A0A024R6U7_HUMAN Loading...

Adhesion G-protein coupled receptor G1

AlphaFold DB (Q9Y653), UniProt , Accession A0A024R6U7, Species HUMAN (Homo sapiens, Human), Gene GPR56, Length 693 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	43.2	Very low	57.6	Low	231 Å²	231	116.7 Å²	116.7	100%	1.138	63%	0.631	S	S	*	*				0	117.7	0	-74.6	170.5	175.7	0	0	106.9
2	T	46.1	Very low	57.8	Low	98 Å²	98	119.3 Å²	119.3	60%	0.601	63%	0.632	S	S	*	*			trans	-69.2	150	-170.9	39.1	0	0	0	0	111.7	Q4 S5	T2-Q4 PolarHBondContact O-N 3.13Å; T2-S5 PolarHBondContact O-N 3.47Å; T2-S5 VanDerWaalsContact O-N 3.13Å
3	P	51.5	Low	57.8	Low	110 Å²	110	118.8 Å²	118.8	71%	0.714	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-13.5	-172.1	21.8	-33.1	0	0	0	115.1	S5 L6	P3-S5 VanDerWaalsContact C-N 3.32Å; P3-S5 PolarHBondContact O-N 3.05Å; P3-L6 PolarHBondContact O-N 2.85Å
4	Q	57.7	Low	57.5	Low	154 Å²	154	116.7 Å²	116.7	72%	0.72	62%	0.618	S	S	*	*	H	α-helix	trans	-64.7	-30.2	174.4	-82.8	174.5	-36.2	0	0	113.5	T2 L6 L7 Q8	T2-Q4 PolarHBondContact O-N 3.13Å; Q4-L6 VanDerWaalsContact C-N 3.33Å; Q4-L6 PolarHBondContact O-N 3.16Å; Q4-L7 PolarHBondContact O-N 3.26Å; Q4-Q8 PolarHBondContact O-N 2.8Å
5	S	57.4	Low	57	Low	57 Å²	57	112.3 Å²	112.3	40%	0.399	60%	0.6	S	S	.	*	H	α-helix	trans	-72.4	-27.2	-179.3	79.3	0	0	0	0	113.1	T2 P3 T9	T2-S5 PolarHBondContact O-N 3.47Å; T2-S5 VanDerWaalsContact O-N 3.13Å; P3-S5 VanDerWaalsContact C-N 3.32Å; P3-S5 PolarHBondContact O-N 3.05Å; S5-T9 PolarHBondContact O-N 3.41Å; S5-T9 PolarHBondContact O-OG1 3.23Å
6	L	57.1	Low	56.4	Low	121 Å²	121	111.7 Å²	111.7	63%	0.634	60%	0.596	S	S	*	*	H	α-helix	trans	-74.8	-33.4	177.2	-103.7	140.5	0	0	0	112.2	P3 Q4 T9 T10	P3-L6 PolarHBondContact O-N 2.85Å; Q4-L6 VanDerWaalsContact C-N 3.33Å; Q4-L6 PolarHBondContact O-N 3.16Å; L6-T9 WeakPolarHBondContact CA-OG1 3.29Å; L6-T9 PolarHBondContact O-OG1 3.25Å; L6-T10 WeakPolarHBondContact O-CG2 3.45Å; L6-T10 PolarHBondContact O-N 3.07Å; L6-T10 VanDerWaalsContact O-N 3.12Å; L6-T10 PolarHBondContact O-OG1 3.02Å
7	L	66.3	Low	55.7	Low	117 Å²	117	111.7 Å²	111.7	61%	0.613	60%	0.595	S	S	*	*	H	α-helix	trans	-72.4	-37.4	176.2	-158.3	77.3	0	0	0	111.7	Q4 T10 L11	Q4-L7 PolarHBondContact O-N 3.26Å; L7-T10 VanDerWaalsContact CA-OG1 3.32Å; L7-T10 WeakPolarHBondContact CA-OG1 3.45Å; L7-T10 PolarHBondContact O-OG1 3.13Å; L7-L11 HydrophobicContact CG-CD1 4.28Å; L7-L11 WeakPolarHBondContact O-CB 3.5Å; L7-L11 PolarHBondContact O-N 3.05Å
8	Q	61.7	Low	54.7	Low	143 Å²	143	113.4 Å²	113.4	67%	0.668	60%	0.597	S	S	*	*	H	α-helix	trans	-70	-37.5	177.9	-116.7	170.4	-23.3	0	0	112.7	Q4 F12	Q4-Q8 PolarHBondContact O-N 2.8Å; Q8-F12 PolarHBondContact O-N 3.24Å
9	T	65	Low	53.7	Low	79 Å²	79	114.9 Å²	114.9	49%	0.485	61%	0.605	S	S	.	*	H	α-helix	trans	-69.4	-38.5	174.8	30.7	0	0	0	0	112.1	S5 L6 F12 L13	S5-T9 PolarHBondContact O-N 3.41Å; S5-T9 PolarHBondContact O-OG1 3.23Å; L6-T9 WeakPolarHBondContact CA-OG1 3.29Å; L6-T9 PolarHBondContact O-OG1 3.25Å; T9-F12 PolarHBondContact O-N 3.16Å; T9-L13 WeakPolarHBondContact O-CB 3.31Å; T9-L13 PolarHBondContact O-N 2.96Å
10	T	62.1	Low	52.7	Low	63 Å²	63	113.4 Å²	113.4	39%	0.387	60%	0.6	S	S	.	*	H	α-helix	trans	-67.2	-39.1	175	45	0	0	0	0	112.6	L6 L7 L13 L14	L6-T10 WeakPolarHBondContact O-CG2 3.45Å; L6-T10 PolarHBondContact O-N 3.07Å; L6-T10 VanDerWaalsContact O-N 3.12Å; L6-T10 PolarHBondContact O-OG1 3.02Å; L7-T10 VanDerWaalsContact CA-OG1 3.32Å; L7-T10 WeakPolarHBondContact CA-OG1 3.45Å; L7-T10 PolarHBondContact O-OG1 3.13Å; T10-L13 PolarHBondContact O-N 3.07Å; T10-L14 WeakPolarHBondContact O-CB 3.41Å; T10-L14 PolarHBondContact O-N 3.49Å
11	L	65.9	Low	51.5	Low	111 Å²	111	115.5 Å²	115.5	58%	0.581	61%	0.606	S	S	*	*	H	α-helix	trans	-64.9	-36.9	173	-92	149.4	0	0	0	113	L7 L14 S15	L7-L11 HydrophobicContact CG-CD1 4.28Å; L7-L11 WeakPolarHBondContact O-CB 3.5Å; L7-L11 PolarHBondContact O-N 3.05Å; L11-L14 PolarHBondContact O-N 3.19Å; L11-S15 PolarHBondContact O-N 3.01Å
12	F	59.6	Low	50.7	Low	148 Å²	148	108 Å²	108	65%	0.649	59%	0.589	S	S	*	*	H	α-helix	trans	-69.9	-36.7	174.6	-117.7	-84.8	0	0	0	112.7	Q8 T9 S15 L16	Q8-F12 PolarHBondContact O-N 3.24Å; T9-F12 PolarHBondContact O-N 3.16Å; F12-S15 PolarHBondContact O-N 2.74Å; F12-S15 PolarHBondContact O-OG 3.23Å; F12-S15 VanDerWaalsContact O-OG 3.07Å; F12-L16 HydrophobicContact CD1-CD1 4.48Å; F12-L16 PolarHBondContact O-N 3.31Å; F12-L16 VanDerWaalsContact O-N 3.08Å
13	L	58.3	Low	49.8	Very low	113 Å²	113	107.4 Å²	107.4	59%	0.592	59%	0.593	S	S	*	*	H	α-helix	trans	-67.1	-38.4	173.3	-91.4	147.1	0	0	0	111.9	T9 T10 L16 L17	T9-L13 WeakPolarHBondContact O-CB 3.31Å; T9-L13 PolarHBondContact O-N 2.96Å; T10-L13 PolarHBondContact O-N 3.07Å; L13-L16 PolarHBondContact O-N 3.05Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 WeakPolarHBondContact O-CG 3.42Å; L13-L17 PolarHBondContact O-N 3.01Å
14	L	53.9	Low	48.5	Very low	89 Å²	89	110.2 Å²	110.2	47%	0.466	60%	0.597	S	S	.	*	H	α-helix	trans	-67.4	-39.2	174.1	-92.9	145.4	0	0	0	112.3	T10 L11 L16 L17 F18	T10-L14 WeakPolarHBondContact O-CB 3.41Å; T10-L14 PolarHBondContact O-N 3.49Å; L11-L14 PolarHBondContact O-N 3.19Å; L14-L16 VanDerWaalsContact C-N 3.35Å; L14-L17 PolarHBondContact O-N 3.43Å; L14-F18 HydrophobicContact CD2-CD2 4.48Å; L14-F18 HydrophobicContact CD2-CE2 3.88Å; L14-F18 WeakPolarHBondContact O-CD2 3.36Å; L14-F18 PolarHBondContact O-N 3.27Å
15	S	50	Low	46.9	Very low	50 Å²	50	106.2 Å²	106.2	35%	0.35	60%	0.597	S	S	.	*	H	α-helix	trans	-67.6	-35.1	175.7	78.8	0	0	0	0	112.3	L11 F12 F18 L19	L11-S15 PolarHBondContact O-N 3.01Å; F12-S15 PolarHBondContact O-N 2.74Å; F12-S15 PolarHBondContact O-OG 3.23Å; F12-S15 VanDerWaalsContact O-OG 3.07Å; S15-F18 PolarHBondContact O-N 2.93Å; S15-L19 WeakPolarHBondContact O-CB 3.48Å; S15-L19 WeakPolarHBondContact O-CG 3.19Å; S15-L19 PolarHBondContact O-N 3.33Å
16	L	46.7	Very low	45.7	Very low	103 Å²	103	111.5 Å²	111.5	54%	0.539	61%	0.608	S	S	.	*	H	α-helix	trans	-65.4	-40.4	170.2	-107.7	105	0	0	0	112	F12 L13 L14 F18 L19 V20	F12-L16 HydrophobicContact CD1-CD1 4.48Å; F12-L16 PolarHBondContact O-N 3.31Å; F12-L16 VanDerWaalsContact O-N 3.08Å; L13-L16 PolarHBondContact O-N 3.05Å; L14-L16 VanDerWaalsContact C-N 3.35Å; L16-F18 VanDerWaalsContact C-N 3.33Å; L16-F18 PolarHBondContact O-N 3.26Å; L16-L19 PolarHBondContact O-N 3.06Å; L16-V20 VanDerWaalsContact O-CG2 3.24Å; L16-V20 WeakPolarHBondContact O-CG2 3.41Å; L16-V20 PolarHBondContact O-N 2.73Å
17	L	44	Very low	44.9	Very low	112 Å²	112	109.1 Å²	109.1	59%	0.586	61%	0.612	S	S	*	*	H	α-helix	trans	-63.3	-38	175.6	-81.4	157.9	0	0	0	112	L13 L14 Q21	L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 WeakPolarHBondContact O-CG 3.42Å; L13-L17 PolarHBondContact O-N 3.01Å; L14-L17 PolarHBondContact O-N 3.43Å; L17-Q21 PolarHBondContact O-N 2.74Å
18	F	38.7	Very low	44.3	Very low	143 Å²	143	109.3 Å²	109.3	63%	0.627	61%	0.61	S	S	*	*	H	α-helix	trans	-75.8	-28.8	175.8	-79.1	-66.9	0	0	0	113.8	L14 S15 L16 V20	L14-F18 HydrophobicContact CD2-CD2 4.48Å; L14-F18 HydrophobicContact CD2-CE2 3.88Å; L14-F18 WeakPolarHBondContact O-CD2 3.36Å; L14-F18 PolarHBondContact O-N 3.27Å; S15-F18 PolarHBondContact O-N 2.93Å; L16-F18 VanDerWaalsContact C-N 3.33Å; L16-F18 PolarHBondContact O-N 3.26Å; F18-V20 VanDerWaalsContact C-N 3.33Å
19	L	35.5	Very low	44.5	Very low	142 Å²	142	105.7 Å²	105.7	74%	0.743	59%	0.59	S	S	*	*	H	α-helix	trans	-74.3	-22.7	173.2	-82.6	158.7	0	0	0	112.9	S15 L16	S15-L19 WeakPolarHBondContact O-CB 3.48Å; S15-L19 WeakPolarHBondContact O-CG 3.19Å; S15-L19 PolarHBondContact O-N 3.33Å; L16-L19 PolarHBondContact O-N 3.06Å
20	V	32.9	Very low	45.3	Very low	84 Å²	84	104.7 Å²	104.7	51%	0.509	58%	0.58	S	S	.	*	H	α-helix	trans	-88.2	-16	179.6	174.3	0	0	0	0	113.1	L16 F18 G22 A23	L16-V20 VanDerWaalsContact O-CG2 3.24Å; L16-V20 WeakPolarHBondContact O-CG2 3.41Å; L16-V20 PolarHBondContact O-N 2.73Å; F18-V20 VanDerWaalsContact C-N 3.33Å; V20-G22 PolarHBondContact O-N 2.86Å; V20-G22 VanDerWaalsContact O-N 3.1Å; V20-A23 PolarHBondContact O-N 3.5Å
21	Q	27.2	Very low	46.4	Very low	157 Å²	157	102 Å²	102	73%	0.734	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	2.1	175.7	-75.6	-166.3	-37.1	0	0	114.8	L17	L17-Q21 PolarHBondContact O-N 2.74Å
22	G	27.7	Very low	47.6	Very low	74 Å²	74	96.8 Å²	96.8	76%	0.763	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-7.5	174.5	0	0	0	0	0	116.3	V20	V20-G22 PolarHBondContact O-N 2.86Å; V20-G22 VanDerWaalsContact O-N 3.1Å
23	A	27.3	Very low	49.2	Very low	85 Å²	85	92.8 Å²	92.8	70%	0.702	52%	0.516	S	S	*	.	S	Bend	trans	-130.3	9.7	-168.3	0	0	0	0	0	116.2	V20 G25	V20-A23 PolarHBondContact O-N 3.5Å; A23-G25 VanDerWaalsContact C-N 3.29Å; A23-G25 PolarHBondContact O-N 3.09Å
24	H	23.1	Very low	50.9	Low	170 Å²	170	87.4 Å²	87.4	79%	0.787	49%	0.488	S	S	*	.			trans	-97	46.1	168.4	-88.7	51.1	0	0	0	111.7	R26	H24-R26 VanDerWaalsContact C-N 3.27Å; H24-R26 PolarHBondContact O-N 3.14Å
25	G	25.6	Very low	52.9	Low	70 Å²	70	83.7 Å²	83.7	72%	0.722	47%	0.47	S	S	*	.			trans	-65.8	93.8	161.2	0	0	0	0	0	108.1	A23 G27	A23-G25 VanDerWaalsContact C-N 3.29Å; A23-G25 PolarHBondContact O-N 3.09Å; G25-G27 VanDerWaalsContact C-N 3.27Å; G25-G27 PolarHBondContact O-N 3.29Å
26	R	31.1	Very low	55	Low	168 Å²	168	81.3 Å²	81.3	63%	0.634	45%	0.453	S	S	*	.			trans	-48.5	98	161.5	-168.7	179.8	-161	-149.3	-4.1	106.1	H24 H28 E257	H24-R26 VanDerWaalsContact C-N 3.27Å; H24-R26 PolarHBondContact O-N 3.14Å; R26-H28 PolarHBondContact O-N 3.31Å; R26-E257 IonicContact CZ-OE1 3.09Å; R26-E257 IonicContact NH2-OE1 3.51Å; R26-E257 PolarHBondContact NH2-OE1 2.98Å
27	G	41	Very low	57.2	Low	70 Å²	70	79.4 Å²	79.4	72%	0.722	44%	0.441	S	S	*	.			trans	-63.5	100.1	-174.4	0	0	0	0	0	108.4	G25 R29	G25-G27 VanDerWaalsContact C-N 3.27Å; G25-G27 PolarHBondContact O-N 3.29Å; G27-R29 PolarHBondContact O-N 2.78Å
28	H	52.3	Low	59.6	Low	121 Å²	121	74.1 Å²	74.1	56%	0.56	41%	0.414	S	S	*	.			trans	-61.1	137.2	173.2	-76.6	-69.1	0	0	0	108	R26 E30	R26-H28 PolarHBondContact O-N 3.31Å; H28-E30 WeakPolarHBondContact O-CG 3.36Å; H28-E30 PolarHBondContact O-N 3.37Å
29	R	67.3	Low	62.1	Low	68 Å²	68	71.7 Å²	71.7	26%	0.257	41%	0.407	S	S	.	.			trans	-64.4	105.5	175	-164	-174.4	-152.7	174.6	34.5	108.2	G27 N95 H97 E229 E230 D231 N234	G27-R29 PolarHBondContact O-N 2.78Å; R29-N95 PolarHBondContact O-ND2 2.87Å; R29-N95 PolarHBondContact O-OD1 3.26Å; R29-H97 PolarHBondContact NH1-NE2 3.05Å; R29-E229 IonicContact NE-OE2 3.84Å; R29-E229 PolarHBondContact NE-OE2 2.79Å; R29-E229 VanDerWaalsContact NH2-CA 3.33Å; R29-E229 PolarHBondContact NH2-O 3.47Å; R29-E229 IonicContact NH2-OE2 3.7Å; R29-E230 PolarHBondContact NH1-O 2.89Å; R29-E230 PolarHBondContact NH2-O 3.02Å; R29-D231 IonicContact NH1-OD1 3.05Å; R29-D231 PolarHBondContact NH1-OD1 3.39Å; R29-N234 PolarHBondContact NH2-OD1 3.04Å; R29-N234 VanDerWaalsContact NH2-OD1 3.13Å
30	E	81	Confident	64.6	Low	58 Å²	58	65 Å²	65	27%	0.271	37%	0.372	S	S	.	.			trans	-112.2	126.4	-175.1	-71.3	159.4	-166.3	0	0	109.1	H28 R33 Y93	H28-E30 WeakPolarHBondContact O-CG 3.36Å; H28-E30 PolarHBondContact O-N 3.37Å; E30-R33 WeakPolarHBondContact OE2-CD 3.28Å; E30-R33 IonicContact OE2-NH1 3.69Å; E30-Y93 HydrophobicContact CG-CD1 4.13Å; E30-Y93 WeakPolarHBondContact OE1-CD1 3.49Å; E30-Y93 VanDerWaalsContact OE2-CD1 3.28Å; E30-Y93 WeakPolarHBondContact OE2-CD1 3.32Å; E30-Y93 WeakPolarHBondContact OE2-CE1 3.4Å
31	D	85.6	Confident	67.2	Low	6 Å²	6	63.7 Å²	63.7	3%	0.032	36%	0.364	C	S	.	.	S	Bend	trans	-79	-30.3	179.4	-63.5	-99.5	0	0	0	111.1	W94 R96 H97 S142 W143	D31-W94 HydrophobicContact CB-CD2 4.44Å; D31-W94 HydrophobicContact CB-CE3 4.46Å; D31-W94 PolarHBondContact N-O 2.81Å; D31-R96 IonicContact OD1-NE 2.79Å; D31-R96 WeakPolarHBondContact OD2-CB 3.24Å; D31-R96 PolarHBondContact OD2-N 3.37Å; D31-H97 IonicContact OD2-ND1 2.63Å; D31-S142 WeakPolarHBondContact O-CA 3.31Å; D31-W143 PolarHBondContact O-N 3.3Å
32	F	90.9	Very high	69.9	Low	1 Å²	1	60.2 Å²	60.2	0%	0.004	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	136.7	176.7	174.4	-91.3	0	0	0	110.4	F34 I56 L92 W94 V140 T141 F159 F161	F32-F34 HydrophobicContact CE1-CB 3.75Å; F32-F34 HydrophobicContact CZ-CB 3.9Å; F32-I56 HydrophobicContact CD1-CD1 4.34Å; F32-I56 HydrophobicContact CE1-CD1 4.44Å; F32-L92 HydrophobicContact CE1-CD2 4.37Å; F32-W94 HydrophobicContact CB-CB 4.13Å; F32-W94 HydrophobicContact CB-CD2 4.49Å; F32-W94 HydrophobicContact CB-CE3 3.69Å; F32-W94 HydrophobicContact CB-CZ3 4.47Å; F32-W94 PolarHBondContact N-O 3.32Å; F32-W94 PolarHBondContact O-N 2.96Å; F32-V140 HydrophobicContact CD2-CG2 4.25Å; F32-V140 HydrophobicContact CE2-CG2 3.55Å; F32-V140 HydrophobicContact CZ-CG2 4.01Å; F32-T141 WeakPolarHBondContact CA-O 3.2Å; F32-F159 HydrophobicContact CE2-CB 4.33Å; F32-F159 AromaticContact CE2-CD1 3.97Å; F32-F159 HydrophobicContact CE2-CD1 3.97Å; F32-F159 HydrophobicContact CE2-CD2 4.16Å; F32-F159 HydrophobicContact CE2-CE1 4.32Å; F32-F159 AromaticContact CE2-CG 3.88Å; F32-F159 HydrophobicContact CE2-CG 3.88Å; F32-F159 HydrophobicContact CZ-CB 4.45Å; F32-F159 HydrophobicContact CZ-CD1 4.2Å; F32-F159 AromaticContact CZ-CD2 3.61Å; F32-F159 HydrophobicContact CZ-CD2 3.61Å; F32-F159 HydrophobicContact CZ-CE1 4.38Å; F32-F159 AromaticContact CZ-CE2 3.83Å; F32-F159 HydrophobicContact CZ-CE2 3.83Å; F32-F159 AromaticContact CZ-CG 3.81Å; F32-F159 HydrophobicContact CZ-CG 3.81Å; F32-F159 HydrophobicContact CZ-CZ 4.22Å; F32-F161 HydrophobicContact CD2-CZ 4.13Å; F32-F161 HydrophobicContact CE2-CZ 4.3Å
33	R	92.9	Very high	72.8	Confident	65 Å²	65	65.4 Å²	65.4	25%	0.245	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	129.7	173	166.8	-174.7	78.4	-169.4	8.2	110	E30 L92 Y93 V140 T141 N148	E30-R33 WeakPolarHBondContact OE2-CD 3.28Å; E30-R33 IonicContact OE2-NH1 3.69Å; R33-L92 CarbonylContact C-O 3.54Å; R33-L92 VanDerWaalsContact CA-O 3.28Å; R33-L92 WeakPolarHBondContact CA-O 3.48Å; R33-Y93 HydrophobicContact CB-CD1 3.93Å; R33-Y93 HydrophobicContact CB-CE1 4.33Å; R33-Y93 HydrophobicContact CG-CD1 3.71Å; R33-Y93 HydrophobicContact CG-CE1 3.66Å; R33-V140 CarbonylContact O-C 3.48Å; R33-V140 WeakPolarHBondContact O-CA 3.37Å; R33-T141 WeakPolarHBondContact CB-OG1 3.44Å; R33-T141 PolarHBondContact N-O 3.46Å; R33-T141 PolarHBondContact NE-OG1 3.15Å; R33-T141 PolarHBondContact O-N 3.21Å; R33-T141 PolarHBondContact O-OG1 3.18Å; R33-N148 PolarHBondContact NH2-OD1 2.67Å
34	F	94.4	Very high	75.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118	174.5	171.4	-90.6	0	0	0	108.8	F32 I58 F90 C91 L92 L135 T138 S139 F157 F159	F32-F34 HydrophobicContact CE1-CB 3.75Å; F32-F34 HydrophobicContact CZ-CB 3.9Å; F34-I58 HydrophobicContact CD1-CD1 3.89Å; F34-I58 HydrophobicContact CD1-CG1 4.25Å; F34-I58 HydrophobicContact CD2-CD1 4.28Å; F34-I58 HydrophobicContact CE1-CB 4.36Å; F34-I58 HydrophobicContact CE1-CD1 4.11Å; F34-I58 HydrophobicContact CE1-CG1 4.27Å; F34-I58 HydrophobicContact CE1-CG2 4.17Å; F34-I58 HydrophobicContact CE2-CD1 4.43Å; F34-I58 HydrophobicContact CG-CD1 3.98Å; F34-I58 HydrophobicContact CZ-CD1 4.37Å; F34-F90 HydrophobicContact CD1-CE2 4.13Å; F34-F90 AromaticContact CE1-CE2 3.83Å; F34-F90 HydrophobicContact CE1-CE2 3.83Å; F34-F90 HydrophobicContact CE1-CZ 4.1Å; F34-C91 CarbonylContact O-C 3.5Å; F34-C91 VanDerWaalsContact O-CA 3.22Å; F34-C91 WeakPolarHBondContact O-CA 3.36Å; F34-L92 HydrophobicContact CB-CB 4.33Å; F34-L92 PolarHBondContact N-O 3.43Å; F34-L92 PolarHBondContact O-N 3.11Å; F34-L135 HydrophobicContact CE1-CD1 4.46Å; F34-L135 HydrophobicContact CZ-CD1 4.26Å; F34-T138 HydrophobicContact CD2-CG2 4.09Å; F34-T138 HydrophobicContact CE1-CG2 4.5Å; F34-T138 HydrophobicContact CE2-CG2 3.18Å; F34-T138 HydrophobicContact CZ-CG2 3.44Å; F34-T138 VanDerWaalsContact CZ-CG2 3.44Å; F34-S139 WeakPolarHBondContact CA-O 3.32Å; F34-F157 HydrophobicContact CE2-CB 4.14Å; F34-F157 HydrophobicContact CE2-CD1 4.5Å; F34-F157 AromaticContact CE2-CD2 3.78Å; F34-F157 HydrophobicContact CE2-CD2 3.78Å; F34-F157 HydrophobicContact CE2-CE2 4.31Å; F34-F157 AromaticContact CE2-CG 3.88Å; F34-F157 HydrophobicContact CE2-CG 3.88Å; F34-F157 HydrophobicContact CZ-CB 4.44Å; F34-F157 AromaticContact CZ-CD2 3.53Å; F34-F157 HydrophobicContact CZ-CD2 3.53Å; F34-F157 HydrophobicContact CZ-CE2 4Å; F34-F157 HydrophobicContact CZ-CG 4.1Å; F34-F159 AromaticContact CD2-CE2 3.65Å; F34-F159 HydrophobicContact CD2-CE2 3.65Å; F34-F159 AromaticContact CD2-CZ 3.54Å; F34-F159 HydrophobicContact CD2-CZ 3.54Å; F34-F159 AromaticContact CE2-CE2 3.98Å; F34-F159 HydrophobicContact CE2-CE2 3.98Å; F34-F159 AromaticContact CE2-CZ 3.85Å; F34-F159 HydrophobicContact CE2-CZ 3.85Å; F34-F159 HydrophobicContact CG-CE2 4.38Å
35	C	95	Very high	79	Confident	11 Å²	11	54.8 Å²	54.8	7%	0.074	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	138.1	-179.6	-71.8	0	0	0	0	110.3	F90 C91 T138 S139	C35-F90 CarbonylContact C-O 3.5Å; C35-F90 WeakPolarHBondContact CA-O 3.23Å; C35-C91 HydrophobicContact CB-CB 4.17Å; C35-C91 WeakPolarHBondContact CB-SG 3.29Å; C35-C91 WeakPolarHBondContact SG-CB 3.27Å; C35-C91 CovalentContact SG-SG 2.04Å; C35-C91 PolarHBondContact SG-SG 2.99Å; C35-T138 CarbonylContact O-C 3.59Å; C35-T138 WeakPolarHBondContact O-CA 3.19Å; C35-S139 PolarHBondContact N-O 2.99Å; C35-S139 PolarHBondContact O-N 3.24Å
36	S	94.9	Very high	82.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	168.7	-177.3	-172.7	0	0	0	0	111.5	H89 F90 L135 L136 T138	S36-H89 PolarHBondContact O-ND1 3.34Å; S36-H89 VanDerWaalsContact O-ND1 3.12Å; S36-F90 PolarHBondContact N-O 3.24Å; S36-F90 PolarHBondContact O-N 2.93Å; S36-F90 VanDerWaalsContact O-O 3.1Å; S36-L135 WeakPolarHBondContact OG-CB 3.34Å; S36-L136 PolarHBondContact OG-O 2.87Å; S36-T138 PolarHBondContact OG-OG1 3.46Å
37	Q	94.1	Very high	85.3	Confident	63 Å²	63	46.3 Å²	46.3	29%	0.294	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	142.2	170	-61.8	-179.4	-14.9	0	0	110.7	L87 Y88 H89 L136 A137	Q37-L87 HydrophobicContact CB-CD1 4.13Å; Q37-L87 HydrophobicContact CB-CG 4.46Å; Q37-Y88 CarbonylContact C-O 3.58Å; Q37-Y88 VanDerWaalsContact CA-O 3.32Å; Q37-Y88 WeakPolarHBondContact CA-O 3.32Å; Q37-H89 HydrophobicContact CG-CB 4.34Å; Q37-L136 HydrophobicContact CB-CB 4.31Å; Q37-L136 WeakPolarHBondContact CB-O 3.17Å; Q37-L136 PolarHBondContact N-O 3.44Å; Q37-L136 PolarHBondContact O-N 3.4Å; Q37-A137 HydrophobicContact CG-CB 4.31Å
38	R	92.8	Very high	87.9	Confident	1 Å²	1	43.4 Å²	43.4	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.1	176.6	174.4	-164.5	165.1	127.6	-7.2	109.4	S44 N60 S61 E62 A64 Y88 F90 L135	R38-S44 PolarHBondContact NH2-OG 3.04Å; R38-N60 WeakPolarHBondContact CD-OD1 3.48Å; R38-N60 WeakPolarHBondContact CG-OD1 3.34Å; R38-N60 PolarHBondContact NE-OD1 3.38Å; R38-N60 PolarHBondContact NH1-OD1 2.76Å; R38-S61 PolarHBondContact NH1-O 3.34Å; R38-S61 PolarHBondContact NH2-O 3.12Å; R38-E62 VanDerWaalsContact NH2-C 3.34Å; R38-E62 PolarHBondContact NH2-O 3.5Å; R38-A64 PolarHBondContact NH1-O 3.43Å; R38-Y88 PolarHBondContact N-O 3.21Å; R38-Y88 PolarHBondContact O-N 3.31Å; R38-F90 HydrophobicContact CB-CD1 4.35Å; R38-F90 HydrophobicContact CB-CE1 4Å; R38-L135 HydrophobicContact CB-CD2 3.85Å; R38-L135 HydrophobicContact CG-CD2 4.39Å
39	N	91.1	Very high	89.8	Confident	91 Å²	91	42.9 Å²	42.9	49%	0.487	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	115.2	168.9	-168.1	7.6	0	0	0	110.6	L87	N39-L87 HydrophobicContact CB-CD1 4.49Å
40	Q	89	Confident	91.1	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.009	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	101.2	179.1	-174.9	177	-35.5	0	0	110.3	H42 P82 R85 G86 Y88 Y105	Q40-H42 VanDerWaalsContact CG-O 3.31Å; Q40-H42 WeakPolarHBondContact CG-O 3.4Å; Q40-P82 PolarHBondContact NE2-O 3.4Å; Q40-R85 WeakPolarHBondContact O-CA 3.36Å; Q40-R85 WeakPolarHBondContact O-CB 3.39Å; Q40-G86 PolarHBondContact N-O 3.44Å; Q40-G86 PolarHBondContact O-N 3.16Å; Q40-G86 VanDerWaalsContact O-N 3.12Å; Q40-Y88 HydrophobicContact CB-CD2 3.94Å; Q40-Y88 HydrophobicContact CB-CE2 4.18Å; Q40-Y105 PolarHBondContact OE1-OH 3.31Å
41	T	86.4	Confident	91.5	Very high	57 Å²	57	41.7 Å²	41.7	35%	0.35	20%	0.202	S	C	.	.			trans	-91.7	-33	-179.5	47.5	0	0	0	0	113.2	R85	T41-R85 VanDerWaalsContact O-CD 3.28Å; T41-R85 WeakPolarHBondContact O-CD 3.45Å; T41-R85 PolarHBondContact O-NE 2.89Å
42	H	85.4	Confident	91.7	Very high	84 Å²	84	47.3 Å²	47.3	39%	0.389	24%	0.239	S	C	.	.	S	Bend	trans	-114.3	171.8	179.6	-66.9	-95.3	0	0	0	111.8	Q40 S44	Q40-H42 VanDerWaalsContact CG-O 3.31Å; Q40-H42 WeakPolarHBondContact CG-O 3.4Å; H42-S44 PolarHBondContact O-N 3.44Å; H42-S44 VanDerWaalsContact O-N 3.08Å
43	R	87.1	Confident	91.6	Very high	182 Å²	182	50.8 Å²	50.8	69%	0.687	26%	0.257	S	S	*	.			trans	-63.6	111.6	167.2	-172.1	178	-171.5	-173.6	-1.8	107.3	D83	R43-D83 IonicContact NE-OD1 3.47Å
44	S	90.2	Very high	91.5	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.021	26%	0.261	C	S	.	.			trans	-108.2	152.6	-171.2	-174.8	0	0	0	0	111.9	R38 H42 E63 F81	R38-S44 PolarHBondContact NH2-OG 3.04Å; H42-S44 PolarHBondContact O-N 3.44Å; H42-S44 VanDerWaalsContact O-N 3.08Å; S44-E63 CarbonylContact C-O 3.56Å; S44-E63 WeakPolarHBondContact CA-O 3.46Å; S44-E63 PolarHBondContact OG-O 3.42Å; S44-F81 WeakPolarHBondContact O-CB 3.35Å; S44-F81 PolarHBondContact O-N 2.97Å; S44-F81 WeakPolarHBondContact OG-CD2 3.36Å
45	S	92	Very high	91.4	Very high	29 Å²	29	56 Å²	56	20%	0.203	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151.8	174.6	65.6	0	0	0	0	112.6	H47 E63 A64 L65 R79	S45-H47 PolarHBondContact OG-NE2 3.41Å; S45-E63 PolarHBondContact N-O 3.13Å; S45-A64 CarbonylContact O-C 3.58Å; S45-A64 WeakPolarHBondContact O-CA 3.41Å; S45-A64 WeakPolarHBondContact O-CB 3.48Å; S45-L65 PolarHBondContact O-N 2.83Å; S45-R79 CarbonylContact C-O 3.48Å; S45-R79 WeakPolarHBondContact CA-O 3.36Å
46	L	93.9	Very high	91.3	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.3	170.4	178.7	55.6	0	0	0	108.6	L65 V67 S78 R79 F81 L103 F110 L112	L46-L65 WeakPolarHBondContact CA-O 3.38Å; L46-V67 HydrophobicContact CD1-CG2 4.31Å; L46-S78 CarbonylContact O-C 3.5Å; L46-S78 VanDerWaalsContact O-CA 3.22Å; L46-S78 WeakPolarHBondContact O-CA 3.34Å; L46-R79 PolarHBondContact N-O 3.43Å; L46-R79 PolarHBondContact O-N 3.43Å; L46-F81 HydrophobicContact CB-CE1 3.84Å; L46-F81 HydrophobicContact CB-CE2 4.11Å; L46-F81 HydrophobicContact CB-CZ 3.58Å; L46-F81 HydrophobicContact CD1-CZ 4.05Å; L46-F81 HydrophobicContact CD2-CE1 4.37Å; L46-F81 HydrophobicContact CG-CZ 4.27Å; L46-L103 HydrophobicContact CD1-CD2 3.61Å; L46-L103 HydrophobicContact CD2-CB 4.47Å; L46-L103 HydrophobicContact CD2-CD2 3.85Å; L46-L103 HydrophobicContact CG-CD2 4.34Å; L46-F110 HydrophobicContact CD2-CB 3.38Å; L46-F110 HydrophobicContact CD2-CD1 3.85Å; L46-F110 HydrophobicContact CD2-CD2 4.21Å; L46-F110 HydrophobicContact CD2-CG 3.56Å; L46-L112 HydrophobicContact CD1-CD2 4.36Å; L46-L112 HydrophobicContact CD2-CD2 3.67Å; L46-L112 HydrophobicContact CG-CD2 4.12Å
47	H	94.5	Very high	91.2	Very high	57 Å²	57	55.9 Å²	55.9	26%	0.264	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.2	171.4	-70.3	-54.7	0	0	0	110.2	S45 A64 L65 T66 V67 S78	S45-H47 PolarHBondContact OG-NE2 3.41Å; H47-A64 VanDerWaalsContact CD2-CB 3.46Å; H47-A64 WeakPolarHBondContact CD2-CB 3.49Å; H47-L65 PolarHBondContact N-O 2.89Å; H47-T66 HydrophobicContact CB-CG2 4.15Å; H47-T66 CarbonylContact O-C 3.41Å; H47-T66 WeakPolarHBondContact O-CA 3.47Å; H47-V67 PolarHBondContact O-N 3.09Å; H47-S78 WeakPolarHBondContact ND1-CB 3.3Å; H47-S78 PolarHBondContact ND1-OG 2.82Å
48	Y	95	Very high	91.2	Very high	9 Å²	9	52.9 Å²	52.9	4%	0.035	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.3	170.8	-175.9	-105.9	0	0	0	110.8	V67 A69 F71 A73 A77 L101 L112	Y48-V67 WeakPolarHBondContact CA-O 3.28Å; Y48-V67 HydrophobicContact CD2-CB 4.19Å; Y48-V67 HydrophobicContact CD2-CG1 4.19Å; Y48-V67 WeakPolarHBondContact CD2-O 3.41Å; Y48-V67 HydrophobicContact CE2-CG1 4.31Å; Y48-A69 HydrophobicContact CE2-CB 3.82Å; Y48-F71 WeakPolarHBondContact OH-CB 3.37Å; Y48-F71 PolarHBondContact OH-O 3.5Å; Y48-A73 HydrophobicContact CD1-CB 3.51Å; Y48-A73 VanDerWaalsContact CE1-CA 3.49Å; Y48-A73 HydrophobicContact CE1-CB 3.79Å; Y48-A77 PolarHBondContact N-O 3.38Å; Y48-L101 HydrophobicContact CE2-CD2 3.63Å; Y48-L112 HydrophobicContact CD2-CB 3.77Å; Y48-L112 HydrophobicContact CD2-CD1 3.86Å; Y48-L112 HydrophobicContact CD2-CD2 4.2Å; Y48-L112 HydrophobicContact CD2-CG 4.17Å; Y48-L112 HydrophobicContact CE2-CB 3.94Å; Y48-L112 HydrophobicContact CE2-CD1 4.23Å; Y48-L112 HydrophobicContact CG-CB 4.1Å; Y48-L112 HydrophobicContact CG-CD2 4.29Å
49	K	93.3	Very high	91.2	Very high	110 Å²	110	56.7 Å²	56.7	48%	0.478	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	111	-179.2	-72.6	178.3	179.8	176.4	0	110	T66 V67 H68 A69	K49-T66 HydrophobicContact CD-CG2 4.01Å; K49-T66 HydrophobicContact CG-CG2 4.43Å; K49-V67 PolarHBondContact N-O 3.37Å; K49-H68 VanDerWaalsContact CB-CD2 3.45Å; K49-H68 WeakPolarHBondContact CB-CD2 3.48Å; K49-H68 WeakPolarHBondContact CD-NE2 3.1Å; K49-H68 VanDerWaalsContact O-CA 3.31Å; K49-H68 WeakPolarHBondContact O-CA 3.29Å; K49-A69 PolarHBondContact O-N 2.94Å
50	P	92.6	Very high	91.3	Very high	78 Å²	78	52.9 Å²	52.9	51%	0.506	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	139	175.1	28.8	-33.7	0	0	0	110.1	A69 F71	P50-A69 WeakPolarHBondContact CA-O 3.44Å; P50-F71 WeakPolarHBondContact CB-O 3.43Å
51	T	90.9	Very high	91.4	Very high	23 Å²	23	55.1 Å²	55.1	14%	0.141	28%	0.28	C	S	.	.			trans	-124.6	150.4	177.2	115.7	0	0	0	0	111	D53 H68 A69 P70	T51-D53 VanDerWaalsContact C-N 3.3Å; T51-D53 PolarHBondContact OG1-N 3.1Å; T51-D53 PolarHBondContact OG1-O 3.31Å; T51-D53 VanDerWaalsContact OG1-O 3.06Å; T51-H68 HydrophobicContact CG2-CB 3.58Å; T51-A69 PolarHBondContact N-O 2.84Å; T51-P70 VanDerWaalsContact O-CA 3.3Å; T51-P70 WeakPolarHBondContact O-CA 3.22Å
52	P	88.7	Confident	91.5	Very high	124 Å²	124	57.5 Å²	57.5	81%	0.805	29%	0.287	S	S	*	.	S	Bend	trans	-74.9	-21.8	172.6	31.8	-34.5	0	0	0	112.9
53	D	89.8	Confident	91.7	Very high	73 Å²	73	60.2 Å²	60.2	39%	0.39	30%	0.3	S	S	.	.	S	Bend	trans	-75.9	140	-179	-56.4	-45.3	0	0	0	110.2	T51 R55	T51-D53 VanDerWaalsContact C-N 3.3Å; T51-D53 PolarHBondContact OG1-N 3.1Å; T51-D53 PolarHBondContact OG1-O 3.31Å; T51-D53 VanDerWaalsContact OG1-O 3.06Å; D53-R55 HydrophobicContact CB-CG 3.73Å; D53-R55 PolarHBondContact O-N 3.45Å; D53-R55 IonicContact OD2-CZ 3.57Å; D53-R55 VanDerWaalsContact OD2-CZ 3.29Å; D53-R55 IonicContact OD2-NE 3.35Å; D53-R55 PolarHBondContact OD2-NE 3.5Å; D53-R55 IonicContact OD2-NH2 3.78Å; D53-R55 PolarHBondContact OD2-NH2 2.91Å
54	L	90.7	Very high	91.9	Very high	60 Å²	60	51.9 Å²	51.9	31%	0.314	27%	0.27	S	S	.	.	S	Bend	trans	-74.9	59.3	178.5	-59.7	-178.1	0	0	0	111.3	P70 L120 F161 S163	L54-P70 HydrophobicContact CD2-CB 4.24Å; L54-L120 HydrophobicContact CD1-CD2 4.28Å; L54-L120 HydrophobicContact CD2-CD2 3.78Å; L54-L120 HydrophobicContact CG-CD2 4.48Å; L54-F161 HydrophobicContact CB-CB 4.44Å; L54-F161 VanDerWaalsContact CB-O 3.24Å; L54-F161 WeakPolarHBondContact CB-O 3.42Å; L54-F161 WeakPolarHBondContact O-CA 3.2Å; L54-F161 WeakPolarHBondContact O-CB 3.43Å; L54-F161 PolarHBondContact O-N 3.11Å; L54-S163 WeakPolarHBondContact CD1-OG 3.42Å
55	R	92.4	Very high	92.1	Very high	115 Å²	115	51.8 Å²	51.8	43%	0.434	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.9	-179.6	56.2	-177.6	163.1	176	-4.4	111.8	D53 P70 T158 F159	D53-R55 HydrophobicContact CB-CG 3.73Å; D53-R55 PolarHBondContact O-N 3.45Å; D53-R55 IonicContact OD2-CZ 3.57Å; D53-R55 VanDerWaalsContact OD2-CZ 3.29Å; D53-R55 IonicContact OD2-NE 3.35Å; D53-R55 PolarHBondContact OD2-NE 3.5Å; D53-R55 IonicContact OD2-NH2 3.78Å; D53-R55 PolarHBondContact OD2-NH2 2.91Å; R55-P70 WeakPolarHBondContact O-CD 3.28Å; R55-T158 HydrophobicContact CB-CG2 4.2Å; R55-F159 CarbonylContact C-O 3.31Å; R55-F159 WeakPolarHBondContact CA-O 3.43Å; R55-F159 WeakPolarHBondContact CB-O 3.17Å
56	I	93.1	Very high	92.2	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.6	169.1	-62.1	174.4	0	0	0	107.1	F32 I58 H68 A69 L92 W94 F159 F161	F32-I56 HydrophobicContact CD1-CD1 4.34Å; F32-I56 HydrophobicContact CE1-CD1 4.44Å; I56-I58 HydrophobicContact CG2-CD1 4.16Å; I56-H68 CarbonylContact C-O 3.51Å; I56-H68 VanDerWaalsContact CA-O 3.22Å; I56-H68 WeakPolarHBondContact CA-O 3.39Å; I56-A69 HydrophobicContact CG1-CB 4.09Å; I56-L92 HydrophobicContact CG2-CD2 3.85Å; I56-W94 HydrophobicContact CD1-CE3 4.28Å; I56-F159 PolarHBondContact N-O 3.42Å; I56-F159 PolarHBondContact O-N 3.37Å; I56-F161 HydrophobicContact CB-CE2 3.96Å; I56-F161 HydrophobicContact CD1-CE2 3.68Å; I56-F161 HydrophobicContact CD1-CZ 3.85Å; I56-F161 HydrophobicContact CG1-CD2 4.44Å; I56-F161 HydrophobicContact CG1-CE2 3.62Å; I56-F161 HydrophobicContact CG1-CZ 4.3Å
57	S	92.4	Very high	92.3	Very high	8 Å²	8	50.9 Å²	50.9	6%	0.056	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.3	171.8	83.8	0	0	0	0	111.3	E59 V67 H68 F157 T158	S57-E59 PolarHBondContact OG-OE1 3.38Å; S57-V67 WeakPolarHBondContact O-CA 3.43Å; S57-H68 PolarHBondContact N-O 3.49Å; S57-H68 PolarHBondContact O-N 3.21Å; S57-H68 VanDerWaalsContact OG-CB 3.29Å; S57-H68 WeakPolarHBondContact OG-CB 3.46Å; S57-H68 PolarHBondContact OG-ND1 3Å; S57-F157 CarbonylContact C-O 3.05Å; S57-F157 VanDerWaalsContact CA-O 3.24Å; S57-F157 WeakPolarHBondContact CA-O 3.44Å; S57-T158 WeakPolarHBondContact CB-OG1 3.25Å
58	I	94.1	Very high	92.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	117	173.7	-57.1	103.7	0	0	0	107.1	F34 I56 L65 F90 L92 L135 S156 F157 F159	F34-I58 HydrophobicContact CD1-CD1 3.89Å; F34-I58 HydrophobicContact CD1-CG1 4.25Å; F34-I58 HydrophobicContact CD2-CD1 4.28Å; F34-I58 HydrophobicContact CE1-CB 4.36Å; F34-I58 HydrophobicContact CE1-CD1 4.11Å; F34-I58 HydrophobicContact CE1-CG1 4.27Å; F34-I58 HydrophobicContact CE1-CG2 4.17Å; F34-I58 HydrophobicContact CE2-CD1 4.43Å; F34-I58 HydrophobicContact CG-CD1 3.98Å; F34-I58 HydrophobicContact CZ-CD1 4.37Å; I56-I58 HydrophobicContact CG2-CD1 4.16Å; I58-L65 HydrophobicContact CG2-CD1 3.85Å; I58-F90 HydrophobicContact CG2-CE2 4.47Å; I58-F90 HydrophobicContact CG2-CZ 4.46Å; I58-L92 HydrophobicContact CD1-CD2 4.17Å; I58-L92 HydrophobicContact CG1-CD2 4.11Å; I58-L135 HydrophobicContact CG2-CD1 4.24Å; I58-S156 WeakPolarHBondContact O-CA 3.3Å; I58-F157 PolarHBondContact N-O 3.18Å; I58-F157 PolarHBondContact O-N 3.19Å; I58-F159 HydrophobicContact CD1-CD2 4.09Å; I58-F159 HydrophobicContact CD1-CE2 3.73Å
59	E	93	Very high	92.3	Very high	82 Å²	82	49.2 Å²	49.2	38%	0.383	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.7	-177.9	-72.5	167.5	-151.6	0	0	110.6	S57 T66 H68	S57-E59 PolarHBondContact OG-OE1 3.38Å; E59-T66 PolarHBondContact N-O 3.19Å; E59-T66 PolarHBondContact O-N 3.36Å; E59-H68 IonicContact OE1-CE1 3.66Å; E59-H68 PolarHBondContact OE1-CE1 3.33Å; E59-H68 IonicContact OE1-ND1 2.85Å; E59-H68 PolarHBondContact OE1-ND1 2.99Å; E59-H68 IonicContact OE2-CE1 2.6Å
60	N	93.1	Very high	92.2	Very high	10 Å²	10	45.4 Å²	45.4	5%	0.053	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.7	-176.5	-166.5	53.8	0	0	0	111.3	R38 L65 P133 L135 A155	R38-N60 WeakPolarHBondContact CD-OD1 3.48Å; R38-N60 WeakPolarHBondContact CG-OD1 3.34Å; R38-N60 PolarHBondContact NE-OD1 3.38Å; R38-N60 PolarHBondContact NH1-OD1 2.76Å; N60-L65 HydrophobicContact CB-CD1 4.37Å; N60-P133 PolarHBondContact ND2-O 2.85Å; N60-L135 HydrophobicContact CB-CD1 4.11Å; N60-L135 HydrophobicContact CB-CD2 3.85Å; N60-L135 HydrophobicContact CB-CG 3.71Å; N60-L135 VanDerWaalsContact CG-CD2 3.48Å; N60-A155 VanDerWaalsContact CB-O 3.28Å; N60-A155 WeakPolarHBondContact CB-O 3.37Å; N60-A155 PolarHBondContact N-O 2.93Å
61	S	90.8	Very high	92.3	Very high	49 Å²	49	41.9 Å²	41.9	34%	0.343	22%	0.218	S	C	.	.			trans	-121.3	173.6	171.8	69.8	0	0	0	0	110.5	R38 E63 A64	R38-S61 PolarHBondContact NH1-O 3.34Å; R38-S61 PolarHBondContact NH2-O 3.12Å; S61-E63 PolarHBondContact O-N 2.8Å; S61-A64 PolarHBondContact N-O 3.06Å; S61-A64 PolarHBondContact OG-N 3.27Å; S61-A64 PolarHBondContact OG-O 3.15Å
62	E	88.4	Confident	92.3	Very high	108 Å²	108	44 Å²	44	51%	0.505	23%	0.233	S	C	.	.	S	Bend	trans	-66.3	-36.6	177.9	-63.1	-175.6	164.5	0	0	113.2	R38 P133	R38-E62 VanDerWaalsContact NH2-C 3.34Å; R38-E62 PolarHBondContact NH2-O 3.5Å; E62-P133 HydrophobicContact CG-CG 4.14Å
63	E	89.9	Confident	92.5	Very high	141 Å²	141	39.4 Å²	39.4	66%	0.659	21%	0.205	S	C	*	.	S	Bend	trans	-96.1	-19	-174.1	-59.7	-175.6	170	0	0	113.8	S44 S45 S61	S44-E63 CarbonylContact C-O 3.56Å; S44-E63 WeakPolarHBondContact CA-O 3.46Å; S44-E63 PolarHBondContact OG-O 3.42Å; S45-E63 PolarHBondContact N-O 3.13Å; S61-E63 PolarHBondContact O-N 2.8Å
64	A	91.7	Very high	92.4	Very high	7 Å²	7	36.4 Å²	36.4	6%	0.058	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	154	-177.6	0	0	0	0	0	114.4	R38 S45 H47 S61	R38-A64 PolarHBondContact NH1-O 3.43Å; S45-A64 CarbonylContact O-C 3.58Å; S45-A64 WeakPolarHBondContact O-CA 3.41Å; S45-A64 WeakPolarHBondContact O-CB 3.48Å; H47-A64 VanDerWaalsContact CD2-CB 3.46Å; H47-A64 WeakPolarHBondContact CD2-CB 3.49Å; S61-A64 PolarHBondContact N-O 3.06Å; S61-A64 PolarHBondContact OG-N 3.27Å; S61-A64 PolarHBondContact OG-O 3.15Å
65	L	93.6	Very high	92.2	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.9	163	-175.8	69.4	0	0	0	107.4	S45 L46 H47 I58 N60 F81 F90 L103	S45-L65 PolarHBondContact O-N 2.83Å; L46-L65 WeakPolarHBondContact CA-O 3.38Å; H47-L65 PolarHBondContact N-O 2.89Å; I58-L65 HydrophobicContact CG2-CD1 3.85Å; N60-L65 HydrophobicContact CB-CD1 4.37Å; L65-F81 HydrophobicContact CB-CE2 3.72Å; L65-F81 HydrophobicContact CB-CZ 3.91Å; L65-F81 HydrophobicContact CD2-CZ 4.05Å; L65-F90 HydrophobicContact CD1-CE1 4.5Å; L65-F90 HydrophobicContact CD1-CZ 4.09Å; L65-F90 HydrophobicContact CD2-CD1 4.46Å; L65-F90 HydrophobicContact CD2-CD2 4.24Å; L65-F90 HydrophobicContact CD2-CE1 4.25Å; L65-F90 HydrophobicContact CD2-CE2 4.01Å; L65-F90 HydrophobicContact CD2-CG 4.44Å; L65-F90 HydrophobicContact CD2-CZ 4.01Å; L65-L103 HydrophobicContact CD2-CD1 4.44Å; L65-L103 HydrophobicContact CD2-CD2 3.79Å
66	T	94	Very high	91.8	Very high	14 Å²	14	40.4 Å²	40.4	9%	0.086	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.1	-178.7	-52.9	0	0	0	0	109.6	H47 K49 E59 H68	H47-T66 HydrophobicContact CB-CG2 4.15Å; H47-T66 CarbonylContact O-C 3.41Å; H47-T66 WeakPolarHBondContact O-CA 3.47Å; K49-T66 HydrophobicContact CD-CG2 4.01Å; K49-T66 HydrophobicContact CG-CG2 4.43Å; E59-T66 PolarHBondContact N-O 3.19Å; E59-T66 PolarHBondContact O-N 3.36Å; T66-H68 VanDerWaalsContact CG2-CE1 3.45Å; T66-H68 WeakPolarHBondContact CG2-CE1 3.47Å
67	V	95.2	Very high	91.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.2	174.4	-179.2	0	0	0	0	108.4	L46 H47 Y48 K49 S57 L92 L112	L46-V67 HydrophobicContact CD1-CG2 4.31Å; H47-V67 PolarHBondContact O-N 3.09Å; Y48-V67 WeakPolarHBondContact CA-O 3.28Å; Y48-V67 HydrophobicContact CD2-CB 4.19Å; Y48-V67 HydrophobicContact CD2-CG1 4.19Å; Y48-V67 WeakPolarHBondContact CD2-O 3.41Å; Y48-V67 HydrophobicContact CE2-CG1 4.31Å; K49-V67 PolarHBondContact N-O 3.37Å; S57-V67 WeakPolarHBondContact O-CA 3.43Å; V67-L92 HydrophobicContact CG1-CD1 4.36Å; V67-L92 HydrophobicContact CG1-CD2 4.11Å; V67-L112 HydrophobicContact CB-CD1 4.15Å; V67-L112 HydrophobicContact CG1-CD1 3.97Å; V67-L112 HydrophobicContact CG2-CD1 4.32Å
68	H	94.7	Very high	90.8	Very high	32 Å²	32	45 Å²	45	15%	0.148	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.7	171	-59.8	95.4	0	0	0	109	K49 T51 I56 S57 E59 T66	K49-H68 VanDerWaalsContact CB-CD2 3.45Å; K49-H68 WeakPolarHBondContact CB-CD2 3.48Å; K49-H68 WeakPolarHBondContact CD-NE2 3.1Å; K49-H68 VanDerWaalsContact O-CA 3.31Å; K49-H68 WeakPolarHBondContact O-CA 3.29Å; T51-H68 HydrophobicContact CG2-CB 3.58Å; I56-H68 CarbonylContact C-O 3.51Å; I56-H68 VanDerWaalsContact CA-O 3.22Å; I56-H68 WeakPolarHBondContact CA-O 3.39Å; S57-H68 PolarHBondContact N-O 3.49Å; S57-H68 PolarHBondContact O-N 3.21Å; S57-H68 VanDerWaalsContact OG-CB 3.29Å; S57-H68 WeakPolarHBondContact OG-CB 3.46Å; S57-H68 PolarHBondContact OG-ND1 3Å; E59-H68 IonicContact OE1-CE1 3.66Å; E59-H68 PolarHBondContact OE1-CE1 3.33Å; E59-H68 IonicContact OE1-ND1 2.85Å; E59-H68 PolarHBondContact OE1-ND1 2.99Å; E59-H68 IonicContact OE2-CE1 2.6Å; T66-H68 VanDerWaalsContact CG2-CE1 3.45Å; T66-H68 WeakPolarHBondContact CG2-CE1 3.47Å
69	A	95	Very high	90.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	159.7	178.1	0	0	0	0	0	111.4	Y48 K49 P50 T51 I56 F71 L101	Y48-A69 HydrophobicContact CE2-CB 3.82Å; K49-A69 PolarHBondContact O-N 2.94Å; P50-A69 WeakPolarHBondContact CA-O 3.44Å; T51-A69 PolarHBondContact N-O 2.84Å; I56-A69 HydrophobicContact CG1-CB 4.09Å; A69-F71 HydrophobicContact CB-CD2 4.1Å; A69-F71 PolarHBondContact O-N 3.18Å; A69-L101 HydrophobicContact CB-CD2 3.84Å
70	P	92.8	Very high	90.4	Very high	30 Å²	30	47 Å²	47	20%	0.195	27%	0.267	C	S	.	.	S	Bend	trans	-77.5	15.2	-175.9	31.5	-35.6	0	0	0	115.2	T51 L54 R55 L120	T51-P70 VanDerWaalsContact O-CA 3.3Å; T51-P70 WeakPolarHBondContact O-CA 3.22Å; L54-P70 HydrophobicContact CD2-CB 4.24Å; R55-P70 WeakPolarHBondContact O-CD 3.28Å; P70-L120 HydrophobicContact CG-CD1 3.71Å
71	F	93.5	Very high	90.3	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.018	27%	0.265	C	S	.	.	S	Bend	trans	-110.8	150.4	-173.3	-44.3	-60.2	0	0	0	111.6	Y48 P50 A69 W94 L101 S113 A116 S118 L120	Y48-F71 WeakPolarHBondContact OH-CB 3.37Å; Y48-F71 PolarHBondContact OH-O 3.5Å; P50-F71 WeakPolarHBondContact CB-O 3.43Å; A69-F71 HydrophobicContact CB-CD2 4.1Å; A69-F71 PolarHBondContact O-N 3.18Å; F71-W94 HydrophobicContact CE1-CZ2 4.44Å; F71-W94 HydrophobicContact CE2-CD2 4.24Å; F71-W94 HydrophobicContact CE2-CG 4.34Å; F71-W94 HydrophobicContact CZ-CD2 4.04Å; F71-W94 AromaticContact CZ-CE2 3.57Å; F71-W94 HydrophobicContact CZ-CH2 4.45Å; F71-W94 AromaticContact CZ-CZ2 3.81Å; F71-W94 HydrophobicContact CZ-CZ2 3.81Å; F71-W94 AromaticContact CZ-NE1 3.68Å; F71-L101 HydrophobicContact CD2-CB 4.33Å; F71-L101 HydrophobicContact CD2-CD2 3.99Å; F71-L101 HydrophobicContact CE2-CD2 4.48Å; F71-S113 WeakPolarHBondContact CB-OG 3.46Å; F71-A116 HydrophobicContact CB-CB 4.1Å; F71-A116 HydrophobicContact CD1-CB 3.89Å; F71-A116 HydrophobicContact CD2-CB 3.63Å; F71-A116 HydrophobicContact CE1-CB 4.19Å; F71-A116 HydrophobicContact CE2-CB 3.96Å; F71-A116 HydrophobicContact CG-CB 3.59Å; F71-A116 HydrophobicContact CZ-CB 4.23Å; F71-S118 WeakPolarHBondContact CE1-OG 3.47Å; F71-L120 HydrophobicContact CE1-CD1 4Å; F71-L120 HydrophobicContact CZ-CD1 3.87Å
72	P	92.3	Very high	90	Very high	68 Å²	68	45 Å²	45	44%	0.442	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-60.5	140.4	175.6	-23.3	33.8	0	0	0	112.5	S113 K115	P72-S113 WeakPolarHBondContact O-CB 3.34Å; P72-S113 PolarHBondContact O-OG 3.48Å; P72-K115 HydrophobicContact CG-CB 4.08Å; P72-K115 HydrophobicContact CG-CD 4.36Å
73	A	91.3	Very high	89.6	Confident	26 Å²	26	45 Å²	45	22%	0.215	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-71.6	132.4	179.4	0	0	0	0	0	113.1	Y48 A77	Y48-A73 HydrophobicContact CD1-CB 3.51Å; Y48-A73 VanDerWaalsContact CE1-CA 3.49Å; Y48-A73 HydrophobicContact CE1-CB 3.79Å; A73-A77 HydrophobicContact CB-CB 4.28Å
74	A	88.9	Confident	89	Confident	10 Å²	10	42.3 Å²	42.3	8%	0.083	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-74.3	138.4	164.4	0	0	0	0	0	109.9	P76 A77 L111 L112	A74-P76 CarbonylContact O-C 3.51Å; A74-P76 VanDerWaalsContact O-C 3.25Å; A74-A77 PolarHBondContact O-N 2.89Å; A74-L111 HydrophobicContact CB-CD2 4.16Å; A74-L111 HydrophobicContact CB-CG 3.97Å; A74-L112 WeakPolarHBondContact CB-O 3.49Å; A74-L112 PolarHBondContact N-O 3.5Å
75	H	85.9	Confident	88.6	Confident	179 Å²	179	50.8 Å²	50.8	83%	0.829	28%	0.282	S	S	*	.	S	Bend	trans	-84.3	136.6	-179.3	-66.3	70.7	0	0	0	110.6
76	P	84.5	Confident	88.4	Confident	80 Å²	80	52 Å²	52	52%	0.519	29%	0.294	S	S	.	.	S	Bend	cis	-79.8	143.7	-7.9	31	-32.6	0	0	0	112.1	A74 S78 R79	A74-P76 CarbonylContact O-C 3.51Å; A74-P76 VanDerWaalsContact O-C 3.25Å; P76-S78 VanDerWaalsContact C-N 3.32Å; P76-S78 PolarHBondContact O-N 3.29Å; P76-R79 HydrophobicContact CG-CG 4Å; P76-R79 PolarHBondContact O-NE 2.94Å; P76-R79 PolarHBondContact O-NH2 2.96Å; P76-R79 VanDerWaalsContact O-NH2 3.14Å
77	A	79.3	Confident	88.2	Confident	40 Å²	40	56 Å²	56	33%	0.331	32%	0.315	S	S	.	.	S	Bend	trans	-72.3	-20.8	-177.8	0	0	0	0	0	114.3	Y48 A73 A74	Y48-A77 PolarHBondContact N-O 3.38Å; A73-A77 HydrophobicContact CB-CB 4.28Å; A74-A77 PolarHBondContact O-N 2.89Å
78	S	84.7	Confident	88.1	Confident	65 Å²	65	57.6 Å²	57.6	46%	0.455	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.1	178.4	-58.5	0	0	0	0	110.3	L46 H47 P76	L46-S78 CarbonylContact O-C 3.5Å; L46-S78 VanDerWaalsContact O-CA 3.22Å; L46-S78 WeakPolarHBondContact O-CA 3.34Å; H47-S78 WeakPolarHBondContact ND1-CB 3.3Å; H47-S78 PolarHBondContact ND1-OG 2.82Å; P76-S78 VanDerWaalsContact C-N 3.32Å; P76-S78 PolarHBondContact O-N 3.29Å
79	R	90.5	Very high	88.1	Confident	60 Å²	60	60.2 Å²	60.2	23%	0.226	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	138.9	-177.1	-63.2	175.3	-166	159.9	16	110.3	S45 L46 P76 F110 L111	S45-R79 CarbonylContact C-O 3.48Å; S45-R79 WeakPolarHBondContact CA-O 3.36Å; L46-R79 PolarHBondContact N-O 3.43Å; L46-R79 PolarHBondContact O-N 3.43Å; P76-R79 HydrophobicContact CG-CG 4Å; P76-R79 PolarHBondContact O-NE 2.94Å; P76-R79 PolarHBondContact O-NH2 2.96Å; P76-R79 VanDerWaalsContact O-NH2 3.14Å; R79-F110 HydrophobicContact CB-CD1 4.02Å; R79-F110 HydrophobicContact CB-CE1 3.92Å; R79-L111 VanDerWaalsContact CZ-O 3.32Å; R79-L111 PolarHBondContact NH1-O 3.34Å; R79-L111 PolarHBondContact NH2-O 2.95Å
80	S	89.2	Confident	88.1	Confident	63 Å²	63	60.2 Å²	60.2	44%	0.441	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	137.7	177.1	55.2	0	0	0	0	111.6
81	F	90.7	Very high	88.2	Confident	2 Å²	2	59 Å²	59	1%	0.009	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-71.5	166.2	170.8	-73.2	-53.2	0	0	0	111.8	S44 L46 L65 L103 Y105 F110	S44-F81 WeakPolarHBondContact O-CB 3.35Å; S44-F81 PolarHBondContact O-N 2.97Å; S44-F81 WeakPolarHBondContact OG-CD2 3.36Å; L46-F81 HydrophobicContact CB-CE1 3.84Å; L46-F81 HydrophobicContact CB-CE2 4.11Å; L46-F81 HydrophobicContact CB-CZ 3.58Å; L46-F81 HydrophobicContact CD1-CZ 4.05Å; L46-F81 HydrophobicContact CD2-CE1 4.37Å; L46-F81 HydrophobicContact CG-CZ 4.27Å; L65-F81 HydrophobicContact CB-CE2 3.72Å; L65-F81 HydrophobicContact CB-CZ 3.91Å; L65-F81 HydrophobicContact CD2-CZ 4.05Å; F81-L103 HydrophobicContact CE1-CD2 4.15Å; F81-L103 HydrophobicContact CZ-CD2 4.14Å; F81-Y105 HydrophobicContact CB-CE1 4.18Å; F81-Y105 AromaticContact CD1-CD1 3.58Å; F81-Y105 HydrophobicContact CD1-CD1 3.58Å; F81-Y105 HydrophobicContact CD1-CD2 4.06Å; F81-Y105 AromaticContact CD1-CE1 3.85Å; F81-Y105 HydrophobicContact CD1-CE1 3.85Å; F81-Y105 HydrophobicContact CD1-CE2 4.34Å; F81-Y105 AromaticContact CD1-CG 3.69Å; F81-Y105 HydrophobicContact CD1-CG 3.69Å; F81-Y105 AromaticContact CE1-CD1 3.93Å; F81-Y105 HydrophobicContact CE1-CD1 3.93Å; F81-Y105 AromaticContact CE1-CD2 3.57Å; F81-Y105 HydrophobicContact CE1-CD2 3.57Å; F81-Y105 HydrophobicContact CE1-CE1 4.34Å; F81-Y105 HydrophobicContact CE1-CE2 4.05Å; F81-Y105 AromaticContact CE1-CG 3.51Å; F81-Y105 HydrophobicContact CE1-CG 3.51Å; F81-Y105 HydrophobicContact CE2-CD2 4.5Å; F81-Y105 HydrophobicContact CE2-CE2 4.23Å; F81-Y105 HydrophobicContact CG-CD1 4.17Å; F81-Y105 AromaticContact CG-CE1 3.95Å; F81-Y105 HydrophobicContact CG-CE1 3.95Å; F81-Y105 AromaticContact CZ-CD2 3.8Å; F81-Y105 HydrophobicContact CZ-CD2 3.8Å; F81-Y105 AromaticContact CZ-CE2 3.98Å; F81-Y105 HydrophobicContact CZ-CE2 3.98Å; F81-Y105 HydrophobicContact CZ-CG 4.23Å; F81-F110 AromaticContact CD1-CE2 3.85Å; F81-F110 HydrophobicContact CD1-CE2 3.85Å; F81-F110 AromaticContact CD1-CZ 3.84Å; F81-F110 HydrophobicContact CD1-CZ 3.84Å; F81-F110 HydrophobicContact CE1-CD2 4.34Å; F81-F110 AromaticContact CE1-CE2 3.96Å; F81-F110 HydrophobicContact CE1-CE2 3.96Å; F81-F110 HydrophobicContact CE1-CZ 4.26Å
82	P	83.5	Confident	88.3	Confident	16 Å²	16	58.8 Å²	58.8	10%	0.104	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-57.6	145.5	172.6	-21.1	32.3	0	0	0	112.8	Q40 R108	Q40-P82 PolarHBondContact NE2-O 3.4Å; P82-R108 HydrophobicContact CG-CG 4.27Å
83	D	79.7	Confident	88.4	Confident	108 Å²	108	57.5 Å²	57.5	58%	0.578	31%	0.311	S	S	*	.	S	Bend	trans	-79.9	-13.9	-174.7	-65.3	-53	0	0	0	117.9	R43 R85	R43-D83 IonicContact NE-OD1 3.47Å; D83-R85 PolarHBondContact O-N 2.84Å
84	P	78.9	Confident	88.5	Confident	85 Å²	85	56.4 Å²	56.4	55%	0.552	30%	0.301	S	S	*	.			trans	-62.4	126.9	169.4	-6.2	16.7	0	0	0	109.1	Y88	P84-Y88 WeakPolarHBondContact CB-OH 3.25Å; P84-Y88 WeakPolarHBondContact CD-OH 3.48Å; P84-Y88 WeakPolarHBondContact CG-OH 3.46Å; P84-Y88 WeakPolarHBondContact O-CE2 3.49Å; P84-Y88 VanDerWaalsContact O-CZ 3.31Å; P84-Y88 PolarHBondContact O-OH 3.16Å
85	R	82.4	Confident	88.6	Confident	184 Å²	184	57.3 Å²	57.3	69%	0.694	31%	0.305	S	S	*	.			trans	-78.7	146	172.3	-64.2	175.9	-173	-173.8	4.5	109.6	Q40 T41 D83	Q40-R85 WeakPolarHBondContact O-CA 3.36Å; Q40-R85 WeakPolarHBondContact O-CB 3.39Å; T41-R85 VanDerWaalsContact O-CD 3.28Å; T41-R85 WeakPolarHBondContact O-CD 3.45Å; T41-R85 PolarHBondContact O-NE 2.89Å; D83-R85 PolarHBondContact O-N 2.84Å
86	G	88.5	Confident	88.7	Confident	25 Å²	25	49.3 Å²	49.3	26%	0.258	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	149.1	-168.3	-179.8	0	0	0	0	0	113.7	Q40 Y88	Q40-G86 PolarHBondContact N-O 3.44Å; Q40-G86 PolarHBondContact O-N 3.16Å; Q40-G86 VanDerWaalsContact O-N 3.12Å; G86-Y88 WeakPolarHBondContact O-CD2 3.34Å
87	L	91.2	Very high	88.6	Confident	100 Å²	100	48.4 Å²	48.4	52%	0.524	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	117.9	179.7	-169.7	71.3	0	0	0	110.4	Q37 N39	Q37-L87 HydrophobicContact CB-CD1 4.13Å; Q37-L87 HydrophobicContact CB-CG 4.46Å; N39-L87 HydrophobicContact CB-CD1 4.49Å
88	Y	92.5	Very high	89	Confident	32 Å²	32	49.6 Å²	49.6	13%	0.125	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131	174.5	-76	-92.4	0	0	0	110.5	Q37 R38 Q40 P84 G86 Y105	Q37-Y88 CarbonylContact C-O 3.58Å; Q37-Y88 VanDerWaalsContact CA-O 3.32Å; Q37-Y88 WeakPolarHBondContact CA-O 3.32Å; R38-Y88 PolarHBondContact N-O 3.21Å; R38-Y88 PolarHBondContact O-N 3.31Å; Q40-Y88 HydrophobicContact CB-CD2 3.94Å; Q40-Y88 HydrophobicContact CB-CE2 4.18Å; P84-Y88 WeakPolarHBondContact CB-OH 3.25Å; P84-Y88 WeakPolarHBondContact CD-OH 3.48Å; P84-Y88 WeakPolarHBondContact CG-OH 3.46Å; P84-Y88 WeakPolarHBondContact O-CE2 3.49Å; P84-Y88 VanDerWaalsContact O-CZ 3.31Å; P84-Y88 PolarHBondContact O-OH 3.16Å; G86-Y88 WeakPolarHBondContact O-CD2 3.34Å; Y88-Y105 AromaticContact CD1-CD1 3.81Å; Y88-Y105 HydrophobicContact CD1-CD1 3.81Å; Y88-Y105 AromaticContact CD1-CE1 3.42Å; Y88-Y105 HydrophobicContact CD1-CE1 3.42Å; Y88-Y105 VanDerWaalsContact CD1-CE1 3.42Å; Y88-Y105 AromaticContact CD2-CE1 3.86Å; Y88-Y105 HydrophobicContact CD2-CE1 3.86Å; Y88-Y105 HydrophobicContact CE1-CD1 4.46Å; Y88-Y105 HydrophobicContact CE1-CE1 4.06Å; Y88-Y105 HydrophobicContact CE2-CE1 4.43Å; Y88-Y105 HydrophobicContact CG-CD1 4.09Å; Y88-Y105 AromaticContact CG-CE1 3.3Å; Y88-Y105 HydrophobicContact CG-CE1 3.3Å; Y88-Y105 AromaticContact CG-CZ 3.64Å
89	H	94.4	Very high	89.3	Confident	88 Å²	88	47 Å²	47	41%	0.407	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.2	163.3	-176.7	59.7	0	0	0	109.3	S36 Q37 C91 G106	S36-H89 PolarHBondContact O-ND1 3.34Å; S36-H89 VanDerWaalsContact O-ND1 3.12Å; Q37-H89 HydrophobicContact CG-CB 4.34Å; H89-C91 PolarHBondContact NE2-SG 3.46Å; H89-C91 VanDerWaalsContact NE2-SG 3.41Å; H89-G106 PolarHBondContact O-N 3.4Å
90	F	95.2	Very high	89.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	152	173.4	73	-94.9	0	0	0	111.7	F34 C35 S36 R38 I58 L65 L103 L104 Y105 L135	F34-F90 HydrophobicContact CD1-CE2 4.13Å; F34-F90 AromaticContact CE1-CE2 3.83Å; F34-F90 HydrophobicContact CE1-CE2 3.83Å; F34-F90 HydrophobicContact CE1-CZ 4.1Å; C35-F90 CarbonylContact C-O 3.5Å; C35-F90 WeakPolarHBondContact CA-O 3.23Å; S36-F90 PolarHBondContact N-O 3.24Å; S36-F90 PolarHBondContact O-N 2.93Å; S36-F90 VanDerWaalsContact O-O 3.1Å; R38-F90 HydrophobicContact CB-CD1 4.35Å; R38-F90 HydrophobicContact CB-CE1 4Å; I58-F90 HydrophobicContact CG2-CE2 4.47Å; I58-F90 HydrophobicContact CG2-CZ 4.46Å; L65-F90 HydrophobicContact CD1-CE1 4.5Å; L65-F90 HydrophobicContact CD1-CZ 4.09Å; L65-F90 HydrophobicContact CD2-CD1 4.46Å; L65-F90 HydrophobicContact CD2-CD2 4.24Å; L65-F90 HydrophobicContact CD2-CE1 4.25Å; L65-F90 HydrophobicContact CD2-CE2 4.01Å; L65-F90 HydrophobicContact CD2-CG 4.44Å; L65-F90 HydrophobicContact CD2-CZ 4.01Å; F90-L103 HydrophobicContact CD2-CD1 3.59Å; F90-L103 HydrophobicContact CE2-CD1 4.18Å; F90-L103 HydrophobicContact CG-CD1 4.44Å; F90-L104 CarbonylContact C-O 3.46Å; F90-L104 WeakPolarHBondContact CA-O 3.47Å; F90-L104 WeakPolarHBondContact CB-O 3.19Å; F90-Y105 HydrophobicContact CB-CD2 3.49Å; F90-Y105 VanDerWaalsContact CB-CD2 3.49Å; F90-Y105 HydrophobicContact CB-CE2 4.25Å; F90-Y105 HydrophobicContact CB-CG 4.14Å; F90-Y105 HydrophobicContact CD1-CD2 4.13Å; F90-Y105 HydrophobicContact CD1-CE2 4.1Å; F90-Y105 HydrophobicContact CG-CD2 4.02Å; F90-Y105 HydrophobicContact CG-CE2 4.45Å; F90-L135 HydrophobicContact CE1-CD2 3.64Å; F90-L135 HydrophobicContact CZ-CD1 4.13Å; F90-L135 HydrophobicContact CZ-CD2 3.8Å
91	C	95.7	Very high	89.6	Confident	4 Å²	4	45.2 Å²	45.2	3%	0.027	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	127	174.9	-67.3	0	0	0	0	110.1	F34 C35 H89 Y93 L103 L104	F34-C91 CarbonylContact O-C 3.5Å; F34-C91 VanDerWaalsContact O-CA 3.22Å; F34-C91 WeakPolarHBondContact O-CA 3.36Å; C35-C91 HydrophobicContact CB-CB 4.17Å; C35-C91 WeakPolarHBondContact CB-SG 3.29Å; C35-C91 WeakPolarHBondContact SG-CB 3.27Å; C35-C91 CovalentContact SG-SG 2.04Å; C35-C91 PolarHBondContact SG-SG 2.99Å; H89-C91 PolarHBondContact NE2-SG 3.46Å; H89-C91 VanDerWaalsContact NE2-SG 3.41Å; C91-Y93 HydrophobicContact CB-CD2 4.05Å; C91-Y93 HydrophobicContact CB-CE1 4.31Å; C91-Y93 HydrophobicContact CB-CE2 3.27Å; C91-Y93 VanDerWaalsContact CB-CZ 3.42Å; C91-Y93 WeakPolarHBondContact CB-OH 3.34Å; C91-Y93 WeakPolarHBondContact O-CD2 3.39Å; C91-L103 CarbonylContact O-C 3.56Å; C91-L103 WeakPolarHBondContact O-CA 3.32Å; C91-L104 PolarHBondContact N-O 3.49Å; C91-L104 PolarHBondContact O-N 3.38Å
92	L	95.7	Very high	89.8	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.9	168.3	-179.8	69.2	0	0	0	107.9	F32 R33 F34 I56 I58 V67 L101 L103 L112	F32-L92 HydrophobicContact CE1-CD2 4.37Å; R33-L92 CarbonylContact C-O 3.54Å; R33-L92 VanDerWaalsContact CA-O 3.28Å; R33-L92 WeakPolarHBondContact CA-O 3.48Å; F34-L92 HydrophobicContact CB-CB 4.33Å; F34-L92 PolarHBondContact N-O 3.43Å; F34-L92 PolarHBondContact O-N 3.11Å; I56-L92 HydrophobicContact CG2-CD2 3.85Å; I58-L92 HydrophobicContact CD1-CD2 4.17Å; I58-L92 HydrophobicContact CG1-CD2 4.11Å; V67-L92 HydrophobicContact CG1-CD1 4.36Å; V67-L92 HydrophobicContact CG1-CD2 4.11Å; L92-L101 HydrophobicContact CD1-CD1 3.85Å; L92-L101 HydrophobicContact CD1-CG 4.09Å; L92-L101 HydrophobicContact CG-CD1 4.14Å; L92-L103 HydrophobicContact CB-CD1 3.88Å; L92-L103 HydrophobicContact CD1-CB 4.35Å; L92-L103 HydrophobicContact CD1-CD1 4.15Å; L92-L112 HydrophobicContact CD1-CD1 3.57Å
93	Y	94.4	Very high	90.3	Very high	41 Å²	41	46.2 Å²	46.2	16%	0.161	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.7	176.5	-52.5	-97	0	0	0	110.4	E30 R33 C91 L101 H102 L104	E30-Y93 HydrophobicContact CG-CD1 4.13Å; E30-Y93 WeakPolarHBondContact OE1-CD1 3.49Å; E30-Y93 VanDerWaalsContact OE2-CD1 3.28Å; E30-Y93 WeakPolarHBondContact OE2-CD1 3.32Å; E30-Y93 WeakPolarHBondContact OE2-CE1 3.4Å; R33-Y93 HydrophobicContact CB-CD1 3.93Å; R33-Y93 HydrophobicContact CB-CE1 4.33Å; R33-Y93 HydrophobicContact CG-CD1 3.71Å; R33-Y93 HydrophobicContact CG-CE1 3.66Å; C91-Y93 HydrophobicContact CB-CD2 4.05Å; C91-Y93 HydrophobicContact CB-CE1 4.31Å; C91-Y93 HydrophobicContact CB-CE2 3.27Å; C91-Y93 VanDerWaalsContact CB-CZ 3.42Å; C91-Y93 WeakPolarHBondContact CB-OH 3.34Å; C91-Y93 WeakPolarHBondContact O-CD2 3.39Å; Y93-L101 WeakPolarHBondContact O-CA 3.41Å; Y93-H102 WeakPolarHBondContact CB-NE2 3.24Å; Y93-H102 AromaticContact CD2-NE2 3.69Å; Y93-H102 AromaticContact CG-NE2 3.84Å; Y93-H102 PolarHBondContact N-O 3.5Å; Y93-H102 PolarHBondContact O-N 2.95Å; Y93-L104 HydrophobicContact CD2-CB 4.46Å; Y93-L104 HydrophobicContact CE2-CB 3.89Å
94	W	93.7	Very high	91.1	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.1	171.4	175.2	28.4	0	0	0	109.1	D31 F32 I56 F71 L101 A116 S118 L120 F161	D31-W94 HydrophobicContact CB-CD2 4.44Å; D31-W94 HydrophobicContact CB-CE3 4.46Å; D31-W94 PolarHBondContact N-O 2.81Å; F32-W94 HydrophobicContact CB-CB 4.13Å; F32-W94 HydrophobicContact CB-CD2 4.49Å; F32-W94 HydrophobicContact CB-CE3 3.69Å; F32-W94 HydrophobicContact CB-CZ3 4.47Å; F32-W94 PolarHBondContact N-O 3.32Å; F32-W94 PolarHBondContact O-N 2.96Å; I56-W94 HydrophobicContact CD1-CE3 4.28Å; F71-W94 HydrophobicContact CE1-CZ2 4.44Å; F71-W94 HydrophobicContact CE2-CD2 4.24Å; F71-W94 HydrophobicContact CE2-CG 4.34Å; F71-W94 HydrophobicContact CZ-CD2 4.04Å; F71-W94 AromaticContact CZ-CE2 3.57Å; F71-W94 HydrophobicContact CZ-CH2 4.45Å; F71-W94 AromaticContact CZ-CZ2 3.81Å; F71-W94 HydrophobicContact CZ-CZ2 3.81Å; F71-W94 AromaticContact CZ-NE1 3.68Å; W94-L101 HydrophobicContact CB-CD1 3.7Å; W94-L101 HydrophobicContact CG-CD1 4.29Å; W94-A116 PolarHBondContact NE1-O 3.16Å; W94-S118 VanDerWaalsContact CZ2-O 3.29Å; W94-S118 WeakPolarHBondContact CZ2-O 3.41Å; W94-L120 HydrophobicContact CH2-CB 3.6Å; W94-L120 HydrophobicContact CH2-CD1 4.04Å; W94-L120 HydrophobicContact CH2-CG 3.95Å; W94-L120 HydrophobicContact CZ2-CD1 4.45Å; W94-L120 HydrophobicContact CZ2-CG 4.44Å; W94-L120 HydrophobicContact CZ3-CB 4.19Å; W94-F161 HydrophobicContact CZ3-CD1 4.43Å; W94-F161 HydrophobicContact CZ3-CE1 4.03Å; W94-F161 HydrophobicContact CZ3-CZ 4.44Å
95	N	90.5	Very high	91.7	Very high	29 Å²	29	39.8 Å²	39.8	16%	0.155	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	107.4	175	-178.8	-22.9	0	0	0	109.1	R29 H97 A98 G99 R100	R29-N95 PolarHBondContact O-ND2 2.87Å; R29-N95 PolarHBondContact O-OD1 3.26Å; N95-H97 VanDerWaalsContact C-N 3.33Å; N95-H97 PolarHBondContact O-N 3.48Å; N95-H97 WeakPolarHBondContact OD1-CB 3.3Å; N95-H97 PolarHBondContact OD1-N 2.96Å; N95-A98 HydrophobicContact CB-CB 4.15Å; N95-A98 PolarHBondContact OD1-N 2.91Å; N95-G99 PolarHBondContact O-N 3.4Å; N95-G99 VanDerWaalsContact O-N 3.07Å; N95-R100 PolarHBondContact N-O 3.12Å; N95-R100 PolarHBondContact O-N 2.96Å
96	R	87.6	Confident	92.1	Very high	12 Å²	12	32.5 Å²	32.5	5%	0.045	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-38.9	-179.7	-179.2	-179.1	58.3	109.7	5.5	112.3	D31 G99 S117 E230	D31-R96 IonicContact OD1-NE 2.79Å; D31-R96 WeakPolarHBondContact OD2-CB 3.24Å; D31-R96 PolarHBondContact OD2-N 3.37Å; R96-G99 PolarHBondContact O-N 2.99Å; R96-S117 VanDerWaalsContact CG-O 3.29Å; R96-S117 WeakPolarHBondContact CG-O 3.24Å; R96-E230 IonicContact CZ-OE1 3.26Å; R96-E230 IonicContact CZ-OE2 2.94Å; R96-E230 IonicContact NH1-OE2 2.77Å; R96-E230 PolarHBondContact NH1-OE2 3.41Å; R96-E230 VanDerWaalsContact NH2-CD 3.3Å; R96-E230 IonicContact NH2-OE1 3.42Å; R96-E230 PolarHBondContact NH2-OE1 3.36Å; R96-E230 IonicContact NH2-OE2 3.66Å; R96-E230 PolarHBondContact NH2-OE2 3.43Å
97	H	83.5	Confident	92.1	Very high	61 Å²	61	41.6 Å²	41.6	28%	0.282	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-38.6	-176.1	-56.2	84.1	0	0	0	111.5	R29 D31 N95 D231	R29-H97 PolarHBondContact NH1-NE2 3.05Å; D31-H97 IonicContact OD2-ND1 2.63Å; N95-H97 VanDerWaalsContact C-N 3.33Å; N95-H97 PolarHBondContact O-N 3.48Å; N95-H97 WeakPolarHBondContact OD1-CB 3.3Å; N95-H97 PolarHBondContact OD1-N 2.96Å; H97-D231 IonicContact CD2-OD1 3.46Å; H97-D231 PolarHBondContact CD2-OD1 2.92Å; H97-D231 IonicContact CD2-OD2 3.59Å; H97-D231 IonicContact NE2-OD1 2.92Å
98	A	87	Confident	92.1	Very high	65 Å²	65	43 Å²	43	54%	0.537	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-9.4	171.2	0	0	0	0	0	113	N95 R100	N95-A98 HydrophobicContact CB-CB 4.15Å; N95-A98 PolarHBondContact OD1-N 2.91Å; A98-R100 HydrophobicContact CB-CB 4.08Å; A98-R100 PolarHBondContact O-N 3.23Å
99	G	89.8	Confident	92	Very high	9 Å²	9	45 Å²	45	9%	0.093	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	24.9	-172.4	0	0	0	0	0	113.1	N95 R96 D114 K115 A116	N95-G99 PolarHBondContact O-N 3.4Å; N95-G99 VanDerWaalsContact O-N 3.07Å; R96-G99 PolarHBondContact O-N 2.99Å; G99-D114 CarbonylContact O-C 3.56Å; G99-D114 WeakPolarHBondContact O-CA 3.43Å; G99-K115 PolarHBondContact O-N 3.14Å; G99-A116 PolarHBondContact O-N 3.43Å
100	R	92.4	Very high	92	Very high	86 Å²	86	41.4 Å²	41.4	33%	0.325	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.3	-165.9	-171.3	170.4	176.6	175.7	-3.8	111.9	N95 A98 H102 D109 L111 S113	N95-R100 PolarHBondContact N-O 3.12Å; N95-R100 PolarHBondContact O-N 2.96Å; A98-R100 HydrophobicContact CB-CB 4.08Å; A98-R100 PolarHBondContact O-N 3.23Å; R100-H102 HydrophobicContact CG-CB 4.34Å; R100-D109 IonicContact CZ-OD2 3.84Å; R100-D109 IonicContact NH2-OD1 2.71Å; R100-D109 PolarHBondContact NH2-OD1 3.16Å; R100-D109 VanDerWaalsContact NH2-OD1 3.09Å; R100-D109 IonicContact NH2-OD2 2.75Å; R100-D109 PolarHBondContact NH2-OD2 3.37Å; R100-L111 HydrophobicContact CG-CD1 3.54Å; R100-S113 WeakPolarHBondContact CA-O 3.23Å
101	L	94.6	Very high	91.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.6	162	-177.3	75	0	0	0	107.6	Y48 A69 F71 L92 Y93 W94 L112 S113 A116	Y48-L101 HydrophobicContact CE2-CD2 3.63Å; A69-L101 HydrophobicContact CB-CD2 3.84Å; F71-L101 HydrophobicContact CD2-CB 4.33Å; F71-L101 HydrophobicContact CD2-CD2 3.99Å; F71-L101 HydrophobicContact CE2-CD2 4.48Å; L92-L101 HydrophobicContact CD1-CD1 3.85Å; L92-L101 HydrophobicContact CD1-CG 4.09Å; L92-L101 HydrophobicContact CG-CD1 4.14Å; Y93-L101 WeakPolarHBondContact O-CA 3.41Å; W94-L101 HydrophobicContact CB-CD1 3.7Å; W94-L101 HydrophobicContact CG-CD1 4.29Å; L101-L112 HydrophobicContact CB-CB 4.46Å; L101-L112 HydrophobicContact CD2-CB 4.08Å; L101-L112 HydrophobicContact CD2-CD1 4.05Å; L101-L112 HydrophobicContact CG-CB 4.19Å; L101-L112 HydrophobicContact CG-CD1 4.21Å; L101-L112 WeakPolarHBondContact O-CA 3.25Å; L101-L112 WeakPolarHBondContact O-CB 3.13Å; L101-L112 PolarHBondContact O-N 3.31Å; L101-S113 PolarHBondContact N-O 3.43Å; L101-S113 PolarHBondContact O-N 3.45Å; L101-A116 HydrophobicContact CB-CB 4.08Å
102	H	94.4	Very high	91.8	Very high	39 Å²	39	43.9 Å²	43.9	18%	0.181	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152.3	178.4	72.2	156.7	0	0	0	112.6	Y93 R100 D109 F110	Y93-H102 WeakPolarHBondContact CB-NE2 3.24Å; Y93-H102 AromaticContact CD2-NE2 3.69Å; Y93-H102 AromaticContact CG-NE2 3.84Å; Y93-H102 PolarHBondContact N-O 3.5Å; Y93-H102 PolarHBondContact O-N 2.95Å; R100-H102 HydrophobicContact CG-CB 4.34Å; H102-D109 WeakPolarHBondContact CB-OD1 3.48Å; H102-D109 IonicContact CE1-OD2 2.71Å; H102-D109 IonicContact CG-OD1 3.71Å; H102-D109 IonicContact ND1-OD1 2.77Å; H102-D109 PolarHBondContact ND1-OD1 2.9Å; H102-D109 IonicContact ND1-OD2 3.42Å; H102-D109 PolarHBondContact ND1-OD2 3.42Å; H102-F110 CarbonylContact C-O 3.58Å; H102-F110 VanDerWaalsContact CA-O 3.25Å; H102-F110 WeakPolarHBondContact CA-O 3.06Å; H102-F110 WeakPolarHBondContact CB-O 3.35Å
103	L	95.3	Very high	91.7	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.7	178.5	-175.6	84.7	0	0	0	108.7	L46 L65 F81 F90 C91 L92 F110 L112	L46-L103 HydrophobicContact CD1-CD2 3.61Å; L46-L103 HydrophobicContact CD2-CB 4.47Å; L46-L103 HydrophobicContact CD2-CD2 3.85Å; L46-L103 HydrophobicContact CG-CD2 4.34Å; L65-L103 HydrophobicContact CD2-CD1 4.44Å; L65-L103 HydrophobicContact CD2-CD2 3.79Å; F81-L103 HydrophobicContact CE1-CD2 4.15Å; F81-L103 HydrophobicContact CZ-CD2 4.14Å; F90-L103 HydrophobicContact CD2-CD1 3.59Å; F90-L103 HydrophobicContact CE2-CD1 4.18Å; F90-L103 HydrophobicContact CG-CD1 4.44Å; C91-L103 CarbonylContact O-C 3.56Å; C91-L103 WeakPolarHBondContact O-CA 3.32Å; L92-L103 HydrophobicContact CB-CD1 3.88Å; L92-L103 HydrophobicContact CD1-CB 4.35Å; L92-L103 HydrophobicContact CD1-CD1 4.15Å; L103-F110 HydrophobicContact CB-CB 4.35Å; L103-F110 PolarHBondContact N-O 2.78Å; L103-F110 WeakPolarHBondContact O-CB 3.38Å; L103-F110 PolarHBondContact O-N 3Å; L103-L112 HydrophobicContact CB-CD1 4.22Å; L103-L112 HydrophobicContact CB-CG 4.43Å
104	L	94.7	Very high	91.6	Very high	58 Å²	58	46.5 Å²	46.5	30%	0.304	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	111.9	169.4	-167.3	128.7	0	0	0	108.3	F90 C91 Y93 G106 R108	F90-L104 CarbonylContact C-O 3.46Å; F90-L104 WeakPolarHBondContact CA-O 3.47Å; F90-L104 WeakPolarHBondContact CB-O 3.19Å; C91-L104 PolarHBondContact N-O 3.49Å; C91-L104 PolarHBondContact O-N 3.38Å; Y93-L104 HydrophobicContact CD2-CB 4.46Å; Y93-L104 HydrophobicContact CE2-CB 3.89Å; L104-G106 WeakPolarHBondContact CD2-O 3.5Å; L104-R108 CarbonylContact C-O 3.56Å; L104-R108 WeakPolarHBondContact CA-O 3.3Å
105	Y	93.1	Very high	91.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	109.1	-179.8	-170.5	-85	0	0	0	109.5	Q40 F81 Y88 F90 K107 R108	Q40-Y105 PolarHBondContact OE1-OH 3.31Å; F81-Y105 HydrophobicContact CB-CE1 4.18Å; F81-Y105 AromaticContact CD1-CD1 3.58Å; F81-Y105 HydrophobicContact CD1-CD1 3.58Å; F81-Y105 HydrophobicContact CD1-CD2 4.06Å; F81-Y105 AromaticContact CD1-CE1 3.85Å; F81-Y105 HydrophobicContact CD1-CE1 3.85Å; F81-Y105 HydrophobicContact CD1-CE2 4.34Å; F81-Y105 AromaticContact CD1-CG 3.69Å; F81-Y105 HydrophobicContact CD1-CG 3.69Å; F81-Y105 AromaticContact CE1-CD1 3.93Å; F81-Y105 HydrophobicContact CE1-CD1 3.93Å; F81-Y105 AromaticContact CE1-CD2 3.57Å; F81-Y105 HydrophobicContact CE1-CD2 3.57Å; F81-Y105 HydrophobicContact CE1-CE1 4.34Å; F81-Y105 HydrophobicContact CE1-CE2 4.05Å; F81-Y105 AromaticContact CE1-CG 3.51Å; F81-Y105 HydrophobicContact CE1-CG 3.51Å; F81-Y105 HydrophobicContact CE2-CD2 4.5Å; F81-Y105 HydrophobicContact CE2-CE2 4.23Å; F81-Y105 HydrophobicContact CG-CD1 4.17Å; F81-Y105 AromaticContact CG-CE1 3.95Å; F81-Y105 HydrophobicContact CG-CE1 3.95Å; F81-Y105 AromaticContact CZ-CD2 3.8Å; F81-Y105 HydrophobicContact CZ-CD2 3.8Å; F81-Y105 AromaticContact CZ-CE2 3.98Å; F81-Y105 HydrophobicContact CZ-CE2 3.98Å; F81-Y105 HydrophobicContact CZ-CG 4.23Å; Y88-Y105 AromaticContact CD1-CD1 3.81Å; Y88-Y105 HydrophobicContact CD1-CD1 3.81Å; Y88-Y105 AromaticContact CD1-CE1 3.42Å; Y88-Y105 HydrophobicContact CD1-CE1 3.42Å; Y88-Y105 VanDerWaalsContact CD1-CE1 3.42Å; Y88-Y105 AromaticContact CD2-CE1 3.86Å; Y88-Y105 HydrophobicContact CD2-CE1 3.86Å; Y88-Y105 HydrophobicContact CE1-CD1 4.46Å; Y88-Y105 HydrophobicContact CE1-CE1 4.06Å; Y88-Y105 HydrophobicContact CE2-CE1 4.43Å; Y88-Y105 HydrophobicContact CG-CD1 4.09Å; Y88-Y105 AromaticContact CG-CE1 3.3Å; Y88-Y105 HydrophobicContact CG-CE1 3.3Å; Y88-Y105 AromaticContact CG-CZ 3.64Å; F90-Y105 HydrophobicContact CB-CD2 3.49Å; F90-Y105 VanDerWaalsContact CB-CD2 3.49Å; F90-Y105 HydrophobicContact CB-CE2 4.25Å; F90-Y105 HydrophobicContact CB-CG 4.14Å; F90-Y105 HydrophobicContact CD1-CD2 4.13Å; F90-Y105 HydrophobicContact CD1-CE2 4.1Å; F90-Y105 HydrophobicContact CG-CD2 4.02Å; F90-Y105 HydrophobicContact CG-CE2 4.45Å; Y105-K107 PolarHBondContact O-N 3.45Å; Y105-K107 VanDerWaalsContact O-N 3.08Å; Y105-R108 PolarHBondContact N-O 2.99Å; Y105-R108 PolarHBondContact O-N 3.02Å
106	G	89.6	Confident	91.4	Very high	31 Å²	31	51.5 Å²	51.5	32%	0.32	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	-108.9	-167.7	0	0	0	0	0	111.1	H89 L104	H89-G106 PolarHBondContact O-N 3.4Å; L104-G106 WeakPolarHBondContact CD2-O 3.5Å
107	K	88.8	Confident	91.4	Very high	216 Å²	216	54.5 Å²	54.5	94%	0.939	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-0.7	177.5	-64.2	-176.3	179.4	-177.6	0	113.9	Y105	Y105-K107 PolarHBondContact O-N 3.45Å; Y105-K107 VanDerWaalsContact O-N 3.08Å
108	R	90.5	Very high	91.5	Very high	130 Å²	130	54.1 Å²	54.1	49%	0.491	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	132.9	-176.8	-68.1	-165.1	-178.3	171.3	-1.2	110.8	P82 L104 Y105 F110	P82-R108 HydrophobicContact CG-CG 4.27Å; L104-R108 CarbonylContact C-O 3.56Å; L104-R108 WeakPolarHBondContact CA-O 3.3Å; Y105-R108 PolarHBondContact N-O 2.99Å; Y105-R108 PolarHBondContact O-N 3.02Å; R108-F110 HydrophobicContact CB-CD2 4.29Å; R108-F110 HydrophobicContact CB-CE2 3.59Å; R108-F110 HydrophobicContact CB-CZ 4.04Å
109	D	92.2	Very high	91.3	Very high	72 Å²	72	51.9 Å²	51.9	39%	0.385	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	121.6	173.3	179.8	-12.1	0	0	0	109.7	R100 H102	R100-D109 IonicContact CZ-OD2 3.84Å; R100-D109 IonicContact NH2-OD1 2.71Å; R100-D109 PolarHBondContact NH2-OD1 3.16Å; R100-D109 VanDerWaalsContact NH2-OD1 3.09Å; R100-D109 IonicContact NH2-OD2 2.75Å; R100-D109 PolarHBondContact NH2-OD2 3.37Å; H102-D109 WeakPolarHBondContact CB-OD1 3.48Å; H102-D109 IonicContact CE1-OD2 2.71Å; H102-D109 IonicContact CG-OD1 3.71Å; H102-D109 IonicContact ND1-OD1 2.77Å; H102-D109 PolarHBondContact ND1-OD1 2.9Å; H102-D109 IonicContact ND1-OD2 3.42Å; H102-D109 PolarHBondContact ND1-OD2 3.42Å
110	F	92.8	Very high	91	Very high	14 Å²	14	51.7 Å²	51.7	6%	0.061	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	103.6	176.5	-64	-90.5	0	0	0	110.2	L46 R79 F81 H102 L103 R108 L112	L46-F110 HydrophobicContact CD2-CB 3.38Å; L46-F110 HydrophobicContact CD2-CD1 3.85Å; L46-F110 HydrophobicContact CD2-CD2 4.21Å; L46-F110 HydrophobicContact CD2-CG 3.56Å; R79-F110 HydrophobicContact CB-CD1 4.02Å; R79-F110 HydrophobicContact CB-CE1 3.92Å; F81-F110 AromaticContact CD1-CE2 3.85Å; F81-F110 HydrophobicContact CD1-CE2 3.85Å; F81-F110 AromaticContact CD1-CZ 3.84Å; F81-F110 HydrophobicContact CD1-CZ 3.84Å; F81-F110 HydrophobicContact CE1-CD2 4.34Å; F81-F110 AromaticContact CE1-CE2 3.96Å; F81-F110 HydrophobicContact CE1-CE2 3.96Å; F81-F110 HydrophobicContact CE1-CZ 4.26Å; H102-F110 CarbonylContact C-O 3.58Å; H102-F110 VanDerWaalsContact CA-O 3.25Å; H102-F110 WeakPolarHBondContact CA-O 3.06Å; H102-F110 WeakPolarHBondContact CB-O 3.35Å; L103-F110 HydrophobicContact CB-CB 4.35Å; L103-F110 PolarHBondContact N-O 2.78Å; L103-F110 WeakPolarHBondContact O-CB 3.38Å; L103-F110 PolarHBondContact O-N 3Å; R108-F110 HydrophobicContact CB-CD2 4.29Å; R108-F110 HydrophobicContact CB-CE2 3.59Å; R108-F110 HydrophobicContact CB-CZ 4.04Å; F110-L112 PolarHBondContact O-N 2.91Å
111	L	94	Very high	90.5	Very high	51 Å²	51	47.8 Å²	47.8	27%	0.267	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	114.9	169.1	178.2	67.5	0	0	0	110.6	A74 R79 R100 S113	A74-L111 HydrophobicContact CB-CD2 4.16Å; A74-L111 HydrophobicContact CB-CG 3.97Å; R79-L111 VanDerWaalsContact CZ-O 3.32Å; R79-L111 PolarHBondContact NH1-O 3.34Å; R79-L111 PolarHBondContact NH2-O 2.95Å; R100-L111 HydrophobicContact CG-CD1 3.54Å; L111-S113 WeakPolarHBondContact CD1-O 3.37Å
112	L	93.4	Very high	89.8	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.026	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-40.7	178.4	-60.8	-174.9	0	0	0	112.2	L46 Y48 V67 A74 L92 L101 L103 F110	L46-L112 HydrophobicContact CD1-CD2 4.36Å; L46-L112 HydrophobicContact CD2-CD2 3.67Å; L46-L112 HydrophobicContact CG-CD2 4.12Å; Y48-L112 HydrophobicContact CD2-CB 3.77Å; Y48-L112 HydrophobicContact CD2-CD1 3.86Å; Y48-L112 HydrophobicContact CD2-CD2 4.2Å; Y48-L112 HydrophobicContact CD2-CG 4.17Å; Y48-L112 HydrophobicContact CE2-CB 3.94Å; Y48-L112 HydrophobicContact CE2-CD1 4.23Å; Y48-L112 HydrophobicContact CG-CB 4.1Å; Y48-L112 HydrophobicContact CG-CD2 4.29Å; V67-L112 HydrophobicContact CB-CD1 4.15Å; V67-L112 HydrophobicContact CG1-CD1 3.97Å; V67-L112 HydrophobicContact CG2-CD1 4.32Å; A74-L112 WeakPolarHBondContact CB-O 3.49Å; A74-L112 PolarHBondContact N-O 3.5Å; L92-L112 HydrophobicContact CD1-CD1 3.57Å; L101-L112 HydrophobicContact CB-CB 4.46Å; L101-L112 HydrophobicContact CD2-CB 4.08Å; L101-L112 HydrophobicContact CD2-CD1 4.05Å; L101-L112 HydrophobicContact CG-CB 4.19Å; L101-L112 HydrophobicContact CG-CD1 4.21Å; L101-L112 WeakPolarHBondContact O-CA 3.25Å; L101-L112 WeakPolarHBondContact O-CB 3.13Å; L101-L112 PolarHBondContact O-N 3.31Å; L103-L112 HydrophobicContact CB-CD1 4.22Å; L103-L112 HydrophobicContact CB-CG 4.43Å; F110-L112 PolarHBondContact O-N 2.91Å
113	S	93.3	Very high	89.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	140.5	176.6	-173.1	0	0	0	0	111.1	F71 P72 R100 L101 L111 K115	F71-S113 WeakPolarHBondContact CB-OG 3.46Å; P72-S113 WeakPolarHBondContact O-CB 3.34Å; P72-S113 PolarHBondContact O-OG 3.48Å; R100-S113 WeakPolarHBondContact CA-O 3.23Å; L101-S113 PolarHBondContact N-O 3.43Å; L101-S113 PolarHBondContact O-N 3.45Å; L111-S113 WeakPolarHBondContact CD1-O 3.37Å; S113-K115 PolarHBondContact OG-N 2.96Å
114	D	91.7	Very high	88.6	Confident	96 Å²	96	60 Å²	60	51%	0.513	30%	0.3	S	S	.	.	S	Bend	trans	-105.7	6.3	171.5	65.4	-24.4	0	0	0	112.8	G99	G99-D114 CarbonylContact O-C 3.56Å; G99-D114 WeakPolarHBondContact O-CA 3.43Å
115	K	90.9	Very high	88	Confident	136 Å²	136	58.9 Å²	58.9	59%	0.591	29%	0.293	S	S	*	.			trans	-127.1	39.8	-179.7	-65.3	-177.6	-175.8	179.3	0	112.1	P72 G99 S113 S117	P72-K115 HydrophobicContact CG-CB 4.08Å; P72-K115 HydrophobicContact CG-CD 4.36Å; G99-K115 PolarHBondContact O-N 3.14Å; S113-K115 PolarHBondContact OG-N 2.96Å; K115-S117 PolarHBondContact O-N 3.48Å
116	A	89.8	Confident	87.5	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.32	C	S	.	.			trans	-98.2	49.1	-178	0	0	0	0	0	112.8	F71 W94 G99 L101	F71-A116 HydrophobicContact CB-CB 4.1Å; F71-A116 HydrophobicContact CD1-CB 3.89Å; F71-A116 HydrophobicContact CD2-CB 3.63Å; F71-A116 HydrophobicContact CE1-CB 4.19Å; F71-A116 HydrophobicContact CE2-CB 3.96Å; F71-A116 HydrophobicContact CG-CB 3.59Å; F71-A116 HydrophobicContact CZ-CB 4.23Å; W94-A116 PolarHBondContact NE1-O 3.16Å; G99-A116 PolarHBondContact O-N 3.43Å; L101-A116 HydrophobicContact CB-CB 4.08Å
117	S	86.7	Confident	87.1	Confident	75 Å²	75	67.6 Å²	67.6	52%	0.524	33%	0.326	S	S	.	.			trans	-100.9	0.1	-173.5	59.1	0	0	0	0	115.4	R96 K115	R96-S117 VanDerWaalsContact CG-O 3.29Å; R96-S117 WeakPolarHBondContact CG-O 3.24Å; K115-S117 PolarHBondContact O-N 3.48Å
118	S	85.6	Confident	86.4	Confident	53 Å²	53	59.8 Å²	59.8	37%	0.371	30%	0.298	S	S	.	.			trans	-70.3	139.7	180	60.6	0	0	0	0	111.7	F71 W94 L120	F71-S118 WeakPolarHBondContact CE1-OG 3.47Å; W94-S118 VanDerWaalsContact CZ2-O 3.29Å; W94-S118 WeakPolarHBondContact CZ2-O 3.41Å; S118-L120 PolarHBondContact O-N 3.3Å
119	L	82.8	Confident	85.2	Confident	18 Å²	18	62 Å²	62	9%	0.094	32%	0.319	C	S	.	.			trans	-75.6	114.4	172.3	-179.8	65.1	0	0	0	110	P164 K180 R181	L119-P164 HydrophobicContact CD2-CG 4.29Å; L119-K180 HydrophobicContact CD1-CG 3.9Å; L119-K180 HydrophobicContact CD2-CG 4.3Å; L119-R181 HydrophobicContact CD2-CB 3.8Å; L119-R181 HydrophobicContact CD2-CG 4.39Å
120	L	83.4	Confident	83.9	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.021	32%	0.319	C	S	.	.			trans	-122.2	138.5	173.7	-50.3	172.8	0	0	0	109.6	L54 P70 F71 W94 S118 F161	L54-L120 HydrophobicContact CD1-CD2 4.28Å; L54-L120 HydrophobicContact CD2-CD2 3.78Å; L54-L120 HydrophobicContact CG-CD2 4.48Å; P70-L120 HydrophobicContact CG-CD1 3.71Å; F71-L120 HydrophobicContact CE1-CD1 4Å; F71-L120 HydrophobicContact CZ-CD1 3.87Å; W94-L120 HydrophobicContact CH2-CB 3.6Å; W94-L120 HydrophobicContact CH2-CD1 4.04Å; W94-L120 HydrophobicContact CH2-CG 3.95Å; W94-L120 HydrophobicContact CZ2-CD1 4.45Å; W94-L120 HydrophobicContact CZ2-CG 4.44Å; W94-L120 HydrophobicContact CZ3-CB 4.19Å; S118-L120 PolarHBondContact O-N 3.3Å; L120-F161 HydrophobicContact CB-CB 3.77Å; L120-F161 HydrophobicContact CB-CD1 4.07Å; L120-F161 HydrophobicContact CB-CG 4.05Å; L120-F161 HydrophobicContact CD1-CB 4.47Å
121	C	81.8	Confident	82.9	Confident	4 Å²	4	70 Å²	70	3%	0.027	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.6	180	-63.3	0	0	0	0	109.6	F161 H162 C177	C121-F161 CarbonylContact O-C 3.58Å; C121-F161 WeakPolarHBondContact O-CA 3.48Å; C121-F161 VanDerWaalsContact O-CB 3.28Å; C121-F161 WeakPolarHBondContact O-CB 3.39Å; C121-H162 PolarHBondContact N-O 2.66Å; C121-H162 PolarHBondContact O-CD2 2.72Å; C121-H162 PolarHBondContact O-N 2.92Å; C121-C177 HydrophobicContact CB-CB 3.62Å; C121-C177 WeakPolarHBondContact CB-SG 3.37Å; C121-C177 WeakPolarHBondContact SG-CA 3.32Å; C121-C177 WeakPolarHBondContact SG-CB 3.33Å; C121-C177 CovalentContact SG-SG 2.01Å; C121-C177 PolarHBondContact SG-SG 3.4Å
122	F	81	Confident	82.2	Confident	58 Å²	58	69.3 Å²	69.3	25%	0.254	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	145.4	178.4	-156.4	-133.3	0	0	0	112.4	H124 Q125 W144 F159 H162	F122-H124 WeakPolarHBondContact CE2-O 3.2Å; F122-H124 VanDerWaalsContact CZ-C 3.49Å; F122-Q125 HydrophobicContact CE2-CB 4.36Å; F122-Q125 HydrophobicContact CZ-CB 3.79Å; F122-W144 HydrophobicContact CB-CD2 3.6Å; F122-W144 HydrophobicContact CB-CE3 3.64Å; F122-W144 HydrophobicContact CB-CH2 3.18Å; F122-W144 HydrophobicContact CB-CZ2 3.11Å; F122-W144 HydrophobicContact CB-CZ3 3.43Å; F122-W144 VanDerWaalsContact CB-CZ3 3.43Å; F122-W144 AromaticContact CD1-CE2 3.7Å; F122-W144 HydrophobicContact CD1-CH2 4.42Å; F122-W144 AromaticContact CD1-CZ2 3.58Å; F122-W144 HydrophobicContact CD1-CZ2 3.58Å; F122-W144 AromaticContact CD1-NE1 3.74Å; F122-W144 AromaticContact CD2-CH2 3.31Å; F122-W144 HydrophobicContact CD2-CH2 3.31Å; F122-W144 AromaticContact CD2-CZ2 3.12Å; F122-W144 HydrophobicContact CD2-CZ2 3.12Å; F122-W144 HydrophobicContact CD2-CZ3 4.37Å; F122-W144 HydrophobicContact CE1-CZ2 4.24Å; F122-W144 HydrophobicContact CE2-CH2 4.29Å; F122-W144 AromaticContact CE2-CZ2 3.87Å; F122-W144 HydrophobicContact CE2-CZ2 3.87Å; F122-W144 HydrophobicContact CG-CD2 4.27Å; F122-W144 AromaticContact CG-CE2 3.41Å; F122-W144 VanDerWaalsContact CG-CE2 3.41Å; F122-W144 AromaticContact CG-CH2 3.38Å; F122-W144 HydrophobicContact CG-CH2 3.38Å; F122-W144 AromaticContact CG-CZ2 2.94Å; F122-W144 HydrophobicContact CG-CZ2 2.94Å; F122-W144 HydrophobicContact CG-CZ3 4.17Å; F122-W144 AromaticContact CG-NE1 3.96Å; F122-W144 HydrophobicContact CZ-CZ2 4.35Å; F122-F159 HydrophobicContact CE2-CB 4.42Å; F122-F159 HydrophobicContact CE2-CD1 4.07Å; F122-H162 PolarHBondContact O-CD2 2.85Å; F122-H162 VanDerWaalsContact O-CD2 3.29Å; F122-H162 PolarHBondContact O-NE2 3.04Å
123	Q	81	Confident	81.9	Confident	129 Å²	129	70.9 Å²	70.9	60%	0.603	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	-62.8	166.2	-169.6	174.1	5.8	0	0	110.3	S160	Q123-S160 PolarHBondContact N-O 3.27Å
124	H	82.7	Confident	81.7	Confident	110 Å²	110	74.2 Å²	74.2	51%	0.509	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	168.8	-177.5	-169.8	56	0	0	0	111.2	F122 S160	F122-H124 WeakPolarHBondContact CE2-O 3.2Å; F122-H124 VanDerWaalsContact CZ-C 3.49Å; H124-S160 PolarHBondContact N-OG 3.31Å; H124-S160 VanDerWaalsContact N-OG 3.08Å; H124-S160 PolarHBondContact O-N 3.19Å; H124-S160 PolarHBondContact O-OG 3.23Å
125	Q	82.7	Confident	81.7	Confident	35 Å²	35	69.6 Å²	69.6	16%	0.164	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.5	174.1	168.8	-170.4	-38.7	0	0	108.9	F122 E127 L151 T158 F159	F122-Q125 HydrophobicContact CE2-CB 4.36Å; F122-Q125 HydrophobicContact CZ-CB 3.79Å; Q125-E127 PolarHBondContact NE2-OE1 3.35Å; Q125-L151 VanDerWaalsContact NE2-CD1 3.27Å; Q125-T158 WeakPolarHBondContact CA-O 3.31Å; Q125-F159 HydrophobicContact CB-CD1 4.09Å; Q125-F159 HydrophobicContact CB-CE1 4.31Å; Q125-F159 HydrophobicContact CG-CD1 3.98Å; Q125-F159 HydrophobicContact CG-CE1 3.79Å
126	E	83.6	Confident	81.6	Confident	120 Å²	120	66.4 Å²	66.4	56%	0.561	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.2	174.4	-69.9	174.9	-173.8	0	0	110.3	T158	E126-T158 PolarHBondContact N-O 3.35Å; E126-T158 PolarHBondContact O-N 2.95Å
127	E	79.5	Confident	81.7	Confident	94 Å²	94	69.5 Å²	69.5	44%	0.439	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.5	173.8	-66.4	170.8	-169.3	0	0	108	Q125 P152 F157	Q125-E127 PolarHBondContact NE2-OE1 3.35Å; E127-P152 VanDerWaalsContact CD-CG 3.48Å; E127-P152 VanDerWaalsContact OE1-CD 3.29Å; E127-P152 WeakPolarHBondContact OE1-CD 3.41Å; E127-P152 WeakPolarHBondContact OE1-CG 3.24Å; E127-P152 WeakPolarHBondContact OE2-CG 3.48Å; E127-F157 HydrophobicContact CG-CD1 4.09Å; E127-F157 HydrophobicContact CG-CE1 4.09Å
128	S	74.1	Confident	81.9	Confident	52 Å²	52	66 Å²	66	36%	0.364	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.8	176.1	137.8	0	0	0	0	109.2	A130 S156	S128-A130 PolarHBondContact O-N 3.34Å; S128-A130 PolarHBondContact OG-N 2.88Å; S128-A130 VanDerWaalsContact OG-N 3.14Å; S128-S156 WeakPolarHBondContact CB-OG 3.36Å; S128-S156 PolarHBondContact N-O 3.47Å; S128-S156 PolarHBondContact O-OG 2.92Å; S128-S156 VanDerWaalsContact O-OG 3.05Å; S128-S156 PolarHBondContact OG-OG 3.32Å
129	L	65.4	Low	82.3	Confident	177 Å²	177	64.9 Å²	64.9	93%	0.927	36%	0.357	S	S	*	.			trans	-71.8	60.3	160.9	-98.1	92.4	0	0	0	109.2
130	A	65.4	Low	82.7	Confident	46 Å²	46	64.5 Å²	64.5	38%	0.38	36%	0.356	S	S	.	.			trans	-62.4	146.9	167.4	0	0	0	0	0	109.3	S128 G132 A155	S128-A130 PolarHBondContact O-N 3.34Å; S128-A130 PolarHBondContact OG-N 2.88Å; S128-A130 VanDerWaalsContact OG-N 3.14Å; A130-G132 PolarHBondContact O-N 2.97Å; A130-A155 HydrophobicContact CB-CB 4.16Å; A130-A155 WeakPolarHBondContact O-CB 3.5Å
131	Q	72.7	Confident	82.9	Confident	207 Å²	207	65 Å²	65	97%	0.967	36%	0.359	S	S	*	.	S	Bend	trans	-68.6	101	170.1	-76.4	175.6	-17.8	0	0	108.6
132	G	78.9	Confident	83	Confident	37 Å²	37	65.3 Å²	65.3	38%	0.381	36%	0.361	S	S	.	.	S	Bend	trans	-176.9	167	179.3	0	0	0	0	0	112.8	A130	A130-G132 PolarHBondContact O-N 2.97Å
133	P	87.2	Confident	82.9	Confident	38 Å²	38	64.3 Å²	64.3	25%	0.247	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-61.3	131	175.7	23.7	-31.1	0	0	0	110.1	N60 E62	N60-P133 PolarHBondContact ND2-O 2.85Å; E62-P133 HydrophobicContact CG-CG 4.14Å
134	P	89.3	Confident	82.4	Confident	69 Å²	69	61.1 Å²	61.1	45%	0.448	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-70.7	140.7	-178	28.8	-34.3	0	0	0	111
135	L	91.1	Very high	81.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-74.1	138	162.8	-72.3	179.5	0	0	0	109.2	F34 S36 R38 I58 N60 F90 S153 A154 F157	F34-L135 HydrophobicContact CE1-CD1 4.46Å; F34-L135 HydrophobicContact CZ-CD1 4.26Å; S36-L135 WeakPolarHBondContact OG-CB 3.34Å; R38-L135 HydrophobicContact CB-CD2 3.85Å; R38-L135 HydrophobicContact CG-CD2 4.39Å; I58-L135 HydrophobicContact CG2-CD1 4.24Å; N60-L135 HydrophobicContact CB-CD1 4.11Å; N60-L135 HydrophobicContact CB-CD2 3.85Å; N60-L135 HydrophobicContact CB-CG 3.71Å; N60-L135 VanDerWaalsContact CG-CD2 3.48Å; F90-L135 HydrophobicContact CE1-CD2 3.64Å; F90-L135 HydrophobicContact CZ-CD1 4.13Å; F90-L135 HydrophobicContact CZ-CD2 3.8Å; L135-S153 VanDerWaalsContact O-CA 3.23Å; L135-S153 WeakPolarHBondContact O-CA 3.48Å; L135-S153 VanDerWaalsContact O-CB 3.28Å; L135-S153 WeakPolarHBondContact O-CB 3.34Å; L135-A154 VanDerWaalsContact CB-O 3.31Å; L135-A154 WeakPolarHBondContact CB-O 3.16Å; L135-A154 PolarHBondContact N-O 3.31Å; L135-F157 HydrophobicContact CB-CE2 4.05Å; L135-F157 HydrophobicContact CD1-CD2 4.04Å; L135-F157 HydrophobicContact CD1-CE2 4.01Å
136	L	89.8	Confident	81.3	Confident	68 Å²	68	60.5 Å²	60.5	36%	0.356	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	154.3	-173.1	-57.5	173.8	0	0	0	110.8	S36 Q37 T138	S36-L136 PolarHBondContact OG-O 2.87Å; Q37-L136 HydrophobicContact CB-CB 4.31Å; Q37-L136 WeakPolarHBondContact CB-O 3.17Å; Q37-L136 PolarHBondContact N-O 3.44Å; Q37-L136 PolarHBondContact O-N 3.4Å; L136-T138 PolarHBondContact O-N 3.42Å
137	A	90.5	Very high	81	Confident	65 Å²	65	62 Å²	62	54%	0.537	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.8	46.1	176	0	0	0	0	0	112.5	Q37	Q37-A137 HydrophobicContact CG-CB 4.31Å
138	T	92.1	Very high	81.2	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.018	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	135.6	-175.8	-51.6	0	0	0	0	110.5	F34 C35 S36 L136 S150 L151 F157	F34-T138 HydrophobicContact CD2-CG2 4.09Å; F34-T138 HydrophobicContact CE1-CG2 4.5Å; F34-T138 HydrophobicContact CE2-CG2 3.18Å; F34-T138 HydrophobicContact CZ-CG2 3.44Å; F34-T138 VanDerWaalsContact CZ-CG2 3.44Å; C35-T138 CarbonylContact O-C 3.59Å; C35-T138 WeakPolarHBondContact O-CA 3.19Å; S36-T138 PolarHBondContact OG-OG1 3.46Å; L136-T138 PolarHBondContact O-N 3.42Å; T138-S150 WeakPolarHBondContact O-CA 3.33Å; T138-L151 HydrophobicContact CG2-CB 3.93Å; T138-L151 HydrophobicContact CG2-CD1 4.05Å; T138-L151 HydrophobicContact CG2-CG 4.44Å; T138-L151 PolarHBondContact O-N 3.36Å; T138-F157 HydrophobicContact CG2-CD2 4.36Å; T138-F157 HydrophobicContact CG2-CE1 4.21Å; T138-F157 HydrophobicContact CG2-CE2 3.81Å; T138-F157 HydrophobicContact CG2-CZ 3.73Å
139	S	92.3	Very high	81.8	Confident	29 Å²	29	63.8 Å²	63.8	20%	0.203	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	147.4	173	55.1	0	0	0	0	111.2	F34 C35 I149	F34-S139 WeakPolarHBondContact CA-O 3.32Å; C35-S139 PolarHBondContact N-O 2.99Å; C35-S139 PolarHBondContact O-N 3.24Å; S139-I149 CarbonylContact C-O 3.56Å; S139-I149 WeakPolarHBondContact CA-O 2.96Å
140	V	91.7	Very high	82.9	Confident	10 Å²	10	60.3 Å²	60.3	6%	0.061	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.7	177	67.2	0	0	0	0	110.5	F32 R33 I149 L151 F159	F32-V140 HydrophobicContact CD2-CG2 4.25Å; F32-V140 HydrophobicContact CE2-CG2 3.55Å; F32-V140 HydrophobicContact CZ-CG2 4.01Å; R33-V140 CarbonylContact O-C 3.48Å; R33-V140 WeakPolarHBondContact O-CA 3.37Å; V140-I149 HydrophobicContact CG1-CB 4.03Å; V140-I149 PolarHBondContact N-O 2.91Å; V140-I149 PolarHBondContact O-N 2.97Å; V140-L151 HydrophobicContact CB-CD1 4.17Å; V140-L151 HydrophobicContact CG1-CD1 3.88Å; V140-L151 HydrophobicContact CG1-CD2 4.35Å; V140-L151 HydrophobicContact CG1-CG 4.15Å; V140-F159 HydrophobicContact CB-CE1 4.23Å; V140-F159 HydrophobicContact CB-CZ 4.4Å; V140-F159 HydrophobicContact CG1-CE1 4.37Å; V140-F159 HydrophobicContact CG2-CD1 4.47Å; V140-F159 HydrophobicContact CG2-CE1 3.81Å; V140-F159 HydrophobicContact CG2-CZ 4.14Å
141	T	87.9	Confident	84	Confident	14 Å²	14	59.1 Å²	59.1	9%	0.086	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	148.1	169.6	39.5	0	0	0	0	109.6	F32 R33 N148	F32-T141 WeakPolarHBondContact CA-O 3.2Å; R33-T141 WeakPolarHBondContact CB-OG1 3.44Å; R33-T141 PolarHBondContact N-O 3.46Å; R33-T141 PolarHBondContact NE-OG1 3.15Å; R33-T141 PolarHBondContact O-N 3.21Å; R33-T141 PolarHBondContact O-OG1 3.18Å; T141-N148 HydrophobicContact CG2-CB 4.21Å; T141-N148 WeakPolarHBondContact CG2-OD1 3.45Å
142	S	84.3	Confident	84.8	Confident	10 Å²	10	52.6 Å²	52.6	7%	0.07	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	166.4	177.7	61.6	0	0	0	0	110.5	D31 W144 S145	D31-S142 WeakPolarHBondContact O-CA 3.31Å; S142-W144 VanDerWaalsContact CB-CE2 3.41Å; S142-W144 PolarHBondContact O-N 2.86Å; S142-W144 WeakPolarHBondContact OG-CZ2 2.92Å; S142-W144 PolarHBondContact OG-NE1 3.37Å; S142-W144 VanDerWaalsContact OG-NE1 3.12Å; S142-S145 PolarHBondContact N-O 3.4Å; S142-S145 CarbonylContact O-C 3.59Å; S142-S145 PolarHBondContact O-N 2.94Å; S142-S145 PolarHBondContact OG-N 3.04Å
143	W	78.4	Confident	85.3	Confident	38 Å²	38	54.3 Å²	54.3	14%	0.144	32%	0.321	C	S	.	.	S	Bend	trans	-63.4	-28.3	178.9	72.5	-92.9	0	0	0	113.6	D31 K180 F228	D31-W143 PolarHBondContact O-N 3.3Å; W143-K180 HydrophobicContact CE3-CD 4.26Å; W143-K180 HydrophobicContact CH2-CB 3.82Å; W143-K180 HydrophobicContact CH2-CD 4.06Å; W143-K180 HydrophobicContact CH2-CG 3.8Å; W143-K180 HydrophobicContact CZ2-CB 4.38Å; W143-K180 HydrophobicContact CZ2-CG 4.09Å; W143-K180 HydrophobicContact CZ3-CB 4.39Å; W143-K180 HydrophobicContact CZ3-CD 3.86Å; W143-K180 HydrophobicContact CZ3-CG 4.14Å; W143-F228 HydrophobicContact CZ3-CD1 4.12Å; W143-F228 HydrophobicContact CZ3-CE1 4.16Å
144	W	70.9	Confident	85.4	Confident	62 Å²	62	53 Å²	53	24%	0.235	31%	0.314	C	S	.	.	S	Bend	trans	-83.3	-25.7	177.1	65.6	80.2	0	0	0	113	F122 S142 F161 M176	F122-W144 HydrophobicContact CB-CD2 3.6Å; F122-W144 HydrophobicContact CB-CE3 3.64Å; F122-W144 HydrophobicContact CB-CH2 3.18Å; F122-W144 HydrophobicContact CB-CZ2 3.11Å; F122-W144 HydrophobicContact CB-CZ3 3.43Å; F122-W144 VanDerWaalsContact CB-CZ3 3.43Å; F122-W144 AromaticContact CD1-CE2 3.7Å; F122-W144 HydrophobicContact CD1-CH2 4.42Å; F122-W144 AromaticContact CD1-CZ2 3.58Å; F122-W144 HydrophobicContact CD1-CZ2 3.58Å; F122-W144 AromaticContact CD1-NE1 3.74Å; F122-W144 AromaticContact CD2-CH2 3.31Å; F122-W144 HydrophobicContact CD2-CH2 3.31Å; F122-W144 AromaticContact CD2-CZ2 3.12Å; F122-W144 HydrophobicContact CD2-CZ2 3.12Å; F122-W144 HydrophobicContact CD2-CZ3 4.37Å; F122-W144 HydrophobicContact CE1-CZ2 4.24Å; F122-W144 HydrophobicContact CE2-CH2 4.29Å; F122-W144 AromaticContact CE2-CZ2 3.87Å; F122-W144 HydrophobicContact CE2-CZ2 3.87Å; F122-W144 HydrophobicContact CG-CD2 4.27Å; F122-W144 AromaticContact CG-CE2 3.41Å; F122-W144 VanDerWaalsContact CG-CE2 3.41Å; F122-W144 AromaticContact CG-CH2 3.38Å; F122-W144 HydrophobicContact CG-CH2 3.38Å; F122-W144 AromaticContact CG-CZ2 2.94Å; F122-W144 HydrophobicContact CG-CZ2 2.94Å; F122-W144 HydrophobicContact CG-CZ3 4.17Å; F122-W144 AromaticContact CG-NE1 3.96Å; F122-W144 HydrophobicContact CZ-CZ2 4.35Å; S142-W144 VanDerWaalsContact CB-CE2 3.41Å; S142-W144 PolarHBondContact O-N 2.86Å; S142-W144 WeakPolarHBondContact OG-CZ2 2.92Å; S142-W144 PolarHBondContact OG-NE1 3.37Å; S142-W144 VanDerWaalsContact OG-NE1 3.12Å; W144-F161 AromaticContact CH2-CE1 4Å; W144-F161 HydrophobicContact CH2-CE1 4Å; W144-F161 HydrophobicContact CZ3-CE1 4.28Å; W144-M176 HydrophobicContact CB-CE 4.36Å
145	S	72.2	Confident	85.5	Confident	28 Å²	28	50 Å²	50	20%	0.196	30%	0.295	C	S	.	.			trans	-129.9	85.7	176.7	179.6	0	0	0	0	108.8	S142 Q147	S142-S145 PolarHBondContact N-O 3.4Å; S142-S145 CarbonylContact O-C 3.59Å; S142-S145 PolarHBondContact O-N 2.94Å; S142-S145 PolarHBondContact OG-N 3.04Å; S145-Q147 PolarHBondContact O-N 3.47Å; S145-Q147 VanDerWaalsContact O-N 3.14Å
146	P	70.5	Confident	85.5	Confident	103 Å²	103	50.3 Å²	50.3	67%	0.669	30%	0.297	S	S	*	.			trans	-69	-10.4	-177.8	26.4	-33.7	0	0	0	113.1
147	Q	77.5	Confident	85.6	Confident	152 Å²	152	47 Å²	47	71%	0.71	28%	0.28	S	S	*	.	S	Bend	trans	-72.3	135.1	174.6	-63.7	-176.7	-2.7	0	0	110.6	S145 I149	S145-Q147 PolarHBondContact O-N 3.47Å; S145-Q147 VanDerWaalsContact O-N 3.14Å; Q147-I149 PolarHBondContact O-N 2.96Å; Q147-I149 VanDerWaalsContact O-N 3.09Å
148	N	82.9	Confident	85.7	Confident	105 Å²	105	45.2 Å²	45.2	56%	0.561	26%	0.262	S	S	*	.			trans	-65.2	107.2	171.3	-84.8	-27.5	0	0	0	109.2	R33 T141	R33-N148 PolarHBondContact NH2-OD1 2.67Å; T141-N148 HydrophobicContact CG2-CB 4.21Å; T141-N148 WeakPolarHBondContact CG2-OD1 3.45Å
149	I	86.5	Confident	85.7	Confident	78 Å²	78	45.1 Å²	45.1	40%	0.4	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	118.5	174.5	-58.8	172.2	0	0	0	107.6	S139 V140 Q147 L151	S139-I149 CarbonylContact C-O 3.56Å; S139-I149 WeakPolarHBondContact CA-O 2.96Å; V140-I149 HydrophobicContact CG1-CB 4.03Å; V140-I149 PolarHBondContact N-O 2.91Å; V140-I149 PolarHBondContact O-N 2.97Å; Q147-I149 PolarHBondContact O-N 2.96Å; Q147-I149 VanDerWaalsContact O-N 3.09Å; I149-L151 HydrophobicContact CG2-CD2 4.06Å
150	S	89.7	Confident	85.6	Confident	104 Å²	104	45 Å²	45	73%	0.727	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	131.1	172.3	56.2	0	0	0	0	110.3	T138	T138-S150 WeakPolarHBondContact O-CA 3.33Å
151	L	88.4	Confident	85.4	Confident	21 Å²	21	44.9 Å²	44.9	11%	0.11	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149.1	178.8	-60.2	-179.1	0	0	0	110.8	Q125 T138 V140 I149 F157 F159	Q125-L151 VanDerWaalsContact NE2-CD1 3.27Å; T138-L151 HydrophobicContact CG2-CB 3.93Å; T138-L151 HydrophobicContact CG2-CD1 4.05Å; T138-L151 HydrophobicContact CG2-CG 4.44Å; T138-L151 PolarHBondContact O-N 3.36Å; V140-L151 HydrophobicContact CB-CD1 4.17Å; V140-L151 HydrophobicContact CG1-CD1 3.88Å; V140-L151 HydrophobicContact CG1-CD2 4.35Å; V140-L151 HydrophobicContact CG1-CG 4.15Å; I149-L151 HydrophobicContact CG2-CD2 4.06Å; L151-F157 HydrophobicContact CB-CE1 4Å; L151-F157 HydrophobicContact CD1-CD1 4.06Å; L151-F157 HydrophobicContact CD1-CE1 4.08Å; L151-F159 HydrophobicContact CD1-CE1 4.26Å; L151-F159 HydrophobicContact CD1-CZ 4.07Å
152	P	88.9	Confident	85.3	Confident	70 Å²	70	46.7 Å²	46.7	46%	0.455	27%	0.267	S	S	.	.			trans	-66.2	159.3	175.9	30.9	-37	0	0	0	111.4	E127 A154 F157	E127-P152 VanDerWaalsContact CD-CG 3.48Å; E127-P152 VanDerWaalsContact OE1-CD 3.29Å; E127-P152 WeakPolarHBondContact OE1-CD 3.41Å; E127-P152 WeakPolarHBondContact OE1-CG 3.24Å; E127-P152 WeakPolarHBondContact OE2-CG 3.48Å; P152-A154 PolarHBondContact O-N 3.39Å; P152-F157 VanDerWaalsContact O-CZ 3.25Å; P152-F157 WeakPolarHBondContact O-CZ 3.34Å
153	S	88.3	Confident	85.2	Confident	74 Å²	74	49 Å²	49	52%	0.517	28%	0.283	S	S	.	.			trans	-69.4	121.2	179.3	-56.5	0	0	0	0	111.3	L135	L135-S153 VanDerWaalsContact O-CA 3.23Å; L135-S153 WeakPolarHBondContact O-CA 3.48Å; L135-S153 VanDerWaalsContact O-CB 3.28Å; L135-S153 WeakPolarHBondContact O-CB 3.34Å
154	A	90.2	Very high	85.1	Confident	10 Å²	10	48 Å²	48	8%	0.083	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-141.9	157.6	177.9	0	0	0	0	0	110.8	L135 P152 S156 F157	L135-A154 VanDerWaalsContact CB-O 3.31Å; L135-A154 WeakPolarHBondContact CB-O 3.16Å; L135-A154 PolarHBondContact N-O 3.31Å; P152-A154 PolarHBondContact O-N 3.39Å; A154-S156 VanDerWaalsContact C-N 3.33Å; A154-F157 HydrophobicContact CB-CE1 4.03Å; A154-F157 HydrophobicContact CB-CE2 4.14Å; A154-F157 HydrophobicContact CB-CZ 3.71Å
155	A	90.7	Very high	85.1	Confident	6 Å²	6	47.2 Å²	47.2	5%	0.05	28%	0.284	C	S	.	.	S	Bend	trans	-76.3	-23.8	177.1	0	0	0	0	0	112.6	N60 A130	N60-A155 VanDerWaalsContact CB-O 3.28Å; N60-A155 WeakPolarHBondContact CB-O 3.37Å; N60-A155 PolarHBondContact N-O 2.93Å; A130-A155 HydrophobicContact CB-CB 4.16Å; A130-A155 WeakPolarHBondContact O-CB 3.5Å
156	S	91.9	Very high	84.9	Confident	6 Å²	6	54.2 Å²	54.2	4%	0.042	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	140.4	-178.6	58	0	0	0	0	112.5	I58 S128 A154	I58-S156 WeakPolarHBondContact O-CA 3.3Å; S128-S156 WeakPolarHBondContact CB-OG 3.36Å; S128-S156 PolarHBondContact N-O 3.47Å; S128-S156 PolarHBondContact O-OG 2.92Å; S128-S156 VanDerWaalsContact O-OG 3.05Å; S128-S156 PolarHBondContact OG-OG 3.32Å; A154-S156 VanDerWaalsContact C-N 3.33Å
157	F	92.9	Very high	84.4	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.9	174.6	-64.1	-86.1	0	0	0	109.7	F34 S57 I58 E127 L135 T138 L151 P152 A154 F159	F34-F157 HydrophobicContact CE2-CB 4.14Å; F34-F157 HydrophobicContact CE2-CD1 4.5Å; F34-F157 AromaticContact CE2-CD2 3.78Å; F34-F157 HydrophobicContact CE2-CD2 3.78Å; F34-F157 HydrophobicContact CE2-CE2 4.31Å; F34-F157 AromaticContact CE2-CG 3.88Å; F34-F157 HydrophobicContact CE2-CG 3.88Å; F34-F157 HydrophobicContact CZ-CB 4.44Å; F34-F157 AromaticContact CZ-CD2 3.53Å; F34-F157 HydrophobicContact CZ-CD2 3.53Å; F34-F157 HydrophobicContact CZ-CE2 4Å; F34-F157 HydrophobicContact CZ-CG 4.1Å; S57-F157 CarbonylContact C-O 3.05Å; S57-F157 VanDerWaalsContact CA-O 3.24Å; S57-F157 WeakPolarHBondContact CA-O 3.44Å; I58-F157 PolarHBondContact N-O 3.18Å; I58-F157 PolarHBondContact O-N 3.19Å; E127-F157 HydrophobicContact CG-CD1 4.09Å; E127-F157 HydrophobicContact CG-CE1 4.09Å; L135-F157 HydrophobicContact CB-CE2 4.05Å; L135-F157 HydrophobicContact CD1-CD2 4.04Å; L135-F157 HydrophobicContact CD1-CE2 4.01Å; T138-F157 HydrophobicContact CG2-CD2 4.36Å; T138-F157 HydrophobicContact CG2-CE1 4.21Å; T138-F157 HydrophobicContact CG2-CE2 3.81Å; T138-F157 HydrophobicContact CG2-CZ 3.73Å; L151-F157 HydrophobicContact CB-CE1 4Å; L151-F157 HydrophobicContact CD1-CD1 4.06Å; L151-F157 HydrophobicContact CD1-CE1 4.08Å; P152-F157 VanDerWaalsContact O-CZ 3.25Å; P152-F157 WeakPolarHBondContact O-CZ 3.34Å; A154-F157 HydrophobicContact CB-CE1 4.03Å; A154-F157 HydrophobicContact CB-CE2 4.14Å; A154-F157 HydrophobicContact CB-CZ 3.71Å; F157-F159 HydrophobicContact CB-CE2 3.79Å; F157-F159 HydrophobicContact CB-CZ 4.08Å
158	T	92.2	Very high	83.4	Confident	27 Å²	27	50.1 Å²	50.1	17%	0.166	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.9	174.1	-58.4	0	0	0	0	109.8	R55 S57 Q125 E126	R55-T158 HydrophobicContact CB-CG2 4.2Å; S57-T158 WeakPolarHBondContact CB-OG1 3.25Å; Q125-T158 WeakPolarHBondContact CA-O 3.31Å; E126-T158 PolarHBondContact N-O 3.35Å; E126-T158 PolarHBondContact O-N 2.95Å
159	F	92.1	Very high	82.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	117.6	175.9	-56.3	-85.6	0	0	0	108.2	F32 F34 R55 I56 I58 F122 Q125 V140 L151 F157 F161	F32-F159 HydrophobicContact CE2-CB 4.33Å; F32-F159 AromaticContact CE2-CD1 3.97Å; F32-F159 HydrophobicContact CE2-CD1 3.97Å; F32-F159 HydrophobicContact CE2-CD2 4.16Å; F32-F159 HydrophobicContact CE2-CE1 4.32Å; F32-F159 AromaticContact CE2-CG 3.88Å; F32-F159 HydrophobicContact CE2-CG 3.88Å; F32-F159 HydrophobicContact CZ-CB 4.45Å; F32-F159 HydrophobicContact CZ-CD1 4.2Å; F32-F159 AromaticContact CZ-CD2 3.61Å; F32-F159 HydrophobicContact CZ-CD2 3.61Å; F32-F159 HydrophobicContact CZ-CE1 4.38Å; F32-F159 AromaticContact CZ-CE2 3.83Å; F32-F159 HydrophobicContact CZ-CE2 3.83Å; F32-F159 AromaticContact CZ-CG 3.81Å; F32-F159 HydrophobicContact CZ-CG 3.81Å; F32-F159 HydrophobicContact CZ-CZ 4.22Å; F34-F159 AromaticContact CD2-CE2 3.65Å; F34-F159 HydrophobicContact CD2-CE2 3.65Å; F34-F159 AromaticContact CD2-CZ 3.54Å; F34-F159 HydrophobicContact CD2-CZ 3.54Å; F34-F159 AromaticContact CE2-CE2 3.98Å; F34-F159 HydrophobicContact CE2-CE2 3.98Å; F34-F159 AromaticContact CE2-CZ 3.85Å; F34-F159 HydrophobicContact CE2-CZ 3.85Å; F34-F159 HydrophobicContact CG-CE2 4.38Å; R55-F159 CarbonylContact C-O 3.31Å; R55-F159 WeakPolarHBondContact CA-O 3.43Å; R55-F159 WeakPolarHBondContact CB-O 3.17Å; I56-F159 PolarHBondContact N-O 3.42Å; I56-F159 PolarHBondContact O-N 3.37Å; I58-F159 HydrophobicContact CD1-CD2 4.09Å; I58-F159 HydrophobicContact CD1-CE2 3.73Å; F122-F159 HydrophobicContact CE2-CB 4.42Å; F122-F159 HydrophobicContact CE2-CD1 4.07Å; Q125-F159 HydrophobicContact CB-CD1 4.09Å; Q125-F159 HydrophobicContact CB-CE1 4.31Å; Q125-F159 HydrophobicContact CG-CD1 3.98Å; Q125-F159 HydrophobicContact CG-CE1 3.79Å; V140-F159 HydrophobicContact CB-CE1 4.23Å; V140-F159 HydrophobicContact CB-CZ 4.4Å; V140-F159 HydrophobicContact CG1-CE1 4.37Å; V140-F159 HydrophobicContact CG2-CD1 4.47Å; V140-F159 HydrophobicContact CG2-CE1 3.81Å; V140-F159 HydrophobicContact CG2-CZ 4.14Å; L151-F159 HydrophobicContact CD1-CE1 4.26Å; L151-F159 HydrophobicContact CD1-CZ 4.07Å; F157-F159 HydrophobicContact CB-CE2 3.79Å; F157-F159 HydrophobicContact CB-CZ 4.08Å; F159-F161 HydrophobicContact CB-CE2 3.89Å; F159-F161 HydrophobicContact CB-CZ 4.04Å; F159-F161 WeakPolarHBondContact O-CD2 3.33Å; F159-F161 WeakPolarHBondContact O-CE2 3.49Å
160	S	89.6	Confident	80.6	Confident	28 Å²	28	52.6 Å²	52.6	20%	0.196	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	143.4	176.8	58.4	0	0	0	0	110.8	Q123 H124	Q123-S160 PolarHBondContact N-O 3.27Å; H124-S160 PolarHBondContact N-OG 3.31Å; H124-S160 VanDerWaalsContact N-OG 3.08Å; H124-S160 PolarHBondContact O-N 3.19Å; H124-S160 PolarHBondContact O-OG 3.23Å
161	F	88.5	Confident	78.8	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.026	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	156.2	178.9	-54.8	-94.3	0	0	0	110.4	F32 L54 I56 W94 L120 C121 W144 F159	F32-F161 HydrophobicContact CD2-CZ 4.13Å; F32-F161 HydrophobicContact CE2-CZ 4.3Å; L54-F161 HydrophobicContact CB-CB 4.44Å; L54-F161 VanDerWaalsContact CB-O 3.24Å; L54-F161 WeakPolarHBondContact CB-O 3.42Å; L54-F161 WeakPolarHBondContact O-CA 3.2Å; L54-F161 WeakPolarHBondContact O-CB 3.43Å; L54-F161 PolarHBondContact O-N 3.11Å; I56-F161 HydrophobicContact CB-CE2 3.96Å; I56-F161 HydrophobicContact CD1-CE2 3.68Å; I56-F161 HydrophobicContact CD1-CZ 3.85Å; I56-F161 HydrophobicContact CG1-CD2 4.44Å; I56-F161 HydrophobicContact CG1-CE2 3.62Å; I56-F161 HydrophobicContact CG1-CZ 4.3Å; W94-F161 HydrophobicContact CZ3-CD1 4.43Å; W94-F161 HydrophobicContact CZ3-CE1 4.03Å; W94-F161 HydrophobicContact CZ3-CZ 4.44Å; L120-F161 HydrophobicContact CB-CB 3.77Å; L120-F161 HydrophobicContact CB-CD1 4.07Å; L120-F161 HydrophobicContact CB-CG 4.05Å; L120-F161 HydrophobicContact CD1-CB 4.47Å; C121-F161 CarbonylContact O-C 3.58Å; C121-F161 WeakPolarHBondContact O-CA 3.48Å; C121-F161 VanDerWaalsContact O-CB 3.28Å; C121-F161 WeakPolarHBondContact O-CB 3.39Å; W144-F161 AromaticContact CH2-CE1 4Å; W144-F161 HydrophobicContact CH2-CE1 4Å; W144-F161 HydrophobicContact CZ3-CE1 4.28Å; F159-F161 HydrophobicContact CB-CE2 3.89Å; F159-F161 HydrophobicContact CB-CZ 4.04Å; F159-F161 WeakPolarHBondContact O-CD2 3.33Å; F159-F161 WeakPolarHBondContact O-CE2 3.49Å
162	H	84.9	Confident	77.4	Confident	52 Å²	52	57.8 Å²	57.8	24%	0.241	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	154.3	170.3	68.7	93.4	0	0	0	110.5	C121 F122 D175	C121-H162 PolarHBondContact N-O 2.66Å; C121-H162 PolarHBondContact O-CD2 2.72Å; C121-H162 PolarHBondContact O-N 2.92Å; F122-H162 PolarHBondContact O-CD2 2.85Å; F122-H162 VanDerWaalsContact O-CD2 3.29Å; F122-H162 PolarHBondContact O-NE2 3.04Å; H162-D175 IonicContact CE1-OD2 2.99Å
163	S	82.3	Confident	76.2	Confident	58 Å²	58	57 Å²	57	41%	0.406	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-76.2	153.3	167.5	-60.5	0	0	0	0	110.2	L54	L54-S163 WeakPolarHBondContact CD1-OG 3.42Å
164	P	76	Confident	75.2	Confident	19 Å²	19	54.8 Å²	54.8	12%	0.123	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-59.5	141.1	171.6	23.7	-33	0	0	0	110.5	L119 H166 C177 R181	L119-P164 HydrophobicContact CD2-CG 4.29Å; P164-H166 PolarHBondContact O-N 3.49Å; P164-C177 VanDerWaalsContact CA-SG 3.53Å; P164-C177 HydrophobicContact CB-CB 4.48Å; P164-R181 HydrophobicContact CB-CB 3.97Å; P164-R181 HydrophobicContact CB-CG 4.35Å; P164-R181 HydrophobicContact CG-CB 4.1Å; P164-R181 HydrophobicContact CG-CG 4.09Å
165	P	71.9	Confident	74.6	Confident	44 Å²	44	57 Å²	57	29%	0.286	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-60.1	137.4	-179.5	23.7	-32.3	0	0	0	111.3	E178 R181	P165-E178 HydrophobicContact CG-CB 4.17Å; P165-R181 PolarHBondContact O-NH1 2.81Å
166	H	66.3	Low	74.2	Confident	175 Å²	175	58.5 Å²	58.5	81%	0.81	34%	0.343	S	S	*	.	S	Bend	trans	-72	-32.3	178.7	-76.3	-64.8	0	0	0	112.5	P164	P164-H166 PolarHBondContact O-N 3.49Å
167	T	61	Low	73.7	Confident	118 Å²	118	58.3 Å²	58.3	72%	0.724	34%	0.342	S	S	*	.	S	Bend	trans	-107	132	179.3	35.2	0	0	0	0	111	A169	T167-A169 PolarHBondContact O-N 3.31Å
168	A	56.5	Low	73.3	Confident	51 Å²	51	59 Å²	59	42%	0.421	35%	0.345	S	S	.	.			trans	-64.1	125.8	174.4	0	0	0	0	0	109.8	H170 E178	A168-H170 PolarHBondContact O-N 2.93Å; A168-E178 WeakPolarHBondContact CA-OE1 3.23Å; A168-E178 WeakPolarHBondContact CB-OE1 3.4Å
169	A	55.8	Low	73	Confident	59 Å²	59	57.7 Å²	57.7	49%	0.488	34%	0.337	S	S	.	.			trans	-73.6	101.3	173.8	0	0	0	0	0	108.8	T167 N171 A172	T167-A169 PolarHBondContact O-N 3.31Å; A169-N171 PolarHBondContact O-N 3.17Å; A169-A172 HydrophobicContact CB-CB 3.9Å
170	H	54.8	Low	72.8	Confident	176 Å²	176	58 Å²	58	82%	0.815	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.7	-173.1	-77.9	-70.9	0	0	0	115.4	A168	A168-H170 PolarHBondContact O-N 2.93Å
171	N	52.3	Low	72.6	Confident	171 Å²	171	59.2 Å²	59.2	91%	0.914	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.1	11.4	-173.3	-74	-26.1	0	0	0	115	A169	A169-N171 PolarHBondContact O-N 3.17Å
172	A	57.5	Low	72.5	Confident	63 Å²	63	60.3 Å²	60.3	52%	0.521	35%	0.345	S	S	.	.	S	Bend	trans	-103.7	157.8	173.7	0	0	0	0	0	110.4	A169 V174	A169-A172 HydrophobicContact CB-CB 3.9Å; A172-V174 PolarHBondContact O-N 3.47Å
173	S	63.7	Low	72.7	Confident	53 Å²	53	57.9 Å²	57.9	37%	0.371	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-52.7	134.4	168.6	52.1	0	0	0	0	109.6	D175	S173-D175 PolarHBondContact O-N 3.28Å
174	V	69	Low	73	Confident	28 Å²	28	57 Å²	57	17%	0.17	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-54.7	123.8	179.9	174.9	0	0	0	0	109.5	A172 L179 K215 S218	A172-V174 PolarHBondContact O-N 3.47Å; V174-L179 HydrophobicContact CG1-CB 4Å; V174-K215 HydrophobicContact CG2-CG 4.38Å; V174-S218 WeakPolarHBondContact CG2-OG 3.32Å
175	D	76.8	Confident	73.5	Confident	58 Å²	58	60.4 Å²	60.4	31%	0.31	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65	133.2	173.9	178.6	17.4	0	0	0	109	H162 S173 C177 E178 L179	H162-D175 IonicContact CE1-OD2 2.99Å; S173-D175 PolarHBondContact O-N 3.28Å; D175-C177 PolarHBondContact O-N 3.1Å; D175-C177 VanDerWaalsContact O-N 3.17Å; D175-C177 PolarHBondContact OD1-N 2.9Å; D175-C177 VanDerWaalsContact OD2-CB 3.22Å; D175-C177 WeakPolarHBondContact OD2-CB 3.24Å; D175-E178 HydrophobicContact CB-CB 4.1Å; D175-E178 PolarHBondContact O-N 3.31Å; D175-E178 VanDerWaalsContact O-N 3.11Å; D175-L179 PolarHBondContact O-N 3.43Å
176	M	81.6	Confident	74.3	Confident	37 Å²	37	59.4 Å²	59.4	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-55.6	-33.5	176.2	-70.9	178.3	65.1	0	0	111.1	W144 K180 V219 R220 F221 V226 F228	W144-M176 HydrophobicContact CB-CE 4.36Å; M176-K180 WeakPolarHBondContact O-CB 3.35Å; M176-K180 PolarHBondContact O-N 2.77Å; M176-V219 HydrophobicContact CB-CG2 4.37Å; M176-V219 HydrophobicContact CG-CG2 3.47Å; M176-V219 VanDerWaalsContact CG-CG2 3.47Å; M176-R220 VanDerWaalsContact SD-O 3.37Å; M176-F221 HydrophobicContact SD-CB 4.23Å; M176-V226 HydrophobicContact CE-CG2 3.94Å; M176-F228 HydrophobicContact CB-CE1 4.49Å; M176-F228 HydrophobicContact CE-CE1 4.44Å; M176-F228 HydrophobicContact CE-CZ 4.38Å
177	C	82.3	Confident	75.3	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.014	30%	0.295	C	S	.	.	H	α-helix	trans	-69.8	-42.4	178.1	-161.6	0	0	0	0	112.7	C121 P164 D175 L179 K180 R181	C121-C177 HydrophobicContact CB-CB 3.62Å; C121-C177 WeakPolarHBondContact CB-SG 3.37Å; C121-C177 WeakPolarHBondContact SG-CA 3.32Å; C121-C177 WeakPolarHBondContact SG-CB 3.33Å; C121-C177 CovalentContact SG-SG 2.01Å; C121-C177 PolarHBondContact SG-SG 3.4Å; P164-C177 VanDerWaalsContact CA-SG 3.53Å; P164-C177 HydrophobicContact CB-CB 4.48Å; D175-C177 PolarHBondContact O-N 3.1Å; D175-C177 VanDerWaalsContact O-N 3.17Å; D175-C177 PolarHBondContact OD1-N 2.9Å; D175-C177 VanDerWaalsContact OD2-CB 3.22Å; D175-C177 WeakPolarHBondContact OD2-CB 3.24Å; C177-L179 VanDerWaalsContact C-N 3.34Å; C177-K180 PolarHBondContact O-N 2.87Å; C177-R181 PolarHBondContact O-N 3.3Å
178	E	83.2	Confident	76.5	Confident	13 Å²	13	50.5 Å²	50.5	6%	0.061	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-46.5	174.9	-173.9	-178.5	176.2	0	0	110.6	P165 A168 D175 K180 R181 D182	P165-E178 HydrophobicContact CG-CB 4.17Å; A168-E178 WeakPolarHBondContact CA-OE1 3.23Å; A168-E178 WeakPolarHBondContact CB-OE1 3.4Å; D175-E178 HydrophobicContact CB-CB 4.1Å; D175-E178 PolarHBondContact O-N 3.31Å; D175-E178 VanDerWaalsContact O-N 3.11Å; E178-K180 PolarHBondContact O-N 2.92Å; E178-R181 WeakPolarHBondContact O-CB 3.48Å; E178-R181 PolarHBondContact O-N 3.47Å; E178-D182 VanDerWaalsContact O-CG 3.29Å; E178-D182 PolarHBondContact O-N 3.21Å
179	L	86.7	Confident	77.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.2	-43.5	176.5	176.9	59.2	0	0	0	112.3	V174 D175 C177 R181 D182 L183 K215 L216 V219 F228	V174-L179 HydrophobicContact CG1-CB 4Å; D175-L179 PolarHBondContact O-N 3.43Å; C177-L179 VanDerWaalsContact C-N 3.34Å; L179-R181 VanDerWaalsContact C-N 3.34Å; L179-R181 PolarHBondContact O-N 2.97Å; L179-D182 PolarHBondContact O-N 2.92Å; L179-L183 HydrophobicContact CD1-CD1 4.31Å; L179-L183 HydrophobicContact CD1-CG 4.29Å; L179-L183 HydrophobicContact CG-CD1 4.23Å; L179-L183 WeakPolarHBondContact O-CB 2.93Å; L179-L183 WeakPolarHBondContact O-CG 3.33Å; L179-L183 PolarHBondContact O-N 3.36Å; L179-K215 HydrophobicContact CD1-CB 3.89Å; L179-L216 HydrophobicContact CD1-CD2 4.38Å; L179-L216 HydrophobicContact CD1-CG 4.27Å; L179-L216 HydrophobicContact CD2-CD2 3.86Å; L179-L216 HydrophobicContact CD2-CG 4.35Å; L179-V219 HydrophobicContact CD2-CB 4.11Å; L179-V219 HydrophobicContact CD2-CG1 4.42Å; L179-V219 HydrophobicContact CD2-CG2 4.1Å; L179-F228 HydrophobicContact CD2-CD2 4.39Å; L179-F228 HydrophobicContact CD2-CE1 4Å; L179-F228 HydrophobicContact CD2-CE2 3.84Å; L179-F228 HydrophobicContact CD2-CZ 3.64Å; L179-F228 HydrophobicContact CG-CE1 4.37Å; L179-F228 HydrophobicContact CG-CZ 4.49Å
180	K	87	Confident	79.2	Confident	7 Å²	7	47.9 Å²	47.9	3%	0.03	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-42.3	176.7	-171.7	66.5	165.4	163.2	0	111.6	L119 W143 M176 C177 E178 Q184 F228 E229 E230	L119-K180 HydrophobicContact CD1-CG 3.9Å; L119-K180 HydrophobicContact CD2-CG 4.3Å; W143-K180 HydrophobicContact CE3-CD 4.26Å; W143-K180 HydrophobicContact CH2-CB 3.82Å; W143-K180 HydrophobicContact CH2-CD 4.06Å; W143-K180 HydrophobicContact CH2-CG 3.8Å; W143-K180 HydrophobicContact CZ2-CB 4.38Å; W143-K180 HydrophobicContact CZ2-CG 4.09Å; W143-K180 HydrophobicContact CZ3-CB 4.39Å; W143-K180 HydrophobicContact CZ3-CD 3.86Å; W143-K180 HydrophobicContact CZ3-CG 4.14Å; M176-K180 WeakPolarHBondContact O-CB 3.35Å; M176-K180 PolarHBondContact O-N 2.77Å; C177-K180 PolarHBondContact O-N 2.87Å; E178-K180 PolarHBondContact O-N 2.92Å; K180-Q184 WeakPolarHBondContact O-CB 3.48Å; K180-Q184 PolarHBondContact O-N 2.9Å; K180-F228 HydrophobicContact CD-CD1 4.26Å; K180-E229 PolarHBondContact NZ-O 3.48Å; K180-E230 VanDerWaalsContact CD-OE1 3.28Å; K180-E230 WeakPolarHBondContact CD-OE1 3.44Å; K180-E230 WeakPolarHBondContact CE-OE1 3.45Å; K180-E230 IonicContact NZ-OE1 3.98Å; K180-E230 PolarHBondContact NZ-OE1 3.49Å
181	R	86.4	Confident	80.5	Confident	53 Å²	53	43.6 Å²	43.6	20%	0.2	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-44.7	174.9	-173.7	-161.1	66	-177.1	-4.6	111.6	L119 P164 P165 C177 E178 L179 Q184 L185	L119-R181 HydrophobicContact CD2-CB 3.8Å; L119-R181 HydrophobicContact CD2-CG 4.39Å; P164-R181 HydrophobicContact CB-CB 3.97Å; P164-R181 HydrophobicContact CB-CG 4.35Å; P164-R181 HydrophobicContact CG-CB 4.1Å; P164-R181 HydrophobicContact CG-CG 4.09Å; P165-R181 PolarHBondContact O-NH1 2.81Å; C177-R181 PolarHBondContact O-N 3.3Å; E178-R181 WeakPolarHBondContact O-CB 3.48Å; E178-R181 PolarHBondContact O-N 3.47Å; L179-R181 VanDerWaalsContact C-N 3.34Å; L179-R181 PolarHBondContact O-N 2.97Å; R181-Q184 WeakPolarHBondContact O-CB 2.97Å; R181-Q184 PolarHBondContact O-N 3.31Å; R181-L185 HydrophobicContact CG-CD1 4.47Å; R181-L185 WeakPolarHBondContact O-CG 3.45Å; R181-L185 PolarHBondContact O-N 3.1Å
182	D	87.4	Confident	81.6	Confident	30 Å²	30	40.5 Å²	40.5	16%	0.16	21%	0.21	C	C	.	.	H	α-helix	trans	-66.9	-39.7	-178.7	-68.8	-5.2	0	0	0	111.6	E178 L179 Q184 L185 L186 K215	E178-D182 VanDerWaalsContact O-CG 3.29Å; E178-D182 PolarHBondContact O-N 3.21Å; L179-D182 PolarHBondContact O-N 2.92Å; D182-Q184 VanDerWaalsContact C-N 3.33Å; D182-Q184 PolarHBondContact O-N 3.12Å; D182-L185 PolarHBondContact O-N 3.37Å; D182-L186 WeakPolarHBondContact O-CB 3.37Å; D182-L186 PolarHBondContact O-N 3.31Å; D182-K215 IonicContact OD2-NZ 2.82Å; D182-K215 PolarHBondContact OD2-NZ 3.16Å
183	L	89.1	Confident	82	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-40.2	170.4	-77.2	172.6	0	0	0	112.1	L179 L186 S187 L212 F228 E230 I233	L179-L183 HydrophobicContact CD1-CD1 4.31Å; L179-L183 HydrophobicContact CD1-CG 4.29Å; L179-L183 HydrophobicContact CG-CD1 4.23Å; L179-L183 WeakPolarHBondContact O-CB 2.93Å; L179-L183 WeakPolarHBondContact O-CG 3.33Å; L179-L183 PolarHBondContact O-N 3.36Å; L183-L186 PolarHBondContact O-N 3.06Å; L183-S187 VanDerWaalsContact O-CB 3.3Å; L183-S187 WeakPolarHBondContact O-CB 3.3Å; L183-S187 PolarHBondContact O-N 3.29Å; L183-L212 HydrophobicContact CD2-CD1 3.57Å; L183-L212 HydrophobicContact CG-CD1 4.4Å; L183-F228 HydrophobicContact CD1-CB 3.36Å; L183-F228 HydrophobicContact CD1-CD1 4.23Å; L183-F228 HydrophobicContact CD1-CG 3.84Å; L183-E230 HydrophobicContact CB-CG 4.02Å; L183-I233 HydrophobicContact CD2-CD1 3.66Å; L183-I233 HydrophobicContact CD2-CG1 4.26Å; L183-I233 HydrophobicContact CD2-CG2 4.27Å
184	Q	86.8	Confident	81.8	Confident	39 Å²	39	45.2 Å²	45.2	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-45.7	174.8	178.5	-172.4	-23.1	0	0	111.4	K180 R181 D182 L186 S187 Q188	K180-Q184 WeakPolarHBondContact O-CB 3.48Å; K180-Q184 PolarHBondContact O-N 2.9Å; R181-Q184 WeakPolarHBondContact O-CB 2.97Å; R181-Q184 PolarHBondContact O-N 3.31Å; D182-Q184 VanDerWaalsContact C-N 3.33Å; D182-Q184 PolarHBondContact O-N 3.12Å; Q184-L186 VanDerWaalsContact C-N 3.31Å; Q184-L186 PolarHBondContact O-N 3.33Å; Q184-S187 WeakPolarHBondContact O-CB 3.15Å; Q184-S187 PolarHBondContact O-N 3.39Å; Q184-Q188 WeakPolarHBondContact O-CG 3.23Å; Q184-Q188 PolarHBondContact O-N 3.36Å
185	L	87	Confident	81	Confident	91 Å²	91	51.7 Å²	51.7	48%	0.476	25%	0.246	S	C	.	.	H	α-helix	trans	-62	-41.2	177.1	-71.7	172.2	0	0	0	111.1	R181 D182 Q188 F189	R181-L185 HydrophobicContact CG-CD1 4.47Å; R181-L185 WeakPolarHBondContact O-CG 3.45Å; R181-L185 PolarHBondContact O-N 3.1Å; D182-L185 PolarHBondContact O-N 3.37Å; L185-Q188 PolarHBondContact O-N 3.37Å; L185-F189 PolarHBondContact O-N 2.67Å
186	L	88.7	Confident	79.5	Confident	23 Å²	23	50.2 Å²	50.2	12%	0.12	24%	0.241	C	C	.	.	H	α-helix	trans	-63.7	-45	174.5	-174.5	58.8	0	0	0	111.4	D182 L183 Q184 Q188 F189 L190 L212 I233 F293 L298	D182-L186 WeakPolarHBondContact O-CB 3.37Å; D182-L186 PolarHBondContact O-N 3.31Å; L183-L186 PolarHBondContact O-N 3.06Å; Q184-L186 VanDerWaalsContact C-N 3.31Å; Q184-L186 PolarHBondContact O-N 3.33Å; L186-Q188 VanDerWaalsContact C-N 3.31Å; L186-Q188 PolarHBondContact O-N 3.09Å; L186-F189 HydrophobicContact CD1-CD1 4.29Å; L186-F189 WeakPolarHBondContact O-CB 3.39Å; L186-F189 PolarHBondContact O-N 3.38Å; L186-F189 VanDerWaalsContact O-N 3.13Å; L186-L190 HydrophobicContact CG-CD1 4.37Å; L186-L190 VanDerWaalsContact O-CG 3.29Å; L186-L190 WeakPolarHBondContact O-CG 3.34Å; L186-L190 PolarHBondContact O-N 2.92Å; L186-L212 HydrophobicContact CD2-CD2 4.03Å; L186-I233 HydrophobicContact CD2-CD1 3.74Å; L186-F293 HydrophobicContact CD2-CE1 4.46Å; L186-L298 HydrophobicContact CD1-CD1 4.37Å
187	S	88.4	Confident	77.8	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-57.6	-42	175.1	-173.9	0	0	0	0	112.2	L183 Q184 L190 K191 R232	L183-S187 VanDerWaalsContact O-CB 3.3Å; L183-S187 WeakPolarHBondContact O-CB 3.3Å; L183-S187 PolarHBondContact O-N 3.29Å; Q184-S187 WeakPolarHBondContact O-CB 3.15Å; Q184-S187 PolarHBondContact O-N 3.39Å; S187-L190 PolarHBondContact O-N 3.32Å; S187-K191 WeakPolarHBondContact O-CG 3.34Å; S187-K191 PolarHBondContact O-N 3.08Å; S187-R232 PolarHBondContact OG-N 3.3Å; S187-R232 VanDerWaalsContact OG-N 3.16Å
188	Q	86.3	Confident	75.9	Confident	101 Å²	101	63.9 Å²	63.9	47%	0.472	31%	0.306	S	S	.	.	H	α-helix	trans	-65.6	-40.1	175.1	-72.5	177.8	-3.8	0	0	112.4	Q184 L185 L186 K191 H192	Q184-Q188 WeakPolarHBondContact O-CG 3.23Å; Q184-Q188 PolarHBondContact O-N 3.36Å; L185-Q188 PolarHBondContact O-N 3.37Å; L186-Q188 VanDerWaalsContact C-N 3.31Å; L186-Q188 PolarHBondContact O-N 3.09Å; Q188-K191 PolarHBondContact O-N 2.84Å; Q188-H192 PolarHBondContact O-N 3.28Å
189	F	84	Confident	73.6	Confident	52 Å²	52	72.2 Å²	72.2	23%	0.228	34%	0.337	C	S	.	.	H	α-helix	trans	-60.5	-46.9	173.2	171	-94.8	0	0	0	111.3	L185 L186 K191 H192 A196 L298	L185-F189 PolarHBondContact O-N 2.67Å; L186-F189 HydrophobicContact CD1-CD1 4.29Å; L186-F189 WeakPolarHBondContact O-CB 3.39Å; L186-F189 PolarHBondContact O-N 3.38Å; L186-F189 VanDerWaalsContact O-N 3.13Å; F189-K191 VanDerWaalsContact C-N 3.3Å; F189-K191 PolarHBondContact O-N 2.95Å; F189-H192 CarbonylContact O-C 3.47Å; F189-H192 VanDerWaalsContact O-C 3.23Å; F189-H192 PolarHBondContact O-N 2.81Å; F189-H192 VanDerWaalsContact O-N 3.1Å; F189-A196 HydrophobicContact CD2-CB 3.37Å; F189-A196 HydrophobicContact CE2-CB 3.38Å; F189-L298 HydrophobicContact CE1-CD2 4.05Å
190	L	84.7	Confident	71.3	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.021	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-34.2	177.7	-67.5	174.2	0	0	0	112.8	L186 S187 H192 R232 I233 F293 A297 L298	L186-L190 HydrophobicContact CG-CD1 4.37Å; L186-L190 VanDerWaalsContact O-CG 3.29Å; L186-L190 WeakPolarHBondContact O-CG 3.34Å; L186-L190 PolarHBondContact O-N 2.92Å; S187-L190 PolarHBondContact O-N 3.32Å; L190-H192 VanDerWaalsContact C-N 3.32Å; L190-H192 PolarHBondContact O-N 2.85Å; L190-R232 HydrophobicContact CB-CB 4.02Å; L190-R232 HydrophobicContact CB-CG 4.46Å; L190-R232 HydrophobicContact CD1-CB 4.21Å; L190-I233 HydrophobicContact CD1-CB 4.45Å; L190-F293 HydrophobicContact CD1-CD1 3.8Å; L190-F293 HydrophobicContact CD1-CE1 4.25Å; L190-A297 HydrophobicContact CD2-CB 3.93Å; L190-L298 HydrophobicContact CD2-CD1 4.08Å; L190-L298 HydrophobicContact CD2-CG 3.83Å
191	K	82.2	Confident	69.2	Low	86 Å²	86	83.3 Å²	83.3	37%	0.374	41%	0.412	S	S	.	.	H	α-helix	trans	-65	-34.7	174.2	-75.1	-175.5	-176.8	-174.5	0	112.8	S187 Q188 F189 D231 R232	S187-K191 WeakPolarHBondContact O-CG 3.34Å; S187-K191 PolarHBondContact O-N 3.08Å; Q188-K191 PolarHBondContact O-N 2.84Å; F189-K191 VanDerWaalsContact C-N 3.3Å; F189-K191 PolarHBondContact O-N 2.95Å; K191-D231 VanDerWaalsContact CE-CB 3.48Å; K191-D231 WeakPolarHBondContact CE-OD2 3.43Å; K191-D231 IonicContact NZ-OD2 3.74Å; K191-D231 PolarHBondContact NZ-OD2 3.39Å; K191-R232 HydrophobicContact CG-CG 3.59Å
192	H	75	Confident	67.6	Low	106 Å²	106	83.4 Å²	83.4	49%	0.491	42%	0.424	S	S	.	.			trans	-135.8	65.9	-170.8	-66.3	-13.5	0	0	0	112.3	Q188 F189 L190 Q194 K195	Q188-H192 PolarHBondContact O-N 3.28Å; F189-H192 CarbonylContact O-C 3.47Å; F189-H192 VanDerWaalsContact O-C 3.23Å; F189-H192 PolarHBondContact O-N 2.81Å; F189-H192 VanDerWaalsContact O-N 3.1Å; L190-H192 VanDerWaalsContact C-N 3.32Å; L190-H192 PolarHBondContact O-N 2.85Å; H192-Q194 VanDerWaalsContact C-N 3.26Å; H192-Q194 PolarHBondContact O-N 3.27Å; H192-K195 HydrophobicContact CB-CB 4.43Å; H192-K195 HydrophobicContact CB-CD 4.45Å; H192-K195 PolarHBondContact O-N 2.85Å
193	P	65.7	Low	66.4	Low	49 Å²	49	84 Å²	84	32%	0.318	43%	0.433	S	S	.	.	H	α-helix	trans	-60.5	-35.6	-176.1	22.7	-32.6	0	0	0	112.5	K195 A196 S197 A297	P193-K195 PolarHBondContact O-N 3.47Å; P193-A196 PolarHBondContact O-N 3.02Å; P193-S197 PolarHBondContact O-N 3.39Å; P193-A297 HydrophobicContact CB-CB 4.15Å; P193-A297 HydrophobicContact CG-CB 4.4Å
194	Q	58.7	Low	65.6	Low	165 Å²	165	86.1 Å²	86.1	77%	0.771	45%	0.447	S	S	*	.	H	α-helix	trans	-68.1	-29.1	-177.9	-66.2	-156.4	-21.7	0	0	114.8	H192 A196	H192-Q194 VanDerWaalsContact C-N 3.26Å; H192-Q194 PolarHBondContact O-N 3.27Å; Q194-A196 VanDerWaalsContact C-N 3.26Å; Q194-A196 PolarHBondContact O-N 3.32Å
195	K	52.1	Low	65	Low	165 Å²	165	85.7 Å²	85.7	72%	0.717	45%	0.45	S	S	*	.	H	α-helix	trans	-71.5	-24.9	176	-79.2	-178.6	-179.4	171.5	0	111.9	H192 P193	H192-K195 HydrophobicContact CB-CB 4.43Å; H192-K195 HydrophobicContact CB-CD 4.45Å; H192-K195 PolarHBondContact O-N 2.85Å; P193-K195 PolarHBondContact O-N 3.47Å
196	A	45.9	Very low	64.5	Low	26 Å²	26	82.8 Å²	82.8	22%	0.215	44%	0.437	C	S	.	.	H	α-helix	trans	-96.7	-28.7	-177.1	0	0	0	0	0	113.8	F189 P193 Q194 R198 R199	F189-A196 HydrophobicContact CD2-CB 3.37Å; F189-A196 HydrophobicContact CE2-CB 3.38Å; P193-A196 PolarHBondContact O-N 3.02Å; Q194-A196 VanDerWaalsContact C-N 3.26Å; Q194-A196 PolarHBondContact O-N 3.32Å; A196-R198 PolarHBondContact O-N 3.5Å; A196-R198 VanDerWaalsContact O-N 3.07Å; A196-R199 WeakPolarHBondContact O-CB 3.45Å; A196-R199 PolarHBondContact O-N 3.34Å
197	S	46.3	Very low	64.2	Low	100 Å²	100	86 Å²	86	70%	0.699	45%	0.451	S	S	*	.	H	α-helix	trans	-55.4	-24.6	174.5	177.5	0	0	0	0	113.3	P193 R199	P193-S197 PolarHBondContact O-N 3.39Å; S197-R199 PolarHBondContact O-N 3.47Å
198	R	41.5	Very low	63.9	Low	226 Å²	226	88.1 Å²	88.1	85%	0.853	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-7.9	172.1	-66.1	-175.5	-179	177.8	-0.2	114.9	A196	A196-R198 PolarHBondContact O-N 3.5Å; A196-R198 VanDerWaalsContact O-N 3.07Å
199	R	35	Very low	63.9	Low	189 Å²	189	83.3 Å²	83.3	71%	0.713	44%	0.438	S	S	*	.			trans	-93.6	117.9	173	-99.2	179	177.9	169.6	-1	109.7	A196 S197 S201	A196-R199 WeakPolarHBondContact O-CB 3.45Å; A196-R199 PolarHBondContact O-N 3.34Å; S197-R199 PolarHBondContact O-N 3.47Å; R199-S201 PolarHBondContact O-N 2.93Å
200	P	39	Very low	64	Low	140 Å²	140	85.9 Å²	85.9	91%	0.909	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-9.2	177.5	-22.2	32.3	0	0	0	115.3
201	S	42.5	Very low	64.1	Low	100 Å²	100	88.1 Å²	88.1	70%	0.699	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	18.5	-171.6	74	0	0	0	0	114.1	R199 A203	R199-S201 PolarHBondContact O-N 2.93Å; S201-A203 PolarHBondContact O-N 2.81Å
202	A	53.5	Low	64.4	Low	55 Å²	55	84.7 Å²	84.7	46%	0.455	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-65.1	116.6	171.7	0	0	0	0	0	108.3
203	A	63	Low	65.1	Low	41 Å²	41	82 Å²	82	34%	0.339	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-56	140.9	174.4	0	0	0	0	0	109.2	S201 Q207 Q208	S201-A203 PolarHBondContact O-N 2.81Å; A203-Q207 HydrophobicContact CB-CB 4.34Å; A203-Q208 HydrophobicContact CB-CG 4.11Å
204	P	70.7	Confident	66.2	Low	46 Å²	46	82.6 Å²	82.6	30%	0.299	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-54.5	146.1	176.5	20.4	-31.1	0	0	0	110.6	S206 Q207 Q208 L355	P204-S206 PolarHBondContact O-N 3.01Å; P204-S206 VanDerWaalsContact O-N 3.09Å; P204-Q207 HydrophobicContact CG-CB 4.17Å; P204-Q207 HydrophobicContact CG-CG 3.81Å; P204-Q207 WeakPolarHBondContact O-CB 3.28Å; P204-Q207 PolarHBondContact O-N 3.42Å; P204-Q208 PolarHBondContact O-N 3.08Å; P204-L355 HydrophobicContact CG-CD2 4.45Å
205	A	74.7	Confident	67.6	Low	30 Å²	30	77.3 Å²	77.3	25%	0.248	42%	0.421	C	S	.	.	H	α-helix	trans	-52.9	-36.9	-174.3	0	0	0	0	0	112.9	Q207 Q208 L209 L298	A205-Q207 PolarHBondContact O-N 2.99Å; A205-Q208 WeakPolarHBondContact O-CB 3.43Å; A205-Q208 PolarHBondContact O-N 2.75Å; A205-Q208 VanDerWaalsContact O-N 3.17Å; A205-L209 WeakPolarHBondContact O-CG 3.44Å; A205-L209 PolarHBondContact O-N 3.48Å; A205-L298 HydrophobicContact CB-CB 4.34Å; A205-L298 HydrophobicContact CB-CD2 4.21Å; A205-L298 WeakPolarHBondContact CB-O 3.29Å
206	S	77.5	Confident	69.3	Low	30 Å²	30	69.4 Å²	69.4	21%	0.21	39%	0.386	C	S	.	.	H	α-helix	trans	-60	-42.9	175.3	54.1	0	0	0	0	113.2	P204 Q208 L209 Q210 E351	P204-S206 PolarHBondContact O-N 3.01Å; P204-S206 VanDerWaalsContact O-N 3.09Å; S206-Q208 VanDerWaalsContact C-N 3.31Å; S206-Q208 PolarHBondContact O-N 3.39Å; S206-L209 PolarHBondContact O-N 2.93Å; S206-Q210 WeakPolarHBondContact O-CB 3.36Å; S206-Q210 VanDerWaalsContact O-CG 3.23Å; S206-Q210 WeakPolarHBondContact O-CG 3.44Å; S206-Q210 PolarHBondContact O-N 2.9Å; S206-E351 WeakPolarHBondContact CB-OE2 3.28Å
207	Q	81.4	Confident	71.2	Confident	90 Å²	90	69 Å²	69	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-66.3	-35.7	175.8	-74.1	179	3.9	0	0	111.7	A203 P204 A205 S211	A203-Q207 HydrophobicContact CB-CB 4.34Å; P204-Q207 HydrophobicContact CG-CB 4.17Å; P204-Q207 HydrophobicContact CG-CG 3.81Å; P204-Q207 WeakPolarHBondContact O-CB 3.28Å; P204-Q207 PolarHBondContact O-N 3.42Å; A205-Q207 PolarHBondContact O-N 2.99Å; Q207-S211 WeakPolarHBondContact O-CB 3.41Å; Q207-S211 PolarHBondContact O-N 3.37Å
208	Q	82.3	Confident	73.1	Confident	49 Å²	49	66.5 Å²	66.5	23%	0.229	36%	0.364	C	S	.	.	H	α-helix	trans	-67	-43.9	176.4	-63.8	-176.9	-51.3	0	0	111.5	A203 P204 A205 S206 S211 L212	A203-Q208 HydrophobicContact CB-CG 4.11Å; P204-Q208 PolarHBondContact O-N 3.08Å; A205-Q208 WeakPolarHBondContact O-CB 3.43Å; A205-Q208 PolarHBondContact O-N 2.75Å; A205-Q208 VanDerWaalsContact O-N 3.17Å; S206-Q208 VanDerWaalsContact C-N 3.31Å; S206-Q208 PolarHBondContact O-N 3.39Å; Q208-S211 PolarHBondContact O-N 3.33Å; Q208-L212 VanDerWaalsContact O-CB 3.27Å; Q208-L212 WeakPolarHBondContact O-CB 2.92Å; Q208-L212 PolarHBondContact O-N 2.86Å
209	L	86.2	Confident	75.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-48.2	176.6	-68.2	173.2	0	0	0	111.4	A205 S206 S211 L212 E213 F293 L298 F299 Y384	A205-L209 WeakPolarHBondContact O-CG 3.44Å; A205-L209 PolarHBondContact O-N 3.48Å; S206-L209 PolarHBondContact O-N 2.93Å; L209-S211 PolarHBondContact O-N 3.45Å; L209-L212 WeakPolarHBondContact O-CB 3.47Å; L209-L212 PolarHBondContact O-N 2.84Å; L209-L212 VanDerWaalsContact O-N 3.1Å; L209-E213 WeakPolarHBondContact O-CG 3.21Å; L209-E213 PolarHBondContact O-N 2.96Å; L209-F293 HydrophobicContact CD2-CE2 4.18Å; L209-F293 HydrophobicContact CD2-CZ 3.78Å; L209-L298 HydrophobicContact CD2-CD1 4.14Å; L209-F299 HydrophobicContact CD1-CD1 4.5Å; L209-F299 HydrophobicContact CD1-CE1 3.63Å; L209-F299 HydrophobicContact CD1-CZ 4.03Å; L209-F299 HydrophobicContact CD2-CE1 4.39Å; L209-F299 HydrophobicContact CD2-CZ 3.94Å; L209-Y384 HydrophobicContact CD1-CD2 4.49Å; L209-Y384 HydrophobicContact CD1-CE2 4.15Å; L209-Y384 HydrophobicContact CD2-CE1 4.05Å; L209-Y384 HydrophobicContact CD2-CE2 4.5Å
210	Q	86.1	Confident	77.4	Confident	107 Å²	107	55.4 Å²	55.4	50%	0.5	32%	0.322	S	S	.	.	H	α-helix	trans	-61.8	-41.8	177	-70.4	171.8	15	0	0	112.2	S206 L212 E213 S214 E351	S206-Q210 WeakPolarHBondContact O-CB 3.36Å; S206-Q210 VanDerWaalsContact O-CG 3.23Å; S206-Q210 WeakPolarHBondContact O-CG 3.44Å; S206-Q210 PolarHBondContact O-N 2.9Å; Q210-L212 VanDerWaalsContact C-N 3.31Å; Q210-L212 PolarHBondContact O-N 3.07Å; Q210-E213 PolarHBondContact O-N 3.42Å; Q210-S214 WeakPolarHBondContact O-CB 3.33Å; Q210-S214 PolarHBondContact O-N 2.86Å; Q210-S214 PolarHBondContact O-OG 2.64Å; Q210-E351 PolarHBondContact NE2-OE2 3.47Å
211	S	86.4	Confident	79.5	Confident	51 Å²	51	49.7 Å²	49.7	36%	0.357	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-41.3	174.2	179.8	0	0	0	0	111.2	Q207 Q208 L209 S214 K215	Q207-S211 WeakPolarHBondContact O-CB 3.41Å; Q207-S211 PolarHBondContact O-N 3.37Å; Q208-S211 PolarHBondContact O-N 3.33Å; L209-S211 PolarHBondContact O-N 3.45Å; S211-S214 PolarHBondContact O-N 3.37Å; S211-S214 PolarHBondContact O-OG 2.86Å; S211-K215 WeakPolarHBondContact O-CG 3.17Å; S211-K215 PolarHBondContact O-N 2.95Å; S211-K215 VanDerWaalsContact O-N 3.1Å
212	L	88.5	Confident	81.1	Confident	14 Å²	14	53.8 Å²	53.8	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-48.7	179.4	177.7	63.3	0	0	0	111.4	L183 L186 Q208 L209 Q210 S214 K215 L216 I233 V291 F293	L183-L212 HydrophobicContact CD2-CD1 3.57Å; L183-L212 HydrophobicContact CG-CD1 4.4Å; L186-L212 HydrophobicContact CD2-CD2 4.03Å; Q208-L212 VanDerWaalsContact O-CB 3.27Å; Q208-L212 WeakPolarHBondContact O-CB 2.92Å; Q208-L212 PolarHBondContact O-N 2.86Å; L209-L212 WeakPolarHBondContact O-CB 3.47Å; L209-L212 PolarHBondContact O-N 2.84Å; L209-L212 VanDerWaalsContact O-N 3.1Å; Q210-L212 VanDerWaalsContact C-N 3.31Å; Q210-L212 PolarHBondContact O-N 3.07Å; L212-S214 VanDerWaalsContact C-N 3.33Å; L212-S214 PolarHBondContact O-N 3.48Å; L212-K215 PolarHBondContact O-N 3.44Å; L212-L216 HydrophobicContact CD1-CD1 3.66Å; L212-L216 HydrophobicContact CD1-CG 4.27Å; L212-L216 HydrophobicContact CD2-CD1 4.44Å; L212-L216 HydrophobicContact CG-CD1 3.68Å; L212-L216 WeakPolarHBondContact O-CB 3.4Å; L212-L216 WeakPolarHBondContact O-CD1 2.93Å; L212-L216 WeakPolarHBondContact O-CG 3.28Å; L212-L216 PolarHBondContact O-N 3.46Å; L212-I233 HydrophobicContact CD2-CD1 3.88Å; L212-V291 HydrophobicContact CD2-CG1 4.38Å; L212-F293 HydrophobicContact CD2-CZ 3.95Å
213	E	90	Very high	82.3	Confident	48 Å²	48	53.4 Å²	53.4	22%	0.224	30%	0.295	C	S	.	.	H	α-helix	trans	-56.5	-45.6	175.4	-71.5	179.3	-173.2	0	0	111.6	L209 Q210 K215 L216 T217 L289 Y384	L209-E213 WeakPolarHBondContact O-CG 3.21Å; L209-E213 PolarHBondContact O-N 2.96Å; Q210-E213 PolarHBondContact O-N 3.42Å; E213-K215 PolarHBondContact O-N 2.85Å; E213-L216 PolarHBondContact O-N 3.19Å; E213-T217 WeakPolarHBondContact O-CB 3.26Å; E213-T217 VanDerWaalsContact O-CG2 3.25Å; E213-T217 WeakPolarHBondContact O-CG2 3.22Å; E213-T217 PolarHBondContact O-N 2.91Å; E213-T217 PolarHBondContact O-OG1 3.4Å; E213-L289 HydrophobicContact CB-CD2 4.45Å; E213-L289 HydrophobicContact CG-CD2 4.07Å; E213-Y384 WeakPolarHBondContact OE1-CE2 3.4Å; E213-Y384 PolarHBondContact OE1-OH 3.18Å
214	S	88.4	Confident	83.3	Confident	63 Å²	63	55.8 Å²	55.8	44%	0.441	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-42.4	179.3	74.1	0	0	0	0	112.5	Q210 S211 L212 T217 S218	Q210-S214 WeakPolarHBondContact O-CB 3.33Å; Q210-S214 PolarHBondContact O-N 2.86Å; Q210-S214 PolarHBondContact O-OG 2.64Å; S211-S214 PolarHBondContact O-N 3.37Å; S211-S214 PolarHBondContact O-OG 2.86Å; L212-S214 VanDerWaalsContact C-N 3.33Å; L212-S214 PolarHBondContact O-N 3.48Å; S214-T217 PolarHBondContact O-OG1 3.35Å; S214-T217 VanDerWaalsContact O-OG1 3.08Å; S214-S218 WeakPolarHBondContact O-CB 3.3Å; S214-S218 PolarHBondContact O-N 2.96Å; S214-S218 VanDerWaalsContact O-N 3.15Å; S214-S218 PolarHBondContact O-OG 3.07Å
215	K	88.3	Confident	84.1	Confident	53 Å²	53	58.2 Å²	58.2	23%	0.23	31%	0.31	C	S	.	.	H	α-helix	trans	-68	-46.6	179.1	-71.3	-179.8	174.2	-175.4	0	111.2	V174 L179 D182 S211 L212 E213 T217 S218 V219	V174-K215 HydrophobicContact CG2-CG 4.38Å; L179-K215 HydrophobicContact CD1-CB 3.89Å; D182-K215 IonicContact OD2-NZ 2.82Å; D182-K215 PolarHBondContact OD2-NZ 3.16Å; S211-K215 WeakPolarHBondContact O-CG 3.17Å; S211-K215 PolarHBondContact O-N 2.95Å; S211-K215 VanDerWaalsContact O-N 3.1Å; L212-K215 PolarHBondContact O-N 3.44Å; E213-K215 PolarHBondContact O-N 2.85Å; K215-T217 VanDerWaalsContact C-N 3.32Å; K215-T217 PolarHBondContact O-N 2.93Å; K215-S218 PolarHBondContact O-N 2.62Å; K215-S218 VanDerWaalsContact O-N 3.16Å; K215-S218 PolarHBondContact O-OG 3.09Å; K215-V219 PolarHBondContact O-N 3.08Å
216	L	89	Confident	84.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.4	-38.9	177.5	-77	159.3	0	0	0	112.4	L179 L212 E213 S218 V219 F228 A235 V237 L289 V291	L179-L216 HydrophobicContact CD1-CD2 4.38Å; L179-L216 HydrophobicContact CD1-CG 4.27Å; L179-L216 HydrophobicContact CD2-CD2 3.86Å; L179-L216 HydrophobicContact CD2-CG 4.35Å; L212-L216 HydrophobicContact CD1-CD1 3.66Å; L212-L216 HydrophobicContact CD1-CG 4.27Å; L212-L216 HydrophobicContact CD2-CD1 4.44Å; L212-L216 HydrophobicContact CG-CD1 3.68Å; L212-L216 WeakPolarHBondContact O-CB 3.4Å; L212-L216 WeakPolarHBondContact O-CD1 2.93Å; L212-L216 WeakPolarHBondContact O-CG 3.28Å; L212-L216 PolarHBondContact O-N 3.46Å; E213-L216 PolarHBondContact O-N 3.19Å; L216-S218 VanDerWaalsContact C-N 3.3Å; L216-S218 PolarHBondContact O-N 3.11Å; L216-V219 VanDerWaalsContact O-CG1 3.24Å; L216-V219 WeakPolarHBondContact O-CG1 3.48Å; L216-F228 HydrophobicContact CD2-CD2 3.93Å; L216-F228 HydrophobicContact CD2-CE2 4.15Å; L216-A235 HydrophobicContact CD1-CB 3.91Å; L216-A235 HydrophobicContact CD2-CB 3.77Å; L216-V237 HydrophobicContact CB-CG2 4.12Å; L216-V237 HydrophobicContact CD2-CG2 3.82Å; L216-L289 HydrophobicContact CB-CD1 4.05Å; L216-L289 HydrophobicContact CB-CD2 4.28Å; L216-L289 HydrophobicContact CD1-CD1 3.67Å; L216-L289 HydrophobicContact CD1-CD2 3.94Å; L216-L289 HydrophobicContact CD1-CG 4.46Å; L216-L289 HydrophobicContact CD2-CD1 4.35Å; L216-L289 HydrophobicContact CG-CD1 4.25Å; L216-V291 HydrophobicContact CD1-CG2 4.18Å
217	T	86.1	Confident	85.1	Confident	17 Å²	17	58.3 Å²	58.3	10%	0.104	31%	0.309	C	S	.	.	H	α-helix	trans	-76	-15.7	178.7	54.6	0	0	0	0	113.7	E213 S214 K215 R287 Q318	E213-T217 WeakPolarHBondContact O-CB 3.26Å; E213-T217 VanDerWaalsContact O-CG2 3.25Å; E213-T217 WeakPolarHBondContact O-CG2 3.22Å; E213-T217 PolarHBondContact O-N 2.91Å; E213-T217 PolarHBondContact O-OG1 3.4Å; S214-T217 PolarHBondContact O-OG1 3.35Å; S214-T217 VanDerWaalsContact O-OG1 3.08Å; K215-T217 VanDerWaalsContact C-N 3.32Å; K215-T217 PolarHBondContact O-N 2.93Å; T217-R287 VanDerWaalsContact O-CD 3.31Å; T217-R287 WeakPolarHBondContact O-CD 3.5Å; T217-R287 PolarHBondContact O-NH1 3.49Å; T217-Q318 HydrophobicContact CG2-CB 3.88Å; T217-Q318 HydrophobicContact CG2-CG 3.9Å; T217-Q318 PolarHBondContact O-NE2 3.21Å
218	S	85.6	Confident	85.5	Confident	48 Å²	48	54 Å²	54	34%	0.336	29%	0.289	S	S	.	.	H	α-helix	trans	-95.7	-12.7	179.4	72.2	0	0	0	0	115	V174 S214 K215 L216	V174-S218 WeakPolarHBondContact CG2-OG 3.32Å; S214-S218 WeakPolarHBondContact O-CB 3.3Å; S214-S218 PolarHBondContact O-N 2.96Å; S214-S218 VanDerWaalsContact O-N 3.15Å; S214-S218 PolarHBondContact O-OG 3.07Å; K215-S218 PolarHBondContact O-N 2.62Å; K215-S218 VanDerWaalsContact O-N 3.16Å; K215-S218 PolarHBondContact O-OG 3.09Å; L216-S218 VanDerWaalsContact C-N 3.3Å; L216-S218 PolarHBondContact O-N 3.11Å
219	V	85	Confident	85.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.29	C	S	.	.			trans	-66	141.7	-173.2	74.3	0	0	0	0	113	M176 L179 K215 L216 F221 F228 R287	M176-V219 HydrophobicContact CB-CG2 4.37Å; M176-V219 HydrophobicContact CG-CG2 3.47Å; M176-V219 VanDerWaalsContact CG-CG2 3.47Å; L179-V219 HydrophobicContact CD2-CB 4.11Å; L179-V219 HydrophobicContact CD2-CG1 4.42Å; L179-V219 HydrophobicContact CD2-CG2 4.1Å; K215-V219 PolarHBondContact O-N 3.08Å; L216-V219 VanDerWaalsContact O-CG1 3.24Å; L216-V219 WeakPolarHBondContact O-CG1 3.48Å; V219-F221 HydrophobicContact CG1-CD1 3.93Å; V219-F221 HydrophobicContact CG1-CE1 4.18Å; V219-F228 HydrophobicContact CG1-CE2 4.46Å; V219-F228 HydrophobicContact CG1-CZ 4.46Å; V219-F228 HydrophobicContact CG2-CZ 4.2Å; V219-R287 VanDerWaalsContact O-CZ 3.28Å; V219-R287 PolarHBondContact O-NH1 3.07Å; V219-R287 PolarHBondContact O-NH2 3.18Å
220	R	81.8	Confident	85.7	Confident	181 Å²	181	54.6 Å²	54.6	68%	0.683	29%	0.291	S	S	*	.			trans	-101	130	174.9	-70.5	-177.7	179	170.2	0.1	110	M176	M176-R220 VanDerWaalsContact SD-O 3.37Å
221	F	82.5	Confident	85.7	Confident	21 Å²	21	53 Å²	53	9%	0.092	29%	0.286	C	S	.	.			trans	-145.8	154.6	177.8	57.8	-85.9	0	0	0	110.5	M176 V219 V226 V237 K239	M176-F221 HydrophobicContact SD-CB 4.23Å; V219-F221 HydrophobicContact CG1-CD1 3.93Å; V219-F221 HydrophobicContact CG1-CE1 4.18Å; F221-V226 HydrophobicContact CB-CB 4.16Å; F221-V226 HydrophobicContact CB-CG1 4.2Å; F221-V226 HydrophobicContact CD1-CB 4.24Å; F221-V226 HydrophobicContact CD1-CG1 3.46Å; F221-V226 VanDerWaalsContact CD1-CG1 3.46Å; F221-V226 HydrophobicContact CD2-CB 3.85Å; F221-V226 HydrophobicContact CD2-CG1 3.89Å; F221-V226 HydrophobicContact CE1-CG1 3.62Å; F221-V226 HydrophobicContact CE2-CB 4.26Å; F221-V226 HydrophobicContact CE2-CG1 4.05Å; F221-V226 HydrophobicContact CG-CB 3.83Å; F221-V226 HydrophobicContact CG-CG1 3.58Å; F221-V226 HydrophobicContact CZ-CG1 3.91Å; F221-V237 HydrophobicContact CE1-CB 4.37Å; F221-V237 HydrophobicContact CE1-CG1 4.01Å; F221-V237 HydrophobicContact CZ-CB 4.48Å; F221-V237 HydrophobicContact CZ-CG1 4.18Å; F221-K239 HydrophobicContact CE2-CD 4.27Å; F221-K239 HydrophobicContact CE2-CG 4.05Å; F221-K239 HydrophobicContact CZ-CD 4.37Å; F221-K239 HydrophobicContact CZ-CG 3.78Å; F221-K239 PolarHBondContact O-NZ 3.41Å
222	M	76	Confident	85.8	Confident	185 Å²	185	55.1 Å²	55.1	91%	0.911	29%	0.286	S	S	*	.	S	Bend	trans	-82.9	147.4	172.7	-62.1	-163.4	74.5	0	0	110.3
223	G	80	Confident	85.9	Confident	48 Å²	48	54.5 Å²	54.5	50%	0.495	28%	0.283	S	S	.	.	S	Bend	trans	84.4	-171	-176.2	0	0	0	0	0	114.4	K239	G223-K239 WeakPolarHBondContact O-CD 3.24Å; G223-K239 WeakPolarHBondContact O-CE 3.32Å; G223-K239 PolarHBondContact O-NZ 2.86Å
224	D	83.7	Confident	86	Confident	91 Å²	91	54.4 Å²	54.4	49%	0.487	28%	0.284	S	S	.	.	S	Bend	trans	-93.7	-18.3	-172.7	-63.5	-38.1	0	0	0	113.7	W238 K239 Q241	D224-W238 CarbonylContact O-C 3.55Å; D224-W238 WeakPolarHBondContact O-CA 3.44Å; D224-K239 PolarHBondContact O-N 3.33Å; D224-Q241 PolarHBondContact OD1-NE2 3.48Å; D224-Q241 PolarHBondContact OD2-NE2 3.49Å
225	M	86.2	Confident	86.2	Confident	97 Å²	97	51.4 Å²	51.4	48%	0.478	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	148.6	-178.2	-165.7	-161	-40.2	0	0	111.7	T236 V237 W238	M225-T236 HydrophobicContact CG-CG2 3.57Å; M225-T236 HydrophobicContact SD-CG2 3.33Å; M225-T236 WeakPolarHBondContact SD-CG2 3.38Å; M225-V237 CarbonylContact C-O 3.41Å; M225-V237 VanDerWaalsContact CA-O 3.22Å; M225-V237 WeakPolarHBondContact CA-O 3.34Å; M225-V237 WeakPolarHBondContact CG-O 3.25Å; M225-W238 HydrophobicContact CB-CG 4.39Å; M225-W238 HydrophobicContact CE-CZ2 4.14Å; M225-W238 HydrophobicContact CG-CD2 3.88Å; M225-W238 HydrophobicContact CG-CG 3.83Å; M225-W238 HydrophobicContact CG-CZ2 4.38Å; M225-W238 HydrophobicContact SD-CD2 4.19Å; M225-W238 HydrophobicContact SD-CZ2 3.63Å; M225-W238 PolarHBondContact SD-NE1 3.03Å; M225-W238 VanDerWaalsContact SD-NE1 3.38Å
226	V	87	Confident	86.3	Confident	16 Å²	16	50 Å²	50	10%	0.097	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	139.9	168.2	63.3	0	0	0	0	110	M176 F221 F228 T236 V237	M176-V226 HydrophobicContact CE-CG2 3.94Å; F221-V226 HydrophobicContact CB-CB 4.16Å; F221-V226 HydrophobicContact CB-CG1 4.2Å; F221-V226 HydrophobicContact CD1-CB 4.24Å; F221-V226 HydrophobicContact CD1-CG1 3.46Å; F221-V226 VanDerWaalsContact CD1-CG1 3.46Å; F221-V226 HydrophobicContact CD2-CB 3.85Å; F221-V226 HydrophobicContact CD2-CG1 3.89Å; F221-V226 HydrophobicContact CE1-CG1 3.62Å; F221-V226 HydrophobicContact CE2-CB 4.26Å; F221-V226 HydrophobicContact CE2-CG1 4.05Å; F221-V226 HydrophobicContact CG-CB 3.83Å; F221-V226 HydrophobicContact CG-CG1 3.58Å; F221-V226 HydrophobicContact CZ-CG1 3.91Å; V226-F228 HydrophobicContact CG1-CE2 3.72Å; V226-F228 HydrophobicContact CG1-CZ 4.24Å; V226-F228 HydrophobicContact CG2-CE2 4.03Å; V226-F228 HydrophobicContact CG2-CZ 4.04Å; V226-T236 WeakPolarHBondContact O-CA 3.31Å; V226-V237 HydrophobicContact CG1-CB 4.06Å; V226-V237 PolarHBondContact N-O 3.39Å; V226-V237 PolarHBondContact O-N 3.02Å
227	S	87.7	Confident	86.4	Confident	46 Å²	46	50 Å²	50	32%	0.322	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.1	174	60.7	0	0	0	0	111.4	A235	S227-A235 CarbonylContact C-O 3.57Å; S227-A235 WeakPolarHBondContact CA-O 3.37Å
228	F	88.5	Confident	86.5	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	99.6	175.7	-60.7	-90.2	0	0	0	107.9	W143 M176 L179 K180 L183 L216 V219 V226 N234 A235	W143-F228 HydrophobicContact CZ3-CD1 4.12Å; W143-F228 HydrophobicContact CZ3-CE1 4.16Å; M176-F228 HydrophobicContact CB-CE1 4.49Å; M176-F228 HydrophobicContact CE-CE1 4.44Å; M176-F228 HydrophobicContact CE-CZ 4.38Å; L179-F228 HydrophobicContact CD2-CD2 4.39Å; L179-F228 HydrophobicContact CD2-CE1 4Å; L179-F228 HydrophobicContact CD2-CE2 3.84Å; L179-F228 HydrophobicContact CD2-CZ 3.64Å; L179-F228 HydrophobicContact CG-CE1 4.37Å; L179-F228 HydrophobicContact CG-CZ 4.49Å; K180-F228 HydrophobicContact CD-CD1 4.26Å; L183-F228 HydrophobicContact CD1-CB 3.36Å; L183-F228 HydrophobicContact CD1-CD1 4.23Å; L183-F228 HydrophobicContact CD1-CG 3.84Å; L216-F228 HydrophobicContact CD2-CD2 3.93Å; L216-F228 HydrophobicContact CD2-CE2 4.15Å; V219-F228 HydrophobicContact CG1-CE2 4.46Å; V219-F228 HydrophobicContact CG1-CZ 4.46Å; V219-F228 HydrophobicContact CG2-CZ 4.2Å; V226-F228 HydrophobicContact CG1-CE2 3.72Å; V226-F228 HydrophobicContact CG1-CZ 4.24Å; V226-F228 HydrophobicContact CG2-CE2 4.03Å; V226-F228 HydrophobicContact CG2-CZ 4.04Å; F228-N234 WeakPolarHBondContact O-CA 3.42Å; F228-A235 HydrophobicContact CB-CB 4.5Å; F228-A235 PolarHBondContact N-O 3.33Å; F228-A235 PolarHBondContact O-N 3.48Å
229	E	85.6	Confident	86.5	Confident	56 Å²	56	50.3 Å²	50.3	26%	0.262	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	122.2	-176.9	-39.4	-175.5	164.2	0	0	110.5	R29 K180 N234 R254	R29-E229 IonicContact NE-OE2 3.84Å; R29-E229 PolarHBondContact NE-OE2 2.79Å; R29-E229 VanDerWaalsContact NH2-CA 3.33Å; R29-E229 PolarHBondContact NH2-O 3.47Å; R29-E229 IonicContact NH2-OE2 3.7Å; K180-E229 PolarHBondContact NZ-O 3.48Å; E229-N234 VanDerWaalsContact CA-OD1 3.27Å; E229-N234 WeakPolarHBondContact CA-OD1 3.22Å; E229-N234 WeakPolarHBondContact CB-OD1 3.45Å; E229-R254 IonicContact OE1-NH1 2.91Å; E229-R254 PolarHBondContact OE1-NH1 3.37Å; E229-R254 IonicContact OE2-NH1 3.8Å
230	E	88.4	Confident	86.3	Confident	5 Å²	5	51.1 Å²	51.1	2%	0.023	26%	0.257	C	S	.	.			trans	-124.7	172.1	167.8	-63.9	-62.2	135	0	0	110.6	R29 R96 K180 L183 R232 I233 N234	R29-E230 PolarHBondContact NH1-O 2.89Å; R29-E230 PolarHBondContact NH2-O 3.02Å; R96-E230 IonicContact CZ-OE1 3.26Å; R96-E230 IonicContact CZ-OE2 2.94Å; R96-E230 IonicContact NH1-OE2 2.77Å; R96-E230 PolarHBondContact NH1-OE2 3.41Å; R96-E230 VanDerWaalsContact NH2-CD 3.3Å; R96-E230 IonicContact NH2-OE1 3.42Å; R96-E230 PolarHBondContact NH2-OE1 3.36Å; R96-E230 IonicContact NH2-OE2 3.66Å; R96-E230 PolarHBondContact NH2-OE2 3.43Å; K180-E230 VanDerWaalsContact CD-OE1 3.28Å; K180-E230 WeakPolarHBondContact CD-OE1 3.44Å; K180-E230 WeakPolarHBondContact CE-OE1 3.45Å; K180-E230 IonicContact NZ-OE1 3.98Å; K180-E230 PolarHBondContact NZ-OE1 3.49Å; L183-E230 HydrophobicContact CB-CG 4.02Å; E230-R232 PolarHBondContact O-N 2.9Å; E230-I233 CarbonylContact C-O 3.47Å; E230-I233 WeakPolarHBondContact CA-O 3.14Å; E230-I233 HydrophobicContact CB-CG2 3.75Å; E230-I233 WeakPolarHBondContact CB-O 3.24Å; E230-I233 HydrophobicContact CG-CG2 4.32Å; E230-I233 PolarHBondContact N-O 2.92Å; E230-N234 PolarHBondContact N-OD1 3.34Å; E230-N234 PolarHBondContact O-OD1 2.93Å; E230-N234 VanDerWaalsContact O-OD1 3.1Å
231	D	85.3	Confident	85.9	Confident	73 Å²	73	46.4 Å²	46.4	39%	0.39	24%	0.242	S	C	.	.	S	Bend	trans	-62.5	-35.3	-170.8	-68.4	-19.7	0	0	0	115.9	R29 H97 K191	R29-D231 IonicContact NH1-OD1 3.05Å; R29-D231 PolarHBondContact NH1-OD1 3.39Å; H97-D231 IonicContact CD2-OD1 3.46Å; H97-D231 PolarHBondContact CD2-OD1 2.92Å; H97-D231 IonicContact CD2-OD2 3.59Å; H97-D231 IonicContact NE2-OD1 2.92Å; K191-D231 VanDerWaalsContact CE-CB 3.48Å; K191-D231 WeakPolarHBondContact CE-OD2 3.43Å; K191-D231 IonicContact NZ-OD2 3.74Å; K191-D231 PolarHBondContact NZ-OD2 3.39Å
232	R	87.6	Confident	85.1	Confident	95 Å²	95	50.5 Å²	50.5	36%	0.358	27%	0.271	S	S	.	.	S	Bend	trans	-115.7	-0.1	-178.9	-67	-65.6	-171.6	167.9	-3.9	113.2	S187 L190 K191 E230 S294	S187-R232 PolarHBondContact OG-N 3.3Å; S187-R232 VanDerWaalsContact OG-N 3.16Å; L190-R232 HydrophobicContact CB-CB 4.02Å; L190-R232 HydrophobicContact CB-CG 4.46Å; L190-R232 HydrophobicContact CD1-CB 4.21Å; K191-R232 HydrophobicContact CG-CG 3.59Å; E230-R232 PolarHBondContact O-N 2.9Å; R232-S294 WeakPolarHBondContact CD-O 3.37Å; R232-S294 PolarHBondContact NH1-O 3.36Å; R232-S294 PolarHBondContact O-N 3.29Å
233	I	91.2	Very high	84.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	127.4	-176.4	-172.3	170.7	0	0	0	110.2	L183 L186 L190 L212 E230 V291 D292 F293	L183-I233 HydrophobicContact CD2-CD1 3.66Å; L183-I233 HydrophobicContact CD2-CG1 4.26Å; L183-I233 HydrophobicContact CD2-CG2 4.27Å; L186-I233 HydrophobicContact CD2-CD1 3.74Å; L190-I233 HydrophobicContact CD1-CB 4.45Å; L212-I233 HydrophobicContact CD2-CD1 3.88Å; E230-I233 CarbonylContact C-O 3.47Å; E230-I233 WeakPolarHBondContact CA-O 3.14Å; E230-I233 HydrophobicContact CB-CG2 3.75Å; E230-I233 WeakPolarHBondContact CB-O 3.24Å; E230-I233 HydrophobicContact CG-CG2 4.32Å; E230-I233 PolarHBondContact N-O 2.92Å; I233-V291 HydrophobicContact CD1-CG1 3.99Å; I233-V291 HydrophobicContact CG1-CG1 3.89Å; I233-D292 CarbonylContact C-O 3.46Å; I233-D292 VanDerWaalsContact CA-O 3.28Å; I233-D292 WeakPolarHBondContact CA-O 3.46Å; I233-F293 HydrophobicContact CB-CD1 4.43Å; I233-F293 HydrophobicContact CD1-CD1 3.93Å; I233-F293 HydrophobicContact CD1-CE1 3.36Å; I233-F293 HydrophobicContact CD1-CZ 3.89Å; I233-F293 HydrophobicContact CG1-CD1 4.07Å; I233-F293 HydrophobicContact CG1-CE1 3.99Å
234	N	91.5	Very high	83.7	Confident	46 Å²	46	44.7 Å²	44.7	25%	0.246	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.4	172.1	-64.6	-33.2	0	0	0	108.3	R29 F228 E229 E230 V291 D292	R29-N234 PolarHBondContact NH2-OD1 3.04Å; R29-N234 VanDerWaalsContact NH2-OD1 3.13Å; F228-N234 WeakPolarHBondContact O-CA 3.42Å; E229-N234 VanDerWaalsContact CA-OD1 3.27Å; E229-N234 WeakPolarHBondContact CA-OD1 3.22Å; E229-N234 WeakPolarHBondContact CB-OD1 3.45Å; E230-N234 PolarHBondContact N-OD1 3.34Å; E230-N234 PolarHBondContact O-OD1 2.93Å; E230-N234 VanDerWaalsContact O-OD1 3.1Å; N234-V291 CarbonylContact O-C 3.55Å; N234-V291 WeakPolarHBondContact O-CA 3.29Å; N234-D292 HydrophobicContact CB-CB 4.2Å; N234-D292 PolarHBondContact N-O 3.41Å; N234-D292 PolarHBondContact O-N 2.95Å
235	A	92.7	Very high	82.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.5	179.9	0	0	0	0	0	110.3	L216 S227 F228 L290 V291	L216-A235 HydrophobicContact CD1-CB 3.91Å; L216-A235 HydrophobicContact CD2-CB 3.77Å; S227-A235 CarbonylContact C-O 3.57Å; S227-A235 WeakPolarHBondContact CA-O 3.37Å; F228-A235 HydrophobicContact CB-CB 4.5Å; F228-A235 PolarHBondContact N-O 3.33Å; F228-A235 PolarHBondContact O-N 3.48Å; A235-L290 CarbonylContact C-O 3.51Å; A235-L290 WeakPolarHBondContact CA-O 3.27Å; A235-V291 HydrophobicContact CB-CG1 4.47Å; A235-V291 HydrophobicContact CB-CG2 4.32Å
236	T	91.3	Very high	81.8	Confident	24 Å²	24	42.6 Å²	42.6	15%	0.147	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.2	179.1	-53.6	0	0	0	0	109.7	M225 V226 W238 L290	M225-T236 HydrophobicContact CG-CG2 3.57Å; M225-T236 HydrophobicContact SD-CG2 3.33Å; M225-T236 WeakPolarHBondContact SD-CG2 3.38Å; V226-T236 WeakPolarHBondContact O-CA 3.31Å; T236-W238 VanDerWaalsContact CB-CZ3 3.47Å; T236-W238 HydrophobicContact CG2-CD2 4.17Å; T236-W238 HydrophobicContact CG2-CE3 3.94Å; T236-W238 HydrophobicContact CG2-CH2 3.2Å; T236-W238 HydrophobicContact CG2-CZ2 3.46Å; T236-W238 VanDerWaalsContact CG2-CZ2 3.46Å; T236-W238 HydrophobicContact CG2-CZ3 3.47Å; T236-W238 VanDerWaalsContact CG2-CZ3 3.47Å; T236-W238 WeakPolarHBondContact O-CZ3 3.44Å; T236-L290 PolarHBondContact N-O 3.45Å; T236-L290 PolarHBondContact O-N 3.4Å
237	V	91	Very high	81.5	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.9	-177.5	-174.8	0	0	0	0	108.9	L216 F221 M225 V226 R287 L288 L289	L216-V237 HydrophobicContact CB-CG2 4.12Å; L216-V237 HydrophobicContact CD2-CG2 3.82Å; F221-V237 HydrophobicContact CE1-CB 4.37Å; F221-V237 HydrophobicContact CE1-CG1 4.01Å; F221-V237 HydrophobicContact CZ-CB 4.48Å; F221-V237 HydrophobicContact CZ-CG1 4.18Å; M225-V237 CarbonylContact C-O 3.41Å; M225-V237 VanDerWaalsContact CA-O 3.22Å; M225-V237 WeakPolarHBondContact CA-O 3.34Å; M225-V237 WeakPolarHBondContact CG-O 3.25Å; V226-V237 HydrophobicContact CG1-CB 4.06Å; V226-V237 PolarHBondContact N-O 3.39Å; V226-V237 PolarHBondContact O-N 3.02Å; V237-R287 HydrophobicContact CG1-CB 4.28Å; V237-L288 WeakPolarHBondContact CA-O 3.41Å; V237-L289 HydrophobicContact CG2-CD1 3.91Å
238	W	88.3	Confident	81.3	Confident	26 Å²	26	50.1 Å²	50.1	10%	0.098	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	142.3	174.2	-65.6	-107.9	0	0	0	110.8	D224 M225 T236 I251 R287 L288 L290	D224-W238 CarbonylContact O-C 3.55Å; D224-W238 WeakPolarHBondContact O-CA 3.44Å; M225-W238 HydrophobicContact CB-CG 4.39Å; M225-W238 HydrophobicContact CE-CZ2 4.14Å; M225-W238 HydrophobicContact CG-CD2 3.88Å; M225-W238 HydrophobicContact CG-CG 3.83Å; M225-W238 HydrophobicContact CG-CZ2 4.38Å; M225-W238 HydrophobicContact SD-CD2 4.19Å; M225-W238 HydrophobicContact SD-CZ2 3.63Å; M225-W238 PolarHBondContact SD-NE1 3.03Å; M225-W238 VanDerWaalsContact SD-NE1 3.38Å; T236-W238 VanDerWaalsContact CB-CZ3 3.47Å; T236-W238 HydrophobicContact CG2-CD2 4.17Å; T236-W238 HydrophobicContact CG2-CE3 3.94Å; T236-W238 HydrophobicContact CG2-CH2 3.2Å; T236-W238 HydrophobicContact CG2-CZ2 3.46Å; T236-W238 VanDerWaalsContact CG2-CZ2 3.46Å; T236-W238 HydrophobicContact CG2-CZ3 3.47Å; T236-W238 VanDerWaalsContact CG2-CZ3 3.47Å; T236-W238 WeakPolarHBondContact O-CZ3 3.44Å; W238-I251 HydrophobicContact CH2-CD1 3.67Å; W238-I251 HydrophobicContact CZ2-CD1 3.7Å; W238-I251 HydrophobicContact CZ2-CG1 4.14Å; W238-I251 HydrophobicContact CZ3-CD1 4.39Å; W238-R287 WeakPolarHBondContact O-CA 3.39Å; W238-L288 HydrophobicContact CB-CB 4.29Å; W238-L288 HydrophobicContact CD2-CD2 4.43Å; W238-L288 HydrophobicContact CE3-CD2 4.21Å; W238-L288 HydrophobicContact CE3-CG 4.22Å; W238-L288 PolarHBondContact N-O 3.07Å; W238-L288 PolarHBondContact O-N 3.37Å; W238-L290 HydrophobicContact CH2-CB 3.71Å; W238-L290 HydrophobicContact CH2-CD2 3.97Å; W238-L290 HydrophobicContact CZ3-CB 3.42Å; W238-L290 VanDerWaalsContact CZ3-CB 3.42Å
239	K	86.1	Confident	81.2	Confident	44 Å²	44	52.4 Å²	52.4	19%	0.191	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	120.1	160.4	-63.5	178.7	-171.6	158.4	0	108.2	F221 G223 D224 Q241	F221-K239 HydrophobicContact CE2-CD 4.27Å; F221-K239 HydrophobicContact CE2-CG 4.05Å; F221-K239 HydrophobicContact CZ-CD 4.37Å; F221-K239 HydrophobicContact CZ-CG 3.78Å; F221-K239 PolarHBondContact O-NZ 3.41Å; G223-K239 WeakPolarHBondContact O-CD 3.24Å; G223-K239 WeakPolarHBondContact O-CE 3.32Å; G223-K239 PolarHBondContact O-NZ 2.86Å; D224-K239 PolarHBondContact O-N 3.33Å; K239-Q241 PolarHBondContact O-N 3.49Å
240	L	79.9	Confident	81.3	Confident	18 Å²	18	55.2 Å²	55.2	9%	0.094	29%	0.29	C	S	.	.			trans	-80	102.7	176.3	-64.9	170.2	0	0	0	108.7	A244 F274 K286 L288 V317	L240-A244 HydrophobicContact CD2-CB 4.47Å; L240-F274 HydrophobicContact CD1-CD1 4.11Å; L240-F274 HydrophobicContact CD1-CE1 4.28Å; L240-F274 HydrophobicContact CD2-CD1 3.55Å; L240-F274 HydrophobicContact CD2-CE1 3.36Å; L240-F274 HydrophobicContact CD2-CZ 4.27Å; L240-F274 HydrophobicContact CG-CD1 4.42Å; L240-F274 HydrophobicContact CG-CE1 4.47Å; L240-K286 VanDerWaalsContact CB-O 3.29Å; L240-K286 WeakPolarHBondContact CB-O 3.43Å; L240-K286 HydrophobicContact CD1-CB 4.14Å; L240-K286 PolarHBondContact N-O 2.94Å; L240-L288 HydrophobicContact CD1-CB 4.21Å; L240-L288 HydrophobicContact CD2-CB 4.09Å; L240-L288 HydrophobicContact CG-CB 4.2Å; L240-V317 HydrophobicContact CD1-CG1 4.41Å
241	Q	73.6	Confident	81.3	Confident	81 Å²	81	56 Å²	56	38%	0.379	29%	0.294	S	S	.	.			trans	-66.8	153	172.5	-66.8	-175.5	-4.6	0	0	110.6	D224 K239 T243 A244	D224-Q241 PolarHBondContact OD1-NE2 3.48Å; D224-Q241 PolarHBondContact OD2-NE2 3.49Å; K239-Q241 PolarHBondContact O-N 3.49Å; Q241-T243 PolarHBondContact O-N 3.39Å; Q241-T243 PolarHBondContact OE1-OG1 3.32Å; Q241-A244 WeakPolarHBondContact O-CB 3.28Å; Q241-A244 PolarHBondContact O-N 2.94Å
242	P	65.1	Low	81.5	Confident	107 Å²	107	58.5 Å²	58.5	70%	0.695	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.2	177.5	-24.5	33.5	0	0	0	114.3
243	T	64.8	Low	81.4	Confident	80 Å²	80	55 Å²	55	49%	0.491	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.6	177.2	46	0	0	0	0	113.8	Q241 G245 L246	Q241-T243 PolarHBondContact O-N 3.39Å; Q241-T243 PolarHBondContact OE1-OG1 3.32Å; T243-G245 PolarHBondContact O-N 3.01Å; T243-L246 HydrophobicContact CG2-CD1 4.45Å; T243-L246 WeakPolarHBondContact O-CB 3.4Å; T243-L246 WeakPolarHBondContact O-CD1 3.36Å; T243-L246 WeakPolarHBondContact O-CG 3.4Å; T243-L246 PolarHBondContact O-N 3.48Å; T243-L246 VanDerWaalsContact O-N 3.08Å
244	A	63.4	Low	80.8	Confident	32 Å²	32	63.6 Å²	63.6	26%	0.264	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-59.3	-21.6	-177.5	0	0	0	0	0	113.5	L240 Q241 L246 F274	L240-A244 HydrophobicContact CD2-CB 4.47Å; Q241-A244 WeakPolarHBondContact O-CB 3.28Å; Q241-A244 PolarHBondContact O-N 2.94Å; A244-L246 PolarHBondContact O-N 3.28Å; A244-F274 HydrophobicContact CB-CB 4.33Å; A244-F274 HydrophobicContact CB-CG 4.26Å; A244-F274 WeakPolarHBondContact O-CD2 3.27Å
245	G	62.5	Low	80	Confident	17 Å²	17	68.4 Å²	68.4	18%	0.175	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-71.9	2.1	175.1	0	0	0	0	0	116.3	T243	T243-G245 PolarHBondContact O-N 3.01Å
246	L	65.5	Low	79.1	Confident	126 Å²	126	71 Å²	71	66%	0.66	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-83.7	-30.6	-179.4	-70.8	166.4	0	0	0	113.4	T243 A244	T243-L246 HydrophobicContact CG2-CD1 4.45Å; T243-L246 WeakPolarHBondContact O-CB 3.4Å; T243-L246 WeakPolarHBondContact O-CD1 3.36Å; T243-L246 WeakPolarHBondContact O-CG 3.4Å; T243-L246 PolarHBondContact O-N 3.48Å; T243-L246 VanDerWaalsContact O-N 3.08Å; A244-L246 PolarHBondContact O-N 3.28Å
247	Q	80.9	Confident	77.9	Confident	153 Å²	153	75.6 Å²	75.6	72%	0.715	38%	0.378	S	S	*	.	S	Bend	trans	-141.6	156.6	-171.4	-68.3	-179.3	1.5	0	0	111.6
248	D	84	Confident	76.2	Confident	67 Å²	67	83.9 Å²	83.9	36%	0.358	42%	0.417	S	S	.	.			trans	-72.6	142.2	173.7	-57.7	-27.6	0	0	0	109.6	L268 L269 P270 R271	D248-L268 HydrophobicContact CB-CD1 3.77Å; D248-L269 WeakPolarHBondContact CA-O 3.3Å; D248-P270 WeakPolarHBondContact OD1-CA 3.49Å; D248-R271 WeakPolarHBondContact OD1-CB 3.18Å; D248-R271 WeakPolarHBondContact OD1-CG 3.35Å; D248-R271 PolarHBondContact OD1-N 3.02Å
249	L	86.3	Confident	74.8	Confident	48 Å²	48	91.3 Å²	91.3	25%	0.251	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	112.7	178.7	179.5	64.4	0	0	0	109.2	I251 L269 F274 L288	L249-I251 HydrophobicContact CD2-CD1 4.2Å; L249-I251 HydrophobicContact CD2-CG1 4.47Å; L249-I251 HydrophobicContact CG-CD1 4.37Å; L249-I251 HydrophobicContact CG-CG1 4.14Å; L249-L269 HydrophobicContact CB-CB 4.23Å; L249-L269 HydrophobicContact CD2-CD1 4.17Å; L249-L269 PolarHBondContact N-O 3.42Å; L249-L269 PolarHBondContact O-N 3.4Å; L249-F274 HydrophobicContact CB-CE2 3.91Å; L249-F274 HydrophobicContact CB-CZ 3.99Å; L249-F274 HydrophobicContact CD2-CZ 4.09Å; L249-L288 HydrophobicContact CD2-CD2 3.61Å
250	H	88.5	Confident	74	Confident	116 Å²	116	90.7 Å²	90.7	54%	0.537	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.9	174.9	-67	-105.6	0	0	0	110	V267 L268	H250-V267 WeakPolarHBondContact CA-O 3.41Å; H250-L268 WeakPolarHBondContact CE1-CD1 3.17Å; H250-L268 VanDerWaalsContact NE2-CD1 3.34Å; H250-L268 WeakPolarHBondContact NE2-CD1 3.18Å
251	I	88	Confident	73.9	Confident	20 Å²	20	93.5 Å²	93.5	10%	0.103	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128	176	-54.8	168.8	0	0	0	107.8	W238 L249 S266 V267 L269 L290	W238-I251 HydrophobicContact CH2-CD1 3.67Å; W238-I251 HydrophobicContact CZ2-CD1 3.7Å; W238-I251 HydrophobicContact CZ2-CG1 4.14Å; W238-I251 HydrophobicContact CZ3-CD1 4.39Å; L249-I251 HydrophobicContact CD2-CD1 4.2Å; L249-I251 HydrophobicContact CD2-CG1 4.47Å; L249-I251 HydrophobicContact CG-CD1 4.37Å; L249-I251 HydrophobicContact CG-CG1 4.14Å; I251-S266 CarbonylContact O-C 3.51Å; I251-S266 VanDerWaalsContact O-CA 3.22Å; I251-S266 WeakPolarHBondContact O-CA 3.42Å; I251-V267 HydrophobicContact CB-CB 4.26Å; I251-V267 PolarHBondContact N-O 3.14Å; I251-V267 PolarHBondContact O-N 2.85Å; I251-L269 HydrophobicContact CD1-CD1 4.3Å; I251-L290 HydrophobicContact CD1-CD2 4.17Å; I251-L290 HydrophobicContact CG2-CD2 3.85Å
252	H	88.7	Confident	74.4	Confident	126 Å²	126	89.8 Å²	89.8	58%	0.583	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.3	175.5	-69.2	-82.4	0	0	0	109.5	S266	H252-S266 WeakPolarHBondContact ND1-CB 3.34Å
253	S	86.6	Confident	75.4	Confident	21 Å²	21	86.6 Å²	86.6	15%	0.147	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-72.8	161.3	170.5	83.2	0	0	0	0	110.5	E264 Y265	S253-E264 WeakPolarHBondContact OG-CA 3.43Å; S253-Y265 VanDerWaalsContact CB-CZ 3.48Å; S253-Y265 WeakPolarHBondContact CB-O 3.47Å; S253-Y265 PolarHBondContact N-O 3.45Å; S253-Y265 PolarHBondContact OG-N 2.95Å; S253-Y265 PolarHBondContact OG-O 3.26Å
254	R	78.4	Confident	76.6	Confident	183 Å²	183	85.2 Å²	85.2	69%	0.691	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-68.1	150.8	162.6	-74	-179.8	162.8	126.3	-3.7	109.4	E229 E256	E229-R254 IonicContact OE1-NH1 2.91Å; E229-R254 PolarHBondContact OE1-NH1 3.37Å; E229-R254 IonicContact OE2-NH1 3.8Å; R254-E256 PolarHBondContact O-N 3.49Å
255	Q	75.1	Confident	78	Confident	146 Å²	146	84.5 Å²	84.5	68%	0.682	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-65.8	122.7	169.8	-170.7	174.7	0.1	0	0	109	M263	Q255-M263 WeakPolarHBondContact CA-O 3.31Å
256	E	72.3	Confident	79.5	Confident	56 Å²	56	85 Å²	85	26%	0.262	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-75.1	171.4	177.5	-63.2	-165.6	177.2	0	0	111.5	R254 S260 M263 K311	R254-E256 PolarHBondContact O-N 3.49Å; E256-S260 WeakPolarHBondContact OE2-CB 3.16Å; E256-S260 PolarHBondContact OE2-OG 3.32Å; E256-M263 PolarHBondContact N-O 3.17Å; E256-K311 IonicContact OE1-NZ 3.93Å; E256-K311 PolarHBondContact OE1-NZ 3.09Å
257	E	66.1	Low	80.9	Confident	119 Å²	119	79.1 Å²	79.1	56%	0.556	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-65.4	152	177.7	-55.7	-163.4	133.2	0	0	111.5	R26 Q259 S260	R26-E257 IonicContact CZ-OE1 3.09Å; R26-E257 IonicContact NH2-OE1 3.51Å; R26-E257 PolarHBondContact NH2-OE1 2.98Å; E257-Q259 PolarHBondContact O-N 3.18Å; E257-S260 WeakPolarHBondContact O-CB 3.42Å; E257-S260 PolarHBondContact O-N 2.9Å; E257-S260 PolarHBondContact O-OG 3.25Å
258	E	57.1	Low	81.5	Confident	175 Å²	175	74.2 Å²	74.2	82%	0.818	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-16.7	-174.6	-68	-178.1	163.1	0	0	115.2	Q336	E258-Q336 PolarHBondContact O-NE2 3.23Å
259	Q	57.1	Low	81.9	Confident	183 Å²	183	71 Å²	71	86%	0.855	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-4.4	178.9	-66.1	-177.4	-1.2	0	0	114.1	E257	E257-Q259 PolarHBondContact O-N 3.18Å
260	S	70	Confident	82.1	Confident	30 Å²	30	69 Å²	69	21%	0.21	33%	0.325	C	S	.	.			trans	-80.3	134	-177	-43.4	0	0	0	0	110.2	E256 E257 I262 Q336	E256-S260 WeakPolarHBondContact OE2-CB 3.16Å; E256-S260 PolarHBondContact OE2-OG 3.32Å; E257-S260 WeakPolarHBondContact O-CB 3.42Å; E257-S260 PolarHBondContact O-N 2.9Å; E257-S260 PolarHBondContact O-OG 3.25Å; S260-I262 VanDerWaalsContact CB-O 3.29Å; S260-I262 WeakPolarHBondContact CB-O 3.32Å; S260-I262 PolarHBondContact O-N 3.44Å; S260-Q336 PolarHBondContact O-NE2 3.39Å
261	E	78.2	Confident	81.9	Confident	78 Å²	78	69 Å²	69	36%	0.364	32%	0.32	S	S	.	.	S	Bend	trans	-62.9	-35.7	179.1	-68.2	-172.2	161.3	0	0	111.7	L308 G309 H335 Q336 M389	E261-L308 HydrophobicContact CB-CD1 4.42Å; E261-G309 WeakPolarHBondContact OE2-CA 3.45Å; E261-G309 PolarHBondContact OE2-N 2.94Å; E261-H335 CarbonylContact O-C 3.53Å; E261-H335 WeakPolarHBondContact O-CA 3.38Å; E261-H335 VanDerWaalsContact O-CB 3.27Å; E261-H335 WeakPolarHBondContact O-CB 3.19Å; E261-Q336 PolarHBondContact O-N 3.14Å; E261-M389 VanDerWaalsContact OE2-CE 3.24Å; E261-M389 WeakPolarHBondContact OE2-CE 3.29Å
262	I	84.4	Confident	81.6	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.015	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.6	170.1	-68.2	167.2	0	0	0	107.6	S260 L308 K311 F333 Q334 H335	S260-I262 VanDerWaalsContact CB-O 3.29Å; S260-I262 WeakPolarHBondContact CB-O 3.32Å; S260-I262 PolarHBondContact O-N 3.44Å; I262-L308 HydrophobicContact CD1-CB 4.39Å; I262-L308 HydrophobicContact CD1-CD2 4.19Å; I262-L308 HydrophobicContact CD1-CG 3.91Å; I262-L308 WeakPolarHBondContact CD1-O 3.17Å; I262-L308 HydrophobicContact CG1-CD2 4.04Å; I262-L308 HydrophobicContact CG1-CG 3.85Å; I262-K311 HydrophobicContact CD1-CB 3.41Å; I262-K311 VanDerWaalsContact CD1-CB 3.41Å; I262-K311 HydrophobicContact CD1-CG 4Å; I262-F333 HydrophobicContact CD1-CD1 4.15Å; I262-F333 HydrophobicContact CG2-CD1 4.47Å; I262-Q334 CarbonylContact C-O 3.59Å; I262-Q334 WeakPolarHBondContact CA-O 3.45Å; I262-H335 HydrophobicContact CG1-CB 4.43Å
263	M	85.3	Confident	81.3	Confident	39 Å²	39	64 Å²	64	19%	0.192	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-40.2	-179.2	-65.1	-62.2	-59.2	0	0	111.5	Q255 E256 Q334 Q336	Q255-M263 WeakPolarHBondContact CA-O 3.31Å; E256-M263 PolarHBondContact N-O 3.17Å; M263-Q334 PolarHBondContact N-O 2.95Å; M263-Q336 HydrophobicContact SD-CG 4.43Å
264	E	90.4	Very high	80.9	Confident	51 Å²	51	63.5 Å²	63.5	24%	0.238	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	162.4	177.4	59.5	169.1	-127.5	0	0	110.7	S253 Q334	S253-E264 WeakPolarHBondContact OG-CA 3.43Å; E264-Q334 VanDerWaalsContact CD-CD 3.48Å; E264-Q334 HydrophobicContact CG-CB 3.59Å; E264-Q334 HydrophobicContact CG-CG 3.59Å; E264-Q334 PolarHBondContact N-O 3.25Å; E264-Q334 PolarHBondContact O-N 3.41Å; E264-Q334 PolarHBondContact OE1-NE2 2.68Å
265	Y	92.9	Very high	80.6	Confident	18 Å²	18	60.2 Å²	60.2	7%	0.071	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.2	169.3	66.6	-92.5	0	0	0	111.6	S253 V267 D292 K311 L313 T332	S253-Y265 VanDerWaalsContact CB-CZ 3.48Å; S253-Y265 WeakPolarHBondContact CB-O 3.47Å; S253-Y265 PolarHBondContact N-O 3.45Å; S253-Y265 PolarHBondContact OG-N 2.95Å; S253-Y265 PolarHBondContact OG-O 3.26Å; Y265-V267 HydrophobicContact CD2-CG2 4.09Å; Y265-V267 HydrophobicContact CE2-CG2 4.28Å; Y265-D292 WeakPolarHBondContact CE1-OD2 3.36Å; Y265-D292 WeakPolarHBondContact OH-CB 3.35Å; Y265-D292 PolarHBondContact OH-OD2 3.31Å; Y265-K311 VanDerWaalsContact CE1-CE 3.49Å; Y265-L313 HydrophobicContact CD2-CD2 4.01Å; Y265-L313 HydrophobicContact CE2-CD1 3.84Å; Y265-L313 HydrophobicContact CE2-CD2 4.02Å; Y265-T332 CarbonylContact C-O 3.58Å; Y265-T332 WeakPolarHBondContact CA-O 3.32Å
266	S	94.3	Very high	80	Confident	27 Å²	27	62.9 Å²	62.9	19%	0.189	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	145.6	169.2	67.3	0	0	0	0	111.2	I251 H252 L331 T332	I251-S266 CarbonylContact O-C 3.51Å; I251-S266 VanDerWaalsContact O-CA 3.22Å; I251-S266 WeakPolarHBondContact O-CA 3.42Å; H252-S266 WeakPolarHBondContact ND1-CB 3.34Å; S266-L331 CarbonylContact O-C 3.55Å; S266-L331 WeakPolarHBondContact O-CA 3.24Å; S266-T332 PolarHBondContact N-O 3.05Å; S266-T332 PolarHBondContact O-N 3.09Å; S266-T332 WeakPolarHBondContact OG-CB 3.48Å
267	V	94.2	Very high	79.5	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.012	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.5	177.2	-170.4	0	0	0	0	108.1	H250 I251 Y265 L269 L290 L313 I315 V329 V330 L331	H250-V267 WeakPolarHBondContact CA-O 3.41Å; I251-V267 HydrophobicContact CB-CB 4.26Å; I251-V267 PolarHBondContact N-O 3.14Å; I251-V267 PolarHBondContact O-N 2.85Å; Y265-V267 HydrophobicContact CD2-CG2 4.09Å; Y265-V267 HydrophobicContact CE2-CG2 4.28Å; V267-L269 HydrophobicContact CG1-CD2 4.26Å; V267-L269 HydrophobicContact CG1-CG 4.04Å; V267-L290 HydrophobicContact CG2-CD1 4.43Å; V267-L313 HydrophobicContact CG2-CD2 3.39Å; V267-I315 HydrophobicContact CG1-CD1 3.55Å; V267-V329 HydrophobicContact CG1-CG1 4.26Å; V267-V330 WeakPolarHBondContact CA-O 3.43Å; V267-L331 HydrophobicContact CG1-CD2 4.45Å; V267-L331 HydrophobicContact CG2-CD2 4.35Å
268	L	93.8	Very high	79.1	Confident	50 Å²	50	63.4 Å²	63.4	26%	0.262	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	111.6	170.3	179.2	60.3	0	0	0	109	D248 H250 V330	D248-L268 HydrophobicContact CB-CD1 3.77Å; H250-L268 WeakPolarHBondContact CE1-CD1 3.17Å; H250-L268 VanDerWaalsContact NE2-CD1 3.34Å; H250-L268 WeakPolarHBondContact NE2-CD1 3.18Å; L268-V330 HydrophobicContact CB-CB 3.99Å; L268-V330 HydrophobicContact CB-CG2 4.48Å; L268-V330 HydrophobicContact CD2-CB 4.4Å; L268-V330 HydrophobicContact CD2-CG2 4.14Å; L268-V330 PolarHBondContact N-O 3.46Å; L268-V330 PolarHBondContact O-N 2.87Å; L268-V330 VanDerWaalsContact O-N 3.09Å
269	L	91.8	Very high	79	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	118.6	173.5	-65.8	167.9	0	0	0	109.4	D248 L249 I251 V267 L273 F274 L288 I315 V329 L382	D248-L269 WeakPolarHBondContact CA-O 3.3Å; L249-L269 HydrophobicContact CB-CB 4.23Å; L249-L269 HydrophobicContact CD2-CD1 4.17Å; L249-L269 PolarHBondContact N-O 3.42Å; L249-L269 PolarHBondContact O-N 3.4Å; I251-L269 HydrophobicContact CD1-CD1 4.3Å; V267-L269 HydrophobicContact CG1-CD2 4.26Å; V267-L269 HydrophobicContact CG1-CG 4.04Å; L269-L273 HydrophobicContact CB-CD2 4.31Å; L269-L273 HydrophobicContact CD2-CD2 4.09Å; L269-F274 HydrophobicContact CB-CZ 4.19Å; L269-L288 HydrophobicContact CD1-CD1 4.18Å; L269-L288 HydrophobicContact CD1-CD2 3.51Å; L269-L288 HydrophobicContact CD1-CG 4.45Å; L269-I315 HydrophobicContact CD1-CG2 4.43Å; L269-I315 HydrophobicContact CD2-CD1 4.43Å; L269-I315 HydrophobicContact CD2-CG2 4.05Å; L269-V329 HydrophobicContact CD2-CB 4.46Å; L269-V329 HydrophobicContact CD2-CG1 3.69Å; L269-V329 HydrophobicContact CD2-CG2 3.91Å; L269-L382 HydrophobicContact CD2-CD2 3.99Å
270	P	90.2	Very high	78.8	Confident	6 Å²	6	58.8 Å²	58.8	4%	0.039	27%	0.269	C	S	.	.			trans	-71.4	146	-176.2	29.1	-34	0	0	0	111.5	D248 T272 L273 E327	D248-P270 WeakPolarHBondContact OD1-CA 3.49Å; P270-T272 PolarHBondContact O-N 3.4Å; P270-T272 VanDerWaalsContact O-N 3.13Å; P270-L273 WeakPolarHBondContact O-CB 3.2Å; P270-L273 PolarHBondContact O-N 2.83Å; P270-E327 HydrophobicContact CB-CB 3.9Å; P270-E327 WeakPolarHBondContact CB-OE2 3.42Å; P270-E327 HydrophobicContact CG-CB 4.16Å
271	R	85.1	Confident	78.2	Confident	116 Å²	116	64 Å²	64	44%	0.438	31%	0.305	S	S	.	.	H	α-helix	trans	-57	-28	178.6	64.4	-171.5	175.8	176.1	-3.3	114.4	D248 L273 F274 Q275	D248-R271 WeakPolarHBondContact OD1-CB 3.18Å; D248-R271 WeakPolarHBondContact OD1-CG 3.35Å; D248-R271 PolarHBondContact OD1-N 3.02Å; R271-L273 PolarHBondContact O-N 3.31Å; R271-F274 PolarHBondContact O-N 2.88Å; R271-Q275 PolarHBondContact O-N 3.43Å
272	T	82.3	Confident	77.1	Confident	35 Å²	35	64.3 Å²	64.3	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-59.5	-28.5	176.8	46.8	0	0	0	0	112.1	P270 F274 E327	P270-T272 PolarHBondContact O-N 3.4Å; P270-T272 VanDerWaalsContact O-N 3.13Å; T272-F274 VanDerWaalsContact C-N 3.34Å; T272-F274 PolarHBondContact O-N 2.99Å; T272-E327 HydrophobicContact CG2-CG 4.46Å; T272-E327 WeakPolarHBondContact CG2-OE2 3.25Å; T272-E327 PolarHBondContact OG1-OE2 3.45Å
273	L	81.5	Confident	75.9	Confident	5 Å²	5	70 Å²	70	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-58	-46.8	171.7	-178.5	65.4	0	0	0	111.5	L269 P270 R271 V322 L325 L382	L269-L273 HydrophobicContact CB-CD2 4.31Å; L269-L273 HydrophobicContact CD2-CD2 4.09Å; P270-L273 WeakPolarHBondContact O-CB 3.2Å; P270-L273 PolarHBondContact O-N 2.83Å; R271-L273 PolarHBondContact O-N 3.31Å; L273-V322 HydrophobicContact CD1-CB 4.35Å; L273-V322 HydrophobicContact CD1-CG1 3.59Å; L273-V322 HydrophobicContact CD1-CG2 4.05Å; L273-L325 HydrophobicContact CD1-CD2 4.23Å; L273-L382 HydrophobicContact CD1-CD1 3.69Å; L273-L382 HydrophobicContact CD1-CG 4.47Å; L273-L382 HydrophobicContact CD2-CD1 3.88Å; L273-L382 HydrophobicContact CG-CD1 4.42Å
274	F	78	Confident	74.8	Confident	12 Å²	12	72.3 Å²	72.3	5%	0.053	38%	0.381	C	S	.	.	H	α-helix	trans	-80.3	-24.9	-174.1	-52.9	-56.2	0	0	0	112.8	L240 A244 L249 L269 R271 T272 R276 T277 L288	L240-F274 HydrophobicContact CD1-CD1 4.11Å; L240-F274 HydrophobicContact CD1-CE1 4.28Å; L240-F274 HydrophobicContact CD2-CD1 3.55Å; L240-F274 HydrophobicContact CD2-CE1 3.36Å; L240-F274 HydrophobicContact CD2-CZ 4.27Å; L240-F274 HydrophobicContact CG-CD1 4.42Å; L240-F274 HydrophobicContact CG-CE1 4.47Å; A244-F274 HydrophobicContact CB-CB 4.33Å; A244-F274 HydrophobicContact CB-CG 4.26Å; A244-F274 WeakPolarHBondContact O-CD2 3.27Å; L249-F274 HydrophobicContact CB-CE2 3.91Å; L249-F274 HydrophobicContact CB-CZ 3.99Å; L249-F274 HydrophobicContact CD2-CZ 4.09Å; L269-F274 HydrophobicContact CB-CZ 4.19Å; R271-F274 PolarHBondContact O-N 2.88Å; T272-F274 VanDerWaalsContact C-N 3.34Å; T272-F274 PolarHBondContact O-N 2.99Å; F274-R276 PolarHBondContact O-N 2.9Å; F274-T277 VanDerWaalsContact C-OG1 3.29Å; F274-T277 VanDerWaalsContact CA-OG1 3.26Å; F274-T277 WeakPolarHBondContact CA-OG1 3.34Å; F274-T277 PolarHBondContact O-N 3.32Å; F274-T277 PolarHBondContact O-OG1 3.49Å; F274-L288 HydrophobicContact CE1-CD2 4.48Å
275	Q	71.9	Confident	73.9	Confident	113 Å²	113	75.3 Å²	75.3	53%	0.528	40%	0.395	S	S	.	.	H	α-helix	trans	-63.8	-40.7	174.1	-69.8	179.6	2	0	0	112.1	R271 T277 K278	R271-Q275 PolarHBondContact O-N 3.43Å; Q275-T277 PolarHBondContact O-N 3.27Å; Q275-K278 PolarHBondContact O-N 3.01Å
276	R	63.3	Low	73.3	Confident	202 Å²	202	76.4 Å²	76.4	76%	0.762	40%	0.4	S	S	*	.	H	α-helix	trans	-70.9	-21.9	178.8	-157.3	171.8	-169.3	168.2	2	112.8	F274 K278	F274-R276 PolarHBondContact O-N 2.9Å; R276-K278 VanDerWaalsContact C-N 3.34Å
277	T	61.6	Low	73	Confident	20 Å²	20	77 Å²	77	12%	0.123	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-8.4	179	53.8	0	0	0	0	114.7	F274 Q275 G279 K286 V317	F274-T277 VanDerWaalsContact C-OG1 3.29Å; F274-T277 VanDerWaalsContact CA-OG1 3.26Å; F274-T277 WeakPolarHBondContact CA-OG1 3.34Å; F274-T277 PolarHBondContact O-N 3.32Å; F274-T277 PolarHBondContact O-OG1 3.49Å; Q275-T277 PolarHBondContact O-N 3.27Å; T277-G279 VanDerWaalsContact C-N 3.33Å; T277-G279 PolarHBondContact O-N 3Å; T277-K286 HydrophobicContact CG2-CD 4.07Å; T277-V317 HydrophobicContact CG2-CG1 4.28Å
278	K	58	Low	72.9	Confident	166 Å²	166	77 Å²	77	72%	0.722	40%	0.398	S	S	*	.			trans	-63.8	93.5	178.4	-160.5	171.8	-173	174.3	0	109.5	Q275 R276	Q275-K278 PolarHBondContact O-N 3.01Å; R276-K278 VanDerWaalsContact C-N 3.34Å
279	G	54.6	Low	72.8	Confident	31 Å²	31	74.7 Å²	74.7	32%	0.32	39%	0.386	S	S	.	.			trans	-58.6	157.1	178.2	0	0	0	0	0	111.7	T277 E283	T277-G279 VanDerWaalsContact C-N 3.33Å; T277-G279 PolarHBondContact O-N 3Å; G279-E283 WeakPolarHBondContact CA-OE2 3.4Å
280	R	53.9	Low	72.9	Confident	231 Å²	231	75 Å²	75	87%	0.872	39%	0.388	S	S	*	.	S	Bend	trans	-58.7	145.8	168.7	-128.6	170.9	-174.6	159.7	0.1	108	G282 E283	R280-G282 PolarHBondContact O-N 3.33Å; R280-E283 PolarHBondContact O-N 3.41Å; R280-E283 VanDerWaalsContact O-N 3.12Å
281	S	56.6	Low	73.1	Confident	138 Å²	138	74.8 Å²	74.8	97%	0.965	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.2	115.8	179.8	-170.8	0	0	0	0	111.3
282	G	55	Low	73.5	Confident	85 Å²	85	69.5 Å²	69.5	88%	0.876	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.9	-5.7	-178.2	0	0	0	0	0	116.8	R280	R280-G282 PolarHBondContact O-N 3.33Å
283	E	58.8	Low	74	Confident	123 Å²	123	67.9 Å²	67.9	58%	0.575	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-78.6	140.2	175.7	-140	168.5	-177.8	0	0	111.7	G279 R280	G279-E283 WeakPolarHBondContact CA-OE2 3.4Å; R280-E283 PolarHBondContact O-N 3.41Å; R280-E283 VanDerWaalsContact O-N 3.12Å
284	A	62.4	Low	74.4	Confident	87 Å²	87	68.7 Å²	68.7	72%	0.719	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-60.3	148.8	-179.9	0	0	0	0	0	112.2	K286	A284-K286 PolarHBondContact O-N 3.43Å; A284-K286 VanDerWaalsContact O-N 3.15Å
285	E	70.6	Confident	74.8	Confident	115 Å²	115	68.5 Å²	68.5	54%	0.537	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-52.1	118.5	173.8	-66.6	178	165.9	0	0	110.6
286	K	82.1	Confident	75.4	Confident	40 Å²	40	65 Å²	65	17%	0.174	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-71.3	152.9	177	-68.2	-166.8	-173.6	170.2	0	110.6	L240 T277 A284 T320	L240-K286 VanDerWaalsContact CB-O 3.29Å; L240-K286 WeakPolarHBondContact CB-O 3.43Å; L240-K286 HydrophobicContact CD1-CB 4.14Å; L240-K286 PolarHBondContact N-O 2.94Å; T277-K286 HydrophobicContact CG2-CD 4.07Å; A284-K286 PolarHBondContact O-N 3.43Å; A284-K286 VanDerWaalsContact O-N 3.15Å; K286-T320 HydrophobicContact CD-CG2 4.34Å
287	R	88.2	Confident	76.3	Confident	40 Å²	40	56.3 Å²	56.3	15%	0.151	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.4	-179.9	-63.5	172.3	176.9	-158.7	-9.6	111	T217 V219 V237 W238 Q318	T217-R287 VanDerWaalsContact O-CD 3.31Å; T217-R287 WeakPolarHBondContact O-CD 3.5Å; T217-R287 PolarHBondContact O-NH1 3.49Å; V219-R287 VanDerWaalsContact O-CZ 3.28Å; V219-R287 PolarHBondContact O-NH1 3.07Å; V219-R287 PolarHBondContact O-NH2 3.18Å; V237-R287 HydrophobicContact CG1-CB 4.28Å; W238-R287 WeakPolarHBondContact O-CA 3.39Å; R287-Q318 HydrophobicContact CB-CB 4.22Å; R287-Q318 PolarHBondContact O-N 3.2Å
288	L	90.5	Very high	77.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	134.7	169.5	173.2	71.1	0	0	0	108.1	V237 W238 L240 L249 L269 F274 I315 V317	V237-L288 WeakPolarHBondContact CA-O 3.41Å; W238-L288 HydrophobicContact CB-CB 4.29Å; W238-L288 HydrophobicContact CD2-CD2 4.43Å; W238-L288 HydrophobicContact CE3-CD2 4.21Å; W238-L288 HydrophobicContact CE3-CG 4.22Å; W238-L288 PolarHBondContact N-O 3.07Å; W238-L288 PolarHBondContact O-N 3.37Å; L240-L288 HydrophobicContact CD1-CB 4.21Å; L240-L288 HydrophobicContact CD2-CB 4.09Å; L240-L288 HydrophobicContact CG-CB 4.2Å; L249-L288 HydrophobicContact CD2-CD2 3.61Å; L269-L288 HydrophobicContact CD1-CD1 4.18Å; L269-L288 HydrophobicContact CD1-CD2 3.51Å; L269-L288 HydrophobicContact CD1-CG 4.45Å; F274-L288 HydrophobicContact CE1-CD2 4.48Å; L288-I315 HydrophobicContact CD1-CG2 3.93Å; L288-V317 HydrophobicContact CD1-CG2 3.87Å
289	L	92.5	Very high	78.7	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.016	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.6	177.1	173.4	63.5	0	0	0	109.6	E213 L216 V237 V291 I315 V316	E213-L289 HydrophobicContact CB-CD2 4.45Å; E213-L289 HydrophobicContact CG-CD2 4.07Å; L216-L289 HydrophobicContact CB-CD1 4.05Å; L216-L289 HydrophobicContact CB-CD2 4.28Å; L216-L289 HydrophobicContact CD1-CD1 3.67Å; L216-L289 HydrophobicContact CD1-CD2 3.94Å; L216-L289 HydrophobicContact CD1-CG 4.46Å; L216-L289 HydrophobicContact CD2-CD1 4.35Å; L216-L289 HydrophobicContact CG-CD1 4.25Å; V237-L289 HydrophobicContact CG2-CD1 3.91Å; L289-V291 HydrophobicContact CD1-CG2 3.7Å; L289-V291 HydrophobicContact CD2-CG2 3.75Å; L289-V291 HydrophobicContact CG-CG2 3.67Å; L289-I315 WeakPolarHBondContact O-CA 3.5Å; L289-V316 PolarHBondContact N-O 3.14Å; L289-V316 PolarHBondContact O-N 3.28Å
290	L	94.1	Very high	79.9	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.037	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.9	165.8	-174.9	72.1	0	0	0	108	A235 T236 W238 I251 V267 L313 G314 I315	A235-L290 CarbonylContact C-O 3.51Å; A235-L290 WeakPolarHBondContact CA-O 3.27Å; T236-L290 PolarHBondContact N-O 3.45Å; T236-L290 PolarHBondContact O-N 3.4Å; W238-L290 HydrophobicContact CH2-CB 3.71Å; W238-L290 HydrophobicContact CH2-CD2 3.97Å; W238-L290 HydrophobicContact CZ3-CB 3.42Å; W238-L290 VanDerWaalsContact CZ3-CB 3.42Å; I251-L290 HydrophobicContact CD1-CD2 4.17Å; I251-L290 HydrophobicContact CG2-CD2 3.85Å; V267-L290 HydrophobicContact CG2-CD1 4.43Å; L290-L313 HydrophobicContact CD1-CD1 3.64Å; L290-L313 HydrophobicContact CD1-CD2 3.95Å; L290-L313 HydrophobicContact CD1-CG 3.7Å; L290-L313 HydrophobicContact CD2-CD1 4.48Å; L290-L313 HydrophobicContact CG-CD1 4.01Å; L290-G314 CarbonylContact C-O 3.37Å; L290-G314 VanDerWaalsContact CA-O 3.28Å; L290-G314 WeakPolarHBondContact CA-O 3Å; L290-I315 HydrophobicContact CD1-CD1 4.33Å; L290-I315 HydrophobicContact CD1-CG1 3.54Å
291	V	94.4	Very high	80.8	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121	172.9	-169.2	0	0	0	0	108.9	L212 L216 I233 N234 A235 L289 F293 L313 G314	L212-V291 HydrophobicContact CD2-CG1 4.38Å; L216-V291 HydrophobicContact CD1-CG2 4.18Å; I233-V291 HydrophobicContact CD1-CG1 3.99Å; I233-V291 HydrophobicContact CG1-CG1 3.89Å; N234-V291 CarbonylContact O-C 3.55Å; N234-V291 WeakPolarHBondContact O-CA 3.29Å; A235-V291 HydrophobicContact CB-CG1 4.47Å; A235-V291 HydrophobicContact CB-CG2 4.32Å; L289-V291 HydrophobicContact CD1-CG2 3.7Å; L289-V291 HydrophobicContact CD2-CG2 3.75Å; L289-V291 HydrophobicContact CG-CG2 3.67Å; V291-F293 HydrophobicContact CB-CE2 3.96Å; V291-F293 HydrophobicContact CG1-CD2 3.85Å; V291-F293 HydrophobicContact CG1-CE1 4.28Å; V291-F293 HydrophobicContact CG1-CE2 3.31Å; V291-F293 HydrophobicContact CG1-CZ 3.57Å; V291-L313 CarbonylContact O-C 3.44Å; V291-L313 WeakPolarHBondContact O-CA 3.26Å; V291-G314 PolarHBondContact N-O 3.46Å; V291-G314 PolarHBondContact O-N 2.9Å
292	D	93.4	Very high	81.4	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.027	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	115.8	175.8	169.8	4.7	0	0	0	108.7	I233 N234 Y265 K311 L313	I233-D292 CarbonylContact C-O 3.46Å; I233-D292 VanDerWaalsContact CA-O 3.28Å; I233-D292 WeakPolarHBondContact CA-O 3.46Å; N234-D292 HydrophobicContact CB-CB 4.2Å; N234-D292 PolarHBondContact N-O 3.41Å; N234-D292 PolarHBondContact O-N 2.95Å; Y265-D292 WeakPolarHBondContact CE1-OD2 3.36Å; Y265-D292 WeakPolarHBondContact OH-CB 3.35Å; Y265-D292 PolarHBondContact OH-OD2 3.31Å; D292-K311 VanDerWaalsContact CG-CE 3.41Å; D292-K311 WeakPolarHBondContact OD1-CD 3.43Å; D292-K311 WeakPolarHBondContact OD1-CE 3.12Å; D292-K311 IonicContact OD1-NZ 3.97Å; D292-K311 PolarHBondContact OD1-NZ 3.47Å; D292-K311 WeakPolarHBondContact OD2-CE 3.28Å; D292-K311 IonicContact OD2-NZ 3.5Å; D292-K311 PolarHBondContact OD2-NZ 3.16Å; D292-L313 HydrophobicContact CB-CD1 3.83Å
293	F	92.8	Very high	82	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.4	172.5	-64.4	-89.7	0	0	0	110.2	L186 L190 L209 L212 I233 V291 S295 L298 F299 K311 V312 Y384	L186-F293 HydrophobicContact CD2-CE1 4.46Å; L190-F293 HydrophobicContact CD1-CD1 3.8Å; L190-F293 HydrophobicContact CD1-CE1 4.25Å; L209-F293 HydrophobicContact CD2-CE2 4.18Å; L209-F293 HydrophobicContact CD2-CZ 3.78Å; L212-F293 HydrophobicContact CD2-CZ 3.95Å; I233-F293 HydrophobicContact CB-CD1 4.43Å; I233-F293 HydrophobicContact CD1-CD1 3.93Å; I233-F293 HydrophobicContact CD1-CE1 3.36Å; I233-F293 HydrophobicContact CD1-CZ 3.89Å; I233-F293 HydrophobicContact CG1-CD1 4.07Å; I233-F293 HydrophobicContact CG1-CE1 3.99Å; V291-F293 HydrophobicContact CB-CE2 3.96Å; V291-F293 HydrophobicContact CG1-CD2 3.85Å; V291-F293 HydrophobicContact CG1-CE1 4.28Å; V291-F293 HydrophobicContact CG1-CE2 3.31Å; V291-F293 HydrophobicContact CG1-CZ 3.57Å; F293-S295 VanDerWaalsContact C-N 3.28Å; F293-S295 PolarHBondContact O-N 2.91Å; F293-L298 HydrophobicContact CD1-CD1 4.38Å; F293-L298 HydrophobicContact CE1-CD1 3.75Å; F293-L298 HydrophobicContact CZ-CD1 4.23Å; F293-F299 AromaticContact CD2-CE2 3.9Å; F293-F299 HydrophobicContact CD2-CE2 3.9Å; F293-F299 HydrophobicContact CD2-CZ 4.11Å; F293-F299 HydrophobicContact CE2-CE2 4.18Å; F293-F299 HydrophobicContact CE2-CZ 4.01Å; F293-F299 HydrophobicContact CG-CE2 4.13Å; F293-K311 WeakPolarHBondContact O-CA 3.49Å; F293-V312 HydrophobicContact CB-CB 4.26Å; F293-V312 PolarHBondContact N-O 3.46Å; F293-V312 PolarHBondContact O-N 3.47Å; F293-Y384 HydrophobicContact CE2-CD1 4.22Å; F293-Y384 AromaticContact CE2-CE1 3.86Å; F293-Y384 HydrophobicContact CE2-CE1 3.86Å
294	S	89.7	Confident	82.6	Confident	23 Å²	23	42.6 Å²	42.6	16%	0.161	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	35.9	170.1	-54.1	0	0	0	0	111.5	R232 E310	R232-S294 WeakPolarHBondContact CD-O 3.37Å; R232-S294 PolarHBondContact NH1-O 3.36Å; R232-S294 PolarHBondContact O-N 3.29Å; S294-E310 CarbonylContact C-O 3.45Å
295	S	86.3	Confident	83.3	Confident	7 Å²	7	39.7 Å²	39.7	5%	0.049	21%	0.206	C	C	.	.			trans	-161.8	136.3	176.3	-177.3	0	0	0	0	111.1	F293 A297 E310	F293-S295 VanDerWaalsContact C-N 3.28Å; F293-S295 PolarHBondContact O-N 2.91Å; S295-A297 VanDerWaalsContact C-N 3.32Å; S295-A297 PolarHBondContact O-N 3.33Å; S295-A297 PolarHBondContact OG-N 2.91Å; S295-E310 CarbonylContact C-O 3.53Å; S295-E310 VanDerWaalsContact C-O 3.31Å; S295-E310 WeakPolarHBondContact CA-O 3.39Å; S295-E310 PolarHBondContact N-O 3.37Å
296	Q	84.1	Confident	83.7	Confident	41 Å²	41	39.3 Å²	39.3	19%	0.192	21%	0.205	C	C	.	.			trans	-87.4	8.9	176.5	66.8	179.4	12.8	0	0	114.1	L298 F299 V307 E310	Q296-L298 PolarHBondContact O-N 3.48Å; Q296-L298 VanDerWaalsContact O-N 3.13Å; Q296-F299 CarbonylContact O-C 3.58Å; Q296-F299 PolarHBondContact O-N 2.86Å; Q296-V307 HydrophobicContact CB-CB 4.49Å; Q296-V307 HydrophobicContact CB-CG2 4.37Å; Q296-V307 VanDerWaalsContact OE1-CB 3.28Å; Q296-E310 HydrophobicContact CB-CB 4.47Å; Q296-E310 HydrophobicContact CG-CB 4.42Å; Q296-E310 HydrophobicContact CG-CG 4.27Å
297	A	83.4	Confident	83.9	Confident	18 Å²	18	37.5 Å²	37.5	15%	0.149	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.6	-172.4	0	0	0	0	0	114.8	L190 P193 S295	L190-A297 HydrophobicContact CD2-CB 3.93Å; P193-A297 HydrophobicContact CB-CB 4.15Å; P193-A297 HydrophobicContact CG-CB 4.4Å; S295-A297 VanDerWaalsContact C-N 3.32Å; S295-A297 PolarHBondContact O-N 3.33Å; S295-A297 PolarHBondContact OG-N 2.91Å
298	L	84.1	Confident	83.8	Confident	7 Å²	7	35.6 Å²	35.6	4%	0.037	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-12.4	174.3	-66	173.2	0	0	0	113.4	L186 F189 L190 A205 L209 F293 Q296	L186-L298 HydrophobicContact CD1-CD1 4.37Å; F189-L298 HydrophobicContact CE1-CD2 4.05Å; L190-L298 HydrophobicContact CD2-CD1 4.08Å; L190-L298 HydrophobicContact CD2-CG 3.83Å; A205-L298 HydrophobicContact CB-CB 4.34Å; A205-L298 HydrophobicContact CB-CD2 4.21Å; A205-L298 WeakPolarHBondContact CB-O 3.29Å; L209-L298 HydrophobicContact CD2-CD1 4.14Å; F293-L298 HydrophobicContact CD1-CD1 4.38Å; F293-L298 HydrophobicContact CE1-CD1 3.75Å; F293-L298 HydrophobicContact CZ-CD1 4.23Å; Q296-L298 PolarHBondContact O-N 3.48Å; Q296-L298 VanDerWaalsContact O-N 3.13Å
299	F	85.5	Confident	83.5	Confident	1 Å²	1	36.8 Å²	36.8	0%	0.004	20%	0.202	C	C	.	.			trans	-124.4	54.5	-168.2	-51.9	-82.1	0	0	0	110.6	L209 F293 Q296 V312 W349 W361 Y384	L209-F299 HydrophobicContact CD1-CD1 4.5Å; L209-F299 HydrophobicContact CD1-CE1 3.63Å; L209-F299 HydrophobicContact CD1-CZ 4.03Å; L209-F299 HydrophobicContact CD2-CE1 4.39Å; L209-F299 HydrophobicContact CD2-CZ 3.94Å; F293-F299 AromaticContact CD2-CE2 3.9Å; F293-F299 HydrophobicContact CD2-CE2 3.9Å; F293-F299 HydrophobicContact CD2-CZ 4.11Å; F293-F299 HydrophobicContact CE2-CE2 4.18Å; F293-F299 HydrophobicContact CE2-CZ 4.01Å; F293-F299 HydrophobicContact CG-CE2 4.13Å; Q296-F299 CarbonylContact O-C 3.58Å; Q296-F299 PolarHBondContact O-N 2.86Å; F299-V312 HydrophobicContact CD1-CG1 4.43Å; F299-V312 HydrophobicContact CD2-CB 4.04Å; F299-V312 HydrophobicContact CD2-CG1 3.94Å; F299-V312 HydrophobicContact CD2-CG2 3.77Å; F299-V312 HydrophobicContact CE1-CG1 4.19Å; F299-V312 HydrophobicContact CE2-CB 3.88Å; F299-V312 HydrophobicContact CE2-CG1 3.68Å; F299-V312 HydrophobicContact CE2-CG2 4.15Å; F299-V312 HydrophobicContact CG-CG1 4.31Å; F299-V312 HydrophobicContact CG-CG2 4.35Å; F299-V312 HydrophobicContact CZ-CB 4.49Å; F299-V312 HydrophobicContact CZ-CG1 3.81Å; F299-W349 HydrophobicContact CB-CD2 4.28Å; F299-W349 HydrophobicContact CB-CE3 4.05Å; F299-W349 HydrophobicContact CB-CZ3 4.19Å; F299-W349 HydrophobicContact CD1-CB 4.04Å; F299-W349 AromaticContact CD1-CD1 3.78Å; F299-W349 AromaticContact CD1-CD2 3.73Å; F299-W349 HydrophobicContact CD1-CD2 3.73Å; F299-W349 HydrophobicContact CD1-CE3 4.3Å; F299-W349 AromaticContact CD1-CG 3.59Å; F299-W349 HydrophobicContact CD1-CG 3.59Å; F299-W349 HydrophobicContact CE1-CB 4.38Å; F299-W349 HydrophobicContact CE1-CG 4.12Å; F299-W361 HydrophobicContact CB-CH2 3.56Å; F299-W361 HydrophobicContact CB-CZ2 3.33Å; F299-W361 HydrophobicContact CD1-CH2 4.23Å; F299-W361 AromaticContact CG-CH2 3.99Å; F299-W361 HydrophobicContact CG-CH2 3.99Å; F299-W361 HydrophobicContact CG-CZ2 4.25Å; F299-W361 WeakPolarHBondContact O-CZ2 3.22Å; F299-Y384 HydrophobicContact CE1-CD1 4.06Å; F299-Y384 HydrophobicContact CE1-CD2 4.42Å; F299-Y384 AromaticContact CE1-CG 3.88Å; F299-Y384 HydrophobicContact CE1-CG 3.88Å; F299-Y384 AromaticContact CZ-CD1 3.79Å; F299-Y384 HydrophobicContact CZ-CD1 3.79Å; F299-Y384 HydrophobicContact CZ-CE1 4.33Å; F299-Y384 HydrophobicContact CZ-CG 4.1Å
300	Q	79.2	Confident	83.3	Confident	109 Å²	109	40.6 Å²	40.6	51%	0.509	22%	0.22	S	C	.	.			trans	-96.9	114.5	178.8	-65.2	-172.7	-4.6	0	0	109.9	P358	Q300-P358 WeakPolarHBondContact O-CB 3.42Å
301	D	73.4	Confident	83.2	Confident	14 Å²	14	40.4 Å²	40.4	8%	0.075	22%	0.219	C	C	.	.			trans	-85.3	169.3	171.7	70.7	-43.1	0	0	0	111.2	N303 S304 S305 W349 G359	D301-N303 PolarHBondContact O-N 2.79Å; D301-N303 VanDerWaalsContact O-N 3.11Å; D301-N303 WeakPolarHBondContact OD2-CB 3.36Å; D301-N303 PolarHBondContact OD2-N 2.87Å; D301-S304 PolarHBondContact O-N 3.24Å; D301-S304 PolarHBondContact OD1-N 3.31Å; D301-S305 WeakPolarHBondContact OD1-CB 3Å; D301-S305 PolarHBondContact OD1-N 3.33Å; D301-S305 PolarHBondContact OD1-OG 3.47Å; D301-S305 PolarHBondContact OD2-OG 3.28Å; D301-W349 HydrophobicContact CB-CZ3 4.34Å; D301-G359 WeakPolarHBondContact CA-O 3.33Å
302	K	69	Low	83.1	Confident	147 Å²	147	40.3 Å²	40.3	64%	0.639	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.2	178.9	-66.6	-179	-175.9	168.6	0	113.7	S357 P358	K302-S357 VanDerWaalsContact CE-OG 3.27Å; K302-S357 WeakPolarHBondContact CE-OG 3.32Å; K302-S357 PolarHBondContact NZ-OG 2.94Å; K302-S357 VanDerWaalsContact NZ-OG 3.12Å; K302-P358 HydrophobicContact CG-CG 3.96Å
303	N	67.5	Low	83.2	Confident	130 Å²	130	40.1 Å²	40.1	70%	0.695	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.2	-179.2	-60.9	-11.8	0	0	0	113.2	D301 S305	D301-N303 PolarHBondContact O-N 2.79Å; D301-N303 VanDerWaalsContact O-N 3.11Å; D301-N303 WeakPolarHBondContact OD2-CB 3.36Å; D301-N303 PolarHBondContact OD2-N 2.87Å; N303-S305 PolarHBondContact O-N 3.12Å
304	S	72	Confident	83.3	Confident	98 Å²	98	40.2 Å²	40.2	69%	0.685	22%	0.218	S	C	*	.			trans	51.8	45.5	-174.1	-57.8	0	0	0	0	112.1	D301	D301-S304 PolarHBondContact O-N 3.24Å; D301-S304 PolarHBondContact OD1-N 3.31Å
305	S	75.6	Confident	83.5	Confident	26 Å²	26	39.1 Å²	39.1	18%	0.182	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-62.7	138.6	-176.1	-57.1	0	0	0	0	110.6	D301 N303 L388	D301-S305 WeakPolarHBondContact OD1-CB 3Å; D301-S305 PolarHBondContact OD1-N 3.33Å; D301-S305 PolarHBondContact OD1-OG 3.47Å; D301-S305 PolarHBondContact OD2-OG 3.28Å; N303-S305 PolarHBondContact O-N 3.12Å; S305-L388 VanDerWaalsContact CB-CD1 3.44Å
306	Q	79.5	Confident	83.8	Confident	108 Å²	108	40 Å²	40	51%	0.505	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-85.1	119.4	-176.6	-175.1	176.3	4	0	0	111.5	L388 M389	Q306-L388 VanDerWaalsContact O-CD1 3.27Å; Q306-L388 WeakPolarHBondContact O-CD1 3.43Å; Q306-M389 HydrophobicContact CB-CB 4.37Å; Q306-M389 HydrophobicContact CG-CB 4.44Å; Q306-M389 HydrophobicContact CG-SD 4.08Å; Q306-M389 PolarHBondContact O-N 2.94Å
307	V	86.3	Confident	84	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.8	171.3	177.2	0	0	0	0	110.3	Q296 G309 E310 K311 V312 W361 A386 L388	Q296-V307 HydrophobicContact CB-CB 4.49Å; Q296-V307 HydrophobicContact CB-CG2 4.37Å; Q296-V307 VanDerWaalsContact OE1-CB 3.28Å; V307-G309 PolarHBondContact O-N 3.15Å; V307-E310 PolarHBondContact O-N 3.39Å; V307-E310 VanDerWaalsContact O-N 3.08Å; V307-K311 WeakPolarHBondContact CG1-O 3.44Å; V307-V312 HydrophobicContact CG1-CG2 4.45Å; V307-W361 HydrophobicContact CG2-CH2 4.49Å; V307-W361 HydrophobicContact CG2-CZ2 3.82Å; V307-A386 HydrophobicContact CG1-CB 3.77Å; V307-A386 HydrophobicContact CG2-CB 4.14Å; V307-L388 HydrophobicContact CG2-CD1 4.18Å
308	L	86.7	Confident	84	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	121.1	174.9	178.5	66.7	0	0	0	110.5	E261 I262 E310 K311 H335 L344 V387 M389	E261-L308 HydrophobicContact CB-CD1 4.42Å; I262-L308 HydrophobicContact CD1-CB 4.39Å; I262-L308 HydrophobicContact CD1-CD2 4.19Å; I262-L308 HydrophobicContact CD1-CG 3.91Å; I262-L308 WeakPolarHBondContact CD1-O 3.17Å; I262-L308 HydrophobicContact CG1-CD2 4.04Å; I262-L308 HydrophobicContact CG1-CG 3.85Å; L308-E310 PolarHBondContact O-N 2.93Å; L308-K311 PolarHBondContact O-N 3.16Å; L308-K311 VanDerWaalsContact O-N 3.17Å; L308-H335 HydrophobicContact CD2-CB 4.05Å; L308-L344 HydrophobicContact CD1-CD2 4.38Å; L308-L344 HydrophobicContact CD2-CD1 4.32Å; L308-L344 HydrophobicContact CD2-CD2 4.2Å; L308-V387 HydrophobicContact CB-CB 4.07Å; L308-V387 HydrophobicContact CB-CG1 4.24Å; L308-V387 VanDerWaalsContact CB-O 3.27Å; L308-V387 WeakPolarHBondContact CB-O 3.22Å; L308-V387 HydrophobicContact CD2-CB 4.07Å; L308-V387 HydrophobicContact CD2-CG1 3.9Å; L308-V387 PolarHBondContact N-O 3.25Å; L308-M389 HydrophobicContact CB-CE 4.4Å; L308-M389 HydrophobicContact CB-CG 4.35Å; L308-M389 HydrophobicContact CD1-CE 3.33Å; L308-M389 HydrophobicContact CG-CE 4.44Å
309	G	85.1	Confident	83.8	Confident	26 Å²	26	46.8 Å²	46.8	27%	0.268	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	58.3	15.3	-177.2	0	0	0	0	0	115.3	E261 V307 K311	E261-G309 WeakPolarHBondContact OE2-CA 3.45Å; E261-G309 PolarHBondContact OE2-N 2.94Å; V307-G309 PolarHBondContact O-N 3.15Å; G309-K311 PolarHBondContact O-N 3.19Å
310	E	87	Confident	83.7	Confident	82 Å²	82	48.7 Å²	48.7	38%	0.383	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52	22.3	-169.7	-54.1	-174.3	173.4	0	0	114.1	S294 S295 Q296 V307 L308	S294-E310 CarbonylContact C-O 3.45Å; S295-E310 CarbonylContact C-O 3.53Å; S295-E310 VanDerWaalsContact C-O 3.31Å; S295-E310 WeakPolarHBondContact CA-O 3.39Å; S295-E310 PolarHBondContact N-O 3.37Å; Q296-E310 HydrophobicContact CB-CB 4.47Å; Q296-E310 HydrophobicContact CG-CB 4.42Å; Q296-E310 HydrophobicContact CG-CG 4.27Å; V307-E310 PolarHBondContact O-N 3.39Å; V307-E310 VanDerWaalsContact O-N 3.08Å; L308-E310 PolarHBondContact O-N 2.93Å
311	K	91.5	Very high	83.9	Confident	3 Å²	3	53.9 Å²	53.9	1%	0.013	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121.9	-171.5	-164.1	79.1	166.5	177.2	0	110.6	E256 I262 Y265 D292 F293 V307 L308 G309	E256-K311 IonicContact OE1-NZ 3.93Å; E256-K311 PolarHBondContact OE1-NZ 3.09Å; I262-K311 HydrophobicContact CD1-CB 3.41Å; I262-K311 VanDerWaalsContact CD1-CB 3.41Å; I262-K311 HydrophobicContact CD1-CG 4Å; Y265-K311 VanDerWaalsContact CE1-CE 3.49Å; D292-K311 VanDerWaalsContact CG-CE 3.41Å; D292-K311 WeakPolarHBondContact OD1-CD 3.43Å; D292-K311 WeakPolarHBondContact OD1-CE 3.12Å; D292-K311 IonicContact OD1-NZ 3.97Å; D292-K311 PolarHBondContact OD1-NZ 3.47Å; D292-K311 WeakPolarHBondContact OD2-CE 3.28Å; D292-K311 IonicContact OD2-NZ 3.5Å; D292-K311 PolarHBondContact OD2-NZ 3.16Å; F293-K311 WeakPolarHBondContact O-CA 3.49Å; V307-K311 WeakPolarHBondContact CG1-O 3.44Å; L308-K311 PolarHBondContact O-N 3.16Å; L308-K311 VanDerWaalsContact O-N 3.17Å; G309-K311 PolarHBondContact O-N 3.19Å
312	V	93.9	Very high	84.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	125.7	176.6	-174	0	0	0	0	109.5	F293 F299 V307 W361 F385 A386	F293-V312 HydrophobicContact CB-CB 4.26Å; F293-V312 PolarHBondContact N-O 3.46Å; F293-V312 PolarHBondContact O-N 3.47Å; F299-V312 HydrophobicContact CD1-CG1 4.43Å; F299-V312 HydrophobicContact CD2-CB 4.04Å; F299-V312 HydrophobicContact CD2-CG1 3.94Å; F299-V312 HydrophobicContact CD2-CG2 3.77Å; F299-V312 HydrophobicContact CE1-CG1 4.19Å; F299-V312 HydrophobicContact CE2-CB 3.88Å; F299-V312 HydrophobicContact CE2-CG1 3.68Å; F299-V312 HydrophobicContact CE2-CG2 4.15Å; F299-V312 HydrophobicContact CG-CG1 4.31Å; F299-V312 HydrophobicContact CG-CG2 4.35Å; F299-V312 HydrophobicContact CZ-CB 4.49Å; F299-V312 HydrophobicContact CZ-CG1 3.81Å; V307-V312 HydrophobicContact CG1-CG2 4.45Å; V312-W361 HydrophobicContact CG1-CH2 4.28Å; V312-W361 HydrophobicContact CG2-CH2 4.16Å; V312-F385 CarbonylContact C-O 3.6Å; V312-F385 WeakPolarHBondContact CA-O 3.37Å; V312-A386 HydrophobicContact CG2-CB 4.26Å
313	L	95.1	Very high	85.3	Confident	1 Å²	1	50 Å²	50	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	108.1	-177.3	-163.3	68.6	0	0	0	111.2	Y265 V267 L290 V291 D292 I315 L331 Y384 F385	Y265-L313 HydrophobicContact CD2-CD2 4.01Å; Y265-L313 HydrophobicContact CE2-CD1 3.84Å; Y265-L313 HydrophobicContact CE2-CD2 4.02Å; V267-L313 HydrophobicContact CG2-CD2 3.39Å; L290-L313 HydrophobicContact CD1-CD1 3.64Å; L290-L313 HydrophobicContact CD1-CD2 3.95Å; L290-L313 HydrophobicContact CD1-CG 3.7Å; L290-L313 HydrophobicContact CD2-CD1 4.48Å; L290-L313 HydrophobicContact CG-CD1 4.01Å; V291-L313 CarbonylContact O-C 3.44Å; V291-L313 WeakPolarHBondContact O-CA 3.26Å; D292-L313 HydrophobicContact CB-CD1 3.83Å; L313-I315 HydrophobicContact CD2-CD1 4.48Å; L313-L331 HydrophobicContact CD2-CD2 3.58Å; L313-Y384 CarbonylContact O-C 3.45Å; L313-Y384 WeakPolarHBondContact O-CA 3.4Å; L313-F385 PolarHBondContact N-O 2.99Å; L313-F385 PolarHBondContact O-N 3.2Å
314	G	94.5	Very high	86.3	Confident	1 Å²	1	50 Å²	50	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	122.1	171.4	0	0	0	0	0	111.9	L290 V291 T383	L290-G314 CarbonylContact C-O 3.37Å; L290-G314 VanDerWaalsContact CA-O 3.28Å; L290-G314 WeakPolarHBondContact CA-O 3Å; V291-G314 PolarHBondContact N-O 3.46Å; V291-G314 PolarHBondContact O-N 2.9Å; G314-T383 WeakPolarHBondContact CA-O 3.08Å
315	I	94.4	Very high	87	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	117.6	169.9	-53.7	166.7	0	0	0	107.5	V267 L269 L288 L289 L290 L313 V329 L331 L382 T383 F385	V267-I315 HydrophobicContact CG1-CD1 3.55Å; L269-I315 HydrophobicContact CD1-CG2 4.43Å; L269-I315 HydrophobicContact CD2-CD1 4.43Å; L269-I315 HydrophobicContact CD2-CG2 4.05Å; L288-I315 HydrophobicContact CD1-CG2 3.93Å; L289-I315 WeakPolarHBondContact O-CA 3.5Å; L290-I315 HydrophobicContact CD1-CD1 4.33Å; L290-I315 HydrophobicContact CD1-CG1 3.54Å; L313-I315 HydrophobicContact CD2-CD1 4.48Å; I315-V329 HydrophobicContact CD1-CG1 4.29Å; I315-L331 HydrophobicContact CD1-CD2 3.73Å; I315-L382 HydrophobicContact CB-CD2 4.11Å; I315-L382 HydrophobicContact CG2-CD1 4.3Å; I315-L382 HydrophobicContact CG2-CD2 3.7Å; I315-L382 HydrophobicContact CG2-CG 4.48Å; I315-L382 CarbonylContact O-C 3.56Å; I315-L382 WeakPolarHBondContact O-CB 3.27Å; I315-T383 PolarHBondContact N-O 3.1Å; I315-T383 PolarHBondContact O-N 2.85Å; I315-F385 HydrophobicContact CD1-CD2 4.33Å; I315-F385 HydrophobicContact CD1-CE2 4.36Å
316	V	91.8	Very high	87.5	Confident	26 Å²	26	51.7 Å²	51.7	16%	0.158	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.8	-174.7	-176.4	0	0	0	0	109.9	L289	L289-V316 PolarHBondContact N-O 3.14Å; L289-V316 PolarHBondContact O-N 3.28Å
317	V	88.8	Confident	88.1	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131.9	170.8	-178.7	0	0	0	0	108.6	L240 T277 L288 N319 T320 L382	L240-V317 HydrophobicContact CD1-CG1 4.41Å; T277-V317 HydrophobicContact CG2-CG1 4.28Å; L288-V317 HydrophobicContact CD1-CG2 3.87Å; V317-N319 PolarHBondContact O-N 2.99Å; V317-T320 VanDerWaalsContact CB-OG1 3.25Å; V317-T320 WeakPolarHBondContact CB-OG1 3.33Å; V317-T320 WeakPolarHBondContact CG1-OG1 3.48Å; V317-T320 PolarHBondContact O-N 2.99Å; V317-T320 VanDerWaalsContact O-N 3.15Å; V317-T320 PolarHBondContact O-OG1 3.31Å; V317-L382 HydrophobicContact CG2-CD1 3.71Å
318	Q	84.2	Confident	88.4	Confident	47 Å²	47	52.7 Å²	52.7	22%	0.22	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	125	-175.3	-178.1	179.3	19.8	0	0	112.4	T217 R287 T320	T217-Q318 HydrophobicContact CG2-CB 3.88Å; T217-Q318 HydrophobicContact CG2-CG 3.9Å; T217-Q318 PolarHBondContact O-NE2 3.21Å; R287-Q318 HydrophobicContact CB-CB 4.22Å; R287-Q318 PolarHBondContact O-N 3.2Å; Q318-T320 PolarHBondContact O-N 2.92Å
319	N	79.6	Confident	88.8	Confident	159 Å²	159	52.7 Å²	52.7	85%	0.85	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	21.4	176.4	-64.7	-13.4	0	0	0	115.1	V317	V317-N319 PolarHBondContact O-N 2.99Å
320	T	82.8	Confident	89.3	Confident	41 Å²	41	52.5 Å²	52.5	25%	0.252	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-135.9	118.6	179.7	56.5	0	0	0	0	111.4	K286 V317 Q318 V322	K286-T320 HydrophobicContact CD-CG2 4.34Å; V317-T320 VanDerWaalsContact CB-OG1 3.25Å; V317-T320 WeakPolarHBondContact CB-OG1 3.33Å; V317-T320 WeakPolarHBondContact CG1-OG1 3.48Å; V317-T320 PolarHBondContact O-N 2.99Å; V317-T320 VanDerWaalsContact O-N 3.15Å; V317-T320 PolarHBondContact O-OG1 3.31Å; Q318-T320 PolarHBondContact O-N 2.92Å; T320-V322 PolarHBondContact O-N 3.34Å
321	K	84	Confident	89.7	Confident	218 Å²	218	48.6 Å²	48.6	95%	0.948	27%	0.266	S	S	*	.			trans	-79.4	117.9	167.2	-68.8	-169.2	176.9	-171.7	0	109
322	V	85	Confident	89.9	Confident	24 Å²	24	49.4 Å²	49.4	15%	0.145	27%	0.271	C	S	.	.			trans	-104	118.1	-179.8	-179.5	0	0	0	0	108.9	L273 T320 L325 H381 L382	L273-V322 HydrophobicContact CD1-CB 4.35Å; L273-V322 HydrophobicContact CD1-CG1 3.59Å; L273-V322 HydrophobicContact CD1-CG2 4.05Å; T320-V322 PolarHBondContact O-N 3.34Å; V322-L325 HydrophobicContact CG1-CD1 3.98Å; V322-L325 HydrophobicContact CG1-CD2 3.61Å; V322-L325 HydrophobicContact CG1-CG 3.85Å; V322-H381 VanDerWaalsContact O-CA 3.29Å; V322-H381 WeakPolarHBondContact O-CA 3.44Å; V322-H381 VanDerWaalsContact O-CB 3.29Å; V322-H381 WeakPolarHBondContact O-CB 3.18Å; V322-L382 HydrophobicContact CB-CB 4.14Å; V322-L382 HydrophobicContact CB-CD1 3.98Å; V322-L382 HydrophobicContact CB-CG 4.01Å; V322-L382 HydrophobicContact CG1-CD1 4.24Å; V322-L382 HydrophobicContact CG1-CG 4.16Å; V322-L382 HydrophobicContact CG2-CD1 4.04Å; V322-L382 PolarHBondContact O-N 3.33Å; V322-L382 VanDerWaalsContact O-N 3.08Å
323	A	87.2	Confident	90	Very high	55 Å²	55	49.5 Å²	49.5	46%	0.455	27%	0.271	S	S	.	.			trans	-144.6	163.4	177.3	0	0	0	0	0	110.8	L325 N380 H381	A323-L325 PolarHBondContact O-N 3.38Å; A323-N380 CarbonylContact C-O 3.51Å; A323-H381 HydrophobicContact CB-CB 4.21Å
324	N	86.7	Confident	89.9	Confident	130 Å²	130	53 Å²	53	70%	0.695	29%	0.287	S	S	*	.			trans	53.5	48.4	-178.4	-62.8	-23.9	0	0	0	113	N380	N324-N380 PolarHBondContact N-O 2.87Å
325	L	87.2	Confident	89.6	Confident	21 Å²	21	53.3 Å²	53.3	11%	0.11	29%	0.288	C	S	.	.			trans	-66.2	134.8	170.3	-66	169.8	0	0	0	110.2	L273 V322 A323 E327 V329 N380	L273-L325 HydrophobicContact CD1-CD2 4.23Å; V322-L325 HydrophobicContact CG1-CD1 3.98Å; V322-L325 HydrophobicContact CG1-CD2 3.61Å; V322-L325 HydrophobicContact CG1-CG 3.85Å; A323-L325 PolarHBondContact O-N 3.38Å; L325-E327 WeakPolarHBondContact CB-O 3.48Å; L325-V329 HydrophobicContact CD1-CG2 3.82Å; L325-N380 WeakPolarHBondContact CB-O 3.42Å; L325-N380 WeakPolarHBondContact CG-O 3.28Å; L325-N380 PolarHBondContact N-O 2.86Å
326	T	87.3	Confident	89.1	Confident	139 Å²	139	57.4 Å²	57.4	85%	0.853	31%	0.308	S	S	*	.	S	Bend	trans	-71.3	-38.1	175.1	5.4	0	0	0	0	112
327	E	90.8	Very high	88.5	Confident	75 Å²	75	62 Å²	62	35%	0.35	33%	0.33	S	S	.	.	S	Bend	trans	-102.7	125.4	170.4	-69.5	171.6	170.3	0	0	108.4	P270 T272 L325	P270-E327 HydrophobicContact CB-CB 3.9Å; P270-E327 WeakPolarHBondContact CB-OE2 3.42Å; P270-E327 HydrophobicContact CG-CB 4.16Å; T272-E327 HydrophobicContact CG2-CG 4.46Å; T272-E327 WeakPolarHBondContact CG2-OE2 3.25Å; T272-E327 PolarHBondContact OG1-OE2 3.45Å; L325-E327 WeakPolarHBondContact CB-O 3.48Å
328	P	93.3	Very high	87.8	Confident	55 Å²	55	63.3 Å²	63.3	36%	0.357	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-73.9	149.4	-177	30.2	-34.8	0	0	0	111.8	F378 C379	P328-F378 HydrophobicContact CB-CB 4.07Å; P328-F378 HydrophobicContact CG-CB 4.3Å; P328-F378 HydrophobicContact CG-CD1 4.01Å; P328-C379 CarbonylContact C-O 3.5Å; P328-C379 WeakPolarHBondContact CA-O 3.44Å
329	V	94.3	Very high	87	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	131.3	163.9	178	0	0	0	0	108.1	V267 L269 I315 L325 L331 F378 C379 L382	V267-V329 HydrophobicContact CG1-CG1 4.26Å; L269-V329 HydrophobicContact CD2-CB 4.46Å; L269-V329 HydrophobicContact CD2-CG1 3.69Å; L269-V329 HydrophobicContact CD2-CG2 3.91Å; I315-V329 HydrophobicContact CD1-CG1 4.29Å; L325-V329 HydrophobicContact CD1-CG2 3.82Å; V329-L331 HydrophobicContact CG1-CG 4.46Å; V329-F378 WeakPolarHBondContact O-CA 3.28Å; V329-C379 PolarHBondContact N-O 3.03Å; V329-C379 PolarHBondContact O-N 3.4Å; V329-L382 HydrophobicContact CG2-CD2 3.7Å
330	V	96	Very high	86.3	Confident	23 Å²	23	66.7 Å²	66.7	14%	0.139	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114	-179.6	-167.5	0	0	0	0	109.2	V267 L268 C377 F378	V267-V330 WeakPolarHBondContact CA-O 3.43Å; L268-V330 HydrophobicContact CB-CB 3.99Å; L268-V330 HydrophobicContact CB-CG2 4.48Å; L268-V330 HydrophobicContact CD2-CB 4.4Å; L268-V330 HydrophobicContact CD2-CG2 4.14Å; L268-V330 PolarHBondContact N-O 3.46Å; L268-V330 PolarHBondContact O-N 2.87Å; L268-V330 VanDerWaalsContact O-N 3.09Å; V330-C377 WeakPolarHBondContact CA-O 3.22Å; V330-F378 HydrophobicContact CB-CD1 4.46Å; V330-F378 HydrophobicContact CB-CE1 4.34Å; V330-F378 HydrophobicContact CG1-CD1 4.19Å; V330-F378 HydrophobicContact CG1-CE1 3.78Å; V330-F378 HydrophobicContact CG1-CZ 3.97Å; V330-F378 HydrophobicContact CG2-CD1 3.66Å; V330-F378 HydrophobicContact CG2-CE1 3.61Å
331	L	96.4	Very high	85.2	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.4	170.9	-50.8	119.4	0	0	0	107.8	S266 V267 L313 I315 V329 F333 S376 C377 F385	S266-L331 CarbonylContact O-C 3.55Å; S266-L331 WeakPolarHBondContact O-CA 3.24Å; V267-L331 HydrophobicContact CG1-CD2 4.45Å; V267-L331 HydrophobicContact CG2-CD2 4.35Å; L313-L331 HydrophobicContact CD2-CD2 3.58Å; I315-L331 HydrophobicContact CD1-CD2 3.73Å; V329-L331 HydrophobicContact CG1-CG 4.46Å; L331-F333 HydrophobicContact CB-CE2 3.74Å; L331-F333 HydrophobicContact CB-CZ 4.27Å; L331-S376 CarbonylContact O-C 3.55Å; L331-S376 VanDerWaalsContact O-CA 3.28Å; L331-S376 WeakPolarHBondContact O-CA 3.45Å; L331-C377 HydrophobicContact CB-CB 4.12Å; L331-C377 HydrophobicContact CD1-CB 3.93Å; L331-C377 PolarHBondContact N-O 2.9Å; L331-C377 PolarHBondContact O-N 3.37Å; L331-F385 HydrophobicContact CD1-CB 4.16Å; L331-F385 HydrophobicContact CD1-CD1 4.26Å; L331-F385 HydrophobicContact CD1-CD2 3.92Å; L331-F385 HydrophobicContact CD1-CE2 4.43Å; L331-F385 HydrophobicContact CD1-CG 3.83Å; L331-F385 HydrophobicContact CD2-CB 4.38Å; L331-F385 HydrophobicContact CD2-CD2 4.08Å; L331-F385 HydrophobicContact CD2-CG 4.44Å
332	T	95.8	Very high	84.7	Confident	19 Å²	19	58.5 Å²	58.5	12%	0.117	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.8	177.8	-60.7	0	0	0	0	109.5	Y265 S266 Q374 T375 S376	Y265-T332 CarbonylContact C-O 3.58Å; Y265-T332 WeakPolarHBondContact CA-O 3.32Å; S266-T332 PolarHBondContact N-O 3.05Å; S266-T332 PolarHBondContact O-N 3.09Å; S266-T332 WeakPolarHBondContact OG-CB 3.48Å; T332-Q374 HydrophobicContact CG2-CG 3.5Å; T332-Q374 VanDerWaalsContact CG2-NE2 3.26Å; T332-T375 WeakPolarHBondContact CA-O 3.35Å; T332-S376 WeakPolarHBondContact CG2-OG 3.49Å; T332-S376 PolarHBondContact OG1-OG 3.47Å; T332-S376 VanDerWaalsContact OG1-OG 3.05Å
333	F	94.3	Very high	84.5	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.009	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	118.8	178.8	-61	-90.7	0	0	0	108.6	I262 L331 Q374 T375 V387	I262-F333 HydrophobicContact CD1-CD1 4.15Å; I262-F333 HydrophobicContact CG2-CD1 4.47Å; L331-F333 HydrophobicContact CB-CE2 3.74Å; L331-F333 HydrophobicContact CB-CZ 4.27Å; F333-Q374 CarbonylContact O-C 3.48Å; F333-Q374 WeakPolarHBondContact O-CA 3.43Å; F333-T375 PolarHBondContact N-O 3.46Å; F333-T375 PolarHBondContact O-N 3.49Å; F333-V387 HydrophobicContact CD2-CG2 3.43Å; F333-V387 VanDerWaalsContact CD2-CG2 3.43Å; F333-V387 HydrophobicContact CE2-CG2 3.67Å; F333-V387 HydrophobicContact CG-CG2 3.97Å; F333-V387 HydrophobicContact CZ-CG2 4.36Å
334	Q	93	Very high	84.6	Confident	75 Å²	75	57.7 Å²	57.7	35%	0.35	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	125.9	167.6	-60.6	-159.6	18	0	0	108.8	I262 M263 E264	I262-Q334 CarbonylContact C-O 3.59Å; I262-Q334 WeakPolarHBondContact CA-O 3.45Å; M263-Q334 PolarHBondContact N-O 2.95Å; E264-Q334 VanDerWaalsContact CD-CD 3.48Å; E264-Q334 HydrophobicContact CG-CB 3.59Å; E264-Q334 HydrophobicContact CG-CG 3.59Å; E264-Q334 PolarHBondContact N-O 3.25Å; E264-Q334 PolarHBondContact O-N 3.41Å; E264-Q334 PolarHBondContact OE1-NE2 2.68Å
335	H	88.1	Confident	84.8	Confident	7 Å²	7	54.5 Å²	54.5	3%	0.032	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	159.6	-174.9	58	72	0	0	0	110.9	E261 I262 L308 L344 E372 T373 Q374 T375	E261-H335 CarbonylContact O-C 3.53Å; E261-H335 WeakPolarHBondContact O-CA 3.38Å; E261-H335 VanDerWaalsContact O-CB 3.27Å; E261-H335 WeakPolarHBondContact O-CB 3.19Å; I262-H335 HydrophobicContact CG1-CB 4.43Å; L308-H335 HydrophobicContact CD2-CB 4.05Å; H335-L344 VanDerWaalsContact NE2-CD1 3.26Å; H335-L344 WeakPolarHBondContact NE2-CD1 3.32Å; H335-E372 PolarHBondContact CE1-O 3.41Å; H335-T373 PolarHBondContact N-O 3.4Å; H335-T373 CarbonylContact O-C 3.58Å; H335-T373 WeakPolarHBondContact O-CA 3.26Å; H335-T373 VanDerWaalsContact O-O 3.11Å; H335-Q374 PolarHBondContact NE2-N 2.88Å; H335-T375 PolarHBondContact NE2-OG1 2.88Å
336	Q	84.2	Confident	85.1	Confident	87 Å²	87	53.6 Å²	53.6	41%	0.407	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-60.2	157.1	170.3	-58.9	-170.3	13.7	0	0	110.4	E258 S260 E261 M263 Q338	E258-Q336 PolarHBondContact O-NE2 3.23Å; S260-Q336 PolarHBondContact O-NE2 3.39Å; E261-Q336 PolarHBondContact O-N 3.14Å; M263-Q336 HydrophobicContact SD-CG 4.43Å; Q336-Q338 PolarHBondContact O-N 2.65Å; Q336-Q338 PolarHBondContact O-NE2 3.23Å
337	L	79	Confident	85.5	Confident	122 Å²	122	47.2 Å²	47.2	64%	0.639	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-55.6	117.1	179.1	-177.7	67.5	0	0	0	109.6	E372	L337-E372 HydrophobicContact CD1-CB 3.94Å
338	Q	74.8	Confident	85.6	Confident	31 Å²	31	45.1 Å²	45.1	15%	0.145	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-82.1	148.8	-178.5	-65.2	-57.9	-43.9	0	0	111.3	Q336 L344	Q336-Q338 PolarHBondContact O-N 2.65Å; Q336-Q338 PolarHBondContact O-NE2 3.23Å; Q338-L344 HydrophobicContact CG-CD1 4.02Å; Q338-L344 HydrophobicContact CG-CD2 4.3Å; Q338-L344 HydrophobicContact CG-CG 4.48Å
339	P	68	Low	85.5	Confident	69 Å²	69	43.2 Å²	43.2	45%	0.448	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-56.4	140.8	172.9	-25.7	36.3	0	0	0	112.2	N341 V342	P339-N341 WeakPolarHBondContact CB-OD1 3.1Å; P339-N341 PolarHBondContact O-N 3.31Å; P339-V342 HydrophobicContact CB-CG2 4.32Å; P339-V342 PolarHBondContact O-N 2.93Å
340	K	65.2	Low	85.3	Confident	208 Å²	208	45 Å²	45	90%	0.904	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.4	-179.1	-67.6	-172.4	178.5	-175.8	0	114.1	V342 S392	K340-V342 VanDerWaalsContact C-N 3.3Å; K340-S392 PolarHBondContact O-OG 3.33Å
341	N	59.4	Low	84.6	Confident	58 Å²	58	46.9 Å²	46.9	31%	0.31	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	7.5	177.9	61.5	-39.6	0	0	0	114.2	P339 S391 S392 V393	P339-N341 WeakPolarHBondContact CB-OD1 3.1Å; P339-N341 PolarHBondContact O-N 3.31Å; N341-S391 CarbonylContact O-C 3.54Å; N341-S391 WeakPolarHBondContact O-CA 3.38Å; N341-S392 VanDerWaalsContact CA-OG 3.23Å; N341-S392 WeakPolarHBondContact CA-OG 3.42Å; N341-S392 PolarHBondContact O-N 2.82Å; N341-S392 PolarHBondContact O-OG 3.4Å; N341-S392 VanDerWaalsContact O-OG 3.11Å; N341-V393 HydrophobicContact CB-CB 3.78Å; N341-V393 HydrophobicContact CB-CG2 3.71Å; N341-V393 PolarHBondContact O-N 3.4Å
342	V	72.2	Confident	83.4	Confident	29 Å²	29	49.1 Å²	49.1	18%	0.176	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.5	177.1	-178.5	0	0	0	0	109	P339 K340 L344 M389 V390 S392	P339-V342 HydrophobicContact CB-CG2 4.32Å; P339-V342 PolarHBondContact O-N 2.93Å; K340-V342 VanDerWaalsContact C-N 3.3Å; V342-L344 HydrophobicContact CG1-CD2 4.17Å; V342-M389 HydrophobicContact CG1-CB 3.66Å; V342-M389 HydrophobicContact CG1-CG 3.92Å; V342-M389 HydrophobicContact CG1-SD 4.46Å; V342-V390 CarbonylContact C-O 3.23Å; V342-S392 PolarHBondContact N-OG 3.37Å
343	T	81.8	Confident	81.9	Confident	53 Å²	53	54 Å²	54	33%	0.325	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.4	163.7	41.9	0	0	0	0	109.7	V390	T343-V390 PolarHBondContact N-O 3.41Å; T343-V390 WeakPolarHBondContact O-CA 3.37Å; T343-V390 WeakPolarHBondContact O-CB 3.43Å; T343-V390 PolarHBondContact O-N 3.18Å; T343-V390 VanDerWaalsContact O-O 3.1Å; T343-V390 PolarHBondContact OG1-O 3.38Å
344	L	88.5	Confident	80.4	Confident	9 Å²	9	57.9 Å²	57.9	5%	0.047	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137.9	172.8	-60.7	178.4	0	0	0	110.2	L308 H335 Q338 V342 R370 T375 V387 L388 M389	L308-L344 HydrophobicContact CD1-CD2 4.38Å; L308-L344 HydrophobicContact CD2-CD1 4.32Å; L308-L344 HydrophobicContact CD2-CD2 4.2Å; H335-L344 VanDerWaalsContact NE2-CD1 3.26Å; H335-L344 WeakPolarHBondContact NE2-CD1 3.32Å; Q338-L344 HydrophobicContact CG-CD1 4.02Å; Q338-L344 HydrophobicContact CG-CD2 4.3Å; Q338-L344 HydrophobicContact CG-CG 4.48Å; V342-L344 HydrophobicContact CG1-CD2 4.17Å; L344-R370 PolarHBondContact O-NE 2.9Å; L344-R370 PolarHBondContact O-NH2 2.76Å; L344-T375 HydrophobicContact CB-CG2 4.35Å; L344-T375 WeakPolarHBondContact CD1-OG1 3.13Å; L344-V387 HydrophobicContact CB-CG1 3.78Å; L344-V387 HydrophobicContact CD2-CG1 4.09Å; L344-V387 HydrophobicContact CG-CG1 4.35Å; L344-L388 CarbonylContact C-O 3.59Å; L344-L388 WeakPolarHBondContact CA-O 3.47Å; L344-M389 HydrophobicContact CD2-CG 4.14Å
345	Q	90.5	Very high	78.8	Confident	63 Å²	63	60.9 Å²	60.9	29%	0.294	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	126.7	177.7	-172.3	170.2	7.6	0	0	110.7	V347 S363 V387 L388 V390	Q345-V347 HydrophobicContact CG-CG1 4.38Å; Q345-V347 PolarHBondContact O-N 3.11Å; Q345-S363 PolarHBondContact NE2-OG 3.47Å; Q345-V387 CarbonylContact O-C 3.58Å; Q345-L388 PolarHBondContact N-O 3.35Å; Q345-L388 PolarHBondContact O-N 3.29Å; Q345-V390 HydrophobicContact CB-CG2 4.15Å
346	C	94.9	Very high	77.5	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.007	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.5	174	-59.2	0	0	0	0	110	C366 T368 C377	C346-C366 HydrophobicContact CB-CB 4.46Å; C346-T368 VanDerWaalsContact CB-OG1 3.31Å; C346-T368 WeakPolarHBondContact CB-OG1 3.33Å; C346-T368 PolarHBondContact N-OG1 3.41Å; C346-T368 PolarHBondContact SG-OG1 2.81Å; C346-C377 HydrophobicContact CB-CB 3.51Å; C346-C377 WeakPolarHBondContact CB-SG 3.3Å; C346-C377 WeakPolarHBondContact SG-CA 3.24Å; C346-C377 WeakPolarHBondContact SG-CB 3.46Å; C346-C377 CovalentContact SG-SG 2.01Å; C346-C377 PolarHBondContact SG-SG 3.48Å
347	V	94.5	Very high	76.5	Confident	6 Å²	6	62.8 Å²	62.8	4%	0.036	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	159.8	-179.3	-64.4	0	0	0	0	110.3	Q345 W361 S362 F385 A386 L388	Q345-V347 HydrophobicContact CG-CG1 4.38Å; Q345-V347 PolarHBondContact O-N 3.11Å; V347-W361 HydrophobicContact CB-CB 4.18Å; V347-W361 HydrophobicContact CB-CE3 4.31Å; V347-W361 HydrophobicContact CG1-CB 4.49Å; V347-W361 HydrophobicContact CG2-CB 4.16Å; V347-W361 HydrophobicContact CG2-CD2 4Å; V347-W361 HydrophobicContact CG2-CE3 3.66Å; V347-W361 HydrophobicContact CG2-CG 4.24Å; V347-W361 HydrophobicContact CG2-CZ3 4.36Å; V347-S362 CarbonylContact C-O 3.25Å; V347-S362 VanDerWaalsContact CA-O 3.26Å; V347-S362 WeakPolarHBondContact CA-O 3.28Å; V347-S362 WeakPolarHBondContact CB-O 3.47Å; V347-F385 WeakPolarHBondContact O-CA 3.39Å; V347-A386 HydrophobicContact CG2-CB 4.15Å; V347-A386 WeakPolarHBondContact CG2-O 3.42Å; V347-A386 PolarHBondContact N-O 3.15Å; V347-A386 PolarHBondContact O-N 2.98Å; V347-A386 VanDerWaalsContact O-O 3.12Å; V347-L388 HydrophobicContact CG1-CB 4.23Å; V347-L388 HydrophobicContact CG2-CB 3.99Å
348	F	93.8	Very high	75.9	Confident	30 Å²	30	60.2 Å²	60.2	13%	0.132	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.6	170.4	77.5	-82.2	0	0	0	110.7	V350 S362 A364 H381 T383 Y384 F385	F348-V350 HydrophobicContact CD2-CG2 4.06Å; F348-V350 HydrophobicContact CE1-CG2 4.48Å; F348-V350 HydrophobicContact CE2-CG2 3.34Å; F348-V350 HydrophobicContact CZ-CG2 3.59Å; F348-S362 WeakPolarHBondContact CD1-O 3.28Å; F348-S362 PolarHBondContact N-O 2.03Å; F348-S362 PolarHBondContact O-N 2.96Å; F348-A364 HydrophobicContact CE1-CB 4.06Å; F348-A364 WeakPolarHBondContact CE1-O 3.46Å; F348-H381 AromaticContact CD1-CE1 3.71Å; F348-H381 AromaticContact CD1-NE2 3.4Å; F348-H381 WeakPolarHBondContact CD1-NE2 3.12Å; F348-H381 AromaticContact CD2-NE2 3.63Å; F348-H381 AromaticContact CE1-CE1 3.95Å; F348-H381 AromaticContact CE1-NE2 3.87Å; F348-H381 AromaticContact CG-NE2 3.27Å; F348-H381 VanDerWaalsContact CG-NE2 3.27Å; F348-H381 WeakPolarHBondContact CG-NE2 3.19Å; F348-T383 WeakPolarHBondContact CB-OG1 3.01Å; F348-T383 HydrophobicContact CD2-CG2 4.31Å; F348-Y384 CarbonylContact C-O 2.94Å; F348-Y384 WeakPolarHBondContact CA-O 3.42Å; F348-F385 HydrophobicContact CB-CD1 3.74Å; F348-F385 HydrophobicContact CB-CE1 3.81Å
349	W	92	Very high	76.1	Confident	16 Å²	16	59 Å²	59	6%	0.061	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	123.8	179.9	-174.2	-114	0	0	0	111.3	F299 D301 G359 W361 Y384	F299-W349 HydrophobicContact CB-CD2 4.28Å; F299-W349 HydrophobicContact CB-CE3 4.05Å; F299-W349 HydrophobicContact CB-CZ3 4.19Å; F299-W349 HydrophobicContact CD1-CB 4.04Å; F299-W349 AromaticContact CD1-CD1 3.78Å; F299-W349 AromaticContact CD1-CD2 3.73Å; F299-W349 HydrophobicContact CD1-CD2 3.73Å; F299-W349 HydrophobicContact CD1-CE3 4.3Å; F299-W349 AromaticContact CD1-CG 3.59Å; F299-W349 HydrophobicContact CD1-CG 3.59Å; F299-W349 HydrophobicContact CE1-CB 4.38Å; F299-W349 HydrophobicContact CE1-CG 4.12Å; D301-W349 HydrophobicContact CB-CZ3 4.34Å; W349-G359 WeakPolarHBondContact CH2-O 3.17Å; W349-G359 VanDerWaalsContact CZ2-CA 3.47Å; W349-W361 HydrophobicContact CB-CE3 4.18Å; W349-W361 HydrophobicContact CB-CH2 4.32Å; W349-W361 HydrophobicContact CB-CZ3 3.72Å; W349-W361 AromaticContact CE3-CD2 3.71Å; W349-W361 HydrophobicContact CE3-CD2 3.71Å; W349-W361 AromaticContact CE3-CE2 3.69Å; W349-W361 AromaticContact CE3-CE3 3.85Å; W349-W361 HydrophobicContact CE3-CE3 3.85Å; W349-W361 HydrophobicContact CE3-CG 4.35Å; W349-W361 AromaticContact CE3-CH2 3.98Å; W349-W361 HydrophobicContact CE3-CH2 3.98Å; W349-W361 AromaticContact CE3-CZ2 3.86Å; W349-W361 HydrophobicContact CE3-CZ2 3.86Å; W349-W361 AromaticContact CE3-CZ3 3.97Å; W349-W361 HydrophobicContact CE3-CZ3 3.97Å; W349-W361 HydrophobicContact CZ3-CD2 4.17Å; W349-W361 AromaticContact CZ3-CE2 3.87Å; W349-W361 HydrophobicContact CZ3-CG 4.47Å; W349-W361 HydrophobicContact CZ3-CZ2 4.23Å; W349-W361 AromaticContact CZ3-NE1 3.95Å; W349-Y384 PolarHBondContact N-O 3.14Å
350	V	88.2	Confident	77	Confident	36 Å²	36	59.7 Å²	59.7	22%	0.218	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117	172	-176.3	0	0	0	0	108.8	F348 G359 H360	F348-V350 HydrophobicContact CD2-CG2 4.06Å; F348-V350 HydrophobicContact CE1-CG2 4.48Å; F348-V350 HydrophobicContact CE2-CG2 3.34Å; F348-V350 HydrophobicContact CZ-CG2 3.59Å; V350-G359 CarbonylContact O-C 3.59Å; V350-G359 VanDerWaalsContact O-CA 3.28Å; V350-G359 WeakPolarHBondContact O-CA 3.37Å; V350-H360 WeakPolarHBondContact CB-O 3.23Å; V350-H360 VanDerWaalsContact CG1-CE1 3.45Å; V350-H360 WeakPolarHBondContact CG1-CE1 3.28Å; V350-H360 PolarHBondContact N-O 2.65Å; V350-H360 PolarHBondContact O-N 3.42Å
351	E	81.9	Confident	78.1	Confident	63 Å²	63	51 Å²	51	29%	0.294	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-79.5	127.5	172	-63.4	-175.5	174.6	0	0	110.5	S206 Q210	S206-E351 WeakPolarHBondContact CB-OE2 3.28Å; Q210-E351 PolarHBondContact NE2-OE2 3.47Å
352	D	71	Confident	79.6	Confident	47 Å²	47	49.6 Å²	49.6	25%	0.251	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-78.1	129.8	170.4	-74.6	-26.3	0	0	0	109.4	T354 S357 H360	D352-T354 PolarHBondContact O-N 3.28Å; D352-S357 WeakPolarHBondContact OD2-CB 3.5Å; D352-S357 PolarHBondContact OD2-OG 3.46Å; D352-H360 IonicContact OD1-CE1 3.18Å; D352-H360 IonicContact OD1-ND1 2.65Å
353	P	64.2	Low	80.5	Confident	123 Å²	123	50.7 Å²	50.7	80%	0.799	30%	0.295	S	S	*	.	S	Bend	trans	-69.4	-21.2	179.5	26.4	-33	0	0	0	112.6
354	T	62.6	Low	80.8	Confident	82 Å²	82	50.9 Å²	50.9	50%	0.503	30%	0.301	S	S	.	.	S	Bend	trans	-80.3	116.4	173.5	56	0	0	0	0	109.2	D352 S356 S357	D352-T354 PolarHBondContact O-N 3.28Å; T354-S356 PolarHBondContact O-N 3.15Å; T354-S357 PolarHBondContact O-N 3.38Å
355	L	59.8	Low	80.9	Confident	138 Å²	138	52.2 Å²	52.2	72%	0.723	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-9.9	177.9	-100.7	77.4	0	0	0	115.1	P204	P204-L355 HydrophobicContact CG-CD2 4.45Å
356	S	60.6	Low	81.1	Confident	110 Å²	110	50 Å²	50	77%	0.769	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-12.5	-177.3	56.4	0	0	0	0	115.1	T354	T354-S356 PolarHBondContact O-N 3.15Å
357	S	63.5	Low	81	Confident	24 Å²	24	56.5 Å²	56.5	17%	0.168	34%	0.339	C	S	.	.	S	Bend	trans	-117.4	124.4	-176.7	-169.3	0	0	0	0	110.3	K302 D352 T354 G359	K302-S357 VanDerWaalsContact CE-OG 3.27Å; K302-S357 WeakPolarHBondContact CE-OG 3.32Å; K302-S357 PolarHBondContact NZ-OG 2.94Å; K302-S357 VanDerWaalsContact NZ-OG 3.12Å; D352-S357 WeakPolarHBondContact OD2-CB 3.5Å; D352-S357 PolarHBondContact OD2-OG 3.46Å; T354-S357 PolarHBondContact O-N 3.38Å; S357-G359 PolarHBondContact O-N 3.12Å
358	P	67.5	Low	81	Confident	68 Å²	68	57.3 Å²	57.3	44%	0.442	34%	0.344	S	S	.	.			trans	-64.2	129.7	165.3	30.3	-31.7	0	0	0	106.1	Q300 K302	Q300-P358 WeakPolarHBondContact O-CB 3.42Å; K302-P358 HydrophobicContact CG-CG 3.96Å
359	G	79.2	Confident	81	Confident	7 Å²	7	58.7 Å²	58.7	7%	0.072	36%	0.355	C	S	.	.			trans	-54	-179.6	-173.9	0	0	0	0	0	114.1	D301 W349 V350 S357	D301-G359 WeakPolarHBondContact CA-O 3.33Å; W349-G359 WeakPolarHBondContact CH2-O 3.17Å; W349-G359 VanDerWaalsContact CZ2-CA 3.47Å; V350-G359 CarbonylContact O-C 3.59Å; V350-G359 VanDerWaalsContact O-CA 3.28Å; V350-G359 WeakPolarHBondContact O-CA 3.37Å; S357-G359 PolarHBondContact O-N 3.12Å
360	H	85.3	Confident	80.9	Confident	82 Å²	82	63.9 Å²	63.9	38%	0.38	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	155	-175.2	65.7	-83.8	0	0	0	112.8	V350 D352	V350-H360 WeakPolarHBondContact CB-O 3.23Å; V350-H360 VanDerWaalsContact CG1-CE1 3.45Å; V350-H360 WeakPolarHBondContact CG1-CE1 3.28Å; V350-H360 PolarHBondContact N-O 2.65Å; V350-H360 PolarHBondContact O-N 3.42Å; D352-H360 IonicContact OD1-CE1 3.18Å; D352-H360 IonicContact OD1-ND1 2.65Å
361	W	89.9	Confident	80.9	Confident	26 Å²	26	70 Å²	70	10%	0.098	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	133.7	171.7	-63.1	112.9	0	0	0	110.6	F299 V307 V312 V347 W349 A386	F299-W361 HydrophobicContact CB-CH2 3.56Å; F299-W361 HydrophobicContact CB-CZ2 3.33Å; F299-W361 HydrophobicContact CD1-CH2 4.23Å; F299-W361 AromaticContact CG-CH2 3.99Å; F299-W361 HydrophobicContact CG-CH2 3.99Å; F299-W361 HydrophobicContact CG-CZ2 4.25Å; F299-W361 WeakPolarHBondContact O-CZ2 3.22Å; V307-W361 HydrophobicContact CG2-CH2 4.49Å; V307-W361 HydrophobicContact CG2-CZ2 3.82Å; V312-W361 HydrophobicContact CG1-CH2 4.28Å; V312-W361 HydrophobicContact CG2-CH2 4.16Å; V347-W361 HydrophobicContact CB-CB 4.18Å; V347-W361 HydrophobicContact CB-CE3 4.31Å; V347-W361 HydrophobicContact CG1-CB 4.49Å; V347-W361 HydrophobicContact CG2-CB 4.16Å; V347-W361 HydrophobicContact CG2-CD2 4Å; V347-W361 HydrophobicContact CG2-CE3 3.66Å; V347-W361 HydrophobicContact CG2-CG 4.24Å; V347-W361 HydrophobicContact CG2-CZ3 4.36Å; W349-W361 HydrophobicContact CB-CE3 4.18Å; W349-W361 HydrophobicContact CB-CH2 4.32Å; W349-W361 HydrophobicContact CB-CZ3 3.72Å; W349-W361 AromaticContact CE3-CD2 3.71Å; W349-W361 HydrophobicContact CE3-CD2 3.71Å; W349-W361 AromaticContact CE3-CE2 3.69Å; W349-W361 AromaticContact CE3-CE3 3.85Å; W349-W361 HydrophobicContact CE3-CE3 3.85Å; W349-W361 HydrophobicContact CE3-CG 4.35Å; W349-W361 AromaticContact CE3-CH2 3.98Å; W349-W361 HydrophobicContact CE3-CH2 3.98Å; W349-W361 AromaticContact CE3-CZ2 3.86Å; W349-W361 HydrophobicContact CE3-CZ2 3.86Å; W349-W361 AromaticContact CE3-CZ3 3.97Å; W349-W361 HydrophobicContact CE3-CZ3 3.97Å; W349-W361 HydrophobicContact CZ3-CD2 4.17Å; W349-W361 AromaticContact CZ3-CE2 3.87Å; W349-W361 HydrophobicContact CZ3-CG 4.47Å; W349-W361 HydrophobicContact CZ3-CZ2 4.23Å; W349-W361 AromaticContact CZ3-NE1 3.95Å; W361-A386 HydrophobicContact CE3-CB 4.48Å; W361-A386 HydrophobicContact CH2-CB 3.79Å; W361-A386 HydrophobicContact CZ2-CB 4.47Å; W361-A386 HydrophobicContact CZ3-CB 3.79Å
362	S	89.3	Confident	81	Confident	29 Å²	29	74.5 Å²	74.5	20%	0.203	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.3	174.3	-179.5	0	0	0	0	110.5	V347 F348 A364	V347-S362 CarbonylContact C-O 3.25Å; V347-S362 VanDerWaalsContact CA-O 3.26Å; V347-S362 WeakPolarHBondContact CA-O 3.28Å; V347-S362 WeakPolarHBondContact CB-O 3.47Å; F348-S362 WeakPolarHBondContact CD1-O 3.28Å; F348-S362 PolarHBondContact N-O 2.03Å; F348-S362 PolarHBondContact O-N 2.96Å; S362-A364 WeakPolarHBondContact OG-CB 3.32Å; S362-A364 PolarHBondContact OG-N 2.69Å
363	S	90.7	Very high	81.9	Confident	52 Å²	52	76.1 Å²	76.1	36%	0.364	43%	0.426	S	S	.	.			trans	-98.6	8.2	173.2	67.3	0	0	0	0	112.7	Q345 G365 C366	Q345-S363 PolarHBondContact NE2-OG 3.47Å; S363-G365 PolarHBondContact O-N 2.61Å; S363-C366 PolarHBondContact O-N 3.47Å
364	A	89.6	Confident	83.3	Confident	56 Å²	56	72.1 Å²	72.1	46%	0.463	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	129.8	-175.6	0	0	0	0	0	111.4	F348 S362 C366 H381	F348-A364 HydrophobicContact CE1-CB 4.06Å; F348-A364 WeakPolarHBondContact CE1-O 3.46Å; S362-A364 WeakPolarHBondContact OG-CB 3.32Å; S362-A364 PolarHBondContact OG-N 2.69Å; A364-C366 PolarHBondContact O-N 2.86Å; A364-H381 PolarHBondContact O-CE1 3.27Å; A364-H381 VanDerWaalsContact O-CE1 3.23Å
365	G	90	Very high	84.8	Confident	38 Å²	38	68.2 Å²	68.2	39%	0.392	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	8.5	179.7	0	0	0	0	0	115.2	S363 C379 N380	S363-G365 PolarHBondContact O-N 2.61Å; G365-C379 WeakPolarHBondContact O-CA 3.3Å; G365-N380 WeakPolarHBondContact CA-OD1 3.22Å; G365-N380 PolarHBondContact O-N 2.88Å; G365-N380 PolarHBondContact O-OD1 2.9Å
366	C	93.8	Very high	86.5	Confident	17 Å²	17	62.3 Å²	62.3	12%	0.115	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	125.7	174.4	-71	0	0	0	0	111.3	C346 S363 A364 F378 C379	C346-C366 HydrophobicContact CB-CB 4.46Å; S363-C366 PolarHBondContact O-N 3.47Å; A364-C366 PolarHBondContact O-N 2.86Å; C366-F378 CarbonylContact C-O 3.51Å; C366-F378 VanDerWaalsContact CA-O 3.31Å; C366-F378 WeakPolarHBondContact CA-O 3.39Å; C366-C379 HydrophobicContact CB-CB 4.23Å; C366-C379 WeakPolarHBondContact CB-SG 3.01Å; C366-C379 WeakPolarHBondContact SG-CB 3.49Å; C366-C379 CovalentContact SG-SG 2.05Å; C366-C379 PolarHBondContact SG-SG 3.19Å
367	E	94.7	Very high	88.2	Confident	136 Å²	136	57.1 Å²	57.1	64%	0.636	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.6	172.7	-170.8	176.4	-177.4	0	0	110.4	C377 F378	E367-C377 WeakPolarHBondContact O-CA 3.27Å; E367-F378 HydrophobicContact CB-CB 4.3Å; E367-F378 PolarHBondContact N-O 3.4Å; E367-F378 PolarHBondContact O-N 3.45Å
368	T	94.2	Very high	89.8	Confident	23 Å²	23	59.1 Å²	59.1	14%	0.141	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117.6	-177.4	-52.2	0	0	0	0	110.9	C346 R370 T375	C346-T368 VanDerWaalsContact CB-OG1 3.31Å; C346-T368 WeakPolarHBondContact CB-OG1 3.33Å; C346-T368 PolarHBondContact N-OG1 3.41Å; C346-T368 PolarHBondContact SG-OG1 2.81Å; T368-R370 HydrophobicContact CG2-CG 3.85Å; T368-T375 HydrophobicContact CG2-CG2 3.93Å
369	V	93.4	Very high	91.1	Very high	59 Å²	59	55.9 Å²	55.9	36%	0.358	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.7	170.7	178.5	0	0	0	0	108.9	S376 F378	V369-S376 PolarHBondContact N-O 3.04Å; V369-S376 PolarHBondContact O-N 3.5Å; V369-F378 HydrophobicContact CB-CE2 3.98Å; V369-F378 HydrophobicContact CG2-CD2 3.88Å; V369-F378 HydrophobicContact CG2-CE2 3.5Å
370	R	89.6	Confident	91.9	Very high	126 Å²	126	57.7 Å²	57.7	48%	0.475	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.4	-173.2	-56.1	171.6	-176.1	82.4	7.2	110.6	L344 T368	L344-R370 PolarHBondContact O-NE 2.9Å; L344-R370 PolarHBondContact O-NH2 2.76Å; T368-R370 HydrophobicContact CG2-CG 3.85Å
371	R	88.4	Confident	92.3	Very high	165 Å²	165	54.5 Å²	54.5	62%	0.623	29%	0.285	S	S	*	.			trans	-131.9	170.5	166.1	-59.6	176.8	171.7	177.3	-7	108.2	T373 Q374	R371-T373 PolarHBondContact O-N 2.99Å; R371-Q374 CarbonylContact C-O 3.5Å; R371-Q374 VanDerWaalsContact CA-O 3.3Å; R371-Q374 WeakPolarHBondContact CA-O 3.49Å; R371-Q374 HydrophobicContact CB-CB 4.2Å; R371-Q374 VanDerWaalsContact CB-O 3.26Å; R371-Q374 WeakPolarHBondContact CB-O 3.45Å; R371-Q374 PolarHBondContact N-O 2.67Å; R371-Q374 VanDerWaalsContact O-O 3.13Å
372	E	84.7	Confident	92.4	Very high	157 Å²	157	54 Å²	54	73%	0.734	28%	0.284	S	S	*	.	S	Bend	trans	-62.4	-39.2	-173.1	-63.5	-170.8	158.7	0	0	113.6	H335 L337	H335-E372 PolarHBondContact CE1-O 3.41Å; L337-E372 HydrophobicContact CD1-CB 3.94Å
373	T	89.2	Confident	92.6	Very high	81 Å²	81	54.2 Å²	54.2	50%	0.497	28%	0.284	S	S	.	.	S	Bend	trans	-121.6	11.6	-177.8	56	0	0	0	0	112.8	H335 R371	H335-T373 PolarHBondContact N-O 3.4Å; H335-T373 CarbonylContact O-C 3.58Å; H335-T373 WeakPolarHBondContact O-CA 3.26Å; H335-T373 VanDerWaalsContact O-O 3.11Å; R371-T373 PolarHBondContact O-N 2.99Å
374	Q	92.9	Very high	92.8	Very high	39 Å²	39	52.2 Å²	52.2	18%	0.182	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	135.5	-174.8	178.2	179.1	71.3	0	0	110.8	T332 F333 H335 R371	T332-Q374 HydrophobicContact CG2-CG 3.5Å; T332-Q374 VanDerWaalsContact CG2-NE2 3.26Å; F333-Q374 CarbonylContact O-C 3.48Å; F333-Q374 WeakPolarHBondContact O-CA 3.43Å; H335-Q374 PolarHBondContact NE2-N 2.88Å; R371-Q374 CarbonylContact C-O 3.5Å; R371-Q374 VanDerWaalsContact CA-O 3.3Å; R371-Q374 WeakPolarHBondContact CA-O 3.49Å; R371-Q374 HydrophobicContact CB-CB 4.2Å; R371-Q374 VanDerWaalsContact CB-O 3.26Å; R371-Q374 WeakPolarHBondContact CB-O 3.45Å; R371-Q374 PolarHBondContact N-O 2.67Å; R371-Q374 VanDerWaalsContact O-O 3.13Å
375	T	93.7	Very high	93.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.8	172.2	-67.2	0	0	0	0	110	T332 F333 H335 L344 T368 V387	T332-T375 WeakPolarHBondContact CA-O 3.35Å; F333-T375 PolarHBondContact N-O 3.46Å; F333-T375 PolarHBondContact O-N 3.49Å; H335-T375 PolarHBondContact NE2-OG1 2.88Å; L344-T375 HydrophobicContact CB-CG2 4.35Å; L344-T375 WeakPolarHBondContact CD1-OG1 3.13Å; T368-T375 HydrophobicContact CG2-CG2 3.93Å; T375-V387 HydrophobicContact CG2-CG1 4.18Å; T375-V387 HydrophobicContact CG2-CG2 4.35Å
376	S	96.2	Very high	93.3	Very high	13 Å²	13	48 Å²	48	9%	0.091	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130.8	178.6	-63.3	0	0	0	0	110.7	L331 T332 V369	L331-S376 CarbonylContact O-C 3.55Å; L331-S376 VanDerWaalsContact O-CA 3.28Å; L331-S376 WeakPolarHBondContact O-CA 3.45Å; T332-S376 WeakPolarHBondContact CG2-OG 3.49Å; T332-S376 PolarHBondContact OG1-OG 3.47Å; T332-S376 VanDerWaalsContact OG1-OG 3.05Å; V369-S376 PolarHBondContact N-O 3.04Å; V369-S376 PolarHBondContact O-N 3.5Å
377	C	96.9	Very high	93.3	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.014	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.3	178.6	-52.6	0	0	0	0	109.6	V330 L331 C346 E367	V330-C377 WeakPolarHBondContact CA-O 3.22Å; L331-C377 HydrophobicContact CB-CB 4.12Å; L331-C377 HydrophobicContact CD1-CB 3.93Å; L331-C377 PolarHBondContact N-O 2.9Å; L331-C377 PolarHBondContact O-N 3.37Å; C346-C377 HydrophobicContact CB-CB 3.51Å; C346-C377 WeakPolarHBondContact CB-SG 3.3Å; C346-C377 WeakPolarHBondContact SG-CA 3.24Å; C346-C377 WeakPolarHBondContact SG-CB 3.46Å; C346-C377 CovalentContact SG-SG 2.01Å; C346-C377 PolarHBondContact SG-SG 3.48Å; E367-C377 WeakPolarHBondContact O-CA 3.27Å
378	F	96.3	Very high	93.1	Very high	65 Å²	65	41.6 Å²	41.6	29%	0.285	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	99.9	176	-64.2	-95.9	0	0	0	108.5	P328 V329 V330 C366 E367 V369	P328-F378 HydrophobicContact CB-CB 4.07Å; P328-F378 HydrophobicContact CG-CB 4.3Å; P328-F378 HydrophobicContact CG-CD1 4.01Å; V329-F378 WeakPolarHBondContact O-CA 3.28Å; V330-F378 HydrophobicContact CB-CD1 4.46Å; V330-F378 HydrophobicContact CB-CE1 4.34Å; V330-F378 HydrophobicContact CG1-CD1 4.19Å; V330-F378 HydrophobicContact CG1-CE1 3.78Å; V330-F378 HydrophobicContact CG1-CZ 3.97Å; V330-F378 HydrophobicContact CG2-CD1 3.66Å; V330-F378 HydrophobicContact CG2-CE1 3.61Å; C366-F378 CarbonylContact C-O 3.51Å; C366-F378 VanDerWaalsContact CA-O 3.31Å; C366-F378 WeakPolarHBondContact CA-O 3.39Å; E367-F378 HydrophobicContact CB-CB 4.3Å; E367-F378 PolarHBondContact N-O 3.4Å; E367-F378 PolarHBondContact O-N 3.45Å; V369-F378 HydrophobicContact CB-CE2 3.98Å; V369-F378 HydrophobicContact CG2-CD2 3.88Å; V369-F378 HydrophobicContact CG2-CE2 3.5Å
379	C	96.2	Very high	92.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.7	-174	-65.4	0	0	0	0	111.8	P328 V329 G365 C366 F385	P328-C379 CarbonylContact C-O 3.5Å; P328-C379 WeakPolarHBondContact CA-O 3.44Å; V329-C379 PolarHBondContact N-O 3.03Å; V329-C379 PolarHBondContact O-N 3.4Å; G365-C379 WeakPolarHBondContact O-CA 3.3Å; C366-C379 HydrophobicContact CB-CB 4.23Å; C366-C379 WeakPolarHBondContact CB-SG 3.01Å; C366-C379 WeakPolarHBondContact SG-CB 3.49Å; C366-C379 CovalentContact SG-SG 2.05Å; C366-C379 PolarHBondContact SG-SG 3.19Å; C379-F385 HydrophobicContact CB-CD1 4.43Å; C379-F385 HydrophobicContact CB-CE1 3.74Å; C379-F385 HydrophobicContact CB-CZ 4.07Å; C379-F385 VanDerWaalsContact SG-CE1 3.58Å
380	N	94.5	Very high	91.7	Very high	46 Å²	46	41.1 Å²	41.1	25%	0.246	19%	0.194	C	C	.	.	S	Bend	trans	-94.5	13.5	-177.5	72.9	-8.3	0	0	0	114.4	A323 N324 L325 G365	A323-N380 CarbonylContact C-O 3.51Å; N324-N380 PolarHBondContact N-O 2.87Å; L325-N380 WeakPolarHBondContact CB-O 3.42Å; L325-N380 WeakPolarHBondContact CG-O 3.28Å; L325-N380 PolarHBondContact N-O 2.86Å; G365-N380 WeakPolarHBondContact CA-OD1 3.22Å; G365-N380 PolarHBondContact O-N 2.88Å; G365-N380 PolarHBondContact O-OD1 2.9Å
381	H	93.8	Very high	90.3	Very high	14 Å²	14	38.4 Å²	38.4	7%	0.065	19%	0.194	C	C	.	.	S	Bend	trans	-147.6	174.4	-176.8	57.9	-85.8	0	0	0	110.3	V322 A323 F348 A364 T383 F385	V322-H381 VanDerWaalsContact O-CA 3.29Å; V322-H381 WeakPolarHBondContact O-CA 3.44Å; V322-H381 VanDerWaalsContact O-CB 3.29Å; V322-H381 WeakPolarHBondContact O-CB 3.18Å; A323-H381 HydrophobicContact CB-CB 4.21Å; F348-H381 AromaticContact CD1-CE1 3.71Å; F348-H381 AromaticContact CD1-NE2 3.4Å; F348-H381 WeakPolarHBondContact CD1-NE2 3.12Å; F348-H381 AromaticContact CD2-NE2 3.63Å; F348-H381 AromaticContact CE1-CE1 3.95Å; F348-H381 AromaticContact CE1-NE2 3.87Å; F348-H381 AromaticContact CG-NE2 3.27Å; F348-H381 VanDerWaalsContact CG-NE2 3.27Å; F348-H381 WeakPolarHBondContact CG-NE2 3.19Å; A364-H381 PolarHBondContact O-CE1 3.27Å; A364-H381 VanDerWaalsContact O-CE1 3.23Å; H381-T383 PolarHBondContact CD2-OG1 2.89Å; H381-T383 VanDerWaalsContact CD2-OG1 3.28Å; H381-T383 PolarHBondContact NE2-OG1 2.98Å; H381-F385 AromaticContact CD2-CE1 3.93Å; H381-F385 AromaticContact CD2-CZ 3.94Å; H381-F385 AromaticContact NE2-CE1 3.57Å; H381-F385 VanDerWaalsContact O-CZ 3.27Å; H381-F385 WeakPolarHBondContact O-CZ 3.46Å
382	L	92.8	Very high	88.6	Confident	15 Å²	15	33 Å²	33	8%	0.079	18%	0.182	C	C	.	.			trans	-121.8	120.6	177.4	-66.2	-174.2	0	0	0	110.6	L269 L273 I315 V317 V322 V329	L269-L382 HydrophobicContact CD2-CD2 3.99Å; L273-L382 HydrophobicContact CD1-CD1 3.69Å; L273-L382 HydrophobicContact CD1-CG 4.47Å; L273-L382 HydrophobicContact CD2-CD1 3.88Å; L273-L382 HydrophobicContact CG-CD1 4.42Å; I315-L382 HydrophobicContact CB-CD2 4.11Å; I315-L382 HydrophobicContact CG2-CD1 4.3Å; I315-L382 HydrophobicContact CG2-CD2 3.7Å; I315-L382 HydrophobicContact CG2-CG 4.48Å; I315-L382 CarbonylContact O-C 3.56Å; I315-L382 WeakPolarHBondContact O-CB 3.27Å; V317-L382 HydrophobicContact CG2-CD1 3.71Å; V322-L382 HydrophobicContact CB-CB 4.14Å; V322-L382 HydrophobicContact CB-CD1 3.98Å; V322-L382 HydrophobicContact CB-CG 4.01Å; V322-L382 HydrophobicContact CG1-CD1 4.24Å; V322-L382 HydrophobicContact CG1-CG 4.16Å; V322-L382 HydrophobicContact CG2-CD1 4.04Å; V322-L382 PolarHBondContact O-N 3.33Å; V322-L382 VanDerWaalsContact O-N 3.08Å; V329-L382 HydrophobicContact CG2-CD2 3.7Å
383	T	92.8	Very high	86.9	Confident	35 Å²	35	28.5 Å²	28.5	22%	0.215	17%	0.165	C	C	.	.	S	Bend	trans	-160	-156.7	-177.8	48.7	0	0	0	0	109.7	G314 I315 F348 H381 F385	G314-T383 WeakPolarHBondContact CA-O 3.08Å; I315-T383 PolarHBondContact N-O 3.1Å; I315-T383 PolarHBondContact O-N 2.85Å; F348-T383 WeakPolarHBondContact CB-OG1 3.01Å; F348-T383 HydrophobicContact CD2-CG2 4.31Å; H381-T383 PolarHBondContact CD2-OG1 2.89Å; H381-T383 VanDerWaalsContact CD2-OG1 3.28Å; H381-T383 PolarHBondContact NE2-OG1 2.98Å; T383-F385 WeakPolarHBondContact O-CD2 3.19Å; T383-F385 WeakPolarHBondContact O-CE2 3.33Å; T383-F385 WeakPolarHBondContact OG1-CE1 3.11Å; T383-F385 WeakPolarHBondContact OG1-CZ 3.15Å
384	Y	94.4	Very high	85	Confident	10 Å²	10	29.8 Å²	29.8	4%	0.039	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	116.9	167.7	-61.8	-85.8	0	0	0	110.8	L209 E213 F293 F299 L313 F348 W349	L209-Y384 HydrophobicContact CD1-CD2 4.49Å; L209-Y384 HydrophobicContact CD1-CE2 4.15Å; L209-Y384 HydrophobicContact CD2-CE1 4.05Å; L209-Y384 HydrophobicContact CD2-CE2 4.5Å; E213-Y384 WeakPolarHBondContact OE1-CE2 3.4Å; E213-Y384 PolarHBondContact OE1-OH 3.18Å; F293-Y384 HydrophobicContact CE2-CD1 4.22Å; F293-Y384 AromaticContact CE2-CE1 3.86Å; F293-Y384 HydrophobicContact CE2-CE1 3.86Å; F299-Y384 HydrophobicContact CE1-CD1 4.06Å; F299-Y384 HydrophobicContact CE1-CD2 4.42Å; F299-Y384 AromaticContact CE1-CG 3.88Å; F299-Y384 HydrophobicContact CE1-CG 3.88Å; F299-Y384 AromaticContact CZ-CD1 3.79Å; F299-Y384 HydrophobicContact CZ-CD1 3.79Å; F299-Y384 HydrophobicContact CZ-CE1 4.33Å; F299-Y384 HydrophobicContact CZ-CG 4.1Å; L313-Y384 CarbonylContact O-C 3.45Å; L313-Y384 WeakPolarHBondContact O-CA 3.4Å; F348-Y384 CarbonylContact C-O 2.94Å; F348-Y384 WeakPolarHBondContact CA-O 3.42Å; W349-Y384 PolarHBondContact N-O 3.14Å
385	F	96.2	Very high	83.2	Confident	3 Å²	3	28.9 Å²	28.9	1%	0.013	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	148.6	-177.9	-59.3	-72.5	0	0	0	111.7	V312 L313 I315 L331 V347 F348 C379 H381 T383	V312-F385 CarbonylContact C-O 3.6Å; V312-F385 WeakPolarHBondContact CA-O 3.37Å; L313-F385 PolarHBondContact N-O 2.99Å; L313-F385 PolarHBondContact O-N 3.2Å; I315-F385 HydrophobicContact CD1-CD2 4.33Å; I315-F385 HydrophobicContact CD1-CE2 4.36Å; L331-F385 HydrophobicContact CD1-CB 4.16Å; L331-F385 HydrophobicContact CD1-CD1 4.26Å; L331-F385 HydrophobicContact CD1-CD2 3.92Å; L331-F385 HydrophobicContact CD1-CE2 4.43Å; L331-F385 HydrophobicContact CD1-CG 3.83Å; L331-F385 HydrophobicContact CD2-CB 4.38Å; L331-F385 HydrophobicContact CD2-CD2 4.08Å; L331-F385 HydrophobicContact CD2-CG 4.44Å; V347-F385 WeakPolarHBondContact O-CA 3.39Å; F348-F385 HydrophobicContact CB-CD1 3.74Å; F348-F385 HydrophobicContact CB-CE1 3.81Å; C379-F385 HydrophobicContact CB-CD1 4.43Å; C379-F385 HydrophobicContact CB-CE1 3.74Å; C379-F385 HydrophobicContact CB-CZ 4.07Å; C379-F385 VanDerWaalsContact SG-CE1 3.58Å; H381-F385 AromaticContact CD2-CE1 3.93Å; H381-F385 AromaticContact CD2-CZ 3.94Å; H381-F385 AromaticContact NE2-CE1 3.57Å; H381-F385 VanDerWaalsContact O-CZ 3.27Å; H381-F385 WeakPolarHBondContact O-CZ 3.46Å; T383-F385 WeakPolarHBondContact O-CD2 3.19Å; T383-F385 WeakPolarHBondContact O-CE2 3.33Å; T383-F385 WeakPolarHBondContact OG1-CE1 3.11Å; T383-F385 WeakPolarHBondContact OG1-CZ 3.15Å
386	A	94.8	Very high	81.5	Confident	1 Å²	1	34 Å²	34	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	159.5	174.9	0	0	0	0	0	110	V307 V312 V347 W361	V307-A386 HydrophobicContact CG1-CB 3.77Å; V307-A386 HydrophobicContact CG2-CB 4.14Å; V312-A386 HydrophobicContact CG2-CB 4.26Å; V347-A386 HydrophobicContact CG2-CB 4.15Å; V347-A386 WeakPolarHBondContact CG2-O 3.42Å; V347-A386 PolarHBondContact N-O 3.15Å; V347-A386 PolarHBondContact O-N 2.98Å; V347-A386 VanDerWaalsContact O-O 3.12Å; W361-A386 HydrophobicContact CE3-CB 4.48Å; W361-A386 HydrophobicContact CH2-CB 3.79Å; W361-A386 HydrophobicContact CZ2-CB 4.47Å; W361-A386 HydrophobicContact CZ3-CB 3.79Å
387	V	93.9	Very high	79.7	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114	167.7	-179.3	0	0	0	0	107.6	L308 F333 L344 Q345 T375	L308-V387 HydrophobicContact CB-CB 4.07Å; L308-V387 HydrophobicContact CB-CG1 4.24Å; L308-V387 VanDerWaalsContact CB-O 3.27Å; L308-V387 WeakPolarHBondContact CB-O 3.22Å; L308-V387 HydrophobicContact CD2-CB 4.07Å; L308-V387 HydrophobicContact CD2-CG1 3.9Å; L308-V387 PolarHBondContact N-O 3.25Å; F333-V387 HydrophobicContact CD2-CG2 3.43Å; F333-V387 VanDerWaalsContact CD2-CG2 3.43Å; F333-V387 HydrophobicContact CE2-CG2 3.67Å; F333-V387 HydrophobicContact CG-CG2 3.97Å; F333-V387 HydrophobicContact CZ-CG2 4.36Å; L344-V387 HydrophobicContact CB-CG1 3.78Å; L344-V387 HydrophobicContact CD2-CG1 4.09Å; L344-V387 HydrophobicContact CG-CG1 4.35Å; Q345-V387 CarbonylContact O-C 3.58Å; T375-V387 HydrophobicContact CG2-CG1 4.18Å; T375-V387 HydrophobicContact CG2-CG2 4.35Å
388	L	89.9	Confident	78.4	Confident	17 Å²	17	37.5 Å²	37.5	9%	0.089	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	135.8	178.3	-159.1	73.7	0	0	0	110.8	S305 Q306 V307 L344 Q345 V347 V390	S305-L388 VanDerWaalsContact CB-CD1 3.44Å; Q306-L388 VanDerWaalsContact O-CD1 3.27Å; Q306-L388 WeakPolarHBondContact O-CD1 3.43Å; V307-L388 HydrophobicContact CG2-CD1 4.18Å; L344-L388 CarbonylContact C-O 3.59Å; L344-L388 WeakPolarHBondContact CA-O 3.47Å; Q345-L388 PolarHBondContact N-O 3.35Å; Q345-L388 PolarHBondContact O-N 3.29Å; V347-L388 HydrophobicContact CG1-CB 4.23Å; V347-L388 HydrophobicContact CG2-CB 3.99Å; L388-V390 HydrophobicContact CD2-CG2 3.97Å; L388-V390 HydrophobicContact CG-CG2 4.4Å; L388-V390 PolarHBondContact O-N 3.03Å
389	M	81.9	Confident	77.5	Confident	23 Å²	23	37 Å²	37	11%	0.113	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	105.8	165.8	-67.1	-171.5	179.9	0	0	108.8	E261 Q306 L308 V342 L344	E261-M389 VanDerWaalsContact OE2-CE 3.24Å; E261-M389 WeakPolarHBondContact OE2-CE 3.29Å; Q306-M389 HydrophobicContact CB-CB 4.37Å; Q306-M389 HydrophobicContact CG-CB 4.44Å; Q306-M389 HydrophobicContact CG-SD 4.08Å; Q306-M389 PolarHBondContact O-N 2.94Å; L308-M389 HydrophobicContact CB-CE 4.4Å; L308-M389 HydrophobicContact CB-CG 4.35Å; L308-M389 HydrophobicContact CD1-CE 3.33Å; L308-M389 HydrophobicContact CG-CE 4.44Å; V342-M389 HydrophobicContact CG1-CB 3.66Å; V342-M389 HydrophobicContact CG1-CG 3.92Å; V342-M389 HydrophobicContact CG1-SD 4.46Å; L344-M389 HydrophobicContact CD2-CG 4.14Å
390	V	76.1	Confident	76.2	Confident	49 Å²	49	38.8 Å²	38.8	30%	0.297	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122	172.1	-175.8	0	0	0	0	107.5	V342 T343 Q345 L388 S392	V342-V390 CarbonylContact C-O 3.23Å; T343-V390 PolarHBondContact N-O 3.41Å; T343-V390 WeakPolarHBondContact O-CA 3.37Å; T343-V390 WeakPolarHBondContact O-CB 3.43Å; T343-V390 PolarHBondContact O-N 3.18Å; T343-V390 VanDerWaalsContact O-O 3.1Å; T343-V390 PolarHBondContact OG1-O 3.38Å; Q345-V390 HydrophobicContact CB-CG2 4.15Å; L388-V390 HydrophobicContact CD2-CG2 3.97Å; L388-V390 HydrophobicContact CG-CG2 4.4Å; L388-V390 PolarHBondContact O-N 3.03Å; V390-S392 PolarHBondContact O-N 3.02Å; V390-S392 VanDerWaalsContact O-N 3.11Å
391	S	61.1	Low	75.4	Confident	69 Å²	69	42 Å²	42	48%	0.483	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	115.2	175.8	-58.2	0	0	0	0	110.3	N341 V393	N341-S391 CarbonylContact O-C 3.54Å; N341-S391 WeakPolarHBondContact O-CA 3.38Å; S391-V393 VanDerWaalsContact C-N 3.32Å
392	S	53.4	Low	74.9	Confident	52 Å²	52	47.6 Å²	47.6	36%	0.364	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.1	176	64.5	0	0	0	0	112.7	K340 N341 V342 V390	K340-S392 PolarHBondContact O-OG 3.33Å; N341-S392 VanDerWaalsContact CA-OG 3.23Å; N341-S392 WeakPolarHBondContact CA-OG 3.42Å; N341-S392 PolarHBondContact O-N 2.82Å; N341-S392 PolarHBondContact O-OG 3.4Å; N341-S392 VanDerWaalsContact O-OG 3.11Å; V342-S392 PolarHBondContact N-OG 3.37Å; V390-S392 PolarHBondContact O-N 3.02Å; V390-S392 VanDerWaalsContact O-N 3.11Å
393	V	48.3	Very low	74.6	Confident	63 Å²	63	48 Å²	48	38%	0.382	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	45.1	175.6	-167.3	0	0	0	0	109.4	N341 S391 V395	N341-V393 HydrophobicContact CB-CB 3.78Å; N341-V393 HydrophobicContact CB-CG2 3.71Å; N341-V393 PolarHBondContact O-N 3.4Å; S391-V393 VanDerWaalsContact C-N 3.32Å; V393-V395 VanDerWaalsContact C-N 3.34Å; V393-V395 PolarHBondContact O-N 2.86Å
394	E	49.1	Very low	74.1	Confident	107 Å²	107	48.8 Å²	48.8	50%	0.5	26%	0.262	S	S	.	.	S	Bend	trans	-66.1	111.2	139.2	-94.8	-162.9	121	0	0	104.8	D396 K400	E394-D396 PolarHBondContact O-N 3.36Å; E394-D396 VanDerWaalsContact O-N 3.08Å; E394-K400 IonicContact OE1-NZ 3.37Å; E394-K400 PolarHBondContact OE1-NZ 3.48Å; E394-K400 IonicContact OE2-NZ 2.65Å; E394-K400 PolarHBondContact OE2-NZ 3.31Å
395	V	54.5	Low	73.8	Confident	21 Å²	21	52.6 Å²	52.6	13%	0.127	28%	0.283	C	S	.	.			trans	-7.3	108	167.7	175.8	0	0	0	0	110.3	V393 A397 H399 K400 L403 L637 L640	V393-V395 VanDerWaalsContact C-N 3.34Å; V393-V395 PolarHBondContact O-N 2.86Å; V395-A397 PolarHBondContact O-N 3.48Å; V395-H399 HydrophobicContact CG1-CB 3.35Å; V395-K400 HydrophobicContact CB-CG 3.97Å; V395-K400 HydrophobicContact CG1-CG 3.97Å; V395-K400 WeakPolarHBondContact O-CG 3.37Å; V395-L403 HydrophobicContact CG1-CD1 3.97Å; V395-L637 HydrophobicContact CG1-CD1 3.96Å; V395-L640 HydrophobicContact CG2-CD1 3.54Å
396	D	57.7	Low	73.4	Confident	108 Å²	108	54.7 Å²	54.7	58%	0.578	29%	0.294	S	S	*	.			trans	-35.2	130.5	-174.4	-128.5	-15.2	0	0	0	109.1	E394 V398 H399 K400	E394-D396 PolarHBondContact O-N 3.36Å; E394-D396 VanDerWaalsContact O-N 3.08Å; D396-V398 CarbonylContact O-C 3.56Å; D396-V398 PolarHBondContact O-N 3.35Å; D396-H399 VanDerWaalsContact CB-ND1 3.33Å; D396-H399 WeakPolarHBondContact CB-ND1 3.3Å; D396-H399 WeakPolarHBondContact O-CA 3.45Å; D396-H399 WeakPolarHBondContact O-CB 3.44Å; D396-H399 PolarHBondContact O-N 2.88Å; D396-K400 PolarHBondContact O-N 2.89Å; D396-K400 VanDerWaalsContact O-N 3.14Å
397	A	59.7	Low	73.2	Confident	14 Å²	14	55.9 Å²	55.9	12%	0.116	30%	0.302	C	S	.	.	H	α-helix	trans	-52.2	-27.9	-168.5	0	0	0	0	0	113.4	V395 K400 H401 V549 H550	V395-A397 PolarHBondContact O-N 3.48Å; A397-K400 PolarHBondContact O-N 2.92Å; A397-H401 WeakPolarHBondContact O-CB 3.4Å; A397-H401 PolarHBondContact O-N 3.35Å; A397-V549 HydrophobicContact CB-CG1 3.93Å; A397-H550 HydrophobicContact CB-CB 4.46Å; A397-H550 WeakPolarHBondContact CB-CE1 3.35Å; A397-H550 WeakPolarHBondContact CB-ND1 3.29Å
398	V	68.8	Low	73	Confident	73 Å²	73	60.5 Å²	60.5	44%	0.442	32%	0.32	S	S	.	.	H	α-helix	trans	-54.7	-52.3	168.1	179	0	0	0	0	112.4	D396 H401 Y402	D396-V398 CarbonylContact O-C 3.56Å; D396-V398 PolarHBondContact O-N 3.35Å; V398-H401 WeakPolarHBondContact O-CB 3.5Å; V398-H401 PolarHBondContact O-N 2.97Å; V398-Y402 HydrophobicContact CG1-CD2 3.72Å; V398-Y402 HydrophobicContact CG1-CE2 3.36Å; V398-Y402 WeakPolarHBondContact O-CD2 3.42Å; V398-Y402 PolarHBondContact O-N 2.86Å
399	H	77	Confident	73.1	Confident	54 Å²	54	63.1 Å²	63.1	25%	0.25	34%	0.336	C	S	.	.	H	α-helix	trans	-67.1	-35.5	177	-63.5	86	0	0	0	112	V395 D396 H401 Y402 L403 L637 Y641	V395-H399 HydrophobicContact CG1-CB 3.35Å; D396-H399 VanDerWaalsContact CB-ND1 3.33Å; D396-H399 WeakPolarHBondContact CB-ND1 3.3Å; D396-H399 WeakPolarHBondContact O-CA 3.45Å; D396-H399 WeakPolarHBondContact O-CB 3.44Å; D396-H399 PolarHBondContact O-N 2.88Å; H399-H401 VanDerWaalsContact C-N 3.33Å; H399-H401 PolarHBondContact O-N 3.35Å; H399-Y402 PolarHBondContact O-N 3.2Å; H399-L403 VanDerWaalsContact O-CB 3.3Å; H399-L403 WeakPolarHBondContact O-CB 3.42Å; H399-L403 WeakPolarHBondContact O-CD1 3.13Å; H399-L403 VanDerWaalsContact O-CG 3.22Å; H399-L403 WeakPolarHBondContact O-CG 3.35Å; H399-L403 PolarHBondContact O-N 3.48Å; H399-L637 HydrophobicContact CB-CD1 3.94Å; H399-Y641 AromaticContact CD2-CE2 3.79Å; H399-Y641 PolarHBondContact CD2-OH 3.09Å
400	K	70.2	Confident	73.6	Confident	38 Å²	38	62 Å²	62	17%	0.165	33%	0.331	C	S	.	.	H	α-helix	trans	-60.1	-44.5	170.9	-77.2	178.9	-174.5	-178.2	0	111	E394 V395 D396 A397 L403 S404 A548 V549	E394-K400 IonicContact OE1-NZ 3.37Å; E394-K400 PolarHBondContact OE1-NZ 3.48Å; E394-K400 IonicContact OE2-NZ 2.65Å; E394-K400 PolarHBondContact OE2-NZ 3.31Å; V395-K400 HydrophobicContact CB-CG 3.97Å; V395-K400 HydrophobicContact CG1-CG 3.97Å; V395-K400 WeakPolarHBondContact O-CG 3.37Å; D396-K400 PolarHBondContact O-N 2.89Å; D396-K400 VanDerWaalsContact O-N 3.14Å; A397-K400 PolarHBondContact O-N 2.92Å; K400-L403 PolarHBondContact O-N 3.05Å; K400-S404 WeakPolarHBondContact O-CB 3.36Å; K400-S404 PolarHBondContact O-N 2.98Å; K400-A548 PolarHBondContact NZ-O 3.23Å; K400-V549 HydrophobicContact CB-CG1 4.43Å; K400-V549 HydrophobicContact CB-CG2 4.02Å; K400-V549 HydrophobicContact CD-CG2 3.81Å
401	H	76.8	Confident	74.4	Confident	114 Å²	114	60.1 Å²	60.1	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-46.5	176.6	-177.1	64.9	0	0	0	111.8	A397 V398 H399 L403 S404 L405	A397-H401 WeakPolarHBondContact O-CB 3.4Å; A397-H401 PolarHBondContact O-N 3.35Å; V398-H401 WeakPolarHBondContact O-CB 3.5Å; V398-H401 PolarHBondContact O-N 2.97Å; H399-H401 VanDerWaalsContact C-N 3.33Å; H399-H401 PolarHBondContact O-N 3.35Å; H401-L403 PolarHBondContact O-N 3.42Å; H401-S404 PolarHBondContact O-N 2.87Å; H401-L405 WeakPolarHBondContact O-CB 3.43Å; H401-L405 PolarHBondContact O-N 2.61Å
402	Y	84.2	Confident	76	Confident	132 Å²	132	59.3 Å²	59.3	52%	0.518	31%	0.312	S	S	.	.	H	α-helix	trans	-63.2	-41.2	175.9	-75.8	-58.8	0	0	0	113.2	V398 H399 L405 L406	V398-Y402 HydrophobicContact CG1-CD2 3.72Å; V398-Y402 HydrophobicContact CG1-CE2 3.36Å; V398-Y402 WeakPolarHBondContact O-CD2 3.42Å; V398-Y402 PolarHBondContact O-N 2.86Å; H399-Y402 PolarHBondContact O-N 3.2Å; Y402-L405 PolarHBondContact O-N 3.44Å; Y402-L406 WeakPolarHBondContact O-CB 3.45Å; Y402-L406 PolarHBondContact O-N 3.27Å
403	L	85.4	Confident	77.9	Confident	23 Å²	23	59.3 Å²	59.3	12%	0.12	31%	0.309	C	S	.	.	H	α-helix	trans	-64.7	-42.1	176.5	-75.6	164	0	0	0	111.4	V395 H399 K400 H401 L406 S407 L640 Y641	V395-L403 HydrophobicContact CG1-CD1 3.97Å; H399-L403 VanDerWaalsContact O-CB 3.3Å; H399-L403 WeakPolarHBondContact O-CB 3.42Å; H399-L403 WeakPolarHBondContact O-CD1 3.13Å; H399-L403 VanDerWaalsContact O-CG 3.22Å; H399-L403 WeakPolarHBondContact O-CG 3.35Å; H399-L403 PolarHBondContact O-N 3.48Å; K400-L403 PolarHBondContact O-N 3.05Å; H401-L403 PolarHBondContact O-N 3.42Å; L403-L406 PolarHBondContact O-N 3.41Å; L403-S407 WeakPolarHBondContact O-CB 3.48Å; L403-S407 PolarHBondContact O-N 3.07Å; L403-S407 PolarHBondContact O-OG 2.97Å; L403-S407 VanDerWaalsContact O-OG 3.05Å; L403-L640 HydrophobicContact CD1-CB 4.42Å; L403-Y641 HydrophobicContact CD2-CD1 3.76Å; L403-Y641 HydrophobicContact CD2-CD2 4.27Å; L403-Y641 HydrophobicContact CD2-CE1 3.93Å; L403-Y641 HydrophobicContact CD2-CE2 4.4Å; L403-Y641 HydrophobicContact CD2-CG 3.94Å; L403-Y641 HydrophobicContact CG-CD1 4.5Å; L403-Y641 HydrophobicContact CG-CE1 4.19Å; L403-Y641 HydrophobicContact CG-CE2 4.41Å
404	S	83.5	Confident	80.1	Confident	51 Å²	51	56.3 Å²	56.3	36%	0.357	29%	0.291	S	S	.	.	H	α-helix	trans	-61.8	-48.4	175.4	170.6	0	0	0	0	111.4	K400 H401 L406 S407 Y408	K400-S404 WeakPolarHBondContact O-CB 3.36Å; K400-S404 PolarHBondContact O-N 2.98Å; H401-S404 PolarHBondContact O-N 2.87Å; S404-L406 VanDerWaalsContact C-N 3.31Å; S404-L406 PolarHBondContact O-N 3.23Å; S404-S407 PolarHBondContact O-N 3.07Å; S404-Y408 WeakPolarHBondContact O-CB 3.22Å; S404-Y408 PolarHBondContact O-N 2.97Å
405	L	86.3	Confident	82.2	Confident	91 Å²	91	51.7 Å²	51.7	48%	0.476	27%	0.271	S	S	.	.	H	α-helix	trans	-59.3	-43.4	175.7	-177.5	66.2	0	0	0	111.6	H401 Y402 Y408 V409	H401-L405 WeakPolarHBondContact O-CB 3.43Å; H401-L405 PolarHBondContact O-N 2.61Å; Y402-L405 PolarHBondContact O-N 3.44Å; L405-Y408 PolarHBondContact O-N 3.17Å; L405-V409 HydrophobicContact CD1-CG2 4.39Å; L405-V409 WeakPolarHBondContact O-CB 3.45Å; L405-V409 VanDerWaalsContact O-CG2 3.32Å; L405-V409 WeakPolarHBondContact O-CG2 3.28Å; L405-V409 PolarHBondContact O-N 3.46Å
406	L	89.5	Confident	84.1	Confident	47 Å²	47	55.6 Å²	55.6	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-45.9	178.9	-178.3	61.8	0	0	0	112	Y402 L403 S404 G410 Y641 I645 F649	Y402-L406 WeakPolarHBondContact O-CB 3.45Å; Y402-L406 PolarHBondContact O-N 3.27Å; L403-L406 PolarHBondContact O-N 3.41Å; S404-L406 VanDerWaalsContact C-N 3.31Å; S404-L406 PolarHBondContact O-N 3.23Å; L406-G410 PolarHBondContact O-N 3.19Å; L406-Y641 HydrophobicContact CD2-CD1 4.17Å; L406-I645 HydrophobicContact CD1-CG1 4.48Å; L406-I645 HydrophobicContact CD2-CD1 4.37Å; L406-I645 HydrophobicContact CD2-CG1 3.6Å; L406-I645 HydrophobicContact CG-CG1 4.38Å; L406-F649 HydrophobicContact CD1-CE2 4.32Å
407	S	89.6	Confident	85.7	Confident	25 Å²	25	50.8 Å²	50.8	18%	0.175	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-41.8	175.8	-61.9	0	0	0	0	111.5	L403 S404 G410 C411 S644	L403-S407 WeakPolarHBondContact O-CB 3.48Å; L403-S407 PolarHBondContact O-N 3.07Å; L403-S407 PolarHBondContact O-OG 2.97Å; L403-S407 VanDerWaalsContact O-OG 3.05Å; S404-S407 PolarHBondContact O-N 3.07Å; S407-G410 PolarHBondContact O-N 3.39Å; S407-C411 VanDerWaalsContact O-CB 3.28Å; S407-C411 WeakPolarHBondContact O-CB 3.47Å; S407-C411 PolarHBondContact O-N 3.26Å; S407-C411 PolarHBondContact O-SG 3.17Å; S407-S644 PolarHBondContact OG-OG 3.34Å
408	Y	90	Very high	87.2	Confident	100 Å²	100	50.1 Å²	50.1	39%	0.392	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-52.7	177.2	-174.2	-90.4	0	0	0	111.7	S404 L405 G410 C411 V412 L461	S404-Y408 WeakPolarHBondContact O-CB 3.22Å; S404-Y408 PolarHBondContact O-N 2.97Å; L405-Y408 PolarHBondContact O-N 3.17Å; Y408-G410 PolarHBondContact O-N 3.28Å; Y408-C411 PolarHBondContact O-N 3.02Å; Y408-V412 HydrophobicContact CD1-CG2 4.46Å; Y408-V412 HydrophobicContact CE1-CG2 4.2Å; Y408-V412 WeakPolarHBondContact O-CG2 3.23Å; Y408-V412 PolarHBondContact O-N 3.29Å; Y408-L461 HydrophobicContact CD2-CD2 3.56Å; Y408-L461 HydrophobicContact CE2-CD2 3.57Å; Y408-L461 HydrophobicContact CG-CD2 4.12Å
409	V	92	Very high	88.3	Confident	71 Å²	71	50.5 Å²	50.5	43%	0.43	26%	0.26	S	S	.	.	H	α-helix	trans	-62	-44	178.2	172.9	0	0	0	0	111.1	L405 V412 V413	L405-V409 HydrophobicContact CD1-CG2 4.39Å; L405-V409 WeakPolarHBondContact O-CB 3.45Å; L405-V409 VanDerWaalsContact O-CG2 3.32Å; L405-V409 WeakPolarHBondContact O-CG2 3.28Å; L405-V409 PolarHBondContact O-N 3.46Å; V409-V412 PolarHBondContact O-N 2.86Å; V409-V413 WeakPolarHBondContact O-CG2 3.39Å; V409-V413 PolarHBondContact O-N 3.26Å; V409-V413 VanDerWaalsContact O-N 3.07Å
410	G	92.3	Very high	88.9	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-49.1	177.8	0	0	0	0	0	112.3	L406 S407 Y408 V412 V413 S414 S648	L406-G410 PolarHBondContact O-N 3.19Å; S407-G410 PolarHBondContact O-N 3.39Å; Y408-G410 PolarHBondContact O-N 3.28Å; G410-V412 VanDerWaalsContact C-N 3.34Å; G410-V412 PolarHBondContact O-N 2.93Å; G410-V413 PolarHBondContact O-N 3.5Å; G410-S414 WeakPolarHBondContact O-CB 3.38Å; G410-S414 PolarHBondContact O-N 3.41Å; G410-S648 CarbonylContact C-O 3.59Å
411	C	93.2	Very high	89.6	Confident	9 Å²	9	50.3 Å²	50.3	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-61.9	-38	178	-75.9	0	0	0	0	112.5	S407 Y408 S414 A415 D457 F460 L461 S648	S407-C411 VanDerWaalsContact O-CB 3.28Å; S407-C411 WeakPolarHBondContact O-CB 3.47Å; S407-C411 PolarHBondContact O-N 3.26Å; S407-C411 PolarHBondContact O-SG 3.17Å; Y408-C411 PolarHBondContact O-N 3.02Å; C411-S414 PolarHBondContact O-N 3.27Å; C411-A415 VanDerWaalsContact O-CB 3.24Å; C411-A415 WeakPolarHBondContact O-CB 3.49Å; C411-A415 PolarHBondContact O-N 2.83Å; C411-D457 HydrophobicContact CB-CB 4.26Å; C411-D457 PolarHBondContact SG-OD1 2.86Å; C411-D457 VanDerWaalsContact SG-OD1 3.33Å; C411-F460 HydrophobicContact CB-CD1 4.36Å; C411-L461 HydrophobicContact CB-CD1 4.4Å; C411-L461 HydrophobicContact CB-CD2 4.11Å; C411-L461 HydrophobicContact CB-CG 4.14Å; C411-S648 PolarHBondContact N-O 3.41Å
412	V	94.4	Very high	90.1	Very high	53 Å²	53	46.5 Å²	46.5	32%	0.321	25%	0.249	S	C	.	.	H	α-helix	trans	-62.1	-47.7	174	172.3	0	0	0	0	110.8	Y408 V409 G410 A415 L416 L461	Y408-V412 HydrophobicContact CD1-CG2 4.46Å; Y408-V412 HydrophobicContact CE1-CG2 4.2Å; Y408-V412 WeakPolarHBondContact O-CG2 3.23Å; Y408-V412 PolarHBondContact O-N 3.29Å; V409-V412 PolarHBondContact O-N 2.86Å; G410-V412 VanDerWaalsContact C-N 3.34Å; G410-V412 PolarHBondContact O-N 2.93Å; V412-A415 PolarHBondContact O-N 2.93Å; V412-L416 HydrophobicContact CG1-CD1 4.17Å; V412-L416 VanDerWaalsContact O-CG 3.32Å; V412-L416 WeakPolarHBondContact O-CG 3.21Å; V412-L416 PolarHBondContact O-N 3.35Å; V412-L461 HydrophobicContact CG2-CD1 3.86Å; V412-L461 HydrophobicContact CG2-CD2 3.75Å; V412-L461 HydrophobicContact CG2-CG 4.49Å
413	V	94.4	Very high	90.2	Very high	52 Å²	52	42.5 Å²	42.5	32%	0.315	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-43.2	178.4	173.2	0	0	0	0	111.1	V409 G410 L416 A417 F649 F652	V409-V413 WeakPolarHBondContact O-CG2 3.39Å; V409-V413 PolarHBondContact O-N 3.26Å; V409-V413 VanDerWaalsContact O-N 3.07Å; G410-V413 PolarHBondContact O-N 3.5Å; V413-L416 PolarHBondContact O-N 3.14Å; V413-A417 WeakPolarHBondContact O-CB 3.27Å; V413-A417 PolarHBondContact O-N 3.29Å; V413-F649 HydrophobicContact CB-CE1 4.11Å; V413-F649 HydrophobicContact CG1-CD1 4.24Å; V413-F649 HydrophobicContact CG1-CE1 4.04Å; V413-F649 HydrophobicContact CG2-CE1 4.41Å; V413-F652 HydrophobicContact CG1-CB 4.36Å; V413-F652 HydrophobicContact CG1-CD2 4.08Å; V413-F652 HydrophobicContact CG1-CG 4.22Å
414	S	92.8	Very high	90.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-48.2	177.2	177.2	0	0	0	0	111.5	G410 C411 L416 A417 C418 D457 S648 G651	G410-S414 WeakPolarHBondContact O-CB 3.38Å; G410-S414 PolarHBondContact O-N 3.41Å; C411-S414 PolarHBondContact O-N 3.27Å; S414-L416 PolarHBondContact O-N 3.32Å; S414-A417 PolarHBondContact O-N 3.11Å; S414-C418 WeakPolarHBondContact O-CB 3.38Å; S414-C418 PolarHBondContact O-N 3.17Å; S414-C418 PolarHBondContact O-SG 3.37Å; S414-D457 WeakPolarHBondContact CB-OD2 3.43Å; S414-D457 PolarHBondContact OG-OD2 3.05Å; S414-S648 VanDerWaalsContact CB-O 3.24Å; S414-S648 WeakPolarHBondContact CB-O 3.17Å; S414-G651 VanDerWaalsContact OG-CA 3.23Å; S414-G651 WeakPolarHBondContact OG-CA 3.45Å; S414-G651 PolarHBondContact OG-N 3.49Å; S414-G651 VanDerWaalsContact OG-N 3.09Å
415	A	93.8	Very high	90.1	Very high	9 Å²	9	41.9 Å²	41.9	7%	0.074	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-44.7	178	0	0	0	0	0	112.1	C411 V412 C418 L419 F454 D457	C411-A415 VanDerWaalsContact O-CB 3.24Å; C411-A415 WeakPolarHBondContact O-CB 3.49Å; C411-A415 PolarHBondContact O-N 2.83Å; V412-A415 PolarHBondContact O-N 2.93Å; A415-C418 PolarHBondContact O-N 3.31Å; A415-L419 WeakPolarHBondContact O-CG 3.27Å; A415-L419 PolarHBondContact O-N 3.29Å; A415-F454 HydrophobicContact CB-CD2 4.23Å; A415-F454 HydrophobicContact CB-CE2 4.41Å; A415-D457 HydrophobicContact CB-CB 4.03Å; A415-D457 PolarHBondContact N-OD2 3.38Å
416	L	94.4	Very high	89.9	Confident	103 Å²	103	42.2 Å²	42.2	54%	0.539	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-42.7	176	-69.5	173.9	0	0	0	111.8	V412 V413 S414 C418 L419 V420	V412-L416 HydrophobicContact CG1-CD1 4.17Å; V412-L416 VanDerWaalsContact O-CG 3.32Å; V412-L416 WeakPolarHBondContact O-CG 3.21Å; V412-L416 PolarHBondContact O-N 3.35Å; V413-L416 PolarHBondContact O-N 3.14Å; S414-L416 PolarHBondContact O-N 3.32Å; L416-C418 VanDerWaalsContact C-N 3.34Å; L416-C418 PolarHBondContact O-N 3.5Å; L416-L419 PolarHBondContact O-N 3.09Å; L416-V420 WeakPolarHBondContact O-CG2 3.38Å; L416-V420 PolarHBondContact O-N 3.1Å
417	A	91.5	Very high	89.4	Confident	8 Å²	8	44.2 Å²	44.2	7%	0.066	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-40.7	176.4	0	0	0	0	0	111.9	V413 S414 V420 T421 F652 F655	V413-A417 WeakPolarHBondContact O-CB 3.27Å; V413-A417 PolarHBondContact O-N 3.29Å; S414-A417 PolarHBondContact O-N 3.11Å; A417-V420 PolarHBondContact O-N 3.22Å; A417-T421 PolarHBondContact O-N 3.37Å; A417-T421 PolarHBondContact O-OG1 3.4Å; A417-F652 HydrophobicContact CB-CB 4.29Å; A417-F652 HydrophobicContact CB-CD2 4.11Å; A417-F655 HydrophobicContact CB-CB 4.06Å; A417-F655 HydrophobicContact CB-CD1 4.09Å; A417-F655 HydrophobicContact CB-CG 4.27Å
418	C	91.1	Very high	88.5	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-45.3	174	-64.8	0	0	0	0	111.6	S414 A415 L416 T421 I422 L450 F454	S414-C418 WeakPolarHBondContact O-CB 3.38Å; S414-C418 PolarHBondContact O-N 3.17Å; S414-C418 PolarHBondContact O-SG 3.37Å; A415-C418 PolarHBondContact O-N 3.31Å; L416-C418 VanDerWaalsContact C-N 3.34Å; L416-C418 PolarHBondContact O-N 3.5Å; C418-T421 VanDerWaalsContact CA-OG1 3.3Å; C418-T421 WeakPolarHBondContact CA-OG1 3.48Å; C418-T421 PolarHBondContact O-N 3.42Å; C418-T421 PolarHBondContact O-OG1 3.42Å; C418-I422 WeakPolarHBondContact O-CB 3.36Å; C418-I422 VanDerWaalsContact O-CG1 3.24Å; C418-I422 WeakPolarHBondContact O-CG1 3.43Å; C418-I422 PolarHBondContact O-N 3.35Å; C418-L450 HydrophobicContact CB-CD1 3.88Å; C418-L450 HydrophobicContact CB-CG 4.01Å; C418-L450 WeakPolarHBondContact SG-CD1 3.29Å; C418-F454 HydrophobicContact CB-CB 3.97Å; C418-F454 HydrophobicContact CB-CD2 4.42Å
419	L	91.5	Very high	87.2	Confident	80 Å²	80	47.7 Å²	47.7	42%	0.419	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-46.6	177.2	-75.8	172.7	0	0	0	112.1	A415 L416 T421 I422 A423 F454	A415-L419 WeakPolarHBondContact O-CG 3.27Å; A415-L419 PolarHBondContact O-N 3.29Å; L416-L419 PolarHBondContact O-N 3.09Å; L419-T421 VanDerWaalsContact C-N 3.31Å; L419-T421 PolarHBondContact O-N 3.36Å; L419-I422 PolarHBondContact O-N 3.47Å; L419-A423 WeakPolarHBondContact O-CB 3.42Å; L419-A423 PolarHBondContact O-N 3.24Å; L419-F454 HydrophobicContact CD1-CE2 3.72Å; L419-F454 HydrophobicContact CD1-CZ 4.36Å; L419-F454 HydrophobicContact CD2-CD2 4.1Å; L419-F454 HydrophobicContact CD2-CE1 4.47Å; L419-F454 HydrophobicContact CD2-CE2 3.59Å; L419-F454 HydrophobicContact CD2-CZ 3.8Å; L419-F454 HydrophobicContact CG-CD2 3.9Å; L419-F454 HydrophobicContact CG-CE2 3.49Å; L419-F454 VanDerWaalsContact CG-CE2 3.49Å; L419-F454 HydrophobicContact CG-CZ 4.2Å
420	V	89.5	Confident	85.3	Confident	86 Å²	86	49.2 Å²	49.2	52%	0.521	28%	0.282	S	S	.	.	H	α-helix	trans	-61.5	-40.3	179.1	170.3	0	0	0	0	111.2	L416 A417 A424	L416-V420 WeakPolarHBondContact O-CG2 3.38Å; L416-V420 PolarHBondContact O-N 3.1Å; A417-V420 PolarHBondContact O-N 3.22Å; V420-A424 WeakPolarHBondContact O-CB 3.41Å; V420-A424 PolarHBondContact O-N 3.12Å
421	T	85.9	Confident	83	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-70.4	-44.3	178.7	33.3	0	0	0	0	113.2	A417 C418 L419 A423 A424 Y425 L450 F655 Y658	A417-T421 PolarHBondContact O-N 3.37Å; A417-T421 PolarHBondContact O-OG1 3.4Å; C418-T421 VanDerWaalsContact CA-OG1 3.3Å; C418-T421 WeakPolarHBondContact CA-OG1 3.48Å; C418-T421 PolarHBondContact O-N 3.42Å; C418-T421 PolarHBondContact O-OG1 3.42Å; L419-T421 VanDerWaalsContact C-N 3.31Å; L419-T421 PolarHBondContact O-N 3.36Å; T421-A423 VanDerWaalsContact C-N 3.35Å; T421-A424 PolarHBondContact O-N 2.7Å; T421-Y425 WeakPolarHBondContact O-CB 3.23Å; T421-Y425 PolarHBondContact O-N 3.36Å; T421-L450 WeakPolarHBondContact OG1-CD2 3.31Å; T421-F655 HydrophobicContact CG2-CB 3.9Å; T421-F655 HydrophobicContact CG2-CD2 3Å; T421-F655 HydrophobicContact CG2-CE2 3.67Å; T421-F655 HydrophobicContact CG2-CG 3.79Å; T421-Y658 HydrophobicContact CG2-CD1 4.42Å
422	I	86.7	Confident	80.4	Confident	34 Å²	34	61.4 Å²	61.4	17%	0.174	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-47.4	174.3	-68.1	167.3	0	0	0	109.4	C418 L419 A424 Y425 L426 L450	C418-I422 WeakPolarHBondContact O-CB 3.36Å; C418-I422 VanDerWaalsContact O-CG1 3.24Å; C418-I422 WeakPolarHBondContact O-CG1 3.43Å; C418-I422 PolarHBondContact O-N 3.35Å; L419-I422 PolarHBondContact O-N 3.47Å; I422-A424 PolarHBondContact O-N 3.28Å; I422-Y425 WeakPolarHBondContact O-CB 3.38Å; I422-Y425 PolarHBondContact O-N 2.82Å; I422-L426 HydrophobicContact CG2-CD1 3.88Å; I422-L426 HydrophobicContact CG2-CG 4.29Å; I422-L426 VanDerWaalsContact O-CG 3.32Å; I422-L426 WeakPolarHBondContact O-CG 3.24Å; I422-L426 PolarHBondContact O-N 3.45Å; I422-L450 HydrophobicContact CD1-CD2 4.28Å; I422-L450 HydrophobicContact CD1-CG 4.31Å; I422-L450 HydrophobicContact CG1-CD2 3.63Å; I422-L450 HydrophobicContact CG1-CG 4.2Å
423	A	87.1	Confident	77.7	Confident	47 Å²	47	64.8 Å²	64.8	39%	0.388	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-46.4	177	0	0	0	0	0	111.6	L419 T421 Y425 L426 C427	L419-A423 WeakPolarHBondContact O-CB 3.42Å; L419-A423 PolarHBondContact O-N 3.24Å; T421-A423 VanDerWaalsContact C-N 3.35Å; A423-Y425 PolarHBondContact O-N 3.4Å; A423-L426 PolarHBondContact O-N 3.11Å; A423-C427 VanDerWaalsContact O-CB 3.28Å; A423-C427 WeakPolarHBondContact O-CB 2.9Å; A423-C427 PolarHBondContact O-N 3.44Å; A423-C427 PolarHBondContact O-SG 2.79Å
424	A	84	Confident	75	Confident	32 Å²	32	67.5 Å²	67.5	26%	0.264	40%	0.396	S	S	.	.	H	α-helix	trans	-62.6	-31.4	176.7	0	0	0	0	0	112.6	V420 T421 I422 S428 R662	V420-A424 WeakPolarHBondContact O-CB 3.41Å; V420-A424 PolarHBondContact O-N 3.12Å; T421-A424 PolarHBondContact O-N 2.7Å; I422-A424 PolarHBondContact O-N 3.28Å; A424-S428 VanDerWaalsContact O-CB 3.23Å; A424-S428 WeakPolarHBondContact O-CB 3.34Å; A424-S428 PolarHBondContact O-N 3.25Å; A424-S428 PolarHBondContact O-OG 2.91Å; A424-S428 VanDerWaalsContact O-OG 3.05Å; A424-R662 PolarHBondContact O-NH2 2.83Å
425	Y	81.4	Confident	72.3	Confident	29 Å²	29	78.6 Å²	78.6	11%	0.114	44%	0.437	C	S	.	.	H	α-helix	trans	-70.6	-50.2	172.9	175.7	-108.1	0	0	0	111.5	T421 I422 A423 S428 R429 I443 M447	T421-Y425 WeakPolarHBondContact O-CB 3.23Å; T421-Y425 PolarHBondContact O-N 3.36Å; I422-Y425 WeakPolarHBondContact O-CB 3.38Å; I422-Y425 PolarHBondContact O-N 2.82Å; A423-Y425 PolarHBondContact O-N 3.4Å; Y425-S428 PolarHBondContact O-N 2.66Å; Y425-S428 PolarHBondContact O-OG 3.21Å; Y425-R429 VanDerWaalsContact CE1-NH2 3.35Å; Y425-R429 PolarHBondContact O-N 3.34Å; Y425-R429 PolarHBondContact OH-NE 3.24Å; Y425-R429 PolarHBondContact OH-NH2 3.05Å; Y425-I443 HydrophobicContact CD2-CG2 3.99Å; Y425-I443 HydrophobicContact CE2-CG2 3.45Å; Y425-I443 VanDerWaalsContact CE2-CG2 3.45Å; Y425-M447 HydrophobicContact CD1-CG 3.73Å; Y425-M447 HydrophobicContact CD1-SD 3.71Å; Y425-M447 HydrophobicContact CD2-CG 4.35Å; Y425-M447 HydrophobicContact CD2-SD 4.18Å; Y425-M447 HydrophobicContact CE1-CG 3.8Å; Y425-M447 HydrophobicContact CE1-SD 4.39Å; Y425-M447 HydrophobicContact CE2-CG 4.42Å; Y425-M447 HydrophobicContact CG-CG 3.99Å; Y425-M447 HydrophobicContact CG-SD 3.56Å; Y425-M447 VanDerWaalsContact CG-SD 3.56Å
426	L	82.6	Confident	69.7	Low	99 Å²	99	87.3 Å²	87.3	52%	0.518	47%	0.468	S	S	.	.	H	α-helix	trans	-61.6	-47.1	178.8	-68.2	176.1	0	0	0	111.9	I422 A423 S428 R429	I422-L426 HydrophobicContact CG2-CD1 3.88Å; I422-L426 HydrophobicContact CG2-CG 4.29Å; I422-L426 VanDerWaalsContact O-CG 3.32Å; I422-L426 WeakPolarHBondContact O-CG 3.24Å; I422-L426 PolarHBondContact O-N 3.45Å; A423-L426 PolarHBondContact O-N 3.11Å; L426-S428 VanDerWaalsContact C-N 3.29Å; L426-S428 PolarHBondContact O-N 3.08Å; L426-R429 WeakPolarHBondContact O-CB 3.39Å; L426-R429 PolarHBondContact O-N 2.8Å
427	C	79.2	Confident	67	Low	88 Å²	88	91.7 Å²	91.7	60%	0.595	48%	0.483	S	S	*	.	H	α-helix	trans	-62	-35.6	175.3	-68.3	0	0	0	0	111.8	A423 R429 V430	A423-C427 VanDerWaalsContact O-CB 3.28Å; A423-C427 WeakPolarHBondContact O-CB 2.9Å; A423-C427 PolarHBondContact O-N 3.44Å; A423-C427 PolarHBondContact O-SG 2.79Å; C427-R429 PolarHBondContact O-N 2.82Å; C427-V430 VanDerWaalsContact O-CB 3.31Å; C427-V430 WeakPolarHBondContact O-CB 3.47Å; C427-V430 WeakPolarHBondContact O-CG2 3.3Å; C427-V430 PolarHBondContact O-N 2.72Å; C427-V430 VanDerWaalsContact O-N 3.13Å
428	S	70.9	Confident	65	Low	50 Å²	50	95.2 Å²	95.2	35%	0.35	51%	0.505	S	S	.	.	H	α-helix	trans	-72.4	-11	175.9	70	0	0	0	0	114.5	A424 Y425 L426 V430 R662	A424-S428 VanDerWaalsContact O-CB 3.23Å; A424-S428 WeakPolarHBondContact O-CB 3.34Å; A424-S428 PolarHBondContact O-N 3.25Å; A424-S428 PolarHBondContact O-OG 2.91Å; A424-S428 VanDerWaalsContact O-OG 3.05Å; Y425-S428 PolarHBondContact O-N 2.66Å; Y425-S428 PolarHBondContact O-OG 3.21Å; L426-S428 VanDerWaalsContact C-N 3.29Å; L426-S428 PolarHBondContact O-N 3.08Å; S428-V430 VanDerWaalsContact C-N 3.35Å; S428-R662 PolarHBondContact OG-NH1 3.09Å
429	R	63.4	Low	63.1	Low	148 Å²	148	101.9 Å²	101.9	56%	0.558	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-13.3	169.3	-68.3	-158.8	-173.4	176.6	7.5	113.1	Y425 L426 C427	Y425-R429 VanDerWaalsContact CE1-NH2 3.35Å; Y425-R429 PolarHBondContact O-N 3.34Å; Y425-R429 PolarHBondContact OH-NE 3.24Å; Y425-R429 PolarHBondContact OH-NH2 3.05Å; L426-R429 WeakPolarHBondContact O-CB 3.39Å; L426-R429 PolarHBondContact O-N 2.8Å; C427-R429 PolarHBondContact O-N 2.82Å
430	V	51.4	Low	61.8	Low	104 Å²	104	102 Å²	102	63%	0.63	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	124.3	164.3	-177.5	0	0	0	0	106.4	C427 S428 L432	C427-V430 VanDerWaalsContact O-CB 3.31Å; C427-V430 WeakPolarHBondContact O-CB 3.47Å; C427-V430 WeakPolarHBondContact O-CG2 3.3Å; C427-V430 PolarHBondContact O-N 2.72Å; C427-V430 VanDerWaalsContact O-N 3.13Å; S428-V430 VanDerWaalsContact C-N 3.35Å; V430-L432 PolarHBondContact O-N 3.35Å
431	P	43.9	Very low	61.1	Low	117 Å²	117	102 Å²	102	76%	0.76	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	103.2	-139	24.7	-34.3	0	0	0	113.7
432	L	39.3	Very low	60.5	Low	148 Å²	148	103.4 Å²	103.4	78%	0.775	53%	0.531	S	S	*	.			trans	-103.9	113	155.6	-89.5	156.5	0	0	0	108.3	V430 C434	V430-L432 PolarHBondContact O-N 3.35Å; L432-C434 VanDerWaalsContact C-N 3.26Å; L432-C434 PolarHBondContact O-N 3.25Å
433	P	37.4	Very low	60.1	Low	124 Å²	124	103.5 Å²	103.5	81%	0.805	53%	0.532	S	S	*	.			trans	-78.9	74.3	-172.5	33.7	-34.5	0	0	0	110.1
434	C	37.1	Very low	60	Low	109 Å²	109	104.6 Å²	104.6	74%	0.736	53%	0.528	S	S	*	.			trans	-97.9	93.7	166.1	-85.3	0	0	0	0	109	L432 R436	L432-C434 VanDerWaalsContact C-N 3.26Å; L432-C434 PolarHBondContact O-N 3.25Å; C434-R436 PolarHBondContact O-N 3.13Å
435	R	35.9	Very low	60.1	Low	233 Å²	233	103.1 Å²	103.1	88%	0.879	52%	0.515	S	S	*	.			trans	-25.8	122.7	154.5	-89.1	179.5	169.3	174.5	-2.5	110.5
436	R	40	Very low	60.2	Low	192 Å²	192	102 Å²	102	73%	0.725	51%	0.511	S	S	*	.			trans	176.6	93.6	139.6	-93.4	160.5	-161.2	110.1	-11.7	113	C434	C434-R436 PolarHBondContact O-N 3.13Å
437	K	37.8	Very low	60.4	Low	195 Å²	195	98.1 Å²	98.1	85%	0.848	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-31.8	149.3	133.7	-144.6	170.7	-174.9	179	0	110.5
438	P	48.5	Very low	61	Low	82 Å²	82	96 Å²	96	53%	0.532	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	cis	-96.8	18.6	-30.2	10.6	13.8	0	0	0	112.6	D440	P438-D440 PolarHBondContact O-N 3.19Å
439	R	51.4	Low	61.9	Low	140 Å²	140	93.7 Å²	93.7	53%	0.528	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-7.5	-178.2	-160.2	169.5	70.9	154.3	1.1	113.8	I443	R439-I443 HydrophobicContact CG-CD1 4.09Å; R439-I443 WeakPolarHBondContact O-CD1 3.37Å; R439-I443 WeakPolarHBondContact O-CG1 3.45Å; R439-I443 PolarHBondContact O-N 2.88Å
440	D	65	Low	63.2	Low	82 Å²	82	86.8 Å²	86.8	44%	0.439	43%	0.431	S	S	.	.	H	α-helix	trans	-70.7	-31.9	-175.8	-67.7	-24.3	0	0	0	114	P438 K444	P438-D440 PolarHBondContact O-N 3.19Å; D440-K444 WeakPolarHBondContact O-CB 3.48Å; D440-K444 WeakPolarHBondContact O-CD 3.29Å; D440-K444 WeakPolarHBondContact O-CG 3.4Å; D440-K444 PolarHBondContact O-N 3.38Å; D440-K444 VanDerWaalsContact O-N 3.07Å
441	Y	73.2	Confident	65.2	Low	87 Å²	87	84.9 Å²	84.9	34%	0.341	42%	0.417	S	S	.	.	H	α-helix	trans	-70.6	-49.4	-177.5	-69	-63.1	0	0	0	112	I443 K444 V445 Y515 L516	Y441-I443 VanDerWaalsContact C-N 3.31Å; Y441-I443 PolarHBondContact O-N 3.48Å; Y441-K444 PolarHBondContact O-N 3.47Å; Y441-K444 VanDerWaalsContact O-N 3.11Å; Y441-V445 WeakPolarHBondContact O-CG2 3.45Å; Y441-V445 PolarHBondContact O-N 3.31Å; Y441-Y515 HydrophobicContact CD1-CD1 4.31Å; Y441-L516 HydrophobicContact CD1-CD1 3.59Å; Y441-L516 HydrophobicContact CD1-CD2 3.89Å; Y441-L516 HydrophobicContact CD1-CG 3.51Å; Y441-L516 HydrophobicContact CE1-CD1 3.7Å; Y441-L516 HydrophobicContact CE1-CG 3.76Å
442	T	75.2	Confident	67.6	Low	32 Å²	32	79.3 Å²	79.3	20%	0.196	38%	0.381	C	S	.	.	H	α-helix	trans	-58.7	-43.5	177.5	-53.1	0	0	0	0	111.7	K444 V445 H446 N499	T442-K444 VanDerWaalsContact C-N 3.34Å; T442-K444 PolarHBondContact O-N 3.39Å; T442-V445 PolarHBondContact O-N 2.92Å; T442-H446 VanDerWaalsContact O-CB 3.28Å; T442-H446 WeakPolarHBondContact O-CB 3.48Å; T442-H446 PolarHBondContact O-N 3.27Å; T442-N499 WeakPolarHBondContact CA-ND2 3.39Å; T442-N499 PolarHBondContact OG1-ND2 3.29Å; T442-N499 VanDerWaalsContact OG1-ND2 3.13Å
443	I	78.4	Confident	70.1	Confident	36 Å²	36	72.4 Å²	72.4	19%	0.185	35%	0.345	C	S	.	.	H	α-helix	trans	-62.4	-43	177	-63.7	169.1	0	0	0	110.4	Y425 R439 Y441 H446 M447	Y425-I443 HydrophobicContact CD2-CG2 3.99Å; Y425-I443 HydrophobicContact CE2-CG2 3.45Å; Y425-I443 VanDerWaalsContact CE2-CG2 3.45Å; R439-I443 HydrophobicContact CG-CD1 4.09Å; R439-I443 WeakPolarHBondContact O-CD1 3.37Å; R439-I443 WeakPolarHBondContact O-CG1 3.45Å; R439-I443 PolarHBondContact O-N 2.88Å; Y441-I443 VanDerWaalsContact C-N 3.31Å; Y441-I443 PolarHBondContact O-N 3.48Å; I443-H446 PolarHBondContact O-N 3.47Å; I443-M447 HydrophobicContact CG2-CG 4.38Å; I443-M447 VanDerWaalsContact O-CG 3.25Å; I443-M447 WeakPolarHBondContact O-CG 3.46Å; I443-M447 PolarHBondContact O-N 2.88Å
444	K	83.9	Confident	72.8	Confident	70 Å²	70	68.6 Å²	68.6	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-41.9	178.8	-74	171.3	-176.2	177.3	0	113.1	D440 Y441 T442 H446 M447 N448 L516	D440-K444 WeakPolarHBondContact O-CB 3.48Å; D440-K444 WeakPolarHBondContact O-CD 3.29Å; D440-K444 WeakPolarHBondContact O-CG 3.4Å; D440-K444 PolarHBondContact O-N 3.38Å; D440-K444 VanDerWaalsContact O-N 3.07Å; Y441-K444 PolarHBondContact O-N 3.47Å; Y441-K444 VanDerWaalsContact O-N 3.11Å; T442-K444 VanDerWaalsContact C-N 3.34Å; T442-K444 PolarHBondContact O-N 3.39Å; K444-H446 VanDerWaalsContact C-N 3.3Å; K444-H446 PolarHBondContact O-N 2.9Å; K444-M447 PolarHBondContact O-N 2.99Å; K444-N448 PolarHBondContact O-N 3.37Å; K444-N448 VanDerWaalsContact O-N 3.1Å; K444-L516 HydrophobicContact CB-CD1 4.34Å; K444-L516 HydrophobicContact CB-CD2 4.21Å; K444-L516 HydrophobicContact CD-CD1 3.43Å; K444-L516 VanDerWaalsContact CD-CD1 3.43Å
445	V	85.4	Confident	75.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-45.9	174.4	171.3	0	0	0	0	110	Y441 T442 M447 N448 L449 W492 E496 N499 L516 L519	Y441-V445 WeakPolarHBondContact O-CG2 3.45Å; Y441-V445 PolarHBondContact O-N 3.31Å; T442-V445 PolarHBondContact O-N 2.92Å; V445-M447 PolarHBondContact O-N 3.37Å; V445-N448 WeakPolarHBondContact O-CB 3.24Å; V445-N448 PolarHBondContact O-N 2.93Å; V445-N448 VanDerWaalsContact O-N 3.11Å; V445-L449 PolarHBondContact O-N 3.07Å; V445-W492 HydrophobicContact CG1-CE3 4.21Å; V445-W492 HydrophobicContact CG1-CZ3 4.1Å; V445-E496 HydrophobicContact CG1-CB 4.21Å; V445-N499 HydrophobicContact CG1-CB 4.39Å; V445-L516 HydrophobicContact CG2-CD2 4.14Å; V445-L519 HydrophobicContact CG2-CD1 3.76Å
446	H	84.5	Confident	78.4	Confident	7 Å²	7	55.1 Å²	55.1	3%	0.032	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-38.1	178.4	-161.8	71.2	0	0	0	112.8	T442 I443 K444 N448 L449 L450 E496 I654 W657	T442-H446 VanDerWaalsContact O-CB 3.28Å; T442-H446 WeakPolarHBondContact O-CB 3.48Å; T442-H446 PolarHBondContact O-N 3.27Å; I443-H446 PolarHBondContact O-N 3.47Å; K444-H446 VanDerWaalsContact C-N 3.3Å; K444-H446 PolarHBondContact O-N 2.9Å; H446-N448 VanDerWaalsContact C-N 3.31Å; H446-N448 PolarHBondContact O-N 2.63Å; H446-L449 PolarHBondContact O-N 3.29Å; H446-L450 VanDerWaalsContact O-CB 3.32Å; H446-L450 WeakPolarHBondContact O-CB 3.47Å; H446-L450 PolarHBondContact O-N 2.92Å; H446-E496 IonicContact CE1-OE1 2.81Å; H446-E496 PolarHBondContact CE1-OE1 3.13Å; H446-E496 IonicContact CG-OE1 3.5Å; H446-E496 IonicContact ND1-OE1 2.86Å; H446-E496 PolarHBondContact ND1-OE1 3.37Å; H446-E496 IonicContact ND1-OE2 2.74Å; H446-E496 PolarHBondContact ND1-OE2 2.88Å; H446-I654 VanDerWaalsContact CE1-CG2 3.41Å; H446-I654 WeakPolarHBondContact CE1-CG2 3.11Å; H446-I654 WeakPolarHBondContact NE2-CG2 3.48Å; H446-W657 AromaticContact CE1-CE3 3.95Å; H446-W657 AromaticContact CE1-CZ3 3.77Å; H446-W657 AromaticContact NE2-CE3 3.76Å; H446-W657 AromaticContact NE2-CZ3 3.65Å
447	M	87.4	Confident	81	Confident	17 Å²	17	46.3 Å²	46.3	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-34.5	173.4	-68.2	-61.6	108.6	0	0	112.5	Y425 I443 K444 V445 L450 L451 Y658	Y425-M447 HydrophobicContact CD1-CG 3.73Å; Y425-M447 HydrophobicContact CD1-SD 3.71Å; Y425-M447 HydrophobicContact CD2-CG 4.35Å; Y425-M447 HydrophobicContact CD2-SD 4.18Å; Y425-M447 HydrophobicContact CE1-CG 3.8Å; Y425-M447 HydrophobicContact CE1-SD 4.39Å; Y425-M447 HydrophobicContact CE2-CG 4.42Å; Y425-M447 HydrophobicContact CG-CG 3.99Å; Y425-M447 HydrophobicContact CG-SD 3.56Å; Y425-M447 VanDerWaalsContact CG-SD 3.56Å; I443-M447 HydrophobicContact CG2-CG 4.38Å; I443-M447 VanDerWaalsContact O-CG 3.25Å; I443-M447 WeakPolarHBondContact O-CG 3.46Å; I443-M447 PolarHBondContact O-N 2.88Å; K444-M447 PolarHBondContact O-N 2.99Å; V445-M447 PolarHBondContact O-N 3.37Å; M447-L450 HydrophobicContact CE-CD2 4.36Å; M447-L450 HydrophobicContact SD-CD2 4.46Å; M447-L451 WeakPolarHBondContact O-CB 3.39Å; M447-L451 PolarHBondContact O-N 3.02Å; M447-Y658 HydrophobicContact CE-CD2 4.43Å; M447-Y658 HydrophobicContact CE-CE2 4.09Å
448	N	91.1	Very high	83.7	Confident	44 Å²	44	39 Å²	39	24%	0.235	19%	0.192	C	C	.	.	H	α-helix	trans	-71.9	-39.5	175.5	-72.6	-32.2	0	0	0	112.1	K444 V445 H446 L450 L451 A452 W492	K444-N448 PolarHBondContact O-N 3.37Å; K444-N448 VanDerWaalsContact O-N 3.1Å; V445-N448 WeakPolarHBondContact O-CB 3.24Å; V445-N448 PolarHBondContact O-N 2.93Å; V445-N448 VanDerWaalsContact O-N 3.11Å; H446-N448 VanDerWaalsContact C-N 3.31Å; H446-N448 PolarHBondContact O-N 2.63Å; N448-L450 VanDerWaalsContact C-N 3.3Å; N448-L450 PolarHBondContact O-N 3.45Å; N448-L451 PolarHBondContact O-N 2.95Å; N448-A452 PolarHBondContact O-N 3.07Å; N448-W492 HydrophobicContact CB-CD2 3.81Å; N448-W492 HydrophobicContact CB-CE3 3.82Å; N448-W492 HydrophobicContact CB-CH2 3.65Å; N448-W492 HydrophobicContact CB-CZ2 3.59Å; N448-W492 HydrophobicContact CB-CZ3 3.75Å; N448-W492 WeakPolarHBondContact ND2-CH2 3.12Å
449	L	90.2	Very high	85.9	Confident	1 Å²	1	35 Å²	35	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-58.8	-46.7	171.7	174.7	64.7	0	0	0	110.4	V445 H446 L451 A452 V453 W492 M493 E496 L619 I654	V445-L449 PolarHBondContact O-N 3.07Å; H446-L449 PolarHBondContact O-N 3.29Å; L449-L451 VanDerWaalsContact C-N 3.29Å; L449-L451 PolarHBondContact O-N 2.62Å; L449-A452 CarbonylContact O-C 3.54Å; L449-A452 WeakPolarHBondContact O-CA 3.4Å; L449-A452 WeakPolarHBondContact O-CB 3.47Å; L449-A452 PolarHBondContact O-N 3.19Å; L449-V453 HydrophobicContact CD1-CG2 4.31Å; L449-V453 HydrophobicContact CG-CG2 4.41Å; L449-V453 WeakPolarHBondContact O-CG2 3.43Å; L449-V453 PolarHBondContact O-N 2.92Å; L449-W492 HydrophobicContact CB-CB 4.19Å; L449-W492 HydrophobicContact CD1-CB 3.75Å; L449-M493 HydrophobicContact CD1-CG 3.63Å; L449-E496 WeakPolarHBondContact CD2-OE2 3.06Å; L449-L619 HydrophobicContact CD2-CD2 3.35Å; L449-I654 HydrophobicContact CD2-CD1 4.12Å
450	L	90.7	Very high	87.8	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-62.5	-37.5	179.6	-170.6	70.4	0	0	0	112.4	C418 T421 I422 H446 M447 N448 V453 F454 I654	C418-L450 HydrophobicContact CB-CD1 3.88Å; C418-L450 HydrophobicContact CB-CG 4.01Å; C418-L450 WeakPolarHBondContact SG-CD1 3.29Å; T421-L450 WeakPolarHBondContact OG1-CD2 3.31Å; I422-L450 HydrophobicContact CD1-CD2 4.28Å; I422-L450 HydrophobicContact CD1-CG 4.31Å; I422-L450 HydrophobicContact CG1-CD2 3.63Å; I422-L450 HydrophobicContact CG1-CG 4.2Å; H446-L450 VanDerWaalsContact O-CB 3.32Å; H446-L450 WeakPolarHBondContact O-CB 3.47Å; H446-L450 PolarHBondContact O-N 2.92Å; M447-L450 HydrophobicContact CE-CD2 4.36Å; M447-L450 HydrophobicContact SD-CD2 4.46Å; N448-L450 VanDerWaalsContact C-N 3.3Å; N448-L450 PolarHBondContact O-N 3.45Å; L450-V453 PolarHBondContact O-N 3Å; L450-F454 WeakPolarHBondContact O-CB 3.36Å; L450-F454 PolarHBondContact O-N 3.06Å; L450-I654 HydrophobicContact CD1-CG2 4.23Å
451	L	93	Very high	89.1	Confident	65 Å²	65	29.5 Å²	29.5	34%	0.34	14%	0.144	S	C	.	.	H	α-helix	trans	-63.6	-41.4	171	-179.6	61.5	0	0	0	111.4	M447 N448 L449 F454 L455 W524	M447-L451 WeakPolarHBondContact O-CB 3.39Å; M447-L451 PolarHBondContact O-N 3.02Å; N448-L451 PolarHBondContact O-N 2.95Å; L449-L451 VanDerWaalsContact C-N 3.29Å; L449-L451 PolarHBondContact O-N 2.62Å; L451-F454 HydrophobicContact CD1-CD1 4.42Å; L451-F454 PolarHBondContact O-N 3.23Å; L451-L455 VanDerWaalsContact O-CG 3.3Å; L451-L455 WeakPolarHBondContact O-CG 3.37Å; L451-L455 PolarHBondContact O-N 2.84Å; L451-W524 HydrophobicContact CD2-CH2 4.07Å; L451-W524 HydrophobicContact CD2-CZ2 3.97Å; L451-W524 HydrophobicContact CG-CH2 4.11Å; L451-W524 HydrophobicContact CG-CZ2 4.34Å
452	A	93.9	Very high	90	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-41.2	176.3	0	0	0	0	0	112.4	N448 L449 L455 L456 T488 C489	N448-A452 PolarHBondContact O-N 3.07Å; L449-A452 CarbonylContact O-C 3.54Å; L449-A452 WeakPolarHBondContact O-CA 3.4Å; L449-A452 WeakPolarHBondContact O-CB 3.47Å; L449-A452 PolarHBondContact O-N 3.19Å; A452-L455 PolarHBondContact O-N 2.91Å; A452-L456 WeakPolarHBondContact O-CB 3.45Å; A452-L456 PolarHBondContact O-N 3.02Å; A452-T488 HydrophobicContact CB-CG2 3.91Å; A452-C489 HydrophobicContact CB-CB 4.4Å
453	V	92.6	Very high	90.6	Very high	3 Å²	3	28 Å²	28	2%	0.018	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-44.9	173.5	173.4	0	0	0	0	110.6	L449 L450 L455 L456 D457	L449-V453 HydrophobicContact CD1-CG2 4.31Å; L449-V453 HydrophobicContact CG-CG2 4.41Å; L449-V453 WeakPolarHBondContact O-CG2 3.43Å; L449-V453 PolarHBondContact O-N 2.92Å; L450-V453 PolarHBondContact O-N 3Å; V453-L455 VanDerWaalsContact C-N 3.34Å; V453-L455 PolarHBondContact O-N 3.04Å; V453-L456 WeakPolarHBondContact O-CB 3.25Å; V453-L456 PolarHBondContact O-N 3.46Å; V453-L456 VanDerWaalsContact O-N 3.16Å; V453-D457 PolarHBondContact O-N 2.91Å
454	F	94.8	Very high	90.9	Very high	44 Å²	44	29.5 Å²	29.5	19%	0.193	15%	0.147	C	C	.	.	H	α-helix	trans	-58.7	-43.6	175.5	172.2	-101.4	0	0	0	112.7	A415 C418 L419 L450 L451 L456 T458	A415-F454 HydrophobicContact CB-CD2 4.23Å; A415-F454 HydrophobicContact CB-CE2 4.41Å; C418-F454 HydrophobicContact CB-CB 3.97Å; C418-F454 HydrophobicContact CB-CD2 4.42Å; L419-F454 HydrophobicContact CD1-CE2 3.72Å; L419-F454 HydrophobicContact CD1-CZ 4.36Å; L419-F454 HydrophobicContact CD2-CD2 4.1Å; L419-F454 HydrophobicContact CD2-CE1 4.47Å; L419-F454 HydrophobicContact CD2-CE2 3.59Å; L419-F454 HydrophobicContact CD2-CZ 3.8Å; L419-F454 HydrophobicContact CG-CD2 3.9Å; L419-F454 HydrophobicContact CG-CE2 3.49Å; L419-F454 VanDerWaalsContact CG-CE2 3.49Å; L419-F454 HydrophobicContact CG-CZ 4.2Å; L450-F454 WeakPolarHBondContact O-CB 3.36Å; L450-F454 PolarHBondContact O-N 3.06Å; L451-F454 HydrophobicContact CD1-CD1 4.42Å; L451-F454 PolarHBondContact O-N 3.23Å; F454-L456 VanDerWaalsContact C-N 3.34Å; F454-T458 WeakPolarHBondContact O-CB 3.32Å; F454-T458 PolarHBondContact O-N 3.14Å; F454-T458 PolarHBondContact O-OG1 2.85Å
455	L	95.7	Very high	91.1	Very high	35 Å²	35	29 Å²	29	18%	0.183	15%	0.151	C	C	.	.	H	α-helix	trans	-64.8	-39.8	176.1	-67.5	173.8	0	0	0	111.4	L451 A452 V453 S459 F481 W524	L451-L455 VanDerWaalsContact O-CG 3.3Å; L451-L455 WeakPolarHBondContact O-CG 3.37Å; L451-L455 PolarHBondContact O-N 2.84Å; A452-L455 PolarHBondContact O-N 2.91Å; V453-L455 VanDerWaalsContact C-N 3.34Å; V453-L455 PolarHBondContact O-N 3.04Å; L455-S459 VanDerWaalsContact O-CB 3.3Å; L455-S459 WeakPolarHBondContact O-CB 3.4Å; L455-S459 PolarHBondContact O-N 2.81Å; L455-S459 PolarHBondContact O-OG 3.31Å; L455-F481 HydrophobicContact CD2-CZ 4.03Å; L455-W524 HydrophobicContact CD1-CH2 3.72Å; L455-W524 HydrophobicContact CD1-CZ3 3.68Å
456	L	94.9	Very high	91.1	Very high	24 Å²	24	30.6 Å²	30.6	13%	0.126	16%	0.161	C	C	.	.	H	α-helix	trans	-63.7	-49.7	176.6	178.5	58.5	0	0	0	111.6	A452 V453 F454 T458 S459 F460 L482 L486 C489	A452-L456 WeakPolarHBondContact O-CB 3.45Å; A452-L456 PolarHBondContact O-N 3.02Å; V453-L456 WeakPolarHBondContact O-CB 3.25Å; V453-L456 PolarHBondContact O-N 3.46Å; V453-L456 VanDerWaalsContact O-N 3.16Å; F454-L456 VanDerWaalsContact C-N 3.34Å; L456-T458 VanDerWaalsContact C-N 3.34Å; L456-T458 PolarHBondContact O-N 2.98Å; L456-S459 PolarHBondContact O-N 3.02Å; L456-F460 WeakPolarHBondContact O-CB 3.48Å; L456-F460 PolarHBondContact O-N 2.99Å; L456-L482 HydrophobicContact CD1-CD2 4.49Å; L456-L486 HydrophobicContact CD1-CB 3.97Å; L456-L486 HydrophobicContact CD1-CD1 4.26Å; L456-L486 HydrophobicContact CD2-CD1 4.15Å; L456-C489 HydrophobicContact CD2-CB 4.01Å
457	D	94.2	Very high	90.9	Very high	7 Å²	7	30.9 Å²	30.9	4%	0.037	16%	0.164	C	C	.	.	H	α-helix	trans	-59.4	-45.9	177.6	-71.6	-27.9	0	0	0	110.8	C411 S414 A415 V453 S459 F460 L461	C411-D457 HydrophobicContact CB-CB 4.26Å; C411-D457 PolarHBondContact SG-OD1 2.86Å; C411-D457 VanDerWaalsContact SG-OD1 3.33Å; S414-D457 WeakPolarHBondContact CB-OD2 3.43Å; S414-D457 PolarHBondContact OG-OD2 3.05Å; A415-D457 HydrophobicContact CB-CB 4.03Å; A415-D457 PolarHBondContact N-OD2 3.38Å; V453-D457 PolarHBondContact O-N 2.91Å; D457-S459 PolarHBondContact O-N 3.17Å; D457-F460 PolarHBondContact O-N 2.85Å; D457-L461 WeakPolarHBondContact O-CB 3.46Å; D457-L461 VanDerWaalsContact O-CG 3.22Å; D457-L461 WeakPolarHBondContact O-CG 3.49Å; D457-L461 PolarHBondContact O-N 3.46Å
458	T	94	Very high	90.5	Very high	40 Å²	40	35.3 Å²	35.3	25%	0.245	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-41.7	178.1	-54.1	0	0	0	0	111.5	F454 L456 F460 L461 L462	F454-T458 WeakPolarHBondContact O-CB 3.32Å; F454-T458 PolarHBondContact O-N 3.14Å; F454-T458 PolarHBondContact O-OG1 2.85Å; L456-T458 VanDerWaalsContact C-N 3.34Å; L456-T458 PolarHBondContact O-N 2.98Å; T458-F460 VanDerWaalsContact C-N 3.34Å; T458-F460 PolarHBondContact O-N 3.46Å; T458-L461 PolarHBondContact O-N 2.92Å; T458-L462 HydrophobicContact CG2-CD1 3.96Å; T458-L462 HydrophobicContact CG2-CG 4.45Å; T458-L462 WeakPolarHBondContact O-CB 3.4Å; T458-L462 VanDerWaalsContact O-CG 3.24Å; T458-L462 WeakPolarHBondContact O-CG 3.17Å; T458-L462 PolarHBondContact O-N 3.4Å
459	S	94	Very high	90	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.3	-43	177	-57.2	0	0	0	0	111.7	L455 L456 D457 L462 S463 F481 S485	L455-S459 VanDerWaalsContact O-CB 3.3Å; L455-S459 WeakPolarHBondContact O-CB 3.4Å; L455-S459 PolarHBondContact O-N 2.81Å; L455-S459 PolarHBondContact O-OG 3.31Å; L456-S459 PolarHBondContact O-N 3.02Å; D457-S459 PolarHBondContact O-N 3.17Å; S459-L462 PolarHBondContact O-N 3.46Å; S459-S463 PolarHBondContact O-N 3.46Å; S459-S463 VanDerWaalsContact O-N 3.12Å; S459-F481 WeakPolarHBondContact OG-CD1 3.28Å; S459-F481 WeakPolarHBondContact OG-CE1 2.85Å; S459-S485 PolarHBondContact OG-OG 3.48Å; S459-S485 VanDerWaalsContact OG-OG 3.07Å
460	F	92.5	Very high	89.3	Confident	72 Å²	72	41 Å²	41	32%	0.316	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-47.1	178.1	-176.2	-101.4	0	0	0	111.2	C411 L456 D457 T458 L462 S463 L482	C411-F460 HydrophobicContact CB-CD1 4.36Å; L456-F460 WeakPolarHBondContact O-CB 3.48Å; L456-F460 PolarHBondContact O-N 2.99Å; D457-F460 PolarHBondContact O-N 2.85Å; T458-F460 VanDerWaalsContact C-N 3.34Å; T458-F460 PolarHBondContact O-N 3.46Å; F460-L462 VanDerWaalsContact C-N 3.28Å; F460-L462 PolarHBondContact O-N 3.11Å; F460-S463 WeakPolarHBondContact O-CB 3.48Å; F460-S463 PolarHBondContact O-N 2.92Å; F460-S463 VanDerWaalsContact O-N 3.15Å; F460-S463 PolarHBondContact O-OG 2.92Å; F460-L482 HydrophobicContact CB-CD1 4.41Å; F460-L482 HydrophobicContact CD2-CD1 4.37Å
461	L	92.5	Very high	88.9	Confident	34 Å²	34	43.6 Å²	43.6	18%	0.178	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-30.7	177.5	-68.4	171.6	0	0	0	113.3	Y408 C411 V412 D457 T458 P465	Y408-L461 HydrophobicContact CD2-CD2 3.56Å; Y408-L461 HydrophobicContact CE2-CD2 3.57Å; Y408-L461 HydrophobicContact CG-CD2 4.12Å; C411-L461 HydrophobicContact CB-CD1 4.4Å; C411-L461 HydrophobicContact CB-CD2 4.11Å; C411-L461 HydrophobicContact CB-CG 4.14Å; V412-L461 HydrophobicContact CG2-CD1 3.86Å; V412-L461 HydrophobicContact CG2-CD2 3.75Å; V412-L461 HydrophobicContact CG2-CG 4.49Å; D457-L461 WeakPolarHBondContact O-CB 3.46Å; D457-L461 VanDerWaalsContact O-CG 3.22Å; D457-L461 WeakPolarHBondContact O-CG 3.49Å; D457-L461 PolarHBondContact O-N 3.46Å; T458-L461 PolarHBondContact O-N 2.92Å; L461-P465 WeakPolarHBondContact O-CD 3.45Å; L461-P465 WeakPolarHBondContact O-CG 3.39Å
462	L	91.7	Very high	88.4	Confident	83 Å²	83	47 Å²	47	44%	0.435	27%	0.27	S	S	.	.	H	α-helix	trans	-78.9	-23.9	176.1	-72.6	171.6	0	0	0	113.3	T458 S459 F460 E464 P465 V466	T458-L462 HydrophobicContact CG2-CD1 3.96Å; T458-L462 HydrophobicContact CG2-CG 4.45Å; T458-L462 WeakPolarHBondContact O-CB 3.4Å; T458-L462 VanDerWaalsContact O-CG 3.24Å; T458-L462 WeakPolarHBondContact O-CG 3.17Å; T458-L462 PolarHBondContact O-N 3.4Å; S459-L462 PolarHBondContact O-N 3.46Å; F460-L462 VanDerWaalsContact C-N 3.28Å; F460-L462 PolarHBondContact O-N 3.11Å; L462-E464 PolarHBondContact O-N 2.77Å; L462-P465 WeakPolarHBondContact O-CD 3.48Å; L462-V466 VanDerWaalsContact O-CB 3.29Å; L462-V466 WeakPolarHBondContact O-CB 3.41Å; L462-V466 WeakPolarHBondContact O-CG2 3.37Å; L462-V466 PolarHBondContact O-N 2.91Å
463	S	88.3	Confident	88	Confident	5 Å²	5	50.2 Å²	50.2	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-62.6	-40	-170.6	70.7	0	0	0	0	114.3	S459 F460 A467	S459-S463 PolarHBondContact O-N 3.46Å; S459-S463 VanDerWaalsContact O-N 3.12Å; F460-S463 WeakPolarHBondContact O-CB 3.48Å; F460-S463 PolarHBondContact O-N 2.92Å; F460-S463 VanDerWaalsContact O-N 3.15Å; F460-S463 PolarHBondContact O-OG 2.92Å; S463-A467 WeakPolarHBondContact O-CB 3.26Å; S463-A467 PolarHBondContact O-N 2.85Å; S463-A467 VanDerWaalsContact O-N 3.11Å
464	E	84.7	Confident	87.8	Confident	66 Å²	66	51.3 Å²	51.3	31%	0.308	31%	0.308	S	S	.	.	H	α-helix	trans	-74	-52	179	168.5	-179.6	-170.4	0	0	111.7	L462 V466 A467 L468	L462-E464 PolarHBondContact O-N 2.77Å; E464-V466 VanDerWaalsContact C-N 3.28Å; E464-V466 PolarHBondContact O-N 2.84Å; E464-A467 WeakPolarHBondContact O-CB 3.39Å; E464-A467 PolarHBondContact O-N 2.73Å; E464-A467 VanDerWaalsContact O-N 3.15Å; E464-L468 HydrophobicContact CG-CD1 4.3Å; E464-L468 WeakPolarHBondContact O-CG 3.4Å; E464-L468 PolarHBondContact O-N 3.01Å
465	P	86.9	Confident	87.5	Confident	61 Å²	61	49.3 Å²	49.3	40%	0.396	30%	0.3	S	S	.	.	H	α-helix	trans	-54.9	-41.7	174.1	-27.2	33.7	0	0	0	113.4	L461 L462 L468 T469	L461-P465 WeakPolarHBondContact O-CD 3.45Å; L461-P465 WeakPolarHBondContact O-CG 3.39Å; L462-P465 WeakPolarHBondContact O-CD 3.48Å; P465-L468 PolarHBondContact O-N 3.48Å; P465-T469 WeakPolarHBondContact O-CG2 3.46Å; P465-T469 PolarHBondContact O-N 3.17Å
466	V	85.9	Confident	87.2	Confident	33 Å²	33	51.1 Å²	51.1	20%	0.2	30%	0.304	C	S	.	.	H	α-helix	trans	-67.5	-39.7	179.3	173.3	0	0	0	0	111.1	L462 E464 L468 T469 G474	L462-V466 VanDerWaalsContact O-CB 3.29Å; L462-V466 WeakPolarHBondContact O-CB 3.41Å; L462-V466 WeakPolarHBondContact O-CG2 3.37Å; L462-V466 PolarHBondContact O-N 2.91Å; E464-V466 VanDerWaalsContact C-N 3.28Å; E464-V466 PolarHBondContact O-N 2.84Å; V466-L468 VanDerWaalsContact C-N 3.28Å; V466-L468 PolarHBondContact O-N 3.47Å; V466-T469 PolarHBondContact O-N 3.43Å; V466-T469 PolarHBondContact O-OG1 3.21Å; V466-G474 WeakPolarHBondContact CG1-O 3.39Å
467	A	80.4	Confident	87.1	Confident	13 Å²	13	52.9 Å²	52.9	11%	0.107	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-39.1	175	0	0	0	0	0	111.9	S463 E464 T469 G470 S560 C562	S463-A467 WeakPolarHBondContact O-CB 3.26Å; S463-A467 PolarHBondContact O-N 2.85Å; S463-A467 VanDerWaalsContact O-N 3.11Å; E464-A467 WeakPolarHBondContact O-CB 3.39Å; E464-A467 PolarHBondContact O-N 2.73Å; E464-A467 VanDerWaalsContact O-N 3.15Å; A467-T469 VanDerWaalsContact C-N 3.27Å; A467-T469 PolarHBondContact O-N 3.11Å; A467-G470 PolarHBondContact O-N 3.01Å; A467-S560 WeakPolarHBondContact CB-O 3.49Å; A467-S560 VanDerWaalsContact CB-OG 3.28Å; A467-S560 WeakPolarHBondContact CB-OG 3.26Å; A467-C562 VanDerWaalsContact CB-SG 3.6Å
468	L	78.1	Confident	87	Confident	109 Å²	109	53 Å²	53	57%	0.571	32%	0.324	S	S	*	.	H	α-helix	trans	-66.7	-23.9	177.3	-69.3	170.1	0	0	0	113.7	E464 P465 V466 G470	E464-L468 HydrophobicContact CG-CD1 4.3Å; E464-L468 WeakPolarHBondContact O-CG 3.4Å; E464-L468 PolarHBondContact O-N 3.01Å; P465-L468 PolarHBondContact O-N 3.48Å; V466-L468 VanDerWaalsContact C-N 3.28Å; V466-L468 PolarHBondContact O-N 3.47Å; L468-G470 PolarHBondContact O-N 3.38Å
469	T	81.8	Confident	86.9	Confident	101 Å²	101	51.1 Å²	51.1	62%	0.62	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-16	176	66.5	0	0	0	0	113.9	P465 V466 A467 S471	P465-T469 WeakPolarHBondContact O-CG2 3.46Å; P465-T469 PolarHBondContact O-N 3.17Å; V466-T469 PolarHBondContact O-N 3.43Å; V466-T469 PolarHBondContact O-OG1 3.21Å; A467-T469 VanDerWaalsContact C-N 3.27Å; A467-T469 PolarHBondContact O-N 3.11Å; T469-S471 PolarHBondContact O-N 3.07Å
470	G	74.6	Confident	87	Confident	65 Å²	65	53.5 Å²	53.5	67%	0.67	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	4.8	-178.9	0	0	0	0	0	115.1	A467 L468 E472	A467-G470 PolarHBondContact O-N 3.01Å; L468-G470 PolarHBondContact O-N 3.38Å; G470-E472 PolarHBondContact O-N 3.48Å
471	S	81.8	Confident	87.1	Confident	56 Å²	56	53.5 Å²	53.5	39%	0.392	32%	0.324	S	S	.	.			trans	-79.1	110.9	176	177.6	0	0	0	0	111	T469 A473 G474 C475	T469-S471 PolarHBondContact O-N 3.07Å; S471-A473 VanDerWaalsContact C-N 3.32Å; S471-A473 PolarHBondContact O-N 3.17Å; S471-G474 PolarHBondContact O-N 3.27Å; S471-G474 PolarHBondContact OG-N 2.6Å; S471-G474 VanDerWaalsContact OG-N 3.14Å; S471-C475 WeakPolarHBondContact O-CB 3.45Å; S471-C475 PolarHBondContact O-N 3.26Å
472	E	82.4	Confident	87.2	Confident	136 Å²	136	52.7 Å²	52.7	64%	0.636	32%	0.32	S	S	*	.	H	α-helix	trans	-58.1	-43.8	176.2	-68.3	-173.2	174.2	0	0	112.1	G470 C475 R476	G470-E472 PolarHBondContact O-N 3.48Å; E472-C475 PolarHBondContact O-N 3.05Å; E472-R476 WeakPolarHBondContact O-CB 3.4Å; E472-R476 WeakPolarHBondContact O-CG 3.27Å; E472-R476 PolarHBondContact O-N 3.04Å
473	A	86.1	Confident	87.3	Confident	68 Å²	68	48.7 Å²	48.7	56%	0.562	30%	0.299	S	S	*	.	H	α-helix	trans	-65.8	-41.6	178.9	0	0	0	0	0	111.8	S471 R476 A477	S471-A473 VanDerWaalsContact C-N 3.32Å; S471-A473 PolarHBondContact O-N 3.17Å; A473-R476 PolarHBondContact O-N 3.08Å; A473-A477 WeakPolarHBondContact O-CB 3.4Å; A473-A477 PolarHBondContact O-N 3.05Å
474	G	88	Confident	87.7	Confident	25 Å²	25	50.2 Å²	50.2	26%	0.258	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-44.5	175.2	0	0	0	0	0	111.6	V466 S471 A477 S478	V466-G474 WeakPolarHBondContact CG1-O 3.39Å; S471-G474 PolarHBondContact O-N 3.27Å; S471-G474 PolarHBondContact OG-N 2.6Å; S471-G474 VanDerWaalsContact OG-N 3.14Å; G474-A477 PolarHBondContact O-N 2.8Å; G474-S478 WeakPolarHBondContact O-CB 3.1Å; G474-S478 PolarHBondContact O-N 2.96Å
475	C	88.4	Confident	88.2	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.02	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-43.8	179.3	-168.7	0	0	0	0	112.4	S471 E472 A477 S478 A479 C562	S471-C475 WeakPolarHBondContact O-CB 3.45Å; S471-C475 PolarHBondContact O-N 3.26Å; E472-C475 PolarHBondContact O-N 3.05Å; C475-A477 PolarHBondContact O-N 3.49Å; C475-S478 PolarHBondContact O-N 2.97Å; C475-A479 WeakPolarHBondContact O-CB 3.45Å; C475-A479 PolarHBondContact O-N 2.91Å; C475-C562 WeakPolarHBondContact CA-SG 3.49Å; C475-C562 HydrophobicContact CB-CB 4.12Å; C475-C562 WeakPolarHBondContact CB-SG 3.45Å; C475-C562 WeakPolarHBondContact O-CB 3.33Å; C475-C562 VanDerWaalsContact SG-CA 3.52Å; C475-C562 WeakPolarHBondContact SG-CB 3.18Å; C475-C562 CovalentContact SG-SG 2.03Å; C475-C562 PolarHBondContact SG-SG 3.19Å
476	R	90.1	Very high	88.5	Confident	73 Å²	73	45.2 Å²	45.2	28%	0.275	28%	0.277	S	S	.	.	H	α-helix	trans	-57.1	-48.4	172.6	-77.3	176.6	179.5	145.7	3.1	111.7	E472 A473 S478 A479 I480 D540 Y542	E472-R476 WeakPolarHBondContact O-CB 3.4Å; E472-R476 WeakPolarHBondContact O-CG 3.27Å; E472-R476 PolarHBondContact O-N 3.04Å; A473-R476 PolarHBondContact O-N 3.08Å; R476-S478 PolarHBondContact O-N 2.81Å; R476-A479 PolarHBondContact O-N 3.46Å; R476-I480 WeakPolarHBondContact O-CB 3.42Å; R476-I480 VanDerWaalsContact O-CG1 3.25Å; R476-I480 WeakPolarHBondContact O-CG1 3.07Å; R476-I480 PolarHBondContact O-N 2.93Å; R476-D540 IonicContact CZ-OD1 3.96Å; R476-D540 IonicContact NE-OD1 3.49Å; R476-D540 IonicContact NH2-OD1 3.32Å; R476-D540 PolarHBondContact NH2-OD1 3.27Å; R476-Y542 WeakPolarHBondContact CG-O 3.26Å
477	A	92.2	Very high	88.9	Confident	60 Å²	60	43.7 Å²	43.7	50%	0.496	27%	0.267	S	S	.	.	H	α-helix	trans	-61.8	-43.7	178.7	0	0	0	0	0	112	A473 G474 C475 I480 F481	A473-A477 WeakPolarHBondContact O-CB 3.4Å; A473-A477 PolarHBondContact O-N 3.05Å; G474-A477 PolarHBondContact O-N 2.8Å; C475-A477 PolarHBondContact O-N 3.49Å; A477-I480 PolarHBondContact O-N 2.98Å; A477-F481 WeakPolarHBondContact O-CB 3.36Å; A477-F481 PolarHBondContact O-N 3.47Å
478	S	92.9	Very high	89.6	Confident	11 Å²	11	43.1 Å²	43.1	8%	0.077	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-40.9	176.2	-174	0	0	0	0	112.3	G474 C475 R476 F481 L482	G474-S478 WeakPolarHBondContact O-CB 3.1Å; G474-S478 PolarHBondContact O-N 2.96Å; C475-S478 PolarHBondContact O-N 2.97Å; R476-S478 PolarHBondContact O-N 2.81Å; S478-F481 PolarHBondContact O-N 3.16Å; S478-L482 WeakPolarHBondContact O-CB 3.38Å; S478-L482 PolarHBondContact O-N 3.33Å
479	A	92.6	Very high	90.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-43.4	178.4	0	0	0	0	0	111.8	C475 R476 F481 L482 H483 Y542 C562	C475-A479 WeakPolarHBondContact O-CB 3.45Å; C475-A479 PolarHBondContact O-N 2.91Å; R476-A479 PolarHBondContact O-N 3.46Å; A479-F481 VanDerWaalsContact C-N 3.32Å; A479-F481 PolarHBondContact O-N 3.34Å; A479-L482 PolarHBondContact O-N 3.05Å; A479-H483 WeakPolarHBondContact O-CB 3.34Å; A479-H483 PolarHBondContact O-N 2.76Å; A479-Y542 HydrophobicContact CB-CD1 3.95Å; A479-Y542 HydrophobicContact CB-CG 4.47Å; A479-C562 HydrophobicContact CB-CB 4.15Å
480	I	94.2	Very high	90.8	Very high	49 Å²	49	33.4 Å²	33.4	25%	0.251	21%	0.208	S	C	.	.	H	α-helix	trans	-59.8	-44.8	174.1	-70.5	167.8	0	0	0	110.2	R476 A477 H483 F484 V531 Y542	R476-I480 WeakPolarHBondContact O-CB 3.42Å; R476-I480 VanDerWaalsContact O-CG1 3.25Å; R476-I480 WeakPolarHBondContact O-CG1 3.07Å; R476-I480 PolarHBondContact O-N 2.93Å; A477-I480 PolarHBondContact O-N 2.98Å; I480-H483 PolarHBondContact O-N 2.85Å; I480-F484 WeakPolarHBondContact O-CB 3.27Å; I480-F484 PolarHBondContact O-N 2.96Å; I480-V531 HydrophobicContact CG2-CG1 3.72Å; I480-Y542 HydrophobicContact CD1-CD2 4.22Å; I480-Y542 HydrophobicContact CG1-CD1 4.01Å; I480-Y542 HydrophobicContact CG1-CD2 3.73Å; I480-Y542 HydrophobicContact CG1-CE1 4.19Å; I480-Y542 HydrophobicContact CG1-CE2 3.91Å; I480-Y542 HydrophobicContact CG1-CG 3.78Å
481	F	95.3	Very high	91.6	Very high	73 Å²	73	31.2 Å²	31.2	32%	0.32	18%	0.182	S	C	.	.	H	α-helix	trans	-65.9	-39.5	179.6	-172.5	-119.7	0	0	0	112.6	L455 S459 A477 S478 A479 F484 S485	L455-F481 HydrophobicContact CD2-CZ 4.03Å; S459-F481 WeakPolarHBondContact OG-CD1 3.28Å; S459-F481 WeakPolarHBondContact OG-CE1 2.85Å; A477-F481 WeakPolarHBondContact O-CB 3.36Å; A477-F481 PolarHBondContact O-N 3.47Å; S478-F481 PolarHBondContact O-N 3.16Å; A479-F481 VanDerWaalsContact C-N 3.32Å; A479-F481 PolarHBondContact O-N 3.34Å; F481-F484 HydrophobicContact CD2-CD1 4.37Å; F481-S485 WeakPolarHBondContact O-CB 3.41Å; F481-S485 PolarHBondContact O-N 2.94Å; F481-S485 PolarHBondContact O-OG 2.97Å
482	L	94.4	Very high	92.1	Very high	16 Å²	16	28.5 Å²	28.5	8%	0.084	16%	0.163	C	C	.	.	H	α-helix	trans	-65.1	-45.5	175.1	-156	155.2	0	0	0	111.3	L456 F460 S478 A479 S485 L486 W563	L456-L482 HydrophobicContact CD1-CD2 4.49Å; F460-L482 HydrophobicContact CB-CD1 4.41Å; F460-L482 HydrophobicContact CD2-CD1 4.37Å; S478-L482 WeakPolarHBondContact O-CB 3.38Å; S478-L482 PolarHBondContact O-N 3.33Å; A479-L482 PolarHBondContact O-N 3.05Å; L482-S485 PolarHBondContact O-N 3.01Å; L482-L486 WeakPolarHBondContact O-CB 2.95Å; L482-L486 PolarHBondContact O-N 3.05Å; L482-W563 HydrophobicContact CB-CE3 4.33Å; L482-W563 HydrophobicContact CB-CZ3 4.05Å; L482-W563 HydrophobicContact CD2-CE3 3.6Å; L482-W563 HydrophobicContact CD2-CH2 3.86Å; L482-W563 HydrophobicContact CD2-CZ3 3.08Å; L482-W563 HydrophobicContact CG-CE3 4.35Å; L482-W563 HydrophobicContact CG-CZ3 4.06Å
483	H	94.9	Very high	92.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.4	-46.9	177	-176.7	-151	0	0	0	111.4	A479 I480 S485 L486 L487 Y542 W563 T573 N574	A479-H483 WeakPolarHBondContact O-CB 3.34Å; A479-H483 PolarHBondContact O-N 2.76Å; I480-H483 PolarHBondContact O-N 2.85Å; H483-S485 PolarHBondContact O-N 2.88Å; H483-L486 PolarHBondContact O-N 2.78Å; H483-L487 WeakPolarHBondContact O-CG 3.43Å; H483-L487 PolarHBondContact O-N 2.9Å; H483-Y542 HydrophobicContact CB-CE1 4.21Å; H483-Y542 PolarHBondContact CE1-OH 2.96Å; H483-Y542 AromaticContact ND1-CE1 3.76Å; H483-Y542 AromaticContact ND1-CZ 3.78Å; H483-Y542 PolarHBondContact ND1-OH 3.48Å; H483-W563 HydrophobicContact CB-CH2 4.5Å; H483-W563 HydrophobicContact CB-CZ3 4.22Å; H483-T573 PolarHBondContact NE2-OG1 2.81Å; H483-N574 PolarHBondContact CD2-OD1 3.4Å; H483-N574 PolarHBondContact NE2-OD1 2.79Å
484	F	96	Very high	92.6	Very high	37 Å²	37	19.1 Å²	19.1	16%	0.162	11%	0.109	C	C	.	.	H	α-helix	trans	-58.4	-48.6	175.2	166.3	-113	0	0	0	112.5	I480 F481 L486 L487 T488 W524 P527 I528 V531	I480-F484 WeakPolarHBondContact O-CB 3.27Å; I480-F484 PolarHBondContact O-N 2.96Å; F481-F484 HydrophobicContact CD2-CD1 4.37Å; F484-L486 VanDerWaalsContact C-N 3.31Å; F484-L486 PolarHBondContact O-N 2.65Å; F484-L487 PolarHBondContact O-N 3.47Å; F484-T488 WeakPolarHBondContact CD2-OG1 3.2Å; F484-T488 WeakPolarHBondContact CE2-OG1 2.97Å; F484-T488 VanDerWaalsContact O-CB 3.23Å; F484-T488 WeakPolarHBondContact O-CB 3.35Å; F484-T488 PolarHBondContact O-N 2.93Å; F484-T488 PolarHBondContact O-OG1 3.06Å; F484-W524 AromaticContact CZ-CE3 3.87Å; F484-W524 HydrophobicContact CZ-CE3 3.87Å; F484-W524 HydrophobicContact CZ-CZ3 4.17Å; F484-P527 HydrophobicContact CD2-CB 3.95Å; F484-P527 HydrophobicContact CE2-CB 4.03Å; F484-I528 HydrophobicContact CD2-CG1 4.09Å; F484-I528 HydrophobicContact CE2-CD1 4.27Å; F484-I528 HydrophobicContact CE2-CG1 3.48Å; F484-I528 VanDerWaalsContact CE2-CG1 3.48Å; F484-I528 HydrophobicContact CZ-CG1 4.14Å; F484-V531 HydrophobicContact CB-CG2 4.08Å
485	S	95.3	Very high	92.7	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.5	-37.4	-178.8	-60.4	0	0	0	0	111.9	S459 F481 L482 H483 C489	S459-S485 PolarHBondContact OG-OG 3.48Å; S459-S485 VanDerWaalsContact OG-OG 3.07Å; F481-S485 WeakPolarHBondContact O-CB 3.41Å; F481-S485 PolarHBondContact O-N 2.94Å; F481-S485 PolarHBondContact O-OG 2.97Å; L482-S485 PolarHBondContact O-N 3.01Å; H483-S485 PolarHBondContact O-N 2.88Å; S485-C489 WeakPolarHBondContact O-CB 3.22Å; S485-C489 PolarHBondContact O-N 2.99Å
486	L	93.7	Very high	92.6	Very high	22 Å²	22	19 Å²	19	12%	0.115	10%	0.102	C	C	.	.	H	α-helix	trans	-63.3	-53.3	175.2	179.6	66.8	0	0	0	111.4	L456 L482 H483 F484 T488 C489 L490 W563 W623	L456-L486 HydrophobicContact CD1-CB 3.97Å; L456-L486 HydrophobicContact CD1-CD1 4.26Å; L456-L486 HydrophobicContact CD2-CD1 4.15Å; L482-L486 WeakPolarHBondContact O-CB 2.95Å; L482-L486 PolarHBondContact O-N 3.05Å; H483-L486 PolarHBondContact O-N 2.78Å; F484-L486 VanDerWaalsContact C-N 3.31Å; F484-L486 PolarHBondContact O-N 2.65Å; L486-T488 PolarHBondContact O-N 2.77Å; L486-C489 WeakPolarHBondContact O-CB 3.28Å; L486-C489 PolarHBondContact O-N 3.38Å; L486-C489 VanDerWaalsContact O-N 3.17Å; L486-L490 HydrophobicContact CG-CD1 4.47Å; L486-L490 WeakPolarHBondContact O-CG 3.49Å; L486-L490 PolarHBondContact O-N 3.18Å; L486-W563 HydrophobicContact CD2-CH2 3.77Å; L486-W563 HydrophobicContact CD2-CZ2 4.33Å; L486-W623 HydrophobicContact CD1-CH2 3.83Å; L486-W623 HydrophobicContact CD1-CZ3 4.08Å
487	L	94.5	Very high	92.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.3	-35.5	-179.8	-66.8	-166.4	0	0	0	112.1	H483 F484 L490 S491 P527 L530 V531 L577	H483-L487 WeakPolarHBondContact O-CG 3.43Å; H483-L487 PolarHBondContact O-N 2.9Å; F484-L487 PolarHBondContact O-N 3.47Å; L487-L490 HydrophobicContact CD2-CD1 4.48Å; L487-S491 WeakPolarHBondContact O-CB 3.27Å; L487-S491 PolarHBondContact O-N 2.9Å; L487-S491 PolarHBondContact O-OG 3.2Å; L487-P527 HydrophobicContact CB-CB 3.87Å; L487-P527 HydrophobicContact CB-CG 4.26Å; L487-L530 HydrophobicContact CD1-CB 4.12Å; L487-L530 HydrophobicContact CD1-CD1 4.24Å; L487-V531 HydrophobicContact CD1-CG2 4.09Å; L487-L577 HydrophobicContact CD1-CD1 4.01Å; L487-L577 HydrophobicContact CD2-CD1 3.57Å; L487-L577 HydrophobicContact CG-CD1 4.27Å
488	T	95	Very high	92	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-66.2	-44.8	175.1	-60.4	0	0	0	0	111.7	A452 F484 L486 S491 W492 W524 P527	A452-T488 HydrophobicContact CB-CG2 3.91Å; F484-T488 WeakPolarHBondContact CD2-OG1 3.2Å; F484-T488 WeakPolarHBondContact CE2-OG1 2.97Å; F484-T488 VanDerWaalsContact O-CB 3.23Å; F484-T488 WeakPolarHBondContact O-CB 3.35Å; F484-T488 PolarHBondContact O-N 2.93Å; F484-T488 PolarHBondContact O-OG1 3.06Å; L486-T488 PolarHBondContact O-N 2.77Å; T488-S491 PolarHBondContact O-N 2.83Å; T488-W492 VanDerWaalsContact O-CD1 3.3Å; T488-W492 PolarHBondContact O-N 2.94Å; T488-W524 HydrophobicContact CG2-CD2 4Å; T488-W524 HydrophobicContact CG2-CE3 3.42Å; T488-W524 VanDerWaalsContact CG2-CE3 3.42Å; T488-W524 HydrophobicContact CG2-CH2 3.98Å; T488-W524 HydrophobicContact CG2-CZ2 4.49Å; T488-W524 HydrophobicContact CG2-CZ3 3.44Å; T488-W524 VanDerWaalsContact CG2-CZ3 3.44Å; T488-P527 WeakPolarHBondContact OG1-CB 2.95Å
489	C	92.4	Very high	91.6	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.2	-51	174.4	-172.1	0	0	0	0	110.5	A452 L456 S485 L486 S491 W492 M493	A452-C489 HydrophobicContact CB-CB 4.4Å; L456-C489 HydrophobicContact CD2-CB 4.01Å; S485-C489 WeakPolarHBondContact O-CB 3.22Å; S485-C489 PolarHBondContact O-N 2.99Å; L486-C489 WeakPolarHBondContact O-CB 3.28Å; L486-C489 PolarHBondContact O-N 3.38Å; L486-C489 VanDerWaalsContact O-N 3.17Å; C489-S491 VanDerWaalsContact C-N 3.34Å; C489-S491 PolarHBondContact O-N 2.87Å; C489-W492 PolarHBondContact O-N 2.77Å; C489-M493 WeakPolarHBondContact O-CG 3.45Å; C489-M493 PolarHBondContact O-N 3.35Å
490	L	91.5	Very high	90.9	Very high	7 Å²	7	17 Å²	17	4%	0.037	8%	0.084	C	C	.	.	H	α-helix	trans	-58.5	-43.1	177.3	-67.5	177.5	0	0	0	112.7	L486 L487 M493 G494 F578	L486-L490 HydrophobicContact CG-CD1 4.47Å; L486-L490 WeakPolarHBondContact O-CG 3.49Å; L486-L490 PolarHBondContact O-N 3.18Å; L487-L490 HydrophobicContact CD2-CD1 4.48Å; L490-M493 HydrophobicContact CD2-SD 4.31Å; L490-M493 PolarHBondContact O-N 3.42Å; L490-G494 PolarHBondContact O-N 2.84Å; L490-F578 HydrophobicContact CD1-CB 4.21Å; L490-F578 HydrophobicContact CD2-CD2 3.89Å
491	S	92.2	Very high	90.3	Very high	18 Å²	18	17.8 Å²	17.8	13%	0.126	8%	0.084	C	C	.	.	H	α-helix	trans	-62.7	-46	178	-60.8	0	0	0	0	111.2	L487 T488 C489 M493 G494 L495 P527	L487-S491 WeakPolarHBondContact O-CB 3.27Å; L487-S491 PolarHBondContact O-N 2.9Å; L487-S491 PolarHBondContact O-OG 3.2Å; T488-S491 PolarHBondContact O-N 2.83Å; C489-S491 VanDerWaalsContact C-N 3.34Å; C489-S491 PolarHBondContact O-N 2.87Å; S491-M493 VanDerWaalsContact C-N 3.35Å; S491-M493 PolarHBondContact O-N 2.96Å; S491-G494 PolarHBondContact O-N 2.8Å; S491-L495 WeakPolarHBondContact O-CG 3.29Å; S491-L495 PolarHBondContact O-N 3.24Å; S491-P527 WeakPolarHBondContact OG-CG 3.43Å
492	W	92.3	Very high	89.6	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-66.9	-32.9	176.3	-82.5	106.1	0	0	0	113.3	V445 N448 L449 T488 C489 L495 E496 L519 W524	V445-W492 HydrophobicContact CG1-CE3 4.21Å; V445-W492 HydrophobicContact CG1-CZ3 4.1Å; N448-W492 HydrophobicContact CB-CD2 3.81Å; N448-W492 HydrophobicContact CB-CE3 3.82Å; N448-W492 HydrophobicContact CB-CH2 3.65Å; N448-W492 HydrophobicContact CB-CZ2 3.59Å; N448-W492 HydrophobicContact CB-CZ3 3.75Å; N448-W492 WeakPolarHBondContact ND2-CH2 3.12Å; L449-W492 HydrophobicContact CB-CB 4.19Å; L449-W492 HydrophobicContact CD1-CB 3.75Å; T488-W492 VanDerWaalsContact O-CD1 3.3Å; T488-W492 PolarHBondContact O-N 2.94Å; C489-W492 PolarHBondContact O-N 2.77Å; W492-L495 HydrophobicContact CD2-CD1 4.47Å; W492-L495 HydrophobicContact CE3-CB 4.31Å; W492-L495 HydrophobicContact CE3-CD1 4.17Å; W492-L495 HydrophobicContact CZ3-CD1 4.22Å; W492-L495 PolarHBondContact O-N 2.92Å; W492-E496 WeakPolarHBondContact O-CB 3.4Å; W492-E496 PolarHBondContact O-N 3.09Å; W492-L519 HydrophobicContact CH2-CB 4.44Å; W492-W524 AromaticContact CE2-CD1 3.98Å; W492-W524 AromaticContact CE2-NE1 3.56Å; W492-W524 AromaticContact CZ2-CD1 3.6Å; W492-W524 AromaticContact CZ2-NE1 3.3Å; W492-W524 VanDerWaalsContact CZ2-NE1 3.3Å; W492-W524 AromaticContact NE1-CD1 3.72Å; W492-W524 AromaticContact NE1-CD2 3.83Å; W492-W524 AromaticContact NE1-CE2 3.37Å; W492-W524 AromaticContact NE1-CZ2 3.79Å; W492-W524 AromaticContact NE1-NE1 3.32Å
493	M	89.2	Confident	88.7	Confident	2 Å²	2	19 Å²	19	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-62.4	-44	173.4	-69.4	166.6	85.3	0	0	111.1	L449 C489 L490 S491 E496 G497 L619 W623 Q650	L449-M493 HydrophobicContact CD1-CG 3.63Å; C489-M493 WeakPolarHBondContact O-CG 3.45Å; C489-M493 PolarHBondContact O-N 3.35Å; L490-M493 HydrophobicContact CD2-SD 4.31Å; L490-M493 PolarHBondContact O-N 3.42Å; S491-M493 VanDerWaalsContact C-N 3.35Å; S491-M493 PolarHBondContact O-N 2.96Å; M493-E496 PolarHBondContact O-N 2.94Å; M493-G497 PolarHBondContact O-N 2.94Å; M493-G497 VanDerWaalsContact O-N 3.08Å; M493-L619 VanDerWaalsContact CE-C 3.49Å; M493-L619 WeakPolarHBondContact CE-O 3.32Å; M493-L619 HydrophobicContact CG-CD2 4.48Å; M493-W623 VanDerWaalsContact CE-CD1 3.48Å; M493-W623 HydrophobicContact CE-CG 4.46Å; M493-Q650 VanDerWaalsContact CE-NE2 3.29Å
494	G	89.3	Confident	87.7	Confident	5 Å²	5	20.7 Å²	20.7	5%	0.052	10%	0.101	C	C	.	.	H	α-helix	trans	-63.1	-43	173.3	0	0	0	0	0	112.9	L490 S491 E496 G497 Y498	L490-G494 PolarHBondContact O-N 2.84Å; S491-G494 PolarHBondContact O-N 2.8Å; G494-E496 PolarHBondContact O-N 2.76Å; G494-G497 PolarHBondContact O-N 3.44Å; G494-Y498 PolarHBondContact O-N 2.8Å
495	L	90.2	Very high	86.6	Confident	23 Å²	23	20.4 Å²	20.4	12%	0.12	10%	0.102	C	C	.	.	H	α-helix	trans	-67.6	-33.8	177.9	-67.6	-178.3	0	0	0	113	S491 W492 Y498 N499 L519 M522	S491-L495 WeakPolarHBondContact O-CG 3.29Å; S491-L495 PolarHBondContact O-N 3.24Å; W492-L495 HydrophobicContact CD2-CD1 4.47Å; W492-L495 HydrophobicContact CE3-CB 4.31Å; W492-L495 HydrophobicContact CE3-CD1 4.17Å; W492-L495 HydrophobicContact CZ3-CD1 4.22Å; W492-L495 PolarHBondContact O-N 2.92Å; L495-Y498 PolarHBondContact O-N 2.9Å; L495-N499 WeakPolarHBondContact O-CB 3.45Å; L495-N499 PolarHBondContact O-N 2.99Å; L495-L519 HydrophobicContact CB-CD2 4.46Å; L495-L519 HydrophobicContact CD1-CB 4.4Å; L495-L519 HydrophobicContact CD1-CD2 4.23Å; L495-L519 VanDerWaalsContact CD1-O 3.28Å; L495-L519 WeakPolarHBondContact CD1-O 3.33Å; L495-L519 HydrophobicContact CD2-CD2 3.73Å; L495-L519 HydrophobicContact CG-CD2 4.34Å; L495-M522 HydrophobicContact CD1-CB 4.4Å; L495-M522 HydrophobicContact CD2-CG 4.36Å
496	E	86	Confident	85.4	Confident	3 Å²	3	23.5 Å²	23.5	1%	0.014	12%	0.117	C	C	.	.	H	α-helix	trans	-66.3	-44.6	173.2	-176.6	157.6	168.4	0	0	111	V445 H446 L449 W492 M493 G494 Y498 N499 L500 L619	V445-E496 HydrophobicContact CG1-CB 4.21Å; H446-E496 IonicContact CE1-OE1 2.81Å; H446-E496 PolarHBondContact CE1-OE1 3.13Å; H446-E496 IonicContact CG-OE1 3.5Å; H446-E496 IonicContact ND1-OE1 2.86Å; H446-E496 PolarHBondContact ND1-OE1 3.37Å; H446-E496 IonicContact ND1-OE2 2.74Å; H446-E496 PolarHBondContact ND1-OE2 2.88Å; L449-E496 WeakPolarHBondContact CD2-OE2 3.06Å; W492-E496 WeakPolarHBondContact O-CB 3.4Å; W492-E496 PolarHBondContact O-N 3.09Å; M493-E496 PolarHBondContact O-N 2.94Å; G494-E496 PolarHBondContact O-N 2.76Å; E496-Y498 VanDerWaalsContact C-N 3.3Å; E496-Y498 PolarHBondContact O-N 2.9Å; E496-N499 PolarHBondContact O-N 3.1Å; E496-N499 VanDerWaalsContact O-N 3.16Å; E496-L500 HydrophobicContact CG-CD1 4.18Å; E496-L500 VanDerWaalsContact O-CG 3.3Å; E496-L500 WeakPolarHBondContact O-CG 3.28Å; E496-L500 PolarHBondContact O-N 3.25Å; E496-L619 HydrophobicContact CB-CD1 4.25Å; E496-L619 HydrophobicContact CG-CD1 3.68Å
497	G	85	Confident	83.8	Confident	6 Å²	6	28.8 Å²	28.8	6%	0.062	15%	0.15	C	C	.	.	H	α-helix	trans	-54.4	-45.6	171.8	0	0	0	0	0	112.3	M493 G494 L500 Y501 M588	M493-G497 PolarHBondContact O-N 2.94Å; M493-G497 VanDerWaalsContact O-N 3.08Å; G494-G497 PolarHBondContact O-N 3.44Å; G497-L500 PolarHBondContact O-N 3.46Å; G497-Y501 PolarHBondContact O-N 2.88Å; G497-M588 VanDerWaalsContact C-CE 3.46Å; G497-M588 VanDerWaalsContact C-SD 3.52Å
498	Y	85.8	Confident	81.7	Confident	79 Å²	79	36.6 Å²	36.6	31%	0.31	18%	0.184	S	C	.	.	H	α-helix	trans	-64.3	-42.1	176.4	179.5	-109.6	0	0	0	112.9	G494 L495 E496 L500 Y501 R502 Y515 F584 M588	G494-Y498 PolarHBondContact O-N 2.8Å; L495-Y498 PolarHBondContact O-N 2.9Å; E496-Y498 VanDerWaalsContact C-N 3.3Å; E496-Y498 PolarHBondContact O-N 2.9Å; Y498-L500 VanDerWaalsContact C-N 3.3Å; Y498-L500 PolarHBondContact O-N 2.78Å; Y498-Y501 WeakPolarHBondContact O-CB 3.33Å; Y498-Y501 PolarHBondContact O-N 2.86Å; Y498-R502 HydrophobicContact CE1-CG 4.15Å; Y498-R502 HydrophobicContact CE2-CG 4.21Å; Y498-R502 PolarHBondContact O-N 3.41Å; Y498-Y515 HydrophobicContact CE1-CE2 4.42Å; Y498-F584 HydrophobicContact CD2-CZ 4.08Å; Y498-F584 HydrophobicContact CG-CZ 4.45Å; Y498-M588 WeakPolarHBondContact CA-SD 3.14Å; Y498-M588 HydrophobicContact CD2-SD 4.35Å; Y498-M588 PolarHBondContact N-SD 3.46Å
499	N	82.7	Confident	79.7	Confident	10 Å²	10	40 Å²	40	5%	0.053	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-36.5	177.4	-176.2	74	0	0	0	112	T442 V445 L495 E496 L503 Y515	T442-N499 WeakPolarHBondContact CA-ND2 3.39Å; T442-N499 PolarHBondContact OG1-ND2 3.29Å; T442-N499 VanDerWaalsContact OG1-ND2 3.13Å; V445-N499 HydrophobicContact CG1-CB 4.39Å; L495-N499 WeakPolarHBondContact O-CB 3.45Å; L495-N499 PolarHBondContact O-N 2.99Å; E496-N499 PolarHBondContact O-N 3.1Å; E496-N499 VanDerWaalsContact O-N 3.16Å; N499-L503 WeakPolarHBondContact O-CB 3.22Å; N499-L503 PolarHBondContact O-N 3.47Å; N499-Y515 PolarHBondContact OD1-OH 2.83Å
500	L	79.5	Confident	78.1	Confident	6 Å²	6	44 Å²	44	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-68.7	-41.3	174.3	-67.7	166.6	0	0	0	112.1	E496 G497 Y498 R502 L503 V504 M592 L612 L615	E496-L500 HydrophobicContact CG-CD1 4.18Å; E496-L500 VanDerWaalsContact O-CG 3.3Å; E496-L500 WeakPolarHBondContact O-CG 3.28Å; E496-L500 PolarHBondContact O-N 3.25Å; G497-L500 PolarHBondContact O-N 3.46Å; Y498-L500 VanDerWaalsContact C-N 3.3Å; Y498-L500 PolarHBondContact O-N 2.78Å; L500-R502 PolarHBondContact O-N 3.5Å; L500-L503 WeakPolarHBondContact O-CB 3.48Å; L500-L503 PolarHBondContact O-N 3.42Å; L500-V504 WeakPolarHBondContact O-CG2 3.47Å; L500-V504 PolarHBondContact O-N 3.46Å; L500-V504 VanDerWaalsContact O-N 3.09Å; L500-M592 HydrophobicContact CB-CE 3.86Å; L500-M592 HydrophobicContact CB-SD 4.21Å; L500-L612 HydrophobicContact CD2-CD1 4.28Å; L500-L615 HydrophobicContact CD1-CD2 3.32Å; L500-L615 HydrophobicContact CD2-CD2 4.23Å; L500-L615 HydrophobicContact CG-CD2 4.37Å
501	Y	81.4	Confident	76.7	Confident	66 Å²	66	52.2 Å²	52.2	26%	0.259	28%	0.275	S	S	.	.	H	α-helix	trans	-56.8	-49.8	173.8	168.4	-95.2	0	0	0	111.1	G497 Y498 L503 V504 V505 T591 M592	G497-Y501 PolarHBondContact O-N 2.88Å; Y498-Y501 WeakPolarHBondContact O-CB 3.33Å; Y498-Y501 PolarHBondContact O-N 2.86Å; Y501-L503 VanDerWaalsContact C-N 3.31Å; Y501-L503 PolarHBondContact O-N 3.5Å; Y501-V504 PolarHBondContact O-N 2.87Å; Y501-V505 HydrophobicContact CD2-CB 4.15Å; Y501-V505 HydrophobicContact CD2-CG2 3.69Å; Y501-V505 HydrophobicContact CE1-CB 4.49Å; Y501-V505 HydrophobicContact CE2-CB 3.79Å; Y501-V505 HydrophobicContact CE2-CG1 3.93Å; Y501-V505 HydrophobicContact CE2-CG2 3.59Å; Y501-V505 HydrophobicContact CG-CG2 4.48Å; Y501-V505 WeakPolarHBondContact O-CB 3.17Å; Y501-V505 PolarHBondContact O-N 3.41Å; Y501-T591 WeakPolarHBondContact CD2-OG1 3.33Å; Y501-T591 VanDerWaalsContact CE2-OG1 3.27Å; Y501-T591 WeakPolarHBondContact CE2-OG1 3.36Å; Y501-M592 HydrophobicContact CD2-CG 4.32Å
502	R	79.4	Confident	75.5	Confident	34 Å²	34	53.6 Å²	53.6	13%	0.128	28%	0.283	C	S	.	.	H	α-helix	trans	-60.1	-40.6	176.6	-70.3	-166.2	70.3	-154.4	-5.8	112.1	Y498 L500 V504 E506 T510 Y515	Y498-R502 HydrophobicContact CE1-CG 4.15Å; Y498-R502 HydrophobicContact CE2-CG 4.21Å; Y498-R502 PolarHBondContact O-N 3.41Å; L500-R502 PolarHBondContact O-N 3.5Å; R502-V504 VanDerWaalsContact C-N 3.28Å; R502-V504 PolarHBondContact O-N 3.1Å; R502-E506 IonicContact CZ-OE2 3.75Å; R502-E506 VanDerWaalsContact CZ-OE2 3.23Å; R502-E506 IonicContact NE-OE1 3.23Å; R502-E506 PolarHBondContact NE-OE1 2.97Å; R502-E506 IonicContact NE-OE2 3.29Å; R502-E506 PolarHBondContact NE-OE2 2.81Å; R502-E506 IonicContact NH2-OE2 2.76Å; R502-E506 PolarHBondContact NH2-OE2 2.76Å; R502-E506 WeakPolarHBondContact O-CB 3.49Å; R502-E506 PolarHBondContact O-N 2.91Å; R502-E506 VanDerWaalsContact O-N 3.15Å; R502-E506 VanDerWaalsContact O-O 3.11Å; R502-T510 PolarHBondContact NH2-O 2.97Å; R502-T510 PolarHBondContact NH2-OG1 2.85Å; R502-Y515 VanDerWaalsContact NH1-CE2 3.31Å
503	L	76.1	Confident	74.4	Confident	80 Å²	80	57.7 Å²	57.7	42%	0.419	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-34.3	178.6	-177.7	67.5	0	0	0	113.1	N499 L500 Y501 F508	N499-L503 WeakPolarHBondContact O-CB 3.22Å; N499-L503 PolarHBondContact O-N 3.47Å; L500-L503 WeakPolarHBondContact O-CB 3.48Å; L500-L503 PolarHBondContact O-N 3.42Å; Y501-L503 VanDerWaalsContact C-N 3.31Å; Y501-L503 PolarHBondContact O-N 3.5Å; L503-F508 HydrophobicContact CD1-CE1 4.44Å
504	V	73.6	Confident	73.8	Confident	35 Å²	35	59.6 Å²	59.6	21%	0.212	33%	0.33	C	S	.	.	H	α-helix	trans	-91.8	-43.6	-176.1	174.8	0	0	0	0	112.6	L500 Y501 R502 M592 I596 L612	L500-V504 WeakPolarHBondContact O-CG2 3.47Å; L500-V504 PolarHBondContact O-N 3.46Å; L500-V504 VanDerWaalsContact O-N 3.09Å; Y501-V504 PolarHBondContact O-N 2.87Å; R502-V504 VanDerWaalsContact C-N 3.28Å; R502-V504 PolarHBondContact O-N 3.1Å; V504-M592 HydrophobicContact CB-CG 4.36Å; V504-M592 HydrophobicContact CG2-CE 3.91Å; V504-I596 HydrophobicContact CG1-CD1 4.2Å; V504-I596 HydrophobicContact CG1-CG1 3.86Å; V504-L612 HydrophobicContact CG2-CD2 3.49Å; V504-L612 VanDerWaalsContact CG2-CD2 3.49Å
505	V	72.8	Confident	73.4	Confident	32 Å²	32	60.5 Å²	60.5	19%	0.194	33%	0.332	C	S	.	.	H	α-helix	trans	-99.4	-41.3	-167.6	-176.1	0	0	0	0	112.1	Y501 V507 M592 Q595	Y501-V505 HydrophobicContact CD2-CB 4.15Å; Y501-V505 HydrophobicContact CD2-CG2 3.69Å; Y501-V505 HydrophobicContact CE1-CB 4.49Å; Y501-V505 HydrophobicContact CE2-CB 3.79Å; Y501-V505 HydrophobicContact CE2-CG1 3.93Å; Y501-V505 HydrophobicContact CE2-CG2 3.59Å; Y501-V505 HydrophobicContact CG-CG2 4.48Å; Y501-V505 WeakPolarHBondContact O-CB 3.17Å; Y501-V505 PolarHBondContact O-N 3.41Å; V505-V507 PolarHBondContact O-N 2.79Å; V505-V507 VanDerWaalsContact O-N 3.14Å; V505-M592 HydrophobicContact CG2-CG 4.43Å; V505-Q595 HydrophobicContact CG1-CG 4.17Å; V505-Q595 HydrophobicContact CG2-CB 4.27Å; V505-Q595 HydrophobicContact CG2-CG 3.94Å
506	E	71.8	Confident	72.8	Confident	65 Å²	65	61.3 Å²	61.3	30%	0.304	34%	0.336	S	S	.	.	S	Bend	trans	-79	100.6	174.1	-71.5	-176.1	-162.3	0	0	109.3	R502 F508 T510	R502-E506 IonicContact CZ-OE2 3.75Å; R502-E506 VanDerWaalsContact CZ-OE2 3.23Å; R502-E506 IonicContact NE-OE1 3.23Å; R502-E506 PolarHBondContact NE-OE1 2.97Å; R502-E506 IonicContact NE-OE2 3.29Å; R502-E506 PolarHBondContact NE-OE2 2.81Å; R502-E506 IonicContact NH2-OE2 2.76Å; R502-E506 PolarHBondContact NH2-OE2 2.76Å; R502-E506 WeakPolarHBondContact O-CB 3.49Å; R502-E506 PolarHBondContact O-N 2.91Å; R502-E506 VanDerWaalsContact O-N 3.15Å; R502-E506 VanDerWaalsContact O-O 3.11Å; E506-F508 PolarHBondContact O-N 2.87Å; E506-F508 VanDerWaalsContact O-N 3.09Å; E506-T510 PolarHBondContact OE2-OG1 2.94Å; E506-T510 VanDerWaalsContact OE2-OG1 3.06Å
507	V	59.7	Low	72.7	Confident	133 Å²	133	67.2 Å²	67.2	81%	0.806	37%	0.367	S	S	*	.			trans	-53.5	117.9	171.8	-174.8	0	0	0	0	108.7	V505 G509	V505-V507 PolarHBondContact O-N 2.79Å; V505-V507 VanDerWaalsContact O-N 3.14Å; V507-G509 PolarHBondContact O-N 2.66Å
508	F	49.9	Very low	72.9	Confident	164 Å²	164	73.2 Å²	73.2	72%	0.719	39%	0.391	S	S	*	.	S	Bend	trans	-25.1	103.5	-177.9	-59.3	-86.3	0	0	0	114.4	L503 E506	L503-F508 HydrophobicContact CD1-CE1 4.44Å; E506-F508 PolarHBondContact O-N 2.87Å; E506-F508 VanDerWaalsContact O-N 3.09Å
509	G	53.7	Low	73	Confident	71 Å²	71	70 Å²	70	73%	0.732	38%	0.38	S	S	*	.			trans	-172.8	-25.8	177	0	0	0	0	0	118.1	V507 Y511	V507-G509 PolarHBondContact O-N 2.66Å; G509-Y511 PolarHBondContact O-N 3.11Å
510	T	58.4	Low	73.3	Confident	85 Å²	85	71.2 Å²	71.2	52%	0.521	39%	0.389	S	S	.	.			trans	-91.3	89.7	-176.7	45.4	0	0	0	0	111.1	R502 E506 V512	R502-T510 PolarHBondContact NH2-O 2.97Å; R502-T510 PolarHBondContact NH2-OG1 2.85Å; E506-T510 PolarHBondContact OE2-OG1 2.94Å; E506-T510 VanDerWaalsContact OE2-OG1 3.06Å; T510-V512 PolarHBondContact O-N 3.17Å; T510-V512 VanDerWaalsContact O-N 3.16Å
511	Y	60.9	Low	73.8	Confident	179 Å²	179	73.9 Å²	73.9	70%	0.702	41%	0.412	S	S	*	.			trans	-68.9	105.8	166.4	179.1	-97.2	0	0	0	109	G509 P513	G509-Y511 PolarHBondContact O-N 3.11Å; Y511-P513 HydrophobicContact CE1-CB 4.05Å; Y511-P513 WeakPolarHBondContact O-CD 3.24Å
512	V	67.2	Low	74.3	Confident	48 Å²	48	76 Å²	76	29%	0.291	43%	0.425	S	S	.	.			trans	-92	112.5	171.1	-178.7	0	0	0	0	107.8	T510 G514 Y515	T510-V512 PolarHBondContact O-N 3.17Å; T510-V512 VanDerWaalsContact O-N 3.16Å; V512-G514 PolarHBondContact O-N 3.04Å; V512-Y515 HydrophobicContact CB-CD2 4.38Å; V512-Y515 WeakPolarHBondContact O-CB 3.41Å; V512-Y515 PolarHBondContact O-N 3.33Å
513	P	70.1	Confident	74.9	Confident	85 Å²	85	74.3 Å²	74.3	55%	0.552	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	135.9	175.7	25.5	-32.9	0	0	0	109.7	Y511 Y515	Y511-P513 HydrophobicContact CE1-CB 4.05Å; Y511-P513 WeakPolarHBondContact O-CD 3.24Å; P513-Y515 VanDerWaalsContact C-N 3.28Å; P513-Y515 PolarHBondContact O-N 2.96Å
514	G	75.7	Confident	75.8	Confident	43 Å²	43	73 Å²	73	44%	0.443	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	22.1	-179.5	0	0	0	0	0	115.2	V512 L516 L517 K518	V512-G514 PolarHBondContact O-N 3.04Å; G514-L516 PolarHBondContact O-N 3.18Å; G514-L517 WeakPolarHBondContact O-CB 3.43Å; G514-L517 PolarHBondContact O-N 2.8Å; G514-K518 PolarHBondContact O-N 2.75Å
515	Y	81.1	Confident	76.8	Confident	23 Å²	23	72.8 Å²	72.8	9%	0.09	41%	0.413	C	S	.	.	H	α-helix	trans	-48.9	-49.5	-178	179.3	-116.9	0	0	0	114	Y441 Y498 N499 R502 V512 P513 L517 K518 L519	Y441-Y515 HydrophobicContact CD1-CD1 4.31Å; Y498-Y515 HydrophobicContact CE1-CE2 4.42Å; N499-Y515 PolarHBondContact OD1-OH 2.83Å; R502-Y515 VanDerWaalsContact NH1-CE2 3.31Å; V512-Y515 HydrophobicContact CB-CD2 4.38Å; V512-Y515 WeakPolarHBondContact O-CB 3.41Å; V512-Y515 PolarHBondContact O-N 3.33Å; P513-Y515 VanDerWaalsContact C-N 3.28Å; P513-Y515 PolarHBondContact O-N 2.96Å; Y515-L517 VanDerWaalsContact C-N 3.33Å; Y515-L517 PolarHBondContact O-N 2.89Å; Y515-K518 PolarHBondContact O-N 2.71Å; Y515-L519 HydrophobicContact CD1-CD1 3.98Å; Y515-L519 HydrophobicContact CD2-CG 4.39Å; Y515-L519 HydrophobicContact CE1-CD1 3.42Å; Y515-L519 VanDerWaalsContact CE1-CD1 3.42Å; Y515-L519 HydrophobicContact CE1-CG 4.27Å; Y515-L519 HydrophobicContact CE2-CD1 4.02Å; Y515-L519 HydrophobicContact CE2-CD2 4.25Å; Y515-L519 HydrophobicContact CE2-CG 4.05Å; Y515-L519 VanDerWaalsContact CZ-CD1 3.45Å; Y515-L519 WeakPolarHBondContact O-CG 3.47Å; Y515-L519 PolarHBondContact O-N 3.46Å
516	L	78.8	Confident	77.8	Confident	41 Å²	41	74.8 Å²	74.8	22%	0.215	42%	0.42	C	S	.	.	H	α-helix	trans	-64.6	-36	178.2	-72.6	173.2	0	0	0	113.1	Y441 K444 V445 G514 L519 S520	Y441-L516 HydrophobicContact CD1-CD1 3.59Å; Y441-L516 HydrophobicContact CD1-CD2 3.89Å; Y441-L516 HydrophobicContact CD1-CG 3.51Å; Y441-L516 HydrophobicContact CE1-CD1 3.7Å; Y441-L516 HydrophobicContact CE1-CG 3.76Å; K444-L516 HydrophobicContact CB-CD1 4.34Å; K444-L516 HydrophobicContact CB-CD2 4.21Å; K444-L516 HydrophobicContact CD-CD1 3.43Å; K444-L516 VanDerWaalsContact CD-CD1 3.43Å; V445-L516 HydrophobicContact CG2-CD2 4.14Å; G514-L516 PolarHBondContact O-N 3.18Å; L516-L519 PolarHBondContact O-N 2.77Å; L516-S520 VanDerWaalsContact O-CB 3.32Å; L516-S520 WeakPolarHBondContact O-CB 3.11Å; L516-S520 PolarHBondContact O-N 3.38Å; L516-S520 PolarHBondContact O-OG 3.05Å; L516-S520 VanDerWaalsContact O-OG 3.12Å
517	L	83.4	Confident	78.9	Confident	127 Å²	127	71.7 Å²	71.7	67%	0.665	41%	0.405	S	S	*	.	H	α-helix	trans	-64.6	-44.9	177.6	-178.7	63	0	0	0	109.9	G514 Y515 S520 A521	G514-L517 WeakPolarHBondContact O-CB 3.43Å; G514-L517 PolarHBondContact O-N 2.8Å; Y515-L517 VanDerWaalsContact C-N 3.33Å; Y515-L517 PolarHBondContact O-N 2.89Å; L517-S520 WeakPolarHBondContact CA-OG 3.49Å; L517-S520 PolarHBondContact O-N 3.06Å; L517-S520 PolarHBondContact O-OG 2.01Å; L517-A521 WeakPolarHBondContact O-CB 3.46Å; L517-A521 PolarHBondContact O-N 3.19Å
518	K	88.4	Confident	80.6	Confident	131 Å²	131	69.5 Å²	69.5	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-61.5	-45.3	175.1	-66.9	-179.7	179.7	-177.1	0	112.1	G514 Y515 S520 A521 M522	G514-K518 PolarHBondContact O-N 2.75Å; Y515-K518 PolarHBondContact O-N 2.71Å; K518-S520 VanDerWaalsContact C-N 3.35Å; K518-S520 PolarHBondContact O-N 2.96Å; K518-A521 PolarHBondContact O-N 2.71Å; K518-M522 PolarHBondContact O-N 2.99Å
519	L	88.3	Confident	82.7	Confident	12 Å²	12	67.7 Å²	67.7	6%	0.063	38%	0.38	C	S	.	.	H	α-helix	trans	-61.9	-42.4	174.9	-72.8	-176.4	0	0	0	111.9	V445 W492 L495 Y515 L516 M522 G523	V445-L519 HydrophobicContact CG2-CD1 3.76Å; W492-L519 HydrophobicContact CH2-CB 4.44Å; L495-L519 HydrophobicContact CB-CD2 4.46Å; L495-L519 HydrophobicContact CD1-CB 4.4Å; L495-L519 HydrophobicContact CD1-CD2 4.23Å; L495-L519 VanDerWaalsContact CD1-O 3.28Å; L495-L519 WeakPolarHBondContact CD1-O 3.33Å; L495-L519 HydrophobicContact CD2-CD2 3.73Å; L495-L519 HydrophobicContact CG-CD2 4.34Å; Y515-L519 HydrophobicContact CD1-CD1 3.98Å; Y515-L519 HydrophobicContact CD2-CG 4.39Å; Y515-L519 HydrophobicContact CE1-CD1 3.42Å; Y515-L519 VanDerWaalsContact CE1-CD1 3.42Å; Y515-L519 HydrophobicContact CE1-CG 4.27Å; Y515-L519 HydrophobicContact CE2-CD1 4.02Å; Y515-L519 HydrophobicContact CE2-CD2 4.25Å; Y515-L519 HydrophobicContact CE2-CG 4.05Å; Y515-L519 VanDerWaalsContact CZ-CD1 3.45Å; Y515-L519 WeakPolarHBondContact O-CG 3.47Å; Y515-L519 PolarHBondContact O-N 3.46Å; L516-L519 PolarHBondContact O-N 2.77Å; L519-M522 PolarHBondContact O-N 2.72Å; L519-G523 PolarHBondContact O-N 3.34Å
520	S	88.4	Confident	84.6	Confident	36 Å²	36	65.8 Å²	65.8	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-67.3	-38.4	178.3	64.6	0	0	0	0	112.4	L516 L517 K518 M522 G523 W524	L516-S520 VanDerWaalsContact O-CB 3.32Å; L516-S520 WeakPolarHBondContact O-CB 3.11Å; L516-S520 PolarHBondContact O-N 3.38Å; L516-S520 PolarHBondContact O-OG 3.05Å; L516-S520 VanDerWaalsContact O-OG 3.12Å; L517-S520 WeakPolarHBondContact CA-OG 3.49Å; L517-S520 PolarHBondContact O-N 3.06Å; L517-S520 PolarHBondContact O-OG 2.01Å; K518-S520 VanDerWaalsContact C-N 3.35Å; K518-S520 PolarHBondContact O-N 2.96Å; S520-M522 VanDerWaalsContact C-N 3.3Å; S520-M522 PolarHBondContact O-N 3.1Å; S520-G523 PolarHBondContact O-N 3.13Å; S520-W524 WeakPolarHBondContact O-CB 3.48Å; S520-W524 PolarHBondContact O-N 2.85Å
521	A	90.5	Very high	86.3	Confident	62 Å²	62	62.1 Å²	62.1	51%	0.512	33%	0.33	S	S	.	.	I	π-helix	trans	-63	-38.9	174.8	0	0	0	0	0	111.2	L517 K518 G525	L517-A521 WeakPolarHBondContact O-CB 3.46Å; L517-A521 PolarHBondContact O-N 3.19Å; K518-A521 PolarHBondContact O-N 2.71Å; A521-G525 WeakPolarHBondContact O-CA 3.4Å; A521-G525 PolarHBondContact O-N 3.26Å
522	M	91.4	Very high	87.9	Confident	109 Å²	109	56.8 Å²	56.8	54%	0.537	32%	0.317	S	S	.	.	I	π-helix	trans	-72.1	-51.1	175.3	-169.9	62.9	72.8	0	0	111.9	L495 K518 L519 S520 W524 F526	L495-M522 HydrophobicContact CD1-CB 4.4Å; L495-M522 HydrophobicContact CD2-CG 4.36Å; K518-M522 PolarHBondContact O-N 2.99Å; L519-M522 PolarHBondContact O-N 2.72Å; S520-M522 VanDerWaalsContact C-N 3.3Å; S520-M522 PolarHBondContact O-N 3.1Å; M522-W524 PolarHBondContact O-N 3.44Å; M522-F526 VanDerWaalsContact O-CB 3.22Å; M522-F526 WeakPolarHBondContact O-CB 3.14Å; M522-F526 PolarHBondContact O-N 2.92Å; M522-F526 HydrophobicContact SD-CB 4.22Å
523	G	92.2	Very high	89.1	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.325	C	S	.	.	I	π-helix	trans	-67.4	-32.5	-173	0	0	0	0	0	114.4	L519 S520 P527	L519-G523 PolarHBondContact O-N 3.34Å; S520-G523 PolarHBondContact O-N 3.13Å; G523-P527 WeakPolarHBondContact O-CD 3.27Å; G523-P527 WeakPolarHBondContact O-CG 3.48Å
524	W	95.2	Very high	90.1	Very high	51 Å²	51	55.2 Å²	55.2	19%	0.193	30%	0.302	C	S	.	.	I	π-helix	trans	-102.6	-41.4	177.2	-62.2	102.1	0	0	0	112.6	L451 L455 F484 T488 W492 S520 M522 P527 I528	L451-W524 HydrophobicContact CD2-CH2 4.07Å; L451-W524 HydrophobicContact CD2-CZ2 3.97Å; L451-W524 HydrophobicContact CG-CH2 4.11Å; L451-W524 HydrophobicContact CG-CZ2 4.34Å; L455-W524 HydrophobicContact CD1-CH2 3.72Å; L455-W524 HydrophobicContact CD1-CZ3 3.68Å; F484-W524 AromaticContact CZ-CE3 3.87Å; F484-W524 HydrophobicContact CZ-CE3 3.87Å; F484-W524 HydrophobicContact CZ-CZ3 4.17Å; T488-W524 HydrophobicContact CG2-CD2 4Å; T488-W524 HydrophobicContact CG2-CE3 3.42Å; T488-W524 VanDerWaalsContact CG2-CE3 3.42Å; T488-W524 HydrophobicContact CG2-CH2 3.98Å; T488-W524 HydrophobicContact CG2-CZ2 4.49Å; T488-W524 HydrophobicContact CG2-CZ3 3.44Å; T488-W524 VanDerWaalsContact CG2-CZ3 3.44Å; W492-W524 AromaticContact CE2-CD1 3.98Å; W492-W524 AromaticContact CE2-NE1 3.56Å; W492-W524 AromaticContact CZ2-CD1 3.6Å; W492-W524 AromaticContact CZ2-NE1 3.3Å; W492-W524 VanDerWaalsContact CZ2-NE1 3.3Å; W492-W524 AromaticContact NE1-CD1 3.72Å; W492-W524 AromaticContact NE1-CD2 3.83Å; W492-W524 AromaticContact NE1-CE2 3.37Å; W492-W524 AromaticContact NE1-CZ2 3.79Å; W492-W524 AromaticContact NE1-NE1 3.32Å; S520-W524 WeakPolarHBondContact O-CB 3.48Å; S520-W524 PolarHBondContact O-N 2.85Å; M522-W524 PolarHBondContact O-N 3.44Å; W524-P527 WeakPolarHBondContact O-CD 3.16Å; W524-I528 WeakPolarHBondContact O-CD1 3.07Å; W524-I528 VanDerWaalsContact O-CG1 3.25Å; W524-I528 WeakPolarHBondContact O-CG1 3.27Å; W524-I528 PolarHBondContact O-N 3.31Å
525	G	94	Very high	90.8	Very high	31 Å²	31	54.5 Å²	54.5	32%	0.32	29%	0.292	S	S	.	.	I	π-helix	trans	-71.9	-37.2	-173.3	0	0	0	0	0	113.8	A521 I528 F529	A521-G525 WeakPolarHBondContact O-CA 3.4Å; A521-G525 PolarHBondContact O-N 3.26Å; G525-I528 PolarHBondContact O-N 2.96Å; G525-F529 WeakPolarHBondContact O-CB 3.04Å; G525-F529 PolarHBondContact O-N 3.49Å
526	F	93.6	Very high	91.2	Very high	75 Å²	75	60 Å²	60	33%	0.329	32%	0.322	S	S	.	.	H	α-helix	trans	-64.5	-47	177.6	176.8	-102.7	0	0	0	112.7	M522 I528 F529 L530 L577	M522-F526 VanDerWaalsContact O-CB 3.22Å; M522-F526 WeakPolarHBondContact O-CB 3.14Å; M522-F526 PolarHBondContact O-N 2.92Å; M522-F526 HydrophobicContact SD-CB 4.22Å; F526-I528 PolarHBondContact O-N 3.04Å; F526-F529 PolarHBondContact O-N 3.42Å; F526-L530 HydrophobicContact CD1-CD1 4.06Å; F526-L530 HydrophobicContact CE1-CD1 3.48Å; F526-L530 VanDerWaalsContact CE1-CD1 3.48Å; F526-L530 HydrophobicContact CE1-CG 4.46Å; F526-L530 HydrophobicContact CE2-CD1 4.11Å; F526-L530 HydrophobicContact CE2-CG 4.36Å; F526-L530 HydrophobicContact CZ-CD1 3.53Å; F526-L530 HydrophobicContact CZ-CG 4.25Å; F526-L530 PolarHBondContact O-N 2.88Å; F526-L530 VanDerWaalsContact O-N 3.1Å; F526-L577 HydrophobicContact CE1-CD1 4Å; F526-L577 HydrophobicContact CE1-CD2 3.6Å; F526-L577 HydrophobicContact CE1-CG 4.47Å; F526-L577 HydrophobicContact CZ-CD2 3.74Å
527	P	95.4	Very high	91.5	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-56.1	-45.5	169.5	-28.1	34	0	0	0	114.2	F484 L487 T488 S491 G523 W524 F529 L530 V531	F484-P527 HydrophobicContact CD2-CB 3.95Å; F484-P527 HydrophobicContact CE2-CB 4.03Å; L487-P527 HydrophobicContact CB-CB 3.87Å; L487-P527 HydrophobicContact CB-CG 4.26Å; T488-P527 WeakPolarHBondContact OG1-CB 2.95Å; S491-P527 WeakPolarHBondContact OG-CG 3.43Å; G523-P527 WeakPolarHBondContact O-CD 3.27Å; G523-P527 WeakPolarHBondContact O-CG 3.48Å; W524-P527 WeakPolarHBondContact O-CD 3.16Å; P527-F529 VanDerWaalsContact C-N 3.3Å; P527-F529 PolarHBondContact O-N 2.81Å; P527-L530 PolarHBondContact O-N 3.31Å; P527-V531 WeakPolarHBondContact O-CG2 3.33Å; P527-V531 PolarHBondContact O-N 2.98Å
528	I	95.1	Very high	91.4	Very high	86 Å²	86	60.8 Å²	60.8	44%	0.441	33%	0.331	S	S	.	.	H	α-helix	trans	-57.8	-46.8	178.2	-70.4	167.7	0	0	0	110.1	F484 W524 G525 F526 L530 T532	F484-I528 HydrophobicContact CD2-CG1 4.09Å; F484-I528 HydrophobicContact CE2-CD1 4.27Å; F484-I528 HydrophobicContact CE2-CG1 3.48Å; F484-I528 VanDerWaalsContact CE2-CG1 3.48Å; F484-I528 HydrophobicContact CZ-CG1 4.14Å; W524-I528 WeakPolarHBondContact O-CD1 3.07Å; W524-I528 VanDerWaalsContact O-CG1 3.25Å; W524-I528 WeakPolarHBondContact O-CG1 3.27Å; W524-I528 PolarHBondContact O-N 3.31Å; G525-I528 PolarHBondContact O-N 2.96Å; F526-I528 PolarHBondContact O-N 3.04Å; I528-L530 PolarHBondContact O-N 2.91Å; I528-T532 VanDerWaalsContact O-CB 3.24Å; I528-T532 WeakPolarHBondContact O-CB 3.39Å; I528-T532 PolarHBondContact O-N 3.29Å; I528-T532 PolarHBondContact O-OG1 3.45Å
529	F	95.3	Very high	91.1	Very high	126 Å²	126	57.5 Å²	57.5	55%	0.553	32%	0.322	S	S	*	.	H	α-helix	trans	-58.2	-48.4	178.9	172	-102.5	0	0	0	111.9	G525 F526 P527 T532 L533	G525-F529 WeakPolarHBondContact O-CB 3.04Å; G525-F529 PolarHBondContact O-N 3.49Å; F526-F529 PolarHBondContact O-N 3.42Å; P527-F529 VanDerWaalsContact C-N 3.3Å; P527-F529 PolarHBondContact O-N 2.81Å; F529-T532 PolarHBondContact O-N 3.36Å; F529-L533 HydrophobicContact CZ-CD1 4.44Å; F529-L533 WeakPolarHBondContact O-CB 3.08Å; F529-L533 PolarHBondContact O-N 3.42Å
530	L	93.9	Very high	90.7	Very high	31 Å²	31	60.6 Å²	60.6	16%	0.162	34%	0.339	C	S	.	.	H	α-helix	trans	-66.3	-44.6	-178.4	-70.5	177.2	0	0	0	113	L487 F526 P527 I528 T532 L533 V534 L577	L487-L530 HydrophobicContact CD1-CB 4.12Å; L487-L530 HydrophobicContact CD1-CD1 4.24Å; F526-L530 HydrophobicContact CD1-CD1 4.06Å; F526-L530 HydrophobicContact CE1-CD1 3.48Å; F526-L530 VanDerWaalsContact CE1-CD1 3.48Å; F526-L530 HydrophobicContact CE1-CG 4.46Å; F526-L530 HydrophobicContact CE2-CD1 4.11Å; F526-L530 HydrophobicContact CE2-CG 4.36Å; F526-L530 HydrophobicContact CZ-CD1 3.53Å; F526-L530 HydrophobicContact CZ-CG 4.25Å; F526-L530 PolarHBondContact O-N 2.88Å; F526-L530 VanDerWaalsContact O-N 3.1Å; P527-L530 PolarHBondContact O-N 3.31Å; I528-L530 PolarHBondContact O-N 2.91Å; L530-T532 VanDerWaalsContact C-N 3.33Å; L530-T532 PolarHBondContact O-N 3.02Å; L530-L533 WeakPolarHBondContact O-CB 3.31Å; L530-L533 PolarHBondContact O-N 2.86Å; L530-V534 WeakPolarHBondContact O-CG2 3.37Å; L530-V534 PolarHBondContact O-N 2.84Å; L530-L577 HydrophobicContact CD1-CD1 3.39Å; L530-L577 HydrophobicContact CD1-CD2 4.27Å; L530-L577 HydrophobicContact CD1-CG 4.25Å
531	V	94.1	Very high	90.3	Very high	8 Å²	8	59.9 Å²	59.9	5%	0.048	33%	0.332	C	S	.	.	H	α-helix	trans	-64.9	-40.8	177.7	175.9	0	0	0	0	110.9	I480 F484 L487 P527 L533 V534 A535	I480-V531 HydrophobicContact CG2-CG1 3.72Å; F484-V531 HydrophobicContact CB-CG2 4.08Å; L487-V531 HydrophobicContact CD1-CG2 4.09Å; P527-V531 WeakPolarHBondContact O-CG2 3.33Å; P527-V531 PolarHBondContact O-N 2.98Å; V531-L533 VanDerWaalsContact C-N 3.33Å; V531-L533 PolarHBondContact O-N 2.84Å; V531-V534 PolarHBondContact O-N 3.01Å; V531-A535 WeakPolarHBondContact O-CB 3.4Å; V531-A535 PolarHBondContact O-N 2.97Å
532	T	93.1	Very high	90	Very high	67 Å²	67	57 Å²	57	41%	0.411	31%	0.308	S	S	.	.	H	α-helix	trans	-62.3	-42.6	175.7	-54.9	0	0	0	0	110.7	I528 F529 L530 V534 A535 L536	I528-T532 VanDerWaalsContact O-CB 3.24Å; I528-T532 WeakPolarHBondContact O-CB 3.39Å; I528-T532 PolarHBondContact O-N 3.29Å; I528-T532 PolarHBondContact O-OG1 3.45Å; F529-T532 PolarHBondContact O-N 3.36Å; L530-T532 VanDerWaalsContact C-N 3.33Å; L530-T532 PolarHBondContact O-N 3.02Å; T532-V534 PolarHBondContact O-N 3.4Å; T532-A535 PolarHBondContact O-N 2.85Å; T532-L536 HydrophobicContact CG2-CD1 3.89Å; T532-L536 HydrophobicContact CG2-CG 4.15Å; T532-L536 VanDerWaalsContact O-CB 3.29Å; T532-L536 WeakPolarHBondContact O-CB 3.47Å; T532-L536 WeakPolarHBondContact O-CG 3.49Å; T532-L536 PolarHBondContact O-N 2.79Å
533	L	93.2	Very high	89.5	Confident	88 Å²	88	52 Å²	52	46%	0.461	28%	0.284	S	S	.	.	H	α-helix	trans	-58.8	-48.6	176.1	-169.8	92.3	0	0	0	111.3	F529 L530 V531 A535 L536 V537	F529-L533 HydrophobicContact CZ-CD1 4.44Å; F529-L533 WeakPolarHBondContact O-CB 3.08Å; F529-L533 PolarHBondContact O-N 3.42Å; L530-L533 WeakPolarHBondContact O-CB 3.31Å; L530-L533 PolarHBondContact O-N 2.86Å; V531-L533 VanDerWaalsContact C-N 3.33Å; V531-L533 PolarHBondContact O-N 2.84Å; L533-A535 PolarHBondContact O-N 2.87Å; L533-L536 PolarHBondContact O-N 2.87Å; L533-V537 VanDerWaalsContact O-CG2 3.28Å; L533-V537 WeakPolarHBondContact O-CG2 3.25Å; L533-V537 PolarHBondContact O-N 2.9Å
534	V	91	Very high	88.7	Confident	12 Å²	12	55.3 Å²	55.3	7%	0.073	31%	0.306	C	S	.	.	H	α-helix	trans	-63.1	-43.6	179.9	176.6	0	0	0	0	111.3	L530 V531 T532 V537 D538 Y542 V569 T573	L530-V534 WeakPolarHBondContact O-CG2 3.37Å; L530-V534 PolarHBondContact O-N 2.84Å; V531-V534 PolarHBondContact O-N 3.01Å; T532-V534 PolarHBondContact O-N 3.4Å; V534-V537 PolarHBondContact O-N 2.82Å; V534-D538 PolarHBondContact O-N 2.76Å; V534-D538 VanDerWaalsContact O-N 3.16Å; V534-Y542 WeakPolarHBondContact CB-OH 3.32Å; V534-Y542 HydrophobicContact CG1-CE2 3.87Å; V534-Y542 WeakPolarHBondContact CG1-OH 3.24Å; V534-V569 HydrophobicContact CG1-CG1 3.66Å; V534-V569 HydrophobicContact CG2-CG1 4.26Å; V534-T573 HydrophobicContact CG2-CG2 3.85Å
535	A	89.3	Confident	87.5	Confident	28 Å²	28	55.1 Å²	55.1	23%	0.231	31%	0.308	C	S	.	.	H	α-helix	trans	-68.4	-31.7	178.4	0	0	0	0	0	113.4	V531 T532 L533 V539 Y542	V531-A535 WeakPolarHBondContact O-CB 3.4Å; V531-A535 PolarHBondContact O-N 2.97Å; T532-A535 PolarHBondContact O-N 2.85Å; L533-A535 PolarHBondContact O-N 2.87Å; A535-V539 PolarHBondContact O-N 2.87Å; A535-Y542 HydrophobicContact CB-CE2 4.13Å
536	L	89.6	Confident	85.9	Confident	140 Å²	140	58.9 Å²	58.9	73%	0.733	32%	0.319	S	S	*	.	H	α-helix	trans	-73.4	-33.8	175.2	-77.2	176.6	0	0	0	112.7	T532 L533	T532-L536 HydrophobicContact CG2-CD1 3.89Å; T532-L536 HydrophobicContact CG2-CG 4.15Å; T532-L536 VanDerWaalsContact O-CB 3.29Å; T532-L536 WeakPolarHBondContact O-CB 3.47Å; T532-L536 WeakPolarHBondContact O-CG 3.49Å; T532-L536 PolarHBondContact O-N 2.79Å; L533-L536 PolarHBondContact O-N 2.87Å
537	V	86.3	Confident	84	Confident	116 Å²	116	58.5 Å²	58.5	70%	0.703	32%	0.32	S	S	*	.	H	α-helix	trans	-68.4	-51.2	177.4	169.3	0	0	0	0	110.1	L533 V534	L533-V537 VanDerWaalsContact O-CG2 3.28Å; L533-V537 WeakPolarHBondContact O-CG2 3.25Å; L533-V537 PolarHBondContact O-N 2.9Å; V534-V537 PolarHBondContact O-N 2.82Å
538	D	80.7	Confident	81.6	Confident	67 Å²	67	61.5 Å²	61.5	36%	0.358	35%	0.345	S	S	.	.			trans	-159.8	120.1	171.4	-169.9	-7.5	0	0	0	110	V534 D540 N541	V534-D538 PolarHBondContact O-N 2.76Å; V534-D538 VanDerWaalsContact O-N 3.16Å; D538-D540 VanDerWaalsContact C-N 3.26Å; D538-D540 WeakPolarHBondContact OD1-CA 2.98Å; D538-D540 VanDerWaalsContact OD1-CB 3.26Å; D538-D540 WeakPolarHBondContact OD1-CB 2.94Å; D538-D540 PolarHBondContact OD1-N 2.99Å; D538-N541 VanDerWaalsContact O-CB 3.31Å; D538-N541 WeakPolarHBondContact O-CB 3.47Å; D538-N541 PolarHBondContact O-N 2.91Å; D538-N541 PolarHBondContact O-ND2 3.05Å; D538-N541 VanDerWaalsContact O-ND2 3.09Å
539	V	82.6	Confident	79	Confident	63 Å²	63	58.6 Å²	58.6	38%	0.382	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-74	-21.7	176.7	76.2	0	0	0	0	111.7	A535 N541 Y542	A535-V539 PolarHBondContact O-N 2.87Å; V539-N541 PolarHBondContact O-N 3Å; V539-Y542 PolarHBondContact O-N 2.8Å; V539-Y542 VanDerWaalsContact O-N 3.12Å
540	D	79.3	Confident	76.5	Confident	77 Å²	77	57.9 Å²	57.9	41%	0.412	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-73.1	-9	177.6	-65.8	-37.5	0	0	0	112.8	R476 D538 Y542	R476-D540 IonicContact CZ-OD1 3.96Å; R476-D540 IonicContact NE-OD1 3.49Å; R476-D540 IonicContact NH2-OD1 3.32Å; R476-D540 PolarHBondContact NH2-OD1 3.27Å; D538-D540 VanDerWaalsContact C-N 3.26Å; D538-D540 WeakPolarHBondContact OD1-CA 2.98Å; D538-D540 VanDerWaalsContact OD1-CB 3.26Å; D538-D540 WeakPolarHBondContact OD1-CB 2.94Å; D538-D540 PolarHBondContact OD1-N 2.99Å; D540-Y542 PolarHBondContact O-N 3.08Å
541	N	81.3	Confident	73.6	Confident	20 Å²	20	66.6 Å²	66.6	11%	0.107	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-58.4	-22.2	164.8	-70.8	-26.3	0	0	0	112.3	D538 V539 I564 R565	D538-N541 VanDerWaalsContact O-CB 3.31Å; D538-N541 WeakPolarHBondContact O-CB 3.47Å; D538-N541 PolarHBondContact O-N 2.91Å; D538-N541 PolarHBondContact O-ND2 3.05Å; D538-N541 VanDerWaalsContact O-ND2 3.09Å; V539-N541 PolarHBondContact O-N 3Å; N541-I564 CarbonylContact O-C 3.08Å; N541-I564 WeakPolarHBondContact O-CA 3.3Å; N541-R565 PolarHBondContact O-N 3.21Å
542	Y	84.4	Confident	70.8	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.008	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.8	178.1	-61.6	-77.6	0	0	0	111.1	R476 A479 I480 H483 V534 A535 V539 D540 I564	R476-Y542 WeakPolarHBondContact CG-O 3.26Å; A479-Y542 HydrophobicContact CB-CD1 3.95Å; A479-Y542 HydrophobicContact CB-CG 4.47Å; I480-Y542 HydrophobicContact CD1-CD2 4.22Å; I480-Y542 HydrophobicContact CG1-CD1 4.01Å; I480-Y542 HydrophobicContact CG1-CD2 3.73Å; I480-Y542 HydrophobicContact CG1-CE1 4.19Å; I480-Y542 HydrophobicContact CG1-CE2 3.91Å; I480-Y542 HydrophobicContact CG1-CG 3.78Å; H483-Y542 HydrophobicContact CB-CE1 4.21Å; H483-Y542 PolarHBondContact CE1-OH 2.96Å; H483-Y542 AromaticContact ND1-CE1 3.76Å; H483-Y542 AromaticContact ND1-CZ 3.78Å; H483-Y542 PolarHBondContact ND1-OH 3.48Å; V534-Y542 WeakPolarHBondContact CB-OH 3.32Å; V534-Y542 HydrophobicContact CG1-CE2 3.87Å; V534-Y542 WeakPolarHBondContact CG1-OH 3.24Å; A535-Y542 HydrophobicContact CB-CE2 4.13Å; V539-Y542 PolarHBondContact O-N 2.8Å; V539-Y542 VanDerWaalsContact O-N 3.12Å; D540-Y542 PolarHBondContact O-N 3.08Å; Y542-I564 HydrophobicContact CD1-CG1 3.97Å; Y542-I564 HydrophobicContact CE1-CD1 4.34Å; Y542-I564 HydrophobicContact CE1-CG1 3.64Å
543	G	80.9	Confident	68.3	Low	3 Å²	3	73.1 Å²	73.1	3%	0.031	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.2	-172.2	177.2	0	0	0	0	0	114.6	W563	G543-W563 PolarHBondContact N-O 3.49Å; G543-W563 PolarHBondContact O-N 3.29Å
544	P	75.2	Confident	65.7	Low	71 Å²	71	78.3 Å²	78.3	46%	0.461	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.1	177.5	29	-32.6	0	0	0	110.4
545	I	68.9	Low	63.1	Low	47 Å²	47	79.9 Å²	79.9	24%	0.241	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.2	168.7	-52.4	-173.6	0	0	0	107.6	S560 M561 W563 I564	I545-S560 WeakPolarHBondContact O-CA 3.45Å; I545-M561 PolarHBondContact N-O 2.97Å; I545-M561 PolarHBondContact O-N 3.28Å; I545-W563 HydrophobicContact CD1-CB 3.59Å; I545-W563 HydrophobicContact CD1-CG 4.03Å; I545-W563 HydrophobicContact CG1-CB 4.15Å; I545-I564 VanDerWaalsContact CD1-O 3.23Å; I545-I564 WeakPolarHBondContact CD1-O 3.46Å
546	I	61.3	Low	60.5	Low	109 Å²	109	81.7 Å²	81.7	56%	0.559	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	112.9	174.6	-56.1	171.1	0	0	0	107.3	A548 Y558	I546-A548 PolarHBondContact O-N 3.08Å; I546-Y558 HydrophobicContact CG2-CD1 4.01Å; I546-Y558 HydrophobicContact CG2-CG 4.43Å
547	L	54.1	Low	58	Low	67 Å²	67	81.4 Å²	81.4	35%	0.351	45%	0.449	S	S	.	.			trans	-81.4	104.7	165.6	-66	159.9	0	0	0	106.4	V549 P559 M561	L547-V549 HydrophobicContact CB-CG2 4.46Å; L547-V549 PolarHBondContact O-N 2.91Å; L547-P559 HydrophobicContact CB-CG 4.32Å; L547-P559 WeakPolarHBondContact CB-O 3.28Å; L547-P559 PolarHBondContact N-O 2.92Å; L547-M561 HydrophobicContact CD1-CE 3.98Å; L547-M561 HydrophobicContact CD1-CG 3.96Å; L547-M561 HydrophobicContact CD1-SD 3.84Å; L547-M561 HydrophobicContact CD2-CE 3.87Å; L547-M561 HydrophobicContact CG-CE 4.08Å; L547-M561 HydrophobicContact CG-CG 4.43Å
548	A	43.1	Very low	56	Low	63 Å²	63	81.1 Å²	81.1	52%	0.521	44%	0.436	S	S	.	.			trans	-64.6	97.7	177.1	0	0	0	0	0	109.7	K400 I546	K400-A548 PolarHBondContact NZ-O 3.23Å; I546-A548 PolarHBondContact O-N 3.08Å
549	V	41.5	Very low	54.7	Low	26 Å²	26	79.3 Å²	79.3	16%	0.158	43%	0.428	C	S	.	.			trans	-123	90.7	172.1	-172.6	0	0	0	0	107.2	A397 K400 L547 P559	A397-V549 HydrophobicContact CB-CG1 3.93Å; K400-V549 HydrophobicContact CB-CG1 4.43Å; K400-V549 HydrophobicContact CB-CG2 4.02Å; K400-V549 HydrophobicContact CD-CG2 3.81Å; L547-V549 HydrophobicContact CB-CG2 4.46Å; L547-V549 PolarHBondContact O-N 2.91Å; V549-P559 HydrophobicContact CB-CG 4.1Å; V549-P559 HydrophobicContact CG2-CG 3.98Å
550	H	43.1	Very low	54	Low	110 Å²	110	77.3 Å²	77.3	51%	0.509	42%	0.417	S	S	.	.			trans	65.5	141	168.9	-88	18.7	0	0	0	120.8	A397	A397-H550 HydrophobicContact CB-CB 4.46Å; A397-H550 WeakPolarHBondContact CB-CE1 3.35Å; A397-H550 WeakPolarHBondContact CB-ND1 3.29Å
551	R	32.9	Very low	54.1	Low	214 Å²	214	76 Å²	76	81%	0.808	41%	0.409	S	S	*	.			trans	-94.6	107.3	149	-76	-178.9	173.2	89.5	-1.3	106.7
552	T	34.3	Very low	54.2	Low	73 Å²	73	75 Å²	75	45%	0.448	40%	0.404	S	S	.	.			trans	-98.5	149.2	157.6	50.8	0	0	0	0	108.7	E554	T552-E554 PolarHBondContact O-N 3.35Å
553	P	41.9	Very low	54.4	Low	139 Å²	139	76.9 Å²	76.9	90%	0.903	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.3	-172.8	-20.4	32	0	0	0	115.7
554	E	39	Very low	54.6	Low	197 Å²	197	76.9 Å²	76.9	92%	0.921	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	2.8	-167.6	-64	-174.8	175.4	0	0	115.1	T552	T552-E554 PolarHBondContact O-N 3.35Å
555	G	34.5	Very low	54.6	Low	45 Å²	45	81.1 Å²	81.1	46%	0.464	42%	0.417	S	S	.	.			trans	158.4	113.8	173.8	0	0	0	0	0	111.9	I557	G555-I557 PolarHBondContact O-N 3.28Å
556	V	35.9	Very low	54.9	Low	67 Å²	67	81.8 Å²	81.8	41%	0.406	42%	0.421	S	S	.	.			trans	-85.8	99.3	-175.9	-167.8	0	0	0	0	109.3	Y558	V556-Y558 HydrophobicContact CB-CE2 4.11Å; V556-Y558 HydrophobicContact CG1-CD1 4.14Å; V556-Y558 HydrophobicContact CG1-CD2 3.68Å; V556-Y558 HydrophobicContact CG1-CE1 3.75Å; V556-Y558 HydrophobicContact CG1-CE2 3.24Å; V556-Y558 HydrophobicContact CG1-CG 4.11Å
557	I	36.9	Very low	55.5	Low	134 Å²	134	81 Å²	81	69%	0.687	43%	0.426	S	S	*	.			trans	-93.9	99.2	166.6	-53.9	174.6	0	0	0	106.5	G555 P559	G555-I557 PolarHBondContact O-N 3.28Å; I557-P559 WeakPolarHBondContact O-CD 3.37Å
558	Y	44	Very low	56.6	Low	110 Å²	110	83.1 Å²	83.1	43%	0.431	44%	0.436	S	S	.	.			trans	-74.6	114	165.9	-61.8	-79.1	0	0	0	107.6	I546 V556 S560	I546-Y558 HydrophobicContact CG2-CD1 4.01Å; I546-Y558 HydrophobicContact CG2-CG 4.43Å; V556-Y558 HydrophobicContact CB-CE2 4.11Å; V556-Y558 HydrophobicContact CG1-CD1 4.14Å; V556-Y558 HydrophobicContact CG1-CD2 3.68Å; V556-Y558 HydrophobicContact CG1-CE1 3.75Å; V556-Y558 HydrophobicContact CG1-CE2 3.24Å; V556-Y558 HydrophobicContact CG1-CG 4.11Å; Y558-S560 VanDerWaalsContact C-N 3.26Å; Y558-S560 PolarHBondContact O-N 3.39Å
559	P	53.4	Low	58.4	Low	29 Å²	29	81.4 Å²	81.4	19%	0.188	42%	0.42	C	S	.	.			trans	-69.2	93.3	167.2	27.4	-30	0	0	0	107.6	L547 V549 I557	L547-P559 HydrophobicContact CB-CG 4.32Å; L547-P559 WeakPolarHBondContact CB-O 3.28Å; L547-P559 PolarHBondContact N-O 2.92Å; V549-P559 HydrophobicContact CB-CG 4.1Å; V549-P559 HydrophobicContact CG2-CG 3.98Å; I557-P559 WeakPolarHBondContact O-CD 3.37Å
560	S	67.9	Low	60.4	Low	20 Å²	20	81.4 Å²	81.4	14%	0.14	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.1	166.4	53.1	0	0	0	0	108.6	A467 I545 Y558	A467-S560 WeakPolarHBondContact CB-O 3.49Å; A467-S560 VanDerWaalsContact CB-OG 3.28Å; A467-S560 WeakPolarHBondContact CB-OG 3.26Å; I545-S560 WeakPolarHBondContact O-CA 3.45Å; Y558-S560 VanDerWaalsContact C-N 3.26Å; Y558-S560 PolarHBondContact O-N 3.39Å
561	M	80.9	Confident	62.2	Low	49 Å²	49	83.4 Å²	83.4	24%	0.241	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	149.8	169.5	66.6	172.8	175.6	0	0	110.1	I545 L547 W563	I545-M561 PolarHBondContact N-O 2.97Å; I545-M561 PolarHBondContact O-N 3.28Å; L547-M561 HydrophobicContact CD1-CE 3.98Å; L547-M561 HydrophobicContact CD1-CG 3.96Å; L547-M561 HydrophobicContact CD1-SD 3.84Å; L547-M561 HydrophobicContact CD2-CE 3.87Å; L547-M561 HydrophobicContact CG-CE 4.08Å; L547-M561 HydrophobicContact CG-CG 4.43Å; M561-W563 HydrophobicContact CE-CB 4.46Å
562	C	85.2	Confident	64.8	Low	1 Å²	1	79 Å²	79	1%	0.007	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	111.2	176.3	-65.7	0	0	0	0	110.7	A467 C475 A479	A467-C562 VanDerWaalsContact CB-SG 3.6Å; C475-C562 WeakPolarHBondContact CA-SG 3.49Å; C475-C562 HydrophobicContact CB-CB 4.12Å; C475-C562 WeakPolarHBondContact CB-SG 3.45Å; C475-C562 WeakPolarHBondContact O-CB 3.33Å; C475-C562 VanDerWaalsContact SG-CA 3.52Å; C475-C562 WeakPolarHBondContact SG-CB 3.18Å; C475-C562 CovalentContact SG-SG 2.03Å; C475-C562 PolarHBondContact SG-SG 3.19Å; A479-C562 HydrophobicContact CB-CB 4.15Å
563	W	88.6	Confident	67.4	Low	40 Å²	40	76.4 Å²	76.4	15%	0.152	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	-174.7	-175.5	-170.8	-112.1	0	0	0	112.7	L482 H483 L486 G543 I545 M561 R565 N574	L482-W563 HydrophobicContact CB-CE3 4.33Å; L482-W563 HydrophobicContact CB-CZ3 4.05Å; L482-W563 HydrophobicContact CD2-CE3 3.6Å; L482-W563 HydrophobicContact CD2-CH2 3.86Å; L482-W563 HydrophobicContact CD2-CZ3 3.08Å; L482-W563 HydrophobicContact CG-CE3 4.35Å; L482-W563 HydrophobicContact CG-CZ3 4.06Å; H483-W563 HydrophobicContact CB-CH2 4.5Å; H483-W563 HydrophobicContact CB-CZ3 4.22Å; L486-W563 HydrophobicContact CD2-CH2 3.77Å; L486-W563 HydrophobicContact CD2-CZ2 4.33Å; G543-W563 PolarHBondContact N-O 3.49Å; G543-W563 PolarHBondContact O-N 3.29Å; I545-W563 HydrophobicContact CD1-CB 3.59Å; I545-W563 HydrophobicContact CD1-CG 4.03Å; I545-W563 HydrophobicContact CG1-CB 4.15Å; M561-W563 HydrophobicContact CE-CB 4.46Å; W563-R565 PolarHBondContact O-N 2.05Å; W563-N574 WeakPolarHBondContact CZ2-ND2 3.42Å
564	I	85.1	Confident	69.6	Low	4 Å²	4	70.6 Å²	70.6	2%	0.021	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	118.5	178.2	-55.9	166.9	0	0	0	109.3	N541 Y542 I545 D566 V569	N541-I564 CarbonylContact O-C 3.08Å; N541-I564 WeakPolarHBondContact O-CA 3.3Å; Y542-I564 HydrophobicContact CD1-CG1 3.97Å; Y542-I564 HydrophobicContact CE1-CD1 4.34Å; Y542-I564 HydrophobicContact CE1-CG1 3.64Å; I545-I564 VanDerWaalsContact CD1-O 3.23Å; I545-I564 WeakPolarHBondContact CD1-O 3.46Å; I564-D566 WeakPolarHBondContact CG2-O 3.33Å; I564-V569 HydrophobicContact CG2-CB 4.17Å; I564-V569 HydrophobicContact CG2-CG1 4.09Å
565	R	74.2	Confident	71.8	Confident	160 Å²	160	63 Å²	63	60%	0.604	33%	0.327	S	S	*	.	S	Bend	trans	-70.8	-39.4	-179.2	-64.8	178.8	69.3	-177.9	1.6	112.7	N541 W563 S567	N541-R565 PolarHBondContact O-N 3.21Å; W563-R565 PolarHBondContact O-N 2.05Å; R565-S567 PolarHBondContact O-N 2.91Å
566	D	75.4	Confident	74.5	Confident	60 Å²	60	62.6 Å²	62.6	32%	0.321	32%	0.323	S	S	.	.			trans	-78	113.5	178.6	-171.2	-17.4	0	0	0	110.3	I564 L568 V569 S570	I564-D566 WeakPolarHBondContact CG2-O 3.33Å; D566-L568 VanDerWaalsContact C-N 3.28Å; D566-L568 PolarHBondContact O-N 2.87Å; D566-L568 WeakPolarHBondContact OD1-CB 3.44Å; D566-L568 PolarHBondContact OD1-N 2.79Å; D566-V569 HydrophobicContact CB-CB 4.04Å; D566-V569 HydrophobicContact CB-CG2 3.85Å; D566-V569 PolarHBondContact O-N 3.48Å; D566-V569 WeakPolarHBondContact OD2-CG2 3.2Å; D566-S570 WeakPolarHBondContact O-CB 3.42Å; D566-S570 PolarHBondContact O-N 3.08Å
567	S	74	Confident	77	Confident	94 Å²	94	60.6 Å²	60.6	66%	0.657	31%	0.309	S	S	*	.	H	α-helix	trans	-63.1	-33	178.8	59.5	0	0	0	0	112.5	R565 Y571	R565-S567 PolarHBondContact O-N 2.91Å; S567-Y571 VanDerWaalsContact O-CB 3.26Å; S567-Y571 WeakPolarHBondContact O-CB 3.47Å; S567-Y571 PolarHBondContact O-N 2.79Å
568	L	76.2	Confident	79.5	Confident	110 Å²	110	54.8 Å²	54.8	58%	0.576	28%	0.279	S	S	*	.	H	α-helix	trans	-70.1	-45.5	178	-69.2	173.2	0	0	0	111.3	D566 S570 Y571 I572	D566-L568 VanDerWaalsContact C-N 3.28Å; D566-L568 PolarHBondContact O-N 2.87Å; D566-L568 WeakPolarHBondContact OD1-CB 3.44Å; D566-L568 PolarHBondContact OD1-N 2.79Å; L568-S570 VanDerWaalsContact C-N 3.34Å; L568-Y571 PolarHBondContact O-N 3.15Å; L568-I572 WeakPolarHBondContact O-CB 3.49Å; L568-I572 WeakPolarHBondContact O-CG1 3.37Å; L568-I572 PolarHBondContact O-N 3.29Å
569	V	81.6	Confident	81.6	Confident	28 Å²	28	51.2 Å²	51.2	17%	0.17	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-49.5	175.9	174.7	0	0	0	0	109.4	V534 I564 D566 Y571 I572 T573	V534-V569 HydrophobicContact CG1-CG1 3.66Å; V534-V569 HydrophobicContact CG2-CG1 4.26Å; I564-V569 HydrophobicContact CG2-CB 4.17Å; I564-V569 HydrophobicContact CG2-CG1 4.09Å; D566-V569 HydrophobicContact CB-CB 4.04Å; D566-V569 HydrophobicContact CB-CG2 3.85Å; D566-V569 PolarHBondContact O-N 3.48Å; D566-V569 WeakPolarHBondContact OD2-CG2 3.2Å; V569-Y571 VanDerWaalsContact C-N 3.33Å; V569-Y571 PolarHBondContact O-N 2.92Å; V569-I572 PolarHBondContact O-N 3.48Å; V569-T573 HydrophobicContact CG1-CG2 4.25Å; V569-T573 WeakPolarHBondContact O-CG2 3.04Å; V569-T573 PolarHBondContact O-N 2.01Å; V569-T573 PolarHBondContact O-OG1 3.36Å
570	S	82.8	Confident	83.4	Confident	25 Å²	25	55.1 Å²	55.1	18%	0.175	29%	0.289	C	S	.	.	H	α-helix	trans	-57.7	-43.4	177.1	-177.2	0	0	0	0	112.3	D566 L568 N574	D566-S570 WeakPolarHBondContact O-CB 3.42Å; D566-S570 PolarHBondContact O-N 3.08Å; L568-S570 VanDerWaalsContact C-N 3.34Å; S570-N574 WeakPolarHBondContact O-CB 3.39Å; S570-N574 PolarHBondContact O-N 2.89Å; S570-N574 PolarHBondContact O-ND2 3.44Å; S570-N574 PolarHBondContact OG-ND2 3.16Å
571	Y	82.4	Confident	84.4	Confident	153 Å²	153	55.3 Å²	55.3	60%	0.6	29%	0.289	S	S	*	.	I	π-helix	trans	-65.2	-47.8	178.9	-171.7	-89.7	0	0	0	111.8	S567 L568 V569 L575 G576	S567-Y571 VanDerWaalsContact O-CB 3.26Å; S567-Y571 WeakPolarHBondContact O-CB 3.47Å; S567-Y571 PolarHBondContact O-N 2.79Å; L568-Y571 PolarHBondContact O-N 3.15Å; V569-Y571 VanDerWaalsContact C-N 3.33Å; V569-Y571 PolarHBondContact O-N 2.92Å; Y571-L575 HydrophobicContact CD2-CB 4.36Å; Y571-L575 HydrophobicContact CD2-CD2 3.65Å; Y571-L575 HydrophobicContact CE1-CD2 4.16Å; Y571-L575 HydrophobicContact CE2-CD2 3.11Å; Y571-L575 HydrophobicContact CE2-CG 4.43Å; Y571-L575 HydrophobicContact CG-CD2 4.37Å; Y571-L575 VanDerWaalsContact CZ-CD2 3.4Å; Y571-L575 WeakPolarHBondContact O-CA 3.48Å; Y571-L575 WeakPolarHBondContact O-CB 3.34Å; Y571-L575 PolarHBondContact O-N 2.79Å; Y571-G576 PolarHBondContact O-N 2.85Å; Y571-G576 VanDerWaalsContact O-N 3.1Å
572	I	87.2	Confident	84.7	Confident	120 Å²	120	54.6 Å²	54.6	62%	0.615	29%	0.285	S	S	*	.	I	π-helix	trans	-66.6	-49	-178.1	-67.3	171.6	0	0	0	111	L568 V569 G576	L568-I572 WeakPolarHBondContact O-CB 3.49Å; L568-I572 WeakPolarHBondContact O-CG1 3.37Å; L568-I572 PolarHBondContact O-N 3.29Å; V569-I572 PolarHBondContact O-N 3.48Å; I572-G576 WeakPolarHBondContact O-CA 3.43Å; I572-G576 PolarHBondContact O-N 2.73Å
573	T	88.1	Confident	84.8	Confident	20 Å²	20	60.1 Å²	60.1	12%	0.123	31%	0.313	C	S	.	.	I	π-helix	trans	-75	-45.7	-174.2	63.7	0	0	0	0	111.8	H483 V534 V569 L577	H483-T573 PolarHBondContact NE2-OG1 2.81Å; V534-T573 HydrophobicContact CG2-CG2 3.85Å; V569-T573 HydrophobicContact CG1-CG2 4.25Å; V569-T573 WeakPolarHBondContact O-CG2 3.04Å; V569-T573 PolarHBondContact O-N 2.01Å; V569-T573 PolarHBondContact O-OG1 3.36Å; T573-L577 VanDerWaalsContact O-CB 3.28Å; T573-L577 WeakPolarHBondContact O-CB 3.28Å; T573-L577 WeakPolarHBondContact O-CD1 3.36Å; T573-L577 WeakPolarHBondContact O-CG 3.37Å
574	N	88.6	Confident	84.8	Confident	17 Å²	17	62.6 Å²	62.6	9%	0.091	33%	0.326	C	S	.	.	I	π-helix	trans	-85.2	-58.4	-175.2	-57.4	-51	0	0	0	111.3	H483 W563 S570 G576 L577 F578	H483-N574 PolarHBondContact CD2-OD1 3.4Å; H483-N574 PolarHBondContact NE2-OD1 2.79Å; W563-N574 WeakPolarHBondContact CZ2-ND2 3.42Å; S570-N574 WeakPolarHBondContact O-CB 3.39Å; S570-N574 PolarHBondContact O-N 2.89Å; S570-N574 PolarHBondContact O-ND2 3.44Å; S570-N574 PolarHBondContact OG-ND2 3.16Å; N574-G576 PolarHBondContact O-N 3.32Å; N574-L577 PolarHBondContact O-N 3.03Å; N574-F578 WeakPolarHBondContact O-CB 3.46Å; N574-F578 PolarHBondContact O-N 3.37Å
575	L	85.9	Confident	84.9	Confident	38 Å²	38	62.9 Å²	62.9	20%	0.199	33%	0.327	C	S	.	.	I	π-helix	trans	-69.1	-36	-175.9	-167.5	73.2	0	0	0	111.5	Y571 F578 S579 I626 F627	Y571-L575 HydrophobicContact CD2-CB 4.36Å; Y571-L575 HydrophobicContact CD2-CD2 3.65Å; Y571-L575 HydrophobicContact CE1-CD2 4.16Å; Y571-L575 HydrophobicContact CE2-CD2 3.11Å; Y571-L575 HydrophobicContact CE2-CG 4.43Å; Y571-L575 HydrophobicContact CG-CD2 4.37Å; Y571-L575 VanDerWaalsContact CZ-CD2 3.4Å; Y571-L575 WeakPolarHBondContact O-CA 3.48Å; Y571-L575 WeakPolarHBondContact O-CB 3.34Å; Y571-L575 PolarHBondContact O-N 2.79Å; L575-F578 HydrophobicContact CD1-CD1 4.1Å; L575-F578 PolarHBondContact O-N 3.38Å; L575-S579 WeakPolarHBondContact O-CB 3.41Å; L575-S579 PolarHBondContact O-N 2.77Å; L575-S579 PolarHBondContact O-OG 2.72Å; L575-I626 HydrophobicContact CD1-CG2 4.3Å; L575-F627 HydrophobicContact CD1-CE1 3.92Å; L575-F627 HydrophobicContact CD1-CZ 4.41Å; L575-F627 HydrophobicContact CG-CE1 4.32Å
576	G	89.9	Confident	85.5	Confident	36 Å²	36	58.6 Å²	58.6	37%	0.371	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-50.7	174.6	0	0	0	0	0	112.7	Y571 I572 N574 S579 L580	Y571-G576 PolarHBondContact O-N 2.85Å; Y571-G576 VanDerWaalsContact O-N 3.1Å; I572-G576 WeakPolarHBondContact O-CA 3.43Å; I572-G576 PolarHBondContact O-N 2.73Å; N574-G576 PolarHBondContact O-N 3.32Å; G576-S579 PolarHBondContact O-N 2.83Å; G576-L580 PolarHBondContact O-N 2.86Å; G576-L580 VanDerWaalsContact O-N 3.14Å
577	L	89.2	Confident	86.1	Confident	24 Å²	24	58.5 Å²	58.5	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-41.1	176.2	-74.9	-175.7	0	0	0	112.9	L487 F526 L530 T573 N574 S579 L580 V581	L487-L577 HydrophobicContact CD1-CD1 4.01Å; L487-L577 HydrophobicContact CD2-CD1 3.57Å; L487-L577 HydrophobicContact CG-CD1 4.27Å; F526-L577 HydrophobicContact CE1-CD1 4Å; F526-L577 HydrophobicContact CE1-CD2 3.6Å; F526-L577 HydrophobicContact CE1-CG 4.47Å; F526-L577 HydrophobicContact CZ-CD2 3.74Å; L530-L577 HydrophobicContact CD1-CD1 3.39Å; L530-L577 HydrophobicContact CD1-CD2 4.27Å; L530-L577 HydrophobicContact CD1-CG 4.25Å; T573-L577 VanDerWaalsContact O-CB 3.28Å; T573-L577 WeakPolarHBondContact O-CB 3.28Å; T573-L577 WeakPolarHBondContact O-CD1 3.36Å; T573-L577 WeakPolarHBondContact O-CG 3.37Å; N574-L577 PolarHBondContact O-N 3.03Å; L577-S579 VanDerWaalsContact C-N 3.32Å; L577-S579 PolarHBondContact O-N 2.9Å; L577-L580 PolarHBondContact O-N 2.77Å; L577-V581 WeakPolarHBondContact O-CG2 3.45Å; L577-V581 PolarHBondContact O-N 3.39Å
578	F	88.6	Confident	86.6	Confident	13 Å²	13	54.6 Å²	54.6	6%	0.057	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-46.8	176.1	172.6	-112	0	0	0	111.3	L490 N574 L575 L580 V581 F582 W623 I626 F627	L490-F578 HydrophobicContact CD1-CB 4.21Å; L490-F578 HydrophobicContact CD2-CD2 3.89Å; N574-F578 WeakPolarHBondContact O-CB 3.46Å; N574-F578 PolarHBondContact O-N 3.37Å; L575-F578 HydrophobicContact CD1-CD1 4.1Å; L575-F578 PolarHBondContact O-N 3.38Å; F578-L580 VanDerWaalsContact C-N 3.32Å; F578-L580 PolarHBondContact O-N 2.87Å; F578-V581 PolarHBondContact O-N 3.49Å; F578-F582 HydrophobicContact CE2-CB 4.22Å; F578-F582 HydrophobicContact CZ-CB 4.1Å; F578-F582 HydrophobicContact CZ-CG 4.44Å; F578-F582 VanDerWaalsContact O-CB 3.26Å; F578-F582 WeakPolarHBondContact O-CB 3.48Å; F578-F582 PolarHBondContact O-N 2.82Å; F578-W623 HydrophobicContact CD2-CB 4.11Å; F578-W623 HydrophobicContact CE1-CB 4.38Å; F578-W623 HydrophobicContact CE2-CB 3.11Å; F578-W623 AromaticContact CE2-CG 3.98Å; F578-W623 HydrophobicContact CE2-CG 3.98Å; F578-W623 HydrophobicContact CZ-CB 3.29Å; F578-W623 VanDerWaalsContact CZ-O 3.3Å; F578-W623 WeakPolarHBondContact CZ-O 3.28Å; F578-I626 HydrophobicContact CD1-CG2 3.99Å; F578-I626 HydrophobicContact CE1-CG2 3.56Å; F578-I626 HydrophobicContact CZ-CG2 4.43Å; F578-F627 AromaticContact CD1-CE2 3.84Å; F578-F627 HydrophobicContact CD1-CE2 3.84Å; F578-F627 AromaticContact CD1-CZ 3.7Å; F578-F627 HydrophobicContact CD1-CZ 3.7Å; F578-F627 AromaticContact CE1-CD2 3.88Å; F578-F627 HydrophobicContact CE1-CD2 3.88Å; F578-F627 AromaticContact CE1-CE2 3.2Å; F578-F627 HydrophobicContact CE1-CE2 3.2Å; F578-F627 AromaticContact CE1-CZ 3.57Å; F578-F627 HydrophobicContact CE1-CZ 3.57Å; F578-F627 HydrophobicContact CZ-CE2 4Å
579	S	88.8	Confident	86.9	Confident	34 Å²	34	50.2 Å²	50.2	24%	0.238	27%	0.271	C	S	.	.	H	α-helix	trans	-58.4	-44.2	177.1	-56.7	0	0	0	0	111.9	L575 G576 L577 F582 L583 F627	L575-S579 WeakPolarHBondContact O-CB 3.41Å; L575-S579 PolarHBondContact O-N 2.77Å; L575-S579 PolarHBondContact O-OG 2.72Å; G576-S579 PolarHBondContact O-N 2.83Å; L577-S579 VanDerWaalsContact C-N 3.32Å; L577-S579 PolarHBondContact O-N 2.9Å; S579-F582 PolarHBondContact O-N 2.82Å; S579-L583 WeakPolarHBondContact O-CB 3.09Å; S579-L583 VanDerWaalsContact O-CG 3.3Å; S579-L583 WeakPolarHBondContact O-CG 3.06Å; S579-L583 PolarHBondContact O-N 2.97Å; S579-F627 VanDerWaalsContact OG-CZ 3.27Å; S579-F627 WeakPolarHBondContact OG-CZ 3.06Å
580	L	90.4	Very high	87.1	Confident	112 Å²	112	51.6 Å²	51.6	59%	0.586	29%	0.285	S	S	*	.	H	α-helix	trans	-62.2	-49.1	178.1	-177.5	68.9	0	0	0	111.7	G576 L577 F578 F582 F584	G576-L580 PolarHBondContact O-N 2.86Å; G576-L580 VanDerWaalsContact O-N 3.14Å; L577-L580 PolarHBondContact O-N 2.77Å; F578-L580 VanDerWaalsContact C-N 3.32Å; F578-L580 PolarHBondContact O-N 2.87Å; L580-F582 VanDerWaalsContact C-N 3.35Å; L580-F584 VanDerWaalsContact O-CB 3.3Å; L580-F584 WeakPolarHBondContact O-CB 3.21Å; L580-F584 PolarHBondContact O-N 2.91Å
581	V	88.6	Confident	87.2	Confident	23 Å²	23	53.1 Å²	53.1	14%	0.139	29%	0.293	C	S	.	.	H	α-helix	trans	-64.2	-41.1	179.1	171.5	0	0	0	0	111	L577 F578 F584 N585	L577-V581 WeakPolarHBondContact O-CG2 3.45Å; L577-V581 PolarHBondContact O-N 3.39Å; F578-V581 PolarHBondContact O-N 3.49Å; V581-F584 PolarHBondContact O-N 3.38Å; V581-N585 WeakPolarHBondContact O-CB 3.43Å; V581-N585 PolarHBondContact O-N 2.98Å
582	F	87.2	Confident	87.1	Confident	34 Å²	34	46 Å²	46	15%	0.149	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-51.2	177.8	174	-107.5	0	0	0	111.8	F578 S579 L580 F584 N585 M586 L621 A624 F627	F578-F582 HydrophobicContact CE2-CB 4.22Å; F578-F582 HydrophobicContact CZ-CB 4.1Å; F578-F582 HydrophobicContact CZ-CG 4.44Å; F578-F582 VanDerWaalsContact O-CB 3.26Å; F578-F582 WeakPolarHBondContact O-CB 3.48Å; F578-F582 PolarHBondContact O-N 2.82Å; S579-F582 PolarHBondContact O-N 2.82Å; L580-F582 VanDerWaalsContact C-N 3.35Å; F582-F584 VanDerWaalsContact C-N 3.3Å; F582-F584 PolarHBondContact O-N 2.82Å; F582-N585 PolarHBondContact O-N 3.22Å; F582-M586 HydrophobicContact CD1-CG 4.44Å; F582-M586 HydrophobicContact CD2-CG 4.04Å; F582-M586 HydrophobicContact CE1-CG 3.99Å; F582-M586 HydrophobicContact CE2-CG 3.51Å; F582-M586 HydrophobicContact CE2-SD 3.88Å; F582-M586 HydrophobicContact CG-CG 4.47Å; F582-M586 HydrophobicContact CZ-CG 3.5Å; F582-M586 HydrophobicContact CZ-SD 4.03Å; F582-M586 WeakPolarHBondContact O-CB 3.22Å; F582-M586 VanDerWaalsContact O-CG 3.31Å; F582-M586 WeakPolarHBondContact O-CG 3.42Å; F582-M586 PolarHBondContact O-N 3.27Å; F582-L621 HydrophobicContact CE2-CD2 3.93Å; F582-L621 HydrophobicContact CE2-CG 4.46Å; F582-L621 HydrophobicContact CZ-CD2 4.29Å; F582-A624 HydrophobicContact CD2-CB 3.93Å; F582-A624 HydrophobicContact CE1-CB 4.35Å; F582-A624 HydrophobicContact CE2-CB 3.37Å; F582-A624 HydrophobicContact CZ-CB 3.6Å; F582-F627 HydrophobicContact CD1-CE2 4.07Å; F582-F627 HydrophobicContact CG-CE2 4.41Å
583	L	88.9	Confident	86.7	Confident	117 Å²	117	42.9 Å²	42.9	61%	0.613	25%	0.252	S	S	*	.	H	α-helix	trans	-59.9	-42.6	177.7	-70.9	173.8	0	0	0	111.5	S579 M586 A587	S579-L583 WeakPolarHBondContact O-CB 3.09Å; S579-L583 VanDerWaalsContact O-CG 3.3Å; S579-L583 WeakPolarHBondContact O-CG 3.06Å; S579-L583 PolarHBondContact O-N 2.97Å; L583-M586 PolarHBondContact O-N 2.82Å; L583-A587 WeakPolarHBondContact O-CB 3.06Å; L583-A587 PolarHBondContact O-N 2.85Å
584	F	88.8	Confident	86.5	Confident	93 Å²	93	45 Å²	45	41%	0.408	27%	0.265	S	S	.	.	H	α-helix	trans	-61.2	-48.7	176.4	-179.2	-114.4	0	0	0	111.8	Y498 L580 V581 F582 M586 A587 M588	Y498-F584 HydrophobicContact CD2-CZ 4.08Å; Y498-F584 HydrophobicContact CG-CZ 4.45Å; L580-F584 VanDerWaalsContact O-CB 3.3Å; L580-F584 WeakPolarHBondContact O-CB 3.21Å; L580-F584 PolarHBondContact O-N 2.91Å; V581-F584 PolarHBondContact O-N 3.38Å; F582-F584 VanDerWaalsContact C-N 3.3Å; F582-F584 PolarHBondContact O-N 2.82Å; F584-M586 PolarHBondContact O-N 2.85Å; F584-A587 PolarHBondContact O-N 3.12Å; F584-M588 HydrophobicContact CD1-CE 3.22Å; F584-M588 HydrophobicContact CD1-SD 3.93Å; F584-M588 HydrophobicContact CD2-SD 4.47Å; F584-M588 HydrophobicContact CE1-CE 3.17Å; F584-M588 HydrophobicContact CE1-SD 3.34Å; F584-M588 WeakPolarHBondContact CE1-SD 3.43Å; F584-M588 HydrophobicContact CE2-CE 4.47Å; F584-M588 HydrophobicContact CE2-CG 4.39Å; F584-M588 HydrophobicContact CE2-SD 3.95Å; F584-M588 HydrophobicContact CG-CE 3.95Å; F584-M588 HydrophobicContact CG-SD 4.46Å; F584-M588 HydrophobicContact CZ-CE 3.84Å; F584-M588 HydrophobicContact CZ-CG 4.35Å; F584-M588 HydrophobicContact CZ-SD 3.35Å; F584-M588 WeakPolarHBondContact CZ-SD 3.28Å; F584-M588 WeakPolarHBondContact O-CG 3.36Å; F584-M588 PolarHBondContact O-N 3.28Å
585	N	87	Confident	86.1	Confident	9 Å²	9	47 Å²	47	5%	0.048	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-40.2	177.5	-80.7	-22.6	0	0	0	112.8	V581 F582 M588 L589	V581-N585 WeakPolarHBondContact O-CB 3.43Å; V581-N585 PolarHBondContact O-N 2.98Å; F582-N585 PolarHBondContact O-N 3.22Å; N585-M588 HydrophobicContact CB-CE 4.34Å; N585-M588 PolarHBondContact O-N 3Å; N585-M588 WeakPolarHBondContact OD1-CE 3.06Å; N585-L589 VanDerWaalsContact O-CB 3.31Å; N585-L589 WeakPolarHBondContact O-CB 3.33Å; N585-L589 PolarHBondContact O-N 3.08Å
586	M	85.9	Confident	85.6	Confident	71 Å²	71	46.8 Å²	46.8	35%	0.35	27%	0.272	S	S	.	.	H	α-helix	trans	-64	-42.3	176.3	-74.6	-61	-66.4	0	0	112.3	F582 L583 F584 L589 A590 L621	F582-M586 HydrophobicContact CD1-CG 4.44Å; F582-M586 HydrophobicContact CD2-CG 4.04Å; F582-M586 HydrophobicContact CE1-CG 3.99Å; F582-M586 HydrophobicContact CE2-CG 3.51Å; F582-M586 HydrophobicContact CE2-SD 3.88Å; F582-M586 HydrophobicContact CG-CG 4.47Å; F582-M586 HydrophobicContact CZ-CG 3.5Å; F582-M586 HydrophobicContact CZ-SD 4.03Å; F582-M586 WeakPolarHBondContact O-CB 3.22Å; F582-M586 VanDerWaalsContact O-CG 3.31Å; F582-M586 WeakPolarHBondContact O-CG 3.42Å; F582-M586 PolarHBondContact O-N 3.27Å; L583-M586 PolarHBondContact O-N 2.82Å; F584-M586 PolarHBondContact O-N 2.85Å; M586-L589 PolarHBondContact O-N 2.85Å; M586-A590 WeakPolarHBondContact O-CB 3.31Å; M586-A590 PolarHBondContact O-N 3.22Å; M586-L621 HydrophobicContact CE-CD2 4.43Å; M586-L621 HydrophobicContact SD-CD1 4.1Å; M586-L621 HydrophobicContact SD-CD2 3.82Å; M586-L621 HydrophobicContact SD-CG 3.97Å
587	A	87.7	Confident	84.9	Confident	57 Å²	57	50.6 Å²	50.6	47%	0.471	28%	0.283	S	S	.	.	H	α-helix	trans	-63.1	-45.1	175.7	0	0	0	0	0	111.6	L583 F584 L589 A590 T591	L583-A587 WeakPolarHBondContact O-CB 3.06Å; L583-A587 PolarHBondContact O-N 2.85Å; F584-A587 PolarHBondContact O-N 3.12Å; A587-L589 PolarHBondContact O-N 2.91Å; A587-A590 PolarHBondContact O-N 3Å; A587-T591 WeakPolarHBondContact O-CG2 3.45Å; A587-T591 PolarHBondContact O-N 2.75Å; A587-T591 VanDerWaalsContact O-N 3.08Å; A587-T591 PolarHBondContact O-OG1 2.83Å
588	M	85.1	Confident	84.3	Confident	12 Å²	12	58 Å²	58	6%	0.059	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-44.6	175.8	-69.6	-175.1	-60.4	0	0	111.6	G497 Y498 F584 N585 A590 T591 M592	G497-M588 VanDerWaalsContact C-CE 3.46Å; G497-M588 VanDerWaalsContact C-SD 3.52Å; Y498-M588 WeakPolarHBondContact CA-SD 3.14Å; Y498-M588 HydrophobicContact CD2-SD 4.35Å; Y498-M588 PolarHBondContact N-SD 3.46Å; F584-M588 HydrophobicContact CD1-CE 3.22Å; F584-M588 HydrophobicContact CD1-SD 3.93Å; F584-M588 HydrophobicContact CD2-SD 4.47Å; F584-M588 HydrophobicContact CE1-CE 3.17Å; F584-M588 HydrophobicContact CE1-SD 3.34Å; F584-M588 WeakPolarHBondContact CE1-SD 3.43Å; F584-M588 HydrophobicContact CE2-CE 4.47Å; F584-M588 HydrophobicContact CE2-CG 4.39Å; F584-M588 HydrophobicContact CE2-SD 3.95Å; F584-M588 HydrophobicContact CG-CE 3.95Å; F584-M588 HydrophobicContact CG-SD 4.46Å; F584-M588 HydrophobicContact CZ-CE 3.84Å; F584-M588 HydrophobicContact CZ-CG 4.35Å; F584-M588 HydrophobicContact CZ-SD 3.35Å; F584-M588 WeakPolarHBondContact CZ-SD 3.28Å; F584-M588 WeakPolarHBondContact O-CG 3.36Å; F584-M588 PolarHBondContact O-N 3.28Å; N585-M588 HydrophobicContact CB-CE 4.34Å; N585-M588 PolarHBondContact O-N 3Å; N585-M588 WeakPolarHBondContact OD1-CE 3.06Å; M588-A590 PolarHBondContact O-N 2.81Å; M588-T591 PolarHBondContact O-N 2.85Å; M588-T591 PolarHBondContact O-OG1 2.89Å; M588-M592 WeakPolarHBondContact O-CB 3.42Å; M588-M592 VanDerWaalsContact O-CG 3.25Å; M588-M592 WeakPolarHBondContact O-CG 3.28Å; M588-M592 PolarHBondContact O-N 3.47Å
589	L	82.6	Confident	83.4	Confident	19 Å²	19	63.2 Å²	63.2	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-46.5	177.2	-178.2	54.1	0	0	0	112.1	N585 M586 A587 T591 M592 V593 L613 S616 L621	N585-L589 VanDerWaalsContact O-CB 3.31Å; N585-L589 WeakPolarHBondContact O-CB 3.33Å; N585-L589 PolarHBondContact O-N 3.08Å; M586-L589 PolarHBondContact O-N 2.85Å; A587-L589 PolarHBondContact O-N 2.91Å; L589-T591 VanDerWaalsContact C-N 3.34Å; L589-T591 PolarHBondContact O-N 2.04Å; L589-M592 PolarHBondContact O-N 3.14Å; L589-V593 HydrophobicContact CD1-CG2 4.13Å; L589-V593 WeakPolarHBondContact O-CG2 3.44Å; L589-V593 PolarHBondContact O-N 2.93Å; L589-L613 HydrophobicContact CD1-CD1 3.69Å; L589-L613 HydrophobicContact CD2-CD1 4.26Å; L589-L613 HydrophobicContact CG-CD1 4.34Å; L589-S616 VanDerWaalsContact CD1-CB 3.5Å; L589-S616 WeakPolarHBondContact CD1-OG 3.22Å; L589-L621 HydrophobicContact CD2-CD1 4.4Å
590	A	84.8	Confident	82.3	Confident	56 Å²	56	68.2 Å²	68.2	46%	0.463	35%	0.351	S	S	.	.	H	α-helix	trans	-58.9	-45.7	178.4	0	0	0	0	0	111.6	M586 A587 M588 V593 V594	M586-A590 WeakPolarHBondContact O-CB 3.31Å; M586-A590 PolarHBondContact O-N 3.22Å; A587-A590 PolarHBondContact O-N 3Å; M588-A590 PolarHBondContact O-N 2.81Å; A590-V593 PolarHBondContact O-N 2.72Å; A590-V594 VanDerWaalsContact O-CG2 3.32Å; A590-V594 WeakPolarHBondContact O-CG2 3.4Å; A590-V594 PolarHBondContact O-N 3.05Å
591	T	84.7	Confident	80.6	Confident	58 Å²	58	68.4 Å²	68.4	36%	0.356	36%	0.359	S	S	.	.	H	α-helix	trans	-65.6	-40.1	177.6	60.6	0	0	0	0	112.6	Y501 A587 M588 L589 V594 Q595	Y501-T591 WeakPolarHBondContact CD2-OG1 3.33Å; Y501-T591 VanDerWaalsContact CE2-OG1 3.27Å; Y501-T591 WeakPolarHBondContact CE2-OG1 3.36Å; A587-T591 WeakPolarHBondContact O-CG2 3.45Å; A587-T591 PolarHBondContact O-N 2.75Å; A587-T591 VanDerWaalsContact O-N 3.08Å; A587-T591 PolarHBondContact O-OG1 2.83Å; M588-T591 PolarHBondContact O-N 2.85Å; M588-T591 PolarHBondContact O-OG1 2.89Å; L589-T591 VanDerWaalsContact C-N 3.34Å; L589-T591 PolarHBondContact O-N 2.04Å; T591-V594 PolarHBondContact O-N 3.41Å; T591-Q595 WeakPolarHBondContact O-CB 3.31Å; T591-Q595 VanDerWaalsContact O-CG 3.29Å; T591-Q595 WeakPolarHBondContact O-CG 3.46Å; T591-Q595 PolarHBondContact O-N 2.94Å
592	M	80.9	Confident	78.9	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.02	39%	0.389	C	S	.	.	H	α-helix	trans	-61.1	-45.6	174.6	-73	168.8	64.3	0	0	111.5	L500 Y501 V504 V505 M588 L589 Q595 I596 L612	L500-M592 HydrophobicContact CB-CE 3.86Å; L500-M592 HydrophobicContact CB-SD 4.21Å; Y501-M592 HydrophobicContact CD2-CG 4.32Å; V504-M592 HydrophobicContact CB-CG 4.36Å; V504-M592 HydrophobicContact CG2-CE 3.91Å; V505-M592 HydrophobicContact CG2-CG 4.43Å; M588-M592 WeakPolarHBondContact O-CB 3.42Å; M588-M592 VanDerWaalsContact O-CG 3.25Å; M588-M592 WeakPolarHBondContact O-CG 3.28Å; M588-M592 PolarHBondContact O-N 3.47Å; L589-M592 PolarHBondContact O-N 3.14Å; M592-Q595 PolarHBondContact O-N 2.86Å; M592-I596 WeakPolarHBondContact O-CB 3.46Å; M592-I596 WeakPolarHBondContact O-CD1 3.37Å; M592-I596 WeakPolarHBondContact O-CG1 3.4Å; M592-I596 PolarHBondContact O-N 2.78Å; M592-L612 HydrophobicContact CE-CD2 3.82Å; M592-L612 HydrophobicContact CE-CG 4.31Å
593	V	79.9	Confident	77.1	Confident	53 Å²	53	79.3 Å²	79.3	32%	0.321	42%	0.417	S	S	.	.	H	α-helix	trans	-61.1	-47.8	177.6	169.8	0	0	0	0	110.6	L589 A590 Q595 I596 L597 L613	L589-V593 HydrophobicContact CD1-CG2 4.13Å; L589-V593 WeakPolarHBondContact O-CG2 3.44Å; L589-V593 PolarHBondContact O-N 2.93Å; A590-V593 PolarHBondContact O-N 2.72Å; V593-Q595 VanDerWaalsContact C-N 3.33Å; V593-Q595 PolarHBondContact O-N 2.85Å; V593-I596 PolarHBondContact O-N 2.65Å; V593-L597 HydrophobicContact CG1-CD1 3.76Å; V593-L597 HydrophobicContact CG1-CG 4.28Å; V593-L597 WeakPolarHBondContact O-CB 3.29Å; V593-L597 VanDerWaalsContact O-CG 3.23Å; V593-L597 WeakPolarHBondContact O-CG 3.29Å; V593-L597 PolarHBondContact O-N 2.83Å; V593-L613 HydrophobicContact CG2-CD1 4.2Å
594	V	83.4	Confident	75	Confident	65 Å²	65	82 Å²	82	39%	0.394	43%	0.427	S	S	.	.	H	α-helix	trans	-58.5	-45.1	177.5	170.2	0	0	0	0	111.3	A590 T591 L597 R598	A590-V594 VanDerWaalsContact O-CG2 3.32Å; A590-V594 WeakPolarHBondContact O-CG2 3.4Å; A590-V594 PolarHBondContact O-N 3.05Å; T591-V594 PolarHBondContact O-N 3.41Å; V594-L597 PolarHBondContact O-N 2.79Å; V594-R598 WeakPolarHBondContact O-CB 3.36Å; V594-R598 VanDerWaalsContact O-CG 3.24Å; V594-R598 WeakPolarHBondContact O-CG 3.4Å; V594-R598 PolarHBondContact O-N 2.63Å
595	Q	79.8	Confident	73.4	Confident	59 Å²	59	82.7 Å²	82.7	28%	0.276	43%	0.429	S	S	.	.	H	α-helix	trans	-68.1	-40.8	179.8	-70	-69	1.7	0	0	112.5	V505 T591 M592 V593 R598 L599	V505-Q595 HydrophobicContact CG1-CG 4.17Å; V505-Q595 HydrophobicContact CG2-CB 4.27Å; V505-Q595 HydrophobicContact CG2-CG 3.94Å; T591-Q595 WeakPolarHBondContact O-CB 3.31Å; T591-Q595 VanDerWaalsContact O-CG 3.29Å; T591-Q595 WeakPolarHBondContact O-CG 3.46Å; T591-Q595 PolarHBondContact O-N 2.94Å; M592-Q595 PolarHBondContact O-N 2.86Å; V593-Q595 VanDerWaalsContact C-N 3.33Å; V593-Q595 PolarHBondContact O-N 2.85Å; Q595-R598 PolarHBondContact O-N 2.86Å; Q595-L599 WeakPolarHBondContact O-CB 3.28Å; Q595-L599 WeakPolarHBondContact O-CD1 3.42Å; Q595-L599 WeakPolarHBondContact O-CG 3.31Å; Q595-L599 PolarHBondContact O-N 2.64Å
596	I	75	Confident	71.9	Confident	33 Å²	33	92.9 Å²	92.9	17%	0.169	47%	0.467	C	S	.	.	H	α-helix	trans	-62.1	-44.5	175.9	-72.1	167.4	0	0	0	110.8	V504 M592 V593 R598 L599 R600 V609 L612	V504-I596 HydrophobicContact CG1-CD1 4.2Å; V504-I596 HydrophobicContact CG1-CG1 3.86Å; M592-I596 WeakPolarHBondContact O-CB 3.46Å; M592-I596 WeakPolarHBondContact O-CD1 3.37Å; M592-I596 WeakPolarHBondContact O-CG1 3.4Å; M592-I596 PolarHBondContact O-N 2.78Å; V593-I596 PolarHBondContact O-N 2.65Å; I596-R598 VanDerWaalsContact C-N 3.31Å; I596-R598 PolarHBondContact O-N 3.12Å; I596-L599 PolarHBondContact O-N 3.43Å; I596-R600 PolarHBondContact O-N 3.43Å; I596-R600 VanDerWaalsContact O-N 3.15Å; I596-V609 HydrophobicContact CG2-CB 4.26Å; I596-V609 HydrophobicContact CG2-CG1 3.8Å; I596-V609 HydrophobicContact CG2-CG2 3.46Å; I596-V609 VanDerWaalsContact CG2-CG2 3.46Å; I596-L612 HydrophobicContact CD1-CD2 4.25Å
597	L	74.9	Confident	70.5	Confident	116 Å²	116	92.8 Å²	92.8	61%	0.607	47%	0.473	S	S	*	.	H	α-helix	trans	-63.2	-36.3	176.3	-70.1	172.8	0	0	0	111.9	V593 V594	V593-L597 HydrophobicContact CG1-CD1 3.76Å; V593-L597 HydrophobicContact CG1-CG 4.28Å; V593-L597 WeakPolarHBondContact O-CB 3.29Å; V593-L597 VanDerWaalsContact O-CG 3.23Å; V593-L597 WeakPolarHBondContact O-CG 3.29Å; V593-L597 PolarHBondContact O-N 2.83Å; V594-L597 PolarHBondContact O-N 2.79Å
598	R	76.7	Confident	69.1	Low	179 Å²	179	94 Å²	94	68%	0.675	47%	0.47	S	S	*	.	H	α-helix	trans	-68.6	-39.4	175	-74.1	172.4	-177.3	-170.5	1.8	113.1	V594 Q595 I596	V594-R598 WeakPolarHBondContact O-CB 3.36Å; V594-R598 VanDerWaalsContact O-CG 3.24Å; V594-R598 WeakPolarHBondContact O-CG 3.4Å; V594-R598 PolarHBondContact O-N 2.63Å; Q595-R598 PolarHBondContact O-N 2.86Å; I596-R598 VanDerWaalsContact C-N 3.31Å; I596-R598 PolarHBondContact O-N 3.12Å
599	L	70.8	Confident	67.8	Low	123 Å²	123	95.3 Å²	95.3	64%	0.644	48%	0.478	S	S	*	.	H	α-helix	trans	-83.9	-23.1	-172.6	-76.8	159.5	0	0	0	114.5	Q595 I596	Q595-L599 WeakPolarHBondContact O-CB 3.28Å; Q595-L599 WeakPolarHBondContact O-CD1 3.42Å; Q595-L599 WeakPolarHBondContact O-CG 3.31Å; Q595-L599 PolarHBondContact O-N 2.64Å; I596-L599 PolarHBondContact O-N 3.43Å
600	R	64.8	Low	66.8	Low	140 Å²	140	100.1 Å²	100.1	53%	0.528	50%	0.503	S	S	.	.			trans	-138.1	77.3	-176.9	-74.7	-168.9	-176.2	158.9	7.8	113.9	I596 K605	I596-R600 PolarHBondContact O-N 3.43Å; I596-R600 VanDerWaalsContact O-N 3.15Å; R600-K605 VanDerWaalsContact NH1-CD 3.28Å
601	P	55.4	Low	65.8	Low	115 Å²	115	99 Å²	99	75%	0.747	49%	0.49	S	S	*	.			trans	-75.1	-23.3	175.5	26.7	-31.3	0	0	0	113.9
602	H	52.9	Low	64.9	Low	165 Å²	165	98 Å²	98	76%	0.764	48%	0.483	S	S	*	.	S	Bend	trans	-149.7	133.1	-167.4	-139	12.9	0	0	0	113.4
603	T	48	Very low	64	Low	122 Å²	122	101.1 Å²	101.1	75%	0.748	50%	0.499	S	S	*	.	S	Bend	trans	77.6	107.6	167.4	70.5	0	0	0	0	117.3
604	Q	46.5	Very low	63.4	Low	174 Å²	174	99.7 Å²	99.7	81%	0.813	50%	0.496	S	S	*	.	S	Bend	trans	64.8	120.3	166.5	-139.3	98	-24.4	0	0	117
605	K	54	Low	62.5	Low	106 Å²	106	97 Å²	97	46%	0.461	48%	0.479	S	S	.	.			trans	118.1	25.7	167.3	-61.4	167	178.5	179.8	0	117.4	R600 S607 H608 V609	R600-K605 VanDerWaalsContact NH1-CD 3.28Å; K605-S607 PolarHBondContact O-N 3.19Å; K605-S607 VanDerWaalsContact O-N 3.16Å; K605-H608 PolarHBondContact O-N 3.08Å; K605-H608 VanDerWaalsContact O-N 3.14Å; K605-V609 PolarHBondContact O-N 3.49Å
606	W	55.3	Low	62	Low	223 Å²	223	94.7 Å²	94.7	85%	0.845	47%	0.469	S	S	*	.	H	α-helix	trans	-49.1	-34.1	161.2	-88.9	92.3	0	0	0	112.8	H608 V609 L610	W606-H608 PolarHBondContact O-N 3.18Å; W606-V609 PolarHBondContact O-N 3.15Å; W606-L610 WeakPolarHBondContact O-CB 3.15Å; W606-L610 PolarHBondContact O-N 3.26Å
607	S	56.9	Low	61.3	Low	69 Å²	69	97.2 Å²	97.2	48%	0.483	48%	0.482	S	S	.	.	H	α-helix	trans	-58.1	-44	176.7	174.9	0	0	0	0	113.6	K605 T611	K605-S607 PolarHBondContact O-N 3.19Å; K605-S607 VanDerWaalsContact O-N 3.16Å; S607-T611 VanDerWaalsContact O-CB 3.31Å; S607-T611 WeakPolarHBondContact O-CB 3.49Å; S607-T611 PolarHBondContact O-N 2.94Å; S607-T611 PolarHBondContact O-OG1 2.87Å
608	H	58.4	Low	60.9	Low	84 Å²	84	93.4 Å²	93.4	39%	0.389	46%	0.464	S	S	.	.	H	α-helix	trans	-72.8	-33.7	-179.8	-65.8	-48.4	0	0	0	112.5	K605 W606 T611 L612	K605-H608 PolarHBondContact O-N 3.08Å; K605-H608 VanDerWaalsContact O-N 3.14Å; W606-H608 PolarHBondContact O-N 3.18Å; H608-T611 PolarHBondContact O-N 2.95Å; H608-L612 WeakPolarHBondContact O-CB 3.49Å; H608-L612 PolarHBondContact O-N 3.06Å
609	V	58.3	Low	60.5	Low	39 Å²	39	85.2 Å²	85.2	24%	0.236	43%	0.434	C	S	.	.	H	α-helix	trans	-65.9	-47.8	174.8	177.9	0	0	0	0	110.1	I596 K605 W606 T611 L612 L613	I596-V609 HydrophobicContact CG2-CB 4.26Å; I596-V609 HydrophobicContact CG2-CG1 3.8Å; I596-V609 HydrophobicContact CG2-CG2 3.46Å; I596-V609 VanDerWaalsContact CG2-CG2 3.46Å; K605-V609 PolarHBondContact O-N 3.49Å; W606-V609 PolarHBondContact O-N 3.15Å; V609-T611 VanDerWaalsContact C-N 3.28Å; V609-T611 PolarHBondContact O-N 2.85Å; V609-L612 PolarHBondContact O-N 3.48Å; V609-L613 WeakPolarHBondContact O-CB 3.17Å; V609-L613 PolarHBondContact O-N 2.91Å
610	L	60.7	Low	60.3	Low	119 Å²	119	79.7 Å²	79.7	62%	0.623	41%	0.406	S	S	*	.	H	α-helix	trans	-61.6	-38	177.2	-173	64.1	0	0	0	111.8	W606 G614	W606-L610 WeakPolarHBondContact O-CB 3.15Å; W606-L610 PolarHBondContact O-N 3.26Å; L610-G614 WeakPolarHBondContact O-CA 3.44Å; L610-G614 PolarHBondContact O-N 3.26Å
611	T	63.5	Low	60.5	Low	32 Å²	32	75.5 Å²	75.5	20%	0.196	39%	0.394	C	S	.	.	H	α-helix	trans	-69	-40.7	177.7	-56.9	0	0	0	0	112.1	S607 H608 V609 L615 M661	S607-T611 VanDerWaalsContact O-CB 3.31Å; S607-T611 WeakPolarHBondContact O-CB 3.49Å; S607-T611 PolarHBondContact O-N 2.94Å; S607-T611 PolarHBondContact O-OG1 2.87Å; H608-T611 PolarHBondContact O-N 2.95Å; V609-T611 VanDerWaalsContact C-N 3.28Å; V609-T611 PolarHBondContact O-N 2.85Å; T611-L615 PolarHBondContact O-N 2.9Å; T611-L615 VanDerWaalsContact O-N 3.1Å; T611-M661 HydrophobicContact CG2-SD 4.26Å
612	L	66.2	Low	61.3	Low	38 Å²	38	70.5 Å²	70.5	20%	0.199	36%	0.362	C	S	.	.	H	α-helix	trans	-73.4	-39	179	-151.7	78.8	0	0	0	111.6	L500 V504 M592 I596 H608 V609 L615 S616	L500-L612 HydrophobicContact CD2-CD1 4.28Å; V504-L612 HydrophobicContact CG2-CD2 3.49Å; V504-L612 VanDerWaalsContact CG2-CD2 3.49Å; M592-L612 HydrophobicContact CE-CD2 3.82Å; M592-L612 HydrophobicContact CE-CG 4.31Å; I596-L612 HydrophobicContact CD1-CD2 4.25Å; H608-L612 WeakPolarHBondContact O-CB 3.49Å; H608-L612 PolarHBondContact O-N 3.06Å; V609-L612 PolarHBondContact O-N 3.48Å; L612-L615 PolarHBondContact O-N 2.74Å; L612-S616 PolarHBondContact O-N 2.69Å; L612-S616 VanDerWaalsContact O-N 3.09Å
613	L	62.6	Low	62.4	Low	69 Å²	69	64 Å²	64	36%	0.361	33%	0.33	S	S	.	.	H	α-helix	trans	-63.1	-44.9	172.1	178.8	59.3	0	0	0	110.9	L589 V593 V609 L615 S616 L617	L589-L613 HydrophobicContact CD1-CD1 3.69Å; L589-L613 HydrophobicContact CD2-CD1 4.26Å; L589-L613 HydrophobicContact CG-CD1 4.34Å; V593-L613 HydrophobicContact CG2-CD1 4.2Å; V609-L613 WeakPolarHBondContact O-CB 3.17Å; V609-L613 PolarHBondContact O-N 2.91Å; L613-L615 VanDerWaalsContact C-N 3.28Å; L613-L615 PolarHBondContact O-N 2.83Å; L613-S616 PolarHBondContact O-N 2.89Å; L613-L617 VanDerWaalsContact O-CB 3.22Å; L613-L617 WeakPolarHBondContact O-CB 3.4Å; L613-L617 PolarHBondContact O-N 2.91Å
614	G	66.5	Low	63.6	Low	24 Å²	24	58.4 Å²	58.4	25%	0.247	30%	0.297	C	S	.	.	H	α-helix	trans	-59.5	-37.4	175.6	0	0	0	0	0	112.6	L610 L617 V618	L610-G614 WeakPolarHBondContact O-CA 3.44Å; L610-G614 PolarHBondContact O-N 3.26Å; G614-L617 WeakPolarHBondContact O-CB 3.47Å; G614-L617 PolarHBondContact O-N 2.79Å; G614-V618 WeakPolarHBondContact O-CB 3.41Å; G614-V618 WeakPolarHBondContact O-CG2 3.22Å; G614-V618 PolarHBondContact O-N 2.93Å
615	L	65.9	Low	65.1	Low	8 Å²	8	51.9 Å²	51.9	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-70.9	-43.7	176.7	-168.9	128.2	0	0	0	112.4	L500 T611 L612 L613 L617 V618 L619 W657	L500-L615 HydrophobicContact CD1-CD2 3.32Å; L500-L615 HydrophobicContact CD2-CD2 4.23Å; L500-L615 HydrophobicContact CG-CD2 4.37Å; T611-L615 PolarHBondContact O-N 2.9Å; T611-L615 VanDerWaalsContact O-N 3.1Å; L612-L615 PolarHBondContact O-N 2.74Å; L613-L615 VanDerWaalsContact C-N 3.28Å; L613-L615 PolarHBondContact O-N 2.83Å; L615-L617 PolarHBondContact O-N 2.86Å; L615-V618 PolarHBondContact O-N 3.05Å; L615-L619 HydrophobicContact CD2-CD1 3.6Å; L615-L619 HydrophobicContact CG-CD1 4.1Å; L615-L619 WeakPolarHBondContact O-CB 3.34Å; L615-L619 WeakPolarHBondContact O-CG 2.87Å; L615-L619 PolarHBondContact O-N 2.67Å; L615-L619 VanDerWaalsContact O-N 3.12Å; L615-W657 HydrophobicContact CD1-CD2 3.21Å; L615-W657 HydrophobicContact CD1-CE3 3.39Å; L615-W657 HydrophobicContact CD1-CG 3.85Å; L615-W657 HydrophobicContact CD1-CH2 3.56Å; L615-W657 HydrophobicContact CD1-CZ2 3.4Å; L615-W657 VanDerWaalsContact CD1-CZ2 3.4Å; L615-W657 HydrophobicContact CD1-CZ3 3.55Å
616	S	68	Low	66.1	Low	11 Å²	11	49.8 Å²	49.8	8%	0.077	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-32.6	173.1	-171.6	0	0	0	0	112.4	L589 L612 L613	L589-S616 VanDerWaalsContact CD1-CB 3.5Å; L589-S616 WeakPolarHBondContact CD1-OG 3.22Å; L612-S616 PolarHBondContact O-N 2.69Å; L612-S616 VanDerWaalsContact O-N 3.09Å; L613-S616 PolarHBondContact O-N 2.89Å
617	L	62	Low	67	Low	85 Å²	85	42.9 Å²	42.9	45%	0.445	24%	0.237	S	C	.	.	H	α-helix	trans	-66.6	-53.4	176	-179.8	70.4	0	0	0	109.9	L613 G614 L615 L619 G620 L621 P622	L613-L617 VanDerWaalsContact O-CB 3.22Å; L613-L617 WeakPolarHBondContact O-CB 3.4Å; L613-L617 PolarHBondContact O-N 2.91Å; G614-L617 WeakPolarHBondContact O-CB 3.47Å; G614-L617 PolarHBondContact O-N 2.79Å; L615-L617 PolarHBondContact O-N 2.86Å; L617-L619 PolarHBondContact O-N 2.81Å; L617-G620 PolarHBondContact O-N 2.82Å; L617-L621 HydrophobicContact CD1-CB 3.61Å; L617-L621 HydrophobicContact CD1-CD1 3.14Å; L617-L621 HydrophobicContact CD1-CG 3.93Å; L617-L621 HydrophobicContact CG-CD1 4.41Å; L617-L621 PolarHBondContact O-N 2.82Å; L617-L621 VanDerWaalsContact O-N 3.09Å; L617-P622 WeakPolarHBondContact O-CD 3.33Å
618	V	64.7	Low	67.7	Low	37 Å²	37	45.2 Å²	45.2	22%	0.224	24%	0.238	C	C	.	.	H	α-helix	trans	-56.7	-32.5	178.3	169.9	0	0	0	0	112.2	G614 L615 L653 I654	G614-V618 WeakPolarHBondContact O-CB 3.41Å; G614-V618 WeakPolarHBondContact O-CG2 3.22Å; G614-V618 PolarHBondContact O-N 2.93Å; L615-V618 PolarHBondContact O-N 3.05Å; V618-L653 HydrophobicContact CG1-CB 4.4Å; V618-I654 HydrophobicContact CG1-CG1 4.49Å
619	L	68.3	Low	68.1	Low	6 Å²	6	42.8 Å²	42.8	3%	0.031	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.4	-176	-67.1	174.1	0	0	0	116	L449 M493 E496 L615 L617 I654	L449-L619 HydrophobicContact CD2-CD2 3.35Å; M493-L619 VanDerWaalsContact CE-C 3.49Å; M493-L619 WeakPolarHBondContact CE-O 3.32Å; M493-L619 HydrophobicContact CG-CD2 4.48Å; E496-L619 HydrophobicContact CB-CD1 4.25Å; E496-L619 HydrophobicContact CG-CD1 3.68Å; L615-L619 HydrophobicContact CD2-CD1 3.6Å; L615-L619 HydrophobicContact CG-CD1 4.1Å; L615-L619 WeakPolarHBondContact O-CB 3.34Å; L615-L619 WeakPolarHBondContact O-CG 2.87Å; L615-L619 PolarHBondContact O-N 2.67Å; L615-L619 VanDerWaalsContact O-N 3.12Å; L617-L619 PolarHBondContact O-N 2.81Å; L619-I654 HydrophobicContact CD2-CD1 4.23Å
620	G	67.5	Low	68.3	Low	7 Å²	7	50 Å²	50	7%	0.072	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-157.3	-33.5	-178.6	0	0	0	0	0	116.7	L617 A624	L617-G620 PolarHBondContact O-N 2.82Å; G620-A624 PolarHBondContact O-N 2.82Å
621	L	68.2	Low	68.2	Low	52 Å²	52	46 Å²	46	27%	0.272	24%	0.243	S	C	.	.	H	α-helix	trans	-77.9	-35.4	-174.4	-85.7	164.4	0	0	0	114.9	F582 M586 L589 L617 W623 A624	F582-L621 HydrophobicContact CE2-CD2 3.93Å; F582-L621 HydrophobicContact CE2-CG 4.46Å; F582-L621 HydrophobicContact CZ-CD2 4.29Å; M586-L621 HydrophobicContact CE-CD2 4.43Å; M586-L621 HydrophobicContact SD-CD1 4.1Å; M586-L621 HydrophobicContact SD-CD2 3.82Å; M586-L621 HydrophobicContact SD-CG 3.97Å; L589-L621 HydrophobicContact CD2-CD1 4.4Å; L617-L621 HydrophobicContact CD1-CB 3.61Å; L617-L621 HydrophobicContact CD1-CD1 3.14Å; L617-L621 HydrophobicContact CD1-CG 3.93Å; L617-L621 HydrophobicContact CG-CD1 4.41Å; L617-L621 PolarHBondContact O-N 2.82Å; L617-L621 VanDerWaalsContact O-N 3.09Å; L621-W623 PolarHBondContact O-N 3.05Å; L621-A624 HydrophobicContact CD2-CB 4.42Å; L621-A624 WeakPolarHBondContact O-CA 3.21Å; L621-A624 WeakPolarHBondContact O-CB 3.25Å; L621-A624 PolarHBondContact O-N 2.95Å
622	P	72.9	Confident	68	Low	11 Å²	11	48.7 Å²	48.7	7%	0.071	26%	0.264	C	S	.	.	H	α-helix	trans	-56.5	-37.2	172.2	-27.7	34	0	0	0	112	L617 A624 L625 F643 I646	L617-P622 WeakPolarHBondContact O-CD 3.33Å; P622-A624 VanDerWaalsContact C-N 3.28Å; P622-A624 PolarHBondContact O-N 2.86Å; P622-L625 WeakPolarHBondContact O-CB 3.35Å; P622-L625 VanDerWaalsContact O-CG 3.24Å; P622-L625 WeakPolarHBondContact O-CG 3.34Å; P622-L625 PolarHBondContact O-N 3.38Å; P622-F643 WeakPolarHBondContact O-CD2 3.36Å; P622-I646 HydrophobicContact CB-CB 3.79Å; P622-I646 HydrophobicContact CB-CD1 4.06Å; P622-I646 HydrophobicContact CB-CG2 3.32Å; P622-I646 HydrophobicContact CG-CB 4.19Å; P622-I646 HydrophobicContact CG-CD1 4.26Å; P622-I646 HydrophobicContact CG-CG2 3.25Å
623	W	75.6	Confident	68	Low	27 Å²	27	48.5 Å²	48.5	10%	0.102	27%	0.271	C	S	.	.	H	α-helix	trans	-68.5	-29.2	176.9	-66.8	82.9	0	0	0	112.5	L486 M493 F578 L621 L625 I626 F643 T647	L486-W623 HydrophobicContact CD1-CH2 3.83Å; L486-W623 HydrophobicContact CD1-CZ3 4.08Å; M493-W623 VanDerWaalsContact CE-CD1 3.48Å; M493-W623 HydrophobicContact CE-CG 4.46Å; F578-W623 HydrophobicContact CD2-CB 4.11Å; F578-W623 HydrophobicContact CE1-CB 4.38Å; F578-W623 HydrophobicContact CE2-CB 3.11Å; F578-W623 AromaticContact CE2-CG 3.98Å; F578-W623 HydrophobicContact CE2-CG 3.98Å; F578-W623 HydrophobicContact CZ-CB 3.29Å; F578-W623 VanDerWaalsContact CZ-O 3.3Å; F578-W623 WeakPolarHBondContact CZ-O 3.28Å; L621-W623 PolarHBondContact O-N 3.05Å; W623-L625 PolarHBondContact O-N 2.86Å; W623-I626 WeakPolarHBondContact O-CB 3.31Å; W623-I626 WeakPolarHBondContact O-CG2 3.28Å; W623-I626 PolarHBondContact O-N 3.21Å; W623-F643 HydrophobicContact CD2-CE2 4.38Å; W623-F643 HydrophobicContact CE3-CE2 4.01Å; W623-F643 HydrophobicContact CE3-CZ 4.17Å; W623-F643 HydrophobicContact CZ3-CZ 4.27Å; W623-T647 HydrophobicContact CD2-CG2 4.15Å; W623-T647 HydrophobicContact CZ2-CG2 4.14Å
624	A	74.4	Confident	68.4	Low	5 Å²	5	50.7 Å²	50.7	4%	0.041	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-21.4	175.5	0	0	0	0	0	112.9	F582 G620 L621 P622 I626 F627 F628	F582-A624 HydrophobicContact CD2-CB 3.93Å; F582-A624 HydrophobicContact CE1-CB 4.35Å; F582-A624 HydrophobicContact CE2-CB 3.37Å; F582-A624 HydrophobicContact CZ-CB 3.6Å; G620-A624 PolarHBondContact O-N 2.82Å; L621-A624 HydrophobicContact CD2-CB 4.42Å; L621-A624 WeakPolarHBondContact O-CA 3.21Å; L621-A624 WeakPolarHBondContact O-CB 3.25Å; L621-A624 PolarHBondContact O-N 2.95Å; P622-A624 VanDerWaalsContact C-N 3.28Å; P622-A624 PolarHBondContact O-N 2.86Å; A624-I626 PolarHBondContact O-N 3.09Å; A624-I626 VanDerWaalsContact O-N 3.14Å; A624-F627 HydrophobicContact CB-CD2 4.47Å; A624-F627 WeakPolarHBondContact O-CB 3.23Å; A624-F627 PolarHBondContact O-N 2.93Å; A624-F628 WeakPolarHBondContact O-CD2 3.46Å
625	L	77.9	Confident	68.8	Low	38 Å²	38	55 Å²	55	20%	0.199	30%	0.3	C	S	.	.	H	α-helix	trans	-55.3	-27.4	171.1	-61.6	176.7	0	0	0	111.4	P622 W623 F627 F628 S629 V639 L642 F643 I646	P622-L625 WeakPolarHBondContact O-CB 3.35Å; P622-L625 VanDerWaalsContact O-CG 3.24Å; P622-L625 WeakPolarHBondContact O-CG 3.34Å; P622-L625 PolarHBondContact O-N 3.38Å; W623-L625 PolarHBondContact O-N 2.86Å; L625-F627 VanDerWaalsContact C-N 3.28Å; L625-F627 PolarHBondContact O-N 3.42Å; L625-F628 PolarHBondContact O-N 2.63Å; L625-F628 VanDerWaalsContact O-N 3.07Å; L625-S629 PolarHBondContact O-N 2.87Å; L625-V639 HydrophobicContact CB-CG1 3.97Å; L625-V639 WeakPolarHBondContact O-CG1 3.21Å; L625-L642 HydrophobicContact CD1-CB 3.88Å; L625-F643 HydrophobicContact CB-CB 4.13Å; L625-F643 HydrophobicContact CB-CD2 4.38Å; L625-F643 HydrophobicContact CD1-CB 4.42Å; L625-I646 HydrophobicContact CD1-CD1 4.23Å
626	I	74.4	Confident	69.3	Low	61 Å²	61	56.8 Å²	56.8	31%	0.313	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-32.4	176	-150.1	166.2	0	0	0	112.6	L575 F578 W623 A624 F628 S629 F643	L575-I626 HydrophobicContact CD1-CG2 4.3Å; F578-I626 HydrophobicContact CD1-CG2 3.99Å; F578-I626 HydrophobicContact CE1-CG2 3.56Å; F578-I626 HydrophobicContact CZ-CG2 4.43Å; W623-I626 WeakPolarHBondContact O-CB 3.31Å; W623-I626 WeakPolarHBondContact O-CG2 3.28Å; W623-I626 PolarHBondContact O-N 3.21Å; A624-I626 PolarHBondContact O-N 3.09Å; A624-I626 VanDerWaalsContact O-N 3.14Å; I626-F628 VanDerWaalsContact C-N 3.29Å; I626-F628 PolarHBondContact O-N 3.14Å; I626-S629 VanDerWaalsContact O-CB 3.3Å; I626-S629 WeakPolarHBondContact O-CB 3.32Å; I626-S629 PolarHBondContact O-N 3.26Å; I626-S629 PolarHBondContact O-OG 3.46Å; I626-F643 HydrophobicContact CB-CD2 4.48Å; I626-F643 HydrophobicContact CB-CE2 4.2Å; I626-F643 HydrophobicContact CD1-CE2 4.38Å; I626-F643 HydrophobicContact CD1-CZ 4.12Å
627	F	75.1	Confident	69.8	Low	78 Å²	78	58.1 Å²	58.1	34%	0.342	31%	0.314	S	S	.	.	H	α-helix	trans	-68.1	-32.1	174.9	-67.4	-65.3	0	0	0	111.9	L575 F578 S579 F582 A624 L625 S629	L575-F627 HydrophobicContact CD1-CE1 3.92Å; L575-F627 HydrophobicContact CD1-CZ 4.41Å; L575-F627 HydrophobicContact CG-CE1 4.32Å; F578-F627 AromaticContact CD1-CE2 3.84Å; F578-F627 HydrophobicContact CD1-CE2 3.84Å; F578-F627 AromaticContact CD1-CZ 3.7Å; F578-F627 HydrophobicContact CD1-CZ 3.7Å; F578-F627 AromaticContact CE1-CD2 3.88Å; F578-F627 HydrophobicContact CE1-CD2 3.88Å; F578-F627 AromaticContact CE1-CE2 3.2Å; F578-F627 HydrophobicContact CE1-CE2 3.2Å; F578-F627 AromaticContact CE1-CZ 3.57Å; F578-F627 HydrophobicContact CE1-CZ 3.57Å; F578-F627 HydrophobicContact CZ-CE2 4Å; S579-F627 VanDerWaalsContact OG-CZ 3.27Å; S579-F627 WeakPolarHBondContact OG-CZ 3.06Å; F582-F627 HydrophobicContact CD1-CE2 4.07Å; F582-F627 HydrophobicContact CG-CE2 4.41Å; A624-F627 HydrophobicContact CB-CD2 4.47Å; A624-F627 WeakPolarHBondContact O-CB 3.23Å; A624-F627 PolarHBondContact O-N 2.93Å; L625-F627 VanDerWaalsContact C-N 3.28Å; L625-F627 PolarHBondContact O-N 3.42Å; F627-S629 PolarHBondContact O-N 3.01Å
628	F	70.7	Confident	70.9	Confident	118 Å²	118	57.7 Å²	57.7	52%	0.518	31%	0.314	S	S	.	.	H	α-helix	trans	-76.7	-9.4	176.3	-64.9	-76.2	0	0	0	112.9	A624 L625 I626 F630 A631 F635 V639	A624-F628 WeakPolarHBondContact O-CD2 3.46Å; L625-F628 PolarHBondContact O-N 2.63Å; L625-F628 VanDerWaalsContact O-N 3.07Å; I626-F628 VanDerWaalsContact C-N 3.29Å; I626-F628 PolarHBondContact O-N 3.14Å; F628-F630 PolarHBondContact O-N 3.1Å; F628-A631 WeakPolarHBondContact O-CB 3.34Å; F628-A631 PolarHBondContact O-N 2.86Å; F628-F635 HydrophobicContact CB-CE1 4.3Å; F628-V639 HydrophobicContact CB-CG1 4.07Å; F628-V639 HydrophobicContact CB-CG2 4.3Å
629	S	67.7	Low	71.8	Confident	33 Å²	33	56.2 Å²	56.2	23%	0.231	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.2	175.3	76.7	0	0	0	0	114.1	L625 I626 F627 A631 Q636	L625-S629 PolarHBondContact O-N 2.87Å; I626-S629 VanDerWaalsContact O-CB 3.3Å; I626-S629 WeakPolarHBondContact O-CB 3.32Å; I626-S629 PolarHBondContact O-N 3.26Å; I626-S629 PolarHBondContact O-OG 3.46Å; F627-S629 PolarHBondContact O-N 3.01Å; S629-A631 PolarHBondContact O-N 3.46Å; S629-Q636 WeakPolarHBondContact O-CG 3.36Å; S629-Q636 PolarHBondContact O-NE2 2.84Å
630	F	62	Low	72.6	Confident	191 Å²	191	57.9 Å²	57.9	84%	0.838	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-21.7	170.5	-175.3	-93.7	0	0	0	112.5	F628	F628-F630 PolarHBondContact O-N 3.1Å
631	A	57.9	Low	73.6	Confident	35 Å²	35	60.3 Å²	60.3	29%	0.289	32%	0.321	S	S	.	.	S	Bend	trans	-64.4	146.3	173.7	0	0	0	0	0	110.3	F628 S629 F635 Q636	F628-A631 WeakPolarHBondContact O-CB 3.34Å; F628-A631 PolarHBondContact O-N 2.86Å; S629-A631 PolarHBondContact O-N 3.46Å; A631-F635 HydrophobicContact CB-CD1 3.58Å; A631-F635 HydrophobicContact CB-CE1 3.99Å; A631-Q636 WeakPolarHBondContact O-CB 3.49Å; A631-Q636 VanDerWaalsContact O-CG 3.28Å; A631-Q636 WeakPolarHBondContact O-CG 3.15Å; A631-Q636 PolarHBondContact O-OE1 3.46Å
632	S	60.1	Low	74.5	Confident	89 Å²	89	61.7 Å²	61.7	62%	0.622	33%	0.329	S	S	*	.			trans	-98.6	152.6	-177.2	57	0	0	0	0	113
633	G	64.7	Low	75.1	Confident	34 Å²	34	63 Å²	63	35%	0.351	33%	0.333	S	S	.	.	S	Bend	trans	87.4	-152.1	171.6	0	0	0	0	0	115.1	F635 Q636 L637	G633-F635 PolarHBondContact O-N 2.79Å; G633-Q636 VanDerWaalsContact O-CB 3.22Å; G633-Q636 WeakPolarHBondContact O-CB 3.48Å; G633-Q636 PolarHBondContact O-N 3.38Å; G633-Q636 VanDerWaalsContact O-N 3.09Å; G633-L637 PolarHBondContact O-N 2.9Å
634	T	73	Confident	75.6	Confident	115 Å²	115	62 Å²	62	71%	0.706	33%	0.331	S	S	*	.	H	α-helix	trans	-59.2	-31.3	-174.2	-45.7	0	0	0	0	113.3	L637 V638	T634-L637 WeakPolarHBondContact O-CB 3.25Å; T634-L637 PolarHBondContact O-N 2.89Å; T634-V638 WeakPolarHBondContact O-CG2 3.33Å; T634-V638 PolarHBondContact O-N 3.12Å; T634-V638 VanDerWaalsContact O-N 3.11Å
635	F	74.1	Confident	76.3	Confident	115 Å²	115	65.4 Å²	65.4	50%	0.504	35%	0.347	S	S	.	.	H	α-helix	trans	-64.7	-41.1	177	-179.8	-101.4	0	0	0	111.8	F628 A631 G633 L637 V638 V639	F628-F635 HydrophobicContact CB-CE1 4.3Å; A631-F635 HydrophobicContact CB-CD1 3.58Å; A631-F635 HydrophobicContact CB-CE1 3.99Å; G633-F635 PolarHBondContact O-N 2.79Å; F635-L637 VanDerWaalsContact C-N 3.27Å; F635-L637 PolarHBondContact O-N 2.88Å; F635-V638 PolarHBondContact O-N 2.77Å; F635-V639 HydrophobicContact CD1-CG2 4.07Å; F635-V639 HydrophobicContact CE1-CG2 3.69Å; F635-V639 HydrophobicContact CE2-CG2 4.16Å; F635-V639 HydrophobicContact CG-CG2 4.48Å; F635-V639 HydrophobicContact CZ-CG2 3.74Å; F635-V639 WeakPolarHBondContact O-CB 3.39Å; F635-V639 VanDerWaalsContact O-CG2 3.27Å; F635-V639 WeakPolarHBondContact O-CG2 3.29Å; F635-V639 PolarHBondContact O-N 3.04Å
636	Q	76.6	Confident	76.6	Confident	44 Å²	44	65.8 Å²	65.8	21%	0.206	35%	0.349	C	S	.	.	H	α-helix	trans	-56	-45.6	173.9	-164.1	-177	-11.3	0	0	111.3	S629 A631 G633 V639 L640	S629-Q636 WeakPolarHBondContact O-CG 3.36Å; S629-Q636 PolarHBondContact O-NE2 2.84Å; A631-Q636 WeakPolarHBondContact O-CB 3.49Å; A631-Q636 VanDerWaalsContact O-CG 3.28Å; A631-Q636 WeakPolarHBondContact O-CG 3.15Å; A631-Q636 PolarHBondContact O-OE1 3.46Å; G633-Q636 VanDerWaalsContact O-CB 3.22Å; G633-Q636 WeakPolarHBondContact O-CB 3.48Å; G633-Q636 PolarHBondContact O-N 3.38Å; G633-Q636 VanDerWaalsContact O-N 3.09Å; Q636-V639 PolarHBondContact O-N 2.9Å; Q636-L640 HydrophobicContact CG-CD1 4.16Å; Q636-L640 WeakPolarHBondContact O-CB 3.39Å; Q636-L640 VanDerWaalsContact O-CG 3.28Å; Q636-L640 WeakPolarHBondContact O-CG 3.49Å; Q636-L640 PolarHBondContact O-N 2.83Å
637	L	78.9	Confident	77.1	Confident	40 Å²	40	64 Å²	64	21%	0.209	34%	0.341	C	S	.	.	H	α-helix	trans	-59.8	-50	-179.8	-171.4	64.4	0	0	0	111	V395 H399 G633 T634 F635 V639 L640 Y641	V395-L637 HydrophobicContact CG1-CD1 3.96Å; H399-L637 HydrophobicContact CB-CD1 3.94Å; G633-L637 PolarHBondContact O-N 2.9Å; T634-L637 WeakPolarHBondContact O-CB 3.25Å; T634-L637 PolarHBondContact O-N 2.89Å; F635-L637 VanDerWaalsContact C-N 3.27Å; F635-L637 PolarHBondContact O-N 2.88Å; L637-V639 VanDerWaalsContact C-N 3.31Å; L637-V639 PolarHBondContact O-N 3.32Å; L637-L640 PolarHBondContact O-N 2.87Å; L637-Y641 HydrophobicContact CD1-CD2 4.1Å; L637-Y641 HydrophobicContact CD1-CE2 3.69Å; L637-Y641 HydrophobicContact CG-CD2 4.02Å; L637-Y641 HydrophobicContact CG-CE2 3.88Å; L637-Y641 VanDerWaalsContact O-CD2 3.28Å; L637-Y641 WeakPolarHBondContact O-CD2 3.36Å; L637-Y641 PolarHBondContact O-N 3.47Å
638	V	83.8	Confident	77.7	Confident	76 Å²	76	60.4 Å²	60.4	46%	0.461	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-44.7	177.8	174.9	0	0	0	0	111	T634 F635 L640 Y641 L642	T634-V638 WeakPolarHBondContact O-CG2 3.33Å; T634-V638 PolarHBondContact O-N 3.12Å; T634-V638 VanDerWaalsContact O-N 3.11Å; F635-V638 PolarHBondContact O-N 2.77Å; V638-L640 PolarHBondContact O-N 3.01Å; V638-Y641 PolarHBondContact O-N 2.82Å; V638-L642 HydrophobicContact CG1-CD1 4Å; V638-L642 HydrophobicContact CG1-CG 4.43Å; V638-L642 WeakPolarHBondContact O-CG 3.44Å; V638-L642 PolarHBondContact O-N 3.06Å
639	V	84.6	Confident	78.5	Confident	6 Å²	6	57.1 Å²	57.1	4%	0.036	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-43.1	177.4	170	0	0	0	0	111.4	L625 F628 F635 Q636 L637 L642 F643	L625-V639 HydrophobicContact CB-CG1 3.97Å; L625-V639 WeakPolarHBondContact O-CG1 3.21Å; F628-V639 HydrophobicContact CB-CG1 4.07Å; F628-V639 HydrophobicContact CB-CG2 4.3Å; F635-V639 HydrophobicContact CD1-CG2 4.07Å; F635-V639 HydrophobicContact CE1-CG2 3.69Å; F635-V639 HydrophobicContact CE2-CG2 4.16Å; F635-V639 HydrophobicContact CG-CG2 4.48Å; F635-V639 HydrophobicContact CZ-CG2 3.74Å; F635-V639 WeakPolarHBondContact O-CB 3.39Å; F635-V639 VanDerWaalsContact O-CG2 3.27Å; F635-V639 WeakPolarHBondContact O-CG2 3.29Å; F635-V639 PolarHBondContact O-N 3.04Å; Q636-V639 PolarHBondContact O-N 2.9Å; L637-V639 VanDerWaalsContact C-N 3.31Å; L637-V639 PolarHBondContact O-N 3.32Å; V639-L642 PolarHBondContact O-N 2.88Å; V639-F643 VanDerWaalsContact O-CB 3.25Å; V639-F643 WeakPolarHBondContact O-CB 3.29Å; V639-F643 PolarHBondContact O-N 2.79Å
640	L	84.6	Confident	79.4	Confident	41 Å²	41	55.9 Å²	55.9	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-65.7	-40.3	177.7	-72.3	172.7	0	0	0	112.5	V395 L403 Q636 L637 V638 S644	V395-L640 HydrophobicContact CG2-CD1 3.54Å; L403-L640 HydrophobicContact CD1-CB 4.42Å; Q636-L640 HydrophobicContact CG-CD1 4.16Å; Q636-L640 WeakPolarHBondContact O-CB 3.39Å; Q636-L640 VanDerWaalsContact O-CG 3.28Å; Q636-L640 WeakPolarHBondContact O-CG 3.49Å; Q636-L640 PolarHBondContact O-N 2.83Å; L637-L640 PolarHBondContact O-N 2.87Å; V638-L640 PolarHBondContact O-N 3.01Å; L640-S644 VanDerWaalsContact O-CB 3.28Å; L640-S644 WeakPolarHBondContact O-CB 3.47Å; L640-S644 PolarHBondContact O-N 2.92Å
641	Y	88.2	Confident	80.5	Confident	57 Å²	57	46.8 Å²	46.8	22%	0.224	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-47.2	173.7	-88	-79.7	0	0	0	111.9	H399 L403 L406 L637 V638 F643 S644 I645	H399-Y641 AromaticContact CD2-CE2 3.79Å; H399-Y641 PolarHBondContact CD2-OH 3.09Å; L403-Y641 HydrophobicContact CD2-CD1 3.76Å; L403-Y641 HydrophobicContact CD2-CD2 4.27Å; L403-Y641 HydrophobicContact CD2-CE1 3.93Å; L403-Y641 HydrophobicContact CD2-CE2 4.4Å; L403-Y641 HydrophobicContact CD2-CG 3.94Å; L403-Y641 HydrophobicContact CG-CD1 4.5Å; L403-Y641 HydrophobicContact CG-CE1 4.19Å; L403-Y641 HydrophobicContact CG-CE2 4.41Å; L406-Y641 HydrophobicContact CD2-CD1 4.17Å; L637-Y641 HydrophobicContact CD1-CD2 4.1Å; L637-Y641 HydrophobicContact CD1-CE2 3.69Å; L637-Y641 HydrophobicContact CG-CD2 4.02Å; L637-Y641 HydrophobicContact CG-CE2 3.88Å; L637-Y641 VanDerWaalsContact O-CD2 3.28Å; L637-Y641 WeakPolarHBondContact O-CD2 3.36Å; L637-Y641 PolarHBondContact O-N 3.47Å; V638-Y641 PolarHBondContact O-N 2.82Å; Y641-F643 VanDerWaalsContact C-N 3.35Å; Y641-F643 PolarHBondContact O-N 3.15Å; Y641-S644 PolarHBondContact O-N 2.9Å; Y641-I645 WeakPolarHBondContact O-CB 3.24Å; Y641-I645 VanDerWaalsContact O-CG1 3.22Å; Y641-I645 WeakPolarHBondContact O-CG1 3.08Å; Y641-I645 PolarHBondContact O-N 2.83Å
642	L	86.9	Confident	81.9	Confident	82 Å²	82	48.4 Å²	48.4	43%	0.429	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-44.4	178.2	-70.9	174.5	0	0	0	111.5	L625 V638 V639 I646	L625-L642 HydrophobicContact CD1-CB 3.88Å; V638-L642 HydrophobicContact CG1-CD1 4Å; V638-L642 HydrophobicContact CG1-CG 4.43Å; V638-L642 WeakPolarHBondContact O-CG 3.44Å; V638-L642 PolarHBondContact O-N 3.06Å; V639-L642 PolarHBondContact O-N 2.88Å; L642-I646 WeakPolarHBondContact O-CD1 3.49Å; L642-I646 VanDerWaalsContact O-CG1 3.24Å; L642-I646 WeakPolarHBondContact O-CG1 3.42Å; L642-I646 PolarHBondContact O-N 2.96Å
643	F	86.4	Confident	83	Confident	38 Å²	38	47.3 Å²	47.3	17%	0.167	25%	0.249	C	C	.	.	H	α-helix	trans	-58.3	-51.3	174.5	174	-96.4	0	0	0	111	P622 W623 L625 I626 V639 Y641 I645 I646 T647	P622-F643 WeakPolarHBondContact O-CD2 3.36Å; W623-F643 HydrophobicContact CD2-CE2 4.38Å; W623-F643 HydrophobicContact CE3-CE2 4.01Å; W623-F643 HydrophobicContact CE3-CZ 4.17Å; W623-F643 HydrophobicContact CZ3-CZ 4.27Å; L625-F643 HydrophobicContact CB-CB 4.13Å; L625-F643 HydrophobicContact CB-CD2 4.38Å; L625-F643 HydrophobicContact CD1-CB 4.42Å; I626-F643 HydrophobicContact CB-CD2 4.48Å; I626-F643 HydrophobicContact CB-CE2 4.2Å; I626-F643 HydrophobicContact CD1-CE2 4.38Å; I626-F643 HydrophobicContact CD1-CZ 4.12Å; V639-F643 VanDerWaalsContact O-CB 3.25Å; V639-F643 WeakPolarHBondContact O-CB 3.29Å; V639-F643 PolarHBondContact O-N 2.79Å; Y641-F643 VanDerWaalsContact C-N 3.35Å; Y641-F643 PolarHBondContact O-N 3.15Å; F643-I645 PolarHBondContact O-N 2.82Å; F643-I646 PolarHBondContact O-N 2.83Å; F643-T647 HydrophobicContact CD2-CG2 3.86Å; F643-T647 HydrophobicContact CE1-CG2 4.29Å; F643-T647 HydrophobicContact CE2-CG2 3.58Å; F643-T647 HydrophobicContact CG-CG2 4.34Å; F643-T647 HydrophobicContact CZ-CG2 3.8Å; F643-T647 WeakPolarHBondContact O-CB 3.43Å; F643-T647 VanDerWaalsContact O-CG2 3.32Å; F643-T647 WeakPolarHBondContact O-CG2 3.48Å; F643-T647 PolarHBondContact O-N 3.33Å; F643-T647 PolarHBondContact O-OG1 3.32Å
644	S	86.6	Confident	83.7	Confident	6 Å²	6	46 Å²	46	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-45.8	-179.1	179.1	0	0	0	0	112.1	S407 L640 Y641 I646 T647 S648	S407-S644 PolarHBondContact OG-OG 3.34Å; L640-S644 VanDerWaalsContact O-CB 3.28Å; L640-S644 WeakPolarHBondContact O-CB 3.47Å; L640-S644 PolarHBondContact O-N 2.92Å; Y641-S644 PolarHBondContact O-N 2.9Å; S644-I646 PolarHBondContact O-N 2.85Å; S644-T647 PolarHBondContact O-OG1 2.94Å; S644-S648 WeakPolarHBondContact O-CB 3.47Å; S644-S648 PolarHBondContact O-N 3.46Å; S644-S648 PolarHBondContact O-OG 2.95Å
645	I	87.5	Confident	84.1	Confident	76 Å²	76	42.9 Å²	42.9	39%	0.39	21%	0.211	S	C	.	.	H	α-helix	trans	-60.1	-50	177.8	-67.7	165.8	0	0	0	110.6	L406 Y641 F643 S648 F649	L406-I645 HydrophobicContact CD1-CG1 4.48Å; L406-I645 HydrophobicContact CD2-CD1 4.37Å; L406-I645 HydrophobicContact CD2-CG1 3.6Å; L406-I645 HydrophobicContact CG-CG1 4.38Å; Y641-I645 WeakPolarHBondContact O-CB 3.24Å; Y641-I645 VanDerWaalsContact O-CG1 3.22Å; Y641-I645 WeakPolarHBondContact O-CG1 3.08Å; Y641-I645 PolarHBondContact O-N 2.83Å; F643-I645 PolarHBondContact O-N 2.82Å; I645-S648 PolarHBondContact O-OG 3.24Å; I645-F649 WeakPolarHBondContact O-CB 3.45Å; I645-F649 VanDerWaalsContact O-CD2 3.28Å; I645-F649 WeakPolarHBondContact O-CD2 2.96Å; I645-F649 PolarHBondContact O-N 2.96Å
646	I	84.9	Confident	84.4	Confident	47 Å²	47	41.4 Å²	41.4	24%	0.241	21%	0.207	C	C	.	.	H	α-helix	trans	-72.9	-38.4	-172.7	-58.6	162.5	0	0	0	111.5	P622 L625 L642 F643 S644 Q650 L653	P622-I646 HydrophobicContact CB-CB 3.79Å; P622-I646 HydrophobicContact CB-CD1 4.06Å; P622-I646 HydrophobicContact CB-CG2 3.32Å; P622-I646 HydrophobicContact CG-CB 4.19Å; P622-I646 HydrophobicContact CG-CD1 4.26Å; P622-I646 HydrophobicContact CG-CG2 3.25Å; L625-I646 HydrophobicContact CD1-CD1 4.23Å; L642-I646 WeakPolarHBondContact O-CD1 3.49Å; L642-I646 VanDerWaalsContact O-CG1 3.24Å; L642-I646 WeakPolarHBondContact O-CG1 3.42Å; L642-I646 PolarHBondContact O-N 2.96Å; F643-I646 PolarHBondContact O-N 2.83Å; S644-I646 PolarHBondContact O-N 2.85Å; I646-Q650 WeakPolarHBondContact O-CA 3.5Å; I646-Q650 PolarHBondContact O-N 3.47Å; I646-Q650 VanDerWaalsContact O-N 3.16Å; I646-L653 HydrophobicContact CG2-CD1 4.12Å
647	T	84.9	Confident	84.4	Confident	24 Å²	24	42 Å²	42	15%	0.147	21%	0.208	C	C	.	.	H	α-helix	trans	-73.3	-44.4	-179.5	54.7	0	0	0	0	112.2	W623 F643 S644 F649 Q650	W623-T647 HydrophobicContact CD2-CG2 4.15Å; W623-T647 HydrophobicContact CZ2-CG2 4.14Å; F643-T647 HydrophobicContact CD2-CG2 3.86Å; F643-T647 HydrophobicContact CE1-CG2 4.29Å; F643-T647 HydrophobicContact CE2-CG2 3.58Å; F643-T647 HydrophobicContact CG-CG2 4.34Å; F643-T647 HydrophobicContact CZ-CG2 3.8Å; F643-T647 WeakPolarHBondContact O-CB 3.43Å; F643-T647 VanDerWaalsContact O-CG2 3.32Å; F643-T647 WeakPolarHBondContact O-CG2 3.48Å; F643-T647 PolarHBondContact O-N 3.33Å; F643-T647 PolarHBondContact O-OG1 3.32Å; S644-T647 PolarHBondContact O-OG1 2.94Å; T647-F649 VanDerWaalsContact C-N 3.31Å; T647-F649 PolarHBondContact O-N 3.27Å; T647-Q650 WeakPolarHBondContact O-CB 3.12Å; T647-Q650 PolarHBondContact O-N 3.07Å; T647-Q650 VanDerWaalsContact O-N 3.15Å
648	S	88.1	Confident	84.2	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.014	20%	0.201	C	C	.	.	H	α-helix	trans	-67	-30.8	179	64	0	0	0	0	112.9	G410 C411 S414 S644 I645	G410-S648 CarbonylContact C-O 3.59Å; C411-S648 PolarHBondContact N-O 3.41Å; S414-S648 VanDerWaalsContact CB-O 3.24Å; S414-S648 WeakPolarHBondContact CB-O 3.17Å; S644-S648 WeakPolarHBondContact O-CB 3.47Å; S644-S648 PolarHBondContact O-N 3.46Å; S644-S648 PolarHBondContact O-OG 2.95Å; I645-S648 PolarHBondContact O-OG 3.24Å
649	F	88.1	Confident	83.8	Confident	48 Å²	48	42.3 Å²	42.3	21%	0.211	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	13.1	174.7	-71.5	-91.2	0	0	0	113.5	L406 V413 I645 T647 G651 F652 L653	L406-F649 HydrophobicContact CD1-CE2 4.32Å; V413-F649 HydrophobicContact CB-CE1 4.11Å; V413-F649 HydrophobicContact CG1-CD1 4.24Å; V413-F649 HydrophobicContact CG1-CE1 4.04Å; V413-F649 HydrophobicContact CG2-CE1 4.41Å; I645-F649 WeakPolarHBondContact O-CB 3.45Å; I645-F649 VanDerWaalsContact O-CD2 3.28Å; I645-F649 WeakPolarHBondContact O-CD2 2.96Å; I645-F649 PolarHBondContact O-N 2.96Å; T647-F649 VanDerWaalsContact C-N 3.31Å; T647-F649 PolarHBondContact O-N 3.27Å; F649-G651 PolarHBondContact O-N 2.93Å; F649-F652 HydrophobicContact CD1-CB 4.38Å; F649-F652 HydrophobicContact CD1-CD1 4.19Å; F649-F652 WeakPolarHBondContact O-CB 3.26Å; F649-F652 PolarHBondContact O-N 2.96Å; F649-F652 VanDerWaalsContact O-N 3.08Å; F649-L653 WeakPolarHBondContact O-CG 3.39Å; F649-L653 PolarHBondContact O-N 3.41Å
650	Q	85.3	Confident	83.2	Confident	7 Å²	7	44.3 Å²	44.3	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-56.8	-47.3	-173.7	-178.6	176.5	-18.3	0	0	112.5	M493 I646 T647 F652 L653 I654	M493-Q650 VanDerWaalsContact CE-NE2 3.29Å; I646-Q650 WeakPolarHBondContact O-CA 3.5Å; I646-Q650 PolarHBondContact O-N 3.47Å; I646-Q650 VanDerWaalsContact O-N 3.16Å; T647-Q650 WeakPolarHBondContact O-CB 3.12Å; T647-Q650 PolarHBondContact O-N 3.07Å; T647-Q650 VanDerWaalsContact O-N 3.15Å; Q650-F652 VanDerWaalsContact C-N 3.31Å; Q650-F652 PolarHBondContact O-N 3.12Å; Q650-L653 PolarHBondContact O-N 3.38Å; Q650-I654 HydrophobicContact CG-CD1 4.01Å; Q650-I654 VanDerWaalsContact O-CG1 3.28Å; Q650-I654 WeakPolarHBondContact O-CG1 3.4Å; Q650-I654 PolarHBondContact O-N 3.29Å
651	G	85.3	Confident	82.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65	-33.7	178.2	0	0	0	0	0	113.2	S414 F649 I654 F655	S414-G651 VanDerWaalsContact OG-CA 3.23Å; S414-G651 WeakPolarHBondContact OG-CA 3.45Å; S414-G651 PolarHBondContact OG-N 3.49Å; S414-G651 VanDerWaalsContact OG-N 3.09Å; F649-G651 PolarHBondContact O-N 2.93Å; G651-I654 PolarHBondContact O-N 3.46Å; G651-F655 WeakPolarHBondContact O-CB 3.42Å; G651-F655 PolarHBondContact O-N 3.5Å
652	F	86.5	Confident	81.5	Confident	70 Å²	70	45.7 Å²	45.7	31%	0.307	22%	0.218	S	C	.	.	H	α-helix	trans	-68.9	-42.3	175.2	177.5	-107.1	0	0	0	112.6	V413 A417 F649 Q650 I654 F655 I656	V413-F652 HydrophobicContact CG1-CB 4.36Å; V413-F652 HydrophobicContact CG1-CD2 4.08Å; V413-F652 HydrophobicContact CG1-CG 4.22Å; A417-F652 HydrophobicContact CB-CB 4.29Å; A417-F652 HydrophobicContact CB-CD2 4.11Å; F649-F652 HydrophobicContact CD1-CB 4.38Å; F649-F652 HydrophobicContact CD1-CD1 4.19Å; F649-F652 WeakPolarHBondContact O-CB 3.26Å; F649-F652 PolarHBondContact O-N 2.96Å; F649-F652 VanDerWaalsContact O-N 3.08Å; Q650-F652 VanDerWaalsContact C-N 3.31Å; Q650-F652 PolarHBondContact O-N 3.12Å; F652-I654 VanDerWaalsContact C-N 3.31Å; F652-I654 PolarHBondContact O-N 2.81Å; F652-F655 HydrophobicContact CD2-CD1 4.22Å; F652-F655 HydrophobicContact CE2-CD1 4.36Å; F652-F655 WeakPolarHBondContact O-CB 3.45Å; F652-F655 PolarHBondContact O-N 3.18Å; F652-I656 HydrophobicContact CD1-CD1 3.89Å; F652-I656 HydrophobicContact CE1-CD1 3.31Å; F652-I656 HydrophobicContact CE1-CG1 4.31Å; F652-I656 HydrophobicContact CE2-CD1 4.18Å; F652-I656 HydrophobicContact CE2-CG1 4.38Å; F652-I656 HydrophobicContact CZ-CD1 3.49Å; F652-I656 VanDerWaalsContact CZ-CD1 3.49Å; F652-I656 HydrophobicContact CZ-CG1 4.14Å; F652-I656 PolarHBondContact O-N 2.92Å
653	L	84.4	Confident	80.7	Confident	66 Å²	66	46 Å²	46	35%	0.346	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-41.3	175	-67.1	175.5	0	0	0	111.3	V618 I646 F649 Q650 F655 I656 W657	V618-L653 HydrophobicContact CG1-CB 4.4Å; I646-L653 HydrophobicContact CG2-CD1 4.12Å; F649-L653 WeakPolarHBondContact O-CG 3.39Å; F649-L653 PolarHBondContact O-N 3.41Å; Q650-L653 PolarHBondContact O-N 3.38Å; L653-F655 VanDerWaalsContact C-N 3.35Å; L653-I656 PolarHBondContact O-N 3.49Å; L653-W657 PolarHBondContact O-N 2.69Å; L653-W657 VanDerWaalsContact O-N 3.17Å
654	I	79.5	Confident	79.7	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-61.9	-42.3	173.8	-70.5	169.3	0	0	0	111.1	H446 L449 L450 V618 L619 Q650 G651 F652 W657 Y658	H446-I654 VanDerWaalsContact CE1-CG2 3.41Å; H446-I654 WeakPolarHBondContact CE1-CG2 3.11Å; H446-I654 WeakPolarHBondContact NE2-CG2 3.48Å; L449-I654 HydrophobicContact CD2-CD1 4.12Å; L450-I654 HydrophobicContact CD1-CG2 4.23Å; V618-I654 HydrophobicContact CG1-CG1 4.49Å; L619-I654 HydrophobicContact CD2-CD1 4.23Å; Q650-I654 HydrophobicContact CG-CD1 4.01Å; Q650-I654 VanDerWaalsContact O-CG1 3.28Å; Q650-I654 WeakPolarHBondContact O-CG1 3.4Å; Q650-I654 PolarHBondContact O-N 3.29Å; G651-I654 PolarHBondContact O-N 3.46Å; F652-I654 VanDerWaalsContact C-N 3.31Å; F652-I654 PolarHBondContact O-N 2.81Å; I654-W657 WeakPolarHBondContact O-CB 3.18Å; I654-W657 PolarHBondContact O-N 3.01Å; I654-Y658 PolarHBondContact O-N 3.13Å
655	F	80.7	Confident	78.6	Confident	49 Å²	49	50 Å²	50	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-50.7	176.6	164.3	-127	0	0	0	113	A417 T421 G651 F652 L653 W657 Y658 W659	A417-F655 HydrophobicContact CB-CB 4.06Å; A417-F655 HydrophobicContact CB-CD1 4.09Å; A417-F655 HydrophobicContact CB-CG 4.27Å; T421-F655 HydrophobicContact CG2-CB 3.9Å; T421-F655 HydrophobicContact CG2-CD2 3Å; T421-F655 HydrophobicContact CG2-CE2 3.67Å; T421-F655 HydrophobicContact CG2-CG 3.79Å; G651-F655 WeakPolarHBondContact O-CB 3.42Å; G651-F655 PolarHBondContact O-N 3.5Å; F652-F655 HydrophobicContact CD2-CD1 4.22Å; F652-F655 HydrophobicContact CE2-CD1 4.36Å; F652-F655 WeakPolarHBondContact O-CB 3.45Å; F652-F655 PolarHBondContact O-N 3.18Å; L653-F655 VanDerWaalsContact C-N 3.35Å; F655-W657 PolarHBondContact O-N 3.24Å; F655-Y658 PolarHBondContact O-N 3.03Å; F655-W659 HydrophobicContact CE2-CB 4.48Å; F655-W659 HydrophobicContact CE2-CE3 4.43Å; F655-W659 PolarHBondContact O-N 3.19Å
656	I	81.4	Confident	77.3	Confident	84 Å²	84	55.5 Å²	55.5	43%	0.431	26%	0.264	S	S	.	.	H	α-helix	trans	-56.2	-43.8	178.4	-70.1	168.1	0	0	0	110.1	F652 L653 W659 S660	F652-I656 HydrophobicContact CD1-CD1 3.89Å; F652-I656 HydrophobicContact CE1-CD1 3.31Å; F652-I656 HydrophobicContact CE1-CG1 4.31Å; F652-I656 HydrophobicContact CE2-CD1 4.18Å; F652-I656 HydrophobicContact CE2-CG1 4.38Å; F652-I656 HydrophobicContact CZ-CD1 3.49Å; F652-I656 VanDerWaalsContact CZ-CD1 3.49Å; F652-I656 HydrophobicContact CZ-CG1 4.14Å; F652-I656 PolarHBondContact O-N 2.92Å; L653-I656 PolarHBondContact O-N 3.49Å; I656-W659 PolarHBondContact O-N 2.8Å; I656-S660 WeakPolarHBondContact O-CB 3.41Å; I656-S660 PolarHBondContact O-N 2.95Å
657	W	76.6	Confident	75.7	Confident	56 Å²	56	56.3 Å²	56.3	21%	0.212	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-49	177.9	177.4	88.5	0	0	0	112.3	H446 L615 L653 I654 F655 W659 S660 M661	H446-W657 AromaticContact CE1-CE3 3.95Å; H446-W657 AromaticContact CE1-CZ3 3.77Å; H446-W657 AromaticContact NE2-CE3 3.76Å; H446-W657 AromaticContact NE2-CZ3 3.65Å; L615-W657 HydrophobicContact CD1-CD2 3.21Å; L615-W657 HydrophobicContact CD1-CE3 3.39Å; L615-W657 HydrophobicContact CD1-CG 3.85Å; L615-W657 HydrophobicContact CD1-CH2 3.56Å; L615-W657 HydrophobicContact CD1-CZ2 3.4Å; L615-W657 VanDerWaalsContact CD1-CZ2 3.4Å; L615-W657 HydrophobicContact CD1-CZ3 3.55Å; L653-W657 PolarHBondContact O-N 2.69Å; L653-W657 VanDerWaalsContact O-N 3.17Å; I654-W657 WeakPolarHBondContact O-CB 3.18Å; I654-W657 PolarHBondContact O-N 3.01Å; F655-W657 PolarHBondContact O-N 3.24Å; W657-W659 VanDerWaalsContact C-N 3.29Å; W657-W659 PolarHBondContact O-N 3.18Å; W657-S660 WeakPolarHBondContact O-CB 3.34Å; W657-S660 PolarHBondContact O-N 3.07Å; W657-M661 HydrophobicContact CD2-CG 4.13Å; W657-M661 HydrophobicContact CH2-CG 4.14Å; W657-M661 HydrophobicContact CZ2-CE 4.3Å; W657-M661 HydrophobicContact CZ2-CG 3.62Å; W657-M661 HydrophobicContact CZ2-SD 4.27Å; W657-M661 PolarHBondContact O-N 2.71Å
658	Y	74.7	Confident	73.7	Confident	17 Å²	17	57.2 Å²	57.2	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-43.2	178.9	177.1	-98.4	0	0	0	111.6	T421 M447 I654 F655 M661 R662	T421-Y658 HydrophobicContact CG2-CD1 4.42Å; M447-Y658 HydrophobicContact CE-CD2 4.43Å; M447-Y658 HydrophobicContact CE-CE2 4.09Å; I654-Y658 PolarHBondContact O-N 3.13Å; F655-Y658 PolarHBondContact O-N 3.03Å; Y658-M661 PolarHBondContact O-N 2.77Å; Y658-R662 HydrophobicContact CD1-CG 4.29Å; Y658-R662 HydrophobicContact CE1-CG 3.85Å; Y658-R662 HydrophobicContact CE2-CG 4.39Å; Y658-R662 WeakPolarHBondContact O-CG 3.32Å; Y658-R662 PolarHBondContact O-N 2.9Å; Y658-R662 PolarHBondContact OH-NE 3.03Å; Y658-R662 PolarHBondContact OH-NH1 2.92Å
659	W	74.6	Confident	71.2	Confident	107 Å²	107	63.1 Å²	63.1	41%	0.405	34%	0.336	S	S	.	.	H	α-helix	trans	-67	-42.8	178.6	-161.4	-104.9	0	0	0	111.9	F655 I656 W657 M661 R662 L663	F655-W659 HydrophobicContact CE2-CB 4.48Å; F655-W659 HydrophobicContact CE2-CE3 4.43Å; F655-W659 PolarHBondContact O-N 3.19Å; I656-W659 PolarHBondContact O-N 2.8Å; W657-W659 VanDerWaalsContact C-N 3.29Å; W657-W659 PolarHBondContact O-N 3.18Å; W659-M661 VanDerWaalsContact C-N 3.32Å; W659-M661 PolarHBondContact O-N 3.08Å; W659-R662 PolarHBondContact O-N 3.36Å; W659-R662 VanDerWaalsContact O-N 3.16Å; W659-L663 VanDerWaalsContact CD1-CD1 3.46Å; W659-L663 HydrophobicContact CG-CD1 4.49Å; W659-L663 WeakPolarHBondContact O-CB 3.24Å; W659-L663 WeakPolarHBondContact O-CG 3.49Å; W659-L663 PolarHBondContact O-N 3Å
660	S	71.7	Confident	68.5	Low	47 Å²	47	65.1 Å²	65.1	33%	0.329	36%	0.356	S	S	.	.	H	α-helix	trans	-56.4	-45.6	173.8	-179.6	0	0	0	0	111.6	I656 W657 R662 L663 Q664	I656-S660 WeakPolarHBondContact O-CB 3.41Å; I656-S660 PolarHBondContact O-N 2.95Å; W657-S660 WeakPolarHBondContact O-CB 3.34Å; W657-S660 PolarHBondContact O-N 3.07Å; S660-R662 PolarHBondContact O-N 3.22Å; S660-L663 PolarHBondContact O-N 2.94Å; S660-Q664 WeakPolarHBondContact O-CB 3.4Å; S660-Q664 VanDerWaalsContact O-CG 3.29Å; S660-Q664 WeakPolarHBondContact O-CG 3.43Å; S660-Q664 PolarHBondContact O-N 3.47Å; S660-Q664 PolarHBondContact OG-NE2 3.12Å; S660-Q664 VanDerWaalsContact OG-NE2 3.12Å
661	M	68.6	Low	66.5	Low	68 Å²	68	70.7 Å²	70.7	34%	0.335	39%	0.393	S	S	.	.	H	α-helix	trans	-64.8	-39	176.6	-73.9	-67.4	-72.9	0	0	112.8	T611 W657 Y658 W659 A665	T611-M661 HydrophobicContact CG2-SD 4.26Å; W657-M661 HydrophobicContact CD2-CG 4.13Å; W657-M661 HydrophobicContact CH2-CG 4.14Å; W657-M661 HydrophobicContact CZ2-CE 4.3Å; W657-M661 HydrophobicContact CZ2-CG 3.62Å; W657-M661 HydrophobicContact CZ2-SD 4.27Å; W657-M661 PolarHBondContact O-N 2.71Å; Y658-M661 PolarHBondContact O-N 2.77Å; W659-M661 VanDerWaalsContact C-N 3.32Å; W659-M661 PolarHBondContact O-N 3.08Å; M661-A665 WeakPolarHBondContact O-CB 3.35Å; M661-A665 PolarHBondContact O-N 3.23Å
662	R	69.5	Low	64.1	Low	59 Å²	59	78.4 Å²	78.4	22%	0.223	43%	0.434	C	S	.	.	H	α-helix	trans	-66	-40.5	174.9	-75.8	-118.2	-89.6	-153.1	-8	111.8	A424 S428 Y658 W659 S660 A665 R666	A424-R662 PolarHBondContact O-NH2 2.83Å; S428-R662 PolarHBondContact OG-NH1 3.09Å; Y658-R662 HydrophobicContact CD1-CG 4.29Å; Y658-R662 HydrophobicContact CE1-CG 3.85Å; Y658-R662 HydrophobicContact CE2-CG 4.39Å; Y658-R662 WeakPolarHBondContact O-CG 3.32Å; Y658-R662 PolarHBondContact O-N 2.9Å; Y658-R662 PolarHBondContact OH-NE 3.03Å; Y658-R662 PolarHBondContact OH-NH1 2.92Å; W659-R662 PolarHBondContact O-N 3.36Å; W659-R662 VanDerWaalsContact O-N 3.16Å; S660-R662 PolarHBondContact O-N 3.22Å; R662-A665 PolarHBondContact O-N 3.37Å; R662-R666 PolarHBondContact O-N 3.04Å; R662-R666 VanDerWaalsContact O-N 3.16Å
663	L	69.4	Low	61.4	Low	88 Å²	88	84.6 Å²	84.6	46%	0.461	46%	0.46	S	S	.	.	H	α-helix	trans	-65.7	-46.6	175.8	-71.7	175.6	0	0	0	111.5	W659 S660 A665 R666 G667	W659-L663 VanDerWaalsContact CD1-CD1 3.46Å; W659-L663 HydrophobicContact CG-CD1 4.49Å; W659-L663 WeakPolarHBondContact O-CB 3.24Å; W659-L663 WeakPolarHBondContact O-CG 3.49Å; W659-L663 PolarHBondContact O-N 3Å; S660-L663 PolarHBondContact O-N 2.94Å; L663-A665 VanDerWaalsContact C-N 3.28Å; L663-A665 PolarHBondContact O-N 2.79Å; L663-R666 PolarHBondContact O-N 3.3Å; L663-G667 PolarHBondContact O-N 3.44Å
664	Q	66.2	Low	59	Low	71 Å²	71	86.8 Å²	86.8	33%	0.332	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-39	175.1	-72.9	176.9	45.6	0	0	112.1	S660 R666 G667 G668	S660-Q664 WeakPolarHBondContact O-CB 3.4Å; S660-Q664 VanDerWaalsContact O-CG 3.29Å; S660-Q664 WeakPolarHBondContact O-CG 3.43Å; S660-Q664 PolarHBondContact O-N 3.47Å; S660-Q664 PolarHBondContact OG-NE2 3.12Å; S660-Q664 VanDerWaalsContact OG-NE2 3.12Å; Q664-R666 VanDerWaalsContact C-N 3.3Å; Q664-R666 PolarHBondContact O-N 3.44Å; Q664-G667 PolarHBondContact O-N 3.44Å; Q664-G668 PolarHBondContact O-N 3.43Å
665	A	62.3	Low	56.6	Low	58 Å²	58	94.2 Å²	94.2	48%	0.479	52%	0.521	S	S	.	.	H	α-helix	trans	-68.8	-25.1	176.3	0	0	0	0	0	113.7	M661 R662 L663	M661-A665 WeakPolarHBondContact O-CB 3.35Å; M661-A665 PolarHBondContact O-N 3.23Å; R662-A665 PolarHBondContact O-N 3.37Å; L663-A665 VanDerWaalsContact C-N 3.28Å; L663-A665 PolarHBondContact O-N 2.79Å
666	R	61.2	Low	54.3	Low	191 Å²	191	97 Å²	97	72%	0.721	55%	0.546	S	S	*	.	H	α-helix	trans	-84.8	-33.2	174.1	-75.8	179.2	177.5	174.5	-1	112.7	R662 L663 Q664	R662-R666 PolarHBondContact O-N 3.04Å; R662-R666 VanDerWaalsContact O-N 3.16Å; L663-R666 PolarHBondContact O-N 3.3Å; Q664-R666 VanDerWaalsContact C-N 3.3Å; Q664-R666 PolarHBondContact O-N 3.44Å
667	G	50.5	Low	52.1	Low	65 Å²	65	100.7 Å²	100.7	67%	0.67	57%	0.567	S	S	*	*	H	α-helix	trans	-82.5	-4.8	178.9	0	0	0	0	0	115.1	L663 Q664	L663-G667 PolarHBondContact O-N 3.44Å; Q664-G667 PolarHBondContact O-N 3.44Å
668	G	43	Very low	50	Low	43 Å²	43	103.6 Å²	103.6	44%	0.443	60%	0.596	S	S	.	*	S	Bend	trans	-63.1	127.7	172.2	0	0	0	0	0	110.5	Q664 S670	Q664-G668 PolarHBondContact O-N 3.43Å; G668-S670 PolarHBondContact O-N 3.04Å
669	P	36.3	Very low	48.3	Very low	125 Å²	125	107.5 Å²	107.5	81%	0.812	63%	0.632	S	S	*	*			trans	-59.8	123.5	-172.3	21.5	-31.4	0	0	0	110.8	P671	P669-P671 VanDerWaalsContact O-CD 3.29Å; P669-P671 WeakPolarHBondContact O-CD 3.4Å
670	S	30.2	Very low	46.2	Very low	90 Å²	90	113.1 Å²	113.1	63%	0.629	65%	0.653	S	S	*	*			trans	-73.9	111.6	160.4	50.1	0	0	0	0	108.2	G668 L672	G668-S670 PolarHBondContact O-N 3.04Å; S670-L672 PolarHBondContact O-N 3.04Å
671	P	43.1	Very low	44.1	Very low	124 Å²	124	117.5 Å²	117.5	81%	0.805	67%	0.672	S	S	*	*	S	Bend	trans	-79.4	29.3	-179.3	29.5	-25.3	0	0	0	113	P669	P669-P671 VanDerWaalsContact O-CD 3.29Å; P669-P671 WeakPolarHBondContact O-CD 3.4Å
672	L	36.6	Very low	42.6	Very low	163 Å²	163	120.2 Å²	120.2	85%	0.853	70%	0.695	S	S	*	*	S	Bend	trans	-146.6	59.3	174.7	-89.8	116.8	0	0	0	110.6	S670	S670-L672 PolarHBondContact O-N 3.04Å
673	K	30	Very low	40.8	Very low	199 Å²	199	124.2 Å²	124.2	87%	0.865	72%	0.719	S	S	*	*			trans	-153.2	54	155.9	-127.8	178.8	-175.7	-176.9	0	111
674	S	32.1	Very low	39.2	Very low	113 Å²	113	125.5 Å²	125.5	79%	0.79	74%	0.735	S	S	*	*			trans	-136.3	52.1	156.9	73.9	0	0	0	0	109.5
675	N	29.4	Very low	37.7	Very low	161 Å²	161	127 Å²	127	86%	0.861	75%	0.754	S	S	*	*			trans	-102.1	93.4	152.5	-93.4	8.5	0	0	0	105.4
676	S	33	Very low	36.3	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	77%	0.765	S	S	*	*			trans	170.3	73.8	155.4	-71.9	0	0	0	0	106.4
677	D	34.9	Very low	35.2	Very low	163 Å²	163	124.2 Å²	124.2	87%	0.872	77%	0.771	S	S	*	*				-154.9	106.6	127.7	-94.7	-23.9	0	0	0	108.1	A679	D677-A679 PolarHBondContact O-N 3.49Å
678	S	33.3	Very low	34.5	Very low	117 Å²	117	128.1 Å²	128.1	82%	0.818	78%	0.782	S	S	*	*			trans	-50.1	82.7	166	-66.8	0	0	0	0	110.8	R680	S678-R680 VanDerWaalsContact C-N 3.3Å; S678-R680 PolarHBondContact O-N 3.19Å; S678-R680 VanDerWaalsContact O-N 3.16Å
679	A	37.6	Very low	34	Very low	99 Å²	99	131.3 Å²	131.3	82%	0.818	80%	0.798	S	S	*	*			trans	-78	93.8	152.8	0	0	0	0	0	107	D677 L681	D677-A679 PolarHBondContact O-N 3.49Å; A679-L681 PolarHBondContact O-N 3.08Å
680	R	31.7	Very low	33.8	Very low	224 Å²	224	130.3 Å²	130.3	85%	0.845	79%	0.794	S	S	*	*			trans	-38.9	128.5	173.3	-69.6	168.7	169.6	159.1	-4.2	112.3	S678	S678-R680 VanDerWaalsContact C-N 3.3Å; S678-R680 PolarHBondContact O-N 3.19Å; S678-R680 VanDerWaalsContact O-N 3.16Å
681	L	27.8	Very low	34.1	Very low	139 Å²	139	131.3 Å²	131.3	73%	0.728	80%	0.801	S	S	*	*			trans	22.5	125.8	137.1	-68	156.5	0	0	0	117.5	A679 I683	A679-L681 PolarHBondContact O-N 3.08Å; L681-I683 HydrophobicContact CB-CG1 4.46Å; L681-I683 HydrophobicContact CD2-CG1 4.02Å
682	P	35.8	Very low	33.7	Very low	126 Å²	126	136.2 Å²	136.2	82%	0.818	80%	0.803	S	S	*	*				-107.1	110.7	127	26.6	-16	0	0	0	108.6	S684	P682-S684 PolarHBondContact O-N 3.13Å
683	I	32.7	Very low	33.9	Very low	143 Å²	143	140 Å²	140	73%	0.733	82%	0.822	S	S	*	*			trans	-64	99.4	162.3	-62.5	168.4	0	0	0	105.7	L681	L681-I683 HydrophobicContact CB-CG1 4.46Å; L681-I683 HydrophobicContact CD2-CG1 4.02Å
684	S	35.2	Very low	34.1	Very low	114 Å²	114	137.1 Å²	137.1	80%	0.797	82%	0.82	S	S	*	*			trans	-90.2	106.9	161.2	-170.3	0	0	0	0	107.4	P682	P682-S684 PolarHBondContact O-N 3.13Å
685	S	34.8	Very low	34.2	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	82%	0.821	S	S	*	*			trans	-52.6	124.6	174.1	46.6	0	0	0	0	112.5
686	G	33.5	Very low	34.4	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	82%	0.819	S	S	*	*			trans	24.3	124.3	141.3	0	0	0	0	0	120
687	S	37.1	Very low	34.5	Very low	120 Å²	120	138.9 Å²	138.9	84%	0.839	82%	0.823	S	S	*	*				179.6	94.4	101.7	41.3	0	0	0	0	108.9	S689	S687-S689 PolarHBondContact O-N 2.94Å; S687-S689 VanDerWaalsContact O-N 3.13Å
688	T	36.6	Very low	34.5	Very low	147 Å²	147	137.4 Å²	137.4	90%	0.902	82%	0.82	S	S	*	*			trans	-69.7	104.1	159.3	33.6	0	0	0	0	108.3
689	S	32.8	Very low	34.6	Very low	111 Å²	111	138.7 Å²	138.7	78%	0.776	82%	0.82	S	S	*	*			trans	-33.7	136.9	140.3	158	0	0	0	0	111.5	S687	S687-S689 PolarHBondContact O-N 2.94Å; S687-S689 VanDerWaalsContact O-N 3.13Å
690	S	31.8	Very low	34.3	Very low	104 Å²	104	141.6 Å²	141.6	73%	0.727	82%	0.821	S	S	*	*			trans	127.6	93.6	148.2	-162	0	0	0	0	114.6
691	S	36.5	Very low	34.5	Very low	111 Å²	111	135.2 Å²	135.2	78%	0.776	82%	0.819	S	S	*	*			trans	-152.9	97.4	139.2	57	0	0	0	0	105.7
692	R	33.4	Very low	35.1	Very low	226 Å²	226	134.9 Å²	134.9	85%	0.853	83%	0.826	S	S	*	*				55.6	103.7	95.9	-77.8	-168.1	-168.8	178.6	4.2	112.8
693	I	40.9	Very low	35	Very low	244 Å²	244	135.7 Å²	135.7	100%	1.251	83%	0.827	S	S	*	*			trans	66.1	0	152.5	-54.3	175.4	0	0	0	115.5

Retrieved 693 of 693 residues in 665.1 ms (Link to these results)

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