A0A077YXR2_TRITR Loading...

Nondiscriminating glutamyl-tRNA synthetase EARS2, mitochondrial

AlphaFold DB , UniProt , Accession A0A077YXR2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 516 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	41.2	Very low	53.4	Low	244 Å²	244	130.9 Å²	130.9	100%	1.202	72%	0.723	S	S	*	*				0	50.1	0	-73	-166	-95.5	0	0	111.6
2	L	41.1	Very low	53.7	Low	187 Å²	187	128.8 Å²	128.8	98%	0.979	71%	0.708	S	S	*	*			trans	-121.7	86	-178.3	-80.3	158.2	0	0	0	107.9
3	G	41.4	Very low	53.6	Low	72 Å²	72	125.4 Å²	125.4	74%	0.742	69%	0.688	S	S	*	*			trans	-146.9	128.8	179.8	0	0	0	0	0	110.1
4	A	51	Low	53.7	Low	104 Å²	104	122.4 Å²	122.4	86%	0.86	68%	0.675	S	S	*	*			trans	62.7	77.8	171.7	0	0	0	0	0	117.2
5	L	52.9	Low	53.7	Low	96 Å²	96	120.3 Å²	120.3	50%	0.503	67%	0.667	S	S	.	*			trans	-109.9	123	149.2	-79.8	163.5	0	0	0	107.5	E9 L13	L5-E9 HydrophobicContact CB-CB 4.34Å; L5-E9 HydrophobicContact CD2-CB 3.84Å; L5-E9 HydrophobicContact CD2-CG 4.31Å; L5-E9 WeakPolarHBondContact CD2-OE2 3.35Å; L5-L13 HydrophobicContact CD1-CD1 4.15Å
6	G	63.1	Low	53.4	Low	38 Å²	38	121.7 Å²	121.7	39%	0.392	66%	0.664	S	S	.	*			trans	-63.1	159.4	-178.1	0	0	0	0	0	112.1	T8 E9 R10	G6-T8 PolarHBondContact O-N 3.03Å; G6-E9 PolarHBondContact N-OE2 3.02Å; G6-E9 PolarHBondContact O-N 2.94Å; G6-R10 PolarHBondContact O-N 3.34Å
7	K	62	Low	52.9	Low	192 Å²	192	125.6 Å²	125.6	84%	0.835	67%	0.667	S	S	*	*	H	α-helix	trans	-49.2	-37	178.6	-101	-178.9	175.7	178	0	112.5	L11	K7-L11 PolarHBondContact O-N 3.06Å
8	T	60.5	Low	52.2	Low	110 Å²	110	128.6 Å²	128.6	68%	0.675	67%	0.669	S	S	*	*	H	α-helix	trans	-68.2	-40.3	179.1	-13.5	0	0	0	0	112.7	G6 L11 L12	G6-T8 PolarHBondContact O-N 3.03Å; T8-L11 WeakPolarHBondContact O-CB 3.47Å; T8-L11 PolarHBondContact O-N 3.3Å; T8-L12 PolarHBondContact O-N 2.84Å
9	E	63.3	Low	51.7	Low	100 Å²	100	125.3 Å²	125.3	47%	0.467	66%	0.658	S	S	.	*	H	α-helix	trans	-74.2	-34.1	177.8	-68.2	168.5	135.5	0	0	111.7	L5 G6 L11 L12 L13	L5-E9 HydrophobicContact CB-CB 4.34Å; L5-E9 HydrophobicContact CD2-CB 3.84Å; L5-E9 HydrophobicContact CD2-CG 4.31Å; L5-E9 WeakPolarHBondContact CD2-OE2 3.35Å; G6-E9 PolarHBondContact N-OE2 3.02Å; G6-E9 PolarHBondContact O-N 2.94Å; E9-L11 VanDerWaalsContact C-N 3.32Å; E9-L12 PolarHBondContact O-N 3.38Å; E9-L13 WeakPolarHBondContact O-CB 3.25Å; E9-L13 PolarHBondContact O-N 3.01Å
10	R	56	Low	51.1	Low	176 Å²	176	124.9 Å²	124.9	66%	0.664	66%	0.656	S	S	*	*	H	α-helix	trans	-60.7	-41.8	168	-81.9	-172.5	-177.6	-170.9	0.8	111.5	G6 L13 V14	G6-R10 PolarHBondContact O-N 3.34Å; R10-L13 PolarHBondContact O-N 2.88Å; R10-V14 VanDerWaalsContact O-CG2 3.25Å; R10-V14 WeakPolarHBondContact O-CG2 3.42Å; R10-V14 PolarHBondContact O-N 2.98Å
11	L	55	Low	50.5	Low	121 Å²	121	122.4 Å²	122.4	63%	0.634	65%	0.653	S	S	*	*	H	α-helix	trans	-63.2	-44.6	175.7	-123.2	94.2	0	0	0	111.4	K7 T8 E9 L13 V14 V15	K7-L11 PolarHBondContact O-N 3.06Å; T8-L11 WeakPolarHBondContact O-CB 3.47Å; T8-L11 PolarHBondContact O-N 3.3Å; E9-L11 VanDerWaalsContact C-N 3.32Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 2.83Å; L11-V14 PolarHBondContact O-N 3.24Å; L11-V15 WeakPolarHBondContact O-CB 3.26Å; L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.47Å; L11-V15 PolarHBondContact O-N 3.45Å
12	L	56.9	Low	50.3	Low	105 Å²	105	113.8 Å²	113.8	55%	0.55	62%	0.616	S	S	.	*	H	α-helix	trans	-63.8	-36.2	176.8	-100.4	144	0	0	0	112.9	T8 E9 K16	T8-L12 PolarHBondContact O-N 2.84Å; E9-L12 PolarHBondContact O-N 3.38Å; L12-K16 WeakPolarHBondContact O-CB 3.48Å; L12-K16 PolarHBondContact O-N 3.35Å
13	L	52.5	Low	50.1	Low	85 Å²	85	112.6 Å²	112.6	45%	0.445	60%	0.603	S	S	.	*	H	α-helix	trans	-70.5	-35.8	174.2	-111	137.8	0	0	0	112.4	L5 E9 R10 L11 R17	L5-L13 HydrophobicContact CD1-CD1 4.15Å; E9-L13 WeakPolarHBondContact O-CB 3.25Å; E9-L13 PolarHBondContact O-N 3.01Å; R10-L13 PolarHBondContact O-N 2.88Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L11-L13 PolarHBondContact O-N 2.83Å; L13-R17 VanDerWaalsContact O-CB 3.28Å; L13-R17 WeakPolarHBondContact O-CB 3.45Å; L13-R17 WeakPolarHBondContact O-CG 3.45Å; L13-R17 PolarHBondContact O-N 2.97Å
14	V	54.8	Low	49.6	Very low	83 Å²	83	111.8 Å²	111.8	50%	0.503	60%	0.595	S	S	.	*	H	α-helix	trans	-68.9	-42.6	173.1	172.4	0	0	0	0	110.5	R10 L11 R17 Y18	R10-V14 VanDerWaalsContact O-CG2 3.25Å; R10-V14 WeakPolarHBondContact O-CG2 3.42Å; R10-V14 PolarHBondContact O-N 2.98Å; L11-V14 PolarHBondContact O-N 3.24Å; V14-R17 PolarHBondContact O-N 2.88Å; V14-Y18 HydrophobicContact CG1-CD2 4.02Å; V14-Y18 HydrophobicContact CG1-CE2 4.33Å; V14-Y18 WeakPolarHBondContact O-CB 3.28Å; V14-Y18 WeakPolarHBondContact O-CD2 3.33Å; V14-Y18 PolarHBondContact O-N 2.83Å
15	V	54.3	Low	48.8	Very low	92 Å²	92	111.1 Å²	111.1	56%	0.558	59%	0.59	S	S	*	*	H	α-helix	trans	-67.5	-40.2	176.3	174.6	0	0	0	0	111.4	L11 Y18 S19	L11-V15 WeakPolarHBondContact O-CB 3.26Å; L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.47Å; L11-V15 PolarHBondContact O-N 3.45Å; V15-Y18 PolarHBondContact O-N 2.82Å; V15-S19 WeakPolarHBondContact O-CB 3.19Å; V15-S19 PolarHBondContact O-N 3.45Å
16	K	48.5	Very low	48.5	Very low	142 Å²	142	116 Å²	116	62%	0.617	60%	0.602	S	S	*	*	H	α-helix	trans	-67.1	-37.8	172.8	-93.1	-177.4	172.8	177.8	0	112.4	L12 S19 L20	L12-K16 WeakPolarHBondContact O-CB 3.48Å; L12-K16 PolarHBondContact O-N 3.35Å; K16-S19 PolarHBondContact O-N 2.91Å; K16-L20 VanDerWaalsContact O-CB 3.31Å; K16-L20 WeakPolarHBondContact O-CB 3.27Å; K16-L20 WeakPolarHBondContact O-CD1 3.5Å; K16-L20 WeakPolarHBondContact O-CG 3.09Å; K16-L20 PolarHBondContact O-N 2.84Å
17	R	44.1	Very low	48.3	Very low	188 Å²	188	120.7 Å²	120.7	71%	0.709	62%	0.617	S	S	*	*	H	α-helix	trans	-69.5	-36.3	174.5	-84	-175.3	170.3	-176.9	-2.4	112.4	L13 V14 A21	L13-R17 VanDerWaalsContact O-CB 3.28Å; L13-R17 WeakPolarHBondContact O-CB 3.45Å; L13-R17 WeakPolarHBondContact O-CG 3.45Å; L13-R17 PolarHBondContact O-N 2.97Å; V14-R17 PolarHBondContact O-N 2.88Å; R17-A21 WeakPolarHBondContact O-CB 3.32Å; R17-A21 PolarHBondContact O-N 2.89Å
18	Y	41.7	Very low	49.6	Very low	180 Å²	180	116.7 Å²	116.7	71%	0.706	60%	0.601	S	S	*	*	H	α-helix	trans	-70.1	-38.3	171.8	-96.9	-93.7	0	0	0	112.3	V14 V15 S22	V14-Y18 HydrophobicContact CG1-CD2 4.02Å; V14-Y18 HydrophobicContact CG1-CE2 4.33Å; V14-Y18 WeakPolarHBondContact O-CB 3.28Å; V14-Y18 WeakPolarHBondContact O-CD2 3.33Å; V14-Y18 PolarHBondContact O-N 2.83Å; V15-Y18 PolarHBondContact O-N 2.82Å; Y18-S22 VanDerWaalsContact O-CB 3.27Å; Y18-S22 WeakPolarHBondContact O-CB 3.31Å; Y18-S22 PolarHBondContact O-N 3.45Å; Y18-S22 PolarHBondContact O-OG 3.37Å
19	S	42.7	Very low	51.3	Low	65 Å²	65	112.1 Å²	112.1	46%	0.455	57%	0.573	S	S	.	*	H	α-helix	trans	-65.7	-39.9	175.6	178.6	0	0	0	0	112.1	V15 K16 S22	V15-S19 WeakPolarHBondContact O-CB 3.19Å; V15-S19 PolarHBondContact O-N 3.45Å; K16-S19 PolarHBondContact O-N 2.91Å; S19-S22 PolarHBondContact O-OG 2.85Å
20	L	38.5	Very low	53	Low	118 Å²	118	108 Å²	108	62%	0.618	55%	0.553	S	S	*	*	H	α-helix	trans	-80.6	-31.8	178	-70.5	164	0	0	0	113.1	K16 S22 K23	K16-L20 VanDerWaalsContact O-CB 3.31Å; K16-L20 WeakPolarHBondContact O-CB 3.27Å; K16-L20 WeakPolarHBondContact O-CD1 3.5Å; K16-L20 WeakPolarHBondContact O-CG 3.09Å; K16-L20 PolarHBondContact O-N 2.84Å; L20-S22 VanDerWaalsContact C-N 3.32Å; L20-K23 PolarHBondContact O-N 3.04Å
21	A	38.9	Very low	55	Low	72 Å²	72	99.6 Å²	99.6	60%	0.595	52%	0.521	S	S	*	.	H	α-helix	trans	-71.8	-26.4	170.8	0	0	0	0	0	112.2	R17 K23 G24	R17-A21 WeakPolarHBondContact O-CB 3.32Å; R17-A21 PolarHBondContact O-N 2.89Å; A21-K23 PolarHBondContact O-N 3.37Å; A21-G24 PolarHBondContact O-N 3.27Å
22	S	37.7	Very low	57.1	Low	63 Å²	63	94.1 Å²	94.1	44%	0.441	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-6.2	172.1	79.4	0	0	0	0	114.3	Y18 S19 L20	Y18-S22 VanDerWaalsContact O-CB 3.27Å; Y18-S22 WeakPolarHBondContact O-CB 3.31Å; Y18-S22 PolarHBondContact O-N 3.45Å; Y18-S22 PolarHBondContact O-OG 3.37Å; S19-S22 PolarHBondContact O-OG 2.85Å; L20-S22 VanDerWaalsContact C-N 3.32Å
23	K	36	Very low	59.1	Low	162 Å²	162	89.7 Å²	89.7	70%	0.704	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	0.1	164.4	-75.4	-174.4	175	-176.3	0	112.9	L20 A21 A25	L20-K23 PolarHBondContact O-N 3.04Å; A21-K23 PolarHBondContact O-N 3.37Å; K23-A25 PolarHBondContact O-N 3.28Å
24	G	31	Very low	61.3	Low	55 Å²	55	86.5 Å²	86.5	57%	0.567	46%	0.455	S	S	*	.	S	Bend	trans	-70.2	105	168.2	0	0	0	0	0	109.8	A21 R26	A21-G24 PolarHBondContact O-N 3.27Å; G24-R26 PolarHBondContact O-N 3.17Å
25	A	33.9	Very low	63.3	Low	91 Å²	91	83.4 Å²	83.4	75%	0.752	44%	0.436	S	S	*	.			trans	31.6	73.8	176.7	0	0	0	0	0	113.2	K23 L27	K23-A25 PolarHBondContact O-N 3.28Å; A25-L27 VanDerWaalsContact C-N 3.29Å; A25-L27 PolarHBondContact O-N 2.91Å
26	R	46.7	Very low	65.3	Low	199 Å²	199	81.6 Å²	81.6	75%	0.751	43%	0.427	S	S	*	.			trans	-53.5	104.7	162.5	-82.9	-175.4	178.2	-177.5	-3.9	106	G24 H28	G24-R26 PolarHBondContact O-N 3.17Å; R26-H28 PolarHBondContact O-N 2.81Å
27	L	59.5	Low	67.6	Low	135 Å²	135	75 Å²	75	71%	0.707	40%	0.399	S	S	*	.			trans	-47.8	114.9	171.5	-92.2	146.4	0	0	0	105.9	A25 V29	A25-L27 VanDerWaalsContact C-N 3.29Å; A25-L27 PolarHBondContact O-N 2.91Å; L27-V29 PolarHBondContact O-N 3.45Å
28	H	88.5	Confident	69.8	Low	109 Å²	109	69 Å²	69	51%	0.505	38%	0.384	S	S	.	.			trans	-59	110.7	-173.8	-177.7	-95.8	0	0	0	107.9	R26 R30 Q62	R26-H28 PolarHBondContact O-N 2.81Å; H28-R30 PolarHBondContact O-N 2.95Å; H28-R30 VanDerWaalsContact O-N 3.09Å; H28-Q62 VanDerWaalsContact CE1-CG 3.47Å; H28-Q62 WeakPolarHBondContact CE1-CG 3.47Å
29	V	97.4	Very high	72.1	Confident	14 Å²	14	61.4 Å²	61.4	9%	0.085	36%	0.36	C	S	.	.			trans	-64.1	117.6	-173.1	169.9	0	0	0	0	108.2	L27 V31 F55 H59 G61 Q62 S234	L27-V29 PolarHBondContact O-N 3.45Å; V29-V31 HydrophobicContact CG1-CG1 4.06Å; V29-F55 HydrophobicContact CG1-CD1 3.8Å; V29-F55 HydrophobicContact CG1-CE1 3.57Å; V29-F55 HydrophobicContact CG2-CE1 4.48Å; V29-H59 HydrophobicContact CB-CB 4.06Å; V29-H59 HydrophobicContact CG1-CB 4.34Å; V29-H59 HydrophobicContact CG2-CB 3.75Å; V29-G61 CarbonylContact O-C 3.5Å; V29-G61 WeakPolarHBondContact O-CA 3.43Å; V29-Q62 PolarHBondContact O-N 3.13Å; V29-S234 WeakPolarHBondContact CA-OG 3.48Å
30	R	98.5	Very high	74.3	Confident	13 Å²	13	63 Å²	63	5%	0.049	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.4	171.6	-63.7	178.1	61.3	76.5	5.2	107.9	H28 Q62 I64 E96 H104 M231 Q232 I233 S234 H235	H28-R30 PolarHBondContact O-N 2.95Å; H28-R30 VanDerWaalsContact O-N 3.09Å; R30-Q62 HydrophobicContact CG-CB 4.27Å; R30-Q62 HydrophobicContact CG-CG 4.49Å; R30-I64 HydrophobicContact CB-CD1 4.11Å; R30-E96 IonicContact CZ-OE1 3.11Å; R30-E96 VanDerWaalsContact CZ-OE1 3.29Å; R30-E96 IonicContact CZ-OE2 2.62Å; R30-E96 IonicContact NH1-OE1 2.7Å; R30-E96 PolarHBondContact NH1-OE1 3.19Å; R30-E96 IonicContact NH1-OE2 3.34Å; R30-E96 IonicContact NH2-OE1 3.97Å; R30-E96 PolarHBondContact NH2-OE1 3.31Å; R30-E96 IonicContact NH2-OE2 3.36Å; R30-E96 PolarHBondContact NH2-OE2 3.09Å; R30-H104 PolarHBondContact NH2-CD2 3.43Å; R30-M231 PolarHBondContact NE-O 3.31Å; R30-M231 PolarHBondContact NH2-O 3.36Å; R30-M231 VanDerWaalsContact NH2-O 3.1Å; R30-Q232 WeakPolarHBondContact CB-O 3.39Å; R30-Q232 WeakPolarHBondContact CD-O 3.19Å; R30-I233 HydrophobicContact CB-CD1 4.48Å; R30-S234 PolarHBondContact N-OG 3.14Å; R30-S234 PolarHBondContact O-N 3.13Å; R30-S234 PolarHBondContact O-OG 3.39Å; R30-H235 PolarHBondContact O-N 2.8Å
31	V	98.8	Very high	76.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	159.7	-178.6	-62.5	0	0	0	0	109.7	V29 N52 F55 A56 Q62 F63 I64 H235	V29-V31 HydrophobicContact CG1-CG1 4.06Å; V31-N52 HydrophobicContact CB-CB 4.42Å; V31-N52 WeakPolarHBondContact CB-OD1 3.24Å; V31-N52 HydrophobicContact CG2-CB 4Å; V31-N52 VanDerWaalsContact CG2-O 3.28Å; V31-N52 WeakPolarHBondContact CG2-O 3.17Å; V31-F55 HydrophobicContact CG1-CD1 3.73Å; V31-F55 HydrophobicContact CG1-CE1 4.1Å; V31-A56 HydrophobicContact CG2-CB 3.79Å; V31-Q62 PolarHBondContact N-O 2.91Å; V31-F63 HydrophobicContact CG2-CD2 4.41Å; V31-I64 WeakPolarHBondContact O-CD1 3.36Å; V31-I64 PolarHBondContact O-N 3.44Å; V31-H235 HydrophobicContact CG1-CB 3.82Å
32	R	98.7	Very high	79.3	Confident	6 Å²	6	58.8 Å²	58.8	2%	0.023	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.7	-174.5	81.1	-60	176.5	-82.8	-6.8	113.4	A34 N52 I64 D228 I233 V236 L237	R32-A34 HydrophobicContact CG-CB 4.06Å; R32-N52 PolarHBondContact N-OD1 2.87Å; R32-N52 PolarHBondContact O-OD1 3.36Å; R32-N52 VanDerWaalsContact O-OD1 3.13Å; R32-I64 CarbonylContact C-O 3.58Å; R32-I64 WeakPolarHBondContact CA-O 3.07Å; R32-I64 HydrophobicContact CB-CB 4.17Å; R32-D228 IonicContact NE-OD1 3.79Å; R32-D228 PolarHBondContact NE-OD1 3.3Å; R32-D228 VanDerWaalsContact NE-OD1 3.11Å; R32-D228 IonicContact NE-OD2 3.44Å; R32-D228 PolarHBondContact NE-OD2 3.41Å; R32-D228 IonicContact NH2-OD2 3.33Å; R32-I233 HydrophobicContact CB-CD1 3.89Å; R32-I233 HydrophobicContact CG-CD1 4.35Å; R32-I233 HydrophobicContact CG-CG1 4.5Å; R32-V236 VanDerWaalsContact NH2-CG1 3.27Å; R32-L237 PolarHBondContact NH1-O 2.89Å
33	F	98.7	Very high	81.8	Confident	11 Å²	11	56.1 Å²	56.1	5%	0.048	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.3	155.9	-179.2	-129.5	0	0	0	108.7	P35 L41 G45 T48 A49 F63 I64 L65 R66 I83 L87	F33-P35 VanDerWaalsContact C-CD 3.46Å; F33-P35 HydrophobicContact CD1-CG 3.99Å; F33-P35 HydrophobicContact CE1-CB 3.98Å; F33-P35 HydrophobicContact CE1-CG 3.56Å; F33-P35 HydrophobicContact CE2-CB 4.28Å; F33-P35 HydrophobicContact CZ-CB 3.72Å; F33-P35 HydrophobicContact CZ-CG 3.86Å; F33-P35 WeakPolarHBondContact O-CD 3.42Å; F33-L41 HydrophobicContact CE1-CD1 4.07Å; F33-L41 HydrophobicContact CZ-CD1 3.62Å; F33-G45 WeakPolarHBondContact CE2-O 3.5Å; F33-T48 HydrophobicContact CD2-CG2 4.25Å; F33-A49 HydrophobicContact CB-CB 4.14Å; F33-A49 HydrophobicContact CD1-CB 3.64Å; F33-A49 HydrophobicContact CD2-CB 3.8Å; F33-A49 HydrophobicContact CE1-CB 3.92Å; F33-A49 HydrophobicContact CE2-CB 4.08Å; F33-A49 HydrophobicContact CG-CB 3.59Å; F33-A49 HydrophobicContact CZ-CB 4.14Å; F33-F63 HydrophobicContact CB-CE2 3.66Å; F33-F63 HydrophobicContact CB-CZ 3.72Å; F33-I64 PolarHBondContact N-O 2.64Å; F33-L65 HydrophobicContact CD1-CD1 3.8Å; F33-L65 HydrophobicContact CE1-CD1 4.47Å; F33-L65 WeakPolarHBondContact O-CA 3.26Å; F33-R66 PolarHBondContact O-N 3.13Å; F33-I83 HydrophobicContact CE1-CG2 4.1Å; F33-L87 HydrophobicContact CD1-CD1 3.99Å; F33-L87 HydrophobicContact CD1-CD2 4.45Å; F33-L87 HydrophobicContact CE1-CD1 4.27Å; F33-L87 HydrophobicContact CE1-CD2 4.42Å
34	A	98.4	Very high	84.4	Confident	19 Å²	19	49.3 Å²	49.3	16%	0.157	28%	0.281	C	S	.	.			trans	-122.4	73.8	-173.9	0	0	0	0	0	111.7	R32 R66 E68	R32-A34 HydrophobicContact CG-CB 4.06Å; A34-R66 VanDerWaalsContact CA-O 3.23Å; A34-R66 WeakPolarHBondContact CA-O 3.13Å; A34-R66 HydrophobicContact CB-CB 4.39Å; A34-E68 HydrophobicContact CB-CG 3.93Å; A34-E68 WeakPolarHBondContact CB-OE1 2.92Å
35	P	97.4	Very high	87.4	Confident	17 Å²	17	47.1 Å²	47.1	11%	0.11	26%	0.258	C	S	.	.			trans	-81.7	141.9	-179.9	32.5	-34.8	0	0	0	112.1	F33 L65 R66 I67 E68 I83	F33-P35 VanDerWaalsContact C-CD 3.46Å; F33-P35 HydrophobicContact CD1-CG 3.99Å; F33-P35 HydrophobicContact CE1-CB 3.98Å; F33-P35 HydrophobicContact CE1-CG 3.56Å; F33-P35 HydrophobicContact CE2-CB 4.28Å; F33-P35 HydrophobicContact CZ-CB 3.72Å; F33-P35 HydrophobicContact CZ-CG 3.86Å; F33-P35 WeakPolarHBondContact O-CD 3.42Å; P35-L65 HydrophobicContact CG-CD1 4Å; P35-R66 WeakPolarHBondContact CD-O 3.5Å; P35-I67 HydrophobicContact CG-CD1 4.34Å; P35-E68 PolarHBondContact O-N 2.96Å; P35-I83 HydrophobicContact CB-CD1 4.06Å; P35-I83 HydrophobicContact CG-CD1 4.12Å; P35-I83 HydrophobicContact CG-CG2 4.03Å
36	S	96.4	Very high	90.3	Very high	54 Å²	54	42.8 Å²	42.8	38%	0.378	22%	0.223	S	C	.	.			trans	-79.9	131.2	162.1	-53.3	0	0	0	0	110	T38 E68	S36-T38 PolarHBondContact O-N 3.01Å; S36-E68 VanDerWaalsContact CA-O 3.31Å; S36-E68 WeakPolarHBondContact CA-O 3.26Å; S36-E68 VanDerWaalsContact CB-O 3.31Å; S36-E68 WeakPolarHBondContact CB-O 3.19Å; S36-E68 PolarHBondContact OG-O 2.67Å
37	P	95.2	Very high	92.5	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.019	19%	0.188	C	C	.	.			trans	-77.5	57.8	-176.6	34.1	-37.3	0	0	0	111.9	I67 E68 D69 T75 V76 A79 A80	P37-I67 HydrophobicContact CB-CG2 4.26Å; P37-I67 HydrophobicContact CG-CG2 3.8Å; P37-E68 WeakPolarHBondContact CD-O 3.37Å; P37-D69 HydrophobicContact CG-CB 3.71Å; P37-T75 HydrophobicContact CG-CG2 4Å; P37-V76 PolarHBondContact O-N 3.42Å; P37-A79 HydrophobicContact CB-CB 4.02Å; P37-A80 HydrophobicContact CB-CB 4.17Å
38	T	91.8	Very high	94.3	Very high	63 Å²	63	27.9 Å²	27.9	39%	0.387	16%	0.159	S	C	.	.	S	Bend	trans	-98.2	15.3	-176.4	63.2	0	0	0	0	113.3	S36 R74	S36-T38 PolarHBondContact O-N 3.01Å; T38-R74 WeakPolarHBondContact CA-O 3Å; T38-R74 WeakPolarHBondContact CB-O 3.35Å; T38-R74 HydrophobicContact CG2-CB 3.73Å; T38-R74 WeakPolarHBondContact CG2-O 3.43Å
39	G	88.8	Confident	94.7	Very high	20 Å²	20	22.7 Å²	22.7	21%	0.206	14%	0.135	C	C	.	.	S	Bend	trans	146.1	-173	-177.1	0	0	0	0	0	112
40	H	89.5	Confident	94.7	Very high	99 Å²	99	22 Å²	22	46%	0.458	13%	0.131	S	C	.	.	S	Bend	trans	-68.8	155.3	-178.1	-62.2	-89.5	0	0	0	113.2	H42 L285 D287	H40-H42 PolarHBondContact O-N 2.95Å; H40-L285 HydrophobicContact CB-CD2 4.24Å; H40-D287 IonicContact CE1-OD2 2.69Å; H40-D287 IonicContact CG-OD2 2.64Å; H40-D287 IonicContact ND1-OD2 3.06Å; H40-D287 PolarHBondContact ND1-OD2 2.77Å
41	L	92.8	Very high	94.7	Very high	8 Å²	8	21.4 Å²	21.4	4%	0.042	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-61.1	124.4	176.4	-173.3	64	0	0	0	110.3	F33 L46 I83 C86 L87 I286	F33-L41 HydrophobicContact CE1-CD1 4.07Å; F33-L41 HydrophobicContact CZ-CD1 3.62Å; L41-L46 HydrophobicContact CD2-CB 4.26Å; L41-L46 HydrophobicContact CG-CB 4.47Å; L41-I83 HydrophobicContact CB-CG1 4.45Å; L41-C86 HydrophobicContact CD2-CB 4.28Å; L41-L87 HydrophobicContact CD2-CD2 4.31Å; L41-I286 HydrophobicContact CB-CG1 4.47Å; L41-I286 HydrophobicContact CD2-CG1 4.32Å; L41-I286 HydrophobicContact CG-CG1 4.16Å; L41-I286 WeakPolarHBondContact O-CG1 3.05Å; L41-I286 PolarHBondContact O-N 3.19Å
42	H	90.4	Very high	94.7	Very high	94 Å²	94	21.4 Å²	21.4	44%	0.435	13%	0.129	S	C	.	.	B	Isolated β-bridge	trans	-102.1	165.8	174	64.1	79.2	0	0	0	111.5	H40 G44 G45 L46 S284 L285	H40-H42 PolarHBondContact O-N 2.95Å; H42-G44 VanDerWaalsContact C-N 3.34Å; H42-G44 PolarHBondContact ND1-N 2.68Å; H42-G44 PolarHBondContact O-N 3.47Å; H42-G45 PolarHBondContact CE1-N 2.82Å; H42-G45 PolarHBondContact ND1-N 3.43Å; H42-G45 VanDerWaalsContact ND1-N 3.17Å; H42-G45 WeakPolarHBondContact O-CA 3.33Å; H42-G45 PolarHBondContact O-N 2.92Å; H42-L46 PolarHBondContact O-N 2.78Å; H42-S284 CarbonylContact C-O 3.55Å; H42-S284 WeakPolarHBondContact CA-O 3.41Å; H42-S284 WeakPolarHBondContact CB-O 3.23Å; H42-L285 HydrophobicContact CB-CD2 4.32Å
43	L	89.9	Confident	94.6	Very high	7 Å²	7	22.4 Å²	22.4	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-56.4	-40.2	-174.5	-169.2	55.5	0	0	0	114.6	G45 L46 R47 I269 S284 I286 F302 A303 L341	L43-G45 VanDerWaalsContact C-N 3.34Å; L43-G45 PolarHBondContact O-N 3.26Å; L43-L46 HydrophobicContact CD1-CD2 4.19Å; L43-L46 PolarHBondContact O-N 2.94Å; L43-R47 PolarHBondContact O-N 3.37Å; L43-I269 HydrophobicContact CG-CD1 4.13Å; L43-S284 PolarHBondContact N-O 2.88Å; L43-I286 HydrophobicContact CB-CD1 4.44Å; L43-I286 HydrophobicContact CD1-CD1 4.06Å; L43-F302 HydrophobicContact CD1-CD1 4.43Å; L43-F302 HydrophobicContact CD2-CD1 4.47Å; L43-F302 HydrophobicContact CD2-CE1 3.84Å; L43-A303 HydrophobicContact CD1-CB 4.42Å; L43-L341 HydrophobicContact CD2-CD1 3.4Å; L43-L341 VanDerWaalsContact CD2-CD1 3.4Å; L43-L341 HydrophobicContact CG-CD1 4.11Å
44	G	90.4	Very high	94.6	Very high	19 Å²	19	21.9 Å²	21.9	20%	0.196	13%	0.13	C	C	.	.	H	α-helix	trans	-62.5	-36.7	172.7	0	0	0	0	0	114.2	H42 T48	H42-G44 VanDerWaalsContact C-N 3.34Å; H42-G44 PolarHBondContact ND1-N 2.68Å; H42-G44 PolarHBondContact O-N 3.47Å; G44-T48 PolarHBondContact O-N 2.81Å; G44-T48 VanDerWaalsContact O-N 3.14Å; G44-T48 PolarHBondContact O-OG1 2.91Å
45	G	93.7	Very high	94.5	Very high	8 Å²	8	21.5 Å²	21.5	8%	0.082	13%	0.125	C	C	.	.	H	α-helix	trans	-69.4	-45.3	174.5	0	0	0	0	0	110.9	F33 H42 L43 R47 T48 A49	F33-G45 WeakPolarHBondContact CE2-O 3.5Å; H42-G45 PolarHBondContact CE1-N 2.82Å; H42-G45 PolarHBondContact ND1-N 3.43Å; H42-G45 VanDerWaalsContact ND1-N 3.17Å; H42-G45 WeakPolarHBondContact O-CA 3.33Å; H42-G45 PolarHBondContact O-N 2.92Å; L43-G45 VanDerWaalsContact C-N 3.34Å; L43-G45 PolarHBondContact O-N 3.26Å; G45-R47 PolarHBondContact O-N 2.91Å; G45-T48 WeakPolarHBondContact O-CB 3.44Å; G45-T48 PolarHBondContact O-N 2.7Å; G45-T48 VanDerWaalsContact O-N 3.14Å; G45-A49 PolarHBondContact O-N 3.44Å
46	L	94.5	Very high	94.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-54.2	-51.2	173	169.9	56.4	0	0	0	111.3	L41 H42 L43 T48 A49 L50 L90 L92 I286 V299 A303	L41-L46 HydrophobicContact CD2-CB 4.26Å; L41-L46 HydrophobicContact CG-CB 4.47Å; H42-L46 PolarHBondContact O-N 2.78Å; L43-L46 HydrophobicContact CD1-CD2 4.19Å; L43-L46 PolarHBondContact O-N 2.94Å; L46-T48 VanDerWaalsContact C-N 3.26Å; L46-T48 PolarHBondContact O-N 2.81Å; L46-A49 WeakPolarHBondContact O-CB 3.43Å; L46-A49 PolarHBondContact O-N 3.25Å; L46-A49 VanDerWaalsContact O-N 3.15Å; L46-L50 VanDerWaalsContact O-CB 3.3Å; L46-L50 WeakPolarHBondContact O-CB 3.45Å; L46-L50 PolarHBondContact O-N 2.93Å; L46-L90 HydrophobicContact CD1-CD1 3.35Å; L46-L90 HydrophobicContact CD1-CG 4.48Å; L46-L90 HydrophobicContact CD2-CD1 4.26Å; L46-L90 HydrophobicContact CG-CD1 4.41Å; L46-L92 HydrophobicContact CD1-CD1 3.74Å; L46-I286 HydrophobicContact CB-CD1 4.02Å; L46-I286 HydrophobicContact CB-CG1 4.05Å; L46-I286 HydrophobicContact CD2-CD1 3.46Å; L46-I286 VanDerWaalsContact CD2-CD1 3.46Å; L46-I286 HydrophobicContact CD2-CG1 4.03Å; L46-I286 HydrophobicContact CG-CD1 4.37Å; L46-V299 HydrophobicContact CD2-CG1 3.67Å; L46-A303 HydrophobicContact CD2-CB 4.07Å; L46-A303 HydrophobicContact CG-CB 4.18Å
47	R	94.1	Very high	94.6	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.015	12%	0.122	C	C	.	.	H	α-helix	trans	-58.7	-42	179.1	-174.7	-158.7	60.6	-166.6	-2.5	111.6	L43 G45 L50 F51 L266 P267 I269 A306	L43-R47 PolarHBondContact O-N 3.37Å; G45-R47 PolarHBondContact O-N 2.91Å; R47-L50 PolarHBondContact O-N 3.1Å; R47-F51 HydrophobicContact CG-CD1 4.01Å; R47-F51 HydrophobicContact CG-CE1 3.83Å; R47-F51 HydrophobicContact CG-CE2 4.37Å; R47-F51 HydrophobicContact CG-CG 4.36Å; R47-F51 HydrophobicContact CG-CZ 4.03Å; R47-F51 WeakPolarHBondContact O-CB 3.29Å; R47-F51 PolarHBondContact O-N 2.99Å; R47-L266 VanDerWaalsContact NH2-CB 3.31Å; R47-L266 PolarHBondContact NH2-O 3.24Å; R47-P267 PolarHBondContact NH1-O 3.17Å; R47-P267 PolarHBondContact NH2-O 3.17Å; R47-I269 HydrophobicContact CB-CD1 4.19Å; R47-A306 WeakPolarHBondContact CD-O 3.24Å; R47-A306 HydrophobicContact CG-CB 4.46Å; R47-A306 PolarHBondContact NH1-O 2.99Å; R47-A306 VanDerWaalsContact NH1-O 3.16Å
48	T	96.3	Very high	94.5	Very high	17 Å²	17	25.8 Å²	25.8	10%	0.104	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-46.4	177.3	-56	0	0	0	0	110.9	F33 G44 G45 L46 N52 L237 L266	F33-T48 HydrophobicContact CD2-CG2 4.25Å; G44-T48 PolarHBondContact O-N 2.81Å; G44-T48 VanDerWaalsContact O-N 3.14Å; G44-T48 PolarHBondContact O-OG1 2.91Å; G45-T48 WeakPolarHBondContact O-CB 3.44Å; G45-T48 PolarHBondContact O-N 2.7Å; G45-T48 VanDerWaalsContact O-N 3.14Å; L46-T48 VanDerWaalsContact C-N 3.26Å; L46-T48 PolarHBondContact O-N 2.81Å; T48-N52 PolarHBondContact O-N 3.44Å; T48-N52 VanDerWaalsContact O-N 3.15Å; T48-N52 PolarHBondContact O-ND2 3.16Å; T48-L237 WeakPolarHBondContact CG2-O 3.35Å; T48-L266 HydrophobicContact CG2-CD1 4.45Å
49	A	97.8	Very high	94.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-47.9	175.2	0	0	0	0	0	111.9	F33 G45 L46 N52 Y53 F63 L87 L92	F33-A49 HydrophobicContact CB-CB 4.14Å; F33-A49 HydrophobicContact CD1-CB 3.64Å; F33-A49 HydrophobicContact CD2-CB 3.8Å; F33-A49 HydrophobicContact CE1-CB 3.92Å; F33-A49 HydrophobicContact CE2-CB 4.08Å; F33-A49 HydrophobicContact CG-CB 3.59Å; F33-A49 HydrophobicContact CZ-CB 4.14Å; G45-A49 PolarHBondContact O-N 3.44Å; L46-A49 WeakPolarHBondContact O-CB 3.43Å; L46-A49 PolarHBondContact O-N 3.25Å; L46-A49 VanDerWaalsContact O-N 3.15Å; A49-N52 PolarHBondContact O-N 3.04Å; A49-Y53 WeakPolarHBondContact O-CB 3.48Å; A49-Y53 PolarHBondContact O-N 2.86Å; A49-F63 HydrophobicContact CB-CZ 4.29Å; A49-L87 HydrophobicContact CB-CD2 3.79Å; A49-L92 HydrophobicContact CB-CD1 4.5Å
50	L	97.4	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.9	-48.2	179.8	178.7	61.4	0	0	0	111.8	L46 R47 N52 Y53 L54 L92 V300 A303 L322	L46-L50 VanDerWaalsContact O-CB 3.3Å; L46-L50 WeakPolarHBondContact O-CB 3.45Å; L46-L50 PolarHBondContact O-N 2.93Å; R47-L50 PolarHBondContact O-N 3.1Å; L50-N52 PolarHBondContact O-N 3.47Å; L50-Y53 WeakPolarHBondContact O-CB 3.36Å; L50-Y53 PolarHBondContact O-N 2.85Å; L50-Y53 VanDerWaalsContact O-N 3.16Å; L50-L54 HydrophobicContact CD1-CD1 3.94Å; L50-L54 HydrophobicContact CD1-CD2 4.27Å; L50-L54 HydrophobicContact CD1-CG 3.91Å; L50-L54 HydrophobicContact CG-CD1 3.95Å; L50-L54 HydrophobicContact CG-CG 4.3Å; L50-L54 VanDerWaalsContact O-CG 3.27Å; L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 3.5Å; L50-L92 HydrophobicContact CB-CD1 4.21Å; L50-L92 HydrophobicContact CD1-CD1 4.38Å; L50-L92 HydrophobicContact CD1-CD2 3.72Å; L50-V300 HydrophobicContact CD1-CG1 3.98Å; L50-V300 HydrophobicContact CD2-CG1 4.28Å; L50-A303 HydrophobicContact CD2-CB 3.71Å; L50-L322 HydrophobicContact CD1-CD2 3.81Å
51	F	97.5	Very high	95.4	Very high	1 Å²	1	24.7 Å²	24.7	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-68.3	-36	-178	-78.9	22.2	0	0	0	111.9	R47 F55 L237 L266 F310 F329 V334	R47-F51 HydrophobicContact CG-CD1 4.01Å; R47-F51 HydrophobicContact CG-CE1 3.83Å; R47-F51 HydrophobicContact CG-CE2 4.37Å; R47-F51 HydrophobicContact CG-CG 4.36Å; R47-F51 HydrophobicContact CG-CZ 4.03Å; R47-F51 WeakPolarHBondContact O-CB 3.29Å; R47-F51 PolarHBondContact O-N 2.99Å; F51-F55 WeakPolarHBondContact O-CB 3.48Å; F51-F55 PolarHBondContact O-N 3.06Å; F51-L237 HydrophobicContact CB-CD2 4.49Å; F51-L266 HydrophobicContact CB-CD1 4.17Å; F51-L266 HydrophobicContact CD2-CD1 3.95Å; F51-L266 HydrophobicContact CD2-CD2 3.76Å; F51-L266 HydrophobicContact CD2-CG 4.5Å; F51-L266 HydrophobicContact CE2-CD2 4.38Å; F51-L266 HydrophobicContact CG-CD1 4.35Å; F51-F310 HydrophobicContact CE1-CE2 4.1Å; F51-F310 HydrophobicContact CE1-CZ 4.09Å; F51-F310 HydrophobicContact CZ-CE2 4.22Å; F51-F329 HydrophobicContact CB-CE2 4.34Å; F51-F329 HydrophobicContact CB-CZ 3.95Å; F51-F329 HydrophobicContact CD1-CE2 4.02Å; F51-F329 HydrophobicContact CD1-CZ 4.5Å; F51-F329 AromaticContact CD2-CE2 3.78Å; F51-F329 HydrophobicContact CD2-CE2 3.78Å; F51-F329 AromaticContact CD2-CZ 3.87Å; F51-F329 HydrophobicContact CD2-CZ 3.87Å; F51-F329 HydrophobicContact CE1-CE2 4.24Å; F51-F329 HydrophobicContact CE2-CE2 4.01Å; F51-F329 HydrophobicContact CE2-CZ 4.49Å; F51-F329 AromaticContact CG-CE2 3.79Å; F51-F329 HydrophobicContact CG-CE2 3.79Å; F51-F329 AromaticContact CG-CZ 3.87Å; F51-F329 HydrophobicContact CG-CZ 3.87Å; F51-F329 HydrophobicContact CZ-CE2 4.23Å; F51-V334 HydrophobicContact CD2-CG2 4.24Å; F51-V334 HydrophobicContact CE2-CG1 4.23Å; F51-V334 HydrophobicContact CE2-CG2 3.92Å
52	N	98.4	Very high	95.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-46.5	170	-80.6	-91.3	0	0	0	110.8	V31 R32 T48 A49 L50 F55 A56 F63 L237	V31-N52 HydrophobicContact CB-CB 4.42Å; V31-N52 WeakPolarHBondContact CB-OD1 3.24Å; V31-N52 HydrophobicContact CG2-CB 4Å; V31-N52 VanDerWaalsContact CG2-O 3.28Å; V31-N52 WeakPolarHBondContact CG2-O 3.17Å; R32-N52 PolarHBondContact N-OD1 2.87Å; R32-N52 PolarHBondContact O-OD1 3.36Å; R32-N52 VanDerWaalsContact O-OD1 3.13Å; T48-N52 PolarHBondContact O-N 3.44Å; T48-N52 VanDerWaalsContact O-N 3.15Å; T48-N52 PolarHBondContact O-ND2 3.16Å; A49-N52 PolarHBondContact O-N 3.04Å; L50-N52 PolarHBondContact O-N 3.47Å; N52-F55 PolarHBondContact O-N 2.9Å; N52-A56 WeakPolarHBondContact O-CB 3.47Å; N52-A56 PolarHBondContact O-N 2.9Å; N52-F63 HydrophobicContact CB-CD2 3.82Å; N52-F63 HydrophobicContact CB-CE2 3.6Å; N52-L237 WeakPolarHBondContact ND2-CB 3.23Å; N52-L237 PolarHBondContact ND2-O 3.15Å
53	Y	98.3	Very high	96	Very high	26 Å²	26	22.5 Å²	22.5	10%	0.102	13%	0.129	C	C	.	.	H	α-helix	trans	-59.1	-50.9	178.3	-179.5	-86.1	0	0	0	112.2	A49 L50 F55 A56 K57 F63 L92 L322	A49-Y53 WeakPolarHBondContact O-CB 3.48Å; A49-Y53 PolarHBondContact O-N 2.86Å; L50-Y53 WeakPolarHBondContact O-CB 3.36Å; L50-Y53 PolarHBondContact O-N 2.85Å; L50-Y53 VanDerWaalsContact O-N 3.16Å; Y53-F55 PolarHBondContact O-N 3.34Å; Y53-A56 PolarHBondContact O-N 3.2Å; Y53-K57 HydrophobicContact CD1-CG 4.03Å; Y53-K57 HydrophobicContact CE1-CD 4.48Å; Y53-K57 HydrophobicContact CE1-CG 3.63Å; Y53-K57 VanDerWaalsContact CZ-CE 3.43Å; Y53-K57 WeakPolarHBondContact O-CG 3.45Å; Y53-K57 PolarHBondContact O-N 2.77Å; Y53-K57 VanDerWaalsContact OH-CE 3.24Å; Y53-K57 WeakPolarHBondContact OH-CE 3.37Å; Y53-F63 HydrophobicContact CD2-CB 4.47Å; Y53-F63 AromaticContact CD2-CD1 3.56Å; Y53-F63 HydrophobicContact CD2-CD1 3.56Å; Y53-F63 HydrophobicContact CD2-CE1 4.02Å; Y53-F63 HydrophobicContact CD2-CG 4.15Å; Y53-F63 HydrophobicContact CE2-CD1 4.49Å; Y53-F63 HydrophobicContact CG-CD1 4.35Å; Y53-L92 HydrophobicContact CD1-CD2 3.78Å; Y53-L92 HydrophobicContact CD2-CB 4.37Å; Y53-L92 HydrophobicContact CD2-CD2 4.2Å; Y53-L92 HydrophobicContact CE1-CD2 4.24Å; Y53-L92 HydrophobicContact CG-CD2 3.77Å; Y53-L322 HydrophobicContact CD1-CD2 4.49Å; Y53-L322 HydrophobicContact CE1-CB 4.34Å; Y53-L322 HydrophobicContact CE1-CD1 4.22Å; Y53-L322 HydrophobicContact CE1-CD2 4.34Å
54	L	97.4	Very high	96.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63	-42.7	-179.7	-64.5	176.9	0	0	0	111.5	L50 A56 K57 Q58 F310 L322 A326 F329	L50-L54 HydrophobicContact CD1-CD1 3.94Å; L50-L54 HydrophobicContact CD1-CD2 4.27Å; L50-L54 HydrophobicContact CD1-CG 3.91Å; L50-L54 HydrophobicContact CG-CD1 3.95Å; L50-L54 HydrophobicContact CG-CG 4.3Å; L50-L54 VanDerWaalsContact O-CG 3.27Å; L50-L54 WeakPolarHBondContact O-CG 3.41Å; L50-L54 PolarHBondContact O-N 3.5Å; L54-A56 PolarHBondContact O-N 3.27Å; L54-K57 PolarHBondContact O-N 3.38Å; L54-Q58 WeakPolarHBondContact O-CB 3.02Å; L54-Q58 PolarHBondContact O-N 2.93Å; L54-F310 HydrophobicContact CD1-CE1 3.74Å; L54-F310 HydrophobicContact CD1-CZ 3.79Å; L54-L322 HydrophobicContact CD2-CD2 4.26Å; L54-L322 WeakPolarHBondContact CD2-O 3.19Å; L54-A326 HydrophobicContact CD2-CB 4.06Å; L54-F329 HydrophobicContact CB-CB 4.14Å; L54-F329 HydrophobicContact CB-CD1 4.08Å; L54-F329 HydrophobicContact CB-CG 4Å; L54-F329 HydrophobicContact CD1-CD2 4.31Å; L54-F329 HydrophobicContact CD1-CG 4.45Å
55	F	97.5	Very high	96.9	Very high	12 Å²	12	21.3 Å²	21.3	5%	0.053	12%	0.119	C	C	.	.	H	α-helix	trans	-60.9	-44.4	176.1	-172.9	-103.9	0	0	0	112.3	V29 V31 F51 N52 Y53 H59 H235 L237 F329 L331	V29-F55 HydrophobicContact CG1-CD1 3.8Å; V29-F55 HydrophobicContact CG1-CE1 3.57Å; V29-F55 HydrophobicContact CG2-CE1 4.48Å; V31-F55 HydrophobicContact CG1-CD1 3.73Å; V31-F55 HydrophobicContact CG1-CE1 4.1Å; F51-F55 WeakPolarHBondContact O-CB 3.48Å; F51-F55 PolarHBondContact O-N 3.06Å; N52-F55 PolarHBondContact O-N 2.9Å; Y53-F55 PolarHBondContact O-N 3.34Å; F55-H59 AromaticContact CD2-CE1 3.76Å; F55-H59 AromaticContact CD2-ND1 3.84Å; F55-H59 AromaticContact CE2-CE1 3.42Å; F55-H59 VanDerWaalsContact CE2-CE1 3.42Å; F55-H59 WeakPolarHBondContact CE2-CE1 3.3Å; F55-H59 AromaticContact CE2-ND1 3.77Å; F55-H59 AromaticContact CZ-CE1 3.97Å; F55-H59 PolarHBondContact O-N 2.92Å; F55-H59 PolarHBondContact O-ND1 3.4Å; F55-H235 HydrophobicContact CE1-CB 4.08Å; F55-H235 AromaticContact CE1-CD2 3.83Å; F55-H235 AromaticContact CE1-CG 3.66Å; F55-H235 AromaticContact CE1-ND1 3.77Å; F55-H235 AromaticContact CZ-CD2 3.69Å; F55-H235 AromaticContact CZ-NE2 3.77Å; F55-L237 HydrophobicContact CB-CD2 4.18Å; F55-L237 HydrophobicContact CG-CD2 4.38Å; F55-F329 HydrophobicContact CB-CD1 4.28Å; F55-F329 HydrophobicContact CB-CE1 3.86Å; F55-F329 HydrophobicContact CD2-CE1 4.16Å; F55-L331 HydrophobicContact CD2-CB 4.01Å; F55-L331 HydrophobicContact CD2-CD2 4.14Å; F55-L331 HydrophobicContact CE2-CB 4Å; F55-L331 HydrophobicContact CE2-CD2 3.85Å; F55-L331 HydrophobicContact CZ-CD2 4.28Å
56	A	97.8	Very high	97.1	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-61	-50.5	175.7	0	0	0	0	0	110.9	V31 N52 Y53 L54 Q58 H59 G60 G61 F63	V31-A56 HydrophobicContact CG2-CB 3.79Å; N52-A56 WeakPolarHBondContact O-CB 3.47Å; N52-A56 PolarHBondContact O-N 2.9Å; Y53-A56 PolarHBondContact O-N 3.2Å; L54-A56 PolarHBondContact O-N 3.27Å; A56-Q58 PolarHBondContact O-N 3.14Å; A56-H59 PolarHBondContact O-N 3.38Å; A56-G60 PolarHBondContact O-N 3.49Å; A56-G60 VanDerWaalsContact O-N 3.08Å; A56-G61 PolarHBondContact O-N 3.05Å; A56-F63 HydrophobicContact CB-CB 4.05Å
57	K	96.3	Very high	97.3	Very high	93 Å²	93	21 Å²	21	40%	0.404	12%	0.115	S	C	.	.	H	α-helix	trans	-59.8	-46.5	-179.6	-71.9	-58.7	-176.6	-164.9	0	112.5	Y53 L54 H59 G60 A326	Y53-K57 HydrophobicContact CD1-CG 4.03Å; Y53-K57 HydrophobicContact CE1-CD 4.48Å; Y53-K57 HydrophobicContact CE1-CG 3.63Å; Y53-K57 VanDerWaalsContact CZ-CE 3.43Å; Y53-K57 WeakPolarHBondContact O-CG 3.45Å; Y53-K57 PolarHBondContact O-N 2.77Å; Y53-K57 VanDerWaalsContact OH-CE 3.24Å; Y53-K57 WeakPolarHBondContact OH-CE 3.37Å; L54-K57 PolarHBondContact O-N 3.38Å; K57-H59 PolarHBondContact O-N 2.86Å; K57-G60 PolarHBondContact O-N 2.92Å; K57-A326 HydrophobicContact CB-CB 3.86Å
58	Q	94.9	Very high	97.5	Very high	69 Å²	69	21.2 Å²	21.2	32%	0.322	12%	0.116	S	C	.	.	H	α-helix	trans	-56.2	-37.2	178.2	-173.3	-172.7	24.5	0	0	112.7	L54 A56 A326 F329	L54-Q58 WeakPolarHBondContact O-CB 3.02Å; L54-Q58 PolarHBondContact O-N 2.93Å; A56-Q58 PolarHBondContact O-N 3.14Å; Q58-A326 WeakPolarHBondContact CB-O 3.47Å; Q58-A326 WeakPolarHBondContact CG-O 3.34Å; Q58-F329 PolarHBondContact NE2-O 3.45Å; Q58-F329 PolarHBondContact OE1-O 3.48Å
59	H	95.2	Very high	97.5	Very high	91 Å²	91	21.6 Å²	21.6	42%	0.421	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	4.6	-175.5	-66.6	82.8	0	0	0	113.8	V29 F55 A56 K57 G61	V29-H59 HydrophobicContact CB-CB 4.06Å; V29-H59 HydrophobicContact CG1-CB 4.34Å; V29-H59 HydrophobicContact CG2-CB 3.75Å; F55-H59 AromaticContact CD2-CE1 3.76Å; F55-H59 AromaticContact CD2-ND1 3.84Å; F55-H59 AromaticContact CE2-CE1 3.42Å; F55-H59 VanDerWaalsContact CE2-CE1 3.42Å; F55-H59 WeakPolarHBondContact CE2-CE1 3.3Å; F55-H59 AromaticContact CE2-ND1 3.77Å; F55-H59 AromaticContact CZ-CE1 3.97Å; F55-H59 PolarHBondContact O-N 2.92Å; F55-H59 PolarHBondContact O-ND1 3.4Å; A56-H59 PolarHBondContact O-N 3.38Å; K57-H59 PolarHBondContact O-N 2.86Å; H59-G61 PolarHBondContact O-N 3Å
60	G	95.6	Very high	97.3	Very high	61 Å²	61	22.1 Å²	22.1	63%	0.629	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	29.9	-172.2	0	0	0	0	0	113	A56 K57	A56-G60 PolarHBondContact O-N 3.49Å; A56-G60 VanDerWaalsContact O-N 3.08Å; K57-G60 PolarHBondContact O-N 2.92Å
61	G	97	Very high	97	Very high	8 Å²	8	25 Å²	25	8%	0.082	14%	0.136	C	C	.	.			trans	-89.3	-163.9	-179.5	0	0	0	0	0	114	V29 A56 H59	V29-G61 CarbonylContact O-C 3.5Å; V29-G61 WeakPolarHBondContact O-CA 3.43Å; A56-G61 PolarHBondContact O-N 3.05Å; H59-G61 PolarHBondContact O-N 3Å
62	Q	98.3	Very high	96.5	Very high	54 Å²	54	28.3 Å²	28.3	25%	0.252	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.7	179.4	-58.4	-69.3	-67.7	0	0	111	H28 V29 R30 V31 I64 D95	H28-Q62 VanDerWaalsContact CE1-CG 3.47Å; H28-Q62 WeakPolarHBondContact CE1-CG 3.47Å; V29-Q62 PolarHBondContact O-N 3.13Å; R30-Q62 HydrophobicContact CG-CB 4.27Å; R30-Q62 HydrophobicContact CG-CG 4.49Å; V31-Q62 PolarHBondContact N-O 2.91Å; Q62-I64 HydrophobicContact CB-CD1 3.95Å; Q62-D95 WeakPolarHBondContact CA-OD2 3.23Å; Q62-D95 HydrophobicContact CB-CB 4.46Å
63	F	98.6	Very high	96.1	Very high	1 Å²	1	37 Å²	37	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	111.7	173.2	175.7	-123.1	0	0	0	110.4	V31 F33 A49 N52 Y53 A56 P94 D95	V31-F63 HydrophobicContact CG2-CD2 4.41Å; F33-F63 HydrophobicContact CB-CE2 3.66Å; F33-F63 HydrophobicContact CB-CZ 3.72Å; A49-F63 HydrophobicContact CB-CZ 4.29Å; N52-F63 HydrophobicContact CB-CD2 3.82Å; N52-F63 HydrophobicContact CB-CE2 3.6Å; Y53-F63 HydrophobicContact CD2-CB 4.47Å; Y53-F63 AromaticContact CD2-CD1 3.56Å; Y53-F63 HydrophobicContact CD2-CD1 3.56Å; Y53-F63 HydrophobicContact CD2-CE1 4.02Å; Y53-F63 HydrophobicContact CD2-CG 4.15Å; Y53-F63 HydrophobicContact CE2-CD1 4.49Å; Y53-F63 HydrophobicContact CG-CD1 4.35Å; A56-F63 HydrophobicContact CB-CB 4.05Å; F63-P94 HydrophobicContact CD1-CB 4.17Å; F63-P94 HydrophobicContact CD1-CG 4.34Å; F63-P94 HydrophobicContact CE1-CB 4.39Å; F63-P94 HydrophobicContact CE1-CG 4.09Å; F63-P94 CarbonylContact O-C 3.51Å; F63-P94 WeakPolarHBondContact O-CA 3.43Å; F63-P94 WeakPolarHBondContact O-CB 3.47Å; F63-D95 PolarHBondContact N-OD2 3.09Å; F63-D95 PolarHBondContact O-N 3.09Å
64	I	98.8	Very high	95.7	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	139	-175.7	-59.7	91.8	0	0	0	110.7	R30 V31 R32 F33 Q62 E96 Y107 M231 I233	R30-I64 HydrophobicContact CB-CD1 4.11Å; V31-I64 WeakPolarHBondContact O-CD1 3.36Å; V31-I64 PolarHBondContact O-N 3.44Å; R32-I64 CarbonylContact C-O 3.58Å; R32-I64 WeakPolarHBondContact CA-O 3.07Å; R32-I64 HydrophobicContact CB-CB 4.17Å; F33-I64 PolarHBondContact N-O 2.64Å; Q62-I64 HydrophobicContact CB-CD1 3.95Å; I64-E96 WeakPolarHBondContact CA-O 3.08Å; I64-E96 HydrophobicContact CB-CB 4.41Å; I64-E96 HydrophobicContact CG1-CB 3.94Å; I64-E96 HydrophobicContact CG1-CG 4.33Å; I64-E96 HydrophobicContact CG2-CB 4.11Å; I64-Y107 HydrophobicContact CG2-CD1 3.73Å; I64-Y107 HydrophobicContact CG2-CE1 3.72Å; I64-M231 HydrophobicContact CG2-SD 4.37Å; I64-I233 HydrophobicContact CD1-CD1 4.07Å
65	L	98.8	Very high	95.4	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.5	166.3	174.9	65.5	0	0	0	110	F33 P35 I67 Q84 L87 P94 E96 Y107	F33-L65 HydrophobicContact CD1-CD1 3.8Å; F33-L65 HydrophobicContact CE1-CD1 4.47Å; F33-L65 WeakPolarHBondContact O-CA 3.26Å; P35-L65 HydrophobicContact CG-CD1 4Å; L65-I67 HydrophobicContact CD1-CD1 4.2Å; L65-I67 HydrophobicContact CD2-CD1 4.44Å; L65-I67 HydrophobicContact CG-CD1 4.28Å; L65-Q84 HydrophobicContact CD2-CG 3.43Å; L65-Q84 VanDerWaalsContact CD2-CG 3.43Å; L65-L87 HydrophobicContact CD1-CD1 4.09Å; L65-L87 HydrophobicContact CD2-CD1 4.11Å; L65-P94 HydrophobicContact CB-CB 3.92Å; L65-P94 HydrophobicContact CB-CG 3.64Å; L65-P94 HydrophobicContact CD2-CG 4.28Å; L65-E96 PolarHBondContact N-O 3.23Å; L65-Y107 WeakPolarHBondContact O-CB 3.28Å
66	R	98.8	Very high	95.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.264	C	S	.	.			trans	-119.9	125.6	174.2	-179.6	177.2	68.5	-133.5	4	110.4	F33 A34 P35 E68 Y107 Q109 D227 D228 M231	F33-R66 PolarHBondContact O-N 3.13Å; A34-R66 VanDerWaalsContact CA-O 3.23Å; A34-R66 WeakPolarHBondContact CA-O 3.13Å; A34-R66 HydrophobicContact CB-CB 4.39Å; P35-R66 WeakPolarHBondContact CD-O 3.5Å; R66-E68 IonicContact CZ-OE1 3.51Å; R66-E68 IonicContact NE-OE1 3.18Å; R66-E68 PolarHBondContact NE-OE1 3.05Å; R66-E68 IonicContact NH2-OE1 3.27Å; R66-E68 PolarHBondContact NH2-OE1 3.35Å; R66-Y107 WeakPolarHBondContact CA-O 3.26Å; R66-Q109 HydrophobicContact CG-CG 4.36Å; R66-D227 WeakPolarHBondContact CD-OD2 3.4Å; R66-D227 IonicContact NE-OD2 3.12Å; R66-D228 IonicContact CZ-OD1 2.68Å; R66-D228 VanDerWaalsContact CZ-OD1 3.29Å; R66-D228 IonicContact NH1-OD1 3.65Å; R66-D228 PolarHBondContact NH1-OD1 3.43Å; R66-D228 IonicContact NH2-OD1 3.99Å; R66-D228 PolarHBondContact NH2-OD1 3.06Å; R66-M231 HydrophobicContact CB-SD 4.41Å; R66-M231 HydrophobicContact CG-CE 4.11Å; R66-M231 HydrophobicContact CG-SD 4.39Å
67	I	98.3	Very high	95	Very high	2 Å²	2	57 Å²	57	1%	0.01	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-88.9	119	178.5	-56.1	-62.7	0	0	0	109.6	P35 P37 L65 D69 A80 P98 Y107 I108 Q109	P35-I67 HydrophobicContact CG-CD1 4.34Å; P37-I67 HydrophobicContact CB-CG2 4.26Å; P37-I67 HydrophobicContact CG-CG2 3.8Å; L65-I67 HydrophobicContact CD1-CD1 4.2Å; L65-I67 HydrophobicContact CD2-CD1 4.44Å; L65-I67 HydrophobicContact CG-CD1 4.28Å; I67-D69 HydrophobicContact CG2-CB 4.19Å; I67-D69 PolarHBondContact O-N 2.92Å; I67-A80 HydrophobicContact CD1-CB 4.14Å; I67-A80 HydrophobicContact CG1-CB 4.29Å; I67-A80 HydrophobicContact CG2-CB 4.04Å; I67-P98 HydrophobicContact CG1-CG 3.7Å; I67-Y107 PolarHBondContact N-O 3.43Å; I67-I108 HydrophobicContact CB-CG1 4.39Å; I67-Q109 WeakPolarHBondContact O-CG 3.47Å; I67-Q109 PolarHBondContact O-N 3.47Å
68	E	97.9	Very high	94.9	Very high	8 Å²	8	54.2 Å²	54.2	4%	0.037	30%	0.303	C	S	.	.			trans	-98.5	73.7	-176.7	-58.8	-163	152.3	0	0	111.5	A34 P35 S36 P37 R66 Q109 Y220	A34-E68 HydrophobicContact CB-CG 3.93Å; A34-E68 WeakPolarHBondContact CB-OE1 2.92Å; P35-E68 PolarHBondContact O-N 2.96Å; S36-E68 VanDerWaalsContact CA-O 3.31Å; S36-E68 WeakPolarHBondContact CA-O 3.26Å; S36-E68 VanDerWaalsContact CB-O 3.31Å; S36-E68 WeakPolarHBondContact CB-O 3.19Å; S36-E68 PolarHBondContact OG-O 2.67Å; P37-E68 WeakPolarHBondContact CD-O 3.37Å; R66-E68 IonicContact CZ-OE1 3.51Å; R66-E68 IonicContact NE-OE1 3.18Å; R66-E68 PolarHBondContact NE-OE1 3.05Å; R66-E68 IonicContact NH2-OE1 3.27Å; R66-E68 PolarHBondContact NH2-OE1 3.35Å; E68-Q109 VanDerWaalsContact CA-OE1 3.26Å; E68-Q109 HydrophobicContact CG-CG 4.45Å; E68-Y220 WeakPolarHBondContact OE2-CD2 3.29Å; E68-Y220 WeakPolarHBondContact OE2-CE2 3.34Å
69	D	96.5	Very high	94.9	Very high	25 Å²	25	51.1 Å²	51.1	13%	0.134	29%	0.289	C	S	.	.			trans	-98.5	27.1	-172.6	65.3	-25.9	0	0	0	114.3	P37 I67 D71 I108 Q109 S110	P37-D69 HydrophobicContact CG-CB 3.71Å; I67-D69 HydrophobicContact CG2-CB 4.19Å; I67-D69 PolarHBondContact O-N 2.92Å; D69-D71 VanDerWaalsContact C-N 3.26Å; D69-D71 PolarHBondContact O-N 2.95Å; D69-I108 WeakPolarHBondContact OD2-CG2 3.15Å; D69-Q109 PolarHBondContact OD1-N 3.48Å; D69-S110 PolarHBondContact OD1-N 3.49Å; D69-S110 PolarHBondContact OD1-OG 2.62Å; D69-S110 WeakPolarHBondContact OD2-CB 3.22Å; D69-S110 PolarHBondContact OD2-OG 2.91Å
70	T	93.5	Very high	94.9	Very high	11 Å²	11	47.5 Å²	47.5	7%	0.067	28%	0.275	C	S	.	.			trans	-74.2	-13.5	-175.2	51.6	0	0	0	0	114.4	Q109 K213 P218 A223	T70-Q109 HydrophobicContact CG2-CB 3.56Å; T70-Q109 HydrophobicContact CG2-CG 4.43Å; T70-K213 PolarHBondContact O-NZ 3.36Å; T70-P218 HydrophobicContact CG2-CG 3.7Å; T70-A223 HydrophobicContact CG2-CB 4.27Å
71	D	91.4	Very high	94.9	Very high	61 Å²	61	50 Å²	50	33%	0.326	27%	0.27	S	S	.	.			trans	-101.2	81.9	173.5	-169.6	-6.2	0	0	0	110.7	D69 E73 R74 T75	D69-D71 VanDerWaalsContact C-N 3.26Å; D69-D71 PolarHBondContact O-N 2.95Å; D71-E73 PolarHBondContact O-N 3.19Å; D71-E73 VanDerWaalsContact O-N 3.13Å; D71-E73 PolarHBondContact OD1-N 3.48Å; D71-R74 HydrophobicContact CB-CB 4.46Å; D71-R74 PolarHBondContact O-N 3.11Å; D71-R74 WeakPolarHBondContact OD2-CD 3.46Å; D71-R74 WeakPolarHBondContact OD2-CG 3.32Å; D71-R74 IonicContact OD2-NE 3.36Å; D71-R74 PolarHBondContact OD2-NE 2.98Å; D71-T75 PolarHBondContact O-N 2.94Å; D71-T75 VanDerWaalsContact O-N 3.1Å; D71-T75 PolarHBondContact O-OG1 3.34Å
72	A	86.3	Confident	94.8	Very high	71 Å²	71	50.8 Å²	50.8	59%	0.587	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.4	-177	0	0	0	0	0	113.8	R74	A72-R74 VanDerWaalsContact C-N 3.28Å; A72-R74 PolarHBondContact O-N 3.49Å
73	E	90.2	Very high	94.7	Very high	182 Å²	182	48.3 Å²	48.3	85%	0.85	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-23.7	178.9	-66.9	-178.9	-176.9	0	0	112.7	D71	D71-E73 PolarHBondContact O-N 3.19Å; D71-E73 VanDerWaalsContact O-N 3.13Å; D71-E73 PolarHBondContact OD1-N 3.48Å
74	R	90.8	Very high	94.6	Very high	173 Å²	173	49.9 Å²	49.9	65%	0.653	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-14.5	-178.4	-63.3	-170.4	-178.5	178.7	-1.1	113.8	T38 D71 A72 V76	T38-R74 WeakPolarHBondContact CA-O 3Å; T38-R74 WeakPolarHBondContact CB-O 3.35Å; T38-R74 HydrophobicContact CG2-CB 3.73Å; T38-R74 WeakPolarHBondContact CG2-O 3.43Å; D71-R74 HydrophobicContact CB-CB 4.46Å; D71-R74 PolarHBondContact O-N 3.11Å; D71-R74 WeakPolarHBondContact OD2-CD 3.46Å; D71-R74 WeakPolarHBondContact OD2-CG 3.32Å; D71-R74 IonicContact OD2-NE 3.36Å; D71-R74 PolarHBondContact OD2-NE 2.98Å; A72-R74 VanDerWaalsContact C-N 3.28Å; A72-R74 PolarHBondContact O-N 3.49Å; R74-V76 PolarHBondContact O-N 3.17Å
75	T	91.8	Very high	94.5	Very high	53 Å²	53	52 Å²	52	33%	0.325	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-62.6	125.9	176.4	-67.3	0	0	0	0	110.1	P37 D71	P37-T75 HydrophobicContact CG-CG2 4Å; D71-T75 PolarHBondContact O-N 2.94Å; D71-T75 VanDerWaalsContact O-N 3.1Å; D71-T75 PolarHBondContact O-OG1 3.34Å
76	V	93.5	Very high	94.4	Very high	71 Å²	71	52 Å²	52	43%	0.43	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-102.2	124.1	176.4	176.2	0	0	0	0	108	P37 R74 A79	P37-V76 PolarHBondContact O-N 3.42Å; R74-V76 PolarHBondContact O-N 3.17Å; V76-A79 HydrophobicContact CB-CB 4Å; V76-A79 HydrophobicContact CG1-CB 4.33Å; V76-A79 WeakPolarHBondContact O-CB 3.06Å; V76-A79 PolarHBondContact O-N 3.3Å; V76-A79 VanDerWaalsContact O-N 3.12Å
77	D	93	Very high	94.3	Very high	163 Å²	163	52 Å²	52	87%	0.872	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	138.8	178.5	-166.8	30.1	0	0	0	111.3	A79	D77-A79 PolarHBondContact O-N 3.09Å
78	G	94.7	Very high	94.2	Very high	34 Å²	34	58.2 Å²	58.2	35%	0.351	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	-7.7	-174.4	0	0	0	0	0	116.2	A80 E81 A82	G78-A80 PolarHBondContact O-N 3.5Å; G78-E81 VanDerWaalsContact C-OE2 3.3Å; G78-E81 WeakPolarHBondContact CA-OE2 3.46Å; G78-E81 PolarHBondContact O-N 2.84Å; G78-A82 WeakPolarHBondContact O-CB 3.23Å; G78-A82 PolarHBondContact O-N 3.31Å
79	A	94.6	Very high	94.2	Very high	4 Å²	4	60.4 Å²	60.4	3%	0.033	32%	0.323	C	S	.	.	H	α-helix	trans	-69.1	-33.3	-177.4	0	0	0	0	0	112.8	P37 V76 D77 A82 I83	P37-A79 HydrophobicContact CB-CB 4.02Å; V76-A79 HydrophobicContact CB-CB 4Å; V76-A79 HydrophobicContact CG1-CB 4.33Å; V76-A79 WeakPolarHBondContact O-CB 3.06Å; V76-A79 PolarHBondContact O-N 3.3Å; V76-A79 VanDerWaalsContact O-N 3.12Å; D77-A79 PolarHBondContact O-N 3.09Å; A79-A82 PolarHBondContact O-N 2.9Å; A79-I83 WeakPolarHBondContact O-CD1 3.37Å; A79-I83 VanDerWaalsContact O-CG1 3.23Å; A79-I83 WeakPolarHBondContact O-CG1 3.1Å; A79-I83 PolarHBondContact O-N 3.25Å
80	A	95.1	Very high	94.2	Very high	15 Å²	15	59.4 Å²	59.4	12%	0.124	32%	0.318	C	S	.	.	H	α-helix	trans	-66.8	-40.2	176.7	0	0	0	0	0	111.8	P37 I67 G78 I83 Q84	P37-A80 HydrophobicContact CB-CB 4.17Å; I67-A80 HydrophobicContact CD1-CB 4.14Å; I67-A80 HydrophobicContact CG1-CB 4.29Å; I67-A80 HydrophobicContact CG2-CB 4.04Å; G78-A80 PolarHBondContact O-N 3.5Å; A80-I83 PolarHBondContact O-N 3Å; A80-Q84 WeakPolarHBondContact O-CG 3.32Å; A80-Q84 PolarHBondContact O-N 2.95Å; A80-Q84 VanDerWaalsContact O-N 3.08Å; A80-Q84 PolarHBondContact O-NE2 2.6Å
81	E	95.8	Very high	94.4	Very high	114 Å²	114	60 Å²	60	53%	0.533	33%	0.327	S	S	.	.	H	α-helix	trans	-67	-43.2	175.2	-66.3	67.8	-151.1	0	0	110.5	G78 I83 Q84 S85	G78-E81 VanDerWaalsContact C-OE2 3.3Å; G78-E81 WeakPolarHBondContact CA-OE2 3.46Å; G78-E81 PolarHBondContact O-N 2.84Å; E81-I83 PolarHBondContact O-N 3.18Å; E81-Q84 PolarHBondContact O-N 2.99Å; E81-S85 WeakPolarHBondContact O-CB 3.33Å; E81-S85 PolarHBondContact O-N 2.67Å
82	A	94.7	Very high	94.7	Very high	23 Å²	23	57.1 Å²	57.1	19%	0.19	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-43.7	175.6	0	0	0	0	0	111.8	G78 A79 S85 C86	G78-A82 WeakPolarHBondContact O-CB 3.23Å; G78-A82 PolarHBondContact O-N 3.31Å; A79-A82 PolarHBondContact O-N 2.9Å; A82-S85 PolarHBondContact O-N 2.85Å; A82-C86 VanDerWaalsContact O-CB 3.25Å; A82-C86 WeakPolarHBondContact O-CB 3.41Å; A82-C86 PolarHBondContact O-N 3.3Å
83	I	95.9	Very high	95.2	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-47.3	174.8	-71.4	162.6	0	0	0	110.8	F33 P35 L41 A79 A80 E81 C86 L87	F33-I83 HydrophobicContact CE1-CG2 4.1Å; P35-I83 HydrophobicContact CB-CD1 4.06Å; P35-I83 HydrophobicContact CG-CD1 4.12Å; P35-I83 HydrophobicContact CG-CG2 4.03Å; L41-I83 HydrophobicContact CB-CG1 4.45Å; A79-I83 WeakPolarHBondContact O-CD1 3.37Å; A79-I83 VanDerWaalsContact O-CG1 3.23Å; A79-I83 WeakPolarHBondContact O-CG1 3.1Å; A79-I83 PolarHBondContact O-N 3.25Å; A80-I83 PolarHBondContact O-N 3Å; E81-I83 PolarHBondContact O-N 3.18Å; I83-C86 WeakPolarHBondContact O-CB 3.35Å; I83-C86 PolarHBondContact O-N 3.19Å; I83-L87 HydrophobicContact CG2-CD1 4.22Å; I83-L87 WeakPolarHBondContact O-CG 3.46Å; I83-L87 PolarHBondContact O-N 2.96Å
84	Q	96.7	Very high	95.5	Very high	33 Å²	33	49.7 Å²	49.7	15%	0.154	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-46.3	178.2	-76.6	177.2	92.1	0	0	112.1	L65 A80 E81 C86 L87 Q88 S99	L65-Q84 HydrophobicContact CD2-CG 3.43Å; L65-Q84 VanDerWaalsContact CD2-CG 3.43Å; A80-Q84 WeakPolarHBondContact O-CG 3.32Å; A80-Q84 PolarHBondContact O-N 2.95Å; A80-Q84 VanDerWaalsContact O-N 3.08Å; A80-Q84 PolarHBondContact O-NE2 2.6Å; E81-Q84 PolarHBondContact O-N 2.99Å; Q84-C86 VanDerWaalsContact C-N 3.28Å; Q84-C86 PolarHBondContact O-N 3.22Å; Q84-L87 PolarHBondContact O-N 3.19Å; Q84-Q88 WeakPolarHBondContact O-CB 3.3Å; Q84-Q88 PolarHBondContact O-N 2.97Å; Q84-S99 PolarHBondContact OE1-OG 2.7Å
85	S	95.8	Very high	95.9	Very high	44 Å²	44	43 Å²	43	31%	0.308	25%	0.245	S	C	.	.	H	α-helix	trans	-60.9	-38.4	176.1	-174.2	0	0	0	0	112	E81 A82 Q88 W89 R290	E81-S85 WeakPolarHBondContact O-CB 3.33Å; E81-S85 PolarHBondContact O-N 2.67Å; A82-S85 PolarHBondContact O-N 2.85Å; S85-Q88 PolarHBondContact O-N 3.33Å; S85-W89 WeakPolarHBondContact O-CB 3.34Å; S85-W89 PolarHBondContact O-N 3.23Å; S85-R290 PolarHBondContact OG-NH1 3.15Å
86	C	96.4	Very high	96.2	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-46.9	177.8	-165.1	0	0	0	0	111.6	L41 A82 I83 Q84 Q88 W89 L90 I286	L41-C86 HydrophobicContact CD2-CB 4.28Å; A82-C86 VanDerWaalsContact O-CB 3.25Å; A82-C86 WeakPolarHBondContact O-CB 3.41Å; A82-C86 PolarHBondContact O-N 3.3Å; I83-C86 WeakPolarHBondContact O-CB 3.35Å; I83-C86 PolarHBondContact O-N 3.19Å; Q84-C86 VanDerWaalsContact C-N 3.28Å; Q84-C86 PolarHBondContact O-N 3.22Å; C86-Q88 VanDerWaalsContact C-N 3.33Å; C86-Q88 PolarHBondContact O-N 2.76Å; C86-W89 PolarHBondContact O-N 3.03Å; C86-L90 WeakPolarHBondContact O-CD1 3.37Å; C86-L90 VanDerWaalsContact O-CG 3.32Å; C86-L90 WeakPolarHBondContact O-CG 3.29Å; C86-L90 PolarHBondContact O-N 3.34Å; C86-I286 WeakPolarHBondContact SG-CG2 3.41Å
87	L	97.5	Very high	96.5	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-42.8	175.9	-68.2	176.2	0	0	0	111.8	F33 L41 A49 L65 I83 Q84 L90 G91 L92	F33-L87 HydrophobicContact CD1-CD1 3.99Å; F33-L87 HydrophobicContact CD1-CD2 4.45Å; F33-L87 HydrophobicContact CE1-CD1 4.27Å; F33-L87 HydrophobicContact CE1-CD2 4.42Å; L41-L87 HydrophobicContact CD2-CD2 4.31Å; A49-L87 HydrophobicContact CB-CD2 3.79Å; L65-L87 HydrophobicContact CD1-CD1 4.09Å; L65-L87 HydrophobicContact CD2-CD1 4.11Å; I83-L87 HydrophobicContact CG2-CD1 4.22Å; I83-L87 WeakPolarHBondContact O-CG 3.46Å; I83-L87 PolarHBondContact O-N 2.96Å; Q84-L87 PolarHBondContact O-N 3.19Å; L87-L90 PolarHBondContact O-N 3.28Å; L87-G91 PolarHBondContact O-N 2.67Å; L87-L92 HydrophobicContact CB-CB 4.41Å; L87-L92 HydrophobicContact CD2-CB 4.14Å; L87-L92 HydrophobicContact CD2-CD1 4.17Å; L87-L92 PolarHBondContact O-N 3.4Å
88	Q	97	Very high	96.7	Very high	133 Å²	133	31.7 Å²	31.7	62%	0.621	18%	0.183	S	C	*	.	H	α-helix	trans	-61.4	-46	175.9	-173.9	-176.4	16.1	0	0	111.8	Q84 S85 C86 L90 G91	Q84-Q88 WeakPolarHBondContact O-CB 3.3Å; Q84-Q88 PolarHBondContact O-N 2.97Å; S85-Q88 PolarHBondContact O-N 3.33Å; C86-Q88 VanDerWaalsContact C-N 3.33Å; C86-Q88 PolarHBondContact O-N 2.76Å; Q88-L90 PolarHBondContact O-N 3.19Å; Q88-G91 PolarHBondContact O-N 3.49Å
89	W	96.5	Very high	96.7	Very high	53 Å²	53	34.7 Å²	34.7	20%	0.201	20%	0.198	C	C	.	.	H	α-helix	trans	-59.5	-36.2	177.2	170.4	65.1	0	0	0	112.5	S85 C86 G91 I286 R290 F294 P296 V299	S85-W89 WeakPolarHBondContact O-CB 3.34Å; S85-W89 PolarHBondContact O-N 3.23Å; C86-W89 PolarHBondContact O-N 3.03Å; W89-G91 VanDerWaalsContact C-N 3.27Å; W89-G91 PolarHBondContact O-N 2.95Å; W89-I286 HydrophobicContact CE3-CG2 4.31Å; W89-I286 HydrophobicContact CZ3-CG2 3.66Å; W89-R290 HydrophobicContact CD2-CB 4.36Å; W89-R290 HydrophobicContact CD2-CG 4.01Å; W89-R290 HydrophobicContact CE3-CB 4.27Å; W89-R290 HydrophobicContact CE3-CG 4.39Å; W89-R290 HydrophobicContact CG-CG 4.49Å; W89-R290 HydrophobicContact CH2-CB 3.84Å; W89-R290 HydrophobicContact CH2-CG 4.37Å; W89-R290 HydrophobicContact CZ2-CB 3.91Å; W89-R290 HydrophobicContact CZ2-CG 3.97Å; W89-R290 HydrophobicContact CZ3-CB 4.04Å; W89-F294 WeakPolarHBondContact CZ2-O 3.41Å; W89-P296 HydrophobicContact CZ2-CB 4.48Å; W89-P296 VanDerWaalsContact O-CB 3.29Å; W89-P296 WeakPolarHBondContact O-CB 3.43Å; W89-V299 HydrophobicContact CH2-CG2 4.04Å
90	L	97.2	Very high	96.8	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.026	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-5.4	176.5	-68.1	161	0	0	0	114	L46 C86 L87 Q88 L92 I286 P296 V299 V300	L46-L90 HydrophobicContact CD1-CD1 3.35Å; L46-L90 HydrophobicContact CD1-CG 4.48Å; L46-L90 HydrophobicContact CD2-CD1 4.26Å; L46-L90 HydrophobicContact CG-CD1 4.41Å; C86-L90 WeakPolarHBondContact O-CD1 3.37Å; C86-L90 VanDerWaalsContact O-CG 3.32Å; C86-L90 WeakPolarHBondContact O-CG 3.29Å; C86-L90 PolarHBondContact O-N 3.34Å; L87-L90 PolarHBondContact O-N 3.28Å; Q88-L90 PolarHBondContact O-N 3.19Å; L90-L92 VanDerWaalsContact C-N 3.29Å; L90-L92 HydrophobicContact CB-CD1 4.26Å; L90-L92 HydrophobicContact CB-CG 4.03Å; L90-L92 HydrophobicContact CD1-CD1 4.46Å; L90-L92 PolarHBondContact O-N 3.41Å; L90-I286 HydrophobicContact CD1-CG2 4.27Å; L90-P296 HydrophobicContact CD2-CB 4.47Å; L90-V299 HydrophobicContact CD2-CB 4.08Å; L90-V299 HydrophobicContact CD2-CG1 3.86Å; L90-V300 HydrophobicContact CB-CG2 4.46Å; L90-V300 HydrophobicContact CD2-CG2 4.16Å
91	G	96.9	Very high	96.9	Very high	24 Å²	24	42.9 Å²	42.9	25%	0.247	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	8.2	-174.3	0	0	0	0	0	114.8	L87 Q88 W89 N93	L87-G91 PolarHBondContact O-N 2.67Å; Q88-G91 PolarHBondContact O-N 3.49Å; W89-G91 VanDerWaalsContact C-N 3.27Å; W89-G91 PolarHBondContact O-N 2.95Å; G91-N93 VanDerWaalsContact C-N 3.26Å; G91-N93 PolarHBondContact O-N 3.13Å; G91-N93 VanDerWaalsContact O-N 3.08Å
92	L	97.8	Very high	97	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.228	C	C	.	.			trans	-87.1	57.2	-178.9	-57.4	-178.3	0	0	0	111.6	L46 A49 L50 Y53 L87 L90 P94 L322	L46-L92 HydrophobicContact CD1-CD1 3.74Å; A49-L92 HydrophobicContact CB-CD1 4.5Å; L50-L92 HydrophobicContact CB-CD1 4.21Å; L50-L92 HydrophobicContact CD1-CD1 4.38Å; L50-L92 HydrophobicContact CD1-CD2 3.72Å; Y53-L92 HydrophobicContact CD1-CD2 3.78Å; Y53-L92 HydrophobicContact CD2-CB 4.37Å; Y53-L92 HydrophobicContact CD2-CD2 4.2Å; Y53-L92 HydrophobicContact CE1-CD2 4.24Å; Y53-L92 HydrophobicContact CG-CD2 3.77Å; L87-L92 HydrophobicContact CB-CB 4.41Å; L87-L92 HydrophobicContact CD2-CB 4.14Å; L87-L92 HydrophobicContact CD2-CD1 4.17Å; L87-L92 PolarHBondContact O-N 3.4Å; L90-L92 VanDerWaalsContact C-N 3.29Å; L90-L92 HydrophobicContact CB-CD1 4.26Å; L90-L92 HydrophobicContact CB-CG 4.03Å; L90-L92 HydrophobicContact CD1-CD1 4.46Å; L90-L92 PolarHBondContact O-N 3.41Å; L92-P94 VanDerWaalsContact O-CD 3.26Å; L92-P94 WeakPolarHBondContact O-CD 3.49Å; L92-L322 HydrophobicContact CD2-CD1 4.14Å; L92-L322 HydrophobicContact CD2-CD2 3.72Å
93	N	96.8	Very high	97.1	Very high	80 Å²	80	43.3 Å²	43.3	43%	0.428	25%	0.252	S	S	.	.			trans	-71.1	118.3	-175.4	-62.2	-46.6	0	0	0	111.5	G91	G91-N93 VanDerWaalsContact C-N 3.26Å; G91-N93 PolarHBondContact O-N 3.13Å; G91-N93 VanDerWaalsContact O-N 3.08Å
94	P	98.1	Very high	97.1	Very high	17 Å²	17	44.7 Å²	44.7	11%	0.11	26%	0.258	C	S	.	.			trans	-66.4	146.7	174.6	-18.1	32.2	0	0	0	112.7	F63 L65 L92 E96 R100	F63-P94 HydrophobicContact CD1-CB 4.17Å; F63-P94 HydrophobicContact CD1-CG 4.34Å; F63-P94 HydrophobicContact CE1-CB 4.39Å; F63-P94 HydrophobicContact CE1-CG 4.09Å; F63-P94 CarbonylContact O-C 3.51Å; F63-P94 WeakPolarHBondContact O-CA 3.43Å; F63-P94 WeakPolarHBondContact O-CB 3.47Å; L65-P94 HydrophobicContact CB-CB 3.92Å; L65-P94 HydrophobicContact CB-CG 3.64Å; L65-P94 HydrophobicContact CD2-CG 4.28Å; L92-P94 VanDerWaalsContact O-CD 3.26Å; L92-P94 WeakPolarHBondContact O-CD 3.49Å; P94-E96 WeakPolarHBondContact CB-O 3.22Å; P94-R100 WeakPolarHBondContact O-CD 3.24Å; P94-R100 PolarHBondContact O-NH1 3.08Å
95	D	98.3	Very high	97.1	Very high	31 Å²	31	44.8 Å²	44.8	17%	0.166	27%	0.269	C	S	.	.	S	Bend	trans	-74.4	-34.4	172	-57.9	-61.2	0	0	0	111.1	Q62 F63 R100	Q62-D95 WeakPolarHBondContact CA-OD2 3.23Å; Q62-D95 HydrophobicContact CB-CB 4.46Å; F63-D95 PolarHBondContact N-OD2 3.09Å; F63-D95 PolarHBondContact O-N 3.09Å; D95-R100 WeakPolarHBondContact O-CD 3.13Å
96	E	98.5	Very high	97.2	Very high	9 Å²	9	45.5 Å²	45.5	4%	0.042	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-130.4	135	174.6	-62.1	170.7	-158.8	0	0	109.7	R30 I64 L65 P94 G101 H104 Y107	R30-E96 IonicContact CZ-OE1 3.11Å; R30-E96 VanDerWaalsContact CZ-OE1 3.29Å; R30-E96 IonicContact CZ-OE2 2.62Å; R30-E96 IonicContact NH1-OE1 2.7Å; R30-E96 PolarHBondContact NH1-OE1 3.19Å; R30-E96 IonicContact NH1-OE2 3.34Å; R30-E96 IonicContact NH2-OE1 3.97Å; R30-E96 PolarHBondContact NH2-OE1 3.31Å; R30-E96 IonicContact NH2-OE2 3.36Å; R30-E96 PolarHBondContact NH2-OE2 3.09Å; I64-E96 WeakPolarHBondContact CA-O 3.08Å; I64-E96 HydrophobicContact CB-CB 4.41Å; I64-E96 HydrophobicContact CG1-CB 3.94Å; I64-E96 HydrophobicContact CG1-CG 4.33Å; I64-E96 HydrophobicContact CG2-CB 4.11Å; L65-E96 PolarHBondContact N-O 3.23Å; P94-E96 WeakPolarHBondContact CB-O 3.22Å; E96-G101 WeakPolarHBondContact CA-O 3.4Å; E96-H104 IonicContact OE2-CD2 2.95Å; E96-Y107 HydrophobicContact CB-CE1 3.79Å; E96-Y107 HydrophobicContact CB-CE2 4.22Å; E96-Y107 WeakPolarHBondContact OE2-CE1 3.49Å; E96-Y107 PolarHBondContact OE2-OH 3.44Å
97	S	98.3	Very high	97.3	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.021	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-164.9	171.1	-177.2	64.9	0	0	0	0	112.2	S99 R100 G101 Y107	S97-S99 VanDerWaalsContact C-N 3.29Å; S97-S99 PolarHBondContact O-N 3.41Å; S97-S99 PolarHBondContact OG-OG 2.87Å; S97-R100 PolarHBondContact O-N 3.07Å; S97-R100 VanDerWaalsContact OG-CB 3.24Å; S97-R100 WeakPolarHBondContact OG-CB 3.33Å; S97-R100 PolarHBondContact OG-N 3.48Å; S97-R100 VanDerWaalsContact OG-N 3.08Å; S97-G101 PolarHBondContact N-O 2.92Å; S97-G101 WeakPolarHBondContact O-CA 3.47Å; S97-G101 PolarHBondContact O-N 3.44Å; S97-Y107 WeakPolarHBondContact O-CD2 3.41Å
98	P	97.6	Very high	97.3	Very high	39 Å²	39	47.2 Å²	47.2	25%	0.253	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-39	173.2	-26.7	35.1	0	0	0	114.3	I67 I108	I67-P98 HydrophobicContact CG1-CG 3.7Å; P98-I108 HydrophobicContact CB-CD1 4.01Å; P98-I108 HydrophobicContact CB-CG1 3.9Å; P98-I108 HydrophobicContact CG-CD1 4.41Å; P98-I108 HydrophobicContact CG-CG1 3.8Å
99	S	96	Very high	97.3	Very high	96 Å²	96	40.9 Å²	40.9	67%	0.671	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-30.8	-178.2	49.1	0	0	0	0	113.8	Q84 S97	Q84-S99 PolarHBondContact OE1-OG 2.7Å; S97-S99 VanDerWaalsContact C-N 3.29Å; S97-S99 PolarHBondContact O-N 3.41Å; S97-S99 PolarHBondContact OG-OG 2.87Å
100	R	95.8	Very high	97.3	Very high	161 Å²	161	40 Å²	40	61%	0.608	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-22.1	-179.4	-166.9	171.4	179.8	-175	-3.6	113.7	P94 D95 S97	P94-R100 WeakPolarHBondContact O-CD 3.24Å; P94-R100 PolarHBondContact O-NH1 3.08Å; D95-R100 WeakPolarHBondContact O-CD 3.13Å; S97-R100 PolarHBondContact O-N 3.07Å; S97-R100 VanDerWaalsContact OG-CB 3.24Å; S97-R100 WeakPolarHBondContact OG-CB 3.33Å; S97-R100 PolarHBondContact OG-N 3.48Å; S97-R100 VanDerWaalsContact OG-N 3.08Å
101	G	97.3	Very high	97.3	Very high	30 Å²	30	46.5 Å²	46.5	31%	0.309	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	73.9	-161	-169.3	0	0	0	0	0	112.3	E96 S97	E96-G101 WeakPolarHBondContact CA-O 3.4Å; S97-G101 PolarHBondContact N-O 2.92Å; S97-G101 WeakPolarHBondContact O-CA 3.47Å; S97-G101 PolarHBondContact O-N 3.44Å
102	G	97.2	Very high	97.4	Very high	40 Å²	40	45.6 Å²	45.6	41%	0.412	27%	0.27	S	S	.	.			trans	146.4	169.8	-178.2	0	0	0	0	0	111.8	H104 G105 Y107	G102-H104 VanDerWaalsContact C-N 3.32Å; G102-H104 PolarHBondContact O-N 3.33Å; G102-G105 PolarHBondContact O-N 2.93Å; G102-Y107 WeakPolarHBondContact CA-OH 3.38Å; G102-Y107 PolarHBondContact O-OH 3.01Å
103	P	96.8	Very high	97.3	Very high	106 Å²	106	48.1 Å²	48.1	69%	0.688	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.3	-169.7	24.3	-32.7	0	0	0	115.1
104	H	97.2	Very high	97.3	Very high	32 Å²	32	51 Å²	51	15%	0.148	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	19.5	-178	-55.8	-81.9	0	0	0	113.4	R30 E96 G102 Y107 R112 D230 M231	R30-H104 PolarHBondContact NH2-CD2 3.43Å; E96-H104 IonicContact OE2-CD2 2.95Å; G102-H104 VanDerWaalsContact C-N 3.32Å; G102-H104 PolarHBondContact O-N 3.33Å; H104-Y107 HydrophobicContact CB-CE1 4.44Å; H104-Y107 PolarHBondContact N-OH 3.17Å; H104-R112 PolarHBondContact O-NH1 2.87Å; H104-D230 PolarHBondContact CE1-O 2.9Å; H104-D230 PolarHBondContact ND1-O 3.48Å; H104-M231 HydrophobicContact CB-CB 4.23Å; H104-M231 HydrophobicContact CB-CG 3.84Å
105	G	95.4	Very high	97.3	Very high	36 Å²	36	52.9 Å²	52.9	37%	0.371	31%	0.307	S	S	.	.			trans	-63.8	164.5	177.2	0	0	0	0	0	112.6	G102 Y107	G102-G105 PolarHBondContact O-N 2.93Å; G105-Y107 PolarHBondContact N-OH 3.45Å
106	P	98	Very high	97.3	Very high	58 Å²	58	51.4 Å²	51.4	38%	0.377	30%	0.3	S	S	.	.			cis	-68.8	149.9	-1.2	-20.4	34	0	0	0	112.8	I108 K111 R112	P106-I108 VanDerWaalsContact C-N 3.34Å; P106-K111 HydrophobicContact CB-CB 3.83Å; P106-K111 HydrophobicContact CG-CB 4.09Å; P106-R112 HydrophobicContact CB-CG 4.42Å; P106-R112 WeakPolarHBondContact O-CD 3.25Å; P106-R112 PolarHBondContact O-NH1 2.79Å
107	Y	98.4	Very high	97.2	Very high	5 Å²	5	55.1 Å²	55.1	2%	0.02	32%	0.323	C	S	.	.			trans	-97	22	177.5	-63.5	-83.6	0	0	0	113.3	I64 L65 R66 I67 E96 S97 G102 H104 G105 M231	I64-Y107 HydrophobicContact CG2-CD1 3.73Å; I64-Y107 HydrophobicContact CG2-CE1 3.72Å; L65-Y107 WeakPolarHBondContact O-CB 3.28Å; R66-Y107 WeakPolarHBondContact CA-O 3.26Å; I67-Y107 PolarHBondContact N-O 3.43Å; E96-Y107 HydrophobicContact CB-CE1 3.79Å; E96-Y107 HydrophobicContact CB-CE2 4.22Å; E96-Y107 WeakPolarHBondContact OE2-CE1 3.49Å; E96-Y107 PolarHBondContact OE2-OH 3.44Å; S97-Y107 WeakPolarHBondContact O-CD2 3.41Å; G102-Y107 WeakPolarHBondContact CA-OH 3.38Å; G102-Y107 PolarHBondContact O-OH 3.01Å; H104-Y107 HydrophobicContact CB-CE1 4.44Å; H104-Y107 PolarHBondContact N-OH 3.17Å; G105-Y107 PolarHBondContact N-OH 3.45Å; Y107-M231 HydrophobicContact CD1-CE 3.76Å; Y107-M231 HydrophobicContact CD1-SD 4.05Å; Y107-M231 HydrophobicContact CE1-CE 4.16Å; Y107-M231 HydrophobicContact CE1-SD 4.16Å
108	I	98	Very high	97.2	Very high	34 Å²	34	60.5 Å²	60.5	17%	0.174	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-123.9	122.7	176.9	-57.5	174.6	0	0	0	106.6	I67 D69 P98 P106 S110 K111 R112	I67-I108 HydrophobicContact CB-CG1 4.39Å; D69-I108 WeakPolarHBondContact OD2-CG2 3.15Å; P98-I108 HydrophobicContact CB-CD1 4.01Å; P98-I108 HydrophobicContact CB-CG1 3.9Å; P98-I108 HydrophobicContact CG-CD1 4.41Å; P98-I108 HydrophobicContact CG-CG1 3.8Å; P106-I108 VanDerWaalsContact C-N 3.34Å; I108-S110 WeakPolarHBondContact CG2-OG 3.46Å; I108-S110 PolarHBondContact O-N 2.99Å; I108-K111 HydrophobicContact CB-CD 4.3Å; I108-K111 HydrophobicContact CB-CG 4.25Å; I108-K111 HydrophobicContact CD1-CD 4.18Å; I108-K111 HydrophobicContact CG2-CG 4.36Å; I108-K111 PolarHBondContact O-N 3.33Å; I108-R112 WeakPolarHBondContact O-CG 3.27Å
109	Q	98.1	Very high	97.2	Very high	0 Å²	0	59 Å²	59	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-66	-35.8	-170.3	-71.2	-168.6	-35.5	0	0	113.4	R66 I67 E68 D69 T70 K111 R112 Y116 D227	R66-Q109 HydrophobicContact CG-CG 4.36Å; I67-Q109 WeakPolarHBondContact O-CG 3.47Å; I67-Q109 PolarHBondContact O-N 3.47Å; E68-Q109 VanDerWaalsContact CA-OE1 3.26Å; E68-Q109 HydrophobicContact CG-CG 4.45Å; D69-Q109 PolarHBondContact OD1-N 3.48Å; T70-Q109 HydrophobicContact CG2-CB 3.56Å; T70-Q109 HydrophobicContact CG2-CG 4.43Å; Q109-K111 PolarHBondContact O-N 3.18Å; Q109-K111 VanDerWaalsContact O-N 3.11Å; Q109-R112 WeakPolarHBondContact O-CB 3.39Å; Q109-R112 PolarHBondContact O-N 3.48Å; Q109-Y116 WeakPolarHBondContact CA-OH 3.15Å; Q109-Y116 WeakPolarHBondContact CB-OH 3.45Å; Q109-Y116 VanDerWaalsContact CG-OH 3.32Å; Q109-Y116 WeakPolarHBondContact CG-OH 3.41Å; Q109-Y116 VanDerWaalsContact O-CE2 3.32Å; Q109-Y116 WeakPolarHBondContact O-CE2 3.4Å; Q109-D227 WeakPolarHBondContact CG-OD2 3.47Å; Q109-D227 PolarHBondContact NE2-OD2 3.05Å
110	S	95.9	Very high	97.3	Very high	35 Å²	35	54.8 Å²	54.8	25%	0.245	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-59.7	-20.1	173.8	62.3	0	0	0	0	113.7	D69 I108 L113	D69-S110 PolarHBondContact OD1-N 3.49Å; D69-S110 PolarHBondContact OD1-OG 2.62Å; D69-S110 WeakPolarHBondContact OD2-CB 3.22Å; D69-S110 PolarHBondContact OD2-OG 2.91Å; I108-S110 WeakPolarHBondContact CG2-OG 3.46Å; I108-S110 PolarHBondContact O-N 2.99Å; S110-L113 WeakPolarHBondContact O-CG 3.42Å
111	K	97.1	Very high	97.4	Very high	141 Å²	141	52.3 Å²	52.3	61%	0.613	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-93	8.1	176	-59.5	-172.4	-179.9	-179.3	0	113.6	P106 I108 Q109	P106-K111 HydrophobicContact CB-CB 3.83Å; P106-K111 HydrophobicContact CG-CB 4.09Å; I108-K111 HydrophobicContact CB-CD 4.3Å; I108-K111 HydrophobicContact CB-CG 4.25Å; I108-K111 HydrophobicContact CD1-CD 4.18Å; I108-K111 HydrophobicContact CG2-CG 4.36Å; I108-K111 PolarHBondContact O-N 3.33Å; Q109-K111 PolarHBondContact O-N 3.18Å; Q109-K111 VanDerWaalsContact O-N 3.11Å
112	R	98	Very high	97.4	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.015	30%	0.301	C	S	.	.			trans	-118.8	17.5	-175.1	-61.5	172.6	71.4	74.5	3.5	113.2	H104 P106 I108 Q109 D114 I115 Y116 D227 D230	H104-R112 PolarHBondContact O-NH1 2.87Å; P106-R112 HydrophobicContact CB-CG 4.42Å; P106-R112 WeakPolarHBondContact O-CD 3.25Å; P106-R112 PolarHBondContact O-NH1 2.79Å; I108-R112 WeakPolarHBondContact O-CG 3.27Å; Q109-R112 WeakPolarHBondContact O-CB 3.39Å; Q109-R112 PolarHBondContact O-N 3.48Å; R112-D114 VanDerWaalsContact C-N 3.26Å; R112-D114 PolarHBondContact O-N 2.92Å; R112-I115 HydrophobicContact CB-CD1 4.26Å; R112-I115 HydrophobicContact CG-CD1 4.42Å; R112-I115 WeakPolarHBondContact O-CB 3.2Å; R112-I115 PolarHBondContact O-N 3.39Å; R112-Y116 HydrophobicContact CB-CE1 4.39Å; R112-Y116 HydrophobicContact CB-CE2 3.7Å; R112-Y116 WeakPolarHBondContact CB-OH 3Å; R112-Y116 VanDerWaalsContact O-CD2 3.24Å; R112-Y116 WeakPolarHBondContact O-CD2 3.24Å; R112-Y116 WeakPolarHBondContact O-CE2 3.48Å; R112-Y116 PolarHBondContact O-N 3.44Å; R112-D227 IonicContact CZ-OD1 3.68Å; R112-D227 VanDerWaalsContact CZ-OD1 3.29Å; R112-D227 IonicContact NE-OD1 2.87Å; R112-D227 PolarHBondContact NE-OD1 3.45Å; R112-D227 IonicContact NE-OD2 2.78Å; R112-D227 IonicContact NH2-OD1 3.72Å; R112-D227 PolarHBondContact NH2-OD1 3.44Å; R112-D230 IonicContact CZ-OD2 3.45Å; R112-D230 IonicContact NH1-OD2 3.49Å; R112-D230 IonicContact NH2-OD2 2.71Å; R112-D230 PolarHBondContact NH2-OD2 3.14Å
113	L	97.1	Very high	97.5	Very high	53 Å²	53	51.6 Å²	51.6	28%	0.277	28%	0.281	S	S	.	.	H	α-helix	trans	-56.7	-35.4	-173.4	-62.3	-179	0	0	0	114	S110 I115 Y116 T117 Y217	S110-L113 WeakPolarHBondContact O-CG 3.42Å; L113-I115 VanDerWaalsContact C-N 3.35Å; L113-I115 PolarHBondContact O-N 2.65Å; L113-Y116 HydrophobicContact CD2-CD2 4.27Å; L113-Y116 PolarHBondContact O-N 3.25Å; L113-T117 WeakPolarHBondContact O-CB 3.3Å; L113-T117 PolarHBondContact O-N 3.04Å; L113-T117 PolarHBondContact O-OG1 2.95Å; L113-Y217 HydrophobicContact CD1-CE1 4.42Å; L113-Y217 HydrophobicContact CD1-CE2 4.28Å; L113-Y217 HydrophobicContact CD2-CD1 3.94Å; L113-Y217 HydrophobicContact CD2-CE1 4Å; L113-Y217 HydrophobicContact CD2-CG 4.3Å
114	D	97.3	Very high	97.4	Very high	140 Å²	140	48.5 Å²	48.5	75%	0.749	26%	0.259	S	S	*	.	H	α-helix	trans	-64.3	-39.2	178.2	-64.9	-29.4	0	0	0	112.2	R112 T117 Q118	R112-D114 VanDerWaalsContact C-N 3.26Å; R112-D114 PolarHBondContact O-N 2.92Å; D114-T117 PolarHBondContact O-N 3.24Å; D114-Q118 WeakPolarHBondContact O-CB 3.42Å; D114-Q118 PolarHBondContact O-N 3.41Å
115	I	97.8	Very high	97.4	Very high	57 Å²	57	53.7 Å²	53.7	29%	0.292	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-46.6	178	-57.9	176.4	0	0	0	109.7	R112 L113 Q118 A119 I226	R112-I115 HydrophobicContact CB-CD1 4.26Å; R112-I115 HydrophobicContact CG-CD1 4.42Å; R112-I115 WeakPolarHBondContact O-CB 3.2Å; R112-I115 PolarHBondContact O-N 3.39Å; L113-I115 VanDerWaalsContact C-N 3.35Å; L113-I115 PolarHBondContact O-N 2.65Å; I115-Q118 PolarHBondContact O-N 3.02Å; I115-A119 WeakPolarHBondContact O-CB 3.41Å; I115-A119 PolarHBondContact O-N 3Å; I115-I226 HydrophobicContact CG2-CG2 3.75Å
116	Y	98	Very high	97.4	Very high	1 Å²	1	55.7 Å²	55.7	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-67.7	-37.9	178.8	-47.2	-48.7	0	0	0	112.1	Q109 R112 L113 Q118 A119 A120 P218 F222 A223 I226 D227	Q109-Y116 WeakPolarHBondContact CA-OH 3.15Å; Q109-Y116 WeakPolarHBondContact CB-OH 3.45Å; Q109-Y116 VanDerWaalsContact CG-OH 3.32Å; Q109-Y116 WeakPolarHBondContact CG-OH 3.41Å; Q109-Y116 VanDerWaalsContact O-CE2 3.32Å; Q109-Y116 WeakPolarHBondContact O-CE2 3.4Å; R112-Y116 HydrophobicContact CB-CE1 4.39Å; R112-Y116 HydrophobicContact CB-CE2 3.7Å; R112-Y116 WeakPolarHBondContact CB-OH 3Å; R112-Y116 VanDerWaalsContact O-CD2 3.24Å; R112-Y116 WeakPolarHBondContact O-CD2 3.24Å; R112-Y116 WeakPolarHBondContact O-CE2 3.48Å; R112-Y116 PolarHBondContact O-N 3.44Å; L113-Y116 HydrophobicContact CD2-CD2 4.27Å; L113-Y116 PolarHBondContact O-N 3.25Å; Y116-Q118 VanDerWaalsContact C-N 3.33Å; Y116-Q118 PolarHBondContact O-N 3.13Å; Y116-A119 PolarHBondContact O-N 3.3Å; Y116-A120 VanDerWaalsContact O-CB 3.22Å; Y116-A120 WeakPolarHBondContact O-CB 3.33Å; Y116-A120 PolarHBondContact O-N 3.43Å; Y116-P218 HydrophobicContact CD2-CB 4.16Å; Y116-P218 HydrophobicContact CD2-CG 3.44Å; Y116-P218 VanDerWaalsContact CD2-CG 3.44Å; Y116-P218 HydrophobicContact CE2-CG 3.66Å; Y116-P218 HydrophobicContact CG-CB 4.18Å; Y116-P218 HydrophobicContact CG-CG 3.95Å; Y116-F222 WeakPolarHBondContact O-CE1 2.69Å; Y116-A223 HydrophobicContact CE1-CB 3.95Å; Y116-I226 HydrophobicContact CD1-CB 4.29Å; Y116-I226 HydrophobicContact CD1-CD1 3.95Å; Y116-I226 HydrophobicContact CD1-CG2 4.06Å; Y116-I226 HydrophobicContact CE1-CB 4.42Å; Y116-I226 HydrophobicContact CE1-CG2 4.23Å; Y116-D227 WeakPolarHBondContact CE1-OD1 3.43Å; Y116-D227 PolarHBondContact OH-OD1 3.43Å; Y116-D227 PolarHBondContact OH-OD2 2.59Å
117	T	97.1	Very high	97.3	Very high	87 Å²	87	57.4 Å²	57.4	53%	0.534	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-44.6	176.6	-60	0	0	0	0	110.7	L113 D114 A120 K121	L113-T117 WeakPolarHBondContact O-CB 3.3Å; L113-T117 PolarHBondContact O-N 3.04Å; L113-T117 PolarHBondContact O-OG1 2.95Å; D114-T117 PolarHBondContact O-N 3.24Å; T117-A120 PolarHBondContact O-N 3.22Å; T117-K121 PolarHBondContact O-N 3.28Å
118	Q	97.7	Very high	97.2	Very high	115 Å²	115	60.6 Å²	60.6	54%	0.537	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-45.4	177.2	-177.5	56.9	28.3	0	0	112.1	D114 I115 Y116 A120 K121 E122	D114-Q118 WeakPolarHBondContact O-CB 3.42Å; D114-Q118 PolarHBondContact O-N 3.41Å; I115-Q118 PolarHBondContact O-N 3.02Å; Y116-Q118 VanDerWaalsContact C-N 3.33Å; Y116-Q118 PolarHBondContact O-N 3.13Å; Q118-A120 VanDerWaalsContact C-N 3.31Å; Q118-A120 PolarHBondContact O-N 3.32Å; Q118-K121 WeakPolarHBondContact O-CB 3.41Å; Q118-K121 PolarHBondContact O-N 3.11Å; Q118-E122 PolarHBondContact O-N 2.9Å
119	A	98.2	Very high	97.1	Very high	9 Å²	9	59.2 Å²	59.2	7%	0.074	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-37.3	176.9	0	0	0	0	0	112.2	I115 Y116 E122 L123 F222 I226 F256	I115-A119 WeakPolarHBondContact O-CB 3.41Å; I115-A119 PolarHBondContact O-N 3Å; Y116-A119 PolarHBondContact O-N 3.3Å; A119-E122 PolarHBondContact O-N 3.45Å; A119-L123 PolarHBondContact O-N 3.48Å; A119-L123 VanDerWaalsContact O-N 3.13Å; A119-F222 HydrophobicContact CB-CE1 4.39Å; A119-F222 HydrophobicContact CB-CZ 4Å; A119-I226 HydrophobicContact CB-CD1 3.45Å; A119-I226 VanDerWaalsContact CB-CD1 3.45Å; A119-I226 HydrophobicContact CB-CG1 4.09Å; A119-F256 HydrophobicContact CB-CE1 4.06Å; A119-F256 HydrophobicContact CB-CZ 3.9Å
120	A	97.9	Very high	97.1	Very high	6 Å²	6	60 Å²	60	5%	0.05	30%	0.297	C	S	.	.	H	α-helix	trans	-67.2	-38.4	176.8	0	0	0	0	0	111.9	Y116 T117 Q118 L123 L124 L179 I212 F222	Y116-A120 VanDerWaalsContact O-CB 3.22Å; Y116-A120 WeakPolarHBondContact O-CB 3.33Å; Y116-A120 PolarHBondContact O-N 3.43Å; T117-A120 PolarHBondContact O-N 3.22Å; Q118-A120 VanDerWaalsContact C-N 3.31Å; Q118-A120 PolarHBondContact O-N 3.32Å; A120-L123 PolarHBondContact O-N 3.2Å; A120-L124 WeakPolarHBondContact O-CB 3.49Å; A120-L124 WeakPolarHBondContact O-CG 3.4Å; A120-L124 PolarHBondContact O-N 2.82Å; A120-L179 HydrophobicContact CB-CD1 3.75Å; A120-I212 HydrophobicContact CB-CG1 3.97Å; A120-F222 HydrophobicContact CB-CE1 4.03Å; A120-F222 HydrophobicContact CB-CZ 3.92Å
121	K	97.4	Very high	97.2	Very high	110 Å²	110	61.8 Å²	61.8	48%	0.478	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-46	173.9	-178	-179.6	171.5	-175.2	0	111.5	T117 Q118 L123 L124 E125	T117-K121 PolarHBondContact O-N 3.28Å; Q118-K121 WeakPolarHBondContact O-CB 3.41Å; Q118-K121 PolarHBondContact O-N 3.11Å; K121-L123 PolarHBondContact O-N 3.3Å; K121-L124 WeakPolarHBondContact O-CB 3.47Å; K121-L124 PolarHBondContact O-N 2.9Å; K121-E125 WeakPolarHBondContact CE-OE1 2.96Å; K121-E125 WeakPolarHBondContact O-CG 3.4Å; K121-E125 PolarHBondContact O-N 2.83Å
122	E	97.9	Very high	97.2	Very high	55 Å²	55	55.2 Å²	55.2	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-57.5	-47.1	176.6	-176.8	-170.8	151.9	0	0	112	Q118 A119 L124 E125 K126	Q118-E122 PolarHBondContact O-N 2.9Å; A119-E122 PolarHBondContact O-N 3.45Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 3.04Å; E122-E125 PolarHBondContact O-N 3.09Å; E122-K126 HydrophobicContact CG-CD 4.15Å; E122-K126 WeakPolarHBondContact O-CG 3.47Å; E122-K126 PolarHBondContact O-N 3.29Å; E122-K126 WeakPolarHBondContact OE1-CE 3.31Å; E122-K126 IonicContact OE1-NZ 2.71Å; E122-K126 PolarHBondContact OE1-NZ 2.96Å
123	L	97.8	Very high	97.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68	-31.3	178.3	-68.8	-167.7	0	0	0	113.3	A119 A120 K121 K126 D127 K128 V129 F222 L252 A255 F256	A119-L123 PolarHBondContact O-N 3.48Å; A119-L123 VanDerWaalsContact O-N 3.13Å; A120-L123 PolarHBondContact O-N 3.2Å; K121-L123 PolarHBondContact O-N 3.3Å; L123-K126 PolarHBondContact O-N 3.31Å; L123-D127 PolarHBondContact O-N 3.1Å; L123-K128 HydrophobicContact CB-CB 4.23Å; L123-K128 HydrophobicContact CD2-CB 4.09Å; L123-K128 HydrophobicContact CD2-CG 4.29Å; L123-K128 PolarHBondContact O-N 3.46Å; L123-V129 HydrophobicContact CB-CB 4.4Å; L123-V129 HydrophobicContact CB-CG1 3.78Å; L123-V129 HydrophobicContact CB-CG2 3.76Å; L123-V129 HydrophobicContact CD1-CG1 3.73Å; L123-V129 HydrophobicContact CG-CG1 4.45Å; L123-V129 PolarHBondContact O-N 3.43Å; L123-F222 HydrophobicContact CD1-CE2 3.86Å; L123-L252 HydrophobicContact CD1-CD2 4.3Å; L123-A255 HydrophobicContact CD2-CB 3.97Å; L123-F256 HydrophobicContact CD1-CD2 4.38Å; L123-F256 HydrophobicContact CD1-CE1 4.12Å; L123-F256 HydrophobicContact CD1-CE2 3.64Å; L123-F256 HydrophobicContact CD1-CZ 3.48Å; L123-F256 VanDerWaalsContact CD1-CZ 3.48Å; L123-F256 HydrophobicContact CD2-CD1 3.64Å; L123-F256 HydrophobicContact CD2-CD2 4.17Å; L123-F256 HydrophobicContact CD2-CE1 3.54Å; L123-F256 HydrophobicContact CD2-CE2 4.09Å; L123-F256 HydrophobicContact CD2-CG 3.95Å; L123-F256 HydrophobicContact CD2-CZ 3.77Å; L123-F256 HydrophobicContact CG-CD1 4.18Å; L123-F256 HydrophobicContact CG-CE1 3.53Å; L123-F256 HydrophobicContact CG-CE2 4Å; L123-F256 HydrophobicContact CG-CZ 3.42Å; L123-F256 VanDerWaalsContact CG-CZ 3.42Å
124	L	96.1	Very high	97.1	Very high	41 Å²	41	54 Å²	54	22%	0.215	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-45.2	173.9	-85.1	168.1	0	0	0	110.6	A120 K121 E122 K126 D127 V129 R131 L179	A120-L124 WeakPolarHBondContact O-CB 3.49Å; A120-L124 WeakPolarHBondContact O-CG 3.4Å; A120-L124 PolarHBondContact O-N 2.82Å; K121-L124 WeakPolarHBondContact O-CB 3.47Å; K121-L124 PolarHBondContact O-N 2.9Å; E122-L124 VanDerWaalsContact C-N 3.32Å; E122-L124 PolarHBondContact O-N 3.04Å; L124-K126 VanDerWaalsContact C-N 3.28Å; L124-K126 PolarHBondContact O-N 2.81Å; L124-D127 PolarHBondContact O-N 2.86Å; L124-V129 HydrophobicContact CB-CG2 4.22Å; L124-V129 HydrophobicContact CD2-CG2 3.79Å; L124-V129 HydrophobicContact CG-CG2 3.59Å; L124-R131 HydrophobicContact CD2-CG 4.43Å; L124-L179 HydrophobicContact CD1-CD1 3.9Å; L124-L179 HydrophobicContact CD1-CD2 4.06Å; L124-L179 HydrophobicContact CD2-CD2 4Å; L124-L179 HydrophobicContact CG-CD1 4.33Å; L124-L179 HydrophobicContact CG-CD2 4.35Å
125	E	95.9	Very high	96.9	Very high	140 Å²	140	49.8 Å²	49.8	65%	0.654	25%	0.247	S	C	*	.	H	α-helix	trans	-64.3	-33.2	177.7	-70.9	170.7	-176.6	0	0	112	K121 E122 D127	K121-E125 WeakPolarHBondContact CE-OE1 2.96Å; K121-E125 WeakPolarHBondContact O-CG 3.4Å; K121-E125 PolarHBondContact O-N 2.83Å; E122-E125 PolarHBondContact O-N 3.09Å; E125-D127 VanDerWaalsContact C-N 3.3Å; E125-D127 PolarHBondContact O-N 2.96Å
126	K	96	Very high	96.7	Very high	78 Å²	78	54.2 Å²	54.2	34%	0.339	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	6.5	176.9	-68.5	175.9	176.7	179.4	0	114.9	E122 L123 L124 K128	E122-K126 HydrophobicContact CG-CD 4.15Å; E122-K126 WeakPolarHBondContact O-CG 3.47Å; E122-K126 PolarHBondContact O-N 3.29Å; E122-K126 WeakPolarHBondContact OE1-CE 3.31Å; E122-K126 IonicContact OE1-NZ 2.71Å; E122-K126 PolarHBondContact OE1-NZ 2.96Å; L123-K126 PolarHBondContact O-N 3.31Å; L124-K126 VanDerWaalsContact C-N 3.28Å; L124-K126 PolarHBondContact O-N 2.81Å; K126-K128 HydrophobicContact CB-CG 3.86Å; K126-K128 PolarHBondContact O-N 3.32Å
127	D	95.3	Very high	96.6	Very high	95 Å²	95	59.9 Å²	59.9	51%	0.508	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	35.7	-173.7	-169.7	40.4	0	0	0	113.8	L123 L124 E125 K182	L123-D127 PolarHBondContact O-N 3.1Å; L124-D127 PolarHBondContact O-N 2.86Å; E125-D127 VanDerWaalsContact C-N 3.3Å; E125-D127 PolarHBondContact O-N 2.96Å; D127-K182 IonicContact OD1-NZ 3.82Å; D127-K182 PolarHBondContact OD1-NZ 3.41Å; D127-K182 IonicContact OD2-NZ 3.5Å; D127-K182 PolarHBondContact OD2-NZ 2.97Å
128	K	96.5	Very high	96.5	Very high	72 Å²	72	58.9 Å²	58.9	31%	0.313	28%	0.277	S	S	.	.	S	Bend	trans	-95.4	-19.3	176.7	-56.5	-54	179.1	-164.9	0	112.8	L123 K126 K182 A255	L123-K128 HydrophobicContact CB-CB 4.23Å; L123-K128 HydrophobicContact CD2-CB 4.09Å; L123-K128 HydrophobicContact CD2-CG 4.29Å; L123-K128 PolarHBondContact O-N 3.46Å; K126-K128 HydrophobicContact CB-CG 3.86Å; K126-K128 PolarHBondContact O-N 3.32Å; K128-K182 WeakPolarHBondContact O-CB 3.43Å; K128-K182 PolarHBondContact O-N 2.81Å; K128-A255 HydrophobicContact CB-CB 3.95Å; K128-A255 HydrophobicContact CD-CB 4.4Å; K128-A255 HydrophobicContact CG-CB 3.94Å
129	V	97	Very high	96.3	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.03	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	158.5	176.1	-55.1	0	0	0	0	109.3	L123 L124 R180 L181 L211	L123-V129 HydrophobicContact CB-CB 4.4Å; L123-V129 HydrophobicContact CB-CG1 3.78Å; L123-V129 HydrophobicContact CB-CG2 3.76Å; L123-V129 HydrophobicContact CD1-CG1 3.73Å; L123-V129 HydrophobicContact CG-CG1 4.45Å; L123-V129 PolarHBondContact O-N 3.43Å; L124-V129 HydrophobicContact CB-CG2 4.22Å; L124-V129 HydrophobicContact CD2-CG2 3.79Å; L124-V129 HydrophobicContact CG-CG2 3.59Å; V129-R180 CarbonylContact C-O 3.53Å; V129-R180 WeakPolarHBondContact CA-O 3.44Å; V129-R180 VanDerWaalsContact CB-O 3.24Å; V129-R180 WeakPolarHBondContact CB-O 3.22Å; V129-L181 HydrophobicContact CG1-CD1 4.47Å; V129-L211 HydrophobicContact CG1-CD1 3.48Å; V129-L211 VanDerWaalsContact CG1-CD1 3.48Å
130	Y	97.2	Very high	96.1	Very high	15 Å²	15	60.4 Å²	60.4	6%	0.059	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	160.3	178.7	62.8	-83.9	0	0	0	112	Y155 C159 R160 L179 R180 K182 D208	Y130-Y155 HydrophobicContact CE2-CE1 4.4Å; Y130-Y155 WeakPolarHBondContact OH-CE1 3.49Å; Y130-C159 HydrophobicContact CD2-CB 4.15Å; Y130-C159 WeakPolarHBondContact CD2-O 3.25Å; Y130-C159 HydrophobicContact CE2-CB 3.96Å; Y130-R160 HydrophobicContact CD1-CG 4.49Å; Y130-R160 HydrophobicContact CE1-CB 4.16Å; Y130-R160 HydrophobicContact CE1-CG 4.11Å; Y130-R160 HydrophobicContact CE2-CB 4.09Å; Y130-L179 WeakPolarHBondContact O-CA 3.38Å; Y130-R180 HydrophobicContact CE1-CB 3.98Å; Y130-R180 HydrophobicContact CE2-CB 4.2Å; Y130-R180 PolarHBondContact N-O 2.9Å; Y130-R180 PolarHBondContact O-N 2.91Å; Y130-K182 HydrophobicContact CD1-CB 4.08Å; Y130-K182 HydrophobicContact CE1-CB 4.24Å; Y130-D208 HydrophobicContact CE1-CB 4.16Å; Y130-D208 WeakPolarHBondContact CE1-OD2 3.39Å; Y130-D208 VanDerWaalsContact CZ-OD2 3.26Å; Y130-D208 VanDerWaalsContact OH-CB 3.23Å; Y130-D208 WeakPolarHBondContact OH-CB 3.47Å; Y130-D208 PolarHBondContact OH-OD2 2.97Å
131	R	97.5	Very high	95.9	Very high	74 Å²	74	65.9 Å²	65.9	28%	0.279	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	122.1	178.5	-64.5	-177.1	178.6	80.1	0.2	110.4	L124 F133 C159 F177 L179	L124-R131 HydrophobicContact CD2-CG 4.43Å; R131-F133 HydrophobicContact CB-CD2 4.4Å; R131-F133 HydrophobicContact CB-CE2 3.63Å; R131-F133 HydrophobicContact CB-CZ 3.9Å; R131-C159 WeakPolarHBondContact O-CB 3.42Å; R131-F177 HydrophobicContact CB-CB 4.42Å; R131-F177 HydrophobicContact CB-CD2 3.98Å; R131-F177 HydrophobicContact CB-CG 4.29Å; R131-F177 HydrophobicContact CG-CD2 3.7Å; R131-F177 HydrophobicContact CG-CE2 3.86Å; R131-F177 HydrophobicContact CG-CG 4.31Å; R131-L179 HydrophobicContact CB-CD2 4.47Å; R131-L179 HydrophobicContact CG-CD2 3.74Å
132	C	97.7	Very high	95.7	Very high	3 Å²	3	64.4 Å²	64.4	2%	0.02	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.4	174.4	168.4	0	0	0	0	110.4	Y155 C159 F177 A178 R180	C132-Y155 PolarHBondContact SG-OH 3.46Å; C132-Y155 VanDerWaalsContact SG-OH 3.38Å; C132-C159 HydrophobicContact CB-CB 4.21Å; C132-F177 CarbonylContact O-C 3.5Å; C132-F177 VanDerWaalsContact O-CA 3.22Å; C132-F177 WeakPolarHBondContact O-CA 3.17Å; C132-F177 WeakPolarHBondContact O-CB 3.46Å; C132-A178 PolarHBondContact N-O 3.19Å; C132-A178 PolarHBondContact O-N 3.08Å; C132-R180 HydrophobicContact CB-CG 3.97Å; C132-R180 PolarHBondContact SG-NE 2.89Å
133	F	97.3	Very high	95.4	Very high	9 Å²	9	69.1 Å²	69.1	4%	0.039	32%	0.322	C	S	.	.			trans	-99.4	8.6	-179.9	-59.8	-90.1	0	0	0	113.2	R131 S135 C159 L162 I167 K170 L171 Q175 F177	R131-F133 HydrophobicContact CB-CD2 4.4Å; R131-F133 HydrophobicContact CB-CE2 3.63Å; R131-F133 HydrophobicContact CB-CZ 3.9Å; F133-S135 PolarHBondContact O-N 2.8Å; F133-C159 PolarHBondContact N-SG 2.91Å; F133-C159 VanDerWaalsContact N-SG 3.4Å; F133-L162 HydrophobicContact CD2-CD1 3.75Å; F133-L162 HydrophobicContact CE2-CD1 4.15Å; F133-I167 HydrophobicContact CE2-CG1 4.4Å; F133-I167 HydrophobicContact CE2-CG2 4.46Å; F133-I167 HydrophobicContact CZ-CG2 4.36Å; F133-K170 HydrophobicContact CB-CD 3.88Å; F133-K170 HydrophobicContact CD1-CB 3.74Å; F133-K170 HydrophobicContact CD1-CD 4Å; F133-K170 HydrophobicContact CD1-CG 4.42Å; F133-K170 HydrophobicContact CD2-CB 4.37Å; F133-K170 HydrophobicContact CD2-CD 3.47Å; F133-K170 VanDerWaalsContact CD2-CD 3.47Å; F133-K170 HydrophobicContact CE1-CB 3.53Å; F133-K170 HydrophobicContact CE1-CD 4.38Å; F133-K170 HydrophobicContact CE2-CB 4.18Å; F133-K170 HydrophobicContact CE2-CD 3.9Å; F133-K170 HydrophobicContact CG-CB 4.15Å; F133-K170 HydrophobicContact CG-CD 3.52Å; F133-K170 HydrophobicContact CG-CG 4.41Å; F133-K170 HydrophobicContact CZ-CB 3.76Å; F133-K170 HydrophobicContact CZ-CD 4.34Å; F133-L171 HydrophobicContact CE1-CD2 4.29Å; F133-L171 HydrophobicContact CZ-CD2 4.24Å; F133-L171 HydrophobicContact CZ-CG 4.29Å; F133-Q175 HydrophobicContact CB-CG 4.44Å; F133-Q175 HydrophobicContact CD1-CB 4.08Å; F133-Q175 HydrophobicContact CD1-CG 4.04Å; F133-Q175 PolarHBondContact O-NE2 2.78Å; F133-F177 HydrophobicContact CD1-CB 3.63Å; F133-F177 HydrophobicContact CE1-CB 3.66Å; F133-F177 HydrophobicContact CE1-CD1 4.01Å; F133-F177 HydrophobicContact CE1-CG 4.11Å; F133-F177 HydrophobicContact CG-CB 4.16Å; F133-F177 HydrophobicContact CZ-CB 4.21Å; F133-F177 HydrophobicContact CZ-CG 4.48Å
134	C	95.7	Very high	95.3	Very high	23 Å²	23	76.3 Å²	76.3	16%	0.155	35%	0.354	C	S	.	.			trans	-63.7	130.1	179	-63.6	0	0	0	0	111.5	L139 Y155	C134-L139 HydrophobicContact CB-CD2 4.16Å; C134-L139 HydrophobicContact CB-CG 4.29Å; C134-Y155 HydrophobicContact CB-CE2 4.35Å; C134-Y155 PolarHBondContact SG-OH 2.83Å; C134-Y155 VanDerWaalsContact SG-OH 3.37Å
135	S	94	Very high	95.1	Very high	51 Å²	51	78 Å²	78	36%	0.357	36%	0.36	S	S	.	.			trans	-71.5	159.6	177.1	86.7	0	0	0	0	112.3	F133 E137 R138 L139	F133-S135 PolarHBondContact O-N 2.8Å; S135-E137 WeakPolarHBondContact CB-OE2 3.35Å; S135-E137 PolarHBondContact O-N 2.86Å; S135-E137 PolarHBondContact OG-N 3.36Å; S135-E137 PolarHBondContact OG-OE2 3.4Å; S135-R138 PolarHBondContact O-N 2.95Å; S135-R138 PolarHBondContact OG-N 3.26Å; S135-L139 WeakPolarHBondContact O-CG 3.25Å; S135-L139 PolarHBondContact O-N 3.33Å
136	K	92.9	Very high	94.9	Very high	149 Å²	149	72.1 Å²	72.1	65%	0.648	34%	0.336	S	S	*	.	H	α-helix	trans	-59.6	-38.2	175.9	-70.5	-176.1	178.9	-179.1	0	110.9	L139 M140	K136-L139 PolarHBondContact O-N 2.65Å; K136-M140 WeakPolarHBondContact O-CG 3.39Å; K136-M140 PolarHBondContact O-N 3.27Å
137	E	95.3	Very high	94.7	Very high	121 Å²	121	73.1 Å²	73.1	57%	0.565	34%	0.344	S	S	*	.	H	α-helix	trans	-63.1	-45.1	-179.8	-57.1	67.5	-138.4	0	0	111.4	S135 L139 M140 L141	S135-E137 WeakPolarHBondContact CB-OE2 3.35Å; S135-E137 PolarHBondContact O-N 2.86Å; S135-E137 PolarHBondContact OG-N 3.36Å; S135-E137 PolarHBondContact OG-OE2 3.4Å; E137-L139 VanDerWaalsContact C-N 3.34Å; E137-L139 PolarHBondContact O-N 2.81Å; E137-M140 HydrophobicContact CG-CE 4.47Å; E137-M140 PolarHBondContact O-N 2.96Å; E137-L141 PolarHBondContact O-N 2.69Å
138	R	95	Very high	94.6	Very high	65 Å²	65	78.3 Å²	78.3	25%	0.245	36%	0.357	C	S	.	.	H	α-helix	trans	-59.2	-47.3	175.2	-178.6	-171.6	-180	-78.6	-3.2	111.1	S135 M140 L141 K142 D156 M158	S135-R138 PolarHBondContact O-N 2.95Å; S135-R138 PolarHBondContact OG-N 3.26Å; R138-M140 VanDerWaalsContact C-N 3.32Å; R138-M140 PolarHBondContact O-N 3.27Å; R138-L141 PolarHBondContact O-N 3.34Å; R138-K142 PolarHBondContact O-N 3.38Å; R138-D156 IonicContact CZ-OD1 3.78Å; R138-D156 IonicContact CZ-OD2 2.98Å; R138-D156 IonicContact NH1-OD1 2.89Å; R138-D156 PolarHBondContact NH1-OD1 3.08Å; R138-D156 IonicContact NH1-OD2 3.95Å; R138-D156 PolarHBondContact NH1-OD2 2.79Å; R138-D156 IonicContact NH2-OD1 3.78Å; R138-D156 PolarHBondContact NH2-OD1 3.2Å; R138-D156 IonicContact NH2-OD2 2.71Å; R138-D156 PolarHBondContact NH2-OD2 3.08Å; R138-M158 VanDerWaalsContact NH2-CB 3.34Å
139	L	93.7	Very high	94.4	Very high	51 Å²	51	79.5 Å²	79.5	27%	0.267	37%	0.365	S	S	.	.	H	α-helix	trans	-64.1	-39.1	-179.4	-64.3	174.6	0	0	0	111.4	C134 S135 K136 E137 R143 Y155	C134-L139 HydrophobicContact CB-CD2 4.16Å; C134-L139 HydrophobicContact CB-CG 4.29Å; S135-L139 WeakPolarHBondContact O-CG 3.25Å; S135-L139 PolarHBondContact O-N 3.33Å; K136-L139 PolarHBondContact O-N 2.65Å; E137-L139 VanDerWaalsContact C-N 3.34Å; E137-L139 PolarHBondContact O-N 2.81Å; L139-R143 WeakPolarHBondContact O-CB 3.28Å; L139-R143 PolarHBondContact O-N 2.7Å; L139-Y155 HydrophobicContact CD2-CD2 3.61Å; L139-Y155 HydrophobicContact CD2-CE2 3.87Å
140	M	93.9	Very high	94.1	Very high	106 Å²	106	82.8 Å²	82.8	52%	0.522	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-42.4	173.9	-74.1	-170.1	-70.5	0	0	112.4	K136 E137 R138 R143 K144	K136-M140 WeakPolarHBondContact O-CG 3.39Å; K136-M140 PolarHBondContact O-N 3.27Å; E137-M140 HydrophobicContact CG-CE 4.47Å; E137-M140 PolarHBondContact O-N 2.96Å; R138-M140 VanDerWaalsContact C-N 3.32Å; R138-M140 PolarHBondContact O-N 3.27Å; M140-R143 PolarHBondContact O-N 3.2Å; M140-K144 WeakPolarHBondContact O-CG 3.43Å; M140-K144 PolarHBondContact O-N 3.13Å
141	L	95	Very high	93.6	Very high	121 Å²	121	89.9 Å²	89.9	63%	0.634	43%	0.427	S	S	*	.	H	α-helix	trans	-62.7	-46.8	177.4	-175.4	65.4	0	0	0	111.2	E137 R138 R143 K144 E145	E137-L141 PolarHBondContact O-N 2.69Å; R138-L141 PolarHBondContact O-N 3.34Å; L141-R143 VanDerWaalsContact C-N 3.34Å; L141-R143 PolarHBondContact O-N 3.26Å; L141-K144 PolarHBondContact O-N 2.99Å; L141-E145 PolarHBondContact O-N 3.11Å
142	K	92.5	Very high	93	Very high	79 Å²	79	93.5 Å²	93.5	34%	0.343	45%	0.451	S	S	.	.	H	α-helix	trans	-61.7	-40.8	176.7	-76.8	-69.5	173.2	-160.7	0	112.7	R138 K144 E145 A146	R138-K142 PolarHBondContact O-N 3.38Å; K142-K144 PolarHBondContact O-N 3.37Å; K142-E145 IonicContact NZ-OE2 3.38Å; K142-E145 PolarHBondContact NZ-OE2 3Å; K142-E145 PolarHBondContact O-N 3.05Å; K142-A146 PolarHBondContact O-N 3.49Å
143	R	92.4	Very high	92.5	Very high	153 Å²	153	95.8 Å²	95.8	58%	0.577	47%	0.466	S	S	*	.	H	α-helix	trans	-59.6	-46.2	173.5	-177	177.2	-175	119.3	1.8	111.8	L139 M140 L141 A146 L147 P153	L139-R143 WeakPolarHBondContact O-CB 3.28Å; L139-R143 PolarHBondContact O-N 2.7Å; M140-R143 PolarHBondContact O-N 3.2Å; L141-R143 VanDerWaalsContact C-N 3.34Å; L141-R143 PolarHBondContact O-N 3.26Å; R143-A146 PolarHBondContact O-N 3.09Å; R143-L147 HydrophobicContact CG-CD1 4.12Å; R143-L147 VanDerWaalsContact O-CG 3.3Å; R143-L147 WeakPolarHBondContact O-CG 3.47Å; R143-L147 PolarHBondContact O-N 3.49Å; R143-L147 VanDerWaalsContact O-N 3.09Å; R143-P153 HydrophobicContact CB-CB 4.43Å; R143-P153 HydrophobicContact CG-CB 3.81Å; R143-P153 HydrophobicContact CG-CG 4.44Å
144	K	93.8	Very high	92	Very high	152 Å²	152	97 Å²	97	66%	0.661	48%	0.481	S	S	*	.	H	α-helix	trans	-62.8	-41.4	177.4	-73.6	178.9	179.5	-178	0	111.9	M140 L141 K142 R148	M140-K144 WeakPolarHBondContact O-CG 3.43Å; M140-K144 PolarHBondContact O-N 3.13Å; L141-K144 PolarHBondContact O-N 2.99Å; K142-K144 PolarHBondContact O-N 3.37Å; K144-R148 WeakPolarHBondContact O-CB 3.34Å; K144-R148 PolarHBondContact O-N 2.95Å
145	E	93.3	Very high	91.8	Very high	75 Å²	75	96.7 Å²	96.7	35%	0.35	48%	0.477	S	S	.	.	H	α-helix	trans	-61	-48.6	176.7	-175.1	178.6	-161.4	0	0	111.7	L141 K142 R148 M149	L141-E145 PolarHBondContact O-N 3.11Å; K142-E145 IonicContact NZ-OE2 3.38Å; K142-E145 PolarHBondContact NZ-OE2 3Å; K142-E145 PolarHBondContact O-N 3.05Å; E145-R148 PolarHBondContact O-N 2.72Å; E145-M149 HydrophobicContact CG-SD 4.4Å; E145-M149 WeakPolarHBondContact O-CG 3.37Å; E145-M149 PolarHBondContact O-N 3.4Å; E145-M149 VanDerWaalsContact O-N 3.1Å
146	A	90.9	Very high	91.7	Very high	17 Å²	17	97.6 Å²	97.6	14%	0.14	48%	0.478	C	S	.	.	H	α-helix	trans	-60	-48.1	178	0	0	0	0	0	112.1	K142 R143 R148 M149 G150 R151 P153	K142-A146 PolarHBondContact O-N 3.49Å; R143-A146 PolarHBondContact O-N 3.09Å; A146-R148 VanDerWaalsContact C-N 3.34Å; A146-R148 PolarHBondContact O-N 3.27Å; A146-M149 CarbonylContact O-C 3.49Å; A146-M149 PolarHBondContact O-N 2.79Å; A146-M149 VanDerWaalsContact O-N 3.07Å; A146-G150 PolarHBondContact O-N 3.38Å; A146-R151 CarbonylContact C-O 3.35Å; A146-R151 HydrophobicContact CB-CB 4.48Å; A146-R151 PolarHBondContact O-N 3.43Å; A146-P153 HydrophobicContact CB-CB 4.31Å
147	L	92.3	Very high	91.7	Very high	99 Å²	99	91.4 Å²	91.4	52%	0.518	45%	0.452	S	S	.	.	H	α-helix	trans	-61.3	-40.9	177.7	-69.7	172.1	0	0	0	112	R143 M149 G150 P153	R143-L147 HydrophobicContact CG-CD1 4.12Å; R143-L147 VanDerWaalsContact O-CG 3.3Å; R143-L147 WeakPolarHBondContact O-CG 3.47Å; R143-L147 PolarHBondContact O-N 3.49Å; R143-L147 VanDerWaalsContact O-N 3.09Å; L147-M149 PolarHBondContact O-N 2.99Å; L147-G150 PolarHBondContact O-N 2.87Å; L147-G150 VanDerWaalsContact O-N 3.12Å; L147-P153 HydrophobicContact CD2-CG 4.26Å
148	R	93.9	Very high	91.6	Very high	205 Å²	205	90.9 Å²	90.9	77%	0.774	45%	0.451	S	S	*	.	H	α-helix	trans	-62	-31.3	175.6	-172	-177.6	70.9	176	1.2	112.1	K144 E145 A146	K144-R148 WeakPolarHBondContact O-CB 3.34Å; K144-R148 PolarHBondContact O-N 2.95Å; E145-R148 PolarHBondContact O-N 2.72Å; A146-R148 VanDerWaalsContact C-N 3.34Å; A146-R148 PolarHBondContact O-N 3.27Å
149	M	92.4	Very high	91.7	Very high	96 Å²	96	88.2 Å²	88.2	47%	0.473	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4.1	178	-66.2	-177.6	71.4	0	0	113.8	E145 A146 L147 R151	E145-M149 HydrophobicContact CG-SD 4.4Å; E145-M149 WeakPolarHBondContact O-CG 3.37Å; E145-M149 PolarHBondContact O-N 3.4Å; E145-M149 VanDerWaalsContact O-N 3.1Å; A146-M149 CarbonylContact O-C 3.49Å; A146-M149 PolarHBondContact O-N 2.79Å; A146-M149 VanDerWaalsContact O-N 3.07Å; L147-M149 PolarHBondContact O-N 2.99Å; M149-R151 HydrophobicContact CB-CG 4.28Å; M149-R151 PolarHBondContact O-N 2.9Å
150	G	90.4	Very high	91.7	Very high	75 Å²	75	88.1 Å²	88.1	77%	0.773	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	24.7	-176.6	0	0	0	0	0	113.8	A146 L147	A146-G150 PolarHBondContact O-N 3.38Å; L147-G150 PolarHBondContact O-N 2.87Å; L147-G150 VanDerWaalsContact O-N 3.12Å
151	R	86.8	Confident	91.7	Very high	163 Å²	163	90.5 Å²	90.5	62%	0.615	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-103.1	150.2	176.9	-63.6	-178.3	-178.5	177.3	-0.6	110.5	A146 M149	A146-R151 CarbonylContact C-O 3.35Å; A146-R151 HydrophobicContact CB-CB 4.48Å; A146-R151 PolarHBondContact O-N 3.43Å; M149-R151 HydrophobicContact CB-CG 4.28Å; M149-R151 PolarHBondContact O-N 2.9Å
152	D	83.8	Confident	91.7	Very high	150 Å²	150	86.1 Å²	86.1	80%	0.802	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-63.7	129	172.5	-70.9	-34.2	0	0	0	110.1	G154	D152-G154 PolarHBondContact O-N 2.71Å
153	P	86.9	Confident	91.8	Very high	51 Å²	51	84.5 Å²	84.5	33%	0.331	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-71.1	119.5	179.6	27.5	-32.7	0	0	0	110.4	R143 A146 L147	R143-P153 HydrophobicContact CB-CB 4.43Å; R143-P153 HydrophobicContact CG-CB 3.81Å; R143-P153 HydrophobicContact CG-CG 4.44Å; A146-P153 HydrophobicContact CB-CB 4.31Å; L147-P153 HydrophobicContact CD2-CG 4.26Å
154	G	87.1	Confident	91.9	Very high	34 Å²	34	83.3 Å²	83.3	35%	0.351	43%	0.429	S	S	.	.			trans	-125.6	168.7	175.3	0	0	0	0	0	112.6	D152 I206	D152-G154 PolarHBondContact O-N 2.71Å; G154-I206 WeakPolarHBondContact CA-O 3.31Å
155	Y	92.8	Very high	92	Very high	18 Å²	18	82.4 Å²	82.4	7%	0.071	43%	0.427	C	S	.	.			trans	-78.9	136.6	164.4	179.8	-120.7	0	0	0	109.4	Y130 C132 C134 L139 N157 C159 R180 G207 D208	Y130-Y155 HydrophobicContact CE2-CE1 4.4Å; Y130-Y155 WeakPolarHBondContact OH-CE1 3.49Å; C132-Y155 PolarHBondContact SG-OH 3.46Å; C132-Y155 VanDerWaalsContact SG-OH 3.38Å; C134-Y155 HydrophobicContact CB-CE2 4.35Å; C134-Y155 PolarHBondContact SG-OH 2.83Å; C134-Y155 VanDerWaalsContact SG-OH 3.37Å; L139-Y155 HydrophobicContact CD2-CD2 3.61Å; L139-Y155 HydrophobicContact CD2-CE2 3.87Å; Y155-N157 PolarHBondContact O-N 2.61Å; Y155-C159 WeakPolarHBondContact OH-CB 3.21Å; Y155-C159 PolarHBondContact OH-N 2.74Å; Y155-R180 VanDerWaalsContact CD1-CD 3.46Å; Y155-G207 WeakPolarHBondContact O-CA 3.43Å; Y155-D208 HydrophobicContact CD1-CB 4.29Å
156	D	90.8	Very high	92.1	Very high	69 Å²	69	83.2 Å²	83.2	37%	0.369	43%	0.43	S	S	.	.			trans	-86.5	15.1	-174.6	60.2	-11.6	0	0	0	113.9	R138 M158	R138-D156 IonicContact CZ-OD1 3.78Å; R138-D156 IonicContact CZ-OD2 2.98Å; R138-D156 IonicContact NH1-OD1 2.89Å; R138-D156 PolarHBondContact NH1-OD1 3.08Å; R138-D156 IonicContact NH1-OD2 3.95Å; R138-D156 PolarHBondContact NH1-OD2 2.79Å; R138-D156 IonicContact NH2-OD1 3.78Å; R138-D156 PolarHBondContact NH2-OD1 3.2Å; R138-D156 IonicContact NH2-OD2 2.71Å; R138-D156 PolarHBondContact NH2-OD2 3.08Å; D156-M158 PolarHBondContact O-N 3.29Å
157	N	93.6	Very high	92.4	Very high	19 Å²	19	83.9 Å²	83.9	10%	0.102	43%	0.431	C	S	.	.			trans	53.7	22.3	179.8	-57.2	-24.8	0	0	0	114.4	Y155 C159 R160 D204 D208	Y155-N157 PolarHBondContact O-N 2.61Å; N157-C159 VanDerWaalsContact C-N 3.25Å; N157-C159 PolarHBondContact O-N 3.01Å; N157-C159 VanDerWaalsContact O-N 3.09Å; N157-R160 HydrophobicContact CB-CB 4.16Å; N157-R160 WeakPolarHBondContact O-CB 3.3Å; N157-R160 PolarHBondContact O-N 3.36Å; N157-D204 PolarHBondContact ND2-O 2.75Å; N157-D208 WeakPolarHBondContact OD1-CB 3.45Å; N157-D208 VanDerWaalsContact OD1-CG 3.26Å; N157-D208 PolarHBondContact OD1-N 3.07Å; N157-D208 PolarHBondContact OD1-OD2 3.39Å
158	M	93.5	Very high	92.5	Very high	110 Å²	110	80.8 Å²	80.8	54%	0.542	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-50.4	-42.1	-173.6	178.7	71.2	-164.8	0	0	113.6	R138 D156 R160	R138-M158 VanDerWaalsContact NH2-CB 3.34Å; D156-M158 PolarHBondContact O-N 3.29Å; M158-R160 VanDerWaalsContact C-N 3.32Å
159	C	95.9	Very high	92.7	Very high	10 Å²	10	74 Å²	74	7%	0.068	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-85.9	-0.3	-176.8	-65.5	0	0	0	0	114.1	Y130 R131 C132 F133 Y155 N157 H161 L162	Y130-C159 HydrophobicContact CD2-CB 4.15Å; Y130-C159 WeakPolarHBondContact CD2-O 3.25Å; Y130-C159 HydrophobicContact CE2-CB 3.96Å; R131-C159 WeakPolarHBondContact O-CB 3.42Å; C132-C159 HydrophobicContact CB-CB 4.21Å; F133-C159 PolarHBondContact N-SG 2.91Å; F133-C159 VanDerWaalsContact N-SG 3.4Å; Y155-C159 WeakPolarHBondContact OH-CB 3.21Å; Y155-C159 PolarHBondContact OH-N 2.74Å; N157-C159 VanDerWaalsContact C-N 3.25Å; N157-C159 PolarHBondContact O-N 3.01Å; N157-C159 VanDerWaalsContact O-N 3.09Å; C159-H161 PolarHBondContact O-N 3.25Å; C159-L162 HydrophobicContact CB-CD1 3.8Å; C159-L162 HydrophobicContact CB-CG 4.29Å
160	R	94.1	Very high	92.9	Very high	48 Å²	48	72.2 Å²	72.2	18%	0.181	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-65.4	-25.8	-176.5	-172.4	175.4	178.9	159.9	1.2	113	Y130 N157 M158 K182 Q183 D204 D208	Y130-R160 HydrophobicContact CD1-CG 4.49Å; Y130-R160 HydrophobicContact CE1-CB 4.16Å; Y130-R160 HydrophobicContact CE1-CG 4.11Å; Y130-R160 HydrophobicContact CE2-CB 4.09Å; N157-R160 HydrophobicContact CB-CB 4.16Å; N157-R160 WeakPolarHBondContact O-CB 3.3Å; N157-R160 PolarHBondContact O-N 3.36Å; M158-R160 VanDerWaalsContact C-N 3.32Å; R160-K182 HydrophobicContact CG-CG 4.46Å; R160-Q183 PolarHBondContact NH2-O 2.86Å; R160-D204 IonicContact NH1-OD1 3.29Å; R160-D204 IonicContact NH1-OD2 3.02Å; R160-D208 IonicContact NH1-OD1 3.81Å; R160-D208 IonicContact NH1-OD2 2.82Å
161	H	92.8	Very high	93.1	Very high	156 Å²	156	72 Å²	72	72%	0.722	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-116.6	15.7	-173.2	-54.6	-67.9	0	0	0	113.7	C159 S163	C159-H161 PolarHBondContact O-N 3.25Å; H161-S163 PolarHBondContact O-N 3.15Å
162	L	95.2	Very high	93.6	Very high	30 Å²	30	72.9 Å²	72.9	16%	0.157	38%	0.378	C	S	.	.			trans	-61.4	138.4	176	-69	174.6	0	0	0	110.6	F133 C159 E166 I167 K170	F133-L162 HydrophobicContact CD2-CD1 3.75Å; F133-L162 HydrophobicContact CE2-CD1 4.15Å; C159-L162 HydrophobicContact CB-CD1 3.8Å; C159-L162 HydrophobicContact CB-CG 4.29Å; L162-E166 VanDerWaalsContact CA-OE2 3.28Å; L162-E166 WeakPolarHBondContact CA-OE2 3.3Å; L162-E166 HydrophobicContact CB-CB 4.38Å; L162-E166 HydrophobicContact CD2-CB 4.27Å; L162-E166 WeakPolarHBondContact CD2-OE2 3.5Å; L162-I167 HydrophobicContact CB-CD1 4.25Å; L162-I167 HydrophobicContact CB-CG1 3.86Å; L162-I167 HydrophobicContact CD1-CG1 4.46Å; L162-K170 HydrophobicContact CD1-CD 4.34Å
163	S	95.4	Very high	94.1	Very high	45 Å²	45	69.6 Å²	69.6	32%	0.315	37%	0.366	S	S	.	.			trans	-70.6	160.3	174.9	96.5	0	0	0	0	111.4	H161 E165 E166 I167	H161-S163 PolarHBondContact O-N 3.15Å; S163-E165 VanDerWaalsContact CB-OE2 3.3Å; S163-E165 WeakPolarHBondContact CB-OE2 3.32Å; S163-E165 PolarHBondContact O-N 3.18Å; S163-E165 PolarHBondContact OG-N 2.99Å; S163-E165 PolarHBondContact OG-OE2 2.92Å; S163-E166 PolarHBondContact N-OE2 3.06Å; S163-E166 PolarHBondContact O-N 2.64Å; S163-E166 PolarHBondContact OG-N 3.48Å; S163-I167 WeakPolarHBondContact O-CG1 3.46Å; S163-I167 PolarHBondContact O-N 3.01Å
164	N	93.5	Very high	94.4	Very high	128 Å²	128	78 Å²	78	68%	0.684	39%	0.391	S	S	*	.	H	α-helix	trans	-59.8	-33.9	175.6	-74	-28	0	0	0	111.7	A168	N164-A168 VanDerWaalsContact O-CB 3.23Å; N164-A168 WeakPolarHBondContact O-CB 3.19Å; N164-A168 PolarHBondContact O-N 3.16Å
165	E	96.3	Very high	94.8	Very high	133 Å²	133	79.6 Å²	79.6	62%	0.621	39%	0.39	S	S	*	.	H	α-helix	trans	-67.7	-43.4	176.5	-59.2	68.5	-146.9	0	0	111.5	S163 A168 S169	S163-E165 VanDerWaalsContact CB-OE2 3.3Å; S163-E165 WeakPolarHBondContact CB-OE2 3.32Å; S163-E165 PolarHBondContact O-N 3.18Å; S163-E165 PolarHBondContact OG-N 2.99Å; S163-E165 PolarHBondContact OG-OE2 2.92Å; E165-A168 PolarHBondContact O-N 3.41Å; E165-S169 VanDerWaalsContact O-CB 3.3Å; E165-S169 WeakPolarHBondContact O-CB 3.4Å; E165-S169 PolarHBondContact O-N 3.38Å
166	E	96.5	Very high	94.9	Very high	91 Å²	91	83.2 Å²	83.2	43%	0.425	42%	0.416	S	S	.	.	H	α-helix	trans	-63.4	-44.6	175.4	-67.6	-179.1	115.5	0	0	111.4	L162 S163 S169 K170	L162-E166 VanDerWaalsContact CA-OE2 3.28Å; L162-E166 WeakPolarHBondContact CA-OE2 3.3Å; L162-E166 HydrophobicContact CB-CB 4.38Å; L162-E166 HydrophobicContact CD2-CB 4.27Å; L162-E166 WeakPolarHBondContact CD2-OE2 3.5Å; S163-E166 PolarHBondContact N-OE2 3.06Å; S163-E166 PolarHBondContact O-N 2.64Å; S163-E166 PolarHBondContact OG-N 3.48Å; E166-S169 PolarHBondContact O-N 3.45Å; E166-K170 VanDerWaalsContact O-CG 3.25Å; E166-K170 WeakPolarHBondContact O-CG 3.42Å; E166-K170 PolarHBondContact O-N 3.33Å
167	I	95.6	Very high	95.2	Very high	31 Å²	31	83.1 Å²	83.1	16%	0.159	41%	0.412	C	S	.	.	H	α-helix	trans	-61.2	-49.3	176.2	-66	167.7	0	0	0	109.9	F133 L162 S163 S169 K170 L171	F133-I167 HydrophobicContact CE2-CG1 4.4Å; F133-I167 HydrophobicContact CE2-CG2 4.46Å; F133-I167 HydrophobicContact CZ-CG2 4.36Å; L162-I167 HydrophobicContact CB-CD1 4.25Å; L162-I167 HydrophobicContact CB-CG1 3.86Å; L162-I167 HydrophobicContact CD1-CG1 4.46Å; S163-I167 WeakPolarHBondContact O-CG1 3.46Å; S163-I167 PolarHBondContact O-N 3.01Å; I167-S169 VanDerWaalsContact C-N 3.31Å; I167-S169 PolarHBondContact O-N 3.29Å; I167-K170 PolarHBondContact O-N 3.15Å; I167-L171 HydrophobicContact CG2-CD1 3.87Å; I167-L171 HydrophobicContact CG2-CG 4.33Å; I167-L171 WeakPolarHBondContact O-CB 3.35Å; I167-L171 VanDerWaalsContact O-CG 3.3Å; I167-L171 WeakPolarHBondContact O-CG 3.11Å; I167-L171 PolarHBondContact O-N 3.15Å
168	A	96	Very high	95.4	Very high	35 Å²	35	82.7 Å²	82.7	29%	0.289	41%	0.411	S	S	.	.	H	α-helix	trans	-61.2	-39.7	179.3	0	0	0	0	0	112	N164 E165 L171 R172	N164-A168 VanDerWaalsContact O-CB 3.23Å; N164-A168 WeakPolarHBondContact O-CB 3.19Å; N164-A168 PolarHBondContact O-N 3.16Å; E165-A168 PolarHBondContact O-N 3.41Å; A168-L171 PolarHBondContact O-N 3.45Å; A168-R172 WeakPolarHBondContact O-CG 3.35Å; A168-R172 PolarHBondContact O-N 3.15Å
169	S	97	Very high	95.6	Very high	62 Å²	62	78 Å²	78	43%	0.434	39%	0.388	S	S	.	.	H	α-helix	trans	-61.1	-48	174.9	-171.8	0	0	0	0	112.1	E165 E166 I167 L171 R172 S173	E165-S169 VanDerWaalsContact O-CB 3.3Å; E165-S169 WeakPolarHBondContact O-CB 3.4Å; E165-S169 PolarHBondContact O-N 3.38Å; E166-S169 PolarHBondContact O-N 3.45Å; I167-S169 VanDerWaalsContact C-N 3.31Å; I167-S169 PolarHBondContact O-N 3.29Å; S169-L171 VanDerWaalsContact C-N 3.34Å; S169-L171 PolarHBondContact O-N 3.39Å; S169-R172 PolarHBondContact O-N 3.01Å; S169-S173 PolarHBondContact O-N 2.99Å; S169-S173 PolarHBondContact O-OG 3.45Å
170	K	96.6	Very high	95.7	Very high	58 Å²	58	78.2 Å²	78.2	25%	0.252	39%	0.387	S	S	.	.	H	α-helix	trans	-66.3	-34	178.6	-67.2	176.2	-171.8	-59.2	0	113.1	F133 L162 E166 I167 S173 R174 Q175	F133-K170 HydrophobicContact CB-CD 3.88Å; F133-K170 HydrophobicContact CD1-CB 3.74Å; F133-K170 HydrophobicContact CD1-CD 4Å; F133-K170 HydrophobicContact CD1-CG 4.42Å; F133-K170 HydrophobicContact CD2-CB 4.37Å; F133-K170 HydrophobicContact CD2-CD 3.47Å; F133-K170 VanDerWaalsContact CD2-CD 3.47Å; F133-K170 HydrophobicContact CE1-CB 3.53Å; F133-K170 HydrophobicContact CE1-CD 4.38Å; F133-K170 HydrophobicContact CE2-CB 4.18Å; F133-K170 HydrophobicContact CE2-CD 3.9Å; F133-K170 HydrophobicContact CG-CB 4.15Å; F133-K170 HydrophobicContact CG-CD 3.52Å; F133-K170 HydrophobicContact CG-CG 4.41Å; F133-K170 HydrophobicContact CZ-CB 3.76Å; F133-K170 HydrophobicContact CZ-CD 4.34Å; L162-K170 HydrophobicContact CD1-CD 4.34Å; E166-K170 VanDerWaalsContact O-CG 3.25Å; E166-K170 WeakPolarHBondContact O-CG 3.42Å; E166-K170 PolarHBondContact O-N 3.33Å; I167-K170 PolarHBondContact O-N 3.15Å; K170-S173 WeakPolarHBondContact CA-OG 3.4Å; K170-S173 PolarHBondContact O-OG 2.77Å; K170-R174 PolarHBondContact O-N 2.83Å; K170-Q175 HydrophobicContact CB-CB 4.39Å; K170-Q175 WeakPolarHBondContact O-CB 3.47Å; K170-Q175 PolarHBondContact O-N 3.16Å
171	L	95.5	Very high	95.8	Very high	71 Å²	71	76.1 Å²	76.1	37%	0.372	38%	0.38	S	S	.	.	H	α-helix	trans	-69.2	-41.5	173.4	-70.2	174.4	0	0	0	111.7	F133 I167 A168 S169 S173 R174 F177	F133-L171 HydrophobicContact CE1-CD2 4.29Å; F133-L171 HydrophobicContact CZ-CD2 4.24Å; F133-L171 HydrophobicContact CZ-CG 4.29Å; I167-L171 HydrophobicContact CG2-CD1 3.87Å; I167-L171 HydrophobicContact CG2-CG 4.33Å; I167-L171 WeakPolarHBondContact O-CB 3.35Å; I167-L171 VanDerWaalsContact O-CG 3.3Å; I167-L171 WeakPolarHBondContact O-CG 3.11Å; I167-L171 PolarHBondContact O-N 3.15Å; A168-L171 PolarHBondContact O-N 3.45Å; S169-L171 VanDerWaalsContact C-N 3.34Å; S169-L171 PolarHBondContact O-N 3.39Å; L171-S173 VanDerWaalsContact C-N 3.3Å; L171-S173 PolarHBondContact O-N 3.13Å; L171-R174 PolarHBondContact O-N 3.41Å; L171-F177 HydrophobicContact CD2-CD1 3.95Å; L171-F177 HydrophobicContact CD2-CE1 3.68Å
172	R	96.3	Very high	95.9	Very high	182 Å²	182	71 Å²	71	69%	0.687	36%	0.355	S	S	*	.	H	α-helix	trans	-61	-37.5	174.8	-77.2	-171.5	-60.3	-95.9	2.2	112.4	A168 S169 R174	A168-R172 WeakPolarHBondContact O-CG 3.35Å; A168-R172 PolarHBondContact O-N 3.15Å; S169-R172 PolarHBondContact O-N 3.01Å; R172-R174 PolarHBondContact O-N 3.11Å
173	S	95.1	Very high	95.8	Very high	80 Å²	80	70 Å²	70	56%	0.559	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	5.1	175.2	66.1	0	0	0	0	114.1	S169 K170 L171 Q175	S169-S173 PolarHBondContact O-N 2.99Å; S169-S173 PolarHBondContact O-OG 3.45Å; K170-S173 WeakPolarHBondContact CA-OG 3.4Å; K170-S173 PolarHBondContact O-OG 2.77Å; L171-S173 VanDerWaalsContact C-N 3.3Å; L171-S173 PolarHBondContact O-N 3.13Å; S173-Q175 PolarHBondContact O-N 2.92Å
174	R	93.9	Very high	95.5	Very high	228 Å²	228	72.2 Å²	72.2	86%	0.86	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	32	-177.3	-57.7	-176.5	177	-177.2	-1.3	112.9	K170 L171 R172 P176	K170-R174 PolarHBondContact O-N 2.83Å; L171-R174 PolarHBondContact O-N 3.41Å; R172-R174 PolarHBondContact O-N 3.11Å; R174-P176 WeakPolarHBondContact O-CD 3.12Å
175	Q	94.6	Very high	95.4	Very high	68 Å²	68	69.4 Å²	69.4	32%	0.318	34%	0.344	S	S	.	.			trans	-66.1	126.3	177.4	-172.4	172.6	-0.3	0	0	109.7	F133 K170 S173	F133-Q175 HydrophobicContact CB-CG 4.44Å; F133-Q175 HydrophobicContact CD1-CB 4.08Å; F133-Q175 HydrophobicContact CD1-CG 4.04Å; F133-Q175 PolarHBondContact O-NE2 2.78Å; K170-Q175 HydrophobicContact CB-CB 4.39Å; K170-Q175 WeakPolarHBondContact O-CB 3.47Å; K170-Q175 PolarHBondContact O-N 3.16Å; S173-Q175 PolarHBondContact O-N 2.92Å
176	P	95.1	Very high	95.2	Very high	94 Å²	94	66.6 Å²	66.6	61%	0.61	33%	0.331	S	S	*	.			trans	-58.5	143.3	175.7	-23.2	32.9	0	0	0	111.4	R174	R174-P176 WeakPolarHBondContact O-CD 3.12Å
177	F	97	Very high	95	Very high	67 Å²	67	67.9 Å²	67.9	29%	0.294	34%	0.339	S	S	.	.			trans	-140.6	150.5	177.7	67.3	-90.1	0	0	0	111.4	R131 C132 F133 L171 L179 S214	R131-F177 HydrophobicContact CB-CB 4.42Å; R131-F177 HydrophobicContact CB-CD2 3.98Å; R131-F177 HydrophobicContact CB-CG 4.29Å; R131-F177 HydrophobicContact CG-CD2 3.7Å; R131-F177 HydrophobicContact CG-CE2 3.86Å; R131-F177 HydrophobicContact CG-CG 4.31Å; C132-F177 CarbonylContact O-C 3.5Å; C132-F177 VanDerWaalsContact O-CA 3.22Å; C132-F177 WeakPolarHBondContact O-CA 3.17Å; C132-F177 WeakPolarHBondContact O-CB 3.46Å; F133-F177 HydrophobicContact CD1-CB 3.63Å; F133-F177 HydrophobicContact CE1-CB 3.66Å; F133-F177 HydrophobicContact CE1-CD1 4.01Å; F133-F177 HydrophobicContact CE1-CG 4.11Å; F133-F177 HydrophobicContact CG-CB 4.16Å; F133-F177 HydrophobicContact CZ-CB 4.21Å; F133-F177 HydrophobicContact CZ-CG 4.48Å; L171-F177 HydrophobicContact CD2-CD1 3.95Å; L171-F177 HydrophobicContact CD2-CE1 3.68Å; F177-L179 HydrophobicContact CD2-CD2 3.9Å; F177-L179 HydrophobicContact CE2-CD2 3.7Å; F177-L179 HydrophobicContact CE2-CG 4.29Å; F177-S214 VanDerWaalsContact O-CA 3.27Å; F177-S214 WeakPolarHBondContact O-CA 3.41Å
178	A	97.4	Very high	95	Very high	10 Å²	10	67 Å²	67	8%	0.083	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	162.5	164.9	0	0	0	0	0	109.9	C132 I210 I212	C132-A178 PolarHBondContact N-O 3.19Å; C132-A178 PolarHBondContact O-N 3.08Å; A178-I210 HydrophobicContact CB-CD1 4.38Å; A178-I210 HydrophobicContact CB-CG2 4.02Å; A178-I212 CarbonylContact C-O 3.35Å; A178-I212 WeakPolarHBondContact CA-O 3.23Å; A178-I212 VanDerWaalsContact CB-O 3.29Å; A178-I212 WeakPolarHBondContact CB-O 3.46Å
179	L	98	Very high	94.9	Very high	11 Å²	11	69 Å²	69	6%	0.058	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130	168.6	-58.6	-177.6	0	0	0	109.9	A120 L124 Y130 R131 F177 L211 I212	A120-L179 HydrophobicContact CB-CD1 3.75Å; L124-L179 HydrophobicContact CD1-CD1 3.9Å; L124-L179 HydrophobicContact CD1-CD2 4.06Å; L124-L179 HydrophobicContact CD2-CD2 4Å; L124-L179 HydrophobicContact CG-CD1 4.33Å; L124-L179 HydrophobicContact CG-CD2 4.35Å; Y130-L179 WeakPolarHBondContact O-CA 3.38Å; R131-L179 HydrophobicContact CB-CD2 4.47Å; R131-L179 HydrophobicContact CG-CD2 3.74Å; F177-L179 HydrophobicContact CD2-CD2 3.9Å; F177-L179 HydrophobicContact CE2-CD2 3.7Å; F177-L179 HydrophobicContact CE2-CG 4.29Å; L179-L211 PolarHBondContact O-N 3.46Å; L179-I212 HydrophobicContact CB-CB 3.99Å; L179-I212 HydrophobicContact CB-CG1 4.38Å; L179-I212 HydrophobicContact CD1-CB 4.15Å; L179-I212 HydrophobicContact CD1-CG1 4.03Å; L179-I212 HydrophobicContact CG-CB 4.13Å; L179-I212 PolarHBondContact N-O 2.97Å; L179-I212 PolarHBondContact O-N 2.74Å
180	R	97.8	Very high	94.9	Very high	15 Å²	15	66.9 Å²	66.9	6%	0.057	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.1	178.3	-68.9	-177.7	179.4	-87.6	-0.7	111.4	V129 Y130 C132 Y155 K182 D208 P209 I210	V129-R180 CarbonylContact C-O 3.53Å; V129-R180 WeakPolarHBondContact CA-O 3.44Å; V129-R180 VanDerWaalsContact CB-O 3.24Å; V129-R180 WeakPolarHBondContact CB-O 3.22Å; Y130-R180 HydrophobicContact CE1-CB 3.98Å; Y130-R180 HydrophobicContact CE2-CB 4.2Å; Y130-R180 PolarHBondContact N-O 2.9Å; Y130-R180 PolarHBondContact O-N 2.91Å; C132-R180 HydrophobicContact CB-CG 3.97Å; C132-R180 PolarHBondContact SG-NE 2.89Å; Y155-R180 VanDerWaalsContact CD1-CD 3.46Å; R180-K182 PolarHBondContact O-N 3.46Å; R180-D208 HydrophobicContact CB-CB 4.12Å; R180-D208 WeakPolarHBondContact CD-O 3.46Å; R180-D208 PolarHBondContact NH1-O 3.1Å; R180-P209 CarbonylContact C-O 3.58Å; R180-P209 WeakPolarHBondContact CA-O 3.3Å; R180-I210 HydrophobicContact CG-CG1 4.16Å
181	L	96.6	Very high	94.9	Very high	4 Å²	4	70.1 Å²	70.1	2%	0.021	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	122.6	171.7	-179.2	59	0	0	0	109.3	V129 Q183 D208 P209 L211 I248 Q251 L252	V129-L181 HydrophobicContact CG1-CD1 4.47Å; L181-Q183 VanDerWaalsContact C-N 3.35Å; L181-Q183 HydrophobicContact CD2-CG 4.16Å; L181-Q183 HydrophobicContact CG-CG 4.15Å; L181-Q183 PolarHBondContact O-N 3.49Å; L181-D208 WeakPolarHBondContact O-CB 3.24Å; L181-P209 HydrophobicContact CB-CG 4.01Å; L181-P209 HydrophobicContact CD2-CG 4.35Å; L181-P209 PolarHBondContact N-O 3.29Å; L181-L211 HydrophobicContact CB-CD1 3.83Å; L181-L211 HydrophobicContact CB-CD2 4.16Å; L181-L211 HydrophobicContact CB-CG 3.96Å; L181-L211 HydrophobicContact CD1-CD1 4.29Å; L181-I248 HydrophobicContact CD2-CG2 4.11Å; L181-Q251 HydrophobicContact CD2-CB 4.26Å; L181-L252 HydrophobicContact CD1-CD2 3.86Å; L181-L252 HydrophobicContact CD2-CD2 4.18Å; L181-L252 HydrophobicContact CD2-CG 4.13Å
182	K	95	Very high	95	Very high	48 Å²	48	66.9 Å²	66.9	21%	0.209	33%	0.325	C	S	.	.			trans	-74.5	90.5	171.4	-172.3	179.2	-92.8	171.6	0	107.9	D127 K128 Y130 R160 R180	D127-K182 IonicContact OD1-NZ 3.82Å; D127-K182 PolarHBondContact OD1-NZ 3.41Å; D127-K182 IonicContact OD2-NZ 3.5Å; D127-K182 PolarHBondContact OD2-NZ 2.97Å; K128-K182 WeakPolarHBondContact O-CB 3.43Å; K128-K182 PolarHBondContact O-N 2.81Å; Y130-K182 HydrophobicContact CD1-CB 4.08Å; Y130-K182 HydrophobicContact CE1-CB 4.24Å; R160-K182 HydrophobicContact CG-CG 4.46Å; R180-K182 PolarHBondContact O-N 3.46Å
183	Q	92.2	Very high	95.1	Very high	8 Å²	8	60.6 Å²	60.6	4%	0.037	31%	0.307	C	S	.	.			trans	-68.1	147.8	-175.5	-63.3	-168.3	-74.9	0	0	110.9	R160 L181 V202 G207 D208 P209	R160-Q183 PolarHBondContact NH2-O 2.86Å; L181-Q183 VanDerWaalsContact C-N 3.35Å; L181-Q183 HydrophobicContact CD2-CG 4.16Å; L181-Q183 HydrophobicContact CG-CG 4.15Å; L181-Q183 PolarHBondContact O-N 3.49Å; Q183-V202 HydrophobicContact CB-CG1 4.09Å; Q183-V202 HydrophobicContact CG-CG1 4.5Å; Q183-G207 PolarHBondContact OE1-O 3.32Å; Q183-D208 WeakPolarHBondContact CB-OD1 3.5Å; Q183-D208 PolarHBondContact N-OD1 3.42Å; Q183-P209 HydrophobicContact CG-CG 4.41Å; Q183-P209 VanDerWaalsContact OE1-CD 3.3Å
184	K	89.4	Confident	95.1	Very high	93 Å²	93	57 Å²	57	40%	0.404	28%	0.282	S	S	.	.			trans	-95	126.1	168.2	-64.4	-179.1	-175.5	176.2	0	108.7	Q186 Q251 E254	K184-Q186 PolarHBondContact O-N 3.37Å; K184-Q186 VanDerWaalsContact O-N 3.13Å; K184-Q251 VanDerWaalsContact N-OE1 3.08Å; K184-Q251 PolarHBondContact O-NE2 3.31Å; K184-Q251 VanDerWaalsContact O-NE2 3.1Å; K184-E254 IonicContact NZ-OE1 3.77Å; K184-E254 PolarHBondContact NZ-OE1 2.77Å
185	S	90.7	Very high	95.1	Very high	69 Å²	69	48 Å²	48	48%	0.483	25%	0.248	S	C	.	.			trans	-64.9	109.2	168.2	-78.9	0	0	0	0	109.9	V202 D204	S185-V202 CarbonylContact C-O 3.58Å; S185-V202 VanDerWaalsContact CA-O 3.26Å; S185-V202 WeakPolarHBondContact CA-O 3.22Å; S185-D204 PolarHBondContact OG-N 2.81Å; S185-D204 PolarHBondContact OG-OD1 2.83Å; S185-D204 PolarHBondContact OG-OD2 2.98Å
186	Q	92.1	Very high	95.2	Very high	74 Å²	74	45.4 Å²	45.4	35%	0.346	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	160.6	-179.3	66.5	-174.1	-1.8	0	0	111.4	K184 V188 V202	K184-Q186 PolarHBondContact O-N 3.37Å; K184-Q186 VanDerWaalsContact O-N 3.13Å; Q186-V188 HydrophobicContact CG-CG2 3.77Å; Q186-V188 PolarHBondContact O-N 3.03Å; Q186-V202 PolarHBondContact N-O 3.37Å; Q186-V202 PolarHBondContact O-N 3.41Å
187	M	93.7	Very high	95.2	Very high	118 Å²	118	44.3 Å²	44.3	58%	0.581	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	109.1	166	-169.6	65.7	70.4	0	0	108.9	F200 P201	M187-F200 VanDerWaalsContact SD-C 3.52Å; M187-P201 HydrophobicContact CE-CB 4.17Å; M187-P201 HydrophobicContact SD-CB 4.25Å
188	V	94.6	Very high	95	Very high	12 Å²	12	43.5 Å²	43.5	7%	0.073	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	116.2	177	-178.3	0	0	0	0	108.5	Q186 S199 F200 V202 P247 L250	Q186-V188 HydrophobicContact CG-CG2 3.77Å; Q186-V188 PolarHBondContact O-N 3.03Å; V188-S199 WeakPolarHBondContact O-CA 3.28Å; V188-F200 PolarHBondContact N-O 3.02Å; V188-F200 PolarHBondContact O-N 2.69Å; V188-V202 HydrophobicContact CG2-CB 4.49Å; V188-V202 HydrophobicContact CG2-CG2 3.75Å; V188-P247 HydrophobicContact CB-CB 4.07Å; V188-P247 HydrophobicContact CG1-CB 4.17Å; V188-P247 HydrophobicContact CG2-CB 4.32Å; V188-L250 HydrophobicContact CG1-CB 4.24Å; V188-L250 HydrophobicContact CG1-CD1 3.69Å
189	T	95.4	Very high	94.8	Very high	76 Å²	76	46.3 Å²	46.3	47%	0.466	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.7	177	-56.6	0	0	0	0	110.4	H198 S199	T189-H198 CarbonylContact C-O 3.56Å; T189-H198 VanDerWaalsContact CA-O 3.26Å; T189-H198 WeakPolarHBondContact CA-O 3.27Å; T189-S199 WeakPolarHBondContact CG2-OG 3.12Å; T189-S199 PolarHBondContact OG1-OG 2.88Å
190	F	96.2	Very high	94.4	Very high	18 Å²	18	48 Å²	48	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.7	174.5	69.8	-83.9	0	0	0	111.8	D192 H198 F200 L243 T246 L250	F190-D192 HydrophobicContact CD2-CB 4.5Å; F190-D192 HydrophobicContact CE2-CB 4.04Å; F190-H198 HydrophobicContact CD1-CB 4.48Å; F190-H198 HydrophobicContact CE1-CB 4.03Å; F190-H198 HydrophobicContact CZ-CB 4.09Å; F190-H198 PolarHBondContact N-O 3.44Å; F190-H198 PolarHBondContact O-N 3.48Å; F190-F200 AromaticContact CE1-CD2 3.76Å; F190-F200 HydrophobicContact CE1-CD2 3.76Å; F190-F200 AromaticContact CE1-CE2 3.64Å; F190-F200 HydrophobicContact CE1-CE2 3.64Å; F190-F200 HydrophobicContact CZ-CE2 4.05Å; F190-L243 HydrophobicContact CE2-CD1 4.03Å; F190-L243 HydrophobicContact CZ-CD1 3.65Å; F190-L243 HydrophobicContact CZ-CG 4.39Å; F190-T246 HydrophobicContact CD1-CG2 4.18Å; F190-T246 HydrophobicContact CD2-CG2 4.07Å; F190-T246 HydrophobicContact CE1-CG2 3.92Å; F190-T246 HydrophobicContact CE2-CG2 3.82Å; F190-T246 HydrophobicContact CG-CG2 4.24Å; F190-T246 HydrophobicContact CZ-CG2 3.74Å; F190-L250 HydrophobicContact CB-CD1 3.67Å; F190-L250 HydrophobicContact CD1-CD1 3.9Å; F190-L250 HydrophobicContact CG-CD1 3.95Å
191	E	97	Very high	94.1	Very high	126 Å²	126	50.5 Å²	50.5	59%	0.589	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	116	174.5	-65.6	-59.2	143.2	0	0	109.9	S197	E191-S197 WeakPolarHBondContact OE1-CB 3.43Å; E191-S197 PolarHBondContact OE1-OG 2.92Å; E191-S197 WeakPolarHBondContact OE2-CA 3.4Å; E191-S197 PolarHBondContact OE2-N 3.34Å; E191-S197 VanDerWaalsContact OE2-N 3.13Å
192	D	97.6	Very high	93.6	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	135	168.6	-170.9	-93.4	0	0	0	110.3	F190 V194 Y195 G196 A264 H265	F190-D192 HydrophobicContact CD2-CB 4.5Å; F190-D192 HydrophobicContact CE2-CB 4.04Å; D192-V194 PolarHBondContact O-N 3.17Å; D192-V194 WeakPolarHBondContact OD1-CA 3.21Å; D192-V194 WeakPolarHBondContact OD1-CB 3.3Å; D192-V194 PolarHBondContact OD1-N 2.91Å; D192-Y195 PolarHBondContact OD1-N 3.44Å; D192-G196 PolarHBondContact N-O 3.35Å; D192-G196 WeakPolarHBondContact O-CA 3.5Å; D192-G196 PolarHBondContact O-N 3.02Å; D192-A264 WeakPolarHBondContact OD2-CA 3.43Å; D192-H265 PolarHBondContact OD1-N 3.32Å; D192-H265 IonicContact OD2-CE1 2.7Å; D192-H265 IonicContact OD2-CG 2.77Å; D192-H265 PolarHBondContact OD2-N 3.39Å; D192-H265 IonicContact OD2-ND1 3.27Å; D192-H265 PolarHBondContact OD2-ND1 2.98Å
193	V	96.9	Very high	93	Very high	49 Å²	49	54.5 Å²	54.5	30%	0.297	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-33.4	-178.8	179.3	0	0	0	0	112.3	V262 F263 A264 L331 K332	V193-V262 HydrophobicContact CG2-CG1 3.4Å; V193-F263 WeakPolarHBondContact CG2-O 3.42Å; V193-F263 PolarHBondContact N-O 3.15Å; V193-A264 HydrophobicContact CB-CB 3.96Å; V193-A264 HydrophobicContact CG2-CB 4.38Å; V193-L331 HydrophobicContact CB-CD2 4.37Å; V193-L331 HydrophobicContact CB-CG 4.44Å; V193-L331 HydrophobicContact CG1-CB 4.43Å; V193-L331 HydrophobicContact CG1-CD2 4Å; V193-L331 HydrophobicContact CG1-CG 3.78Å; V193-K332 HydrophobicContact CG1-CG 4.23Å
194	V	96	Very high	92.2	Very high	6 Å²	6	57.1 Å²	57.1	4%	0.036	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-50.6	-177.4	178.4	0	0	0	0	110.5	D192 A264 H265 V334 R336	D192-V194 PolarHBondContact O-N 3.17Å; D192-V194 WeakPolarHBondContact OD1-CA 3.21Å; D192-V194 WeakPolarHBondContact OD1-CB 3.3Å; D192-V194 PolarHBondContact OD1-N 2.91Å; V194-A264 HydrophobicContact CG2-CB 4.26Å; V194-H265 WeakPolarHBondContact CB-O 3.43Å; V194-H265 WeakPolarHBondContact CG1-O 3.36Å; V194-V334 HydrophobicContact CG1-CG1 4.2Å; V194-V334 HydrophobicContact CG2-CB 4.13Å; V194-V334 HydrophobicContact CG2-CG1 4.14Å; V194-R336 HydrophobicContact CG1-CG 4.22Å; V194-R336 VanDerWaalsContact O-CG 3.26Å; V194-R336 WeakPolarHBondContact O-CG 3.25Å; V194-R336 PolarHBondContact O-NE 2.94Å
195	Y	95	Very high	91.5	Very high	37 Å²	37	57.4 Å²	57.4	15%	0.145	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-12.6	-173.2	-68.7	-87.1	0	0	0	115.3	D192 H198 E240 H265 P267 R336	D192-Y195 PolarHBondContact OD1-N 3.44Å; Y195-H198 WeakPolarHBondContact CB-NE2 3.32Å; Y195-H198 AromaticContact CG-NE2 3.85Å; Y195-E240 HydrophobicContact CE2-CB 3.94Å; Y195-E240 WeakPolarHBondContact OH-CB 3.38Å; Y195-E240 VanDerWaalsContact OH-CD 3.31Å; Y195-E240 PolarHBondContact OH-OE2 3.31Å; Y195-H265 HydrophobicContact CD2-CB 3.97Å; Y195-H265 WeakPolarHBondContact CD2-O 3.41Å; Y195-H265 HydrophobicContact CE2-CB 3.93Å; Y195-H265 WeakPolarHBondContact CE2-O 3.31Å; Y195-P267 WeakPolarHBondContact OH-CA 3.36Å; Y195-P267 WeakPolarHBondContact OH-CB 3.48Å; Y195-R336 HydrophobicContact CD1-CB 4.2Å; Y195-R336 HydrophobicContact CD1-CG 4.09Å; Y195-R336 HydrophobicContact CE1-CB 4.08Å; Y195-R336 HydrophobicContact CE1-CG 4.43Å; Y195-R336 PolarHBondContact O-NH2 3.45Å
196	G	95.2	Very high	91	Very high	15 Å²	15	58.3 Å²	58.3	16%	0.155	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80	-152.7	-176.8	0	0	0	0	0	112.8	D192 H198	D192-G196 PolarHBondContact N-O 3.35Å; D192-G196 WeakPolarHBondContact O-CA 3.5Å; D192-G196 PolarHBondContact O-N 3.02Å; G196-H198 PolarHBondContact O-CD2 2.9Å; G196-H198 PolarHBondContact O-N 3.44Å
197	S	96.1	Very high	90.8	Very high	71 Å²	71	55.2 Å²	55.2	50%	0.497	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	125.2	-177.1	-150.9	0	0	0	0	112.4	E191	E191-S197 WeakPolarHBondContact OE1-CB 3.43Å; E191-S197 PolarHBondContact OE1-OG 2.92Å; E191-S197 WeakPolarHBondContact OE2-CA 3.4Å; E191-S197 PolarHBondContact OE2-N 3.34Å; E191-S197 VanDerWaalsContact OE2-N 3.13Å
198	H	91.9	Very high	90.8	Very high	49 Å²	49	49.6 Å²	49.6	23%	0.227	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.4	175.5	-81.7	-80.6	0	0	0	111.5	T189 F190 Y195 G196 F200	T189-H198 CarbonylContact C-O 3.56Å; T189-H198 VanDerWaalsContact CA-O 3.26Å; T189-H198 WeakPolarHBondContact CA-O 3.27Å; F190-H198 HydrophobicContact CD1-CB 4.48Å; F190-H198 HydrophobicContact CE1-CB 4.03Å; F190-H198 HydrophobicContact CZ-CB 4.09Å; F190-H198 PolarHBondContact N-O 3.44Å; F190-H198 PolarHBondContact O-N 3.48Å; Y195-H198 WeakPolarHBondContact CB-NE2 3.32Å; Y195-H198 AromaticContact CG-NE2 3.85Å; G196-H198 PolarHBondContact O-CD2 2.9Å; G196-H198 PolarHBondContact O-N 3.44Å; H198-F200 HydrophobicContact CB-CD2 4.41Å; H198-F200 HydrophobicContact CB-CE2 3.87Å
199	S	93.1	Very high	90.8	Very high	69 Å²	69	50.1 Å²	50.1	48%	0.483	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129	173.7	-56.4	0	0	0	0	110.5	V188 T189	V188-S199 WeakPolarHBondContact O-CA 3.28Å; T189-S199 WeakPolarHBondContact CG2-OG 3.12Å; T189-S199 PolarHBondContact OG1-OG 2.88Å
200	F	91	Very high	90.9	Very high	47 Å²	47	49 Å²	49	21%	0.206	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	128.3	176.3	-70.5	-89.2	0	0	0	110.3	M187 V188 F190 H198 V202 L243 T244 P247	M187-F200 VanDerWaalsContact SD-C 3.52Å; V188-F200 PolarHBondContact N-O 3.02Å; V188-F200 PolarHBondContact O-N 2.69Å; F190-F200 AromaticContact CE1-CD2 3.76Å; F190-F200 HydrophobicContact CE1-CD2 3.76Å; F190-F200 AromaticContact CE1-CE2 3.64Å; F190-F200 HydrophobicContact CE1-CE2 3.64Å; F190-F200 HydrophobicContact CZ-CE2 4.05Å; H198-F200 HydrophobicContact CB-CD2 4.41Å; H198-F200 HydrophobicContact CB-CE2 3.87Å; F200-V202 PolarHBondContact O-N 2.71Å; F200-L243 HydrophobicContact CE2-CG 4.36Å; F200-L243 HydrophobicContact CZ-CD2 4.33Å; F200-L243 HydrophobicContact CZ-CG 4.08Å; F200-T244 HydrophobicContact CE1-CG2 4.13Å; F200-P247 HydrophobicContact CB-CB 4.3Å; F200-P247 HydrophobicContact CB-CG 3.44Å; F200-P247 VanDerWaalsContact CB-CG 3.44Å; F200-P247 HydrophobicContact CD1-CG 4.46Å; F200-P247 HydrophobicContact CD2-CG 3.65Å; F200-P247 HydrophobicContact CG-CG 3.6Å
201	P	89.9	Confident	91	Very high	68 Å²	68	48.2 Å²	48.2	44%	0.442	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	113.7	172.6	29.8	-31.8	0	0	0	109.2	M187 R203	M187-P201 HydrophobicContact CE-CB 4.17Å; M187-P201 HydrophobicContact SD-CB 4.25Å; P201-R203 HydrophobicContact CB-CG 4.36Å
202	V	87.2	Confident	91	Very high	12 Å²	12	43 Å²	43	7%	0.073	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	122.5	163.8	-177.9	0	0	0	0	106.9	Q183 S185 Q186 V188 F200 P247 Q251	Q183-V202 HydrophobicContact CB-CG1 4.09Å; Q183-V202 HydrophobicContact CG-CG1 4.5Å; S185-V202 CarbonylContact C-O 3.58Å; S185-V202 VanDerWaalsContact CA-O 3.26Å; S185-V202 WeakPolarHBondContact CA-O 3.22Å; Q186-V202 PolarHBondContact N-O 3.37Å; Q186-V202 PolarHBondContact O-N 3.41Å; V188-V202 HydrophobicContact CG2-CB 4.49Å; V188-V202 HydrophobicContact CG2-CG2 3.75Å; F200-V202 PolarHBondContact O-N 2.71Å; V202-P247 HydrophobicContact CG2-CB 3.8Å; V202-Q251 VanDerWaalsContact CG1-NE2 3.33Å
203	R	81	Confident	90.9	Very high	123 Å²	123	45.4 Å²	45.4	46%	0.464	25%	0.247	S	C	.	.			trans	-128.7	145.6	-176.9	-58.2	-172.3	-50.2	-154.2	-3	109.6	P201 D205 I206	P201-R203 HydrophobicContact CB-CG 4.36Å; R203-D205 WeakPolarHBondContact CB-OD1 3.15Å; R203-D205 IonicContact CZ-OD1 3.38Å; R203-D205 IonicContact CZ-OD2 2.67Å; R203-D205 IonicContact NE-OD1 3.43Å; R203-D205 PolarHBondContact NE-OD1 3.39Å; R203-D205 IonicContact NE-OD2 3.51Å; R203-D205 PolarHBondContact NE-OD2 2.95Å; R203-D205 IonicContact NH2-OD1 3.94Å; R203-D205 PolarHBondContact NH2-OD1 3.36Å; R203-D205 IonicContact NH2-OD2 2.75Å; R203-D205 PolarHBondContact NH2-OD2 3.27Å; R203-D205 VanDerWaalsContact NH2-OD2 3.11Å; R203-D205 PolarHBondContact O-N 2.71Å; R203-D205 VanDerWaalsContact O-N 3.17Å; R203-I206 HydrophobicContact CB-CD1 4.28Å; R203-I206 HydrophobicContact CB-CG1 4.27Å; R203-I206 PolarHBondContact O-N 3.03Å
204	D	75.8	Confident	90.7	Very high	63 Å²	63	46.7 Å²	46.7	34%	0.337	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-61	-25.7	179.9	-71	-4.4	0	0	0	112.3	N157 R160 S185 I206 G207	N157-D204 PolarHBondContact ND2-O 2.75Å; R160-D204 IonicContact NH1-OD1 3.29Å; R160-D204 IonicContact NH1-OD2 3.02Å; S185-D204 PolarHBondContact OG-N 2.81Å; S185-D204 PolarHBondContact OG-OD1 2.83Å; S185-D204 PolarHBondContact OG-OD2 2.98Å; D204-I206 VanDerWaalsContact C-N 3.34Å; D204-I206 PolarHBondContact O-N 3.12Å; D204-G207 PolarHBondContact O-N 3.19Å
205	D	74.8	Confident	90.5	Very high	100 Å²	100	50.9 Å²	50.9	54%	0.535	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-74.1	-18.3	-179.5	72	-26.9	0	0	0	114.5	R203 G207	R203-D205 WeakPolarHBondContact CB-OD1 3.15Å; R203-D205 IonicContact CZ-OD1 3.38Å; R203-D205 IonicContact CZ-OD2 2.67Å; R203-D205 IonicContact NE-OD1 3.43Å; R203-D205 PolarHBondContact NE-OD1 3.39Å; R203-D205 IonicContact NE-OD2 3.51Å; R203-D205 PolarHBondContact NE-OD2 2.95Å; R203-D205 IonicContact NH2-OD1 3.94Å; R203-D205 PolarHBondContact NH2-OD1 3.36Å; R203-D205 IonicContact NH2-OD2 2.75Å; R203-D205 PolarHBondContact NH2-OD2 3.27Å; R203-D205 VanDerWaalsContact NH2-OD2 3.11Å; R203-D205 PolarHBondContact O-N 2.71Å; R203-D205 VanDerWaalsContact O-N 3.17Å; D205-G207 VanDerWaalsContact C-N 3.27Å
206	I	80.3	Confident	90.4	Very high	88 Å²	88	51 Å²	51	45%	0.451	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-73.1	-29	174.6	-57.5	175.8	0	0	0	110.2	G154 R203 D204	G154-I206 WeakPolarHBondContact CA-O 3.31Å; R203-I206 HydrophobicContact CB-CD1 4.28Å; R203-I206 HydrophobicContact CB-CG1 4.27Å; R203-I206 PolarHBondContact O-N 3.03Å; D204-I206 VanDerWaalsContact C-N 3.34Å; D204-I206 PolarHBondContact O-N 3.12Å
207	G	88.1	Confident	90.4	Very high	9 Å²	9	53.7 Å²	53.7	9%	0.093	30%	0.298	C	S	.	.			trans	93.1	138.5	173.9	0	0	0	0	0	114.5	Y155 Q183 D204 D205	Y155-G207 WeakPolarHBondContact O-CA 3.43Å; Q183-G207 PolarHBondContact OE1-O 3.32Å; D204-G207 PolarHBondContact O-N 3.19Å; D205-G207 VanDerWaalsContact C-N 3.27Å
208	D	94.7	Very high	90.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-61.8	120.3	-175.9	-73.6	-22.7	0	0	0	112.3	Y130 Y155 N157 R160 R180 L181 Q183	Y130-D208 HydrophobicContact CE1-CB 4.16Å; Y130-D208 WeakPolarHBondContact CE1-OD2 3.39Å; Y130-D208 VanDerWaalsContact CZ-OD2 3.26Å; Y130-D208 VanDerWaalsContact OH-CB 3.23Å; Y130-D208 WeakPolarHBondContact OH-CB 3.47Å; Y130-D208 PolarHBondContact OH-OD2 2.97Å; Y155-D208 HydrophobicContact CD1-CB 4.29Å; N157-D208 WeakPolarHBondContact OD1-CB 3.45Å; N157-D208 VanDerWaalsContact OD1-CG 3.26Å; N157-D208 PolarHBondContact OD1-N 3.07Å; N157-D208 PolarHBondContact OD1-OD2 3.39Å; R160-D208 IonicContact NH1-OD1 3.81Å; R160-D208 IonicContact NH1-OD2 2.82Å; R180-D208 HydrophobicContact CB-CB 4.12Å; R180-D208 WeakPolarHBondContact CD-O 3.46Å; R180-D208 PolarHBondContact NH1-O 3.1Å; L181-D208 WeakPolarHBondContact O-CB 3.24Å; Q183-D208 WeakPolarHBondContact CB-OD1 3.5Å; Q183-D208 PolarHBondContact N-OD1 3.42Å
209	P	94.7	Very high	90.7	Very high	22 Å²	22	49.3 Å²	49.3	14%	0.143	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-71.8	149.2	-175.7	28.8	-34.7	0	0	0	111.6	R180 L181 Q183 I248	R180-P209 CarbonylContact C-O 3.58Å; R180-P209 WeakPolarHBondContact CA-O 3.3Å; L181-P209 HydrophobicContact CB-CG 4.01Å; L181-P209 HydrophobicContact CD2-CG 4.35Å; L181-P209 PolarHBondContact N-O 3.29Å; Q183-P209 HydrophobicContact CG-CG 4.41Å; Q183-P209 VanDerWaalsContact OE1-CD 3.3Å; P209-I248 HydrophobicContact CG-CD1 4.38Å; P209-I248 HydrophobicContact CG-CG2 4.07Å
210	I	96.5	Very high	90.9	Very high	53 Å²	53	47.7 Å²	47.7	27%	0.272	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	134.2	171.5	-60.2	178.9	0	0	0	108.7	A178 R180 I212 T219	A178-I210 HydrophobicContact CB-CD1 4.38Å; A178-I210 HydrophobicContact CB-CG2 4.02Å; R180-I210 HydrophobicContact CG-CG1 4.16Å; I210-I212 VanDerWaalsContact CG2-O 3.29Å; I210-I212 WeakPolarHBondContact CG2-O 3.44Å; I210-T219 HydrophobicContact CB-CG2 4.26Å; I210-T219 HydrophobicContact CG2-CG2 3.89Å; I210-T219 VanDerWaalsContact O-CG2 3.32Å; I210-T219 WeakPolarHBondContact O-CG2 3.4Å; I210-T219 PolarHBondContact O-OG1 3.09Å; I210-T219 VanDerWaalsContact O-OG1 3.08Å
211	L	97.7	Very high	91.2	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-45.4	173.3	-63	-177.7	0	0	0	111.7	V129 L179 L181 P218 T219 H221 F222 L252	V129-L211 HydrophobicContact CG1-CD1 3.48Å; V129-L211 VanDerWaalsContact CG1-CD1 3.48Å; L179-L211 PolarHBondContact O-N 3.46Å; L181-L211 HydrophobicContact CB-CD1 3.83Å; L181-L211 HydrophobicContact CB-CD2 4.16Å; L181-L211 HydrophobicContact CB-CG 3.96Å; L181-L211 HydrophobicContact CD1-CD1 4.29Å; L211-P218 CarbonylContact O-C 3.58Å; L211-P218 WeakPolarHBondContact O-CA 3.29Å; L211-T219 PolarHBondContact O-N 3.13Å; L211-T219 PolarHBondContact O-OG1 2.86Å; L211-T219 VanDerWaalsContact O-OG1 3.09Å; L211-H221 HydrophobicContact CD2-CB 4.46Å; L211-F222 HydrophobicContact CB-CB 3.98Å; L211-F222 HydrophobicContact CB-CD2 3.86Å; L211-F222 HydrophobicContact CB-CG 3.96Å; L211-F222 HydrophobicContact CD1-CD2 3.83Å; L211-F222 HydrophobicContact CD1-CE2 4.11Å; L211-F222 HydrophobicContact CD2-CB 4.25Å; L211-F222 HydrophobicContact CD2-CD2 4.24Å; L211-F222 HydrophobicContact CG-CD2 4.2Å; L211-F222 WeakPolarHBondContact O-CB 3.27Å; L211-L252 HydrophobicContact CD1-CD2 3.63Å; L211-L252 HydrophobicContact CD2-CD1 3.95Å; L211-L252 HydrophobicContact CD2-CD2 3.93Å; L211-L252 HydrophobicContact CD2-CG 4.44Å; L211-L252 HydrophobicContact CG-CD2 4.43Å
212	I	97.7	Very high	91.6	Very high	16 Å²	16	44.1 Å²	44.1	8%	0.082	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.8	173.4	-58.3	-61	0	0	0	108.3	A120 A178 L179 I210 P218 F222	A120-I212 HydrophobicContact CB-CG1 3.97Å; A178-I212 CarbonylContact C-O 3.35Å; A178-I212 WeakPolarHBondContact CA-O 3.23Å; A178-I212 VanDerWaalsContact CB-O 3.29Å; A178-I212 WeakPolarHBondContact CB-O 3.46Å; L179-I212 HydrophobicContact CB-CB 3.99Å; L179-I212 HydrophobicContact CB-CG1 4.38Å; L179-I212 HydrophobicContact CD1-CB 4.15Å; L179-I212 HydrophobicContact CD1-CG1 4.03Å; L179-I212 HydrophobicContact CG-CB 4.13Å; L179-I212 PolarHBondContact N-O 2.97Å; L179-I212 PolarHBondContact O-N 2.74Å; I210-I212 VanDerWaalsContact CG2-O 3.29Å; I210-I212 WeakPolarHBondContact CG2-O 3.44Å; I212-P218 HydrophobicContact CD1-CB 3.76Å; I212-F222 HydrophobicContact CD1-CD1 3.32Å; I212-F222 HydrophobicContact CD1-CE1 3.5Å; I212-F222 HydrophobicContact CD1-CG 4.29Å; I212-F222 HydrophobicContact CG1-CD1 4.12Å; I212-F222 HydrophobicContact CG1-CE1 4.06Å
213	K	95.4	Very high	92.2	Very high	56 Å²	56	43.5 Å²	43.5	24%	0.243	23%	0.23	C	C	.	.			trans	-71.5	166.8	176.5	-68.7	-177.8	-70.6	152.6	0	110.8	T70 D215 G216 Y217 T219	T70-K213 PolarHBondContact O-NZ 3.36Å; K213-D215 WeakPolarHBondContact CB-OD1 3.22Å; K213-D215 IonicContact NZ-OD1 2.65Å; K213-D215 IonicContact NZ-OD2 3.73Å; K213-D215 PolarHBondContact NZ-OD2 2.89Å; K213-D215 PolarHBondContact O-N 3.4Å; K213-G216 PolarHBondContact O-N 3.5Å; K213-Y217 WeakPolarHBondContact CB-O 2.96Å; K213-Y217 PolarHBondContact N-O 3.33Å; K213-T219 HydrophobicContact CG-CG2 4.23Å
214	S	93.5	Very high	93	Very high	75 Å²	75	37.7 Å²	37.7	52%	0.524	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-16.4	179	57.1	0	0	0	0	114.9	F177 G216	F177-S214 VanDerWaalsContact O-CA 3.27Å; F177-S214 WeakPolarHBondContact O-CA 3.41Å; S214-G216 VanDerWaalsContact C-N 3.28Å
215	D	92	Very high	94.1	Very high	94 Å²	94	34.7 Å²	34.7	50%	0.503	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	0.4	172.7	61.2	7.5	0	0	0	112.7	K213 Y217	K213-D215 WeakPolarHBondContact CB-OD1 3.22Å; K213-D215 IonicContact NZ-OD1 2.65Å; K213-D215 IonicContact NZ-OD2 3.73Å; K213-D215 PolarHBondContact NZ-OD2 2.89Å; K213-D215 PolarHBondContact O-N 3.4Å; D215-Y217 VanDerWaalsContact C-N 3.31Å; D215-Y217 PolarHBondContact O-N 2.96Å; D215-Y217 WeakPolarHBondContact OD1-CB 3.24Å; D215-Y217 PolarHBondContact OD1-N 2.98Å
216	G	92.6	Very high	95.2	Very high	39 Å²	39	30.2 Å²	30.2	40%	0.402	17%	0.168	S	C	.	.	S	Bend	trans	85.6	-9.6	-178	0	0	0	0	0	114.8	K213 S214	K213-G216 PolarHBondContact O-N 3.5Å; S214-G216 VanDerWaalsContact C-N 3.28Å
217	Y	95.1	Very high	96.1	Very high	72 Å²	72	26 Å²	26	28%	0.282	15%	0.146	S	C	.	.	P	Polyproline II helix	trans	-75	141.9	177.6	-85.4	-105.6	0	0	0	111.2	L113 K213 D215	L113-Y217 HydrophobicContact CD1-CE1 4.42Å; L113-Y217 HydrophobicContact CD1-CE2 4.28Å; L113-Y217 HydrophobicContact CD2-CD1 3.94Å; L113-Y217 HydrophobicContact CD2-CE1 4Å; L113-Y217 HydrophobicContact CD2-CG 4.3Å; K213-Y217 WeakPolarHBondContact CB-O 2.96Å; K213-Y217 PolarHBondContact N-O 3.33Å; D215-Y217 VanDerWaalsContact C-N 3.31Å; D215-Y217 PolarHBondContact O-N 2.96Å; D215-Y217 WeakPolarHBondContact OD1-CB 3.24Å; D215-Y217 PolarHBondContact OD1-N 2.98Å
218	P	97.5	Very high	96.6	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.006	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-69.5	156.6	172.5	36.3	-41.9	0	0	0	111.3	T70 Y116 L211 I212 F222 A223	T70-P218 HydrophobicContact CG2-CG 3.7Å; Y116-P218 HydrophobicContact CD2-CB 4.16Å; Y116-P218 HydrophobicContact CD2-CG 3.44Å; Y116-P218 VanDerWaalsContact CD2-CG 3.44Å; Y116-P218 HydrophobicContact CE2-CG 3.66Å; Y116-P218 HydrophobicContact CG-CB 4.18Å; Y116-P218 HydrophobicContact CG-CG 3.95Å; L211-P218 CarbonylContact O-C 3.58Å; L211-P218 WeakPolarHBondContact O-CA 3.29Å; I212-P218 HydrophobicContact CD1-CB 3.76Å; P218-F222 HydrophobicContact CB-CB 4.33Å; P218-F222 HydrophobicContact CB-CD1 4.05Å; P218-A223 HydrophobicContact CB-CB 4Å; P218-A223 HydrophobicContact CG-CB 3.86Å
219	T	97	Very high	96.8	Very high	27 Å²	27	29.4 Å²	29.4	17%	0.166	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-82	164.6	162.2	64.4	0	0	0	0	110	I210 L211 K213 H221 F222 A223	I210-T219 HydrophobicContact CB-CG2 4.26Å; I210-T219 HydrophobicContact CG2-CG2 3.89Å; I210-T219 VanDerWaalsContact O-CG2 3.32Å; I210-T219 WeakPolarHBondContact O-CG2 3.4Å; I210-T219 PolarHBondContact O-OG1 3.09Å; I210-T219 VanDerWaalsContact O-OG1 3.08Å; L211-T219 PolarHBondContact O-N 3.13Å; L211-T219 PolarHBondContact O-OG1 2.86Å; L211-T219 VanDerWaalsContact O-OG1 3.09Å; K213-T219 HydrophobicContact CG-CG2 4.23Å; T219-H221 PolarHBondContact O-N 2.94Å; T219-F222 PolarHBondContact O-N 3.15Å; T219-F222 VanDerWaalsContact O-N 3.15Å; T219-A223 PolarHBondContact O-N 3.16Å
220	Y	96.6	Very high	96.9	Very high	35 Å²	35	31.3 Å²	31.3	14%	0.137	17%	0.169	C	C	.	.	H	α-helix	trans	-47.2	-45.1	172.2	167.2	-99.9	0	0	0	113	E68 F222 S224 R238 W242 H249	E68-Y220 WeakPolarHBondContact OE2-CD2 3.29Å; E68-Y220 WeakPolarHBondContact OE2-CE2 3.34Å; Y220-F222 VanDerWaalsContact C-N 3.31Å; Y220-F222 PolarHBondContact O-N 3.07Å; Y220-S224 WeakPolarHBondContact O-CB 2.82Å; Y220-S224 PolarHBondContact O-N 3.09Å; Y220-R238 PolarHBondContact OH-NH1 3.05Å; Y220-R238 VanDerWaalsContact OH-NH1 3.16Å; Y220-W242 HydrophobicContact CD1-CE3 4.02Å; Y220-W242 AromaticContact CD1-CH2 3.7Å; Y220-W242 HydrophobicContact CD1-CH2 3.7Å; Y220-W242 AromaticContact CD1-CZ3 3.32Å; Y220-W242 HydrophobicContact CD1-CZ3 3.32Å; Y220-W242 HydrophobicContact CD2-CH2 4.17Å; Y220-W242 HydrophobicContact CE1-CD2 4.01Å; Y220-W242 AromaticContact CE1-CE3 3.3Å; Y220-W242 HydrophobicContact CE1-CE3 3.3Å; Y220-W242 AromaticContact CE1-CH2 3.64Å; Y220-W242 HydrophobicContact CE1-CH2 3.64Å; Y220-W242 HydrophobicContact CE1-CZ2 4.31Å; Y220-W242 AromaticContact CE1-CZ3 3.09Å; Y220-W242 HydrophobicContact CE1-CZ3 3.09Å; Y220-W242 HydrophobicContact CE2-CH2 4.11Å; Y220-W242 HydrophobicContact CE2-CZ2 4.25Å; Y220-W242 HydrophobicContact CE2-CZ3 4.38Å; Y220-W242 AromaticContact CG-CH2 3.97Å; Y220-W242 HydrophobicContact CG-CH2 3.97Å; Y220-W242 HydrophobicContact CG-CZ3 4.08Å; Y220-W242 AromaticContact CZ-CD2 3.95Å; Y220-W242 AromaticContact CZ-CE3 3.73Å; Y220-W242 AromaticContact CZ-CH2 3.85Å; Y220-W242 AromaticContact CZ-CZ3 3.69Å; Y220-H249 AromaticContact CE1-CE1 3.62Å; Y220-H249 AromaticContact CE1-NE2 3.76Å
221	H	97.5	Very high	97	Very high	38 Å²	38	28.8 Å²	28.8	18%	0.176	16%	0.156	C	C	.	.	H	α-helix	trans	-61	-41.2	-176	-61.9	-70	0	0	0	112.6	L211 T219 V225 S245 I248 H249 L252	L211-H221 HydrophobicContact CD2-CB 4.46Å; T219-H221 PolarHBondContact O-N 2.94Å; H221-V225 WeakPolarHBondContact O-CG2 3.5Å; H221-S245 PolarHBondContact CE1-OG 3.31Å; H221-I248 HydrophobicContact CB-CG2 4.27Å; H221-H249 AromaticContact CG-NE2 4Å; H221-H249 AromaticContact ND1-CD2 3.83Å; H221-H249 AromaticContact ND1-NE2 3.29Å; H221-H249 PolarHBondContact ND1-NE2 3.33Å; H221-L252 HydrophobicContact CB-CD1 4.39Å; H221-L252 WeakPolarHBondContact O-CD1 3.21Å
222	F	98.3	Very high	97	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-76.6	-50.8	-177.3	-164	-117.8	0	0	0	111.4	Y116 A119 A120 L123 L211 I212 P218 T219 Y220 S224 V225 I226 L252 F256	Y116-F222 WeakPolarHBondContact O-CE1 2.69Å; A119-F222 HydrophobicContact CB-CE1 4.39Å; A119-F222 HydrophobicContact CB-CZ 4Å; A120-F222 HydrophobicContact CB-CE1 4.03Å; A120-F222 HydrophobicContact CB-CZ 3.92Å; L123-F222 HydrophobicContact CD1-CE2 3.86Å; L211-F222 HydrophobicContact CB-CB 3.98Å; L211-F222 HydrophobicContact CB-CD2 3.86Å; L211-F222 HydrophobicContact CB-CG 3.96Å; L211-F222 HydrophobicContact CD1-CD2 3.83Å; L211-F222 HydrophobicContact CD1-CE2 4.11Å; L211-F222 HydrophobicContact CD2-CB 4.25Å; L211-F222 HydrophobicContact CD2-CD2 4.24Å; L211-F222 HydrophobicContact CG-CD2 4.2Å; L211-F222 WeakPolarHBondContact O-CB 3.27Å; I212-F222 HydrophobicContact CD1-CD1 3.32Å; I212-F222 HydrophobicContact CD1-CE1 3.5Å; I212-F222 HydrophobicContact CD1-CG 4.29Å; I212-F222 HydrophobicContact CG1-CD1 4.12Å; I212-F222 HydrophobicContact CG1-CE1 4.06Å; P218-F222 HydrophobicContact CB-CB 4.33Å; P218-F222 HydrophobicContact CB-CD1 4.05Å; T219-F222 PolarHBondContact O-N 3.15Å; T219-F222 VanDerWaalsContact O-N 3.15Å; Y220-F222 VanDerWaalsContact C-N 3.31Å; Y220-F222 PolarHBondContact O-N 3.07Å; F222-S224 PolarHBondContact O-N 2.85Å; F222-V225 PolarHBondContact O-N 2.9Å; F222-I226 HydrophobicContact CD1-CD1 3.49Å; F222-I226 VanDerWaalsContact CD1-CD1 3.49Å; F222-I226 HydrophobicContact CD2-CD1 4Å; F222-I226 HydrophobicContact CE1-CD1 3.23Å; F222-I226 HydrophobicContact CE2-CD1 3.76Å; F222-I226 HydrophobicContact CG-CD1 3.89Å; F222-I226 HydrophobicContact CZ-CD1 3.39Å; F222-I226 WeakPolarHBondContact O-CG1 3.36Å; F222-I226 PolarHBondContact O-N 3.19Å; F222-I226 VanDerWaalsContact O-N 3.15Å; F222-L252 HydrophobicContact CD2-CD2 4.29Å; F222-F256 HydrophobicContact CE2-CE2 4.21Å; F222-F256 HydrophobicContact CE2-CZ 4.01Å; F222-F256 HydrophobicContact CZ-CZ 4.3Å
223	A	98.4	Very high	97.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.2	-43.7	-178.9	0	0	0	0	0	111.8	T70 Y116 P218 T219 V225 I226 D227	T70-A223 HydrophobicContact CG2-CB 4.27Å; Y116-A223 HydrophobicContact CE1-CB 3.95Å; P218-A223 HydrophobicContact CB-CB 4Å; P218-A223 HydrophobicContact CG-CB 3.86Å; T219-A223 PolarHBondContact O-N 3.16Å; A223-V225 PolarHBondContact O-N 3.03Å; A223-I226 PolarHBondContact O-N 3.46Å; A223-D227 VanDerWaalsContact O-CB 3.3Å; A223-D227 WeakPolarHBondContact O-CB 3.43Å; A223-D227 VanDerWaalsContact O-CG 3.24Å; A223-D227 PolarHBondContact O-N 2.95Å
224	S	98.4	Very high	97.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-42.9	179.5	-179.8	0	0	0	0	112.6	Y220 F222 D228	Y220-S224 WeakPolarHBondContact O-CB 2.82Å; Y220-S224 PolarHBondContact O-N 3.09Å; F222-S224 PolarHBondContact O-N 2.85Å; S224-D228 WeakPolarHBondContact O-CB 3.46Å; S224-D228 PolarHBondContact O-N 2.84Å
225	V	98.6	Very high	97.4	Very high	1 Å²	1	31 Å²	31	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-70.6	-44.1	-178.1	170	0	0	0	0	111.2	H221 F222 A223 H229 H249 L252 Y253	H221-V225 WeakPolarHBondContact O-CG2 3.5Å; F222-V225 PolarHBondContact O-N 2.9Å; A223-V225 PolarHBondContact O-N 3.03Å; V225-H229 WeakPolarHBondContact O-CB 3.19Å; V225-H229 PolarHBondContact O-N 3.29Å; V225-H249 HydrophobicContact CG2-CB 3.72Å; V225-L252 HydrophobicContact CB-CB 4.39Å; V225-L252 HydrophobicContact CB-CD1 4.37Å; V225-L252 HydrophobicContact CG1-CB 3.95Å; V225-L252 HydrophobicContact CG2-CB 4.19Å; V225-L252 HydrophobicContact CG2-CD1 3.96Å; V225-Y253 HydrophobicContact CB-CE2 4.47Å; V225-Y253 HydrophobicContact CG1-CD1 4.2Å; V225-Y253 HydrophobicContact CG1-CD2 4.07Å; V225-Y253 HydrophobicContact CG1-CE1 4.02Å; V225-Y253 HydrophobicContact CG1-CE2 3.89Å; V225-Y253 HydrophobicContact CG1-CG 4.2Å; V225-Y253 HydrophobicContact CG2-CE2 4.12Å
226	I	98.6	Very high	97.8	Very high	5 Å²	5	26.5 Å²	26.5	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-63.2	-47.7	178.6	-69.2	166	0	0	0	110.2	I115 Y116 A119 F222 A223 H229 D230 F256 W258	I115-I226 HydrophobicContact CG2-CG2 3.75Å; Y116-I226 HydrophobicContact CD1-CB 4.29Å; Y116-I226 HydrophobicContact CD1-CD1 3.95Å; Y116-I226 HydrophobicContact CD1-CG2 4.06Å; Y116-I226 HydrophobicContact CE1-CB 4.42Å; Y116-I226 HydrophobicContact CE1-CG2 4.23Å; A119-I226 HydrophobicContact CB-CD1 3.45Å; A119-I226 VanDerWaalsContact CB-CD1 3.45Å; A119-I226 HydrophobicContact CB-CG1 4.09Å; F222-I226 HydrophobicContact CD1-CD1 3.49Å; F222-I226 VanDerWaalsContact CD1-CD1 3.49Å; F222-I226 HydrophobicContact CD2-CD1 4Å; F222-I226 HydrophobicContact CE1-CD1 3.23Å; F222-I226 HydrophobicContact CE2-CD1 3.76Å; F222-I226 HydrophobicContact CG-CD1 3.89Å; F222-I226 HydrophobicContact CZ-CD1 3.39Å; F222-I226 WeakPolarHBondContact O-CG1 3.36Å; F222-I226 PolarHBondContact O-N 3.19Å; F222-I226 VanDerWaalsContact O-N 3.15Å; A223-I226 PolarHBondContact O-N 3.46Å; I226-H229 PolarHBondContact O-N 3.42Å; I226-D230 WeakPolarHBondContact O-CB 3.35Å; I226-D230 PolarHBondContact O-N 3.26Å; I226-F256 HydrophobicContact CG1-CE2 4.38Å; I226-F256 HydrophobicContact CG1-CZ 4.39Å; I226-W258 HydrophobicContact CG1-CZ3 4.46Å
227	D	98.8	Very high	98	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-71.2	-35.9	-178.8	-67.8	-22	0	0	0	112.5	R66 Q109 R112 Y116 A223 H229 M231	R66-D227 WeakPolarHBondContact CD-OD2 3.4Å; R66-D227 IonicContact NE-OD2 3.12Å; Q109-D227 WeakPolarHBondContact CG-OD2 3.47Å; Q109-D227 PolarHBondContact NE2-OD2 3.05Å; R112-D227 IonicContact CZ-OD1 3.68Å; R112-D227 VanDerWaalsContact CZ-OD1 3.29Å; R112-D227 IonicContact NE-OD1 2.87Å; R112-D227 PolarHBondContact NE-OD1 3.45Å; R112-D227 IonicContact NE-OD2 2.78Å; R112-D227 IonicContact NH2-OD1 3.72Å; R112-D227 PolarHBondContact NH2-OD1 3.44Å; Y116-D227 WeakPolarHBondContact CE1-OD1 3.43Å; Y116-D227 PolarHBondContact OH-OD1 3.43Å; Y116-D227 PolarHBondContact OH-OD2 2.59Å; A223-D227 VanDerWaalsContact O-CB 3.3Å; A223-D227 WeakPolarHBondContact O-CB 3.43Å; A223-D227 VanDerWaalsContact O-CG 3.24Å; A223-D227 PolarHBondContact O-N 2.95Å; D227-H229 VanDerWaalsContact C-N 3.25Å; D227-H229 PolarHBondContact O-N 3.24Å; D227-M231 HydrophobicContact CB-CE 4.37Å; D227-M231 HydrophobicContact CB-SD 4.43Å; D227-M231 WeakPolarHBondContact O-CB 3.36Å; D227-M231 VanDerWaalsContact O-CG 3.22Å; D227-M231 WeakPolarHBondContact O-CG 3.45Å; D227-M231 PolarHBondContact O-N 3.14Å
228	D	98.7	Very high	98.2	Very high	4 Å²	4	21.6 Å²	21.6	2%	0.021	11%	0.106	C	C	.	.	H	α-helix	trans	-63.9	-34.6	173.9	-74.8	-11.7	0	0	0	110.5	R32 R66 S224 Q232 I233 V236 Y253	R32-D228 IonicContact NE-OD1 3.79Å; R32-D228 PolarHBondContact NE-OD1 3.3Å; R32-D228 VanDerWaalsContact NE-OD1 3.11Å; R32-D228 IonicContact NE-OD2 3.44Å; R32-D228 PolarHBondContact NE-OD2 3.41Å; R32-D228 IonicContact NH2-OD2 3.33Å; R66-D228 IonicContact CZ-OD1 2.68Å; R66-D228 VanDerWaalsContact CZ-OD1 3.29Å; R66-D228 IonicContact NH1-OD1 3.65Å; R66-D228 PolarHBondContact NH1-OD1 3.43Å; R66-D228 IonicContact NH2-OD1 3.99Å; R66-D228 PolarHBondContact NH2-OD1 3.06Å; S224-D228 WeakPolarHBondContact O-CB 3.46Å; S224-D228 PolarHBondContact O-N 2.84Å; D228-Q232 PolarHBondContact O-N 2.88Å; D228-I233 HydrophobicContact CB-CB 4.04Å; D228-I233 HydrophobicContact CB-CG1 4.13Å; D228-I233 VanDerWaalsContact O-CB 3.31Å; D228-I233 WeakPolarHBondContact O-CB 3.36Å; D228-I233 PolarHBondContact O-N 2.76Å; D228-V236 WeakPolarHBondContact OD2-CG2 3.34Å; D228-Y253 WeakPolarHBondContact CB-OH 3.35Å
229	H	98.3	Very high	98	Very high	77 Å²	77	21.7 Å²	21.7	36%	0.356	11%	0.107	S	C	.	.	H	α-helix	trans	-71.3	-53.1	172.6	-178.2	72	0	0	0	112.7	V225 I226 D227 M231 Q232 Y253 W258	V225-H229 WeakPolarHBondContact O-CB 3.19Å; V225-H229 PolarHBondContact O-N 3.29Å; I226-H229 PolarHBondContact O-N 3.42Å; D227-H229 VanDerWaalsContact C-N 3.25Å; D227-H229 PolarHBondContact O-N 3.24Å; H229-M231 PolarHBondContact O-N 2.95Å; H229-Q232 WeakPolarHBondContact O-CA 3.32Å; H229-Q232 PolarHBondContact O-N 3.43Å; H229-Y253 HydrophobicContact CB-CE1 4.39Å; H229-W258 HydrophobicContact CB-CD2 4.21Å; H229-W258 HydrophobicContact CB-CE3 3.61Å; H229-W258 HydrophobicContact CB-CH2 4.41Å; H229-W258 HydrophobicContact CB-CZ3 3.72Å; H229-W258 AromaticContact CD2-CD2 3.56Å; H229-W258 AromaticContact CD2-CE2 3.43Å; H229-W258 VanDerWaalsContact CD2-CE2 3.43Å; H229-W258 AromaticContact CD2-CE3 3.76Å; H229-W258 AromaticContact CD2-CH2 3.77Å; H229-W258 AromaticContact CD2-CZ2 3.56Å; H229-W258 AromaticContact CD2-CZ3 3.87Å; H229-W258 AromaticContact CE1-CD1 3.63Å; H229-W258 AromaticContact CE1-CD2 3.68Å; H229-W258 AromaticContact CE1-CE2 3.86Å; H229-W258 AromaticContact CE1-CG 3.55Å; H229-W258 AromaticContact CE1-NE1 3.79Å; H229-W258 AromaticContact CG-CD2 3.52Å; H229-W258 AromaticContact CG-CE2 3.92Å; H229-W258 AromaticContact CG-CE3 3.45Å; H229-W258 VanDerWaalsContact CG-CE3 3.45Å; H229-W258 AromaticContact CG-CZ3 3.81Å; H229-W258 AromaticContact ND1-CD2 3.6Å; H229-W258 AromaticContact ND1-CE3 3.89Å; H229-W258 AromaticContact ND1-CG 3.66Å; H229-W258 AromaticContact NE2-CD1 3.82Å; H229-W258 AromaticContact NE2-CD2 3.67Å; H229-W258 AromaticContact NE2-CE2 3.4Å; H229-W258 AromaticContact NE2-CG 3.94Å; H229-W258 AromaticContact NE2-CZ2 3.89Å; H229-W258 AromaticContact NE2-NE1 3.48Å; H229-W258 PolarHBondContact NE2-NE1 3.36Å
230	D	98	Very high	97.9	Very high	62 Å²	62	21.7 Å²	21.7	33%	0.332	11%	0.105	S	C	.	.	H	α-helix	trans	-62.8	-39.5	-176.3	-176.8	66.6	0	0	0	112.3	H104 R112 I226 Q232	H104-D230 PolarHBondContact CE1-O 2.9Å; H104-D230 PolarHBondContact ND1-O 3.48Å; R112-D230 IonicContact CZ-OD2 3.45Å; R112-D230 IonicContact NH1-OD2 3.49Å; R112-D230 IonicContact NH2-OD2 2.71Å; R112-D230 PolarHBondContact NH2-OD2 3.14Å; I226-D230 WeakPolarHBondContact O-CB 3.35Å; I226-D230 PolarHBondContact O-N 3.26Å; D230-Q232 PolarHBondContact O-N 2.9Å
231	M	98.3	Very high	97.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	6.3	174.7	-57.7	177.3	178.4	0	0	113.2	R30 I64 R66 H104 Y107 D227 H229 I233	R30-M231 PolarHBondContact NE-O 3.31Å; R30-M231 PolarHBondContact NH2-O 3.36Å; R30-M231 VanDerWaalsContact NH2-O 3.1Å; I64-M231 HydrophobicContact CG2-SD 4.37Å; R66-M231 HydrophobicContact CB-SD 4.41Å; R66-M231 HydrophobicContact CG-CE 4.11Å; R66-M231 HydrophobicContact CG-SD 4.39Å; H104-M231 HydrophobicContact CB-CB 4.23Å; H104-M231 HydrophobicContact CB-CG 3.84Å; Y107-M231 HydrophobicContact CD1-CE 3.76Å; Y107-M231 HydrophobicContact CD1-SD 4.05Å; Y107-M231 HydrophobicContact CE1-CE 4.16Å; Y107-M231 HydrophobicContact CE1-SD 4.16Å; D227-M231 HydrophobicContact CB-CE 4.37Å; D227-M231 HydrophobicContact CB-SD 4.43Å; D227-M231 WeakPolarHBondContact O-CB 3.36Å; D227-M231 VanDerWaalsContact O-CG 3.22Å; D227-M231 WeakPolarHBondContact O-CG 3.45Å; D227-M231 PolarHBondContact O-N 3.14Å; H229-M231 PolarHBondContact O-N 2.95Å; M231-I233 VanDerWaalsContact C-N 3.3Å; M231-I233 HydrophobicContact CB-CD1 4.27Å; M231-I233 HydrophobicContact CB-CG1 4.28Å; M231-I233 PolarHBondContact O-N 3.03Å
232	Q	98.1	Very high	97.7	Very high	124 Å²	124	26.2 Å²	26.2	58%	0.579	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	40.6	176.5	-55.8	-178.8	-8.2	0	0	113.4	R30 D228 H229 D230 S234	R30-Q232 WeakPolarHBondContact CB-O 3.39Å; R30-Q232 WeakPolarHBondContact CD-O 3.19Å; D228-Q232 PolarHBondContact O-N 2.88Å; H229-Q232 WeakPolarHBondContact O-CA 3.32Å; H229-Q232 PolarHBondContact O-N 3.43Å; D230-Q232 PolarHBondContact O-N 2.9Å; Q232-S234 PolarHBondContact O-N 3.47Å
233	I	98.7	Very high	97.5	Very high	12 Å²	12	27 Å²	27	6%	0.062	13%	0.129	C	C	.	.			trans	-64.4	125.4	178.4	-59.9	-55.2	0	0	0	109.3	R30 R32 I64 D228 M231 H235 V236	R30-I233 HydrophobicContact CB-CD1 4.48Å; R32-I233 HydrophobicContact CB-CD1 3.89Å; R32-I233 HydrophobicContact CG-CD1 4.35Å; R32-I233 HydrophobicContact CG-CG1 4.5Å; I64-I233 HydrophobicContact CD1-CD1 4.07Å; D228-I233 HydrophobicContact CB-CB 4.04Å; D228-I233 HydrophobicContact CB-CG1 4.13Å; D228-I233 VanDerWaalsContact O-CB 3.31Å; D228-I233 WeakPolarHBondContact O-CB 3.36Å; D228-I233 PolarHBondContact O-N 2.76Å; M231-I233 VanDerWaalsContact C-N 3.3Å; M231-I233 HydrophobicContact CB-CD1 4.27Å; M231-I233 HydrophobicContact CB-CG1 4.28Å; M231-I233 PolarHBondContact O-N 3.03Å; I233-H235 VanDerWaalsContact CG2-O 3.24Å; I233-H235 WeakPolarHBondContact CG2-O 3.47Å; I233-V236 HydrophobicContact CG2-CG2 3.88Å
234	S	98.4	Very high	97.3	Very high	20 Å²	20	31.5 Å²	31.5	14%	0.14	16%	0.156	C	C	.	.			trans	-91	-35.3	179.9	65.5	0	0	0	0	112.6	V29 R30 Q232 P261 V262	V29-S234 WeakPolarHBondContact CA-OG 3.48Å; R30-S234 PolarHBondContact N-OG 3.14Å; R30-S234 PolarHBondContact O-N 3.13Å; R30-S234 PolarHBondContact O-OG 3.39Å; Q232-S234 PolarHBondContact O-N 3.47Å; S234-P261 WeakPolarHBondContact O-CA 3.3Å; S234-P261 WeakPolarHBondContact O-CB 3.4Å; S234-V262 PolarHBondContact O-N 3.47Å
235	H	98.6	Very high	97.1	Very high	37 Å²	37	32.2 Å²	32.2	17%	0.171	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	134.1	-178.9	-55.7	67.6	0	0	0	110.2	R30 V31 F55 I233 L237 V262	R30-H235 PolarHBondContact O-N 2.8Å; V31-H235 HydrophobicContact CG1-CB 3.82Å; F55-H235 HydrophobicContact CE1-CB 4.08Å; F55-H235 AromaticContact CE1-CD2 3.83Å; F55-H235 AromaticContact CE1-CG 3.66Å; F55-H235 AromaticContact CE1-ND1 3.77Å; F55-H235 AromaticContact CZ-CD2 3.69Å; F55-H235 AromaticContact CZ-NE2 3.77Å; I233-H235 VanDerWaalsContact CG2-O 3.24Å; I233-H235 WeakPolarHBondContact CG2-O 3.47Å; H235-L237 HydrophobicContact CB-CD1 3.72Å; H235-V262 CarbonylContact C-O 3.47Å; H235-V262 VanDerWaalsContact CA-O 3.25Å; H235-V262 WeakPolarHBondContact CA-O 3.48Å
236	V	98.6	Very high	97	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	99.8	176.9	169.4	0	0	0	0	108.6	R32 D228 I233 R238 P261 V262 F263 A264	R32-V236 VanDerWaalsContact NH2-CG1 3.27Å; D228-V236 WeakPolarHBondContact OD2-CG2 3.34Å; I233-V236 HydrophobicContact CG2-CG2 3.88Å; V236-R238 HydrophobicContact CG1-CG 4.02Å; V236-P261 HydrophobicContact CB-CG 4.43Å; V236-P261 HydrophobicContact CG2-CB 4.02Å; V236-P261 HydrophobicContact CG2-CG 3.52Å; V236-V262 PolarHBondContact N-O 3.42Å; V236-F263 HydrophobicContact CB-CD1 3.74Å; V236-F263 HydrophobicContact CB-CE1 3.87Å; V236-F263 HydrophobicContact CG1-CD1 3.79Å; V236-F263 HydrophobicContact CG1-CE1 3.87Å; V236-F263 HydrophobicContact CG2-CD1 4.48Å; V236-F263 HydrophobicContact CG2-CE1 4.14Å; V236-A264 PolarHBondContact O-N 2.75Å
237	L	98.2	Very high	96.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	113.6	172.3	-75.7	61.8	0	0	0	108.6	R32 T48 F51 N52 F55 H235 A264 L331	R32-L237 PolarHBondContact NH1-O 2.89Å; T48-L237 WeakPolarHBondContact CG2-O 3.35Å; F51-L237 HydrophobicContact CB-CD2 4.49Å; N52-L237 WeakPolarHBondContact ND2-CB 3.23Å; N52-L237 PolarHBondContact ND2-O 3.15Å; F55-L237 HydrophobicContact CB-CD2 4.18Å; F55-L237 HydrophobicContact CG-CD2 4.38Å; H235-L237 HydrophobicContact CB-CD1 3.72Å; L237-A264 WeakPolarHBondContact CA-O 3.38Å; L237-A264 HydrophobicContact CD1-CB 4.1Å; L237-A264 HydrophobicContact CG-CB 3.94Å; L237-L331 HydrophobicContact CD1-CD2 3.94Å; L237-L331 HydrophobicContact CD2-CD1 3.72Å; L237-L331 HydrophobicContact CD2-CD2 4.18Å; L237-L331 HydrophobicContact CG-CD1 4.03Å; L237-L331 HydrophobicContact CG-CD2 4.17Å
238	R	97.7	Very high	96.7	Very high	8 Å²	8	33.6 Å²	33.6	3%	0.03	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	167.9	-176.9	64.9	-177.7	-179.6	-167.1	-1.7	111.9	Y220 V236 W242 T246 H249 A264 H265 L266	Y220-R238 PolarHBondContact OH-NH1 3.05Å; Y220-R238 VanDerWaalsContact OH-NH1 3.16Å; V236-R238 HydrophobicContact CG1-CG 4.02Å; R238-W242 HydrophobicContact CG-CB 4.1Å; R238-T246 PolarHBondContact NH2-OG1 2.92Å; R238-T246 VanDerWaalsContact NH2-OG1 3.13Å; R238-H249 PolarHBondContact NH1-CE1 3.25Å; R238-H249 PolarHBondContact NH1-ND1 3.46Å; R238-H249 PolarHBondContact NH2-ND1 2.86Å; R238-A264 PolarHBondContact N-O 3.42Å; R238-H265 PolarHBondContact NE-NE2 3.25Å; R238-H265 CarbonylContact O-C 3.52Å; R238-H265 VanDerWaalsContact O-CA 3.29Å; R238-H265 WeakPolarHBondContact O-CA 3.4Å; R238-L266 PolarHBondContact O-N 3.27Å
239	G	95.2	Very high	96.6	Very high	4 Å²	4	33.5 Å²	33.5	4%	0.041	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	149.1	179	0	0	0	0	0	114	E241 W242 H265 L266	G239-E241 WeakPolarHBondContact CA-OE2 3.38Å; G239-E241 PolarHBondContact O-N 3.44Å; G239-E241 VanDerWaalsContact O-N 3.13Å; G239-W242 PolarHBondContact O-N 2.92Å; G239-W242 VanDerWaalsContact O-N 3.09Å; G239-H265 PolarHBondContact O-CD2 3.44Å; G239-L266 CarbonylContact C-O 3.57Å; G239-L266 WeakPolarHBondContact CA-O 3.42Å
240	E	95	Very high	96.6	Very high	27 Å²	27	31.2 Å²	31.2	13%	0.126	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-59.4	-18.5	179.6	65.5	166.6	146.3	0	0	114.4	Y195 W242 L243 H265 L266 L268 R338	Y195-E240 HydrophobicContact CE2-CB 3.94Å; Y195-E240 WeakPolarHBondContact OH-CB 3.38Å; Y195-E240 VanDerWaalsContact OH-CD 3.31Å; Y195-E240 PolarHBondContact OH-OE2 3.31Å; E240-W242 PolarHBondContact O-N 2.81Å; E240-W242 VanDerWaalsContact O-N 3.11Å; E240-L243 WeakPolarHBondContact O-CB 3.32Å; E240-L243 PolarHBondContact O-N 2.96Å; E240-H265 HydrophobicContact CB-CB 4.49Å; E240-L266 PolarHBondContact N-O 2.91Å; E240-L268 HydrophobicContact CG-CB 4.43Å; E240-L268 HydrophobicContact CG-CD1 4.31Å; E240-L268 HydrophobicContact CG-CG 3.71Å; E240-L268 VanDerWaalsContact OE1-CB 3.31Å; E240-L268 WeakPolarHBondContact OE1-CB 3.35Å; E240-L268 WeakPolarHBondContact OE1-CG 3.36Å; E240-L268 PolarHBondContact OE1-N 3.24Å; E240-R338 IonicContact OE1-CZ 3.72Å; E240-R338 IonicContact OE1-NE 3.29Å; E240-R338 PolarHBondContact OE1-NE 3.48Å; E240-R338 IonicContact OE1-NH2 3.5Å; E240-R338 PolarHBondContact OE1-NH2 2.99Å; E240-R338 IonicContact OE2-CZ 3.49Å; E240-R338 IonicContact OE2-NE 3.79Å; E240-R338 IonicContact OE2-NH2 2.67Å; E240-R338 PolarHBondContact OE2-NH2 3.33Å
241	E	93.2	Very high	96.5	Very high	84 Å²	84	28.7 Å²	28.7	39%	0.393	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-58.9	-22.1	172.7	63.5	-93	-139.9	0	0	113	G239 L268	G239-E241 WeakPolarHBondContact CA-OE2 3.38Å; G239-E241 PolarHBondContact O-N 3.44Å; G239-E241 VanDerWaalsContact O-N 3.13Å; E241-L268 VanDerWaalsContact OE2-CD2 3.23Å; E241-L268 WeakPolarHBondContact OE2-CD2 3.3Å
242	W	95.8	Very high	96.4	Very high	84 Å²	84	28.7 Å²	28.7	32%	0.318	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-91.4	-2.9	177.4	-63.3	108.6	0	0	0	113.8	Y220 R238 G239 E240 T244 S245 T246	Y220-W242 HydrophobicContact CD1-CE3 4.02Å; Y220-W242 AromaticContact CD1-CH2 3.7Å; Y220-W242 HydrophobicContact CD1-CH2 3.7Å; Y220-W242 AromaticContact CD1-CZ3 3.32Å; Y220-W242 HydrophobicContact CD1-CZ3 3.32Å; Y220-W242 HydrophobicContact CD2-CH2 4.17Å; Y220-W242 HydrophobicContact CE1-CD2 4.01Å; Y220-W242 AromaticContact CE1-CE3 3.3Å; Y220-W242 HydrophobicContact CE1-CE3 3.3Å; Y220-W242 AromaticContact CE1-CH2 3.64Å; Y220-W242 HydrophobicContact CE1-CH2 3.64Å; Y220-W242 HydrophobicContact CE1-CZ2 4.31Å; Y220-W242 AromaticContact CE1-CZ3 3.09Å; Y220-W242 HydrophobicContact CE1-CZ3 3.09Å; Y220-W242 HydrophobicContact CE2-CH2 4.11Å; Y220-W242 HydrophobicContact CE2-CZ2 4.25Å; Y220-W242 HydrophobicContact CE2-CZ3 4.38Å; Y220-W242 AromaticContact CG-CH2 3.97Å; Y220-W242 HydrophobicContact CG-CH2 3.97Å; Y220-W242 HydrophobicContact CG-CZ3 4.08Å; Y220-W242 AromaticContact CZ-CD2 3.95Å; Y220-W242 AromaticContact CZ-CE3 3.73Å; Y220-W242 AromaticContact CZ-CH2 3.85Å; Y220-W242 AromaticContact CZ-CZ3 3.69Å; R238-W242 HydrophobicContact CG-CB 4.1Å; G239-W242 PolarHBondContact O-N 2.92Å; G239-W242 VanDerWaalsContact O-N 3.09Å; E240-W242 PolarHBondContact O-N 2.81Å; E240-W242 VanDerWaalsContact O-N 3.11Å; W242-T244 VanDerWaalsContact C-N 3.28Å; W242-T244 PolarHBondContact O-N 2.73Å; W242-S245 WeakPolarHBondContact O-CB 3.43Å; W242-S245 PolarHBondContact O-N 2.86Å; W242-T246 PolarHBondContact O-N 2.86Å; W242-T246 PolarHBondContact O-OG1 2.97Å
243	L	94.9	Very high	96.4	Very high	19 Å²	19	23 Å²	23	10%	0.099	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-57.7	-43.2	-177.4	-171.9	70.4	0	0	0	111.1	F190 F200 E240 S245 T246 H265	F190-L243 HydrophobicContact CE2-CD1 4.03Å; F190-L243 HydrophobicContact CZ-CD1 3.65Å; F190-L243 HydrophobicContact CZ-CG 4.39Å; F200-L243 HydrophobicContact CE2-CG 4.36Å; F200-L243 HydrophobicContact CZ-CD2 4.33Å; F200-L243 HydrophobicContact CZ-CG 4.08Å; E240-L243 WeakPolarHBondContact O-CB 3.32Å; E240-L243 PolarHBondContact O-N 2.96Å; L243-S245 PolarHBondContact O-N 3.48Å; L243-T246 VanDerWaalsContact O-CB 3.32Å; L243-T246 WeakPolarHBondContact O-CB 3.35Å; L243-T246 PolarHBondContact O-N 2.82Å; L243-T246 PolarHBondContact O-OG1 3.31Å; L243-H265 HydrophobicContact CD1-CB 4.02Å; L243-H265 WeakPolarHBondContact CD1-ND1 3.45Å; L243-H265 PolarHBondContact N-CD2 3.32Å
244	T	93	Very high	96.3	Very high	94 Å²	94	26.3 Å²	26.3	58%	0.577	13%	0.133	S	C	*	.	G	3₁₀ helix	trans	-68.4	-16.1	178.8	60.6	0	0	0	0	114	F200 W242 P247	F200-T244 HydrophobicContact CE1-CG2 4.13Å; W242-T244 VanDerWaalsContact C-N 3.28Å; W242-T244 PolarHBondContact O-N 2.73Å; T244-P247 WeakPolarHBondContact O-CD 3.42Å
245	S	94.9	Very high	96.2	Very high	14 Å²	14	25.8 Å²	25.8	10%	0.098	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-88.3	-17.2	176.5	-63.2	0	0	0	0	112.8	H221 W242 L243 P247 I248 H249	H221-S245 PolarHBondContact CE1-OG 3.31Å; W242-S245 WeakPolarHBondContact O-CB 3.43Å; W242-S245 PolarHBondContact O-N 2.86Å; L243-S245 PolarHBondContact O-N 3.48Å; S245-P247 VanDerWaalsContact C-CD 3.46Å; S245-I248 WeakPolarHBondContact O-CB 3.47Å; S245-I248 PolarHBondContact O-N 3.19Å; S245-I248 VanDerWaalsContact O-N 3.09Å; S245-H249 PolarHBondContact O-N 2.92Å
246	T	97	Very high	96.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.7	-39.7	-178.6	-48.4	0	0	0	0	113.2	F190 R238 W242 L243 I248 H249 L250 F263 H265	F190-T246 HydrophobicContact CD1-CG2 4.18Å; F190-T246 HydrophobicContact CD2-CG2 4.07Å; F190-T246 HydrophobicContact CE1-CG2 3.92Å; F190-T246 HydrophobicContact CE2-CG2 3.82Å; F190-T246 HydrophobicContact CG-CG2 4.24Å; F190-T246 HydrophobicContact CZ-CG2 3.74Å; R238-T246 PolarHBondContact NH2-OG1 2.92Å; R238-T246 VanDerWaalsContact NH2-OG1 3.13Å; W242-T246 PolarHBondContact O-N 2.86Å; W242-T246 PolarHBondContact O-OG1 2.97Å; L243-T246 VanDerWaalsContact O-CB 3.32Å; L243-T246 WeakPolarHBondContact O-CB 3.35Å; L243-T246 PolarHBondContact O-N 2.82Å; L243-T246 PolarHBondContact O-OG1 3.31Å; T246-I248 VanDerWaalsContact C-N 3.3Å; T246-I248 PolarHBondContact O-N 2.8Å; T246-H249 WeakPolarHBondContact O-CB 3.24Å; T246-H249 PolarHBondContact O-N 3.47Å; T246-H249 VanDerWaalsContact O-N 3.09Å; T246-L250 HydrophobicContact CG2-CD1 4.08Å; T246-L250 HydrophobicContact CG2-CG 4.18Å; T246-L250 WeakPolarHBondContact O-CG 3.46Å; T246-L250 PolarHBondContact O-N 2.94Å; T246-F263 HydrophobicContact CG2-CD1 4.23Å; T246-F263 HydrophobicContact CG2-CD2 4.1Å; T246-F263 HydrophobicContact CG2-CE1 4.32Å; T246-F263 HydrophobicContact CG2-CE2 4.18Å; T246-F263 HydrophobicContact CG2-CG 4.12Å; T246-F263 HydrophobicContact CG2-CZ 4.3Å; T246-H265 PolarHBondContact OG1-CE1 2.98Å; T246-H265 PolarHBondContact OG1-NE2 3.14Å
247	P	95.1	Very high	96.1	Very high	5 Å²	5	32 Å²	32	3%	0.032	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-38.5	174.7	-26.3	35.8	0	0	0	114.1	V188 F200 V202 T244 S245 L250 Q251	V188-P247 HydrophobicContact CB-CB 4.07Å; V188-P247 HydrophobicContact CG1-CB 4.17Å; V188-P247 HydrophobicContact CG2-CB 4.32Å; F200-P247 HydrophobicContact CB-CB 4.3Å; F200-P247 HydrophobicContact CB-CG 3.44Å; F200-P247 VanDerWaalsContact CB-CG 3.44Å; F200-P247 HydrophobicContact CD1-CG 4.46Å; F200-P247 HydrophobicContact CD2-CG 3.65Å; F200-P247 HydrophobicContact CG-CG 3.6Å; V202-P247 HydrophobicContact CG2-CB 3.8Å; T244-P247 WeakPolarHBondContact O-CD 3.42Å; S245-P247 VanDerWaalsContact C-CD 3.46Å; P247-L250 PolarHBondContact O-N 3Å; P247-Q251 WeakPolarHBondContact O-CG 3.32Å; P247-Q251 PolarHBondContact O-N 3.06Å
248	I	94.9	Very high	96.1	Very high	30 Å²	30	34.8 Å²	34.8	15%	0.154	17%	0.169	C	C	.	.	H	α-helix	trans	-65.3	-44.3	175.7	-59.8	171.3	0	0	0	109.6	L181 P209 H221 S245 T246 L250 Q251 L252	L181-I248 HydrophobicContact CD2-CG2 4.11Å; P209-I248 HydrophobicContact CG-CD1 4.38Å; P209-I248 HydrophobicContact CG-CG2 4.07Å; H221-I248 HydrophobicContact CB-CG2 4.27Å; S245-I248 WeakPolarHBondContact O-CB 3.47Å; S245-I248 PolarHBondContact O-N 3.19Å; S245-I248 VanDerWaalsContact O-N 3.09Å; T246-I248 VanDerWaalsContact C-N 3.3Å; T246-I248 PolarHBondContact O-N 2.8Å; I248-L250 PolarHBondContact O-N 3.2Å; I248-Q251 PolarHBondContact O-N 2.92Å; I248-L252 HydrophobicContact CG2-CD1 4.42Å; I248-L252 WeakPolarHBondContact O-CG 3.45Å; I248-L252 PolarHBondContact O-N 2.9Å
249	H	97.6	Very high	96.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-41.6	178.1	-60.9	161.7	0	0	0	112	Y220 H221 V225 R238 S245 T246 L252 Y253	Y220-H249 AromaticContact CE1-CE1 3.62Å; Y220-H249 AromaticContact CE1-NE2 3.76Å; H221-H249 AromaticContact CG-NE2 4Å; H221-H249 AromaticContact ND1-CD2 3.83Å; H221-H249 AromaticContact ND1-NE2 3.29Å; H221-H249 PolarHBondContact ND1-NE2 3.33Å; V225-H249 HydrophobicContact CG2-CB 3.72Å; R238-H249 PolarHBondContact NH1-CE1 3.25Å; R238-H249 PolarHBondContact NH1-ND1 3.46Å; R238-H249 PolarHBondContact NH2-ND1 2.86Å; S245-H249 PolarHBondContact O-N 2.92Å; T246-H249 WeakPolarHBondContact O-CB 3.24Å; T246-H249 PolarHBondContact O-N 3.47Å; T246-H249 VanDerWaalsContact O-N 3.09Å; H249-L252 WeakPolarHBondContact O-CB 3.42Å; H249-L252 PolarHBondContact O-N 3.46Å; H249-L252 VanDerWaalsContact O-N 3.16Å; H249-Y253 WeakPolarHBondContact O-CD2 3.48Å; H249-Y253 PolarHBondContact O-N 3.23Å
250	L	97.3	Very high	96.2	Very high	29 Å²	29	45.1 Å²	45.1	15%	0.152	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-40.4	176.7	-68.1	171.9	0	0	0	112.3	V188 F190 T246 P247 I248 L252 Y253 E254 P260 F263	V188-L250 HydrophobicContact CG1-CB 4.24Å; V188-L250 HydrophobicContact CG1-CD1 3.69Å; F190-L250 HydrophobicContact CB-CD1 3.67Å; F190-L250 HydrophobicContact CD1-CD1 3.9Å; F190-L250 HydrophobicContact CG-CD1 3.95Å; T246-L250 HydrophobicContact CG2-CD1 4.08Å; T246-L250 HydrophobicContact CG2-CG 4.18Å; T246-L250 WeakPolarHBondContact O-CG 3.46Å; T246-L250 PolarHBondContact O-N 2.94Å; P247-L250 PolarHBondContact O-N 3Å; I248-L250 PolarHBondContact O-N 3.2Å; L250-L252 VanDerWaalsContact C-N 3.28Å; L250-L252 PolarHBondContact O-N 3.28Å; L250-Y253 PolarHBondContact O-N 3.45Å; L250-E254 WeakPolarHBondContact O-CB 3.42Å; L250-E254 PolarHBondContact O-N 3.28Å; L250-P260 HydrophobicContact CD2-CB 3.79Å; L250-P260 HydrophobicContact CD2-CG 3.94Å; L250-F263 HydrophobicContact CD2-CE2 4Å
251	Q	95.7	Very high	96.4	Very high	9 Å²	9	44.6 Å²	44.6	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-32.3	172.7	-71.9	-164.8	22.5	0	0	112.4	L181 K184 V202 P247 I248 A255	L181-Q251 HydrophobicContact CD2-CB 4.26Å; K184-Q251 VanDerWaalsContact N-OE1 3.08Å; K184-Q251 PolarHBondContact O-NE2 3.31Å; K184-Q251 VanDerWaalsContact O-NE2 3.1Å; V202-Q251 VanDerWaalsContact CG1-NE2 3.33Å; P247-Q251 WeakPolarHBondContact O-CG 3.32Å; P247-Q251 PolarHBondContact O-N 3.06Å; I248-Q251 PolarHBondContact O-N 2.92Å; Q251-A255 VanDerWaalsContact O-CB 3.29Å; Q251-A255 WeakPolarHBondContact O-CB 3.48Å; Q251-A255 PolarHBondContact O-N 3.48Å
252	L	97.2	Very high	96.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-47.1	172.5	-73.2	168.3	0	0	0	111.8	L123 L181 L211 H221 F222 V225 I248 H249 L250 E254 A255 F256	L123-L252 HydrophobicContact CD1-CD2 4.3Å; L181-L252 HydrophobicContact CD1-CD2 3.86Å; L181-L252 HydrophobicContact CD2-CD2 4.18Å; L181-L252 HydrophobicContact CD2-CG 4.13Å; L211-L252 HydrophobicContact CD1-CD2 3.63Å; L211-L252 HydrophobicContact CD2-CD1 3.95Å; L211-L252 HydrophobicContact CD2-CD2 3.93Å; L211-L252 HydrophobicContact CD2-CG 4.44Å; L211-L252 HydrophobicContact CG-CD2 4.43Å; H221-L252 HydrophobicContact CB-CD1 4.39Å; H221-L252 WeakPolarHBondContact O-CD1 3.21Å; F222-L252 HydrophobicContact CD2-CD2 4.29Å; V225-L252 HydrophobicContact CB-CB 4.39Å; V225-L252 HydrophobicContact CB-CD1 4.37Å; V225-L252 HydrophobicContact CG1-CB 3.95Å; V225-L252 HydrophobicContact CG2-CB 4.19Å; V225-L252 HydrophobicContact CG2-CD1 3.96Å; I248-L252 HydrophobicContact CG2-CD1 4.42Å; I248-L252 WeakPolarHBondContact O-CG 3.45Å; I248-L252 PolarHBondContact O-N 2.9Å; H249-L252 WeakPolarHBondContact O-CB 3.42Å; H249-L252 PolarHBondContact O-N 3.46Å; H249-L252 VanDerWaalsContact O-N 3.16Å; L250-L252 VanDerWaalsContact C-N 3.28Å; L250-L252 PolarHBondContact O-N 3.28Å; L252-E254 VanDerWaalsContact C-N 3.28Å; L252-E254 PolarHBondContact O-N 2.83Å; L252-A255 WeakPolarHBondContact O-CB 3.49Å; L252-A255 PolarHBondContact O-N 3.2Å; L252-A255 VanDerWaalsContact O-N 3.13Å; L252-F256 VanDerWaalsContact O-CD2 3.24Å; L252-F256 WeakPolarHBondContact O-CD2 3.49Å; L252-F256 PolarHBondContact O-N 3.33Å
253	Y	98	Very high	96.7	Very high	4 Å²	4	40 Å²	40	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-56.3	-43.9	172.8	-79.8	-71.5	0	0	0	111.3	V225 D228 H229 H249 L250 A255 F256 Q257 W258 P260 P261 F263	V225-Y253 HydrophobicContact CB-CE2 4.47Å; V225-Y253 HydrophobicContact CG1-CD1 4.2Å; V225-Y253 HydrophobicContact CG1-CD2 4.07Å; V225-Y253 HydrophobicContact CG1-CE1 4.02Å; V225-Y253 HydrophobicContact CG1-CE2 3.89Å; V225-Y253 HydrophobicContact CG1-CG 4.2Å; V225-Y253 HydrophobicContact CG2-CE2 4.12Å; D228-Y253 WeakPolarHBondContact CB-OH 3.35Å; H229-Y253 HydrophobicContact CB-CE1 4.39Å; H249-Y253 WeakPolarHBondContact O-CD2 3.48Å; H249-Y253 PolarHBondContact O-N 3.23Å; L250-Y253 PolarHBondContact O-N 3.45Å; Y253-A255 PolarHBondContact O-N 3.25Å; Y253-F256 PolarHBondContact O-N 3.2Å; Y253-Q257 PolarHBondContact O-N 2.88Å; Y253-W258 HydrophobicContact CD1-CB 3.8Å; Y253-W258 HydrophobicContact CD1-CE3 4.32Å; Y253-W258 HydrophobicContact CE1-CE3 4.48Å; Y253-W258 PolarHBondContact O-N 3.15Å; Y253-P260 HydrophobicContact CD1-CB 4.37Å; Y253-P260 HydrophobicContact CD2-CB 3.77Å; Y253-P260 HydrophobicContact CE2-CB 4.2Å; Y253-P260 HydrophobicContact CG-CB 3.89Å; Y253-P261 HydrophobicContact CE2-CG 4.45Å; Y253-P261 VanDerWaalsContact OH-CD 3.3Å; Y253-P261 WeakPolarHBondContact OH-CD 3.46Å; Y253-F263 HydrophobicContact CE2-CZ 4.32Å
254	E	96.6	Very high	96.9	Very high	83 Å²	83	39.1 Å²	39.1	39%	0.388	20%	0.199	S	C	.	.	H	α-helix	trans	-61.4	-42.5	174.9	-168.4	-164.5	155.6	0	0	112.1	K184 L250 L252 F256 Q257	K184-E254 IonicContact NZ-OE1 3.77Å; K184-E254 PolarHBondContact NZ-OE1 2.77Å; L250-E254 WeakPolarHBondContact O-CB 3.42Å; L250-E254 PolarHBondContact O-N 3.28Å; L252-E254 VanDerWaalsContact C-N 3.28Å; L252-E254 PolarHBondContact O-N 2.83Å; E254-F256 VanDerWaalsContact C-N 3.32Å; E254-F256 PolarHBondContact O-N 3.29Å; E254-Q257 PolarHBondContact O-N 3.27Å
255	A	96.8	Very high	97.1	Very high	8 Å²	8	34.6 Å²	34.6	7%	0.066	17%	0.171	C	C	.	.	H	α-helix	trans	-62.3	-38.4	179.7	0	0	0	0	0	112.7	L123 K128 Q251 L252 Y253 Q257	L123-A255 HydrophobicContact CD2-CB 3.97Å; K128-A255 HydrophobicContact CB-CB 3.95Å; K128-A255 HydrophobicContact CD-CB 4.4Å; K128-A255 HydrophobicContact CG-CB 3.94Å; Q251-A255 VanDerWaalsContact O-CB 3.29Å; Q251-A255 WeakPolarHBondContact O-CB 3.48Å; Q251-A255 PolarHBondContact O-N 3.48Å; L252-A255 WeakPolarHBondContact O-CB 3.49Å; L252-A255 PolarHBondContact O-N 3.2Å; L252-A255 VanDerWaalsContact O-N 3.13Å; Y253-A255 PolarHBondContact O-N 3.25Å; A255-Q257 VanDerWaalsContact C-N 3.32Å
256	F	97.7	Very high	97.1	Very high	6 Å²	6	34 Å²	34	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-81.2	-9.7	173	-73.1	-71.9	0	0	0	113.8	A119 L123 F222 I226 L252 Y253 E254 W258	A119-F256 HydrophobicContact CB-CE1 4.06Å; A119-F256 HydrophobicContact CB-CZ 3.9Å; L123-F256 HydrophobicContact CD1-CD2 4.38Å; L123-F256 HydrophobicContact CD1-CE1 4.12Å; L123-F256 HydrophobicContact CD1-CE2 3.64Å; L123-F256 HydrophobicContact CD1-CZ 3.48Å; L123-F256 VanDerWaalsContact CD1-CZ 3.48Å; L123-F256 HydrophobicContact CD2-CD1 3.64Å; L123-F256 HydrophobicContact CD2-CD2 4.17Å; L123-F256 HydrophobicContact CD2-CE1 3.54Å; L123-F256 HydrophobicContact CD2-CE2 4.09Å; L123-F256 HydrophobicContact CD2-CG 3.95Å; L123-F256 HydrophobicContact CD2-CZ 3.77Å; L123-F256 HydrophobicContact CG-CD1 4.18Å; L123-F256 HydrophobicContact CG-CE1 3.53Å; L123-F256 HydrophobicContact CG-CE2 4Å; L123-F256 HydrophobicContact CG-CZ 3.42Å; L123-F256 VanDerWaalsContact CG-CZ 3.42Å; F222-F256 HydrophobicContact CE2-CE2 4.21Å; F222-F256 HydrophobicContact CE2-CZ 4.01Å; F222-F256 HydrophobicContact CZ-CZ 4.3Å; I226-F256 HydrophobicContact CG1-CE2 4.38Å; I226-F256 HydrophobicContact CG1-CZ 4.39Å; L252-F256 VanDerWaalsContact O-CD2 3.24Å; L252-F256 WeakPolarHBondContact O-CD2 3.49Å; L252-F256 PolarHBondContact O-N 3.33Å; Y253-F256 PolarHBondContact O-N 3.2Å; E254-F256 VanDerWaalsContact C-N 3.32Å; E254-F256 PolarHBondContact O-N 3.29Å; F256-W258 HydrophobicContact CB-CB 4.37Å; F256-W258 HydrophobicContact CB-CD2 3.33Å; F256-W258 VanDerWaalsContact CB-CE2 3.5Å; F256-W258 HydrophobicContact CB-CE3 3.61Å; F256-W258 HydrophobicContact CB-CG 3.69Å; F256-W258 HydrophobicContact CB-CH2 4.17Å; F256-W258 HydrophobicContact CB-CZ2 3.93Å; F256-W258 HydrophobicContact CB-CZ3 4.02Å; F256-W258 AromaticContact CD1-CH2 3.68Å; F256-W258 HydrophobicContact CD1-CH2 3.68Å; F256-W258 AromaticContact CD1-CZ2 3.65Å; F256-W258 HydrophobicContact CD1-CZ2 3.65Å; F256-W258 HydrophobicContact CD1-CZ3 4.17Å; F256-W258 HydrophobicContact CD2-CD2 4.4Å; F256-W258 AromaticContact CD2-CE3 3.8Å; F256-W258 HydrophobicContact CD2-CE3 3.8Å; F256-W258 AromaticContact CD2-CH2 3.88Å; F256-W258 HydrophobicContact CD2-CH2 3.88Å; F256-W258 HydrophobicContact CD2-CZ2 4.45Å; F256-W258 AromaticContact CD2-CZ3 3.51Å; F256-W258 HydrophobicContact CD2-CZ3 3.51Å; F256-W258 AromaticContact CE1-CH2 3.95Å; F256-W258 HydrophobicContact CE1-CH2 3.95Å; F256-W258 HydrophobicContact CE1-CZ2 4.25Å; F256-W258 HydrophobicContact CE2-CH2 4.14Å; F256-W258 AromaticContact CE2-CZ3 3.95Å; F256-W258 HydrophobicContact CE2-CZ3 3.95Å; F256-W258 AromaticContact CG-CD2 3.91Å; F256-W258 HydrophobicContact CG-CD2 3.91Å; F256-W258 AromaticContact CG-CE2 3.9Å; F256-W258 AromaticContact CG-CE3 3.78Å; F256-W258 HydrophobicContact CG-CE3 3.78Å; F256-W258 AromaticContact CG-CH2 3.65Å; F256-W258 HydrophobicContact CG-CH2 3.65Å; F256-W258 AromaticContact CG-CZ2 3.78Å; F256-W258 HydrophobicContact CG-CZ2 3.78Å; F256-W258 AromaticContact CG-CZ3 3.65Å; F256-W258 HydrophobicContact CG-CZ3 3.65Å; F256-W258 HydrophobicContact CZ-CH2 4.18Å; F256-W258 HydrophobicContact CZ-CZ3 4.45Å; F256-W258 PolarHBondContact O-N 2.92Å
257	Q	97.5	Very high	97	Very high	161 Å²	161	34 Å²	34	75%	0.752	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	34.5	-170.7	-52.4	175.1	4.6	0	0	112.7	Y253 E254 A255	Y253-Q257 PolarHBondContact O-N 2.88Å; E254-Q257 PolarHBondContact O-N 3.27Å; A255-Q257 VanDerWaalsContact C-N 3.32Å
258	W	97.9	Very high	96.8	Very high	60 Å²	60	35.1 Å²	35.1	23%	0.227	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-95.6	149.9	176.6	-66.2	-17	0	0	0	111.2	I226 H229 Y253 F256	I226-W258 HydrophobicContact CG1-CZ3 4.46Å; H229-W258 HydrophobicContact CB-CD2 4.21Å; H229-W258 HydrophobicContact CB-CE3 3.61Å; H229-W258 HydrophobicContact CB-CH2 4.41Å; H229-W258 HydrophobicContact CB-CZ3 3.72Å; H229-W258 AromaticContact CD2-CD2 3.56Å; H229-W258 AromaticContact CD2-CE2 3.43Å; H229-W258 VanDerWaalsContact CD2-CE2 3.43Å; H229-W258 AromaticContact CD2-CE3 3.76Å; H229-W258 AromaticContact CD2-CH2 3.77Å; H229-W258 AromaticContact CD2-CZ2 3.56Å; H229-W258 AromaticContact CD2-CZ3 3.87Å; H229-W258 AromaticContact CE1-CD1 3.63Å; H229-W258 AromaticContact CE1-CD2 3.68Å; H229-W258 AromaticContact CE1-CE2 3.86Å; H229-W258 AromaticContact CE1-CG 3.55Å; H229-W258 AromaticContact CE1-NE1 3.79Å; H229-W258 AromaticContact CG-CD2 3.52Å; H229-W258 AromaticContact CG-CE2 3.92Å; H229-W258 AromaticContact CG-CE3 3.45Å; H229-W258 VanDerWaalsContact CG-CE3 3.45Å; H229-W258 AromaticContact CG-CZ3 3.81Å; H229-W258 AromaticContact ND1-CD2 3.6Å; H229-W258 AromaticContact ND1-CE3 3.89Å; H229-W258 AromaticContact ND1-CG 3.66Å; H229-W258 AromaticContact NE2-CD1 3.82Å; H229-W258 AromaticContact NE2-CD2 3.67Å; H229-W258 AromaticContact NE2-CE2 3.4Å; H229-W258 AromaticContact NE2-CG 3.94Å; H229-W258 AromaticContact NE2-CZ2 3.89Å; H229-W258 AromaticContact NE2-NE1 3.48Å; H229-W258 PolarHBondContact NE2-NE1 3.36Å; Y253-W258 HydrophobicContact CD1-CB 3.8Å; Y253-W258 HydrophobicContact CD1-CE3 4.32Å; Y253-W258 HydrophobicContact CE1-CE3 4.48Å; Y253-W258 PolarHBondContact O-N 3.15Å; F256-W258 HydrophobicContact CB-CB 4.37Å; F256-W258 HydrophobicContact CB-CD2 3.33Å; F256-W258 VanDerWaalsContact CB-CE2 3.5Å; F256-W258 HydrophobicContact CB-CE3 3.61Å; F256-W258 HydrophobicContact CB-CG 3.69Å; F256-W258 HydrophobicContact CB-CH2 4.17Å; F256-W258 HydrophobicContact CB-CZ2 3.93Å; F256-W258 HydrophobicContact CB-CZ3 4.02Å; F256-W258 AromaticContact CD1-CH2 3.68Å; F256-W258 HydrophobicContact CD1-CH2 3.68Å; F256-W258 AromaticContact CD1-CZ2 3.65Å; F256-W258 HydrophobicContact CD1-CZ2 3.65Å; F256-W258 HydrophobicContact CD1-CZ3 4.17Å; F256-W258 HydrophobicContact CD2-CD2 4.4Å; F256-W258 AromaticContact CD2-CE3 3.8Å; F256-W258 HydrophobicContact CD2-CE3 3.8Å; F256-W258 AromaticContact CD2-CH2 3.88Å; F256-W258 HydrophobicContact CD2-CH2 3.88Å; F256-W258 HydrophobicContact CD2-CZ2 4.45Å; F256-W258 AromaticContact CD2-CZ3 3.51Å; F256-W258 HydrophobicContact CD2-CZ3 3.51Å; F256-W258 AromaticContact CE1-CH2 3.95Å; F256-W258 HydrophobicContact CE1-CH2 3.95Å; F256-W258 HydrophobicContact CE1-CZ2 4.25Å; F256-W258 HydrophobicContact CE2-CH2 4.14Å; F256-W258 AromaticContact CE2-CZ3 3.95Å; F256-W258 HydrophobicContact CE2-CZ3 3.95Å; F256-W258 AromaticContact CG-CD2 3.91Å; F256-W258 HydrophobicContact CG-CD2 3.91Å; F256-W258 AromaticContact CG-CE2 3.9Å; F256-W258 AromaticContact CG-CE3 3.78Å; F256-W258 HydrophobicContact CG-CE3 3.78Å; F256-W258 AromaticContact CG-CH2 3.65Å; F256-W258 HydrophobicContact CG-CH2 3.65Å; F256-W258 AromaticContact CG-CZ2 3.78Å; F256-W258 HydrophobicContact CG-CZ2 3.78Å; F256-W258 AromaticContact CG-CZ3 3.65Å; F256-W258 HydrophobicContact CG-CZ3 3.65Å; F256-W258 HydrophobicContact CZ-CH2 4.18Å; F256-W258 HydrophobicContact CZ-CZ3 4.45Å; F256-W258 PolarHBondContact O-N 2.92Å
259	K	97.1	Very high	96.4	Very high	175 Å²	175	34.1 Å²	34.1	76%	0.761	17%	0.168	S	C	*	.	P	Polyproline II helix	trans	-77.7	125.9	170.7	-174.7	179.2	177.4	-178.8	0	109.5
260	P	97.8	Very high	95.8	Very high	54 Å²	54	35.3 Å²	35.3	35%	0.351	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-70.3	154.8	176.7	28.8	-34.6	0	0	0	112	L250 Y253 F263	L250-P260 HydrophobicContact CD2-CB 3.79Å; L250-P260 HydrophobicContact CD2-CG 3.94Å; Y253-P260 HydrophobicContact CD1-CB 4.37Å; Y253-P260 HydrophobicContact CD2-CB 3.77Å; Y253-P260 HydrophobicContact CE2-CB 4.2Å; Y253-P260 HydrophobicContact CG-CB 3.89Å; P260-F263 HydrophobicContact CB-CE2 4.19Å
261	P	98.1	Very high	94.9	Very high	15 Å²	15	34.3 Å²	34.3	10%	0.097	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-68.6	169.2	169.3	30.9	-35.2	0	0	0	111.2	S234 V236 Y253 F263	S234-P261 WeakPolarHBondContact O-CA 3.3Å; S234-P261 WeakPolarHBondContact O-CB 3.4Å; V236-P261 HydrophobicContact CB-CG 4.43Å; V236-P261 HydrophobicContact CG2-CB 4.02Å; V236-P261 HydrophobicContact CG2-CG 3.52Å; Y253-P261 HydrophobicContact CE2-CG 4.45Å; Y253-P261 VanDerWaalsContact OH-CD 3.3Å; Y253-P261 WeakPolarHBondContact OH-CD 3.46Å; P261-F263 HydrophobicContact CG-CE1 4.36Å; P261-F263 HydrophobicContact CG-CE2 4.15Å; P261-F263 HydrophobicContact CG-CZ 3.89Å; P261-F263 WeakPolarHBondContact O-CD2 3.34Å; P261-F263 WeakPolarHBondContact O-CE2 3.35Å
262	V	98	Very high	94	Very high	64 Å²	64	38.4 Å²	38.4	39%	0.388	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.6	168.4	176.9	0	0	0	0	109.2	V193 S234 H235 V236	V193-V262 HydrophobicContact CG2-CG1 3.4Å; S234-V262 PolarHBondContact O-N 3.47Å; H235-V262 CarbonylContact C-O 3.47Å; H235-V262 VanDerWaalsContact CA-O 3.25Å; H235-V262 WeakPolarHBondContact CA-O 3.48Å; V236-V262 PolarHBondContact N-O 3.42Å
263	F	98.3	Very high	93	Very high	7 Å²	7	43 Å²	43	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	139.3	179.3	-70.5	-83.3	0	0	0	111.9	V193 V236 T246 L250 Y253 P260 P261	V193-F263 WeakPolarHBondContact CG2-O 3.42Å; V193-F263 PolarHBondContact N-O 3.15Å; V236-F263 HydrophobicContact CB-CD1 3.74Å; V236-F263 HydrophobicContact CB-CE1 3.87Å; V236-F263 HydrophobicContact CG1-CD1 3.79Å; V236-F263 HydrophobicContact CG1-CE1 3.87Å; V236-F263 HydrophobicContact CG2-CD1 4.48Å; V236-F263 HydrophobicContact CG2-CE1 4.14Å; T246-F263 HydrophobicContact CG2-CD1 4.23Å; T246-F263 HydrophobicContact CG2-CD2 4.1Å; T246-F263 HydrophobicContact CG2-CE1 4.32Å; T246-F263 HydrophobicContact CG2-CE2 4.18Å; T246-F263 HydrophobicContact CG2-CG 4.12Å; T246-F263 HydrophobicContact CG2-CZ 4.3Å; L250-F263 HydrophobicContact CD2-CE2 4Å; Y253-F263 HydrophobicContact CE2-CZ 4.32Å; P260-F263 HydrophobicContact CB-CE2 4.19Å; P261-F263 HydrophobicContact CG-CE1 4.36Å; P261-F263 HydrophobicContact CG-CE2 4.15Å; P261-F263 HydrophobicContact CG-CZ 3.89Å; P261-F263 WeakPolarHBondContact O-CD2 3.34Å; P261-F263 WeakPolarHBondContact O-CE2 3.35Å
264	A	97.7	Very high	91.8	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	111.4	172.9	0	0	0	0	0	109.5	D192 V193 V194 V236 L237 R238 L331	D192-A264 WeakPolarHBondContact OD2-CA 3.43Å; V193-A264 HydrophobicContact CB-CB 3.96Å; V193-A264 HydrophobicContact CG2-CB 4.38Å; V194-A264 HydrophobicContact CG2-CB 4.26Å; V236-A264 PolarHBondContact O-N 2.75Å; L237-A264 WeakPolarHBondContact CA-O 3.38Å; L237-A264 HydrophobicContact CD1-CB 4.1Å; L237-A264 HydrophobicContact CG-CB 3.94Å; R238-A264 PolarHBondContact N-O 3.42Å; A264-L331 HydrophobicContact CB-CD1 4.04Å; A264-L331 HydrophobicContact CB-CD2 3.86Å; A264-L331 HydrophobicContact CB-CG 4.24Å
265	H	97.5	Very high	90.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.7	-178.5	-70.6	84.4	0	0	0	111.3	D192 V194 Y195 R238 G239 E240 L243 T246	D192-H265 PolarHBondContact OD1-N 3.32Å; D192-H265 IonicContact OD2-CE1 2.7Å; D192-H265 IonicContact OD2-CG 2.77Å; D192-H265 PolarHBondContact OD2-N 3.39Å; D192-H265 IonicContact OD2-ND1 3.27Å; D192-H265 PolarHBondContact OD2-ND1 2.98Å; V194-H265 WeakPolarHBondContact CB-O 3.43Å; V194-H265 WeakPolarHBondContact CG1-O 3.36Å; Y195-H265 HydrophobicContact CD2-CB 3.97Å; Y195-H265 WeakPolarHBondContact CD2-O 3.41Å; Y195-H265 HydrophobicContact CE2-CB 3.93Å; Y195-H265 WeakPolarHBondContact CE2-O 3.31Å; R238-H265 PolarHBondContact NE-NE2 3.25Å; R238-H265 CarbonylContact O-C 3.52Å; R238-H265 VanDerWaalsContact O-CA 3.29Å; R238-H265 WeakPolarHBondContact O-CA 3.4Å; G239-H265 PolarHBondContact O-CD2 3.44Å; E240-H265 HydrophobicContact CB-CB 4.49Å; L243-H265 HydrophobicContact CD1-CB 4.02Å; L243-H265 WeakPolarHBondContact CD1-ND1 3.45Å; L243-H265 PolarHBondContact N-CD2 3.32Å; T246-H265 PolarHBondContact OG1-CE1 2.98Å; T246-H265 PolarHBondContact OG1-NE2 3.14Å
266	L	95.6	Very high	89.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	128.9	-176.5	-53.3	-179.3	0	0	0	110.1	R47 T48 F51 R238 G239 E240 V334	R47-L266 VanDerWaalsContact NH2-CB 3.31Å; R47-L266 PolarHBondContact NH2-O 3.24Å; T48-L266 HydrophobicContact CG2-CD1 4.45Å; F51-L266 HydrophobicContact CB-CD1 4.17Å; F51-L266 HydrophobicContact CD2-CD1 3.95Å; F51-L266 HydrophobicContact CD2-CD2 3.76Å; F51-L266 HydrophobicContact CD2-CG 4.5Å; F51-L266 HydrophobicContact CE2-CD2 4.38Å; F51-L266 HydrophobicContact CG-CD1 4.35Å; R238-L266 PolarHBondContact O-N 3.27Å; G239-L266 CarbonylContact C-O 3.57Å; G239-L266 WeakPolarHBondContact CA-O 3.42Å; E240-L266 PolarHBondContact N-O 2.91Å; L266-V334 HydrophobicContact CD2-CG1 4.22Å
267	P	93.8	Very high	87.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-61.4	148.4	-176.7	29.9	-40	0	0	0	112.3	R47 Y195 A335 R338	R47-P267 PolarHBondContact NH1-O 3.17Å; R47-P267 PolarHBondContact NH2-O 3.17Å; Y195-P267 WeakPolarHBondContact OH-CA 3.36Å; Y195-P267 WeakPolarHBondContact OH-CB 3.48Å; P267-A335 WeakPolarHBondContact CG-O 3.44Å; P267-R338 HydrophobicContact CB-CG 4.29Å
268	L	91.1	Very high	85.9	Confident	29 Å²	29	44.7 Å²	44.7	15%	0.152	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-63.9	142.5	178.1	-73.4	170.9	0	0	0	111.3	E240 E241 R338 P339	E240-L268 HydrophobicContact CG-CB 4.43Å; E240-L268 HydrophobicContact CG-CD1 4.31Å; E240-L268 HydrophobicContact CG-CG 3.71Å; E240-L268 VanDerWaalsContact OE1-CB 3.31Å; E240-L268 WeakPolarHBondContact OE1-CB 3.35Å; E240-L268 WeakPolarHBondContact OE1-CG 3.36Å; E240-L268 PolarHBondContact OE1-N 3.24Å; E241-L268 VanDerWaalsContact OE2-CD2 3.23Å; E241-L268 WeakPolarHBondContact OE2-CD2 3.3Å; L268-R338 WeakPolarHBondContact O-CA 3.44Å; L268-R338 VanDerWaalsContact O-CB 3.28Å; L268-R338 WeakPolarHBondContact O-CB 3.23Å; L268-P339 WeakPolarHBondContact O-CD 3.15Å
269	I	88.1	Confident	83.9	Confident	10 Å²	10	49.4 Å²	49.4	5%	0.051	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-81.5	130	171.5	-54.4	177.3	0	0	0	108.7	L43 R47 V277 A306 P339 L341	L43-I269 HydrophobicContact CG-CD1 4.13Å; R47-I269 HydrophobicContact CB-CD1 4.19Å; I269-V277 HydrophobicContact CG2-CG2 3.99Å; I269-A306 HydrophobicContact CD1-CB 3.8Å; I269-A306 HydrophobicContact CG1-CB 4.18Å; I269-P339 HydrophobicContact CG1-CG 4.24Å; I269-L341 HydrophobicContact CD1-CD1 4.24Å; I269-L341 HydrophobicContact CG2-CB 4.44Å; I269-L341 HydrophobicContact CG2-CD1 3.54Å; I269-L341 HydrophobicContact CG2-CG 3.83Å
270	L	85.1	Confident	81.6	Confident	27 Å²	27	52.5 Å²	52.5	14%	0.141	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-105.5	150.7	177.6	-56.9	178.7	0	0	0	111	A275 V277 R338 P339 K340 L341	L270-A275 CarbonylContact C-O 3.56Å; L270-A275 VanDerWaalsContact CA-O 3.3Å; L270-A275 WeakPolarHBondContact CA-O 3.37Å; L270-V277 VanDerWaalsContact C-CG2 3.43Å; L270-R338 HydrophobicContact CD1-CB 3.59Å; L270-R338 HydrophobicContact CD1-CG 4.48Å; L270-R338 HydrophobicContact CG-CB 3.81Å; L270-P339 PolarHBondContact N-O 2.96Å; L270-K340 HydrophobicContact CB-CG 4.12Å; L270-K340 WeakPolarHBondContact O-CA 3.48Å; L270-L341 PolarHBondContact O-N 3.25Å
271	S	77.5	Confident	79.5	Confident	7 Å²	7	55 Å²	55	5%	0.049	29%	0.289	C	S	.	.			trans	-69.2	169	165.2	64.2	0	0	0	0	110	S273 G274 A275	S271-S273 PolarHBondContact O-N 3.41Å; S271-S273 PolarHBondContact OG-OG 3.26Å; S271-G274 WeakPolarHBondContact O-CA 3.11Å; S271-G274 PolarHBondContact O-N 3.19Å; S271-A275 PolarHBondContact N-O 2.94Å; S271-A275 PolarHBondContact OG-N 3.45Å; S271-A275 PolarHBondContact OG-O 3.31Å
272	L	76.7	Confident	77.7	Confident	95 Å²	95	55.6 Å²	55.6	50%	0.497	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-35.4	174.1	-67.1	178.2	0	0	0	112.1	G274 K340 D342	L272-G274 PolarHBondContact O-N 3.01Å; L272-K340 PolarHBondContact O-NZ 3.39Å; L272-K340 VanDerWaalsContact O-NZ 3.13Å; L272-D342 HydrophobicContact CD1-CB 4.35Å; L272-D342 HydrophobicContact CD2-CB 3.98Å
273	S	75.5	Confident	76.2	Confident	97 Å²	97	55.9 Å²	55.9	68%	0.678	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.9	174.2	62.3	0	0	0	0	114.1	S271 A275	S271-S273 PolarHBondContact O-N 3.41Å; S271-S273 PolarHBondContact OG-OG 3.26Å; S273-A275 VanDerWaalsContact C-N 3.33Å
274	G	73.6	Confident	75.2	Confident	31 Å²	31	55.8 Å²	55.8	32%	0.32	30%	0.297	S	S	.	.	S	Bend	trans	87.2	-2.4	-179.1	0	0	0	0	0	114.3	S271 L272	S271-G274 WeakPolarHBondContact O-CA 3.11Å; S271-G274 PolarHBondContact O-N 3.19Å; L272-G274 PolarHBondContact O-N 3.01Å
275	A	69.1	Low	74.7	Confident	54 Å²	54	58 Å²	58	45%	0.446	31%	0.308	S	S	.	.	S	Bend	trans	-72.2	159.5	170.8	0	0	0	0	0	110.8	L270 S271 S273 V277	L270-A275 CarbonylContact C-O 3.56Å; L270-A275 VanDerWaalsContact CA-O 3.3Å; L270-A275 WeakPolarHBondContact CA-O 3.37Å; S271-A275 PolarHBondContact N-O 2.94Å; S271-A275 PolarHBondContact OG-N 3.45Å; S271-A275 PolarHBondContact OG-O 3.31Å; S273-A275 VanDerWaalsContact C-N 3.33Å; A275-V277 PolarHBondContact O-N 2.98Å
276	K	69.2	Low	74.5	Confident	122 Å²	122	58 Å²	58	53%	0.53	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-60	128	167.1	-176.8	173.8	-179.8	171.6	0	107.9	S278	K276-S278 PolarHBondContact O-N 3.1Å
277	V	66.8	Low	74.3	Confident	36 Å²	36	59.6 Å²	59.6	22%	0.218	32%	0.317	C	S	.	.			trans	-52.9	111.3	175.9	178.5	0	0	0	0	107.8	I269 L270 A275	I269-V277 HydrophobicContact CG2-CG2 3.99Å; L270-V277 VanDerWaalsContact C-CG2 3.43Å; A275-V277 PolarHBondContact O-N 2.98Å
278	S	59.8	Low	74.1	Confident	54 Å²	54	62.6 Å²	62.6	38%	0.378	33%	0.331	S	S	.	.			trans	-112.8	156.9	-170	81.5	0	0	0	0	111	K276 R280 E281	K276-S278 PolarHBondContact O-N 3.1Å; S278-R280 PolarHBondContact O-N 3.45Å; S278-E281 PolarHBondContact O-N 3.34Å
279	K	54.9	Low	74.2	Confident	160 Å²	160	61.4 Å²	61.4	70%	0.696	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-51.3	-22.7	-179.8	-65.2	-177.3	178	-176.2	0	113.9	E281 G282	K279-E281 VanDerWaalsContact C-N 3.28Å; K279-E281 PolarHBondContact O-N 2.89Å; K279-G282 PolarHBondContact O-N 3.47Å
280	R	49.4	Very low	74.5	Confident	240 Å²	240	66 Å²	66	91%	0.906	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-67	-23.1	-174.7	-65.8	-173.1	-177.7	-179	1	114.3	S278 G282	S278-R280 PolarHBondContact O-N 3.45Å; R280-G282 VanDerWaalsContact C-N 3.35Å
281	E	53.8	Low	74.8	Confident	105 Å²	105	68.6 Å²	68.6	49%	0.491	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-85	-8.5	-178.8	-69.7	176.3	174.4	0	0	112.6	S278 K279 M283	S278-E281 PolarHBondContact O-N 3.34Å; K279-E281 VanDerWaalsContact C-N 3.28Å; K279-E281 PolarHBondContact O-N 2.89Å; E281-M283 WeakPolarHBondContact O-CG 3.49Å; E281-M283 PolarHBondContact O-N 3.37Å
282	G	59.3	Low	75.5	Confident	29 Å²	29	70.6 Å²	70.6	30%	0.299	36%	0.359	S	S	.	.	S	Bend	trans	67.3	-36.7	-175.3	0	0	0	0	0	113.7	K279 R280 S284 L285	K279-G282 PolarHBondContact O-N 3.47Å; R280-G282 VanDerWaalsContact C-N 3.35Å; G282-S284 PolarHBondContact O-N 2.89Å; G282-S284 VanDerWaalsContact O-N 3.11Å; G282-L285 PolarHBondContact O-N 2.9Å
283	M	66.8	Low	76.3	Confident	70 Å²	70	66.8 Å²	66.8	35%	0.345	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-6.3	176.2	-55.9	-168	121.4	0	0	113.4	E281 L285 Y289 I343	E281-M283 WeakPolarHBondContact O-CG 3.49Å; E281-M283 PolarHBondContact O-N 3.37Å; M283-L285 VanDerWaalsContact C-N 3.35Å; M283-Y289 PolarHBondContact O-OH 3.33Å; M283-I343 HydrophobicContact CE-CB 4.37Å; M283-I343 HydrophobicContact CE-CD1 4.29Å; M283-I343 HydrophobicContact CE-CG1 3.61Å; M283-I343 HydrophobicContact CE-CG2 4.23Å; M283-I343 HydrophobicContact SD-CB 4.35Å; M283-I343 HydrophobicContact SD-CG1 4.07Å; M283-I343 HydrophobicContact SD-CG2 4.27Å
284	S	78.4	Confident	77.3	Confident	5 Å²	5	62.9 Å²	62.9	4%	0.035	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-24.8	176.2	66.1	0	0	0	0	113.3	H42 L43 G282	H42-S284 CarbonylContact C-O 3.55Å; H42-S284 WeakPolarHBondContact CA-O 3.41Å; H42-S284 WeakPolarHBondContact CB-O 3.23Å; L43-S284 PolarHBondContact N-O 2.88Å; G282-S284 PolarHBondContact O-N 2.89Å; G282-S284 VanDerWaalsContact O-N 3.11Å
285	L	87.6	Confident	78.4	Confident	47 Å²	47	61.8 Å²	61.8	25%	0.246	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-91.8	135	-172.3	-59.6	-179	0	0	0	110.6	H40 H42 G282 M283 D287 H288	H40-L285 HydrophobicContact CB-CD2 4.24Å; H42-L285 HydrophobicContact CB-CD2 4.32Å; G282-L285 PolarHBondContact O-N 2.9Å; M283-L285 VanDerWaalsContact C-N 3.35Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.92Å; L285-H288 WeakPolarHBondContact O-CB 3.48Å; L285-H288 PolarHBondContact O-N 2.94Å
286	I	92.5	Very high	79.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-32.9	-177.4	-58.3	-51.8	0	0	0	111.9	L41 L43 L46 C86 W89 L90 H288 Y289 R290 V299	L41-I286 HydrophobicContact CB-CG1 4.47Å; L41-I286 HydrophobicContact CD2-CG1 4.32Å; L41-I286 HydrophobicContact CG-CG1 4.16Å; L41-I286 WeakPolarHBondContact O-CG1 3.05Å; L41-I286 PolarHBondContact O-N 3.19Å; L43-I286 HydrophobicContact CB-CD1 4.44Å; L43-I286 HydrophobicContact CD1-CD1 4.06Å; L46-I286 HydrophobicContact CB-CD1 4.02Å; L46-I286 HydrophobicContact CB-CG1 4.05Å; L46-I286 HydrophobicContact CD2-CD1 3.46Å; L46-I286 VanDerWaalsContact CD2-CD1 3.46Å; L46-I286 HydrophobicContact CD2-CG1 4.03Å; L46-I286 HydrophobicContact CG-CD1 4.37Å; C86-I286 WeakPolarHBondContact SG-CG2 3.41Å; W89-I286 HydrophobicContact CE3-CG2 4.31Å; W89-I286 HydrophobicContact CZ3-CG2 3.66Å; L90-I286 HydrophobicContact CD1-CG2 4.27Å; I286-H288 PolarHBondContact O-N 3.48Å; I286-Y289 HydrophobicContact CD1-CD2 3.92Å; I286-Y289 HydrophobicContact CD1-CE2 3.9Å; I286-Y289 WeakPolarHBondContact O-CB 3.33Å; I286-Y289 PolarHBondContact O-N 3.15Å; I286-R290 PolarHBondContact O-N 3.33Å; I286-R290 VanDerWaalsContact O-N 3.15Å; I286-V299 HydrophobicContact CD1-CG1 4.45Å
287	D	91.1	Very high	81	Confident	33 Å²	33	57.1 Å²	57.1	18%	0.176	27%	0.271	C	S	.	.	H	α-helix	trans	-59.5	-34.8	176.9	-69.1	-31.3	0	0	0	111.7	H40 L285 Y289 R290 E291	H40-D287 IonicContact CE1-OD2 2.69Å; H40-D287 IonicContact CG-OD2 2.64Å; H40-D287 IonicContact ND1-OD2 3.06Å; H40-D287 PolarHBondContact ND1-OD2 2.77Å; L285-D287 VanDerWaalsContact C-N 3.32Å; L285-D287 PolarHBondContact O-N 2.92Å; D287-Y289 VanDerWaalsContact C-N 3.27Å; D287-Y289 PolarHBondContact O-N 2.75Å; D287-R290 WeakPolarHBondContact O-CB 3.41Å; D287-R290 PolarHBondContact O-N 2.99Å; D287-R290 VanDerWaalsContact O-N 3.12Å; D287-E291 WeakPolarHBondContact O-CB 3.44Å; D287-E291 VanDerWaalsContact O-CG 3.25Å; D287-E291 WeakPolarHBondContact O-CG 3.33Å; D287-E291 PolarHBondContact O-N 3.39Å
288	H	90.4	Very high	82.3	Confident	63 Å²	63	55.4 Å²	55.4	29%	0.292	26%	0.261	S	S	.	.	H	α-helix	trans	-57.5	-41.1	174.1	179.3	73.3	0	0	0	112.1	L285 I286 R292	L285-H288 WeakPolarHBondContact O-CB 3.48Å; L285-H288 PolarHBondContact O-N 2.94Å; I286-H288 PolarHBondContact O-N 3.48Å; H288-R292 WeakPolarHBondContact O-CB 3.28Å; H288-R292 WeakPolarHBondContact O-CG 3.46Å; H288-R292 PolarHBondContact O-N 2.84Å
289	Y	93.4	Very high	84	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-43.7	176.7	-56.9	-40	0	0	0	111.4	M283 I286 D287 E291 R292 C293 F294 V299 I343 L346	M283-Y289 PolarHBondContact O-OH 3.33Å; I286-Y289 HydrophobicContact CD1-CD2 3.92Å; I286-Y289 HydrophobicContact CD1-CE2 3.9Å; I286-Y289 WeakPolarHBondContact O-CB 3.33Å; I286-Y289 PolarHBondContact O-N 3.15Å; D287-Y289 VanDerWaalsContact C-N 3.27Å; D287-Y289 PolarHBondContact O-N 2.75Å; Y289-E291 PolarHBondContact O-N 2.65Å; Y289-R292 CarbonylContact O-C 3.53Å; Y289-R292 PolarHBondContact O-N 3.41Å; Y289-C293 PolarHBondContact O-N 3.04Å; Y289-F294 HydrophobicContact CD1-CD2 4.15Å; Y289-F294 HydrophobicContact CD1-CE2 4.19Å; Y289-F294 HydrophobicContact CG-CD2 4.48Å; Y289-F294 WeakPolarHBondContact O-CB 3.31Å; Y289-F294 WeakPolarHBondContact O-CD2 3.31Å; Y289-F294 PolarHBondContact O-N 3.43Å; Y289-V299 HydrophobicContact CD2-CG1 4.19Å; Y289-V299 HydrophobicContact CD2-CG2 4.38Å; Y289-V299 HydrophobicContact CG-CG2 4.49Å; Y289-I343 HydrophobicContact CE1-CD1 3.68Å; Y289-L346 HydrophobicContact CD1-CD2 3.75Å; Y289-L346 HydrophobicContact CD2-CD2 4.31Å; Y289-L346 HydrophobicContact CE1-CD2 3.66Å; Y289-L346 HydrophobicContact CE2-CD2 4.19Å; Y289-L346 HydrophobicContact CG-CD2 4.09Å
290	R	93.3	Very high	85.9	Confident	106 Å²	106	45.4 Å²	45.4	40%	0.4	21%	0.211	S	C	.	.	H	α-helix	trans	-59.7	-45.9	176.6	-173.7	177.5	179.3	-178.6	1.8	111.7	S85 W89 I286 D287 R292 C293	S85-R290 PolarHBondContact OG-NH1 3.15Å; W89-R290 HydrophobicContact CD2-CB 4.36Å; W89-R290 HydrophobicContact CD2-CG 4.01Å; W89-R290 HydrophobicContact CE3-CB 4.27Å; W89-R290 HydrophobicContact CE3-CG 4.39Å; W89-R290 HydrophobicContact CG-CG 4.49Å; W89-R290 HydrophobicContact CH2-CB 3.84Å; W89-R290 HydrophobicContact CH2-CG 4.37Å; W89-R290 HydrophobicContact CZ2-CB 3.91Å; W89-R290 HydrophobicContact CZ2-CG 3.97Å; W89-R290 HydrophobicContact CZ3-CB 4.04Å; I286-R290 PolarHBondContact O-N 3.33Å; I286-R290 VanDerWaalsContact O-N 3.15Å; D287-R290 WeakPolarHBondContact O-CB 3.41Å; D287-R290 PolarHBondContact O-N 2.99Å; D287-R290 VanDerWaalsContact O-N 3.12Å; R290-R292 VanDerWaalsContact C-N 3.32Å; R290-R292 PolarHBondContact O-N 2.86Å; R290-C293 PolarHBondContact O-N 3.24Å
291	E	90.9	Very high	88.1	Confident	83 Å²	83	34 Å²	34	39%	0.388	17%	0.168	S	C	.	.	H	α-helix	trans	-64.7	-33.8	178.7	-68.7	-171.6	135.8	0	0	113.4	D287 Y289 C293 R372	D287-E291 WeakPolarHBondContact O-CB 3.44Å; D287-E291 VanDerWaalsContact O-CG 3.25Å; D287-E291 WeakPolarHBondContact O-CG 3.33Å; D287-E291 PolarHBondContact O-N 3.39Å; Y289-E291 PolarHBondContact O-N 2.65Å; E291-C293 PolarHBondContact O-N 2.8Å; E291-R372 IonicContact OE1-CZ 3.61Å; E291-R372 IonicContact OE1-NH1 2.63Å; E291-R372 PolarHBondContact OE1-NH1 2.86Å; E291-R372 IonicContact OE1-NH2 2.99Å; E291-R372 PolarHBondContact OE1-NH2 3.43Å; E291-R372 IonicContact OE2-NH2 3.82Å; E291-R372 PolarHBondContact OE2-NH2 3Å
292	R	92.1	Very high	89.9	Confident	48 Å²	48	29.1 Å²	29.1	18%	0.181	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	5.2	173.6	-76.1	-64.8	-47.1	173.2	1.5	113.4	H288 Y289 R290 F294 T400 A402 D406	H288-R292 WeakPolarHBondContact O-CB 3.28Å; H288-R292 WeakPolarHBondContact O-CG 3.46Å; H288-R292 PolarHBondContact O-N 2.84Å; Y289-R292 CarbonylContact O-C 3.53Å; Y289-R292 PolarHBondContact O-N 3.41Å; R290-R292 VanDerWaalsContact C-N 3.32Å; R290-R292 PolarHBondContact O-N 2.86Å; R292-F294 VanDerWaalsContact C-N 3.31Å; R292-F294 HydrophobicContact CB-CD2 3.75Å; R292-F294 HydrophobicContact CB-CE2 3.78Å; R292-F294 PolarHBondContact O-N 3.01Å; R292-T400 PolarHBondContact NH2-OG1 3Å; R292-T400 WeakPolarHBondContact O-CB 3.17Å; R292-T400 PolarHBondContact O-OG1 3Å; R292-A402 PolarHBondContact NH1-O 3.18Å; R292-A402 VanDerWaalsContact NH2-C 3.28Å; R292-A402 WeakPolarHBondContact O-CB 3.3Å; R292-D406 IonicContact CZ-OD1 3.01Å; R292-D406 IonicContact NH1-OD1 3.45Å; R292-D406 PolarHBondContact NH1-OD1 3.47Å; R292-D406 IonicContact NH2-OD1 3.63Å; R292-D406 IonicContact NH2-OD2 3.31Å
293	C	95.2	Very high	91.4	Very high	16 Å²	16	27.7 Å²	27.7	11%	0.108	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	42.2	-178.5	-158.4	0	0	0	0	112.6	Y289 R290 E291 L369 L401	Y289-C293 PolarHBondContact O-N 3.04Å; R290-C293 PolarHBondContact O-N 3.24Å; E291-C293 PolarHBondContact O-N 2.8Å; C293-L369 HydrophobicContact CB-CD1 4.05Å; C293-L369 HydrophobicContact CB-CD2 4.33Å; C293-L401 HydrophobicContact CB-CB 4.25Å
294	F	96.2	Very high	92.6	Very high	14 Å²	14	24.4 Å²	24.4	6%	0.061	11%	0.114	C	C	.	.			trans	-71	145.7	156.5	-72	-92.6	0	0	0	109.2	W89 Y289 R292 V299 L346 Q347 N350 T400	W89-F294 WeakPolarHBondContact CZ2-O 3.41Å; Y289-F294 HydrophobicContact CD1-CD2 4.15Å; Y289-F294 HydrophobicContact CD1-CE2 4.19Å; Y289-F294 HydrophobicContact CG-CD2 4.48Å; Y289-F294 WeakPolarHBondContact O-CB 3.31Å; Y289-F294 WeakPolarHBondContact O-CD2 3.31Å; Y289-F294 PolarHBondContact O-N 3.43Å; R292-F294 VanDerWaalsContact C-N 3.31Å; R292-F294 HydrophobicContact CB-CD2 3.75Å; R292-F294 HydrophobicContact CB-CE2 3.78Å; R292-F294 PolarHBondContact O-N 3.01Å; F294-V299 HydrophobicContact CB-CG2 3.92Å; F294-L346 HydrophobicContact CD1-CD1 4.05Å; F294-L346 HydrophobicContact CD1-CD2 3.83Å; F294-L346 HydrophobicContact CD1-CG 3.64Å; F294-L346 HydrophobicContact CE1-CD1 4.45Å; F294-L346 HydrophobicContact CE1-CD2 3.79Å; F294-L346 HydrophobicContact CE1-CG 3.58Å; F294-L346 HydrophobicContact CG-CD2 4.36Å; F294-L346 HydrophobicContact CZ-CD2 4.24Å; F294-L346 HydrophobicContact CZ-CG 4.44Å; F294-Q347 HydrophobicContact CE1-CG 4.47Å; F294-Q347 HydrophobicContact CZ-CG 4.45Å; F294-N350 VanDerWaalsContact CA-OD1 3.22Å; F294-N350 WeakPolarHBondContact CA-OD1 3.38Å; F294-N350 HydrophobicContact CD1-CB 3.58Å; F294-N350 VanDerWaalsContact CD1-CG 3.43Å; F294-N350 HydrophobicContact CE1-CB 3.92Å; F294-T400 HydrophobicContact CD1-CG2 3.99Å; F294-T400 HydrophobicContact CD2-CG2 3.88Å; F294-T400 HydrophobicContact CE1-CG2 3.65Å; F294-T400 HydrophobicContact CE2-CG2 3.6Å; F294-T400 HydrophobicContact CG-CG2 4.1Å; F294-T400 HydrophobicContact CZ-CG2 3.46Å; F294-T400 VanDerWaalsContact CZ-CG2 3.46Å
295	Y	96.5	Very high	92.8	Very high	8 Å²	8	25.4 Å²	25.4	3%	0.031	12%	0.118	C	C	.	.			trans	-89.4	144.7	178.2	-69	-66.2	0	0	0	111	E297 A298 V299 N350 A353 L354 K357 H365 L401	Y295-E297 VanDerWaalsContact C-N 3.29Å; Y295-E297 PolarHBondContact O-N 3.4Å; Y295-A298 WeakPolarHBondContact O-CB 3.47Å; Y295-A298 PolarHBondContact O-N 3.11Å; Y295-V299 PolarHBondContact O-N 3.45Å; Y295-V299 VanDerWaalsContact O-N 3.15Å; Y295-N350 PolarHBondContact N-OD1 2.71Å; Y295-A353 HydrophobicContact CD2-CB 3.79Å; Y295-A353 HydrophobicContact CG-CB 4.16Å; Y295-L354 HydrophobicContact CD2-CB 4.49Å; Y295-L354 HydrophobicContact CE2-CB 3.92Å; Y295-L354 HydrophobicContact CE2-CD1 3.77Å; Y295-L354 HydrophobicContact CE2-CG 4.49Å; Y295-K357 HydrophobicContact CD1-CD 4.42Å; Y295-K357 HydrophobicContact CE1-CD 4.08Å; Y295-K357 HydrophobicContact CE1-CG 4.01Å; Y295-K357 HydrophobicContact CE2-CG 3.97Å; Y295-H365 AromaticContact CE1-CE1 3.72Å; Y295-H365 AromaticContact CE1-ND1 3.62Å; Y295-L401 WeakPolarHBondContact OH-CD1 3.49Å
296	P	96.2	Very high	92.5	Very high	32 Å²	32	23.1 Å²	23.1	21%	0.208	11%	0.106	C	C	.	.	H	α-helix	trans	-59.2	-37.9	-174.4	23	-33	0	0	0	112.6	W89 L90 A298 V299 V300	W89-P296 HydrophobicContact CZ2-CB 4.48Å; W89-P296 VanDerWaalsContact O-CB 3.29Å; W89-P296 WeakPolarHBondContact O-CB 3.43Å; L90-P296 HydrophobicContact CD2-CB 4.47Å; P296-A298 VanDerWaalsContact C-N 3.28Å; P296-A298 PolarHBondContact O-N 3.48Å; P296-V299 PolarHBondContact O-N 3.01Å; P296-V300 WeakPolarHBondContact O-CB 3.31Å; P296-V300 VanDerWaalsContact O-CG2 3.31Å; P296-V300 WeakPolarHBondContact O-CG2 3.4Å; P296-V300 PolarHBondContact O-N 3.19Å
297	E	95.5	Very high	91.6	Very high	47 Å²	47	23.4 Å²	23.4	22%	0.22	11%	0.109	C	C	.	.	H	α-helix	trans	-60.7	-35.1	176.3	61.1	-89.4	-149.3	0	0	112.9	Y295 S301 L319 A353 K357	Y295-E297 VanDerWaalsContact C-N 3.29Å; Y295-E297 PolarHBondContact O-N 3.4Å; E297-S301 VanDerWaalsContact O-CB 3.25Å; E297-S301 WeakPolarHBondContact O-CB 3.39Å; E297-S301 PolarHBondContact O-N 2.97Å; E297-S301 PolarHBondContact O-OG 3.06Å; E297-L319 HydrophobicContact CG-CD2 4.26Å; E297-A353 HydrophobicContact CG-CB 3.85Å; E297-K357 WeakPolarHBondContact OE1-CE 3.18Å; E297-K357 IonicContact OE1-NZ 3.27Å; E297-K357 PolarHBondContact OE1-NZ 3.19Å; E297-K357 IonicContact OE2-NZ 2.96Å
298	A	95.7	Very high	91.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-73.3	-42.1	177.1	0	0	0	0	0	111.1	Y295 P296 S301 F302 L319 L346 L349 N350 A353	Y295-A298 WeakPolarHBondContact O-CB 3.47Å; Y295-A298 PolarHBondContact O-N 3.11Å; P296-A298 VanDerWaalsContact C-N 3.28Å; P296-A298 PolarHBondContact O-N 3.48Å; A298-S301 PolarHBondContact O-N 2.86Å; A298-F302 VanDerWaalsContact O-CB 3.28Å; A298-F302 WeakPolarHBondContact O-CB 3.17Å; A298-F302 PolarHBondContact O-N 3.08Å; A298-L319 HydrophobicContact CB-CD2 4.24Å; A298-L346 HydrophobicContact CB-CD1 4.23Å; A298-L346 WeakPolarHBondContact O-CD1 3.31Å; A298-L349 HydrophobicContact CB-CB 3.96Å; A298-N350 HydrophobicContact CB-CB 4.01Å; A298-N350 WeakPolarHBondContact CB-OD1 3.4Å; A298-A353 HydrophobicContact CB-CB 4.26Å
299	V	95.2	Very high	91.4	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.3	-41.9	178.3	179.1	0	0	0	0	111.4	L46 W89 L90 I286 Y289 F294 Y295 P296 F302 A303 L346	L46-V299 HydrophobicContact CD2-CG1 3.67Å; W89-V299 HydrophobicContact CH2-CG2 4.04Å; L90-V299 HydrophobicContact CD2-CB 4.08Å; L90-V299 HydrophobicContact CD2-CG1 3.86Å; I286-V299 HydrophobicContact CD1-CG1 4.45Å; Y289-V299 HydrophobicContact CD2-CG1 4.19Å; Y289-V299 HydrophobicContact CD2-CG2 4.38Å; Y289-V299 HydrophobicContact CG-CG2 4.49Å; F294-V299 HydrophobicContact CB-CG2 3.92Å; Y295-V299 PolarHBondContact O-N 3.45Å; Y295-V299 VanDerWaalsContact O-N 3.15Å; P296-V299 PolarHBondContact O-N 3.01Å; V299-F302 PolarHBondContact O-N 3.39Å; V299-A303 WeakPolarHBondContact O-CB 3.25Å; V299-A303 PolarHBondContact O-N 3.34Å; V299-L346 HydrophobicContact CG2-CD1 4.1Å
300	V	95	Very high	91.4	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.024	11%	0.108	C	C	.	.	H	α-helix	trans	-61.5	-49.9	173.4	166.8	0	0	0	0	110.6	L50 L90 P296 F302 A303 C304 L322 Y325	L50-V300 HydrophobicContact CD1-CG1 3.98Å; L50-V300 HydrophobicContact CD2-CG1 4.28Å; L90-V300 HydrophobicContact CB-CG2 4.46Å; L90-V300 HydrophobicContact CD2-CG2 4.16Å; P296-V300 WeakPolarHBondContact O-CB 3.31Å; P296-V300 VanDerWaalsContact O-CG2 3.31Å; P296-V300 WeakPolarHBondContact O-CG2 3.4Å; P296-V300 PolarHBondContact O-N 3.19Å; V300-F302 VanDerWaalsContact C-N 3.28Å; V300-F302 PolarHBondContact O-N 3.08Å; V300-A303 PolarHBondContact O-N 2.85Å; V300-A303 VanDerWaalsContact O-N 3.1Å; V300-C304 PolarHBondContact O-N 3.45Å; V300-C304 PolarHBondContact O-SG 2.91Å; V300-C304 VanDerWaalsContact O-SG 3.39Å; V300-L322 HydrophobicContact CG1-CD2 3.64Å; V300-L322 HydrophobicContact CG1-CG 4.46Å; V300-L322 HydrophobicContact CG2-CD2 4.4Å; V300-Y325 HydrophobicContact CG1-CD2 4.21Å; V300-Y325 HydrophobicContact CG1-CE2 4.32Å
301	S	94.1	Very high	91.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.7	-42.4	179	-59.8	0	0	0	0	111.6	E297 A298 A303 C304 F305 Y325	E297-S301 VanDerWaalsContact O-CB 3.25Å; E297-S301 WeakPolarHBondContact O-CB 3.39Å; E297-S301 PolarHBondContact O-N 2.97Å; E297-S301 PolarHBondContact O-OG 3.06Å; A298-S301 PolarHBondContact O-N 2.86Å; S301-A303 PolarHBondContact O-N 3.27Å; S301-C304 WeakPolarHBondContact O-CB 3.48Å; S301-C304 PolarHBondContact O-N 2.92Å; S301-F305 WeakPolarHBondContact O-CD2 3.49Å; S301-F305 WeakPolarHBondContact O-CE2 3.26Å; S301-F305 WeakPolarHBondContact O-CZ 3.38Å; S301-F305 PolarHBondContact O-N 3.29Å; S301-Y325 WeakPolarHBondContact CA-OH 3.49Å; S301-Y325 WeakPolarHBondContact CB-OH 3.26Å; S301-Y325 PolarHBondContact OG-OH 2.8Å
302	F	92.2	Very high	91	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-40.9	176	-179.3	-122.7	0	0	0	112.7	L43 A298 V299 V300 C304 F305 L341 D342 I343 W345 L346 L349	L43-F302 HydrophobicContact CD1-CD1 4.43Å; L43-F302 HydrophobicContact CD2-CD1 4.47Å; L43-F302 HydrophobicContact CD2-CE1 3.84Å; A298-F302 VanDerWaalsContact O-CB 3.28Å; A298-F302 WeakPolarHBondContact O-CB 3.17Å; A298-F302 PolarHBondContact O-N 3.08Å; V299-F302 PolarHBondContact O-N 3.39Å; V300-F302 VanDerWaalsContact C-N 3.28Å; V300-F302 PolarHBondContact O-N 3.08Å; F302-C304 VanDerWaalsContact C-N 3.34Å; F302-F305 PolarHBondContact O-N 3.44Å; F302-L341 HydrophobicContact CE1-CB 4.45Å; F302-L341 HydrophobicContact CE1-CD1 4.16Å; F302-L341 HydrophobicContact CE2-CB 4.05Å; F302-L341 HydrophobicContact CE2-CD2 4.15Å; F302-L341 HydrophobicContact CE2-CG 4.5Å; F302-L341 HydrophobicContact CZ-CB 3.66Å; F302-L341 HydrophobicContact CZ-CD1 4.1Å; F302-L341 HydrophobicContact CZ-CD2 4.42Å; F302-L341 HydrophobicContact CZ-CG 4.29Å; F302-D342 VanDerWaalsContact CE2-O 3.23Å; F302-D342 WeakPolarHBondContact CE2-O 3.22Å; F302-I343 HydrophobicContact CE1-CD1 4.41Å; F302-I343 HydrophobicContact CZ-CD1 4.46Å; F302-W345 HydrophobicContact CD2-CB 4.29Å; F302-W345 HydrophobicContact CE2-CB 4.26Å; F302-L346 HydrophobicContact CB-CB 4.26Å; F302-L346 HydrophobicContact CB-CD1 3.67Å; F302-L346 HydrophobicContact CB-CG 4.49Å; F302-L346 HydrophobicContact CD1-CB 3.93Å; F302-L346 HydrophobicContact CD1-CD1 4.14Å; F302-L346 HydrophobicContact CD1-CD2 4.12Å; F302-L346 HydrophobicContact CD1-CG 4.26Å; F302-L346 HydrophobicContact CD2-CB 3.87Å; F302-L346 HydrophobicContact CE1-CB 4.13Å; F302-L346 HydrophobicContact CE1-CD2 4.33Å; F302-L346 HydrophobicContact CE2-CB 4.09Å; F302-L346 HydrophobicContact CG-CB 3.77Å; F302-L346 HydrophobicContact CG-CD1 4.01Å; F302-L346 HydrophobicContact CG-CG 4.32Å; F302-L346 HydrophobicContact CZ-CB 4.19Å; F302-L349 HydrophobicContact CB-CD1 3.89Å
303	A	92	Very high	90.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.8	-31	176	0	0	0	0	0	112.7	L43 L46 L50 V299 V300 S301 F305 A306	L43-A303 HydrophobicContact CD1-CB 4.42Å; L46-A303 HydrophobicContact CD2-CB 4.07Å; L46-A303 HydrophobicContact CG-CB 4.18Å; L50-A303 HydrophobicContact CD2-CB 3.71Å; V299-A303 WeakPolarHBondContact O-CB 3.25Å; V299-A303 PolarHBondContact O-N 3.34Å; V300-A303 PolarHBondContact O-N 2.85Å; V300-A303 VanDerWaalsContact O-N 3.1Å; S301-A303 PolarHBondContact O-N 3.27Å; A303-F305 VanDerWaalsContact C-N 3.29Å; A303-F305 PolarHBondContact O-N 2.97Å; A303-A306 VanDerWaalsContact O-CB 3.24Å; A303-A306 WeakPolarHBondContact O-CB 3.38Å; A303-A306 PolarHBondContact O-N 3.31Å; A303-A306 VanDerWaalsContact O-N 3.15Å
304	C	91	Very high	89.9	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.9	-32.8	172.8	-70.2	0	0	0	0	112.5	V300 S301 F302 A306 F310 Y325	V300-C304 PolarHBondContact O-N 3.45Å; V300-C304 PolarHBondContact O-SG 2.91Å; V300-C304 VanDerWaalsContact O-SG 3.39Å; S301-C304 WeakPolarHBondContact O-CB 3.48Å; S301-C304 PolarHBondContact O-N 2.92Å; F302-C304 VanDerWaalsContact C-N 3.34Å; C304-A306 PolarHBondContact O-N 3.07Å; C304-F310 HydrophobicContact CB-CD2 4.25Å; C304-F310 HydrophobicContact CB-CE1 4.23Å; C304-F310 HydrophobicContact CB-CE2 3.55Å; C304-F310 HydrophobicContact CB-CZ 3.51Å; C304-F310 WeakPolarHBondContact O-CE2 3.34Å; C304-F310 WeakPolarHBondContact SG-CZ 3.45Å; C304-Y325 HydrophobicContact CB-CD1 4.13Å; C304-Y325 HydrophobicContact CB-CE1 3.75Å
305	F	83.4	Confident	89.4	Confident	26 Å²	26	27.4 Å²	27.4	11%	0.114	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17	176.4	-56.2	-38.9	0	0	0	113.9	S301 F302 A303 G307 R316 L341 W345 L349	S301-F305 WeakPolarHBondContact O-CD2 3.49Å; S301-F305 WeakPolarHBondContact O-CE2 3.26Å; S301-F305 WeakPolarHBondContact O-CZ 3.38Å; S301-F305 PolarHBondContact O-N 3.29Å; F302-F305 PolarHBondContact O-N 3.44Å; A303-F305 VanDerWaalsContact C-N 3.29Å; A303-F305 PolarHBondContact O-N 2.97Å; F305-G307 PolarHBondContact O-N 2.57Å; F305-R316 HydrophobicContact CD1-CB 3.84Å; F305-R316 HydrophobicContact CD1-CG 3.86Å; F305-R316 HydrophobicContact CD2-CB 4.49Å; F305-R316 HydrophobicContact CE1-CB 3.59Å; F305-R316 HydrophobicContact CE1-CG 3.93Å; F305-R316 HydrophobicContact CE2-CB 4.21Å; F305-R316 WeakPolarHBondContact CE2-O 3.43Å; F305-R316 HydrophobicContact CG-CB 4.36Å; F305-R316 VanDerWaalsContact CZ-CA 3.45Å; F305-R316 HydrophobicContact CZ-CB 3.83Å; F305-R316 WeakPolarHBondContact CZ-O 3.46Å; F305-L341 HydrophobicContact CB-CD2 4.46Å; F305-W345 HydrophobicContact CD2-CE3 4.45Å; F305-L349 HydrophobicContact CD2-CD1 4.38Å; F305-L349 HydrophobicContact CE2-CD1 3.58Å; F305-L349 HydrophobicContact CE2-CD2 4.34Å; F305-L349 HydrophobicContact CE2-CG 4.36Å; F305-L349 HydrophobicContact CZ-CD1 4.42Å
306	A	80.4	Confident	88.7	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	54.4	-174.5	0	0	0	0	0	113.7	R47 I269 A303 C304 P339 L341	R47-A306 WeakPolarHBondContact CD-O 3.24Å; R47-A306 HydrophobicContact CG-CB 4.46Å; R47-A306 PolarHBondContact NH1-O 2.99Å; R47-A306 VanDerWaalsContact NH1-O 3.16Å; I269-A306 HydrophobicContact CD1-CB 3.8Å; I269-A306 HydrophobicContact CG1-CB 4.18Å; A303-A306 VanDerWaalsContact O-CB 3.24Å; A303-A306 WeakPolarHBondContact O-CB 3.38Å; A303-A306 PolarHBondContact O-N 3.31Å; A303-A306 VanDerWaalsContact O-N 3.15Å; C304-A306 PolarHBondContact O-N 3.07Å; A306-P339 HydrophobicContact CB-CG 4.26Å; A306-L341 HydrophobicContact CB-CD1 3.73Å; A306-L341 HydrophobicContact CB-CD2 3.9Å; A306-L341 HydrophobicContact CB-CG 4.15Å
307	G	74.7	Confident	88.2	Confident	5 Å²	5	34.3 Å²	34.3	5%	0.052	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	148.3	-6.9	171.5	0	0	0	0	0	115.9	F305 A335	F305-G307 PolarHBondContact O-N 2.57Å; G307-A335 WeakPolarHBondContact O-CB 3.32Å; G307-A335 PolarHBondContact O-N 3.27Å
308	G	85	Confident	88	Confident	32 Å²	32	34.2 Å²	34.2	33%	0.33	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	77	-152.7	-172.6	0	0	0	0	0	111.5	F310	G308-F310 WeakPolarHBondContact O-CD2 3.3Å; G308-F310 WeakPolarHBondContact O-CE2 3.32Å
309	G	91.4	Very high	87.8	Confident	3 Å²	3	34.6 Å²	34.6	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.1	3.8	-174.1	0	0	0	0	0	114.8	F329 D330 H333	G309-F329 CarbonylContact O-C 3.58Å; G309-F329 WeakPolarHBondContact O-CA 3.39Å; G309-D330 PolarHBondContact O-N 3.11Å; G309-H333 VanDerWaalsContact CA-C 3.47Å; G309-H333 WeakPolarHBondContact CA-O 3.47Å; G309-H333 PolarHBondContact N-O 3.47Å
310	F	93.2	Very high	87.7	Confident	25 Å²	25	36.4 Å²	36.4	11%	0.11	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	100.4	-178.5	-60.3	-83.5	0	0	0	110	F51 L54 C304 G308 D313 Y325 L328 F329	F51-F310 HydrophobicContact CE1-CE2 4.1Å; F51-F310 HydrophobicContact CE1-CZ 4.09Å; F51-F310 HydrophobicContact CZ-CE2 4.22Å; L54-F310 HydrophobicContact CD1-CE1 3.74Å; L54-F310 HydrophobicContact CD1-CZ 3.79Å; C304-F310 HydrophobicContact CB-CD2 4.25Å; C304-F310 HydrophobicContact CB-CE1 4.23Å; C304-F310 HydrophobicContact CB-CE2 3.55Å; C304-F310 HydrophobicContact CB-CZ 3.51Å; C304-F310 WeakPolarHBondContact O-CE2 3.34Å; C304-F310 WeakPolarHBondContact SG-CZ 3.45Å; G308-F310 WeakPolarHBondContact O-CD2 3.3Å; G308-F310 WeakPolarHBondContact O-CE2 3.32Å; F310-D313 HydrophobicContact CB-CB 3.87Å; F310-D313 PolarHBondContact O-N 3.43Å; F310-Y325 AromaticContact CD1-CD1 3.69Å; F310-Y325 HydrophobicContact CD1-CD1 3.69Å; F310-Y325 HydrophobicContact CD1-CE1 4.42Å; F310-Y325 AromaticContact CE1-CD1 3.55Å; F310-Y325 HydrophobicContact CE1-CD1 3.55Å; F310-Y325 HydrophobicContact CE1-CE1 4.41Å; F310-Y325 HydrophobicContact CE1-CG 4.16Å; F310-Y325 HydrophobicContact CG-CD1 4.5Å; F310-Y325 HydrophobicContact CZ-CD1 4.31Å; F310-L328 CarbonylContact C-O 3.55Å; F310-L328 WeakPolarHBondContact CA-O 3.34Å; F310-L328 HydrophobicContact CB-CB 4.34Å; F310-L328 HydrophobicContact CD1-CB 4.15Å; F310-F329 HydrophobicContact CD1-CB 4.39Å; F310-F329 HydrophobicContact CD1-CD2 4.39Å; F310-F329 HydrophobicContact CE1-CB 4.14Å; F310-F329 AromaticContact CE1-CD2 3.84Å; F310-F329 HydrophobicContact CE1-CD2 3.84Å; F310-F329 HydrophobicContact CE1-CG 4.46Å; F310-F329 HydrophobicContact CE2-CD2 4.35Å; F310-F329 AromaticContact CZ-CD2 3.8Å; F310-F329 HydrophobicContact CZ-CD2 3.8Å; F310-F329 HydrophobicContact CZ-CE2 4.42Å
311	V	89.9	Confident	87.6	Confident	70 Å²	70	38.9 Å²	38.9	42%	0.424	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	127.1	-171.8	-176.4	0	0	0	0	110.2	D313 L328 D330 H333	V311-D313 PolarHBondContact O-N 2.99Å; V311-L328 PolarHBondContact N-O 3.35Å; V311-L328 WeakPolarHBondContact O-CD2 3.27Å; V311-D330 HydrophobicContact CG2-CB 3.83Å; V311-H333 HydrophobicContact CG2-CB 4.12Å
312	G	86.1	Confident	87.7	Confident	63 Å²	63	40.6 Å²	40.6	65%	0.649	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.7	-2.8	-178.1	0	0	0	0	0	114.7	N314	G312-N314 PolarHBondContact O-N 3.45Å
313	D	83.9	Confident	87.8	Confident	24 Å²	24	47.4 Å²	47.4	13%	0.128	27%	0.266	C	S	.	.			trans	-82	93.2	174.4	-173.4	5.3	0	0	0	111.4	F310 V311 D315 R320 L328	F310-D313 HydrophobicContact CB-CB 3.87Å; F310-D313 PolarHBondContact O-N 3.43Å; V311-D313 PolarHBondContact O-N 2.99Å; D313-D315 PolarHBondContact OD1-N 3.27Å; D313-D315 VanDerWaalsContact OD1-N 3.15Å; D313-D315 VanDerWaalsContact OD1-O 3.06Å; D313-R320 VanDerWaalsContact CG-NH1 3.27Å; D313-R320 IonicContact OD1-CZ 3.31Å; D313-R320 IonicContact OD1-NH1 2.84Å; D313-R320 PolarHBondContact OD1-NH1 3.48Å; D313-R320 IonicContact OD1-NH2 3.6Å; D313-R320 PolarHBondContact OD1-NH2 3.13Å; D313-R320 IonicContact OD2-CZ 3.4Å; D313-R320 IonicContact OD2-NH1 2.81Å; D313-R320 PolarHBondContact OD2-NH1 2.81Å; D313-R320 IonicContact OD2-NH2 2.65Å; D313-L328 HydrophobicContact CB-CD1 4.4Å
314	N	80	Confident	88	Confident	158 Å²	158	52 Å²	52	85%	0.845	29%	0.288	S	S	*	.			trans	-92	-8.6	177	-65.9	-35.3	0	0	0	113.5	G312	G312-N314 PolarHBondContact O-N 3.45Å
315	D	86.1	Confident	88.2	Confident	76 Å²	76	52 Å²	52	41%	0.406	29%	0.288	S	S	.	.			trans	-116.8	101.6	-177.9	-175.8	8.4	0	0	0	111.6	D313 L317 T318 R320	D313-D315 PolarHBondContact OD1-N 3.27Å; D313-D315 VanDerWaalsContact OD1-N 3.15Å; D313-D315 VanDerWaalsContact OD1-O 3.06Å; D315-L317 PolarHBondContact O-N 3.26Å; D315-L317 PolarHBondContact OD1-N 2.84Å; D315-T318 PolarHBondContact O-N 3.4Å; D315-T318 PolarHBondContact OD2-OG1 2.91Å; D315-R320 PolarHBondContact O-NH1 3.47Å
316	R	81.4	Confident	88.8	Confident	126 Å²	126	51 Å²	51	48%	0.475	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	3.8	177.9	-58.7	-174.3	-174.1	166.1	6.1	114.1	F305	F305-R316 HydrophobicContact CD1-CB 3.84Å; F305-R316 HydrophobicContact CD1-CG 3.86Å; F305-R316 HydrophobicContact CD2-CB 4.49Å; F305-R316 HydrophobicContact CE1-CB 3.59Å; F305-R316 HydrophobicContact CE1-CG 3.93Å; F305-R316 HydrophobicContact CE2-CB 4.21Å; F305-R316 WeakPolarHBondContact CE2-O 3.43Å; F305-R316 HydrophobicContact CG-CB 4.36Å; F305-R316 VanDerWaalsContact CZ-CA 3.45Å; F305-R316 HydrophobicContact CZ-CB 3.83Å; F305-R316 WeakPolarHBondContact CZ-O 3.46Å
317	L	85.9	Confident	89.5	Confident	59 Å²	59	56.5 Å²	56.5	31%	0.309	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	2	173.9	-66.5	176.5	0	0	0	111.8	D315 L319 L348 L349 Q352	D315-L317 PolarHBondContact O-N 3.26Å; D315-L317 PolarHBondContact OD1-N 2.84Å; L317-L319 PolarHBondContact O-N 3.28Å; L317-L348 HydrophobicContact CD1-CD1 4.1Å; L317-L348 HydrophobicContact CD2-CB 4Å; L317-L348 HydrophobicContact CD2-CD1 4.25Å; L317-L349 HydrophobicContact CD2-CG 4.41Å; L317-Q352 PolarHBondContact O-NE2 3.26Å; L317-Q352 PolarHBondContact O-OE1 3.29Å
318	T	90.5	Very high	90.4	Very high	46 Å²	46	58.4 Å²	58.4	28%	0.282	32%	0.323	S	S	.	.			trans	-77.4	121.6	171.4	-76.6	0	0	0	0	110.9	D315 R320	D315-T318 PolarHBondContact O-N 3.4Å; D315-T318 PolarHBondContact OD2-OG1 2.91Å; T318-R320 HydrophobicContact CG2-CG 3.93Å; T318-R320 PolarHBondContact O-N 2.94Å; T318-R320 PolarHBondContact O-NH1 3.17Å
319	L	92.9	Very high	90.9	Very high	7 Å²	7	56.9 Å²	56.9	4%	0.037	31%	0.307	C	S	.	.			trans	-73.1	119.3	168.8	-74.5	173.1	0	0	0	110.9	E297 A298 L317 L349 Q352 A353 R356	E297-L319 HydrophobicContact CG-CD2 4.26Å; A298-L319 HydrophobicContact CB-CD2 4.24Å; L317-L319 PolarHBondContact O-N 3.28Å; L319-L349 HydrophobicContact CD2-CB 4.17Å; L319-L349 HydrophobicContact CD2-CD2 3.95Å; L319-L349 HydrophobicContact CG-CD2 4.3Å; L319-Q352 HydrophobicContact CD1-CB 3.62Å; L319-Q352 HydrophobicContact CG-CB 4.28Å; L319-A353 HydrophobicContact CD1-CB 3.73Å; L319-A353 VanDerWaalsContact CD1-N 3.27Å; L319-R356 PolarHBondContact O-NH1 2.79Å
320	R	93	Very high	91.1	Very high	38 Å²	38	58.9 Å²	58.9	14%	0.143	32%	0.317	C	S	.	.			trans	-116	153.1	178.1	-59.8	-178.7	176.7	81.5	-3.2	111.5	D313 D315 T318 E324 Y325	D313-R320 VanDerWaalsContact CG-NH1 3.27Å; D313-R320 IonicContact OD1-CZ 3.31Å; D313-R320 IonicContact OD1-NH1 2.84Å; D313-R320 PolarHBondContact OD1-NH1 3.48Å; D313-R320 IonicContact OD1-NH2 3.6Å; D313-R320 PolarHBondContact OD1-NH2 3.13Å; D313-R320 IonicContact OD2-CZ 3.4Å; D313-R320 IonicContact OD2-NH1 2.81Å; D313-R320 PolarHBondContact OD2-NH1 2.81Å; D313-R320 IonicContact OD2-NH2 2.65Å; D315-R320 PolarHBondContact O-NH1 3.47Å; T318-R320 HydrophobicContact CG2-CG 3.93Å; T318-R320 PolarHBondContact O-N 2.94Å; T318-R320 PolarHBondContact O-NH1 3.17Å; R320-E324 WeakPolarHBondContact CA-OE2 3.46Å; R320-E324 HydrophobicContact CB-CB 3.95Å; R320-Y325 HydrophobicContact CB-CD1 4.48Å; R320-Y325 HydrophobicContact CB-CD2 3.93Å; R320-Y325 HydrophobicContact CB-CE1 4.22Å; R320-Y325 HydrophobicContact CB-CE2 3.64Å; R320-Y325 HydrophobicContact CB-CG 4.34Å; R320-Y325 HydrophobicContact CG-CE1 4.48Å
321	S	93.6	Very high	91.1	Very high	56 Å²	56	58 Å²	58	39%	0.392	31%	0.313	S	S	.	.			trans	-67.9	160.4	167.8	65.3	0	0	0	0	111.3	E323 E324 Y325	S321-E323 PolarHBondContact O-N 3.1Å; S321-E324 WeakPolarHBondContact CB-OE2 3.14Å; S321-E324 PolarHBondContact N-OE2 3.21Å; S321-E324 PolarHBondContact O-N 3.2Å; S321-E324 VanDerWaalsContact OG-CG 3.31Å; S321-E324 WeakPolarHBondContact OG-CG 3.41Å; S321-E324 PolarHBondContact OG-N 2.97Å; S321-E324 VanDerWaalsContact OG-N 3.15Å; S321-E324 PolarHBondContact OG-OE2 3.02Å; S321-Y325 WeakPolarHBondContact O-CD2 3.37Å; S321-Y325 PolarHBondContact O-N 3.48Å
322	L	95.1	Very high	91.3	Very high	37 Å²	37	62.5 Å²	62.5	19%	0.194	33%	0.327	C	S	.	.	H	α-helix	trans	-59.5	-32	172.6	-76.9	168.5	0	0	0	112.3	L50 Y53 L54 L92 V300 A326	L50-L322 HydrophobicContact CD1-CD2 3.81Å; Y53-L322 HydrophobicContact CD1-CD2 4.49Å; Y53-L322 HydrophobicContact CE1-CB 4.34Å; Y53-L322 HydrophobicContact CE1-CD1 4.22Å; Y53-L322 HydrophobicContact CE1-CD2 4.34Å; L54-L322 HydrophobicContact CD2-CD2 4.26Å; L54-L322 WeakPolarHBondContact CD2-O 3.19Å; L92-L322 HydrophobicContact CD2-CD1 4.14Å; L92-L322 HydrophobicContact CD2-CD2 3.72Å; V300-L322 HydrophobicContact CG1-CD2 3.64Å; V300-L322 HydrophobicContact CG1-CG 4.46Å; V300-L322 HydrophobicContact CG2-CD2 4.4Å; L322-A326 WeakPolarHBondContact O-CB 3.45Å; L322-A326 PolarHBondContact O-N 2.74Å
323	E	95	Very high	91.6	Very high	144 Å²	144	64.8 Å²	64.8	67%	0.673	32%	0.321	S	S	*	.	H	α-helix	trans	-68.3	-46.4	177.2	-175.6	175.8	-179.6	0	0	111.7	S321 Y325 A326 N327	S321-E323 PolarHBondContact O-N 3.1Å; E323-Y325 VanDerWaalsContact C-N 3.33Å; E323-Y325 PolarHBondContact O-N 3.47Å; E323-A326 PolarHBondContact O-N 3.28Å; E323-A326 VanDerWaalsContact O-N 3.17Å; E323-N327 PolarHBondContact O-N 2.95Å; E323-N327 PolarHBondContact O-ND2 3.39Å
324	E	94.9	Very high	92.1	Very high	97 Å²	97	64 Å²	64	45%	0.453	32%	0.317	S	S	.	.	H	α-helix	trans	-59.6	-44.3	173.3	-73.7	166.5	124.2	0	0	111.3	R320 S321 A326 N327 L328	R320-E324 WeakPolarHBondContact CA-OE2 3.46Å; R320-E324 HydrophobicContact CB-CB 3.95Å; S321-E324 WeakPolarHBondContact CB-OE2 3.14Å; S321-E324 PolarHBondContact N-OE2 3.21Å; S321-E324 PolarHBondContact O-N 3.2Å; S321-E324 VanDerWaalsContact OG-CG 3.31Å; S321-E324 WeakPolarHBondContact OG-CG 3.41Å; S321-E324 PolarHBondContact OG-N 2.97Å; S321-E324 VanDerWaalsContact OG-N 3.15Å; S321-E324 PolarHBondContact OG-OE2 3.02Å; E324-A326 VanDerWaalsContact C-N 3.33Å; E324-A326 PolarHBondContact O-N 3.47Å; E324-N327 PolarHBondContact O-N 3.48Å; E324-L328 VanDerWaalsContact O-CG 3.27Å; E324-L328 WeakPolarHBondContact O-CG 3.48Å; E324-L328 PolarHBondContact O-N 3.5Å; E324-L328 VanDerWaalsContact O-N 3.11Å
325	Y	95.6	Very high	92.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-38.3	175.1	-81.4	-53.9	0	0	0	112.7	V300 S301 C304 F310 R320 S321 E323 N327 L328 F329	V300-Y325 HydrophobicContact CG1-CD2 4.21Å; V300-Y325 HydrophobicContact CG1-CE2 4.32Å; S301-Y325 WeakPolarHBondContact CA-OH 3.49Å; S301-Y325 WeakPolarHBondContact CB-OH 3.26Å; S301-Y325 PolarHBondContact OG-OH 2.8Å; C304-Y325 HydrophobicContact CB-CD1 4.13Å; C304-Y325 HydrophobicContact CB-CE1 3.75Å; F310-Y325 AromaticContact CD1-CD1 3.69Å; F310-Y325 HydrophobicContact CD1-CD1 3.69Å; F310-Y325 HydrophobicContact CD1-CE1 4.42Å; F310-Y325 AromaticContact CE1-CD1 3.55Å; F310-Y325 HydrophobicContact CE1-CD1 3.55Å; F310-Y325 HydrophobicContact CE1-CE1 4.41Å; F310-Y325 HydrophobicContact CE1-CG 4.16Å; F310-Y325 HydrophobicContact CG-CD1 4.5Å; F310-Y325 HydrophobicContact CZ-CD1 4.31Å; R320-Y325 HydrophobicContact CB-CD1 4.48Å; R320-Y325 HydrophobicContact CB-CD2 3.93Å; R320-Y325 HydrophobicContact CB-CE1 4.22Å; R320-Y325 HydrophobicContact CB-CE2 3.64Å; R320-Y325 HydrophobicContact CB-CG 4.34Å; R320-Y325 HydrophobicContact CG-CE1 4.48Å; S321-Y325 WeakPolarHBondContact O-CD2 3.37Å; S321-Y325 PolarHBondContact O-N 3.48Å; E323-Y325 VanDerWaalsContact C-N 3.33Å; E323-Y325 PolarHBondContact O-N 3.47Å; Y325-N327 VanDerWaalsContact C-N 3.34Å; Y325-L328 PolarHBondContact O-N 3.4Å; Y325-F329 VanDerWaalsContact O-CB 3.3Å; Y325-F329 WeakPolarHBondContact O-CB 3.45Å; Y325-F329 PolarHBondContact O-N 2.89Å
326	A	95.5	Very high	93	Very high	5 Å²	5	61.3 Å²	61.3	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-66.1	-37.4	177.9	0	0	0	0	0	111.8	L54 K57 Q58 L322 E323 E324 L328	L54-A326 HydrophobicContact CD2-CB 4.06Å; K57-A326 HydrophobicContact CB-CB 3.86Å; Q58-A326 WeakPolarHBondContact CB-O 3.47Å; Q58-A326 WeakPolarHBondContact CG-O 3.34Å; L322-A326 WeakPolarHBondContact O-CB 3.45Å; L322-A326 PolarHBondContact O-N 2.74Å; E323-A326 PolarHBondContact O-N 3.28Å; E323-A326 VanDerWaalsContact O-N 3.17Å; E324-A326 VanDerWaalsContact C-N 3.33Å; E324-A326 PolarHBondContact O-N 3.47Å; A326-L328 VanDerWaalsContact C-N 3.33Å
327	N	94.9	Very high	93.5	Very high	115 Å²	115	64 Å²	64	62%	0.615	31%	0.305	S	S	*	.	H	α-helix	trans	-67.9	-32.5	176.1	-71.2	-29.3	0	0	0	112.9	E323 E324 Y325	E323-N327 PolarHBondContact O-N 2.95Å; E323-N327 PolarHBondContact O-ND2 3.39Å; E324-N327 PolarHBondContact O-N 3.48Å; Y325-N327 VanDerWaalsContact C-N 3.34Å
328	L	94.8	Very high	93.8	Very high	46 Å²	46	67.1 Å²	67.1	24%	0.241	31%	0.313	C	S	.	.	H	α-helix	trans	-85	-24.2	179.2	-64.9	167.7	0	0	0	113.2	F310 V311 D313 E324 Y325 A326	F310-L328 CarbonylContact C-O 3.55Å; F310-L328 WeakPolarHBondContact CA-O 3.34Å; F310-L328 HydrophobicContact CB-CB 4.34Å; F310-L328 HydrophobicContact CD1-CB 4.15Å; V311-L328 PolarHBondContact N-O 3.35Å; V311-L328 WeakPolarHBondContact O-CD2 3.27Å; D313-L328 HydrophobicContact CB-CD1 4.4Å; E324-L328 VanDerWaalsContact O-CG 3.27Å; E324-L328 WeakPolarHBondContact O-CG 3.48Å; E324-L328 PolarHBondContact O-N 3.5Å; E324-L328 VanDerWaalsContact O-N 3.11Å; Y325-L328 PolarHBondContact O-N 3.4Å; A326-L328 VanDerWaalsContact C-N 3.33Å
329	F	95.5	Very high	93.7	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	133.5	-173.1	-172.9	-108.7	0	0	0	111.3	F51 L54 F55 Q58 G309 F310 Y325 L331 V334	F51-F329 HydrophobicContact CB-CE2 4.34Å; F51-F329 HydrophobicContact CB-CZ 3.95Å; F51-F329 HydrophobicContact CD1-CE2 4.02Å; F51-F329 HydrophobicContact CD1-CZ 4.5Å; F51-F329 AromaticContact CD2-CE2 3.78Å; F51-F329 HydrophobicContact CD2-CE2 3.78Å; F51-F329 AromaticContact CD2-CZ 3.87Å; F51-F329 HydrophobicContact CD2-CZ 3.87Å; F51-F329 HydrophobicContact CE1-CE2 4.24Å; F51-F329 HydrophobicContact CE2-CE2 4.01Å; F51-F329 HydrophobicContact CE2-CZ 4.49Å; F51-F329 AromaticContact CG-CE2 3.79Å; F51-F329 HydrophobicContact CG-CE2 3.79Å; F51-F329 AromaticContact CG-CZ 3.87Å; F51-F329 HydrophobicContact CG-CZ 3.87Å; F51-F329 HydrophobicContact CZ-CE2 4.23Å; L54-F329 HydrophobicContact CB-CB 4.14Å; L54-F329 HydrophobicContact CB-CD1 4.08Å; L54-F329 HydrophobicContact CB-CG 4Å; L54-F329 HydrophobicContact CD1-CD2 4.31Å; L54-F329 HydrophobicContact CD1-CG 4.45Å; F55-F329 HydrophobicContact CB-CD1 4.28Å; F55-F329 HydrophobicContact CB-CE1 3.86Å; F55-F329 HydrophobicContact CD2-CE1 4.16Å; Q58-F329 PolarHBondContact NE2-O 3.45Å; Q58-F329 PolarHBondContact OE1-O 3.48Å; G309-F329 CarbonylContact O-C 3.58Å; G309-F329 WeakPolarHBondContact O-CA 3.39Å; F310-F329 HydrophobicContact CD1-CB 4.39Å; F310-F329 HydrophobicContact CD1-CD2 4.39Å; F310-F329 HydrophobicContact CE1-CB 4.14Å; F310-F329 AromaticContact CE1-CD2 3.84Å; F310-F329 HydrophobicContact CE1-CD2 3.84Å; F310-F329 HydrophobicContact CE1-CG 4.46Å; F310-F329 HydrophobicContact CE2-CD2 4.35Å; F310-F329 AromaticContact CZ-CD2 3.8Å; F310-F329 HydrophobicContact CZ-CD2 3.8Å; F310-F329 HydrophobicContact CZ-CE2 4.42Å; Y325-F329 VanDerWaalsContact O-CB 3.3Å; Y325-F329 WeakPolarHBondContact O-CB 3.45Å; Y325-F329 PolarHBondContact O-N 2.89Å; F329-L331 HydrophobicContact CE1-CB 4.32Å; F329-L331 HydrophobicContact CZ-CD1 4.27Å; F329-V334 HydrophobicContact CE2-CG2 4.14Å; F329-V334 HydrophobicContact CZ-CG2 4.21Å
330	D	94.4	Very high	93.4	Very high	45 Å²	45	70.5 Å²	70.5	24%	0.241	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	116.5	168.5	-179.7	-6.6	0	0	0	107.8	G309 V311 K332 H333	G309-D330 PolarHBondContact O-N 3.11Å; V311-D330 HydrophobicContact CG2-CB 3.83Å; D330-K332 PolarHBondContact O-N 2.56Å; D330-K332 VanDerWaalsContact O-N 3.14Å; D330-K332 WeakPolarHBondContact OD1-CB 3.22Å; D330-K332 PolarHBondContact OD1-N 3.17Å; D330-H333 HydrophobicContact CB-CB 4.34Å; D330-H333 VanDerWaalsContact CG-ND1 3.32Å; D330-H333 PolarHBondContact O-N 3.3Å; D330-H333 IonicContact OD2-CE1 3.79Å; D330-H333 PolarHBondContact OD2-CE1 3.33Å; D330-H333 VanDerWaalsContact OD2-CE1 3.27Å; D330-H333 IonicContact OD2-ND1 2.81Å; D330-H333 PolarHBondContact OD2-ND1 2.68Å
331	L	94.7	Very high	92.8	Very high	6 Å²	6	69.4 Å²	69.4	3%	0.031	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	-31.2	-178.6	-173.6	58.3	0	0	0	112.6	F55 V193 L237 A264 F329 H333 V334	F55-L331 HydrophobicContact CD2-CB 4.01Å; F55-L331 HydrophobicContact CD2-CD2 4.14Å; F55-L331 HydrophobicContact CE2-CB 4Å; F55-L331 HydrophobicContact CE2-CD2 3.85Å; F55-L331 HydrophobicContact CZ-CD2 4.28Å; V193-L331 HydrophobicContact CB-CD2 4.37Å; V193-L331 HydrophobicContact CB-CG 4.44Å; V193-L331 HydrophobicContact CG1-CB 4.43Å; V193-L331 HydrophobicContact CG1-CD2 4Å; V193-L331 HydrophobicContact CG1-CG 3.78Å; L237-L331 HydrophobicContact CD1-CD2 3.94Å; L237-L331 HydrophobicContact CD2-CD1 3.72Å; L237-L331 HydrophobicContact CD2-CD2 4.18Å; L237-L331 HydrophobicContact CG-CD1 4.03Å; L237-L331 HydrophobicContact CG-CD2 4.17Å; A264-L331 HydrophobicContact CB-CD1 4.04Å; A264-L331 HydrophobicContact CB-CD2 3.86Å; A264-L331 HydrophobicContact CB-CG 4.24Å; F329-L331 HydrophobicContact CE1-CB 4.32Å; F329-L331 HydrophobicContact CZ-CD1 4.27Å; L331-H333 PolarHBondContact O-N 3.24Å; L331-V334 HydrophobicContact CD1-CG2 4.2Å; L331-V334 WeakPolarHBondContact O-CB 3.32Å; L331-V334 WeakPolarHBondContact O-CG2 3.34Å; L331-V334 PolarHBondContact O-N 3.05Å
332	K	93.2	Very high	92.4	Very high	164 Å²	164	68.2 Å²	68.2	71%	0.713	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	-20	178.3	-63.5	178.6	-179.3	177.1	0	113.3	V193 D330	V193-K332 HydrophobicContact CG1-CG 4.23Å; D330-K332 PolarHBondContact O-N 2.56Å; D330-K332 VanDerWaalsContact O-N 3.14Å; D330-K332 WeakPolarHBondContact OD1-CB 3.22Å; D330-K332 PolarHBondContact OD1-N 3.17Å
333	H	93.7	Very high	91.9	Very high	111 Å²	111	68 Å²	68	51%	0.514	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	3.3	179.3	-71.9	87.2	0	0	0	112.7	G309 V311 D330 L331 A335	G309-H333 VanDerWaalsContact CA-C 3.47Å; G309-H333 WeakPolarHBondContact CA-O 3.47Å; G309-H333 PolarHBondContact N-O 3.47Å; V311-H333 HydrophobicContact CG2-CB 4.12Å; D330-H333 HydrophobicContact CB-CB 4.34Å; D330-H333 VanDerWaalsContact CG-ND1 3.32Å; D330-H333 PolarHBondContact O-N 3.3Å; D330-H333 IonicContact OD2-CE1 3.79Å; D330-H333 PolarHBondContact OD2-CE1 3.33Å; D330-H333 VanDerWaalsContact OD2-CE1 3.27Å; D330-H333 IonicContact OD2-ND1 2.81Å; D330-H333 PolarHBondContact OD2-ND1 2.68Å; L331-H333 PolarHBondContact O-N 3.24Å; H333-A335 PolarHBondContact O-N 3.32Å
334	V	94.5	Very high	91.6	Very high	7 Å²	7	66.6 Å²	66.6	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	123.1	169.7	176.6	0	0	0	0	108.5	F51 V194 L266 F329 L331	F51-V334 HydrophobicContact CD2-CG2 4.24Å; F51-V334 HydrophobicContact CE2-CG1 4.23Å; F51-V334 HydrophobicContact CE2-CG2 3.92Å; V194-V334 HydrophobicContact CG1-CG1 4.2Å; V194-V334 HydrophobicContact CG2-CB 4.13Å; V194-V334 HydrophobicContact CG2-CG1 4.14Å; L266-V334 HydrophobicContact CD2-CG1 4.22Å; F329-V334 HydrophobicContact CE2-CG2 4.14Å; F329-V334 HydrophobicContact CZ-CG2 4.21Å; L331-V334 HydrophobicContact CD1-CG2 4.2Å; L331-V334 WeakPolarHBondContact O-CB 3.32Å; L331-V334 WeakPolarHBondContact O-CG2 3.34Å; L331-V334 PolarHBondContact O-N 3.05Å
335	A	92	Very high	91.3	Very high	27 Å²	27	65.8 Å²	65.8	22%	0.223	30%	0.296	C	S	.	.			trans	-72.5	146	-177.7	0	0	0	0	0	111.2	P267 G307 H333 R337	P267-A335 WeakPolarHBondContact CG-O 3.44Å; G307-A335 WeakPolarHBondContact O-CB 3.32Å; G307-A335 PolarHBondContact O-N 3.27Å; H333-A335 PolarHBondContact O-N 3.32Å; A335-R337 VanDerWaalsContact C-N 3.32Å; A335-R337 HydrophobicContact CB-CG 4.11Å
336	R	92.3	Very high	91.2	Very high	151 Å²	151	65.8 Å²	65.8	57%	0.57	30%	0.296	S	S	*	.	S	Bend	trans	-75.3	-20.7	174.2	-61.6	174.8	-173.3	175.2	-1.7	113.5	V194 Y195	V194-R336 HydrophobicContact CG1-CG 4.22Å; V194-R336 VanDerWaalsContact O-CG 3.26Å; V194-R336 WeakPolarHBondContact O-CG 3.25Å; V194-R336 PolarHBondContact O-NE 2.94Å; Y195-R336 HydrophobicContact CD1-CB 4.2Å; Y195-R336 HydrophobicContact CD1-CG 4.09Å; Y195-R336 HydrophobicContact CE1-CB 4.08Å; Y195-R336 HydrophobicContact CE1-CG 4.43Å; Y195-R336 PolarHBondContact O-NH2 3.45Å
337	R	91.6	Very high	91.1	Very high	182 Å²	182	68.8 Å²	68.8	69%	0.687	31%	0.309	S	S	*	.	S	Bend	trans	-70.3	140.9	-178.5	71.4	-175.8	176.7	-144.2	-4.8	110.4	A335 P339	A335-R337 VanDerWaalsContact C-N 3.32Å; A335-R337 HydrophobicContact CB-CG 4.11Å; R337-P339 VanDerWaalsContact O-CD 3.25Å; R337-P339 WeakPolarHBondContact O-CD 3.43Å
338	R	92	Very high	91	Very high	126 Å²	126	66.6 Å²	66.6	48%	0.475	30%	0.297	S	S	.	.			trans	-68.6	112.7	172.5	-67.1	-178.8	179.1	166.4	3.1	110.4	E240 P267 L268 L270	E240-R338 IonicContact OE1-CZ 3.72Å; E240-R338 IonicContact OE1-NE 3.29Å; E240-R338 PolarHBondContact OE1-NE 3.48Å; E240-R338 IonicContact OE1-NH2 3.5Å; E240-R338 PolarHBondContact OE1-NH2 2.99Å; E240-R338 IonicContact OE2-CZ 3.49Å; E240-R338 IonicContact OE2-NE 3.79Å; E240-R338 IonicContact OE2-NH2 2.67Å; E240-R338 PolarHBondContact OE2-NH2 3.33Å; P267-R338 HydrophobicContact CB-CG 4.29Å; L268-R338 WeakPolarHBondContact O-CA 3.44Å; L268-R338 VanDerWaalsContact O-CB 3.28Å; L268-R338 WeakPolarHBondContact O-CB 3.23Å; L270-R338 HydrophobicContact CD1-CB 3.59Å; L270-R338 HydrophobicContact CD1-CG 4.48Å; L270-R338 HydrophobicContact CG-CB 3.81Å
339	P	88.9	Confident	91	Very high	15 Å²	15	64.4 Å²	64.4	10%	0.097	29%	0.286	C	S	.	.			trans	-70.8	140.2	-178.6	30.2	-37	0	0	0	110.8	L268 I269 L270 A306 R337	L268-P339 WeakPolarHBondContact O-CD 3.15Å; I269-P339 HydrophobicContact CG1-CG 4.24Å; L270-P339 PolarHBondContact N-O 2.96Å; A306-P339 HydrophobicContact CB-CG 4.26Å; R337-P339 VanDerWaalsContact O-CD 3.25Å; R337-P339 WeakPolarHBondContact O-CD 3.43Å
340	K	86	Confident	91.1	Very high	108 Å²	108	64.4 Å²	64.4	47%	0.47	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-96.9	130.2	164.6	-65.9	-174.8	175.7	-165.5	0	108.5	L270 L272	L270-K340 HydrophobicContact CB-CG 4.12Å; L270-K340 WeakPolarHBondContact O-CA 3.48Å; L272-K340 PolarHBondContact O-NZ 3.39Å; L272-K340 VanDerWaalsContact O-NZ 3.13Å
341	L	80.7	Confident	91.2	Very high	16 Å²	16	66.5 Å²	66.5	8%	0.084	29%	0.29	C	S	.	.			trans	-107	125.4	178.3	-68.5	179.1	0	0	0	110.6	L43 I269 L270 F302 F305 A306	L43-L341 HydrophobicContact CD2-CD1 3.4Å; L43-L341 VanDerWaalsContact CD2-CD1 3.4Å; L43-L341 HydrophobicContact CG-CD1 4.11Å; I269-L341 HydrophobicContact CD1-CD1 4.24Å; I269-L341 HydrophobicContact CG2-CB 4.44Å; I269-L341 HydrophobicContact CG2-CD1 3.54Å; I269-L341 HydrophobicContact CG2-CG 3.83Å; L270-L341 PolarHBondContact O-N 3.25Å; F302-L341 HydrophobicContact CE1-CB 4.45Å; F302-L341 HydrophobicContact CE1-CD1 4.16Å; F302-L341 HydrophobicContact CE2-CB 4.05Å; F302-L341 HydrophobicContact CE2-CD2 4.15Å; F302-L341 HydrophobicContact CE2-CG 4.5Å; F302-L341 HydrophobicContact CZ-CB 3.66Å; F302-L341 HydrophobicContact CZ-CD1 4.1Å; F302-L341 HydrophobicContact CZ-CD2 4.42Å; F302-L341 HydrophobicContact CZ-CG 4.29Å; F305-L341 HydrophobicContact CB-CD2 4.46Å; A306-L341 HydrophobicContact CB-CD1 3.73Å; A306-L341 HydrophobicContact CB-CD2 3.9Å; A306-L341 HydrophobicContact CB-CG 4.15Å
342	D	84.3	Confident	91.2	Very high	30 Å²	30	69.3 Å²	69.3	16%	0.16	30%	0.303	C	S	.	.			trans	-94.7	120.3	171.6	-165.3	-24.5	0	0	0	109.5	L272 F302 Q344 W345	L272-D342 HydrophobicContact CD1-CB 4.35Å; L272-D342 HydrophobicContact CD2-CB 3.98Å; F302-D342 VanDerWaalsContact CE2-O 3.23Å; F302-D342 WeakPolarHBondContact CE2-O 3.22Å; D342-Q344 PolarHBondContact O-N 2.87Å; D342-Q344 VanDerWaalsContact O-N 3.14Å; D342-Q344 WeakPolarHBondContact OD1-CB 3.29Å; D342-Q344 VanDerWaalsContact OD1-CG 3.3Å; D342-Q344 WeakPolarHBondContact OD1-CG 3.43Å; D342-Q344 PolarHBondContact OD1-N 3.26Å; D342-W345 HydrophobicContact CB-CD2 4.28Å; D342-W345 HydrophobicContact CB-CG 4.34Å; D342-W345 WeakPolarHBondContact O-CB 3.41Å; D342-W345 PolarHBondContact O-N 3.31Å
343	I	85.5	Confident	91.3	Very high	33 Å²	33	61.5 Å²	61.5	17%	0.169	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-22.6	178.3	-163	68.2	0	0	0	112.6	M283 Y289 F302 W345 L346 Q347	M283-I343 HydrophobicContact CE-CB 4.37Å; M283-I343 HydrophobicContact CE-CD1 4.29Å; M283-I343 HydrophobicContact CE-CG1 3.61Å; M283-I343 HydrophobicContact CE-CG2 4.23Å; M283-I343 HydrophobicContact SD-CB 4.35Å; M283-I343 HydrophobicContact SD-CG1 4.07Å; M283-I343 HydrophobicContact SD-CG2 4.27Å; Y289-I343 HydrophobicContact CE1-CD1 3.68Å; F302-I343 HydrophobicContact CE1-CD1 4.41Å; F302-I343 HydrophobicContact CZ-CD1 4.46Å; I343-W345 PolarHBondContact O-N 2.71Å; I343-L346 HydrophobicContact CD1-CB 4Å; I343-L346 HydrophobicContact CD1-CD2 3.59Å; I343-L346 HydrophobicContact CD1-CG 4.38Å; I343-L346 WeakPolarHBondContact O-CB 3.39Å; I343-L346 PolarHBondContact O-N 2.96Å; I343-Q347 PolarHBondContact O-N 3.08Å
344	Q	87.9	Confident	91.4	Very high	115 Å²	115	56.5 Å²	56.5	54%	0.537	25%	0.246	S	C	.	.	H	α-helix	trans	-58.4	-32.7	173.3	-65.2	-179.9	16	0	0	111.6	D342 Q347 L348	D342-Q344 PolarHBondContact O-N 2.87Å; D342-Q344 VanDerWaalsContact O-N 3.14Å; D342-Q344 WeakPolarHBondContact OD1-CB 3.29Å; D342-Q344 VanDerWaalsContact OD1-CG 3.3Å; D342-Q344 WeakPolarHBondContact OD1-CG 3.43Å; D342-Q344 PolarHBondContact OD1-N 3.26Å; Q344-Q347 WeakPolarHBondContact O-CB 3.5Å; Q344-Q347 PolarHBondContact O-N 3.35Å; Q344-L348 WeakPolarHBondContact O-CG 3.34Å; Q344-L348 PolarHBondContact O-N 2.7Å
345	W	89.4	Confident	91.4	Very high	80 Å²	80	60.1 Å²	60.1	30%	0.303	28%	0.277	S	S	.	.	H	α-helix	trans	-67.9	-40.6	175.4	-60.9	-8.1	0	0	0	111.7	F302 F305 D342 I343 Q347 L348 L349	F302-W345 HydrophobicContact CD2-CB 4.29Å; F302-W345 HydrophobicContact CE2-CB 4.26Å; F305-W345 HydrophobicContact CD2-CE3 4.45Å; D342-W345 HydrophobicContact CB-CD2 4.28Å; D342-W345 HydrophobicContact CB-CG 4.34Å; D342-W345 WeakPolarHBondContact O-CB 3.41Å; D342-W345 PolarHBondContact O-N 3.31Å; I343-W345 PolarHBondContact O-N 2.71Å; W345-Q347 VanDerWaalsContact C-N 3.29Å; W345-Q347 PolarHBondContact O-N 3.31Å; W345-L348 PolarHBondContact O-N 2.92Å; W345-L349 WeakPolarHBondContact O-CB 3.39Å; W345-L349 WeakPolarHBondContact O-CG 3.38Å; W345-L349 PolarHBondContact O-N 3.28Å
346	L	92.7	Very high	91.5	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-41.4	173.7	179.9	61.3	0	0	0	110.8	Y289 F294 A298 V299 F302 I343 L349 N350	Y289-L346 HydrophobicContact CD1-CD2 3.75Å; Y289-L346 HydrophobicContact CD2-CD2 4.31Å; Y289-L346 HydrophobicContact CE1-CD2 3.66Å; Y289-L346 HydrophobicContact CE2-CD2 4.19Å; Y289-L346 HydrophobicContact CG-CD2 4.09Å; F294-L346 HydrophobicContact CD1-CD1 4.05Å; F294-L346 HydrophobicContact CD1-CD2 3.83Å; F294-L346 HydrophobicContact CD1-CG 3.64Å; F294-L346 HydrophobicContact CE1-CD1 4.45Å; F294-L346 HydrophobicContact CE1-CD2 3.79Å; F294-L346 HydrophobicContact CE1-CG 3.58Å; F294-L346 HydrophobicContact CG-CD2 4.36Å; F294-L346 HydrophobicContact CZ-CD2 4.24Å; F294-L346 HydrophobicContact CZ-CG 4.44Å; A298-L346 HydrophobicContact CB-CD1 4.23Å; A298-L346 WeakPolarHBondContact O-CD1 3.31Å; V299-L346 HydrophobicContact CG2-CD1 4.1Å; F302-L346 HydrophobicContact CB-CB 4.26Å; F302-L346 HydrophobicContact CB-CD1 3.67Å; F302-L346 HydrophobicContact CB-CG 4.49Å; F302-L346 HydrophobicContact CD1-CB 3.93Å; F302-L346 HydrophobicContact CD1-CD1 4.14Å; F302-L346 HydrophobicContact CD1-CD2 4.12Å; F302-L346 HydrophobicContact CD1-CG 4.26Å; F302-L346 HydrophobicContact CD2-CB 3.87Å; F302-L346 HydrophobicContact CE1-CB 4.13Å; F302-L346 HydrophobicContact CE1-CD2 4.33Å; F302-L346 HydrophobicContact CE2-CB 4.09Å; F302-L346 HydrophobicContact CG-CB 3.77Å; F302-L346 HydrophobicContact CG-CD1 4.01Å; F302-L346 HydrophobicContact CG-CG 4.32Å; F302-L346 HydrophobicContact CZ-CB 4.19Å; I343-L346 HydrophobicContact CD1-CB 4Å; I343-L346 HydrophobicContact CD1-CD2 3.59Å; I343-L346 HydrophobicContact CD1-CG 4.38Å; I343-L346 WeakPolarHBondContact O-CB 3.39Å; I343-L346 PolarHBondContact O-N 2.96Å; L346-L349 PolarHBondContact O-N 3.3Å; L346-N350 VanDerWaalsContact O-CB 3.26Å; L346-N350 WeakPolarHBondContact O-CB 3.31Å; L346-N350 PolarHBondContact O-N 3.15Å
347	Q	93.5	Very high	91.7	Very high	68 Å²	68	60.4 Å²	60.4	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-60.7	-45.1	176.1	-72.4	175.2	-26.7	0	0	112.1	F294 I343 Q344 W345 N350 R351 C399	F294-Q347 HydrophobicContact CE1-CG 4.47Å; F294-Q347 HydrophobicContact CZ-CG 4.45Å; I343-Q347 PolarHBondContact O-N 3.08Å; Q344-Q347 WeakPolarHBondContact O-CB 3.5Å; Q344-Q347 PolarHBondContact O-N 3.35Å; W345-Q347 VanDerWaalsContact C-N 3.29Å; W345-Q347 PolarHBondContact O-N 3.31Å; Q347-N350 PolarHBondContact O-N 2.74Å; Q347-R351 PolarHBondContact O-N 3Å; Q347-C399 HydrophobicContact CB-CB 3.82Å; Q347-C399 HydrophobicContact CG-CB 4.19Å; Q347-C399 WeakPolarHBondContact O-CB 3.11Å
348	L	94	Very high	91.9	Very high	69 Å²	69	55.4 Å²	55.4	36%	0.361	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-44.6	177.3	-69.7	173.5	0	0	0	112.5	L317 Q344 W345 N350 R351 Q352	L317-L348 HydrophobicContact CD1-CD1 4.1Å; L317-L348 HydrophobicContact CD2-CB 4Å; L317-L348 HydrophobicContact CD2-CD1 4.25Å; Q344-L348 WeakPolarHBondContact O-CG 3.34Å; Q344-L348 PolarHBondContact O-N 2.7Å; W345-L348 PolarHBondContact O-N 2.92Å; L348-N350 VanDerWaalsContact C-N 3.29Å; L348-N350 PolarHBondContact O-N 3.29Å; L348-R351 PolarHBondContact O-N 3.05Å; L348-Q352 PolarHBondContact O-N 3.26Å
349	L	95	Very high	92.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-42.9	173.1	-73.5	169.8	0	0	0	110.9	A298 F302 F305 L317 L319 W345 L346 R351 Q352 A353	A298-L349 HydrophobicContact CB-CB 3.96Å; F302-L349 HydrophobicContact CB-CD1 3.89Å; F305-L349 HydrophobicContact CD2-CD1 4.38Å; F305-L349 HydrophobicContact CE2-CD1 3.58Å; F305-L349 HydrophobicContact CE2-CD2 4.34Å; F305-L349 HydrophobicContact CE2-CG 4.36Å; F305-L349 HydrophobicContact CZ-CD1 4.42Å; L317-L349 HydrophobicContact CD2-CG 4.41Å; L319-L349 HydrophobicContact CD2-CB 4.17Å; L319-L349 HydrophobicContact CD2-CD2 3.95Å; L319-L349 HydrophobicContact CG-CD2 4.3Å; W345-L349 WeakPolarHBondContact O-CB 3.39Å; W345-L349 WeakPolarHBondContact O-CG 3.38Å; W345-L349 PolarHBondContact O-N 3.28Å; L346-L349 PolarHBondContact O-N 3.3Å; L349-R351 VanDerWaalsContact C-N 3.35Å; L349-R351 PolarHBondContact O-N 3.02Å; L349-Q352 WeakPolarHBondContact O-CB 3.25Å; L349-Q352 PolarHBondContact O-N 3.03Å; L349-A353 PolarHBondContact O-N 3.46Å
350	N	96.7	Very high	92.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-33.6	-178	-154.6	70.4	0	0	0	112.8	F294 Y295 A298 L346 Q347 L348 Q352 A353 L354 C399	F294-N350 VanDerWaalsContact CA-OD1 3.22Å; F294-N350 WeakPolarHBondContact CA-OD1 3.38Å; F294-N350 HydrophobicContact CD1-CB 3.58Å; F294-N350 VanDerWaalsContact CD1-CG 3.43Å; F294-N350 HydrophobicContact CE1-CB 3.92Å; Y295-N350 PolarHBondContact N-OD1 2.71Å; A298-N350 HydrophobicContact CB-CB 4.01Å; A298-N350 WeakPolarHBondContact CB-OD1 3.4Å; L346-N350 VanDerWaalsContact O-CB 3.26Å; L346-N350 WeakPolarHBondContact O-CB 3.31Å; L346-N350 PolarHBondContact O-N 3.15Å; Q347-N350 PolarHBondContact O-N 2.74Å; L348-N350 VanDerWaalsContact C-N 3.29Å; L348-N350 PolarHBondContact O-N 3.29Å; N350-Q352 VanDerWaalsContact C-N 3.3Å; N350-Q352 PolarHBondContact O-N 3.42Å; N350-A353 PolarHBondContact O-N 3.12Å; N350-L354 VanDerWaalsContact O-CB 3.27Å; N350-L354 WeakPolarHBondContact O-CB 3.35Å; N350-L354 PolarHBondContact O-N 3.45Å; N350-C399 PolarHBondContact ND2-O 3.44Å
351	R	95.6	Very high	93.1	Very high	89 Å²	89	54 Å²	54	34%	0.336	28%	0.276	S	S	.	.	H	α-helix	trans	-60.1	-42.1	171.6	-176.7	-179.6	-73.1	165	-4.8	111.2	Q347 L348 L349 L354 A355 E397 I398	Q347-R351 PolarHBondContact O-N 3Å; L348-R351 PolarHBondContact O-N 3.05Å; L349-R351 VanDerWaalsContact C-N 3.35Å; L349-R351 PolarHBondContact O-N 3.02Å; R351-L354 PolarHBondContact O-N 2.73Å; R351-A355 WeakPolarHBondContact O-CB 3.48Å; R351-A355 PolarHBondContact O-N 2.93Å; R351-E397 PolarHBondContact NH2-O 2.73Å; R351-I398 PolarHBondContact NE-O 3.46Å
352	Q	94.9	Very high	93.8	Very high	65 Å²	65	53.7 Å²	53.7	30%	0.304	28%	0.275	S	S	.	.	H	α-helix	trans	-66.1	-39.2	174.5	-67.5	179.8	53.6	0	0	112	L317 L319 L348 L349 N350 L354 A355 R356	L317-Q352 PolarHBondContact O-NE2 3.26Å; L317-Q352 PolarHBondContact O-OE1 3.29Å; L319-Q352 HydrophobicContact CD1-CB 3.62Å; L319-Q352 HydrophobicContact CG-CB 4.28Å; L348-Q352 PolarHBondContact O-N 3.26Å; L349-Q352 WeakPolarHBondContact O-CB 3.25Å; L349-Q352 PolarHBondContact O-N 3.03Å; N350-Q352 VanDerWaalsContact C-N 3.3Å; N350-Q352 PolarHBondContact O-N 3.42Å; Q352-L354 VanDerWaalsContact C-N 3.35Å; Q352-A355 PolarHBondContact O-N 3.23Å; Q352-R356 WeakPolarHBondContact O-CG 3.4Å; Q352-R356 PolarHBondContact O-N 3.43Å
353	A	96.3	Very high	94.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-42.6	178.6	0	0	0	0	0	110.6	Y295 E297 A298 L319 L349 N350 A355 R356 K357	Y295-A353 HydrophobicContact CD2-CB 3.79Å; Y295-A353 HydrophobicContact CG-CB 4.16Å; E297-A353 HydrophobicContact CG-CB 3.85Å; A298-A353 HydrophobicContact CB-CB 4.26Å; L319-A353 HydrophobicContact CD1-CB 3.73Å; L319-A353 VanDerWaalsContact CD1-N 3.27Å; L349-A353 PolarHBondContact O-N 3.46Å; N350-A353 PolarHBondContact O-N 3.12Å; A353-A355 VanDerWaalsContact C-N 3.34Å; A353-A355 PolarHBondContact O-N 3.12Å; A353-R356 PolarHBondContact O-N 2.95Å; A353-R356 VanDerWaalsContact O-N 3.17Å; A353-K357 WeakPolarHBondContact O-CG 3.49Å
354	L	96	Very high	95	Very high	6 Å²	6	54.5 Å²	54.5	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-58.7	-44	174.2	-178.9	66.1	0	0	0	111.8	Y295 N350 R351 Q352 R356 K357 L362 I398 L401	Y295-L354 HydrophobicContact CD2-CB 4.49Å; Y295-L354 HydrophobicContact CE2-CB 3.92Å; Y295-L354 HydrophobicContact CE2-CD1 3.77Å; Y295-L354 HydrophobicContact CE2-CG 4.49Å; N350-L354 VanDerWaalsContact O-CB 3.27Å; N350-L354 WeakPolarHBondContact O-CB 3.35Å; N350-L354 PolarHBondContact O-N 3.45Å; R351-L354 PolarHBondContact O-N 2.73Å; Q352-L354 VanDerWaalsContact C-N 3.35Å; L354-R356 PolarHBondContact O-N 2.88Å; L354-K357 PolarHBondContact O-N 2.86Å; L354-L362 HydrophobicContact CD1-CD2 3.53Å; L354-I398 HydrophobicContact CD2-CD1 4.06Å; L354-I398 HydrophobicContact CD2-CG1 3.8Å; L354-L401 HydrophobicContact CD1-CD1 4.31Å; L354-L401 HydrophobicContact CD1-CD2 3.81Å; L354-L401 HydrophobicContact CD1-CG 3.74Å
355	A	94	Very high	95.3	Very high	83 Å²	83	52.1 Å²	52.1	69%	0.686	28%	0.276	S	S	*	.	H	α-helix	trans	-65.3	-20.4	178.8	0	0	0	0	0	113.9	R351 Q352 A353	R351-A355 WeakPolarHBondContact O-CB 3.48Å; R351-A355 PolarHBondContact O-N 2.93Å; Q352-A355 PolarHBondContact O-N 3.23Å; A353-A355 VanDerWaalsContact C-N 3.34Å; A353-A355 PolarHBondContact O-N 3.12Å
356	R	94.3	Very high	95.7	Very high	146 Å²	146	48.3 Å²	48.3	55%	0.551	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.1	177.5	-68.2	176.2	-175.3	-173.7	1.9	113.7	L319 Q352 A353 L354	L319-R356 PolarHBondContact O-NH1 2.79Å; Q352-R356 WeakPolarHBondContact O-CG 3.4Å; Q352-R356 PolarHBondContact O-N 3.43Å; A353-R356 PolarHBondContact O-N 2.95Å; A353-R356 VanDerWaalsContact O-N 3.17Å; L354-R356 PolarHBondContact O-N 2.88Å
357	K	95.8	Very high	95.8	Very high	38 Å²	38	51.2 Å²	51.2	17%	0.165	27%	0.273	C	S	.	.			trans	-78.5	143.5	-176.8	-60.2	-54.3	171.9	-174.7	0	112.2	Y295 E297 A353 L354 E361 L362	Y295-K357 HydrophobicContact CD1-CD 4.42Å; Y295-K357 HydrophobicContact CE1-CD 4.08Å; Y295-K357 HydrophobicContact CE1-CG 4.01Å; Y295-K357 HydrophobicContact CE2-CG 3.97Å; E297-K357 WeakPolarHBondContact OE1-CE 3.18Å; E297-K357 IonicContact OE1-NZ 3.27Å; E297-K357 PolarHBondContact OE1-NZ 3.19Å; E297-K357 IonicContact OE2-NZ 2.96Å; A353-K357 WeakPolarHBondContact O-CG 3.49Å; L354-K357 PolarHBondContact O-N 2.86Å; K357-E361 HydrophobicContact CB-CB 4.26Å; K357-E361 IonicContact NZ-OE1 3.58Å; K357-L362 HydrophobicContact CB-CD1 4.47Å; K357-L362 HydrophobicContact CB-CD2 3.76Å; K357-L362 HydrophobicContact CB-CG 3.81Å; K357-L362 HydrophobicContact CG-CD2 4.4Å
358	T	96.8	Very high	95.8	Very high	76 Å²	76	53.5 Å²	53.5	47%	0.466	28%	0.283	S	S	.	.			trans	-73.1	156.3	172.1	62	0	0	0	0	110.9	A360 E361 L362	T358-A360 PolarHBondContact O-N 2.87Å; T358-E361 WeakPolarHBondContact CB-OE2 3.48Å; T358-E361 PolarHBondContact N-OE2 2.92Å; T358-E361 PolarHBondContact O-N 3.26Å; T358-E361 VanDerWaalsContact O-N 3.09Å; T358-E361 VanDerWaalsContact OG1-CG 3.31Å; T358-E361 WeakPolarHBondContact OG1-CG 3.48Å; T358-E361 PolarHBondContact OG1-N 2.8Å; T358-E361 PolarHBondContact OG1-OE2 3.2Å; T358-L362 VanDerWaalsContact O-CG 3.31Å; T358-L362 WeakPolarHBondContact O-CG 3.35Å; T358-L362 PolarHBondContact O-N 2.84Å
359	D	96.8	Very high	95.9	Very high	81 Å²	81	50.3 Å²	50.3	43%	0.433	27%	0.266	S	S	.	.	H	α-helix	trans	-55	-36.8	174.9	-78	0.2	0	0	0	112.1	L362 L363 L388	D359-L362 PolarHBondContact O-N 3.09Å; D359-L363 VanDerWaalsContact O-CB 3.31Å; D359-L363 WeakPolarHBondContact O-CB 3.2Å; D359-L363 VanDerWaalsContact O-CG 3.28Å; D359-L363 WeakPolarHBondContact O-CG 3.5Å; D359-L363 PolarHBondContact O-N 3.49Å; D359-L388 HydrophobicContact CB-CD1 4.07Å; D359-L388 HydrophobicContact CB-CD2 3.73Å
360	A	97.4	Very high	95.8	Very high	70 Å²	70	50.4 Å²	50.4	58%	0.579	27%	0.267	S	S	*	.	H	α-helix	trans	-63.3	-45.1	176.5	0	0	0	0	0	112.5	T358 A364	T358-A360 PolarHBondContact O-N 2.87Å; A360-A364 WeakPolarHBondContact O-CB 3.2Å; A360-A364 PolarHBondContact O-N 3.22Å
361	E	96.7	Very high	95.7	Very high	68 Å²	68	57.8 Å²	57.8	32%	0.318	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-44.6	175.1	-71.8	168.3	107.3	0	0	111.4	K357 T358 L363 A364 H365	K357-E361 HydrophobicContact CB-CB 4.26Å; K357-E361 IonicContact NZ-OE1 3.58Å; T358-E361 WeakPolarHBondContact CB-OE2 3.48Å; T358-E361 PolarHBondContact N-OE2 2.92Å; T358-E361 PolarHBondContact O-N 3.26Å; T358-E361 VanDerWaalsContact O-N 3.09Å; T358-E361 VanDerWaalsContact OG1-CG 3.31Å; T358-E361 WeakPolarHBondContact OG1-CG 3.48Å; T358-E361 PolarHBondContact OG1-N 2.8Å; T358-E361 PolarHBondContact OG1-OE2 3.2Å; E361-L363 VanDerWaalsContact C-N 3.33Å; E361-L363 PolarHBondContact O-N 2.87Å; E361-A364 PolarHBondContact O-N 3.08Å; E361-H365 WeakPolarHBondContact O-CB 3.27Å; E361-H365 PolarHBondContact O-N 3.32Å; E361-H365 PolarHBondContact O-ND1 3.4Å
362	L	97.1	Very high	95.5	Very high	11 Å²	11	59.2 Å²	59.2	6%	0.058	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-43.5	179.1	-70.5	173.4	0	0	0	111.5	L354 K357 T358 D359 T366 I391 L401	L354-L362 HydrophobicContact CD1-CD2 3.53Å; K357-L362 HydrophobicContact CB-CD1 4.47Å; K357-L362 HydrophobicContact CB-CD2 3.76Å; K357-L362 HydrophobicContact CB-CG 3.81Å; K357-L362 HydrophobicContact CG-CD2 4.4Å; T358-L362 VanDerWaalsContact O-CG 3.31Å; T358-L362 WeakPolarHBondContact O-CG 3.35Å; T358-L362 PolarHBondContact O-N 2.84Å; D359-L362 PolarHBondContact O-N 3.09Å; L362-T366 VanDerWaalsContact O-CB 3.28Å; L362-T366 WeakPolarHBondContact O-CB 3.31Å; L362-T366 PolarHBondContact O-N 3.36Å; L362-T366 PolarHBondContact O-OG1 3.05Å; L362-I391 HydrophobicContact CB-CD1 3.97Å; L362-I391 HydrophobicContact CD1-CG2 4.06Å; L362-I391 HydrophobicContact CD2-CG2 4.37Å; L362-L401 HydrophobicContact CD2-CD1 4.22Å; L362-L401 HydrophobicContact CD2-CD2 4.35Å
363	L	96.9	Very high	95.4	Very high	24 Å²	24	59.9 Å²	59.9	13%	0.126	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-51.3	173.4	-81	171.8	0	0	0	111.7	D359 E361 H365 T366 R367 D384 I387 L388	D359-L363 VanDerWaalsContact O-CB 3.31Å; D359-L363 WeakPolarHBondContact O-CB 3.2Å; D359-L363 VanDerWaalsContact O-CG 3.28Å; D359-L363 WeakPolarHBondContact O-CG 3.5Å; D359-L363 PolarHBondContact O-N 3.49Å; E361-L363 VanDerWaalsContact C-N 3.33Å; E361-L363 PolarHBondContact O-N 2.87Å; L363-H365 PolarHBondContact O-N 3.34Å; L363-T366 PolarHBondContact O-N 2.8Å; L363-R367 WeakPolarHBondContact O-CB 3.3Å; L363-R367 WeakPolarHBondContact O-CG 3.4Å; L363-R367 PolarHBondContact O-N 3.24Å; L363-D384 HydrophobicContact CD1-CB 3.96Å; L363-D384 HydrophobicContact CD2-CB 3.8Å; L363-I387 HydrophobicContact CD2-CB 3.8Å; L363-I387 HydrophobicContact CD2-CD1 4.37Å; L363-I387 HydrophobicContact CD2-CG2 3.72Å; L363-L388 HydrophobicContact CD1-CD1 3.91Å; L363-L388 HydrophobicContact CD1-CD2 4.34Å; L363-L388 HydrophobicContact CD1-CG 4.08Å; L363-L388 HydrophobicContact CD2-CD1 4.5Å; L363-L388 HydrophobicContact CD2-CD2 4.24Å; L363-L388 HydrophobicContact CD2-CG 3.85Å; L363-L388 HydrophobicContact CG-CD1 4.24Å; L363-L388 HydrophobicContact CG-CD2 3.82Å; L363-L388 HydrophobicContact CG-CG 3.83Å
364	A	96.2	Very high	95.1	Very high	56 Å²	56	60.3 Å²	60.3	46%	0.463	30%	0.303	S	S	.	.	H	α-helix	trans	-59	-47	-178.6	0	0	0	0	0	111.8	A360 E361 R367 H368	A360-A364 WeakPolarHBondContact O-CB 3.2Å; A360-A364 PolarHBondContact O-N 3.22Å; E361-A364 PolarHBondContact O-N 3.08Å; A364-R367 PolarHBondContact O-N 3.36Å; A364-H368 PolarHBondContact O-N 2.93Å; A364-H368 VanDerWaalsContact O-N 3.09Å
365	H	95.8	Very high	94.8	Very high	64 Å²	64	62.3 Å²	62.3	30%	0.296	32%	0.32	S	S	.	.	H	α-helix	trans	-67.1	-41.6	178.9	-61.1	136.6	0	0	0	112.3	Y295 E361 L363 H368 L369 L401	Y295-H365 AromaticContact CE1-CE1 3.72Å; Y295-H365 AromaticContact CE1-ND1 3.62Å; E361-H365 WeakPolarHBondContact O-CB 3.27Å; E361-H365 PolarHBondContact O-N 3.32Å; E361-H365 PolarHBondContact O-ND1 3.4Å; L363-H365 PolarHBondContact O-N 3.34Å; H365-H368 WeakPolarHBondContact O-CB 3.49Å; H365-H368 PolarHBondContact O-N 2.7Å; H365-L369 WeakPolarHBondContact O-CG 3.28Å; H365-L369 PolarHBondContact O-N 2.87Å; H365-L369 VanDerWaalsContact O-N 3.13Å; H365-L401 HydrophobicContact CB-CD1 3.71Å
366	T	96.4	Very high	94.5	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-67.9	-38.5	178.1	-54.1	0	0	0	0	111.4	L362 L363 H368 L369 I370 I387 I391 F405 W413	L362-T366 VanDerWaalsContact O-CB 3.28Å; L362-T366 WeakPolarHBondContact O-CB 3.31Å; L362-T366 PolarHBondContact O-N 3.36Å; L362-T366 PolarHBondContact O-OG1 3.05Å; L363-T366 PolarHBondContact O-N 2.8Å; T366-H368 VanDerWaalsContact C-N 3.29Å; T366-H368 PolarHBondContact O-N 3.16Å; T366-L369 CarbonylContact O-C 3.46Å; T366-L369 WeakPolarHBondContact O-CB 3.45Å; T366-L369 PolarHBondContact O-N 3.15Å; T366-I370 HydrophobicContact CG2-CD1 4.37Å; T366-I370 HydrophobicContact CG2-CG1 4.5Å; T366-I370 WeakPolarHBondContact O-CG1 3.46Å; T366-I370 PolarHBondContact O-N 3.28Å; T366-I387 HydrophobicContact CG2-CG2 3.69Å; T366-I391 HydrophobicContact CG2-CD1 4.42Å; T366-I391 WeakPolarHBondContact OG1-CD1 3.37Å; T366-F405 HydrophobicContact CG2-CE2 4.3Å; T366-F405 HydrophobicContact CG2-CZ 4.12Å; T366-W413 HydrophobicContact CG2-CH2 3.82Å; T366-W413 HydrophobicContact CG2-CZ2 4.16Å
367	R	95.1	Very high	94	Very high	62 Å²	62	66 Å²	66	23%	0.234	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-36.2	172.8	-76.2	-171.9	171.5	-72.1	-3.4	112.3	L363 A364 L369 I370 R371 F382 D384 I387	L363-R367 WeakPolarHBondContact O-CB 3.3Å; L363-R367 WeakPolarHBondContact O-CG 3.4Å; L363-R367 PolarHBondContact O-N 3.24Å; A364-R367 PolarHBondContact O-N 3.36Å; R367-L369 VanDerWaalsContact C-N 3.34Å; R367-I370 PolarHBondContact O-N 3.45Å; R367-R371 WeakPolarHBondContact O-CG 3.31Å; R367-R371 PolarHBondContact O-N 2.95Å; R367-F382 PolarHBondContact NH2-O 2.99Å; R367-F382 VanDerWaalsContact NH2-O 3.16Å; R367-D384 IonicContact CZ-OD1 3.41Å; R367-D384 IonicContact NE-OD1 3.29Å; R367-D384 PolarHBondContact NE-OD1 3.5Å; R367-D384 IonicContact NH2-OD1 3.11Å; R367-D384 PolarHBondContact NH2-OD1 2.87Å; R367-I387 HydrophobicContact CG-CD1 4.06Å
368	H	94	Very high	93.4	Very high	115 Å²	115	65.8 Å²	65.8	53%	0.532	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-42.1	171.8	-178.9	77.3	0	0	0	111.9	A364 H365 T366 R371 R372	A364-H368 PolarHBondContact O-N 2.93Å; A364-H368 VanDerWaalsContact O-N 3.09Å; H365-H368 WeakPolarHBondContact O-CB 3.49Å; H365-H368 PolarHBondContact O-N 2.7Å; T366-H368 VanDerWaalsContact C-N 3.29Å; T366-H368 PolarHBondContact O-N 3.16Å; H368-R371 PolarHBondContact O-N 3.34Å; H368-R372 PolarHBondContact O-N 3.13Å
369	L	95.3	Very high	92.8	Very high	3 Å²	3	63.8 Å²	63.8	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-67.7	-39.7	176	-63.2	168.2	0	0	0	112.5	C293 H365 T366 R367 R371 R372 Y373 L401 A402 F405	C293-L369 HydrophobicContact CB-CD1 4.05Å; C293-L369 HydrophobicContact CB-CD2 4.33Å; H365-L369 WeakPolarHBondContact O-CG 3.28Å; H365-L369 PolarHBondContact O-N 2.87Å; H365-L369 VanDerWaalsContact O-N 3.13Å; T366-L369 CarbonylContact O-C 3.46Å; T366-L369 WeakPolarHBondContact O-CB 3.45Å; T366-L369 PolarHBondContact O-N 3.15Å; R367-L369 VanDerWaalsContact C-N 3.34Å; L369-R371 VanDerWaalsContact C-N 3.33Å; L369-R371 PolarHBondContact O-N 3.23Å; L369-R372 WeakPolarHBondContact O-CB 3.28Å; L369-R372 PolarHBondContact O-N 2.76Å; L369-Y373 HydrophobicContact CB-CD2 4.26Å; L369-Y373 HydrophobicContact CB-CE2 4.49Å; L369-Y373 HydrophobicContact CD2-CD2 4.41Å; L369-Y373 HydrophobicContact CD2-CE2 3.81Å; L369-Y373 VanDerWaalsContact O-CD2 3.26Å; L369-Y373 WeakPolarHBondContact O-CD2 3.31Å; L369-Y373 PolarHBondContact O-N 2.88Å; L369-L401 HydrophobicContact CD1-CB 3.55Å; L369-A402 HydrophobicContact CD1-CB 4.42Å; L369-A402 HydrophobicContact CD2-CB 4.22Å; L369-F405 HydrophobicContact CB-CD2 3.95Å; L369-F405 HydrophobicContact CB-CE1 4.37Å; L369-F405 HydrophobicContact CB-CE2 3.36Å; L369-F405 HydrophobicContact CB-CZ 3.62Å; L369-F405 HydrophobicContact CD1-CD2 4.23Å; L369-F405 HydrophobicContact CD1-CE2 3.81Å; L369-F405 HydrophobicContact CG-CE2 4.22Å
370	I	94.8	Very high	91.9	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-56.2	-48.8	173.4	-68.9	170.5	0	0	0	109.9	T366 R367 R372 Y373 V374 Q379 F382 I387 F405 W413	T366-I370 HydrophobicContact CG2-CD1 4.37Å; T366-I370 HydrophobicContact CG2-CG1 4.5Å; T366-I370 WeakPolarHBondContact O-CG1 3.46Å; T366-I370 PolarHBondContact O-N 3.28Å; R367-I370 PolarHBondContact O-N 3.45Å; I370-R372 PolarHBondContact O-N 2.94Å; I370-Y373 PolarHBondContact O-N 3.28Å; I370-V374 HydrophobicContact CB-CG2 4.49Å; I370-V374 HydrophobicContact CG2-CB 4.09Å; I370-V374 HydrophobicContact CG2-CG2 4.09Å; I370-V374 WeakPolarHBondContact O-CA 3.42Å; I370-V374 VanDerWaalsContact O-CB 3.24Å; I370-V374 WeakPolarHBondContact O-CB 3.43Å; I370-V374 PolarHBondContact O-N 3.02Å; I370-Q379 HydrophobicContact CG2-CB 4.05Å; I370-Q379 HydrophobicContact CG2-CG 4.02Å; I370-F382 HydrophobicContact CD1-CB 4.45Å; I370-F382 HydrophobicContact CD1-CD2 4.23Å; I370-F382 HydrophobicContact CG2-CD2 4.2Å; I370-F382 HydrophobicContact CG2-CE2 4.5Å; I370-I387 HydrophobicContact CD1-CD1 3.78Å; I370-I387 HydrophobicContact CD1-CG1 4.12Å; I370-F405 HydrophobicContact CG1-CE1 3.88Å; I370-F405 HydrophobicContact CG1-CZ 3.75Å; I370-W413 HydrophobicContact CD1-CE3 3.98Å; I370-W413 HydrophobicContact CD1-CZ3 3.76Å; I370-W413 HydrophobicContact CG1-CE3 4.08Å; I370-W413 HydrophobicContact CG1-CZ3 4.24Å
371	R	93.3	Very high	91.1	Very high	155 Å²	155	66.7 Å²	66.7	59%	0.585	33%	0.327	S	S	*	.	H	α-helix	trans	-58.9	-30.6	177.9	-70.8	179.9	-167.8	114.7	-3.6	113.4	R367 H368 L369 Q379	R367-R371 WeakPolarHBondContact O-CG 3.31Å; R367-R371 PolarHBondContact O-N 2.95Å; H368-R371 PolarHBondContact O-N 3.34Å; L369-R371 VanDerWaalsContact C-N 3.33Å; L369-R371 PolarHBondContact O-N 3.23Å; R371-Q379 PolarHBondContact O-NE2 3.41Å
372	R	91.5	Very high	90.7	Very high	119 Å²	119	63.6 Å²	63.6	45%	0.449	31%	0.313	S	S	.	.	H	α-helix	trans	-81.8	-39.9	-178.8	-178.4	172.5	175.3	131.1	1.1	113	E291 H368 L369 I370	E291-R372 IonicContact OE1-CZ 3.61Å; E291-R372 IonicContact OE1-NH1 2.63Å; E291-R372 PolarHBondContact OE1-NH1 2.86Å; E291-R372 IonicContact OE1-NH2 2.99Å; E291-R372 PolarHBondContact OE1-NH2 3.43Å; E291-R372 IonicContact OE2-NH2 3.82Å; E291-R372 PolarHBondContact OE2-NH2 3Å; H368-R372 PolarHBondContact O-N 3.13Å; L369-R372 WeakPolarHBondContact O-CB 3.28Å; L369-R372 PolarHBondContact O-N 2.76Å; I370-R372 PolarHBondContact O-N 2.94Å
373	Y	92.1	Very high	90.4	Very high	79 Å²	79	65.8 Å²	65.8	31%	0.31	33%	0.329	S	S	.	.	H	α-helix	trans	-108.2	-14.4	-168.9	-65.8	-67.7	0	0	0	114.7	L369 I370 F405	L369-Y373 HydrophobicContact CB-CD2 4.26Å; L369-Y373 HydrophobicContact CB-CE2 4.49Å; L369-Y373 HydrophobicContact CD2-CD2 4.41Å; L369-Y373 HydrophobicContact CD2-CE2 3.81Å; L369-Y373 VanDerWaalsContact O-CD2 3.26Å; L369-Y373 WeakPolarHBondContact O-CD2 3.31Å; L369-Y373 PolarHBondContact O-N 2.88Å; I370-Y373 PolarHBondContact O-N 3.28Å; Y373-F405 HydrophobicContact CD2-CB 3.99Å; Y373-F405 HydrophobicContact CD2-CD1 4.05Å; Y373-F405 HydrophobicContact CD2-CD2 4.38Å; Y373-F405 AromaticContact CD2-CG 3.86Å; Y373-F405 HydrophobicContact CD2-CG 3.86Å; Y373-F405 HydrophobicContact CG-CB 4.2Å; Y373-F405 HydrophobicContact CG-CD1 4.26Å; Y373-F405 HydrophobicContact CG-CG 4.32Å
374	V	91.6	Very high	90.2	Very high	8 Å²	8	68.2 Å²	68.2	5%	0.048	34%	0.342	C	S	.	.	S	Bend	trans	-113.2	140.2	-173.8	-174.7	0	0	0	0	110.5	I370 E378 Q379 F382 F405 W413	I370-V374 HydrophobicContact CB-CG2 4.49Å; I370-V374 HydrophobicContact CG2-CB 4.09Å; I370-V374 HydrophobicContact CG2-CG2 4.09Å; I370-V374 WeakPolarHBondContact O-CA 3.42Å; I370-V374 VanDerWaalsContact O-CB 3.24Å; I370-V374 WeakPolarHBondContact O-CB 3.43Å; I370-V374 PolarHBondContact O-N 3.02Å; V374-E378 HydrophobicContact CG1-CB 3.71Å; V374-Q379 HydrophobicContact CB-CG 4.36Å; V374-Q379 HydrophobicContact CG1-CG 4.48Å; V374-Q379 PolarHBondContact O-NE2 3.49Å; V374-F382 HydrophobicContact CG1-CE2 4.11Å; V374-F405 HydrophobicContact CG2-CD1 4.48Å; V374-F405 HydrophobicContact CG2-CE1 4.16Å; V374-W413 WeakPolarHBondContact CG1-O 3.43Å; V374-W413 HydrophobicContact CG2-CB 3.72Å
375	A	88.8	Confident	90	Very high	49 Å²	49	69.7 Å²	69.7	41%	0.405	35%	0.349	S	S	.	.			trans	-59.9	142.2	178.3	0	0	0	0	0	111.3	E377 E378 Q379	A375-E377 PolarHBondContact O-N 3.28Å; A375-E377 VanDerWaalsContact O-N 3.1Å; A375-E378 PolarHBondContact O-N 2.7Å; A375-Q379 WeakPolarHBondContact O-CG 3.32Å; A375-Q379 PolarHBondContact O-N 3.11Å
376	L	87.5	Confident	89.9	Confident	135 Å²	135	67 Å²	67	71%	0.707	34%	0.336	S	S	*	.	H	α-helix	trans	-51.6	-39.4	-171.8	-176	63.4	0	0	0	113.1	E378 Q379	L376-E378 VanDerWaalsContact C-N 3.27Å; L376-E378 PolarHBondContact O-N 3.38Å; L376-Q379 PolarHBondContact O-N 3.23Å
377	E	84	Confident	89.8	Confident	171 Å²	171	67 Å²	67	80%	0.799	34%	0.336	S	S	*	.	H	α-helix	trans	-62.5	-30	-179.8	-59.2	123.2	-135.7	0	0	113.5	A375	A375-E377 PolarHBondContact O-N 3.28Å; A375-E377 VanDerWaalsContact O-N 3.1Å
378	E	83.1	Confident	89.8	Confident	34 Å²	34	65.5 Å²	65.5	16%	0.159	33%	0.333	C	S	.	.	H	α-helix	trans	-94.5	-17.7	-176.5	-61.9	-175.7	113.6	0	0	112.4	V374 A375 L376 L380 S381 F382 M415	V374-E378 HydrophobicContact CG1-CB 3.71Å; A375-E378 PolarHBondContact O-N 2.7Å; L376-E378 VanDerWaalsContact C-N 3.27Å; L376-E378 PolarHBondContact O-N 3.38Å; E378-L380 VanDerWaalsContact C-N 3.25Å; E378-L380 PolarHBondContact O-N 3.12Å; E378-L380 VanDerWaalsContact O-N 3.16Å; E378-S381 VanDerWaalsContact O-CB 3.31Å; E378-S381 WeakPolarHBondContact O-CB 3.35Å; E378-S381 PolarHBondContact O-N 3.2Å; E378-S381 PolarHBondContact O-OG 2.85Å; E378-F382 HydrophobicContact CB-CE2 4.48Å; E378-F382 WeakPolarHBondContact O-CD2 3.42Å; E378-F382 WeakPolarHBondContact O-CE2 3.37Å; E378-M415 PolarHBondContact OE1-N 3.18Å
379	Q	84.1	Confident	89.7	Confident	33 Å²	33	64 Å²	64	15%	0.154	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-34	-171.4	-63.8	-179.2	7.4	0	0	113.5	I370 R371 V374 A375 L376 S381	I370-Q379 HydrophobicContact CG2-CB 4.05Å; I370-Q379 HydrophobicContact CG2-CG 4.02Å; R371-Q379 PolarHBondContact O-NE2 3.41Å; V374-Q379 HydrophobicContact CB-CG 4.36Å; V374-Q379 HydrophobicContact CG1-CG 4.48Å; V374-Q379 PolarHBondContact O-NE2 3.49Å; A375-Q379 WeakPolarHBondContact O-CG 3.32Å; A375-Q379 PolarHBondContact O-N 3.11Å; L376-Q379 PolarHBondContact O-N 3.23Å; Q379-S381 VanDerWaalsContact C-N 3.34Å
380	L	79.1	Confident	89.7	Confident	162 Å²	162	63.8 Å²	63.8	85%	0.848	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.7	-179.6	-65.1	176.1	0	0	0	113.3	E378 F382	E378-L380 VanDerWaalsContact C-N 3.25Å; E378-L380 PolarHBondContact O-N 3.12Å; E378-L380 VanDerWaalsContact O-N 3.16Å; L380-F382 PolarHBondContact O-N 3.42Å
381	S	80.7	Confident	89.8	Confident	50 Å²	50	63.8 Å²	63.8	35%	0.35	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-13	-178.6	-55.2	0	0	0	0	113.4	E378 Q379	E378-S381 VanDerWaalsContact O-CB 3.31Å; E378-S381 WeakPolarHBondContact O-CB 3.35Å; E378-S381 PolarHBondContact O-N 3.2Å; E378-S381 PolarHBondContact O-OG 2.85Å; Q379-S381 VanDerWaalsContact C-N 3.34Å
382	F	87.4	Confident	89.8	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.018	31%	0.313	C	S	.	.			trans	-98.7	108.9	-175.9	-50.6	-62	0	0	0	111.6	R367 I370 V374 E378 L380 F386 I387 W413	R367-F382 PolarHBondContact NH2-O 2.99Å; R367-F382 VanDerWaalsContact NH2-O 3.16Å; I370-F382 HydrophobicContact CD1-CB 4.45Å; I370-F382 HydrophobicContact CD1-CD2 4.23Å; I370-F382 HydrophobicContact CG2-CD2 4.2Å; I370-F382 HydrophobicContact CG2-CE2 4.5Å; V374-F382 HydrophobicContact CG1-CE2 4.11Å; E378-F382 HydrophobicContact CB-CE2 4.48Å; E378-F382 WeakPolarHBondContact O-CD2 3.42Å; E378-F382 WeakPolarHBondContact O-CE2 3.37Å; L380-F382 PolarHBondContact O-N 3.42Å; F382-F386 HydrophobicContact CB-CD1 4.03Å; F382-F386 HydrophobicContact CB-CE1 4.48Å; F382-F386 AromaticContact CD1-CD1 3.72Å; F382-F386 HydrophobicContact CD1-CD1 3.72Å; F382-F386 AromaticContact CD1-CE1 3.46Å; F382-F386 HydrophobicContact CD1-CE1 3.46Å; F382-F386 VanDerWaalsContact CD1-CE1 3.46Å; F382-F386 HydrophobicContact CE1-CE1 4.13Å; F382-F386 HydrophobicContact CG-CD1 4.28Å; F382-F386 HydrophobicContact CG-CE1 4.27Å; F382-I387 HydrophobicContact CB-CD1 4.19Å; F382-I387 HydrophobicContact CB-CG1 4.08Å; F382-W413 HydrophobicContact CD1-CE3 4.37Å; F382-W413 HydrophobicContact CD2-CE3 4.37Å; F382-W413 HydrophobicContact CG-CE3 4.28Å; F382-W413 HydrophobicContact CZ-CB 4.36Å; F382-W413 VanDerWaalsContact CZ-O 3.26Å; F382-W413 WeakPolarHBondContact CZ-O 3.37Å
383	S	90.3	Very high	89.8	Confident	56 Å²	56	56.4 Å²	56.4	39%	0.392	30%	0.303	S	S	.	.			trans	-66.8	154	172.5	69.3	0	0	0	0	111.4	S385 F386 I387	S383-S385 PolarHBondContact O-N 3.06Å; S383-S385 PolarHBondContact OG-OG 3.5Å; S383-F386 PolarHBondContact O-N 2.92Å; S383-F386 VanDerWaalsContact O-N 3.14Å; S383-F386 WeakPolarHBondContact OG-CB 3.41Å; S383-F386 PolarHBondContact OG-N 3.07Å; S383-F386 VanDerWaalsContact OG-N 3.12Å; S383-I387 WeakPolarHBondContact O-CG1 3.26Å; S383-I387 PolarHBondContact O-N 3.38Å
384	D	93.6	Very high	89.9	Confident	75 Å²	75	52.9 Å²	52.9	40%	0.401	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-38.9	174.5	-72.4	-20.6	0	0	0	111.7	L363 R367 F386 I387 L388	L363-D384 HydrophobicContact CD1-CB 3.96Å; L363-D384 HydrophobicContact CD2-CB 3.8Å; R367-D384 IonicContact CZ-OD1 3.41Å; R367-D384 IonicContact NE-OD1 3.29Å; R367-D384 PolarHBondContact NE-OD1 3.5Å; R367-D384 IonicContact NH2-OD1 3.11Å; R367-D384 PolarHBondContact NH2-OD1 2.87Å; D384-F386 VanDerWaalsContact C-N 3.33Å; D384-F386 PolarHBondContact O-N 2.78Å; D384-I387 PolarHBondContact O-N 3.31Å; D384-L388 WeakPolarHBondContact O-CG 3.5Å; D384-L388 PolarHBondContact O-N 2.98Å
385	S	91.7	Very high	89.9	Confident	88 Å²	88	56.6 Å²	56.6	62%	0.615	30%	0.304	S	S	*	.	H	α-helix	trans	-60.7	-40.3	176.1	57.1	0	0	0	0	112.8	S383 K389	S383-S385 PolarHBondContact O-N 3.06Å; S383-S385 PolarHBondContact OG-OG 3.5Å; S385-K389 WeakPolarHBondContact O-CB 3.5Å; S385-K389 PolarHBondContact O-N 3.26Å
386	F	92.8	Very high	89.9	Confident	7 Å²	7	60.3 Å²	60.3	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-67.8	-46.5	175.7	169.7	-109.6	0	0	0	111.3	F382 S383 D384 L388 K389 V390 L412 W413 I496 L497 N501	F382-F386 HydrophobicContact CB-CD1 4.03Å; F382-F386 HydrophobicContact CB-CE1 4.48Å; F382-F386 AromaticContact CD1-CD1 3.72Å; F382-F386 HydrophobicContact CD1-CD1 3.72Å; F382-F386 AromaticContact CD1-CE1 3.46Å; F382-F386 HydrophobicContact CD1-CE1 3.46Å; F382-F386 VanDerWaalsContact CD1-CE1 3.46Å; F382-F386 HydrophobicContact CE1-CE1 4.13Å; F382-F386 HydrophobicContact CG-CD1 4.28Å; F382-F386 HydrophobicContact CG-CE1 4.27Å; S383-F386 PolarHBondContact O-N 2.92Å; S383-F386 VanDerWaalsContact O-N 3.14Å; S383-F386 WeakPolarHBondContact OG-CB 3.41Å; S383-F386 PolarHBondContact OG-N 3.07Å; S383-F386 VanDerWaalsContact OG-N 3.12Å; D384-F386 VanDerWaalsContact C-N 3.33Å; D384-F386 PolarHBondContact O-N 2.78Å; F386-L388 VanDerWaalsContact C-N 3.34Å; F386-L388 PolarHBondContact O-N 3.43Å; F386-K389 WeakPolarHBondContact O-CB 3.47Å; F386-K389 PolarHBondContact O-N 3.13Å; F386-K389 VanDerWaalsContact O-N 3.13Å; F386-V390 HydrophobicContact CD2-CG2 4.16Å; F386-V390 HydrophobicContact CE1-CG2 4.08Å; F386-V390 HydrophobicContact CE2-CG2 3.54Å; F386-V390 HydrophobicContact CZ-CG2 3.53Å; F386-V390 WeakPolarHBondContact O-CG2 3.21Å; F386-V390 PolarHBondContact O-N 3.43Å; F386-L412 WeakPolarHBondContact CZ-O 3.47Å; F386-W413 HydrophobicContact CE1-CE3 4.27Å; F386-W413 HydrophobicContact CE1-CZ3 4.01Å; F386-I496 WeakPolarHBondContact CE2-O 3.36Å; F386-L497 HydrophobicContact CE2-CD2 4.16Å; F386-L497 HydrophobicContact CZ-CD2 4.24Å; F386-N501 WeakPolarHBondContact CD2-ND2 3.29Å
387	I	95	Very high	90.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-57.6	-48.4	178.8	-65.5	166.9	0	0	0	110.4	L363 T366 R367 I370 F382 S383 D384 K389 V390 I391 W413	L363-I387 HydrophobicContact CD2-CB 3.8Å; L363-I387 HydrophobicContact CD2-CD1 4.37Å; L363-I387 HydrophobicContact CD2-CG2 3.72Å; T366-I387 HydrophobicContact CG2-CG2 3.69Å; R367-I387 HydrophobicContact CG-CD1 4.06Å; I370-I387 HydrophobicContact CD1-CD1 3.78Å; I370-I387 HydrophobicContact CD1-CG1 4.12Å; F382-I387 HydrophobicContact CB-CD1 4.19Å; F382-I387 HydrophobicContact CB-CG1 4.08Å; S383-I387 WeakPolarHBondContact O-CG1 3.26Å; S383-I387 PolarHBondContact O-N 3.38Å; D384-I387 PolarHBondContact O-N 3.31Å; I387-K389 VanDerWaalsContact C-N 3.32Å; I387-K389 PolarHBondContact O-N 3.03Å; I387-V390 PolarHBondContact O-N 3.1Å; I387-I391 HydrophobicContact CG2-CD1 3.81Å; I387-I391 HydrophobicContact CG2-CG1 4.49Å; I387-I391 VanDerWaalsContact O-CG1 3.31Å; I387-I391 WeakPolarHBondContact O-CG1 3.31Å; I387-I391 PolarHBondContact O-N 3.48Å; I387-W413 HydrophobicContact CG1-CH2 4.44Å; I387-W413 HydrophobicContact CG1-CZ3 4.04Å; I387-W413 HydrophobicContact CG2-CH2 4.42Å
388	L	95.2	Very high	90.6	Very high	30 Å²	30	50.2 Å²	50.2	16%	0.157	27%	0.267	C	S	.	.	H	α-helix	trans	-63.8	-36.4	177.3	-74.2	175.7	0	0	0	112.7	D359 L363 D384 F386 I391 N392	D359-L388 HydrophobicContact CB-CD1 4.07Å; D359-L388 HydrophobicContact CB-CD2 3.73Å; L363-L388 HydrophobicContact CD1-CD1 3.91Å; L363-L388 HydrophobicContact CD1-CD2 4.34Å; L363-L388 HydrophobicContact CD1-CG 4.08Å; L363-L388 HydrophobicContact CD2-CD1 4.5Å; L363-L388 HydrophobicContact CD2-CD2 4.24Å; L363-L388 HydrophobicContact CD2-CG 3.85Å; L363-L388 HydrophobicContact CG-CD1 4.24Å; L363-L388 HydrophobicContact CG-CD2 3.82Å; L363-L388 HydrophobicContact CG-CG 3.83Å; D384-L388 WeakPolarHBondContact O-CG 3.5Å; D384-L388 PolarHBondContact O-N 2.98Å; F386-L388 VanDerWaalsContact C-N 3.34Å; F386-L388 PolarHBondContact O-N 3.43Å; L388-I391 PolarHBondContact O-N 2.83Å; L388-N392 VanDerWaalsContact O-CB 3.3Å; L388-N392 WeakPolarHBondContact O-CB 3.38Å; L388-N392 PolarHBondContact O-N 3.38Å; L388-N392 PolarHBondContact O-ND2 2.96Å; L388-N392 VanDerWaalsContact O-ND2 3.1Å
389	K	92.8	Very high	91.2	Very high	83 Å²	83	49.2 Å²	49.2	36%	0.361	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-44.7	175	-167.6	174	-167.3	177.1	0	111.4	S385 F386 I387 N392 H393 E495	S385-K389 WeakPolarHBondContact O-CB 3.5Å; S385-K389 PolarHBondContact O-N 3.26Å; F386-K389 WeakPolarHBondContact O-CB 3.47Å; F386-K389 PolarHBondContact O-N 3.13Å; F386-K389 VanDerWaalsContact O-N 3.13Å; I387-K389 VanDerWaalsContact C-N 3.32Å; I387-K389 PolarHBondContact O-N 3.03Å; K389-N392 PolarHBondContact O-N 3.44Å; K389-H393 WeakPolarHBondContact O-CB 3.49Å; K389-H393 PolarHBondContact O-N 3.24Å; K389-E495 WeakPolarHBondContact CE-O 3.4Å; K389-E495 PolarHBondContact NZ-O 3.44Å
390	V	95.3	Very high	91.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-49	175.2	170.3	0	0	0	0	111	F386 I387 N392 H393 Y394 L404 L412 W413 I496	F386-V390 HydrophobicContact CD2-CG2 4.16Å; F386-V390 HydrophobicContact CE1-CG2 4.08Å; F386-V390 HydrophobicContact CE2-CG2 3.54Å; F386-V390 HydrophobicContact CZ-CG2 3.53Å; F386-V390 WeakPolarHBondContact O-CG2 3.21Å; F386-V390 PolarHBondContact O-N 3.43Å; I387-V390 PolarHBondContact O-N 3.1Å; V390-N392 PolarHBondContact O-N 2.85Å; V390-H393 PolarHBondContact O-N 3.41Å; V390-Y394 HydrophobicContact CG1-CD2 4.1Å; V390-Y394 HydrophobicContact CG1-CE2 4.48Å; V390-Y394 WeakPolarHBondContact O-CD2 3.49Å; V390-Y394 PolarHBondContact O-N 3.09Å; V390-Y394 VanDerWaalsContact O-N 3.15Å; V390-L404 HydrophobicContact CG1-CD1 4.3Å; V390-L404 HydrophobicContact CG1-CD2 4.13Å; V390-L412 HydrophobicContact CG1-CD1 3.74Å; V390-L412 HydrophobicContact CG2-CD2 4.42Å; V390-W413 HydrophobicContact CB-CH2 4.22Å; V390-W413 HydrophobicContact CB-CZ2 4.45Å; V390-W413 HydrophobicContact CG1-CH2 3.99Å; V390-W413 HydrophobicContact CG1-CZ2 3.72Å; V390-W413 HydrophobicContact CG2-CH2 4.46Å; V390-I496 HydrophobicContact CG2-CG2 3.85Å
391	I	95.4	Very high	92.6	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-47.9	-179.1	-64.3	167.4	0	0	0	110.4	L362 T366 I387 L388 H393 Y394 K395 L401 L404	L362-I391 HydrophobicContact CB-CD1 3.97Å; L362-I391 HydrophobicContact CD1-CG2 4.06Å; L362-I391 HydrophobicContact CD2-CG2 4.37Å; T366-I391 HydrophobicContact CG2-CD1 4.42Å; T366-I391 WeakPolarHBondContact OG1-CD1 3.37Å; I387-I391 HydrophobicContact CG2-CD1 3.81Å; I387-I391 HydrophobicContact CG2-CG1 4.49Å; I387-I391 VanDerWaalsContact O-CG1 3.31Å; I387-I391 WeakPolarHBondContact O-CG1 3.31Å; I387-I391 PolarHBondContact O-N 3.48Å; L388-I391 PolarHBondContact O-N 2.83Å; I391-H393 PolarHBondContact O-N 3.07Å; I391-Y394 PolarHBondContact O-N 3.06Å; I391-Y394 VanDerWaalsContact O-N 3.16Å; I391-K395 WeakPolarHBondContact O-CA 3.28Å; I391-K395 VanDerWaalsContact O-CB 3.27Å; I391-K395 WeakPolarHBondContact O-CB 3.48Å; I391-K395 PolarHBondContact O-N 2.92Å; I391-L401 HydrophobicContact CD1-CD2 4.35Å; I391-L401 HydrophobicContact CG1-CD2 4.18Å; I391-L401 HydrophobicContact CG2-CD2 4.26Å; I391-L404 HydrophobicContact CG1-CD1 4.01Å
392	N	93.1	Very high	93.3	Very high	68 Å²	68	37.6 Å²	37.6	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-32.1	-179.6	-83.4	-49.3	0	0	0	113.4	L388 K389 V390 K395	L388-N392 VanDerWaalsContact O-CB 3.3Å; L388-N392 WeakPolarHBondContact O-CB 3.38Å; L388-N392 PolarHBondContact O-N 3.38Å; L388-N392 PolarHBondContact O-ND2 2.96Å; L388-N392 VanDerWaalsContact O-ND2 3.1Å; K389-N392 PolarHBondContact O-N 3.44Å; V390-N392 PolarHBondContact O-N 2.85Å; N392-K395 PolarHBondContact OD1-NZ 3.29Å
393	H	92.4	Very high	93.7	Very high	51 Å²	51	39 Å²	39	24%	0.236	21%	0.206	C	C	.	.	H	α-helix	trans	-67	-47.2	174	-176.7	86.1	0	0	0	111.7	K389 V390 I391 E492 I496	K389-H393 WeakPolarHBondContact O-CB 3.49Å; K389-H393 PolarHBondContact O-N 3.24Å; V390-H393 PolarHBondContact O-N 3.41Å; I391-H393 PolarHBondContact O-N 3.07Å; H393-E492 IonicContact CE1-OE1 2.63Å; H393-E492 PolarHBondContact CE1-OE1 3.05Å; H393-E492 IonicContact NE2-OE1 3.17Å; H393-E492 PolarHBondContact NE2-OE1 3.37Å; H393-I496 HydrophobicContact CB-CG1 4.32Å; H393-I496 VanDerWaalsContact NE2-CD1 3.35Å; H393-I496 WeakPolarHBondContact NE2-CD1 3.35Å
394	Y	93.7	Very high	93.9	Very high	6 Å²	6	36.3 Å²	36.3	2%	0.024	19%	0.187	C	C	.	.	H	α-helix	trans	-95.1	-10	-171.7	-74.5	-71.5	0	0	0	115.5	V390 I391 N396 E397 I398 L404 R409 L412 L488 I496	V390-Y394 HydrophobicContact CG1-CD2 4.1Å; V390-Y394 HydrophobicContact CG1-CE2 4.48Å; V390-Y394 WeakPolarHBondContact O-CD2 3.49Å; V390-Y394 PolarHBondContact O-N 3.09Å; V390-Y394 VanDerWaalsContact O-N 3.15Å; I391-Y394 PolarHBondContact O-N 3.06Å; I391-Y394 VanDerWaalsContact O-N 3.16Å; Y394-N396 PolarHBondContact O-N 3.41Å; Y394-E397 PolarHBondContact O-N 2.71Å; Y394-I398 WeakPolarHBondContact O-CG1 3.37Å; Y394-I398 PolarHBondContact O-N 3.32Å; Y394-L404 HydrophobicContact CD2-CD2 3.76Å; Y394-L404 HydrophobicContact CG-CD2 3.83Å; Y394-R409 VanDerWaalsContact CD1-NE 3.35Å; Y394-R409 HydrophobicContact CE1-CG 4.19Å; Y394-R409 VanDerWaalsContact CE1-NE 3.32Å; Y394-L412 HydrophobicContact CD2-CD1 4.17Å; Y394-L412 HydrophobicContact CE2-CD1 3.46Å; Y394-L412 VanDerWaalsContact CE2-CD1 3.46Å; Y394-L488 HydrophobicContact CE1-CD1 4.34Å; Y394-L488 VanDerWaalsContact OH-CD1 3.26Å; Y394-L488 WeakPolarHBondContact OH-CD1 3.44Å; Y394-I496 HydrophobicContact CE2-CD1 4.32Å
395	K	91	Very high	94	Very high	85 Å²	85	33.3 Å²	33.3	37%	0.37	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.7	-171.2	65.1	-178.6	177.4	-170.2	0	114.9	I391 N392	I391-K395 WeakPolarHBondContact O-CA 3.28Å; I391-K395 VanDerWaalsContact O-CB 3.27Å; I391-K395 WeakPolarHBondContact O-CB 3.48Å; I391-K395 PolarHBondContact O-N 2.92Å; N392-K395 PolarHBondContact OD1-NZ 3.29Å
396	N	89.8	Confident	94	Very high	128 Å²	128	32 Å²	32	68%	0.684	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-16	178.8	-65.4	-27.5	0	0	0	113.2	Y394	Y394-N396 PolarHBondContact O-N 3.41Å
397	E	91.8	Very high	93.8	Very high	94 Å²	94	39.4 Å²	39.4	44%	0.439	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-43.8	179.6	-62.5	-175.3	-175.1	0	0	112	R351 Y394 R409	R351-E397 PolarHBondContact NH2-O 2.73Å; Y394-E397 PolarHBondContact O-N 2.71Å; E397-R409 IonicContact OE2-NH2 2.91Å; E397-R409 PolarHBondContact OE2-NH2 3.33Å
398	I	94.7	Very high	93.4	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.			trans	-78.1	155.9	-175.5	67.8	-174.3	0	0	0	111.3	R351 L354 Y394 L401 E403 L404	R351-I398 PolarHBondContact NE-O 3.46Å; L354-I398 HydrophobicContact CD2-CD1 4.06Å; L354-I398 HydrophobicContact CD2-CG1 3.8Å; Y394-I398 WeakPolarHBondContact O-CG1 3.37Å; Y394-I398 PolarHBondContact O-N 3.32Å; I398-L401 HydrophobicContact CD1-CD2 4.4Å; I398-E403 HydrophobicContact CB-CB 4.07Å; I398-E403 HydrophobicContact CG2-CB 3.8Å; I398-L404 HydrophobicContact CD1-CD1 4.26Å; I398-L404 HydrophobicContact CD1-CD2 3.93Å; I398-L404 HydrophobicContact CD1-CG 3.93Å; I398-L404 HydrophobicContact CG2-CD2 4.38Å
399	C	95.1	Very high	93.2	Very high	12 Å²	12	48.2 Å²	48.2	8%	0.081	23%	0.233	C	C	.	.	S	Bend	trans	-104.5	-25.9	168.6	-59.1	0	0	0	0	111	Q347 N350 E403	Q347-C399 HydrophobicContact CB-CB 3.82Å; Q347-C399 HydrophobicContact CG-CB 4.19Å; Q347-C399 WeakPolarHBondContact O-CB 3.11Å; N350-C399 PolarHBondContact ND2-O 3.44Å; C399-E403 VanDerWaalsContact CA-OE1 3.31Å; C399-E403 WeakPolarHBondContact CA-OE1 3.26Å; C399-E403 VanDerWaalsContact CB-OE1 3.31Å; C399-E403 WeakPolarHBondContact CB-OE1 3.44Å; C399-E403 PolarHBondContact N-OE1 2.87Å
400	T	96.2	Very high	93.1	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	23%	0.228	C	C	.	.	S	Bend	trans	-135.3	151.9	174.5	92.3	0	0	0	0	112.5	R292 F294 A402 E403	R292-T400 PolarHBondContact NH2-OG1 3Å; R292-T400 WeakPolarHBondContact O-CB 3.17Å; R292-T400 PolarHBondContact O-OG1 3Å; F294-T400 HydrophobicContact CD1-CG2 3.99Å; F294-T400 HydrophobicContact CD2-CG2 3.88Å; F294-T400 HydrophobicContact CE1-CG2 3.65Å; F294-T400 HydrophobicContact CE2-CG2 3.6Å; F294-T400 HydrophobicContact CG-CG2 4.1Å; F294-T400 HydrophobicContact CZ-CG2 3.46Å; F294-T400 VanDerWaalsContact CZ-CG2 3.46Å; T400-A402 PolarHBondContact O-N 3.33Å; T400-A402 PolarHBondContact OG1-N 3.16Å; T400-E403 PolarHBondContact N-OE1 3.26Å; T400-E403 WeakPolarHBondContact O-CB 3.39Å; T400-E403 PolarHBondContact O-N 2.9Å; T400-E403 VanDerWaalsContact O-N 3.08Å
401	L	96.8	Very high	92.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-62.2	-27.4	176.6	-72.3	176	0	0	0	112.8	C293 Y295 L354 L362 H365 L369 I391 I398 E403 L404	C293-L401 HydrophobicContact CB-CB 4.25Å; Y295-L401 WeakPolarHBondContact OH-CD1 3.49Å; L354-L401 HydrophobicContact CD1-CD1 4.31Å; L354-L401 HydrophobicContact CD1-CD2 3.81Å; L354-L401 HydrophobicContact CD1-CG 3.74Å; L362-L401 HydrophobicContact CD2-CD1 4.22Å; L362-L401 HydrophobicContact CD2-CD2 4.35Å; H365-L401 HydrophobicContact CB-CD1 3.71Å; L369-L401 HydrophobicContact CD1-CB 3.55Å; I391-L401 HydrophobicContact CD1-CD2 4.35Å; I391-L401 HydrophobicContact CG1-CD2 4.18Å; I391-L401 HydrophobicContact CG2-CD2 4.26Å; I398-L401 HydrophobicContact CD1-CD2 4.4Å; L401-E403 PolarHBondContact O-N 3.01Å; L401-L404 HydrophobicContact CD2-CD1 4.03Å; L401-L404 VanDerWaalsContact O-CB 3.29Å; L401-L404 WeakPolarHBondContact O-CB 3.4Å; L401-L404 WeakPolarHBondContact O-CG 3.39Å; L401-L404 PolarHBondContact O-N 3.06Å; L401-L404 VanDerWaalsContact O-N 3.11Å
402	A	95.7	Very high	92.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-65	-20.5	177.1	0	0	0	0	0	112.6	R292 L369 T400 L404 F405	R292-A402 PolarHBondContact NH1-O 3.18Å; R292-A402 VanDerWaalsContact NH2-C 3.28Å; R292-A402 WeakPolarHBondContact O-CB 3.3Å; L369-A402 HydrophobicContact CD1-CB 4.42Å; L369-A402 HydrophobicContact CD2-CB 4.22Å; T400-A402 PolarHBondContact O-N 3.33Å; T400-A402 PolarHBondContact OG1-N 3.16Å; A402-L404 PolarHBondContact O-N 2.94Å; A402-F405 PolarHBondContact O-N 3.02Å
403	E	95.1	Very high	92.6	Very high	33 Å²	33	45.3 Å²	45.3	15%	0.154	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-66.5	-16.6	174.4	-66.5	-179.6	-125.8	0	0	113.6	I398 C399 T400 L401 F405 D406 R409	I398-E403 HydrophobicContact CB-CB 4.07Å; I398-E403 HydrophobicContact CG2-CB 3.8Å; C399-E403 VanDerWaalsContact CA-OE1 3.31Å; C399-E403 WeakPolarHBondContact CA-OE1 3.26Å; C399-E403 VanDerWaalsContact CB-OE1 3.31Å; C399-E403 WeakPolarHBondContact CB-OE1 3.44Å; C399-E403 PolarHBondContact N-OE1 2.87Å; T400-E403 PolarHBondContact N-OE1 3.26Å; T400-E403 WeakPolarHBondContact O-CB 3.39Å; T400-E403 PolarHBondContact O-N 2.9Å; T400-E403 VanDerWaalsContact O-N 3.08Å; L401-E403 PolarHBondContact O-N 3.01Å; E403-F405 PolarHBondContact O-N 2.94Å; E403-D406 WeakPolarHBondContact CA-OD2 3.44Å; E403-D406 PolarHBondContact O-N 2.83Å; E403-R409 PolarHBondContact O-NH1 3.48Å
404	L	95.6	Very high	92.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-69.1	-19.4	171.1	-60.7	175.5	0	0	0	112.1	V390 I391 Y394 I398 L401 A402 R409 W413	V390-L404 HydrophobicContact CG1-CD1 4.3Å; V390-L404 HydrophobicContact CG1-CD2 4.13Å; I391-L404 HydrophobicContact CG1-CD1 4.01Å; Y394-L404 HydrophobicContact CD2-CD2 3.76Å; Y394-L404 HydrophobicContact CG-CD2 3.83Å; I398-L404 HydrophobicContact CD1-CD1 4.26Å; I398-L404 HydrophobicContact CD1-CD2 3.93Å; I398-L404 HydrophobicContact CD1-CG 3.93Å; I398-L404 HydrophobicContact CG2-CD2 4.38Å; L401-L404 HydrophobicContact CD2-CD1 4.03Å; L401-L404 VanDerWaalsContact O-CB 3.29Å; L401-L404 WeakPolarHBondContact O-CB 3.4Å; L401-L404 WeakPolarHBondContact O-CG 3.39Å; L401-L404 PolarHBondContact O-N 3.06Å; L401-L404 VanDerWaalsContact O-N 3.11Å; A402-L404 PolarHBondContact O-N 2.94Å; L404-R409 CarbonylContact O-C 3.5Å; L404-R409 VanDerWaalsContact O-CB 3.32Å; L404-R409 WeakPolarHBondContact O-CB 3.47Å; L404-W413 HydrophobicContact CB-CZ2 4.05Å; L404-W413 HydrophobicContact CD1-CZ2 4.2Å; L404-W413 PolarHBondContact O-NE1 2.92Å
405	F	94.7	Very high	91.6	Very high	12 Å²	12	47.8 Å²	47.8	5%	0.053	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-103.4	0.7	-178.5	-60.2	-93.5	0	0	0	112.5	T366 L369 I370 Y373 V374 A402 E403 F410 W413	T366-F405 HydrophobicContact CG2-CE2 4.3Å; T366-F405 HydrophobicContact CG2-CZ 4.12Å; L369-F405 HydrophobicContact CB-CD2 3.95Å; L369-F405 HydrophobicContact CB-CE1 4.37Å; L369-F405 HydrophobicContact CB-CE2 3.36Å; L369-F405 HydrophobicContact CB-CZ 3.62Å; L369-F405 HydrophobicContact CD1-CD2 4.23Å; L369-F405 HydrophobicContact CD1-CE2 3.81Å; L369-F405 HydrophobicContact CG-CE2 4.22Å; I370-F405 HydrophobicContact CG1-CE1 3.88Å; I370-F405 HydrophobicContact CG1-CZ 3.75Å; Y373-F405 HydrophobicContact CD2-CB 3.99Å; Y373-F405 HydrophobicContact CD2-CD1 4.05Å; Y373-F405 HydrophobicContact CD2-CD2 4.38Å; Y373-F405 AromaticContact CD2-CG 3.86Å; Y373-F405 HydrophobicContact CD2-CG 3.86Å; Y373-F405 HydrophobicContact CG-CB 4.2Å; Y373-F405 HydrophobicContact CG-CD1 4.26Å; Y373-F405 HydrophobicContact CG-CG 4.32Å; V374-F405 HydrophobicContact CG2-CD1 4.48Å; V374-F405 HydrophobicContact CG2-CE1 4.16Å; A402-F405 PolarHBondContact O-N 3.02Å; E403-F405 PolarHBondContact O-N 2.94Å; F405-F410 WeakPolarHBondContact O-CD2 3.49Å; F405-W413 AromaticContact CD1-CD1 3.55Å; F405-W413 AromaticContact CD1-CG 3.98Å; F405-W413 HydrophobicContact CD1-CG 3.98Å; F405-W413 AromaticContact CD1-NE1 3.83Å; F405-W413 HydrophobicContact CE1-CB 4.35Å; F405-W413 AromaticContact CE1-CD1 3.63Å; F405-W413 AromaticContact CE1-CD2 3.82Å; F405-W413 HydrophobicContact CE1-CD2 3.82Å; F405-W413 AromaticContact CE1-CE2 3.85Å; F405-W413 AromaticContact CE1-CG 3.68Å; F405-W413 HydrophobicContact CE1-CG 3.68Å; F405-W413 AromaticContact CE1-NE1 3.73Å; F405-W413 HydrophobicContact CE2-CZ2 4.41Å; F405-W413 HydrophobicContact CZ-CD2 4.08Å; F405-W413 AromaticContact CZ-CE2 3.76Å; F405-W413 HydrophobicContact CZ-CG 4.38Å; F405-W413 HydrophobicContact CZ-CZ2 4.07Å; F405-W413 AromaticContact CZ-NE1 3.89Å
406	D	92.3	Very high	90.8	Very high	60 Å²	60	44.4 Å²	44.4	32%	0.321	22%	0.215	S	C	.	.	S	Bend	trans	-67.9	156.3	173.7	-62	-13.1	0	0	0	110.3	R292 E403 K408 R409 F410	R292-D406 IonicContact CZ-OD1 3.01Å; R292-D406 IonicContact NH1-OD1 3.45Å; R292-D406 PolarHBondContact NH1-OD1 3.47Å; R292-D406 IonicContact NH2-OD1 3.63Å; R292-D406 IonicContact NH2-OD2 3.31Å; E403-D406 WeakPolarHBondContact CA-OD2 3.44Å; E403-D406 PolarHBondContact O-N 2.83Å; D406-K408 PolarHBondContact O-N 2.95Å; D406-R409 PolarHBondContact O-N 3.31Å; D406-F410 PolarHBondContact O-N 2.89Å
407	N	87.9	Confident	89.7	Confident	162 Å²	162	43.4 Å²	43.4	87%	0.866	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.4	-30.9	-175.4	-69.2	-13.3	0	0	0	115	R409	N407-R409 VanDerWaalsContact C-N 3.3Å; N407-R409 PolarHBondContact O-N 2.79Å
408	K	87.3	Confident	88.2	Confident	180 Å²	180	40.3 Å²	40.3	78%	0.783	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-24.1	179.1	-65.1	-178.9	-178.1	176	0	113.8	D406	D406-K408 PolarHBondContact O-N 2.95Å
409	R	91.6	Very high	86.2	Confident	36 Å²	36	45.6 Å²	45.6	14%	0.136	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-7.1	-172.4	-62.2	-179	-169.9	97.6	-3.4	113.1	Y394 E397 E403 L404 D406 N407 F411 L412	Y394-R409 VanDerWaalsContact CD1-NE 3.35Å; Y394-R409 HydrophobicContact CE1-CG 4.19Å; Y394-R409 VanDerWaalsContact CE1-NE 3.32Å; E397-R409 IonicContact OE2-NH2 2.91Å; E397-R409 PolarHBondContact OE2-NH2 3.33Å; E403-R409 PolarHBondContact O-NH1 3.48Å; L404-R409 CarbonylContact O-C 3.5Å; L404-R409 VanDerWaalsContact O-CB 3.32Å; L404-R409 WeakPolarHBondContact O-CB 3.47Å; D406-R409 PolarHBondContact O-N 3.31Å; N407-R409 VanDerWaalsContact C-N 3.3Å; N407-R409 PolarHBondContact O-N 2.79Å; R409-F411 PolarHBondContact O-N 3.42Å; R409-L412 HydrophobicContact CB-CD1 4Å; R409-L412 VanDerWaalsContact O-CB 3.3Å; R409-L412 WeakPolarHBondContact O-CB 3.23Å; R409-L412 WeakPolarHBondContact O-CD1 3Å; R409-L412 WeakPolarHBondContact O-CG 3.32Å; R409-L412 PolarHBondContact O-N 3.31Å
410	F	90.5	Very high	84.2	Confident	59 Å²	59	46.4 Å²	46.4	26%	0.259	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-55.5	-26.1	-179.5	-165.4	-104	0	0	0	113.9	F405 D406 L412 W413 K414	F405-F410 WeakPolarHBondContact O-CD2 3.49Å; D406-F410 PolarHBondContact O-N 2.89Å; F410-L412 PolarHBondContact O-N 3.33Å; F410-L412 VanDerWaalsContact O-N 3.08Å; F410-W413 PolarHBondContact O-N 2.82Å; F410-K414 HydrophobicContact CD1-CB 4.38Å; F410-K414 HydrophobicContact CD1-CD 4.49Å; F410-K414 HydrophobicContact CE1-CB 4.17Å; F410-K414 HydrophobicContact CE1-CD 4.02Å
411	F	89.7	Confident	82.1	Confident	31 Å²	31	54.6 Å²	54.6	14%	0.136	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-58.7	-19.8	174.2	78.7	-89.9	0	0	0	114.1	R409 W413 T482 V493 R505	R409-F411 PolarHBondContact O-N 3.42Å; F411-W413 PolarHBondContact O-N 2.65Å; F411-T482 HydrophobicContact CD1-CG2 4.44Å; F411-T482 HydrophobicContact CD2-CG2 3.71Å; F411-T482 HydrophobicContact CE2-CG2 3.83Å; F411-T482 HydrophobicContact CG-CG2 4.05Å; F411-T482 HydrophobicContact CZ-CG2 4.24Å; F411-V493 HydrophobicContact CE2-CG1 3.97Å; F411-R505 VanDerWaalsContact O-CZ 3.29Å; F411-R505 PolarHBondContact O-NH1 3.01Å; F411-R505 PolarHBondContact O-NH2 3.34Å
412	L	91.9	Very high	79.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-66.2	-29.6	174.7	-61.5	168.9	0	0	0	111.4	F386 V390 Y394 R409 F410 I496 L497 R505	F386-L412 WeakPolarHBondContact CZ-O 3.47Å; V390-L412 HydrophobicContact CG1-CD1 3.74Å; V390-L412 HydrophobicContact CG2-CD2 4.42Å; Y394-L412 HydrophobicContact CD2-CD1 4.17Å; Y394-L412 HydrophobicContact CE2-CD1 3.46Å; Y394-L412 VanDerWaalsContact CE2-CD1 3.46Å; R409-L412 HydrophobicContact CB-CD1 4Å; R409-L412 VanDerWaalsContact O-CB 3.3Å; R409-L412 WeakPolarHBondContact O-CB 3.23Å; R409-L412 WeakPolarHBondContact O-CD1 3Å; R409-L412 WeakPolarHBondContact O-CG 3.32Å; R409-L412 PolarHBondContact O-N 3.31Å; F410-L412 PolarHBondContact O-N 3.33Å; F410-L412 VanDerWaalsContact O-N 3.08Å; L412-I496 HydrophobicContact CD2-CG2 3.65Å; L412-L497 HydrophobicContact CD2-CD2 4.39Å; L412-R505 PolarHBondContact O-NH2 3.21Å
413	W	91.3	Very high	77.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-110.7	13.7	-171.4	-45.5	110.2	0	0	0	113.8	T366 I370 V374 F382 F386 I387 V390 L404 F405 F410 F411	T366-W413 HydrophobicContact CG2-CH2 3.82Å; T366-W413 HydrophobicContact CG2-CZ2 4.16Å; I370-W413 HydrophobicContact CD1-CE3 3.98Å; I370-W413 HydrophobicContact CD1-CZ3 3.76Å; I370-W413 HydrophobicContact CG1-CE3 4.08Å; I370-W413 HydrophobicContact CG1-CZ3 4.24Å; V374-W413 WeakPolarHBondContact CG1-O 3.43Å; V374-W413 HydrophobicContact CG2-CB 3.72Å; F382-W413 HydrophobicContact CD1-CE3 4.37Å; F382-W413 HydrophobicContact CD2-CE3 4.37Å; F382-W413 HydrophobicContact CG-CE3 4.28Å; F382-W413 HydrophobicContact CZ-CB 4.36Å; F382-W413 VanDerWaalsContact CZ-O 3.26Å; F382-W413 WeakPolarHBondContact CZ-O 3.37Å; F386-W413 HydrophobicContact CE1-CE3 4.27Å; F386-W413 HydrophobicContact CE1-CZ3 4.01Å; I387-W413 HydrophobicContact CG1-CH2 4.44Å; I387-W413 HydrophobicContact CG1-CZ3 4.04Å; I387-W413 HydrophobicContact CG2-CH2 4.42Å; V390-W413 HydrophobicContact CB-CH2 4.22Å; V390-W413 HydrophobicContact CB-CZ2 4.45Å; V390-W413 HydrophobicContact CG1-CH2 3.99Å; V390-W413 HydrophobicContact CG1-CZ2 3.72Å; V390-W413 HydrophobicContact CG2-CH2 4.46Å; L404-W413 HydrophobicContact CB-CZ2 4.05Å; L404-W413 HydrophobicContact CD1-CZ2 4.2Å; L404-W413 PolarHBondContact O-NE1 2.92Å; F405-W413 AromaticContact CD1-CD1 3.55Å; F405-W413 AromaticContact CD1-CG 3.98Å; F405-W413 HydrophobicContact CD1-CG 3.98Å; F405-W413 AromaticContact CD1-NE1 3.83Å; F405-W413 HydrophobicContact CE1-CB 4.35Å; F405-W413 AromaticContact CE1-CD1 3.63Å; F405-W413 AromaticContact CE1-CD2 3.82Å; F405-W413 HydrophobicContact CE1-CD2 3.82Å; F405-W413 AromaticContact CE1-CE2 3.85Å; F405-W413 AromaticContact CE1-CG 3.68Å; F405-W413 HydrophobicContact CE1-CG 3.68Å; F405-W413 AromaticContact CE1-NE1 3.73Å; F405-W413 HydrophobicContact CE2-CZ2 4.41Å; F405-W413 HydrophobicContact CZ-CD2 4.08Å; F405-W413 AromaticContact CZ-CE2 3.76Å; F405-W413 HydrophobicContact CZ-CG 4.38Å; F405-W413 HydrophobicContact CZ-CZ2 4.07Å; F405-W413 AromaticContact CZ-NE1 3.89Å; F410-W413 PolarHBondContact O-N 2.82Å; F411-W413 PolarHBondContact O-N 2.65Å
414	K	85.3	Confident	75.5	Confident	89 Å²	89	63.4 Å²	63.4	39%	0.387	35%	0.349	S	S	.	.	S	Bend	trans	-137.6	136.7	-179.7	-178.5	167.9	-177.6	177.4	0	110.5	F410 R505	F410-K414 HydrophobicContact CD1-CB 4.38Å; F410-K414 HydrophobicContact CD1-CD 4.49Å; F410-K414 HydrophobicContact CE1-CB 4.17Å; F410-K414 HydrophobicContact CE1-CD 4.02Å; K414-R505 PolarHBondContact O-NH2 3.04Å
415	M	79	Confident	73.6	Confident	20 Å²	20	70.5 Å²	70.5	10%	0.099	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-78.4	137.7	169.6	-65	-59.7	-73.6	0	0	109.5	E378 T417 Q504 R505 I508	E378-M415 PolarHBondContact OE1-N 3.18Å; M415-T417 PolarHBondContact O-N 3.41Å; M415-T417 VanDerWaalsContact O-N 3.16Å; M415-Q504 HydrophobicContact CE-CB 4.15Å; M415-Q504 HydrophobicContact CE-CG 3.67Å; M415-R505 HydrophobicContact CE-CB 4.36Å; M415-R505 HydrophobicContact CE-CG 3.49Å; M415-R505 VanDerWaalsContact CE-CG 3.49Å; M415-R505 HydrophobicContact SD-CG 3.77Å; M415-I508 HydrophobicContact CE-CD1 3.5Å; M415-I508 VanDerWaalsContact CE-CD1 3.5Å
416	P	75.1	Confident	71.6	Confident	15 Å²	15	73.6 Å²	73.6	10%	0.097	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-63.7	121.5	-178.7	25.5	-31.5	0	0	0	110.1	V480 R505 V509	P416-V480 VanDerWaalsContact CB-O 3.24Å; P416-V480 WeakPolarHBondContact CB-O 3.18Å; P416-R505 HydrophobicContact CG-CB 3.91Å; P416-R505 HydrophobicContact CG-CG 4.05Å; P416-V509 HydrophobicContact CB-CG2 3.86Å; P416-V509 HydrophobicContact CG-CG2 3.68Å
417	T	66	Low	70.1	Confident	106 Å²	106	74.5 Å²	74.5	65%	0.65	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-103.6	118	165.2	52.1	0	0	0	0	107.6	M415 P419	M415-T417 PolarHBondContact O-N 3.41Å; M415-T417 VanDerWaalsContact O-N 3.16Å; T417-P419 VanDerWaalsContact O-CD 3.27Å; T417-P419 WeakPolarHBondContact O-CD 3.49Å
418	V	60.3	Low	68.8	Low	29 Å²	29	69.2 Å²	69.2	18%	0.176	39%	0.385	C	S	.	.			trans	-103.8	113.4	-170.1	164.7	0	0	0	0	110.8	L420 V509	V418-L420 HydrophobicContact CG1-CB 3.48Å; V418-L420 VanDerWaalsContact CG1-CB 3.48Å; V418-L420 HydrophobicContact CG1-CD1 3.57Å; V418-L420 HydrophobicContact CG1-CG 3.49Å; V418-L420 VanDerWaalsContact CG1-CG 3.49Å; V418-L420 HydrophobicContact CG2-CD1 4.43Å; V418-V509 HydrophobicContact CG2-CB 4.28Å; V418-V509 HydrophobicContact CG2-CG1 3.84Å; V418-V509 HydrophobicContact CG2-CG2 3.62Å
419	P	52.7	Low	67.7	Low	111 Å²	111	67.2 Å²	67.2	72%	0.721	38%	0.382	S	S	*	.			trans	-103	71.5	140.3	34.2	-23.1	0	0	0	107	T417 Q421	T417-P419 VanDerWaalsContact O-CD 3.27Å; T417-P419 WeakPolarHBondContact O-CD 3.49Å; P419-Q421 PolarHBondContact O-N 3.41Å
420	L	54.3	Low	66.9	Low	30 Å²	30	68 Å²	68	16%	0.157	39%	0.391	C	S	.	.			trans	-60	110.6	167.2	-90.9	159.7	0	0	0	105.1	V418 P422 V509 I513	V418-L420 HydrophobicContact CG1-CB 3.48Å; V418-L420 VanDerWaalsContact CG1-CB 3.48Å; V418-L420 HydrophobicContact CG1-CD1 3.57Å; V418-L420 HydrophobicContact CG1-CG 3.49Å; V418-L420 VanDerWaalsContact CG1-CG 3.49Å; V418-L420 HydrophobicContact CG2-CD1 4.43Å; L420-P422 WeakPolarHBondContact O-CD 3.37Å; L420-V509 HydrophobicContact CD1-CG1 4.47Å; L420-I513 HydrophobicContact CD1-CD1 3.85Å; L420-I513 HydrophobicContact CD1-CG1 4.27Å
421	Q	51.1	Low	66.5	Low	173 Å²	173	65.6 Å²	65.6	81%	0.808	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-65.6	120.9	150.7	-80.4	-175.3	-18.6	0	0	104.9	P419 A423	P419-Q421 PolarHBondContact O-N 3.41Å; Q421-A423 PolarHBondContact O-N 3.18Å
422	P	48.9	Very low	66.4	Low	74 Å²	74	65 Å²	65	48%	0.481	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-50.7	140.1	173.1	-21.6	31.1	0	0	0	108.4	L420 A424	L420-P422 WeakPolarHBondContact O-CD 3.37Å; P422-A424 PolarHBondContact O-N 2.93Å
423	A	50.8	Low	66.3	Low	45 Å²	45	72.2 Å²	72.2	37%	0.372	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-55	130.5	155.2	0	0	0	0	0	105.4	Q421 D425 Q426	Q421-A423 PolarHBondContact O-N 3.18Å; A423-D425 PolarHBondContact O-N 3.12Å; A423-Q426 PolarHBondContact O-N 3.35Å
424	A	50.1	Low	66.3	Low	99 Å²	99	72.8 Å²	72.8	82%	0.818	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-10.9	-166.8	0	0	0	0	0	114.9	P422	P422-A424 PolarHBondContact O-N 2.93Å
425	D	54.5	Low	66.7	Low	149 Å²	149	68.6 Å²	68.6	80%	0.797	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	10.9	-168.9	-49.9	-37.7	0	0	0	114.4	A423	A423-D425 PolarHBondContact O-N 3.12Å
426	Q	53.9	Low	67.4	Low	77 Å²	77	70.1 Å²	70.1	36%	0.36	40%	0.404	S	S	.	.	S	Bend	trans	-133.3	124.8	176.4	-71.2	-170.7	-11.4	0	0	113.9	A423	A423-Q426 PolarHBondContact O-N 3.35Å
427	P	59.7	Low	68.4	Low	79 Å²	79	71.1 Å²	71.1	51%	0.513	41%	0.413	S	S	.	.			trans	-67.7	139.7	177.9	20.3	-24.4	0	0	0	111.8	L429 V430	P427-L429 PolarHBondContact O-N 2.86Å; P427-V430 HydrophobicContact CG-CG2 3.99Å; P427-V430 PolarHBondContact O-N 3.33Å
428	P	61.3	Low	69.9	Low	52 Å²	52	66.1 Å²	66.1	34%	0.338	38%	0.382	S	S	.	.	H	α-helix	trans	-51.6	-33	-175.7	-27.5	32.7	0	0	0	115	V430 E431 V432 I513	P428-V430 PolarHBondContact O-N 3.01Å; P428-E431 PolarHBondContact O-N 3.11Å; P428-E431 VanDerWaalsContact O-N 3.17Å; P428-V432 PolarHBondContact O-N 3.14Å; P428-I513 HydrophobicContact CB-CG2 4.11Å
429	L	63.7	Low	71.6	Confident	137 Å²	137	65.2 Å²	65.2	72%	0.717	38%	0.377	S	S	*	.	H	α-helix	trans	-59.6	-27.6	179.4	-78.2	152.3	0	0	0	113.8	P427 K433	P427-L429 PolarHBondContact O-N 2.86Å; L429-K433 PolarHBondContact O-N 3.29Å
430	V	74.6	Confident	73.7	Confident	53 Å²	53	64 Å²	64	32%	0.321	37%	0.367	S	S	.	.	H	α-helix	trans	-73.3	-39.4	178.8	175.9	0	0	0	0	110.6	P427 P428 V432 K433 H434	P427-V430 HydrophobicContact CG-CG2 3.99Å; P427-V430 PolarHBondContact O-N 3.33Å; P428-V430 PolarHBondContact O-N 3.01Å; V430-V432 VanDerWaalsContact C-N 3.33Å; V430-V432 PolarHBondContact O-N 3.16Å; V430-K433 PolarHBondContact O-N 2.65Å; V430-H434 WeakPolarHBondContact CG1-CE1 3.37Å; V430-H434 PolarHBondContact O-CD2 3.36Å; V430-H434 VanDerWaalsContact O-CG 3.29Å; V430-H434 PolarHBondContact O-N 2.91Å
431	E	82	Confident	75.8	Confident	8 Å²	8	63.8 Å²	63.8	4%	0.037	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-36.4	178	-64	-169.8	153.4	0	0	112	P428 H434 L435 F476 I513	P428-E431 PolarHBondContact O-N 3.11Å; P428-E431 VanDerWaalsContact O-N 3.17Å; E431-H434 PolarHBondContact O-N 3.31Å; E431-L435 WeakPolarHBondContact O-CG 3.43Å; E431-L435 PolarHBondContact O-N 3.17Å; E431-F476 HydrophobicContact CB-CE2 3.82Å; E431-F476 HydrophobicContact CB-CZ 3.82Å; E431-F476 VanDerWaalsContact CD-CE2 3.45Å; E431-F476 HydrophobicContact CG-CD2 4.3Å; E431-F476 HydrophobicContact CG-CE2 3.71Å; E431-F476 HydrophobicContact CG-CZ 4.18Å; E431-I513 HydrophobicContact CB-CD1 4.23Å; E431-I513 HydrophobicContact CB-CG2 4.47Å
432	V	87.4	Confident	77.9	Confident	19 Å²	19	55.5 Å²	55.5	12%	0.115	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-45.9	176.3	178.4	0	0	0	0	111.2	P428 V430 H434 L435 D436 R510 I513 A514	P428-V432 PolarHBondContact O-N 3.14Å; V430-V432 VanDerWaalsContact C-N 3.33Å; V430-V432 PolarHBondContact O-N 3.16Å; V432-H434 VanDerWaalsContact C-N 3.32Å; V432-H434 PolarHBondContact O-N 3.37Å; V432-L435 PolarHBondContact O-N 3.4Å; V432-D436 PolarHBondContact O-N 2.73Å; V432-R510 HydrophobicContact CG1-CG 4.18Å; V432-I513 HydrophobicContact CG2-CB 4.15Å; V432-I513 HydrophobicContact CG2-CG2 3.64Å; V432-A514 HydrophobicContact CG2-CB 4.2Å
433	K	90	Very high	80.2	Confident	151 Å²	151	55.7 Å²	55.7	66%	0.657	33%	0.325	S	S	*	.	H	α-helix	trans	-60.5	-41.4	177.8	-71.1	-176.9	178	-175.6	0	112.2	L429 V430 D436 A437	L429-K433 PolarHBondContact O-N 3.29Å; V430-K433 PolarHBondContact O-N 2.65Å; K433-D436 PolarHBondContact O-N 3.08Å; K433-A437 PolarHBondContact O-N 2.64Å
434	H	91.4	Very high	82.3	Confident	13 Å²	13	58.1 Å²	58.1	6%	0.06	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-41.1	177	-65.3	169	0	0	0	112.4	V430 E431 V432 L438 F473 F476	V430-H434 WeakPolarHBondContact CG1-CE1 3.37Å; V430-H434 PolarHBondContact O-CD2 3.36Å; V430-H434 VanDerWaalsContact O-CG 3.29Å; V430-H434 PolarHBondContact O-N 2.91Å; E431-H434 PolarHBondContact O-N 3.31Å; V432-H434 VanDerWaalsContact C-N 3.32Å; V432-H434 PolarHBondContact O-N 3.37Å; H434-L438 PolarHBondContact O-N 2.71Å; H434-F473 HydrophobicContact CB-CE2 4.08Å; H434-F476 HydrophobicContact CB-CE1 4.33Å
435	L	93.4	Very high	84.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.9	-40.8	175.7	-68.4	172.5	0	0	0	111.5	E431 V432 L438 I439 F476 L477 V480 L506 V509 R510 I513	E431-L435 WeakPolarHBondContact O-CG 3.43Å; E431-L435 PolarHBondContact O-N 3.17Å; V432-L435 PolarHBondContact O-N 3.4Å; L435-L438 PolarHBondContact O-N 3.28Å; L435-I439 WeakPolarHBondContact O-CB 3.45Å; L435-I439 WeakPolarHBondContact O-CD1 3.42Å; L435-I439 WeakPolarHBondContact O-CG1 3.48Å; L435-I439 PolarHBondContact O-N 3.13Å; L435-F476 HydrophobicContact CD1-CZ 4.02Å; L435-F476 HydrophobicContact CD2-CE1 3.7Å; L435-F476 HydrophobicContact CD2-CZ 3.88Å; L435-F476 HydrophobicContact CG-CE1 3.88Å; L435-F476 HydrophobicContact CG-CZ 3.78Å; L435-L477 HydrophobicContact CD2-CD2 4.39Å; L435-V480 HydrophobicContact CD2-CG1 4.27Å; L435-L506 HydrophobicContact CD2-CD2 3.65Å; L435-V509 HydrophobicContact CD1-CG1 4.2Å; L435-R510 HydrophobicContact CB-CB 4.18Å; L435-R510 HydrophobicContact CB-CG 4.22Å; L435-R510 HydrophobicContact CD1-CB 3.87Å; L435-R510 HydrophobicContact CD1-CG 4.48Å; L435-I513 HydrophobicContact CD1-CD1 3.86Å
436	D	95.1	Very high	86.3	Confident	53 Å²	53	53.1 Å²	53.1	28%	0.283	29%	0.294	S	S	.	.	H	α-helix	trans	-60	-48.4	176.8	-79.7	-23.6	0	0	0	112	V432 K433 L438 I439 V440 R510	V432-D436 PolarHBondContact O-N 2.73Å; K433-D436 PolarHBondContact O-N 3.08Å; D436-L438 VanDerWaalsContact C-N 3.32Å; D436-L438 PolarHBondContact O-N 2.95Å; D436-I439 PolarHBondContact O-N 3.05Å; D436-V440 WeakPolarHBondContact O-CG2 3.29Å; D436-V440 PolarHBondContact O-N 2.84Å; D436-R510 IonicContact OD1-CZ 3.69Å; D436-R510 VanDerWaalsContact OD1-CZ 3.31Å; D436-R510 IonicContact OD1-NE 3.58Å; D436-R510 PolarHBondContact OD1-NE 2.96Å; D436-R510 IonicContact OD1-NH2 2.89Å; D436-R510 PolarHBondContact OD1-NH2 3.08Å; D436-R510 IonicContact OD2-CZ 2.89Å; D436-R510 IonicContact OD2-NE 3.65Å; D436-R510 IonicContact OD2-NH2 2.69Å; D436-R510 PolarHBondContact OD2-NH2 2.99Å
437	A	95.5	Very high	87.9	Confident	36 Å²	36	54.5 Å²	54.5	30%	0.298	30%	0.304	S	S	.	.	H	α-helix	trans	-59.2	-43.5	177.1	0	0	0	0	0	112	K433 A441 V462	K433-A437 PolarHBondContact O-N 2.64Å; A437-A441 WeakPolarHBondContact O-CB 3.41Å; A437-A441 PolarHBondContact O-N 3.4Å; A437-V462 HydrophobicContact CB-CG1 4.05Å
438	L	96.7	Very high	89.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-42.2	177.5	-177.4	60.2	0	0	0	112.4	H434 L435 D436 V440 A441 L442 L458 L459 V462 F473 L477 L506	H434-L438 PolarHBondContact O-N 2.71Å; L435-L438 PolarHBondContact O-N 3.28Å; D436-L438 VanDerWaalsContact C-N 3.32Å; D436-L438 PolarHBondContact O-N 2.95Å; L438-V440 PolarHBondContact O-N 2.98Å; L438-A441 PolarHBondContact O-N 3.37Å; L438-L442 HydrophobicContact CD1-CD1 4.03Å; L438-L442 HydrophobicContact CD1-CD2 4.29Å; L438-L442 HydrophobicContact CD1-CG 3.88Å; L438-L442 HydrophobicContact CD2-CD1 4.47Å; L438-L442 HydrophobicContact CG-CD1 3.91Å; L438-L442 HydrophobicContact CG-CG 4.18Å; L438-L442 WeakPolarHBondContact O-CB 3.44Å; L438-L442 VanDerWaalsContact O-CG 3.27Å; L438-L442 WeakPolarHBondContact O-CG 3.21Å; L438-L442 PolarHBondContact O-N 3.11Å; L438-L458 HydrophobicContact CD1-CD2 3.9Å; L438-L459 HydrophobicContact CD1-CD2 3.75Å; L438-L459 HydrophobicContact CD2-CD2 4.39Å; L438-V462 HydrophobicContact CB-CG1 4.26Å; L438-V462 HydrophobicContact CD1-CG2 4.5Å; L438-F473 HydrophobicContact CB-CZ 4.31Å; L438-F473 HydrophobicContact CD2-CZ 4.3Å; L438-L477 HydrophobicContact CD2-CD1 3.73Å; L438-L477 HydrophobicContact CD2-CD2 3.47Å; L438-L477 VanDerWaalsContact CD2-CD2 3.47Å; L438-L477 HydrophobicContact CD2-CG 4.25Å; L438-L506 HydrophobicContact CD2-CD1 3.83Å; L438-L506 HydrophobicContact CD2-CD2 4.08Å; L438-L506 HydrophobicContact CG-CD1 4.06Å
439	I	97.1	Very high	90.9	Very high	11 Å²	11	60.2 Å²	60.2	6%	0.056	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-49.6	179	-74.8	164.6	0	0	0	109.7	L435 D436 A441 L442 E443 L503 L506 R507 R510	L435-I439 WeakPolarHBondContact O-CB 3.45Å; L435-I439 WeakPolarHBondContact O-CD1 3.42Å; L435-I439 WeakPolarHBondContact O-CG1 3.48Å; L435-I439 PolarHBondContact O-N 3.13Å; D436-I439 PolarHBondContact O-N 3.05Å; I439-A441 PolarHBondContact O-N 2.8Å; I439-L442 PolarHBondContact O-N 3.27Å; I439-E443 HydrophobicContact CG2-CG 4.45Å; I439-E443 WeakPolarHBondContact CG2-OE1 3.37Å; I439-E443 WeakPolarHBondContact O-CB 3.45Å; I439-E443 VanDerWaalsContact O-CG 3.29Å; I439-E443 WeakPolarHBondContact O-CG 3.45Å; I439-E443 PolarHBondContact O-N 3.2Å; I439-L503 HydrophobicContact CB-CD2 4.47Å; I439-L503 HydrophobicContact CG2-CD2 4.14Å; I439-L506 HydrophobicContact CD1-CB 4.06Å; I439-L506 HydrophobicContact CG1-CB 3.83Å; I439-L506 HydrophobicContact CG1-CD1 4.24Å; I439-R507 HydrophobicContact CD1-CG 3.97Å; I439-R510 HydrophobicContact CD1-CB 4.47Å
440	V	97	Very high	92.3	Very high	84 Å²	84	54.1 Å²	54.1	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-47.4	177.9	172.8	0	0	0	0	111.1	D436 L438 L442 E443 C444	D436-V440 WeakPolarHBondContact O-CG2 3.29Å; D436-V440 PolarHBondContact O-N 2.84Å; L438-V440 PolarHBondContact O-N 2.98Å; V440-L442 VanDerWaalsContact C-N 3.34Å; V440-L442 PolarHBondContact O-N 3.21Å; V440-E443 PolarHBondContact O-N 3.34Å; V440-C444 PolarHBondContact O-N 3.45Å; V440-C444 VanDerWaalsContact O-N 3.15Å; V440-C444 PolarHBondContact O-SG 2.83Å; V440-C444 VanDerWaalsContact O-SG 3.42Å
441	A	96.6	Very high	93.2	Very high	26 Å²	26	56.6 Å²	56.6	22%	0.215	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-41.8	180	0	0	0	0	0	112.4	A437 L438 I439 L458 V462	A437-A441 WeakPolarHBondContact O-CB 3.41Å; A437-A441 PolarHBondContact O-N 3.4Å; L438-A441 PolarHBondContact O-N 3.37Å; I439-A441 PolarHBondContact O-N 2.8Å; A441-L458 HydrophobicContact CB-CD1 4.21Å; A441-L458 HydrophobicContact CB-CD2 3.99Å; A441-L458 HydrophobicContact CB-CG 4.21Å; A441-V462 HydrophobicContact CB-CG2 3.66Å
442	L	97	Very high	93.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-70.4	-36	177.4	-66.9	179.4	0	0	0	112	L438 I439 V440 C444 L445 F450 L455 L458 K499 C502 L503 L506	L438-L442 HydrophobicContact CD1-CD1 4.03Å; L438-L442 HydrophobicContact CD1-CD2 4.29Å; L438-L442 HydrophobicContact CD1-CG 3.88Å; L438-L442 HydrophobicContact CD2-CD1 4.47Å; L438-L442 HydrophobicContact CG-CD1 3.91Å; L438-L442 HydrophobicContact CG-CG 4.18Å; L438-L442 WeakPolarHBondContact O-CB 3.44Å; L438-L442 VanDerWaalsContact O-CG 3.27Å; L438-L442 WeakPolarHBondContact O-CG 3.21Å; L438-L442 PolarHBondContact O-N 3.11Å; I439-L442 PolarHBondContact O-N 3.27Å; V440-L442 VanDerWaalsContact C-N 3.34Å; V440-L442 PolarHBondContact O-N 3.21Å; L442-C444 VanDerWaalsContact C-N 3.34Å; L442-C444 PolarHBondContact O-N 2.89Å; L442-L445 WeakPolarHBondContact O-CB 3.32Å; L442-L445 PolarHBondContact O-N 3.45Å; L442-F450 HydrophobicContact CD2-CE2 3.93Å; L442-F450 HydrophobicContact CD2-CZ 4.43Å; L442-L455 HydrophobicContact CD2-CD2 3.8Å; L442-L458 HydrophobicContact CD2-CD1 4.46Å; L442-L458 HydrophobicContact CD2-CD2 3.93Å; L442-K499 WeakPolarHBondContact O-CE 3.49Å; L442-K499 PolarHBondContact O-NZ 3.38Å; L442-C502 HydrophobicContact CD1-CB 4.49Å; L442-L503 HydrophobicContact CB-CD2 3.88Å; L442-L506 HydrophobicContact CD1-CD1 3.68Å
443	E	96.7	Very high	94.1	Very high	77 Å²	77	67.1 Å²	67.1	36%	0.36	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-41.3	176.2	-78.6	170.8	176.8	0	0	112.2	I439 V440 L445 K499 L503 R507	I439-E443 HydrophobicContact CG2-CG 4.45Å; I439-E443 WeakPolarHBondContact CG2-OE1 3.37Å; I439-E443 WeakPolarHBondContact O-CB 3.45Å; I439-E443 VanDerWaalsContact O-CG 3.29Å; I439-E443 WeakPolarHBondContact O-CG 3.45Å; I439-E443 PolarHBondContact O-N 3.2Å; V440-E443 PolarHBondContact O-N 3.34Å; E443-L445 VanDerWaalsContact C-N 3.26Å; E443-L445 PolarHBondContact O-N 3Å; E443-K499 PolarHBondContact O-NZ 3.19Å; E443-L503 HydrophobicContact CG-CD1 3.95Å; E443-L503 HydrophobicContact CG-CD2 3.95Å; E443-R507 IonicContact OE1-CZ 2.74Å; E443-R507 IonicContact OE1-NE 2.92Å; E443-R507 IonicContact OE1-NH2 3.54Å; E443-R507 PolarHBondContact OE1-NH2 3.37Å
444	C	95.5	Very high	94.5	Very high	97 Å²	97	62 Å²	62	66%	0.655	32%	0.316	S	S	*	.	H	α-helix	trans	-69.5	-18.8	177.5	-65.6	0	0	0	0	114.2	V440 L442	V440-C444 PolarHBondContact O-N 3.45Å; V440-C444 VanDerWaalsContact O-N 3.15Å; V440-C444 PolarHBondContact O-SG 2.83Å; V440-C444 VanDerWaalsContact O-SG 3.42Å; L442-C444 VanDerWaalsContact C-N 3.34Å; L442-C444 PolarHBondContact O-N 2.89Å
445	L	94.7	Very high	94.7	Very high	16 Å²	16	61.4 Å²	61.4	8%	0.084	31%	0.313	C	S	.	.	S	Bend	trans	-79	126.3	-177.6	-169.7	64.3	0	0	0	111.1	L442 E443 R449 F450 I454 L455 L458 K499	L442-L445 WeakPolarHBondContact O-CB 3.32Å; L442-L445 PolarHBondContact O-N 3.45Å; E443-L445 VanDerWaalsContact C-N 3.26Å; E443-L445 PolarHBondContact O-N 3Å; L445-R449 HydrophobicContact CD1-CB 3.76Å; L445-R449 HydrophobicContact CG-CB 4.21Å; L445-F450 HydrophobicContact CD2-CD2 3.88Å; L445-I454 HydrophobicContact CD1-CG2 3.92Å; L445-I454 HydrophobicContact CD2-CG2 4.4Å; L445-L455 HydrophobicContact CD2-CD2 3.93Å; L445-L458 HydrophobicContact CD2-CD1 4.31Å; L445-K499 PolarHBondContact O-NZ 3.39Å
446	Q	92.6	Very high	94.9	Very high	126 Å²	126	64 Å²	64	59%	0.589	33%	0.33	S	S	*	.			trans	-66.2	149.4	174.9	-60	-60.2	-49.8	0	0	111.6	D448 R449 F450	Q446-D448 VanDerWaalsContact C-N 3.33Å; Q446-D448 WeakPolarHBondContact CB-OD1 3.47Å; Q446-D448 PolarHBondContact O-N 3.42Å; Q446-R449 HydrophobicContact CB-CG 4.45Å; Q446-R449 WeakPolarHBondContact O-CB 3.41Å; Q446-R449 PolarHBondContact O-N 2.85Å; Q446-F450 PolarHBondContact O-N 2.99Å
447	D	87.3	Confident	95	Very high	107 Å²	107	65.6 Å²	65.6	57%	0.572	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-63	-36.4	-172.5	-75.7	-4.9	0	0	0	113.2	R449 F450 K499	D447-R449 PolarHBondContact O-N 3.39Å; D447-F450 WeakPolarHBondContact O-CB 3.42Å; D447-F450 PolarHBondContact O-N 3.16Å; D447-K499 WeakPolarHBondContact OD1-CD 3.27Å
448	D	90.5	Very high	95	Very high	117 Å²	117	65.2 Å²	65.2	63%	0.626	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-66.1	-24.9	175.8	67.3	-39.1	0	0	0	112.9	Q446 Q451	Q446-D448 VanDerWaalsContact C-N 3.33Å; Q446-D448 WeakPolarHBondContact CB-OD1 3.47Å; Q446-D448 PolarHBondContact O-N 3.42Å; D448-Q451 PolarHBondContact O-NE2 3.33Å
449	R	93.5	Very high	95.1	Very high	133 Å²	133	65.2 Å²	65.2	50%	0.502	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-90.8	-0	176.6	-63	-170.8	65.8	-177.6	-1.4	113.7	L445 Q446 D447 Q451 I454	L445-R449 HydrophobicContact CD1-CB 3.76Å; L445-R449 HydrophobicContact CG-CB 4.21Å; Q446-R449 HydrophobicContact CB-CG 4.45Å; Q446-R449 WeakPolarHBondContact O-CB 3.41Å; Q446-R449 PolarHBondContact O-N 2.85Å; D447-R449 PolarHBondContact O-N 3.39Å; R449-Q451 PolarHBondContact O-N 2.85Å; R449-I454 HydrophobicContact CB-CD1 3.89Å; R449-I454 HydrophobicContact CG-CD1 4.34Å; R449-I454 WeakPolarHBondContact O-CD1 3.37Å
450	F	93.8	Very high	95	Very high	10 Å²	10	67 Å²	67	4%	0.044	34%	0.343	C	S	.	.			trans	-77.4	62.6	180	-155.6	-85.8	0	0	0	111.9	L442 L445 Q446 D447 L455 L494 K499 C502	L442-F450 HydrophobicContact CD2-CE2 3.93Å; L442-F450 HydrophobicContact CD2-CZ 4.43Å; L445-F450 HydrophobicContact CD2-CD2 3.88Å; Q446-F450 PolarHBondContact O-N 2.99Å; D447-F450 WeakPolarHBondContact O-CB 3.42Å; D447-F450 PolarHBondContact O-N 3.16Å; F450-L455 HydrophobicContact CD1-CD1 3.84Å; F450-L455 HydrophobicContact CD2-CD2 4.11Å; F450-L455 HydrophobicContact CE1-CD1 3.73Å; F450-L455 HydrophobicContact CE1-CD2 4.25Å; F450-L455 HydrophobicContact CE2-CD2 3.85Å; F450-L455 HydrophobicContact CG-CD1 4.38Å; F450-L455 HydrophobicContact CG-CD2 4.43Å; F450-L455 HydrophobicContact CZ-CD1 4.21Å; F450-L455 HydrophobicContact CZ-CD2 3.92Å; F450-L494 HydrophobicContact CE1-CB 4.29Å; F450-L494 VanDerWaalsContact CE1-O 3.32Å; F450-L494 WeakPolarHBondContact CE1-O 3.36Å; F450-L494 HydrophobicContact CZ-CB 4.27Å; F450-K499 HydrophobicContact CD2-CB 3.59Å; F450-K499 HydrophobicContact CD2-CD 4.4Å; F450-K499 HydrophobicContact CD2-CG 3.97Å; F450-K499 HydrophobicContact CE2-CB 3.59Å; F450-K499 HydrophobicContact CE2-CG 3.84Å; F450-K499 HydrophobicContact CG-CB 4.11Å; F450-K499 HydrophobicContact CZ-CB 4.13Å; F450-C502 HydrophobicContact CZ-CB 4.43Å
451	Q	93.9	Very high	95	Very high	105 Å²	105	68.9 Å²	68.9	49%	0.491	35%	0.347	S	S	.	.			trans	-120.4	147.4	-173.3	-59.1	179.4	10.9	0	0	110.8	D448 R449 K453 I454 L455 E495	D448-Q451 PolarHBondContact O-NE2 3.33Å; R449-Q451 PolarHBondContact O-N 2.85Å; Q451-K453 PolarHBondContact O-N 3.36Å; Q451-I454 PolarHBondContact O-N 3.39Å; Q451-L455 WeakPolarHBondContact O-CG 3.24Å; Q451-L455 PolarHBondContact O-N 3.36Å; Q451-E495 VanDerWaalsContact CA-OE1 3.32Å; Q451-E495 WeakPolarHBondContact CA-OE1 3.26Å
452	K	93.4	Very high	95	Very high	81 Å²	81	68.1 Å²	68.1	35%	0.352	34%	0.339	S	S	.	.	H	α-helix	trans	-47.9	-42.2	-174.2	175	177.6	174.3	174.3	0	113.7	T456 A491 E492 E495	K452-T456 WeakPolarHBondContact O-CB 3.32Å; K452-T456 PolarHBondContact O-N 3.1Å; K452-T456 PolarHBondContact O-OG1 3.03Å; K452-A491 HydrophobicContact CG-CB 4.17Å; K452-E492 HydrophobicContact CD-CB 4.03Å; K452-E492 HydrophobicContact CD-CG 4.3Å; K452-E492 IonicContact NZ-OE2 3.85Å; K452-E492 PolarHBondContact NZ-OE2 3.05Å; K452-E495 WeakPolarHBondContact CB-OE2 3.27Å; K452-E495 PolarHBondContact N-OE1 2.95Å
453	K	95	Very high	94.9	Very high	166 Å²	166	68.1 Å²	68.1	72%	0.722	34%	0.339	S	S	*	.	H	α-helix	trans	-61.4	-51.8	179.9	-172.1	179.5	178.9	-176.7	0	111.5	Q451 T456 D457	Q451-K453 PolarHBondContact O-N 3.36Å; K453-T456 WeakPolarHBondContact O-CB 3.46Å; K453-T456 PolarHBondContact O-N 3.33Å; K453-D457 PolarHBondContact O-N 3.42Å
454	I	96.7	Very high	94.8	Very high	44 Å²	44	67.8 Å²	67.8	23%	0.226	35%	0.35	C	S	.	.	H	α-helix	trans	-67.3	-40.4	-179.3	-61.8	171.7	0	0	0	110.8	L445 R449 Q451 T456 D457 L458	L445-I454 HydrophobicContact CD1-CG2 3.92Å; L445-I454 HydrophobicContact CD2-CG2 4.4Å; R449-I454 HydrophobicContact CB-CD1 3.89Å; R449-I454 HydrophobicContact CG-CD1 4.34Å; R449-I454 WeakPolarHBondContact O-CD1 3.37Å; Q451-I454 PolarHBondContact O-N 3.39Å; I454-T456 VanDerWaalsContact C-N 3.28Å; I454-T456 PolarHBondContact O-N 3.13Å; I454-D457 PolarHBondContact O-N 2.93Å; I454-L458 WeakPolarHBondContact O-CB 3.49Å; I454-L458 PolarHBondContact O-N 3.36Å
455	L	97.3	Very high	94.7	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-63.2	-34.5	176.8	-69.8	167.8	0	0	0	112.1	L442 L445 F450 Q451 L459 A491 L494 E495	L442-L455 HydrophobicContact CD2-CD2 3.8Å; L445-L455 HydrophobicContact CD2-CD2 3.93Å; F450-L455 HydrophobicContact CD1-CD1 3.84Å; F450-L455 HydrophobicContact CD2-CD2 4.11Å; F450-L455 HydrophobicContact CE1-CD1 3.73Å; F450-L455 HydrophobicContact CE1-CD2 4.25Å; F450-L455 HydrophobicContact CE2-CD2 3.85Å; F450-L455 HydrophobicContact CG-CD1 4.38Å; F450-L455 HydrophobicContact CG-CD2 4.43Å; F450-L455 HydrophobicContact CZ-CD1 4.21Å; F450-L455 HydrophobicContact CZ-CD2 3.92Å; Q451-L455 WeakPolarHBondContact O-CG 3.24Å; Q451-L455 PolarHBondContact O-N 3.36Å; L455-L459 WeakPolarHBondContact O-CB 3.48Å; L455-L459 WeakPolarHBondContact O-CD1 3.38Å; L455-L459 WeakPolarHBondContact O-CG 3.31Å; L455-L459 PolarHBondContact O-N 3.42Å; L455-A491 HydrophobicContact CB-CB 3.96Å; L455-L494 HydrophobicContact CD1-CB 3.97Å; L455-L494 HydrophobicContact CD2-CD1 4.31Å; L455-E495 HydrophobicContact CD1-CB 4.06Å
456	T	97	Very high	94.6	Very high	55 Å²	55	70.8 Å²	70.8	34%	0.337	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-49.2	176.2	-58.5	0	0	0	0	110.5	K452 K453 I454 L459 C460 A491	K452-T456 WeakPolarHBondContact O-CB 3.32Å; K452-T456 PolarHBondContact O-N 3.1Å; K452-T456 PolarHBondContact O-OG1 3.03Å; K453-T456 WeakPolarHBondContact O-CB 3.46Å; K453-T456 PolarHBondContact O-N 3.33Å; I454-T456 VanDerWaalsContact C-N 3.28Å; I454-T456 PolarHBondContact O-N 3.13Å; T456-L459 PolarHBondContact O-N 3.24Å; T456-C460 PolarHBondContact O-N 3.05Å; T456-C460 VanDerWaalsContact O-N 3.17Å; T456-C460 PolarHBondContact O-SG 3.5Å; T456-C460 VanDerWaalsContact O-SG 3.36Å; T456-A491 WeakPolarHBondContact OG1-CB 3.3Å
457	D	96.4	Very high	94.6	Very high	87 Å²	87	68.3 Å²	68.3	47%	0.465	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-45.3	178.8	-62.2	-26.3	0	0	0	111	K453 I454 L459 C460 H461	K453-D457 PolarHBondContact O-N 3.42Å; I454-D457 PolarHBondContact O-N 2.93Å; D457-L459 VanDerWaalsContact C-N 3.34Å; D457-L459 PolarHBondContact O-N 3.5Å; D457-C460 WeakPolarHBondContact O-CB 3.48Å; D457-C460 PolarHBondContact O-N 2.9Å; D457-C460 VanDerWaalsContact O-N 3.14Å; D457-H461 PolarHBondContact O-N 3.22Å; D457-H461 PolarHBondContact O-ND1 3.26Å
458	L	97.2	Very high	94.8	Very high	28 Å²	28	64.3 Å²	64.3	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-57.4	-45.7	177.9	-178.4	149.9	0	0	0	111.9	L438 A441 L442 L445 I454 C460 H461 V462	L438-L458 HydrophobicContact CD1-CD2 3.9Å; A441-L458 HydrophobicContact CB-CD1 4.21Å; A441-L458 HydrophobicContact CB-CD2 3.99Å; A441-L458 HydrophobicContact CB-CG 4.21Å; L442-L458 HydrophobicContact CD2-CD1 4.46Å; L442-L458 HydrophobicContact CD2-CD2 3.93Å; L445-L458 HydrophobicContact CD2-CD1 4.31Å; I454-L458 WeakPolarHBondContact O-CB 3.49Å; I454-L458 PolarHBondContact O-N 3.36Å; L458-C460 VanDerWaalsContact C-N 3.3Å; L458-C460 PolarHBondContact O-N 3.43Å; L458-H461 PolarHBondContact O-N 2.86Å; L458-V462 HydrophobicContact CD2-CG2 4.04Å; L458-V462 WeakPolarHBondContact O-CG2 3.12Å; L458-V462 PolarHBondContact O-N 3.49Å
459	L	97.4	Very high	94.9	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.5	-35.4	178.5	-72.5	169.3	0	0	0	112.5	L438 L455 T456 D457 A463 F473 M474 L477 I490 A491 L494	L438-L459 HydrophobicContact CD1-CD2 3.75Å; L438-L459 HydrophobicContact CD2-CD2 4.39Å; L455-L459 WeakPolarHBondContact O-CB 3.48Å; L455-L459 WeakPolarHBondContact O-CD1 3.38Å; L455-L459 WeakPolarHBondContact O-CG 3.31Å; L455-L459 PolarHBondContact O-N 3.42Å; T456-L459 PolarHBondContact O-N 3.24Å; D457-L459 VanDerWaalsContact C-N 3.34Å; D457-L459 PolarHBondContact O-N 3.5Å; L459-A463 WeakPolarHBondContact O-CB 3.19Å; L459-A463 PolarHBondContact O-N 3.38Å; L459-A463 VanDerWaalsContact O-N 3.07Å; L459-F473 HydrophobicContact CD2-CE1 3.9Å; L459-M474 HydrophobicContact CB-CE 3.43Å; L459-M474 VanDerWaalsContact CB-CE 3.43Å; L459-M474 HydrophobicContact CB-SD 4.38Å; L459-M474 HydrophobicContact CD1-CE 3.83Å; L459-M474 HydrophobicContact CD1-SD 3.92Å; L459-M474 HydrophobicContact CG-CE 4.23Å; L459-L477 HydrophobicContact CD2-CD1 3.5Å; L459-I490 HydrophobicContact CD1-CB 4.31Å; L459-I490 HydrophobicContact CD1-CG2 3.95Å; L459-A491 HydrophobicContact CD1-CB 4.13Å; L459-L494 HydrophobicContact CD1-CD1 3.92Å; L459-L494 HydrophobicContact CD2-CD1 4.04Å; L459-L494 HydrophobicContact CG-CD1 4.23Å
460	C	96.3	Very high	94.9	Very high	47 Å²	47	58 Å²	58	32%	0.318	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-43.2	175	-69.9	0	0	0	0	111.9	T456 D457 L458 A463 A464	T456-C460 PolarHBondContact O-N 3.05Å; T456-C460 VanDerWaalsContact O-N 3.17Å; T456-C460 PolarHBondContact O-SG 3.5Å; T456-C460 VanDerWaalsContact O-SG 3.36Å; D457-C460 WeakPolarHBondContact O-CB 3.48Å; D457-C460 PolarHBondContact O-N 2.9Å; D457-C460 VanDerWaalsContact O-N 3.14Å; L458-C460 VanDerWaalsContact C-N 3.3Å; L458-C460 PolarHBondContact O-N 3.43Å; C460-A463 PolarHBondContact O-N 2.89Å; C460-A464 PolarHBondContact O-N 2.92Å
461	H	96.2	Very high	94.8	Very high	125 Å²	125	61 Å²	61	58%	0.579	36%	0.358	S	S	*	.	H	α-helix	trans	-64.7	-47.6	176.9	-69.8	87.1	0	0	0	111.4	D457 L458 A463 A464 D465	D457-H461 PolarHBondContact O-N 3.22Å; D457-H461 PolarHBondContact O-ND1 3.26Å; L458-H461 PolarHBondContact O-N 2.86Å; H461-A463 VanDerWaalsContact C-N 3.28Å; H461-A463 PolarHBondContact O-N 3.24Å; H461-A464 WeakPolarHBondContact O-CB 3.49Å; H461-A464 PolarHBondContact O-N 3.05Å; H461-A464 VanDerWaalsContact O-N 3.08Å; H461-D465 PolarHBondContact O-N 3.26Å
462	V	96.4	Very high	94.6	Very high	9 Å²	9	61.1 Å²	61.1	6%	0.055	36%	0.359	C	S	.	.	H	α-helix	trans	-59.4	-39.7	177.7	174	0	0	0	0	111.5	A437 L438 A441 L458 C466 F473	A437-V462 HydrophobicContact CB-CG1 4.05Å; L438-V462 HydrophobicContact CB-CG1 4.26Å; L438-V462 HydrophobicContact CD1-CG2 4.5Å; A441-V462 HydrophobicContact CB-CG2 3.66Å; L458-V462 HydrophobicContact CD2-CG2 4.04Å; L458-V462 WeakPolarHBondContact O-CG2 3.12Å; L458-V462 PolarHBondContact O-N 3.49Å; V462-C466 WeakPolarHBondContact O-CB 3.12Å; V462-C466 PolarHBondContact O-N 3.05Å; V462-C466 PolarHBondContact O-SG 3.31Å; V462-F473 HydrophobicContact CB-CE1 4.26Å; V462-F473 HydrophobicContact CB-CZ 4.38Å; V462-F473 HydrophobicContact CG1-CE1 3.98Å; V462-F473 HydrophobicContact CG1-CE2 4.44Å; V462-F473 HydrophobicContact CG1-CZ 3.6Å
463	A	95.5	Very high	94.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-44.6	175.4	0	0	0	0	0	111.9	L459 C460 H461 C466 G467 I468 F473	L459-A463 WeakPolarHBondContact O-CB 3.19Å; L459-A463 PolarHBondContact O-N 3.38Å; L459-A463 VanDerWaalsContact O-N 3.07Å; C460-A463 PolarHBondContact O-N 2.89Å; H461-A463 VanDerWaalsContact C-N 3.28Å; H461-A463 PolarHBondContact O-N 3.24Å; A463-C466 PolarHBondContact O-N 3.04Å; A463-G467 PolarHBondContact O-N 3.04Å; A463-I468 CarbonylContact C-O 3.57Å; A463-I468 HydrophobicContact CB-CG2 4.21Å; A463-I468 WeakPolarHBondContact O-CG2 3.09Å; A463-I468 PolarHBondContact O-N 3.48Å; A463-I468 VanDerWaalsContact O-O 3.06Å; A463-F473 HydrophobicContact CB-CB 3.93Å; A463-F473 HydrophobicContact CB-CD1 3.77Å; A463-F473 HydrophobicContact CB-CG 3.99Å
464	A	95.2	Very high	94.6	Very high	71 Å²	71	51.2 Å²	51.2	59%	0.587	32%	0.317	S	S	*	.	H	α-helix	trans	-62.9	-46.4	177.8	0	0	0	0	0	111.9	C460 H461 C466 G467	C460-A464 PolarHBondContact O-N 2.92Å; H461-A464 WeakPolarHBondContact O-CB 3.49Å; H461-A464 PolarHBondContact O-N 3.05Å; H461-A464 VanDerWaalsContact O-N 3.08Å; A464-C466 VanDerWaalsContact C-N 3.26Å; A464-C466 PolarHBondContact O-N 3.27Å; A464-G467 PolarHBondContact O-N 2.74Å
465	D	93.5	Very high	94.3	Very high	139 Å²	139	53.9 Å²	53.9	74%	0.743	33%	0.328	S	S	*	.	H	α-helix	trans	-63.3	-32.8	178.7	-67.8	-16.2	0	0	0	112.4	H461 G467	H461-D465 PolarHBondContact O-N 3.26Å; D465-G467 VanDerWaalsContact C-N 3.31Å
466	C	91.9	Very high	93.9	Very high	36 Å²	36	54.2 Å²	54.2	24%	0.243	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-6.9	175.1	-69	0	0	0	0	114	V462 A463 A464 I468	V462-C466 WeakPolarHBondContact O-CB 3.12Å; V462-C466 PolarHBondContact O-N 3.05Å; V462-C466 PolarHBondContact O-SG 3.31Å; A463-C466 PolarHBondContact O-N 3.04Å; A464-C466 VanDerWaalsContact C-N 3.26Å; A464-C466 PolarHBondContact O-N 3.27Å; C466-I468 VanDerWaalsContact C-N 3.3Å; C466-I468 HydrophobicContact CB-CG2 3.94Å; C466-I468 PolarHBondContact O-N 3.14Å
467	G	92	Very high	93.7	Very high	75 Å²	75	51.6 Å²	51.6	77%	0.773	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	23	-176.5	0	0	0	0	0	114.5	A463 A464 D465	A463-G467 PolarHBondContact O-N 3.04Å; A464-G467 PolarHBondContact O-N 2.74Å; D465-G467 VanDerWaalsContact C-N 3.31Å
468	I	91.3	Very high	93.4	Very high	22 Å²	22	49 Å²	49	11%	0.113	30%	0.297	C	S	.	.			trans	-108.1	142	178.2	-176	168.1	0	0	0	110.3	A463 C466 T470 H472 F473	A463-I468 CarbonylContact C-O 3.57Å; A463-I468 HydrophobicContact CB-CG2 4.21Å; A463-I468 WeakPolarHBondContact O-CG2 3.09Å; A463-I468 PolarHBondContact O-N 3.48Å; A463-I468 VanDerWaalsContact O-O 3.06Å; C466-I468 VanDerWaalsContact C-N 3.3Å; C466-I468 HydrophobicContact CB-CG2 3.94Å; C466-I468 PolarHBondContact O-N 3.14Å; I468-T470 PolarHBondContact O-N 3.07Å; I468-H472 HydrophobicContact CD1-CB 3.9Å; I468-H472 HydrophobicContact CG1-CB 3.85Å; I468-F473 HydrophobicContact CD1-CB 4.32Å; I468-F473 HydrophobicContact CG1-CB 4.38Å; I468-F473 HydrophobicContact CG2-CB 3.88Å; I468-F473 HydrophobicContact CG2-CD2 3.99Å; I468-F473 HydrophobicContact CG2-CG 4.15Å
469	S	92.6	Very high	92.9	Very high	59 Å²	59	50.8 Å²	50.8	41%	0.413	30%	0.302	S	S	.	.			trans	-60.2	138.7	174.1	77.1	0	0	0	0	110.4	A471 H472 F473	S469-A471 PolarHBondContact O-N 2.83Å; S469-A471 VanDerWaalsContact O-N 3.13Å; S469-H472 PolarHBondContact O-N 3.24Å; S469-H472 WeakPolarHBondContact OG-CB 3.44Å; S469-H472 VanDerWaalsContact OG-CG 3.23Å; S469-H472 PolarHBondContact OG-N 3.4Å; S469-H472 PolarHBondContact OG-ND1 3.4Å; S469-F473 PolarHBondContact O-N 3.39Å
470	T	93.6	Very high	92.4	Very high	60 Å²	60	50.8 Å²	50.8	37%	0.368	30%	0.302	S	S	.	.	H	α-helix	trans	-53.4	-39	179	-47.2	0	0	0	0	111.1	I468 F473 M474	I468-T470 PolarHBondContact O-N 3.07Å; T470-F473 PolarHBondContact O-N 2.97Å; T470-M474 HydrophobicContact CG2-CE 3.77Å; T470-M474 HydrophobicContact CG2-CG 4.24Å; T470-M474 WeakPolarHBondContact O-CB 3.47Å; T470-M474 WeakPolarHBondContact O-CG 3.29Å; T470-M474 PolarHBondContact O-N 3.22Å
471	A	92.1	Very high	92	Very high	72 Å²	72	48.7 Å²	48.7	60%	0.595	29%	0.288	S	S	*	.	H	α-helix	trans	-60.8	-47	177.4	0	0	0	0	0	113.1	S469 M474 Q475	S469-A471 PolarHBondContact O-N 2.83Å; S469-A471 VanDerWaalsContact O-N 3.13Å; A471-M474 PolarHBondContact O-N 3.11Å; A471-Q475 WeakPolarHBondContact O-CB 3.46Å; A471-Q475 PolarHBondContact O-N 2.88Å
472	H	90.9	Very high	91.6	Very high	107 Å²	107	43.4 Å²	43.4	50%	0.495	26%	0.264	S	S	.	.	H	α-helix	trans	-67.6	-39.8	177.8	-70.6	170.7	0	0	0	111.7	I468 S469 M474 Q475 F476	I468-H472 HydrophobicContact CD1-CB 3.9Å; I468-H472 HydrophobicContact CG1-CB 3.85Å; S469-H472 PolarHBondContact O-N 3.24Å; S469-H472 WeakPolarHBondContact OG-CB 3.44Å; S469-H472 VanDerWaalsContact OG-CG 3.23Å; S469-H472 PolarHBondContact OG-N 3.4Å; S469-H472 PolarHBondContact OG-ND1 3.4Å; H472-M474 PolarHBondContact O-N 2.9Å; H472-Q475 PolarHBondContact O-N 3.39Å; H472-F476 WeakPolarHBondContact O-CB 3.37Å; H472-F476 PolarHBondContact O-N 3.49Å
473	F	93.4	Very high	90.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.4	-46.1	176.5	-171.1	-121.8	0	0	0	111.7	H434 L438 L459 V462 A463 I468 S469 T470 Q475 F476 L477	H434-F473 HydrophobicContact CB-CE2 4.08Å; L438-F473 HydrophobicContact CB-CZ 4.31Å; L438-F473 HydrophobicContact CD2-CZ 4.3Å; L459-F473 HydrophobicContact CD2-CE1 3.9Å; V462-F473 HydrophobicContact CB-CE1 4.26Å; V462-F473 HydrophobicContact CB-CZ 4.38Å; V462-F473 HydrophobicContact CG1-CE1 3.98Å; V462-F473 HydrophobicContact CG1-CE2 4.44Å; V462-F473 HydrophobicContact CG1-CZ 3.6Å; A463-F473 HydrophobicContact CB-CB 3.93Å; A463-F473 HydrophobicContact CB-CD1 3.77Å; A463-F473 HydrophobicContact CB-CG 3.99Å; I468-F473 HydrophobicContact CD1-CB 4.32Å; I468-F473 HydrophobicContact CG1-CB 4.38Å; I468-F473 HydrophobicContact CG2-CB 3.88Å; I468-F473 HydrophobicContact CG2-CD2 3.99Å; I468-F473 HydrophobicContact CG2-CG 4.15Å; S469-F473 PolarHBondContact O-N 3.39Å; T470-F473 PolarHBondContact O-N 2.97Å; F473-Q475 VanDerWaalsContact C-N 3.34Å; F473-Q475 PolarHBondContact O-N 2.81Å; F473-F476 HydrophobicContact CD2-CD1 4.48Å; F473-F476 WeakPolarHBondContact O-CB 3.47Å; F473-F476 PolarHBondContact O-N 3.42Å; F473-L477 HydrophobicContact CD1-CD1 3.96Å; F473-L477 HydrophobicContact CE1-CD1 3.59Å; F473-L477 HydrophobicContact CE1-CG 4.38Å; F473-L477 HydrophobicContact CE2-CD1 4.34Å; F473-L477 HydrophobicContact CE2-CD2 4.4Å; F473-L477 HydrophobicContact CE2-CG 4.32Å; F473-L477 HydrophobicContact CZ-CD1 3.79Å; F473-L477 HydrophobicContact CZ-CD2 4.37Å; F473-L477 HydrophobicContact CZ-CG 4.24Å; F473-L477 WeakPolarHBondContact O-CG 3.38Å; F473-L477 PolarHBondContact O-N 3.48Å
474	M	94.1	Very high	90.3	Very high	39 Å²	39	49.7 Å²	49.7	19%	0.192	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-38.6	176.2	-64	-68.3	177.6	0	0	112.1	L459 T470 A471 H472 R478 I490	L459-M474 HydrophobicContact CB-CE 3.43Å; L459-M474 VanDerWaalsContact CB-CE 3.43Å; L459-M474 HydrophobicContact CB-SD 4.38Å; L459-M474 HydrophobicContact CD1-CE 3.83Å; L459-M474 HydrophobicContact CD1-SD 3.92Å; L459-M474 HydrophobicContact CG-CE 4.23Å; T470-M474 HydrophobicContact CG2-CE 3.77Å; T470-M474 HydrophobicContact CG2-CG 4.24Å; T470-M474 WeakPolarHBondContact O-CB 3.47Å; T470-M474 WeakPolarHBondContact O-CG 3.29Å; T470-M474 PolarHBondContact O-N 3.22Å; A471-M474 PolarHBondContact O-N 3.11Å; H472-M474 PolarHBondContact O-N 2.9Å; M474-R478 WeakPolarHBondContact O-CB 3.45Å; M474-R478 PolarHBondContact O-N 2.95Å; M474-I490 HydrophobicContact CB-CG1 4.21Å; M474-I490 WeakPolarHBondContact O-CG1 3.45Å; M474-I490 HydrophobicContact SD-CB 3.72Å; M474-I490 HydrophobicContact SD-CG1 4.05Å; M474-I490 HydrophobicContact SD-CG2 4.31Å
475	Q	90.5	Very high	89.6	Confident	101 Å²	101	56.4 Å²	56.4	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-66.9	-40.4	176.1	-171.2	-177.3	43.1	0	0	111.9	A471 H472 F473 R478 R479	A471-Q475 WeakPolarHBondContact O-CB 3.46Å; A471-Q475 PolarHBondContact O-N 2.88Å; H472-Q475 PolarHBondContact O-N 3.39Å; F473-Q475 VanDerWaalsContact C-N 3.34Å; F473-Q475 PolarHBondContact O-N 2.81Å; Q475-R478 WeakPolarHBondContact O-CB 3.36Å; Q475-R478 PolarHBondContact O-N 3.45Å; Q475-R479 WeakPolarHBondContact O-CG 3.47Å; Q475-R479 PolarHBondContact O-N 3.23Å
476	F	89.2	Confident	89.2	Confident	7 Å²	7	60.2 Å²	60.2	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-55.3	172.6	168.3	-110.7	0	0	0	111	E431 H434 L435 H472 F473 R478 R479 V480	E431-F476 HydrophobicContact CB-CE2 3.82Å; E431-F476 HydrophobicContact CB-CZ 3.82Å; E431-F476 VanDerWaalsContact CD-CE2 3.45Å; E431-F476 HydrophobicContact CG-CD2 4.3Å; E431-F476 HydrophobicContact CG-CE2 3.71Å; E431-F476 HydrophobicContact CG-CZ 4.18Å; H434-F476 HydrophobicContact CB-CE1 4.33Å; L435-F476 HydrophobicContact CD1-CZ 4.02Å; L435-F476 HydrophobicContact CD2-CE1 3.7Å; L435-F476 HydrophobicContact CD2-CZ 3.88Å; L435-F476 HydrophobicContact CG-CE1 3.88Å; L435-F476 HydrophobicContact CG-CZ 3.78Å; H472-F476 WeakPolarHBondContact O-CB 3.37Å; H472-F476 PolarHBondContact O-N 3.49Å; F473-F476 HydrophobicContact CD2-CD1 4.48Å; F473-F476 WeakPolarHBondContact O-CB 3.47Å; F473-F476 PolarHBondContact O-N 3.42Å; F476-R478 PolarHBondContact O-N 2.95Å; F476-R479 WeakPolarHBondContact O-CB 3.24Å; F476-R479 PolarHBondContact O-N 2.69Å; F476-V480 HydrophobicContact CD2-CG2 4.1Å; F476-V480 HydrophobicContact CE1-CG2 4.16Å; F476-V480 HydrophobicContact CE2-CG2 3.68Å; F476-V480 HydrophobicContact CZ-CG2 3.72Å; F476-V480 WeakPolarHBondContact O-CG2 3.43Å; F476-V480 PolarHBondContact O-N 2.95Å
477	L	92.4	Very high	88.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-33.5	178.7	-66.7	-179.1	0	0	0	112.8	L435 L438 L459 F473 R479 V480 L481 I490 L506	L435-L477 HydrophobicContact CD2-CD2 4.39Å; L438-L477 HydrophobicContact CD2-CD1 3.73Å; L438-L477 HydrophobicContact CD2-CD2 3.47Å; L438-L477 VanDerWaalsContact CD2-CD2 3.47Å; L438-L477 HydrophobicContact CD2-CG 4.25Å; L459-L477 HydrophobicContact CD2-CD1 3.5Å; F473-L477 HydrophobicContact CD1-CD1 3.96Å; F473-L477 HydrophobicContact CE1-CD1 3.59Å; F473-L477 HydrophobicContact CE1-CG 4.38Å; F473-L477 HydrophobicContact CE2-CD1 4.34Å; F473-L477 HydrophobicContact CE2-CD2 4.4Å; F473-L477 HydrophobicContact CE2-CG 4.32Å; F473-L477 HydrophobicContact CZ-CD1 3.79Å; F473-L477 HydrophobicContact CZ-CD2 4.37Å; F473-L477 HydrophobicContact CZ-CG 4.24Å; F473-L477 WeakPolarHBondContact O-CG 3.38Å; F473-L477 PolarHBondContact O-N 3.48Å; L477-R479 PolarHBondContact O-N 2.85Å; L477-V480 PolarHBondContact O-N 3.08Å; L477-L481 HydrophobicContact CB-CD1 4.37Å; L477-L481 WeakPolarHBondContact O-CB 3.49Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å; L477-L481 PolarHBondContact O-N 3.46Å; L477-I490 HydrophobicContact CB-CG1 4.45Å; L477-I490 HydrophobicContact CB-CG2 3.93Å; L477-I490 HydrophobicContact CD1-CG2 3.98Å; L477-L506 HydrophobicContact CD2-CD2 4.28Å
478	R	90.3	Very high	88.7	Confident	31 Å²	31	59.6 Å²	59.6	12%	0.117	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-49	173.7	-165.6	174.2	-70.7	-68.5	-2.3	111.9	M474 Q475 F476 V480 T482 S484 R485 G487 L488 I490	M474-R478 WeakPolarHBondContact O-CB 3.45Å; M474-R478 PolarHBondContact O-N 2.95Å; Q475-R478 WeakPolarHBondContact O-CB 3.36Å; Q475-R478 PolarHBondContact O-N 3.45Å; F476-R478 PolarHBondContact O-N 2.95Å; R478-V480 VanDerWaalsContact C-N 3.31Å; R478-V480 PolarHBondContact O-N 3.06Å; R478-T482 WeakPolarHBondContact CG-OG1 3.33Å; R478-T482 WeakPolarHBondContact O-CA 3.43Å; R478-T482 WeakPolarHBondContact O-CB 3.12Å; R478-T482 PolarHBondContact O-N 3.36Å; R478-T482 PolarHBondContact O-OG1 3.19Å; R478-S484 VanDerWaalsContact CG-O 3.29Å; R478-S484 WeakPolarHBondContact CG-O 3.32Å; R478-R485 VanDerWaalsContact CD-C 3.44Å; R478-R485 WeakPolarHBondContact CD-O 3.23Å; R478-G487 PolarHBondContact NH1-O 3.23Å; R478-G487 PolarHBondContact NH2-O 3.05Å; R478-L488 PolarHBondContact NH1-O 2.95Å; R478-L488 PolarHBondContact NH2-O 3.16Å; R478-I490 VanDerWaalsContact CA-CD1 3.45Å; R478-I490 HydrophobicContact CB-CD1 3.67Å; R478-I490 HydrophobicContact CG-CD1 4.06Å
479	R	85.9	Confident	88.8	Confident	67 Å²	67	61.8 Å²	61.8	25%	0.253	33%	0.334	S	S	.	.	H	α-helix	trans	-62.1	-43.4	179.1	-67.1	-179.5	-65.8	168.4	4.4	110.4	Q475 F476 L477 A483	Q475-R479 WeakPolarHBondContact O-CG 3.47Å; Q475-R479 PolarHBondContact O-N 3.23Å; F476-R479 WeakPolarHBondContact O-CB 3.24Å; F476-R479 PolarHBondContact O-N 2.69Å; L477-R479 PolarHBondContact O-N 2.85Å; R479-A483 VanDerWaalsContact O-CA 3.29Å; R479-A483 WeakPolarHBondContact O-CA 3.34Å; R479-A483 PolarHBondContact O-N 3.42Å
480	V	87.1	Confident	88.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.5	-48.5	179	171.1	0	0	0	0	112.3	P416 L435 F476 L477 R478 L506 V509	P416-V480 VanDerWaalsContact CB-O 3.24Å; P416-V480 WeakPolarHBondContact CB-O 3.18Å; L435-V480 HydrophobicContact CD2-CG1 4.27Å; F476-V480 HydrophobicContact CD2-CG2 4.1Å; F476-V480 HydrophobicContact CE1-CG2 4.16Å; F476-V480 HydrophobicContact CE2-CG2 3.68Å; F476-V480 HydrophobicContact CZ-CG2 3.72Å; F476-V480 WeakPolarHBondContact O-CG2 3.43Å; F476-V480 PolarHBondContact O-N 2.95Å; L477-V480 PolarHBondContact O-N 3.08Å; R478-V480 VanDerWaalsContact C-N 3.31Å; R478-V480 PolarHBondContact O-N 3.06Å; V480-L506 HydrophobicContact CG1-CD2 3.98Å; V480-V509 HydrophobicContact CG1-CB 4.01Å; V480-V509 HydrophobicContact CG1-CG1 3.93Å; V480-V509 HydrophobicContact CG1-CG2 4Å; V480-V509 HydrophobicContact CG2-CG1 4.13Å
481	L	88.9	Confident	89.1	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-88	-28.6	-170.5	-65.2	169.8	0	0	0	113.8	L477 I490 V493 L494 L497 R505 L506	L477-L481 HydrophobicContact CB-CD1 4.37Å; L477-L481 WeakPolarHBondContact O-CB 3.49Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å; L477-L481 PolarHBondContact O-N 3.46Å; L481-I490 HydrophobicContact CD1-CG2 4.12Å; L481-V493 HydrophobicContact CB-CG1 4.19Å; L481-V493 HydrophobicContact CD1-CG1 4.36Å; L481-L494 HydrophobicContact CD1-CD2 3.59Å; L481-L494 HydrophobicContact CD1-CG 4.27Å; L481-L494 HydrophobicContact CD2-CD2 4.47Å; L481-L497 HydrophobicContact CD2-CD1 4.44Å; L481-R505 HydrophobicContact CD2-CB 4.31Å; L481-R505 PolarHBondContact O-NH1 3.05Å; L481-R505 VanDerWaalsContact O-NH1 3.11Å; L481-L506 HydrophobicContact CD2-CD2 4.11Å; L481-L506 HydrophobicContact CD2-CG 4.35Å
482	T	86.4	Confident	89.2	Confident	15 Å²	15	54.2 Å²	54.2	9%	0.092	28%	0.276	C	S	.	.	H	α-helix	trans	-123.9	-10.6	-169.7	74	0	0	0	0	114.8	F411 R478 S484 V493	F411-T482 HydrophobicContact CD1-CG2 4.44Å; F411-T482 HydrophobicContact CD2-CG2 3.71Å; F411-T482 HydrophobicContact CE2-CG2 3.83Å; F411-T482 HydrophobicContact CG-CG2 4.05Å; F411-T482 HydrophobicContact CZ-CG2 4.24Å; R478-T482 WeakPolarHBondContact CG-OG1 3.33Å; R478-T482 WeakPolarHBondContact O-CA 3.43Å; R478-T482 WeakPolarHBondContact O-CB 3.12Å; R478-T482 PolarHBondContact O-N 3.36Å; R478-T482 PolarHBondContact O-OG1 3.19Å; T482-S484 PolarHBondContact O-N 3.39Å; T482-S484 VanDerWaalsContact O-N 3.08Å; T482-S484 PolarHBondContact OG1-N 2.88Å; T482-V493 HydrophobicContact CG2-CG1 3.84Å; T482-V493 HydrophobicContact CG2-CG2 4.17Å
483	A	82.7	Confident	89.3	Confident	93 Å²	93	49.1 Å²	49.1	77%	0.769	25%	0.252	S	S	*	.	S	Bend	trans	53.6	22	-170.6	0	0	0	0	0	114.4	R479	R479-A483 VanDerWaalsContact O-CA 3.29Å; R479-A483 WeakPolarHBondContact O-CA 3.34Å; R479-A483 PolarHBondContact O-N 3.42Å
484	S	82.2	Confident	89.4	Confident	47 Å²	47	49.1 Å²	49.1	33%	0.329	25%	0.252	S	S	.	.			trans	-122.1	160.5	-178.7	178.5	0	0	0	0	111.6	R478 T482 R486	R478-S484 VanDerWaalsContact CG-O 3.29Å; R478-S484 WeakPolarHBondContact CG-O 3.32Å; T482-S484 PolarHBondContact O-N 3.39Å; T482-S484 VanDerWaalsContact O-N 3.08Å; T482-S484 PolarHBondContact OG1-N 2.88Å; S484-R486 PolarHBondContact OG-N 3.3Å; S484-R486 VanDerWaalsContact OG-N 3.11Å; S484-R486 PolarHBondContact OG-O 3.44Å
485	R	81.6	Confident	89.3	Confident	212 Å²	212	49.5 Å²	49.5	80%	0.8	25%	0.254	S	S	*	.	S	Bend	trans	-93.5	-14.4	170.6	-62.9	-175.9	-176.9	-173.7	0.5	113.1	R478	R478-R485 VanDerWaalsContact CD-C 3.44Å; R478-R485 WeakPolarHBondContact CD-O 3.23Å
486	R	83.6	Confident	89.4	Confident	219 Å²	219	44.8 Å²	44.8	83%	0.826	23%	0.232	S	C	*	.	S	Bend	trans	-133.8	154.2	-177.1	-62.6	-178.4	-178.4	171.8	0.2	110.5	S484	S484-R486 PolarHBondContact OG-N 3.3Å; S484-R486 VanDerWaalsContact OG-N 3.11Å; S484-R486 PolarHBondContact OG-O 3.44Å
487	G	85.1	Confident	89.6	Confident	56 Å²	56	44.5 Å²	44.5	58%	0.577	23%	0.23	S	C	*	.	S	Bend	trans	151.2	-167.4	177	0	0	0	0	0	112.2	R478	R478-G487 PolarHBondContact NH1-O 3.23Å; R478-G487 PolarHBondContact NH2-O 3.05Å
488	L	88.9	Confident	89.5	Confident	42 Å²	42	45.2 Å²	45.2	22%	0.22	24%	0.237	C	C	.	.	S	Bend	trans	-56.8	151.9	179.5	-61.7	178	0	0	0	112.7	Y394 R478 E492 V493 I496	Y394-L488 HydrophobicContact CE1-CD1 4.34Å; Y394-L488 VanDerWaalsContact OH-CD1 3.26Å; Y394-L488 WeakPolarHBondContact OH-CD1 3.44Å; R478-L488 PolarHBondContact NH1-O 2.95Å; R478-L488 PolarHBondContact NH2-O 3.16Å; L488-E492 HydrophobicContact CB-CB 4.46Å; L488-E492 HydrophobicContact CB-CG 4.43Å; L488-E492 HydrophobicContact CD1-CG 4.22Å; L488-V493 HydrophobicContact CB-CG2 4.1Å; L488-I496 HydrophobicContact CD1-CD1 3.66Å
489	P	93.7	Very high	89.6	Confident	69 Å²	69	45.3 Å²	45.3	45%	0.448	24%	0.239	S	C	.	.			trans	-46.7	143.2	169.9	-27.4	35.2	0	0	0	112.6	A491 E492 V493	P489-A491 VanDerWaalsContact C-N 3.32Å; P489-A491 PolarHBondContact O-N 3.26Å; P489-E492 HydrophobicContact CB-CB 4.34Å; P489-E492 WeakPolarHBondContact CD-OE2 3.5Å; P489-E492 WeakPolarHBondContact O-CA 3.39Å; P489-E492 VanDerWaalsContact O-CB 3.28Å; P489-E492 WeakPolarHBondContact O-CB 3.41Å; P489-E492 PolarHBondContact O-N 2.91Å; P489-V493 PolarHBondContact O-N 3.11Å
490	I	95.2	Very high	89.8	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-36.4	-173.4	-63.7	-59.5	0	0	0	112.7	L459 M474 L477 R478 L481 E492 V493 L494	L459-I490 HydrophobicContact CD1-CB 4.31Å; L459-I490 HydrophobicContact CD1-CG2 3.95Å; M474-I490 HydrophobicContact CB-CG1 4.21Å; M474-I490 WeakPolarHBondContact O-CG1 3.45Å; M474-I490 HydrophobicContact SD-CB 3.72Å; M474-I490 HydrophobicContact SD-CG1 4.05Å; M474-I490 HydrophobicContact SD-CG2 4.31Å; L477-I490 HydrophobicContact CB-CG1 4.45Å; L477-I490 HydrophobicContact CB-CG2 3.93Å; L477-I490 HydrophobicContact CD1-CG2 3.98Å; R478-I490 VanDerWaalsContact CA-CD1 3.45Å; R478-I490 HydrophobicContact CB-CD1 3.67Å; R478-I490 HydrophobicContact CG-CD1 4.06Å; L481-I490 HydrophobicContact CD1-CG2 4.12Å; I490-E492 PolarHBondContact O-N 3.32Å; I490-V493 WeakPolarHBondContact O-CB 3.39Å; I490-V493 PolarHBondContact O-N 3.42Å; I490-V493 VanDerWaalsContact O-N 3.16Å; I490-L494 HydrophobicContact CG2-CD1 4.37Å; I490-L494 HydrophobicContact CG2-CG 4.25Å; I490-L494 WeakPolarHBondContact O-CG 3.07Å; I490-L494 PolarHBondContact O-N 2.85Å
491	A	96.4	Very high	89.8	Confident	3 Å²	3	48.8 Å²	48.8	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-57.3	-35.8	173.2	0	0	0	0	0	112.5	K452 L455 T456 L459 P489 E495	K452-A491 HydrophobicContact CG-CB 4.17Å; L455-A491 HydrophobicContact CB-CB 3.96Å; T456-A491 WeakPolarHBondContact OG1-CB 3.3Å; L459-A491 HydrophobicContact CD1-CB 4.13Å; P489-A491 VanDerWaalsContact C-N 3.32Å; P489-A491 PolarHBondContact O-N 3.26Å; A491-E495 WeakPolarHBondContact O-CB 3.42Å; A491-E495 PolarHBondContact O-N 3.49Å
492	E	93.8	Very high	90	Very high	24 Å²	24	48.7 Å²	48.7	11%	0.112	26%	0.262	C	S	.	.	H	α-helix	trans	-74.7	-40	176.9	-170.6	171.8	160.8	0	0	111.6	H393 K452 L488 P489 I490 L494 E495 I496	H393-E492 IonicContact CE1-OE1 2.63Å; H393-E492 PolarHBondContact CE1-OE1 3.05Å; H393-E492 IonicContact NE2-OE1 3.17Å; H393-E492 PolarHBondContact NE2-OE1 3.37Å; K452-E492 HydrophobicContact CD-CB 4.03Å; K452-E492 HydrophobicContact CD-CG 4.3Å; K452-E492 IonicContact NZ-OE2 3.85Å; K452-E492 PolarHBondContact NZ-OE2 3.05Å; L488-E492 HydrophobicContact CB-CB 4.46Å; L488-E492 HydrophobicContact CB-CG 4.43Å; L488-E492 HydrophobicContact CD1-CG 4.22Å; P489-E492 HydrophobicContact CB-CB 4.34Å; P489-E492 WeakPolarHBondContact CD-OE2 3.5Å; P489-E492 WeakPolarHBondContact O-CA 3.39Å; P489-E492 VanDerWaalsContact O-CB 3.28Å; P489-E492 WeakPolarHBondContact O-CB 3.41Å; P489-E492 PolarHBondContact O-N 2.91Å; I490-E492 PolarHBondContact O-N 3.32Å; E492-L494 VanDerWaalsContact C-N 3.34Å; E492-L494 PolarHBondContact O-N 3.4Å; E492-E495 PolarHBondContact O-N 3.33Å; E492-I496 HydrophobicContact CG-CD1 4.31Å; E492-I496 WeakPolarHBondContact O-CD1 3.39Å; E492-I496 VanDerWaalsContact O-CG1 3.23Å; E492-I496 WeakPolarHBondContact O-CG1 3.43Å; E492-I496 PolarHBondContact O-N 2.83Å
493	V	93.7	Very high	90.3	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-47.9	171.4	172.6	0	0	0	0	110.9	F411 L481 T482 L488 P489 I490 I496 L497	F411-V493 HydrophobicContact CE2-CG1 3.97Å; L481-V493 HydrophobicContact CB-CG1 4.19Å; L481-V493 HydrophobicContact CD1-CG1 4.36Å; T482-V493 HydrophobicContact CG2-CG1 3.84Å; T482-V493 HydrophobicContact CG2-CG2 4.17Å; L488-V493 HydrophobicContact CB-CG2 4.1Å; P489-V493 PolarHBondContact O-N 3.11Å; I490-V493 WeakPolarHBondContact O-CB 3.39Å; I490-V493 PolarHBondContact O-N 3.42Å; I490-V493 VanDerWaalsContact O-N 3.16Å; V493-I496 PolarHBondContact O-N 3.42Å; V493-L497 HydrophobicContact CG1-CD1 3.88Å; V493-L497 HydrophobicContact CG1-CG 4.46Å; V493-L497 WeakPolarHBondContact O-CB 3.47Å; V493-L497 VanDerWaalsContact O-CG 3.27Å; V493-L497 WeakPolarHBondContact O-CG 3.45Å; V493-L497 PolarHBondContact O-N 3.38Å
494	L	94.7	Very high	90.6	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.3	-52.8	176.7	-70.5	178.4	0	0	0	109.8	F450 L455 L459 L481 I490 E492 I496 L497 G498 C502	F450-L494 HydrophobicContact CE1-CB 4.29Å; F450-L494 VanDerWaalsContact CE1-O 3.32Å; F450-L494 WeakPolarHBondContact CE1-O 3.36Å; F450-L494 HydrophobicContact CZ-CB 4.27Å; L455-L494 HydrophobicContact CD1-CB 3.97Å; L455-L494 HydrophobicContact CD2-CD1 4.31Å; L459-L494 HydrophobicContact CD1-CD1 3.92Å; L459-L494 HydrophobicContact CD2-CD1 4.04Å; L459-L494 HydrophobicContact CG-CD1 4.23Å; L481-L494 HydrophobicContact CD1-CD2 3.59Å; L481-L494 HydrophobicContact CD1-CG 4.27Å; L481-L494 HydrophobicContact CD2-CD2 4.47Å; I490-L494 HydrophobicContact CG2-CD1 4.37Å; I490-L494 HydrophobicContact CG2-CG 4.25Å; I490-L494 WeakPolarHBondContact O-CG 3.07Å; I490-L494 PolarHBondContact O-N 2.85Å; E492-L494 VanDerWaalsContact C-N 3.34Å; E492-L494 PolarHBondContact O-N 3.4Å; L494-I496 VanDerWaalsContact C-N 3.34Å; L494-I496 PolarHBondContact O-N 3.22Å; L494-L497 PolarHBondContact O-N 3.32Å; L494-L497 VanDerWaalsContact O-N 3.13Å; L494-G498 PolarHBondContact O-N 3.03Å; L494-C502 HydrophobicContact CD2-CB 3.94Å; L494-C502 WeakPolarHBondContact CD2-SG 3.32Å; L494-C502 PolarHBondContact O-SG 3.17Å; L494-C502 VanDerWaalsContact O-SG 3.37Å
495	E	93.9	Very high	90.9	Very high	47 Å²	47	45.9 Å²	45.9	22%	0.22	23%	0.227	C	C	.	.	H	α-helix	trans	-51.8	-50.1	179.3	-177.7	176.8	-115.7	0	0	111.8	K389 Q451 K452 L455 A491 E492 L497 G498	K389-E495 WeakPolarHBondContact CE-O 3.4Å; K389-E495 PolarHBondContact NZ-O 3.44Å; Q451-E495 VanDerWaalsContact CA-OE1 3.32Å; Q451-E495 WeakPolarHBondContact CA-OE1 3.26Å; K452-E495 WeakPolarHBondContact CB-OE2 3.27Å; K452-E495 PolarHBondContact N-OE1 2.95Å; L455-E495 HydrophobicContact CD1-CB 4.06Å; A491-E495 WeakPolarHBondContact O-CB 3.42Å; A491-E495 PolarHBondContact O-N 3.49Å; E492-E495 PolarHBondContact O-N 3.33Å; E495-L497 PolarHBondContact O-N 3.47Å; E495-G498 PolarHBondContact O-N 2.92Å
496	I	92.4	Very high	91.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-46.3	179.2	-63.7	160.4	0	0	0	111.5	F386 V390 H393 Y394 L412 L488 E492 V493 L494 G498	F386-I496 WeakPolarHBondContact CE2-O 3.36Å; V390-I496 HydrophobicContact CG2-CG2 3.85Å; H393-I496 HydrophobicContact CB-CG1 4.32Å; H393-I496 VanDerWaalsContact NE2-CD1 3.35Å; H393-I496 WeakPolarHBondContact NE2-CD1 3.35Å; Y394-I496 HydrophobicContact CE2-CD1 4.32Å; L412-I496 HydrophobicContact CD2-CG2 3.65Å; L488-I496 HydrophobicContact CD1-CD1 3.66Å; E492-I496 HydrophobicContact CG-CD1 4.31Å; E492-I496 WeakPolarHBondContact O-CD1 3.39Å; E492-I496 VanDerWaalsContact O-CG1 3.23Å; E492-I496 WeakPolarHBondContact O-CG1 3.43Å; E492-I496 PolarHBondContact O-N 2.83Å; V493-I496 PolarHBondContact O-N 3.42Å; L494-I496 VanDerWaalsContact C-N 3.34Å; L494-I496 PolarHBondContact O-N 3.22Å; I496-G498 VanDerWaalsContact C-N 3.26Å; I496-G498 PolarHBondContact O-N 2.91Å
497	L	91.8	Very high	91.8	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-35.1	178.6	-69.1	176.7	0	0	0	111.7	F386 L412 L481 V493 L494 E495 N501 C502	F386-L497 HydrophobicContact CE2-CD2 4.16Å; F386-L497 HydrophobicContact CZ-CD2 4.24Å; L412-L497 HydrophobicContact CD2-CD2 4.39Å; L481-L497 HydrophobicContact CD2-CD1 4.44Å; V493-L497 HydrophobicContact CG1-CD1 3.88Å; V493-L497 HydrophobicContact CG1-CG 4.46Å; V493-L497 WeakPolarHBondContact O-CB 3.47Å; V493-L497 VanDerWaalsContact O-CG 3.27Å; V493-L497 WeakPolarHBondContact O-CG 3.45Å; V493-L497 PolarHBondContact O-N 3.38Å; L494-L497 PolarHBondContact O-N 3.32Å; L494-L497 VanDerWaalsContact O-N 3.13Å; E495-L497 PolarHBondContact O-N 3.47Å; L497-N501 HydrophobicContact CB-CB 4.3Å; L497-N501 VanDerWaalsContact O-CB 3.3Å; L497-N501 WeakPolarHBondContact O-CB 3.18Å; L497-N501 PolarHBondContact O-ND2 3.43Å; L497-C502 WeakPolarHBondContact CB-SG 3.21Å
498	G	91	Very high	91.9	Very high	14 Å²	14	30.8 Å²	30.8	14%	0.144	16%	0.156	C	C	.	.	H	α-helix	trans	75.2	160.6	-172.7	0	0	0	0	0	112.3	L494 E495 I496 N500 N501 C502	L494-G498 PolarHBondContact O-N 3.03Å; E495-G498 PolarHBondContact O-N 2.92Å; I496-G498 VanDerWaalsContact C-N 3.26Å; I496-G498 PolarHBondContact O-N 2.91Å; G498-N500 PolarHBondContact O-N 3.42Å; G498-N501 PolarHBondContact O-N 3.15Å; G498-C502 WeakPolarHBondContact O-CB 3.27Å; G498-C502 PolarHBondContact O-N 2.63Å; G498-C502 PolarHBondContact O-SG 3.2Å
499	K	92.5	Very high	91.9	Very high	33 Å²	33	28.8 Å²	28.8	14%	0.143	15%	0.146	C	C	.	.	H	α-helix	trans	-52.1	-53.3	-171.2	-173.4	-178.7	172	170.4	0	113.4	L442 E443 L445 D447 F450 N501 C502 L503	L442-K499 WeakPolarHBondContact O-CE 3.49Å; L442-K499 PolarHBondContact O-NZ 3.38Å; E443-K499 PolarHBondContact O-NZ 3.19Å; L445-K499 PolarHBondContact O-NZ 3.39Å; D447-K499 WeakPolarHBondContact OD1-CD 3.27Å; F450-K499 HydrophobicContact CD2-CB 3.59Å; F450-K499 HydrophobicContact CD2-CD 4.4Å; F450-K499 HydrophobicContact CD2-CG 3.97Å; F450-K499 HydrophobicContact CE2-CB 3.59Å; F450-K499 HydrophobicContact CE2-CG 3.84Å; F450-K499 HydrophobicContact CG-CB 4.11Å; F450-K499 HydrophobicContact CZ-CB 4.13Å; K499-N501 PolarHBondContact O-N 2.72Å; K499-C502 WeakPolarHBondContact O-CB 3.17Å; K499-C502 PolarHBondContact O-N 3.23Å; K499-L503 HydrophobicContact CG-CG 4.42Å; K499-L503 HydrophobicContact CG-CD1 3.88Å; K499-L503 PolarHBondContact O-N 3.4Å; K499-L503 WeakPolarHBondContact O-CG 3.45Å
500	N	89.4	Confident	91.7	Very high	117 Å²	117	29 Å²	29	63%	0.626	14%	0.138	S	C	*	.	H	α-helix	trans	-62.3	-47.8	-174.4	-67.9	-22	0	0	0	112.5	G498 C502 L503 Q504	G498-N500 PolarHBondContact O-N 3.42Å; N500-C502 VanDerWaalsContact C-N 3.33Å; N500-C502 PolarHBondContact O-N 3.45Å; N500-L503 PolarHBondContact O-N 3.36Å; N500-Q504 WeakPolarHBondContact O-CB 3.35Å; N500-Q504 PolarHBondContact O-N 2.97Å
501	N	88.1	Confident	91.4	Very high	23 Å²	23	33.3 Å²	33.3	12%	0.123	16%	0.161	C	C	.	.	H	α-helix	trans	-64.6	-39.3	177	-68.5	-52.2	0	0	0	111.4	F386 L497 G498 K499 Q504 R505	F386-N501 WeakPolarHBondContact CD2-ND2 3.29Å; L497-N501 HydrophobicContact CB-CB 4.3Å; L497-N501 VanDerWaalsContact O-CB 3.3Å; L497-N501 WeakPolarHBondContact O-CB 3.18Å; L497-N501 PolarHBondContact O-ND2 3.43Å; G498-N501 PolarHBondContact O-N 3.15Å; K499-N501 PolarHBondContact O-N 2.72Å; N501-Q504 PolarHBondContact O-N 3.34Å; N501-R505 WeakPolarHBondContact O-CB 3.33Å; N501-R505 WeakPolarHBondContact O-CG 3.4Å; N501-R505 PolarHBondContact O-N 3.01Å
502	C	92.1	Very high	90.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-52.8	175.8	-68.2	0	0	0	0	111.2	L442 F450 L494 L497 G498 K499 N500 Q504 R505 L506	L442-C502 HydrophobicContact CD1-CB 4.49Å; F450-C502 HydrophobicContact CZ-CB 4.43Å; L494-C502 HydrophobicContact CD2-CB 3.94Å; L494-C502 WeakPolarHBondContact CD2-SG 3.32Å; L494-C502 PolarHBondContact O-SG 3.17Å; L494-C502 VanDerWaalsContact O-SG 3.37Å; L497-C502 WeakPolarHBondContact CB-SG 3.21Å; G498-C502 WeakPolarHBondContact O-CB 3.27Å; G498-C502 PolarHBondContact O-N 2.63Å; G498-C502 PolarHBondContact O-SG 3.2Å; K499-C502 WeakPolarHBondContact O-CB 3.17Å; K499-C502 PolarHBondContact O-N 3.23Å; N500-C502 VanDerWaalsContact C-N 3.33Å; N500-C502 PolarHBondContact O-N 3.45Å; C502-Q504 VanDerWaalsContact C-N 3.32Å; C502-Q504 PolarHBondContact O-N 3.21Å; C502-R505 PolarHBondContact O-N 3.34Å; C502-L506 VanDerWaalsContact O-CG 3.23Å; C502-L506 PolarHBondContact O-N 3.43Å; C502-L506 WeakPolarHBondContact O-CG 3.47Å; C502-L506 WeakPolarHBondContact O-CB 3.29Å
503	L	93.2	Very high	90.2	Very high	10 Å²	10	34.4 Å²	34.4	5%	0.052	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-43.7	179.6	-71.7	173.9	0	0	0	111.6	I439 L442 E443 K499 N500 L506 R507	I439-L503 HydrophobicContact CB-CD2 4.47Å; I439-L503 HydrophobicContact CG2-CD2 4.14Å; L442-L503 HydrophobicContact CB-CD2 3.88Å; E443-L503 HydrophobicContact CG-CD1 3.95Å; E443-L503 HydrophobicContact CG-CD2 3.95Å; K499-L503 HydrophobicContact CG-CG 4.42Å; K499-L503 HydrophobicContact CG-CD1 3.88Å; K499-L503 PolarHBondContact O-N 3.4Å; K499-L503 WeakPolarHBondContact O-CG 3.45Å; N500-L503 PolarHBondContact O-N 3.36Å; L503-L506 PolarHBondContact O-N 2.89Å; L503-R507 WeakPolarHBondContact O-CB 3.36Å; L503-R507 WeakPolarHBondContact O-CG 3.49Å; L503-R507 PolarHBondContact O-N 3.19Å
504	Q	89	Confident	89.7	Confident	84 Å²	84	37.1 Å²	37.1	39%	0.393	19%	0.192	S	C	.	.	H	α-helix	trans	-60.9	-47	177.1	-171.1	-177.4	-3.6	0	0	111.7	M415 N500 N501 C502 R507 I508	M415-Q504 HydrophobicContact CE-CB 4.15Å; M415-Q504 HydrophobicContact CE-CG 3.67Å; N500-Q504 WeakPolarHBondContact O-CB 3.35Å; N500-Q504 PolarHBondContact O-N 2.97Å; N501-Q504 PolarHBondContact O-N 3.34Å; C502-Q504 VanDerWaalsContact C-N 3.32Å; C502-Q504 PolarHBondContact O-N 3.21Å; Q504-R507 PolarHBondContact O-N 2.9Å; Q504-I508 HydrophobicContact CG-CD1 4.11Å; Q504-I508 VanDerWaalsContact O-CG1 3.32Å; Q504-I508 WeakPolarHBondContact O-CG1 3.34Å; Q504-I508 PolarHBondContact O-N 3.04Å
505	R	89.3	Confident	88.9	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-46.8	177.5	-71.6	179.3	-178.5	-147.3	-0.5	111.9	F411 L412 K414 M415 P416 L481 N501 C502 I508 V509	F411-R505 VanDerWaalsContact O-CZ 3.29Å; F411-R505 PolarHBondContact O-NH1 3.01Å; F411-R505 PolarHBondContact O-NH2 3.34Å; L412-R505 PolarHBondContact O-NH2 3.21Å; K414-R505 PolarHBondContact O-NH2 3.04Å; M415-R505 HydrophobicContact CE-CB 4.36Å; M415-R505 HydrophobicContact CE-CG 3.49Å; M415-R505 VanDerWaalsContact CE-CG 3.49Å; M415-R505 HydrophobicContact SD-CG 3.77Å; P416-R505 HydrophobicContact CG-CB 3.91Å; P416-R505 HydrophobicContact CG-CG 4.05Å; L481-R505 HydrophobicContact CD2-CB 4.31Å; L481-R505 PolarHBondContact O-NH1 3.05Å; L481-R505 VanDerWaalsContact O-NH1 3.11Å; N501-R505 WeakPolarHBondContact O-CB 3.33Å; N501-R505 WeakPolarHBondContact O-CG 3.4Å; N501-R505 PolarHBondContact O-N 3.01Å; C502-R505 PolarHBondContact O-N 3.34Å; R505-I508 PolarHBondContact O-N 3.17Å; R505-V509 VanDerWaalsContact O-N 3.11Å; R505-V509 PolarHBondContact O-N 2.63Å; R505-V509 WeakPolarHBondContact O-CG2 3.4Å
506	L	92.3	Very high	87.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-45	179.2	-68.5	170.5	0	0	0	111.2	L435 L438 I439 L442 L477 V480 L481 C502 L503 V509 R510	L435-L506 HydrophobicContact CD2-CD2 3.65Å; L438-L506 HydrophobicContact CD2-CD1 3.83Å; L438-L506 HydrophobicContact CD2-CD2 4.08Å; L438-L506 HydrophobicContact CG-CD1 4.06Å; I439-L506 HydrophobicContact CD1-CB 4.06Å; I439-L506 HydrophobicContact CG1-CB 3.83Å; I439-L506 HydrophobicContact CG1-CD1 4.24Å; L442-L506 HydrophobicContact CD1-CD1 3.68Å; L477-L506 HydrophobicContact CD2-CD2 4.28Å; V480-L506 HydrophobicContact CG1-CD2 3.98Å; L481-L506 HydrophobicContact CD2-CD2 4.11Å; L481-L506 HydrophobicContact CD2-CG 4.35Å; C502-L506 VanDerWaalsContact O-CG 3.23Å; C502-L506 PolarHBondContact O-N 3.43Å; C502-L506 WeakPolarHBondContact O-CG 3.47Å; C502-L506 WeakPolarHBondContact O-CB 3.29Å; L503-L506 PolarHBondContact O-N 2.89Å; L506-V509 PolarHBondContact O-N 2.94Å; L506-R510 WeakPolarHBondContact O-CB 3.45Å; L506-R510 PolarHBondContact O-N 3.4Å
507	R	91.8	Very high	87.5	Confident	111 Å²	111	49.4 Å²	49.4	42%	0.419	26%	0.259	S	S	.	.	H	α-helix	trans	-63.8	-41.9	178.3	-72.5	170.1	-175.8	162.6	-2.2	112.7	I439 E443 L503 Q504 R510 N511	I439-R507 HydrophobicContact CD1-CG 3.97Å; E443-R507 IonicContact OE1-CZ 2.74Å; E443-R507 IonicContact OE1-NE 2.92Å; E443-R507 IonicContact OE1-NH2 3.54Å; E443-R507 PolarHBondContact OE1-NH2 3.37Å; L503-R507 WeakPolarHBondContact O-CB 3.36Å; L503-R507 WeakPolarHBondContact O-CG 3.49Å; L503-R507 PolarHBondContact O-N 3.19Å; Q504-R507 PolarHBondContact O-N 2.9Å; R507-R510 PolarHBondContact O-N 3.45Å; R507-N511 WeakPolarHBondContact O-CB 3.39Å; R507-N511 PolarHBondContact O-N 3.21Å; R507-N511 PolarHBondContact O-ND2 3.48Å
508	I	87.6	Confident	87.3	Confident	59 Å²	59	51.9 Å²	51.9	30%	0.303	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-51.4	175.4	-72.7	165.7	0	0	0	110	M415 Q504 R505 R510 N511 C512	M415-I508 HydrophobicContact CE-CD1 3.5Å; M415-I508 VanDerWaalsContact CE-CD1 3.5Å; Q504-I508 HydrophobicContact CG-CD1 4.11Å; Q504-I508 VanDerWaalsContact O-CG1 3.32Å; Q504-I508 WeakPolarHBondContact O-CG1 3.34Å; Q504-I508 PolarHBondContact O-N 3.04Å; R505-I508 PolarHBondContact O-N 3.17Å; I508-R510 PolarHBondContact O-N 3.29Å; I508-N511 PolarHBondContact O-N 3.01Å; I508-C512 PolarHBondContact O-N 3.03Å; I508-C512 PolarHBondContact O-SG 3.39Å
509	V	87.8	Confident	87.1	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-65.2	-43.2	-178.9	174.2	0	0	0	0	111.7	P416 V418 L420 L435 V480 R505 L506 N511 C512 I513	P416-V509 HydrophobicContact CB-CG2 3.86Å; P416-V509 HydrophobicContact CG-CG2 3.68Å; V418-V509 HydrophobicContact CG2-CB 4.28Å; V418-V509 HydrophobicContact CG2-CG1 3.84Å; V418-V509 HydrophobicContact CG2-CG2 3.62Å; L420-V509 HydrophobicContact CD1-CG1 4.47Å; L435-V509 HydrophobicContact CD1-CG1 4.2Å; V480-V509 HydrophobicContact CG1-CB 4.01Å; V480-V509 HydrophobicContact CG1-CG1 3.93Å; V480-V509 HydrophobicContact CG1-CG2 4Å; V480-V509 HydrophobicContact CG2-CG1 4.13Å; R505-V509 VanDerWaalsContact O-N 3.11Å; R505-V509 PolarHBondContact O-N 2.63Å; R505-V509 WeakPolarHBondContact O-CG2 3.4Å; L506-V509 PolarHBondContact O-N 2.94Å; V509-N511 VanDerWaalsContact C-N 3.32Å; V509-N511 PolarHBondContact O-N 3.31Å; V509-C512 PolarHBondContact O-N 3.46Å; V509-I513 HydrophobicContact CG1-CD1 3.68Å; V509-I513 PolarHBondContact O-N 3.5Å; V509-I513 WeakPolarHBondContact O-CG1 3.36Å; V509-I513 HydrophobicContact CG1-CG1 4.23Å
510	R	90.4	Very high	86.7	Confident	73 Å²	73	55.3 Å²	55.3	28%	0.275	29%	0.288	S	S	.	.	H	α-helix	trans	-55.2	-46.5	175.3	-177.8	-126.3	-176.1	-119.8	-4.6	111.6	V432 L435 D436 I439 L506 R507 I508 I513 A514	V432-R510 HydrophobicContact CG1-CG 4.18Å; L435-R510 HydrophobicContact CB-CB 4.18Å; L435-R510 HydrophobicContact CB-CG 4.22Å; L435-R510 HydrophobicContact CD1-CB 3.87Å; L435-R510 HydrophobicContact CD1-CG 4.48Å; D436-R510 IonicContact OD1-CZ 3.69Å; D436-R510 VanDerWaalsContact OD1-CZ 3.31Å; D436-R510 IonicContact OD1-NE 3.58Å; D436-R510 PolarHBondContact OD1-NE 2.96Å; D436-R510 IonicContact OD1-NH2 2.89Å; D436-R510 PolarHBondContact OD1-NH2 3.08Å; D436-R510 IonicContact OD2-CZ 2.89Å; D436-R510 IonicContact OD2-NE 3.65Å; D436-R510 IonicContact OD2-NH2 2.69Å; D436-R510 PolarHBondContact OD2-NH2 2.99Å; I439-R510 HydrophobicContact CD1-CB 4.47Å; L506-R510 WeakPolarHBondContact O-CB 3.45Å; L506-R510 PolarHBondContact O-N 3.4Å; R507-R510 PolarHBondContact O-N 3.45Å; I508-R510 PolarHBondContact O-N 3.29Å; R510-I513 PolarHBondContact O-N 3.47Å; R510-A514 WeakPolarHBondContact O-CB 3.32Å; R510-A514 PolarHBondContact O-N 3.29Å
511	N	87.9	Confident	86.6	Confident	94 Å²	94	51.4 Å²	51.4	50%	0.503	27%	0.267	S	S	.	.	H	α-helix	trans	-65.8	-41	177.8	-69.9	-12	0	0	0	112	R507 I508 V509 I513 A514 S515	R507-N511 WeakPolarHBondContact O-CB 3.39Å; R507-N511 PolarHBondContact O-N 3.21Å; R507-N511 PolarHBondContact O-ND2 3.48Å; I508-N511 PolarHBondContact O-N 3.01Å; V509-N511 VanDerWaalsContact C-N 3.32Å; V509-N511 PolarHBondContact O-N 3.31Å; N511-I513 VanDerWaalsContact C-N 3.35Å; N511-I513 PolarHBondContact O-N 2.92Å; N511-A514 PolarHBondContact O-N 2.89Å; N511-S515 WeakPolarHBondContact O-CB 3.43Å; N511-S515 PolarHBondContact O-N 3.18Å; N511-S515 PolarHBondContact O-OG 3.02Å
512	C	82.9	Confident	86.5	Confident	43 Å²	43	53.3 Å²	53.3	29%	0.291	28%	0.276	S	S	.	.	H	α-helix	trans	-63.9	-36.9	175.7	-68.6	0	0	0	0	113.1	I508 V509 S515	I508-C512 PolarHBondContact O-N 3.03Å; I508-C512 PolarHBondContact O-SG 3.39Å; V509-C512 PolarHBondContact O-N 3.46Å; C512-S515 PolarHBondContact O-OG 2.89Å
513	I	82.7	Confident	86.1	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.041	30%	0.296	C	S	.	.	H	α-helix	trans	-72.2	-44.2	176.4	-64.2	167.5	0	0	0	110	L420 P428 E431 V432 L435 V509 R510 N511 S515 K516	L420-I513 HydrophobicContact CD1-CD1 3.85Å; L420-I513 HydrophobicContact CD1-CG1 4.27Å; P428-I513 HydrophobicContact CB-CG2 4.11Å; E431-I513 HydrophobicContact CB-CD1 4.23Å; E431-I513 HydrophobicContact CB-CG2 4.47Å; V432-I513 HydrophobicContact CG2-CB 4.15Å; V432-I513 HydrophobicContact CG2-CG2 3.64Å; L435-I513 HydrophobicContact CD1-CD1 3.86Å; V509-I513 HydrophobicContact CG1-CD1 3.68Å; V509-I513 PolarHBondContact O-N 3.5Å; V509-I513 WeakPolarHBondContact O-CG1 3.36Å; V509-I513 HydrophobicContact CG1-CG1 4.23Å; R510-I513 PolarHBondContact O-N 3.47Å; N511-I513 VanDerWaalsContact C-N 3.35Å; N511-I513 PolarHBondContact O-N 2.92Å; I513-S515 PolarHBondContact O-N 3.41Å; I513-K516 PolarHBondContact O-N 3.17Å
514	A	83.5	Confident	85.5	Confident	57 Å²	57	60.8 Å²	60.8	47%	0.471	32%	0.315	S	S	.	.	H	α-helix	trans	-66.3	-23	179.9	0	0	0	0	0	113.7	V432 R510 N511	V432-A514 HydrophobicContact CG2-CB 4.2Å; R510-A514 WeakPolarHBondContact O-CB 3.32Å; R510-A514 PolarHBondContact O-N 3.29Å; N511-A514 PolarHBondContact O-N 2.89Å
515	S	78	Confident	85.2	Confident	98 Å²	98	58.8 Å²	58.8	69%	0.685	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-8.7	175.7	62	0	0	0	0	114.8	N511 C512 I513	N511-S515 WeakPolarHBondContact O-CB 3.43Å; N511-S515 PolarHBondContact O-N 3.18Å; N511-S515 PolarHBondContact O-OG 3.02Å; C512-S515 PolarHBondContact O-OG 2.89Å; I513-S515 PolarHBondContact O-N 3.41Å
516	K	68.8	Low	84.9	Confident	160 Å²	160	64 Å²	64	70%	0.696	34%	0.335	S	S	*	.			trans	-100.5	0	176.6	-70.6	-178.2	-178.8	-174.1	0	110	I513	I513-K516 PolarHBondContact O-N 3.17Å

Retrieved 516 of 516 residues in 1160 ms (Link to these results)

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