A0A077ZEM6_TRITR Loading...

SMC N and SMC hinge domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZEM6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 768 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	36.7	Very low	31	Very low	245 Å²	245	163.3 Å²	163.3	100%	1.207	83%	0.825	S	S	*	*				0	72.2	0	-66	-176.9	-159.5	0	0	109.4
2	L	30.9	Very low	31.2	Very low	171 Å²	171	165 Å²	165	90%	0.895	82%	0.823	S	S	*	*			trans	-104.2	23.6	-167.8	-96.1	160.3	0	0	0	114.3
3	Y	34.2	Very low	31.5	Very low	243 Å²	243	171.2 Å²	171.2	95%	0.953	83%	0.831	S	S	*	*			trans	-106.2	76	175.1	-88.2	-88.3	0	0	0	110.2
4	S	31	Very low	32.2	Very low	97 Å²	97	164.7 Å²	164.7	68%	0.678	80%	0.797	S	S	*	*			trans	-88.6	117.7	170.5	-179.8	0	0	0	0	109.5	Y6	S4-Y6 PolarHBondContact O-N 3.02Å
5	S	30.2	Very low	33.1	Very low	100 Å²	100	157.3 Å²	157.3	70%	0.699	77%	0.769	S	S	*	*			trans	58.4	50.3	132.2	-32	0	0	0	0	119.3	Q7	S5-Q7 VanDerWaalsContact C-N 3.26Å; S5-Q7 PolarHBondContact O-N 3.35Å
6	Y	29	Very low	34.1	Very low	229 Å²	229	152.6 Å²	152.6	90%	0.898	75%	0.745	S	S	*	*			trans	-84	76	151.9	-98.7	-86.9	0	0	0	109.2	S4 K8	S4-Y6 PolarHBondContact O-N 3.02Å; Y6-K8 PolarHBondContact O-N 3.49Å; Y6-K8 VanDerWaalsContact O-N 3.08Å
7	Q	30.4	Very low	35.3	Very low	186 Å²	186	148.6 Å²	148.6	87%	0.869	73%	0.732	S	S	*	*			trans	-65.9	104.8	163.4	-83.1	-173	-19.4	0	0	107.8	S5 S9	S5-Q7 VanDerWaalsContact C-N 3.26Å; S5-Q7 PolarHBondContact O-N 3.35Å; Q7-S9 PolarHBondContact O-N 3.18Å
8	K	29.6	Very low	36.5	Very low	200 Å²	200	145.8 Å²	145.8	87%	0.87	72%	0.716	S	S	*	*			trans	-60.2	104.8	169.9	-75.8	175.9	177.7	171.6	0	108	Y6	Y6-K8 PolarHBondContact O-N 3.49Å; Y6-K8 VanDerWaalsContact O-N 3.08Å
9	S	25.9	Very low	37.6	Very low	90 Å²	90	138.5 Å²	138.5	63%	0.629	68%	0.681	S	S	*	*			trans	-46.8	127.9	154.6	168.3	0	0	0	0	107.6	Q7 L11	Q7-S9 PolarHBondContact O-N 3.18Å; S9-L11 PolarHBondContact O-N 3.28Å
10	P	31.6	Very low	38.6	Very low	117 Å²	117	133.1 Å²	133.1	76%	0.76	65%	0.653	S	S	*	*			trans	-69.5	85.4	179.5	27.6	-31.2	0	0	0	108	K12	P10-K12 PolarHBondContact O-N 3.3Å
11	L	32	Very low	39.7	Very low	118 Å²	118	134.7 Å²	134.7	62%	0.618	65%	0.652	S	S	*	*			trans	-53.7	105.5	164.7	-86	148.5	0	0	0	106.5	S9 R13	S9-L11 PolarHBondContact O-N 3.28Å; L11-R13 PolarHBondContact O-N 2.9Å
12	K	32.6	Very low	40.7	Very low	184 Å²	184	125.8 Å²	125.8	80%	0.8	61%	0.608	S	S	*	*			trans	-41.9	106.6	172.2	-84	179.1	172.7	178.8	0	107.8	P10 F14	P10-K12 PolarHBondContact O-N 3.3Å; K12-F14 VanDerWaalsContact C-N 3.31Å; K12-F14 PolarHBondContact O-N 2.78Å
13	R	35.1	Very low	42.1	Very low	245 Å²	245	118.3 Å²	118.3	93%	0.925	57%	0.569	S	S	*	*			trans	-64.3	102.9	164.1	-76.6	-177.3	176.5	-177.3	-2.7	104.3	L11	L11-R13 PolarHBondContact O-N 2.9Å
14	F	42	Very low	43.4	Very low	81 Å²	81	110.8 Å²	110.8	36%	0.355	55%	0.545	S	S	.	.			trans	-51.3	142.6	164.8	-81.5	-88.8	0	0	0	107.7	K12 E16 V19 K83	K12-F14 VanDerWaalsContact C-N 3.31Å; K12-F14 PolarHBondContact O-N 2.78Å; F14-E16 PolarHBondContact O-N 3.29Å; F14-E16 VanDerWaalsContact O-N 3.15Å; F14-V19 HydrophobicContact CB-CG2 4.26Å; F14-K83 VanDerWaalsContact CD2-C 3.42Å; F14-K83 WeakPolarHBondContact CD2-O 3.33Å
15	S	45.4	Very low	44.5	Very low	54 Å²	54	114.8 Å²	114.8	38%	0.378	55%	0.545	S	S	.	.			trans	-53.6	127.6	177	68.6	0	0	0	0	107.7	T17 E18 V19	S15-T17 PolarHBondContact O-N 2.79Å; S15-E18 PolarHBondContact O-N 3.17Å; S15-E18 WeakPolarHBondContact OG-CG 3.16Å; S15-E18 PolarHBondContact OG-N 3.19Å; S15-E18 PolarHBondContact OG-OE2 3.14Å; S15-V19 PolarHBondContact O-N 3.29Å
16	E	49.3	Very low	45.5	Very low	82 Å²	82	112.8 Å²	112.8	38%	0.383	53%	0.529	S	S	.	.	H	α-helix	trans	-46.3	-34.9	177.3	-126.1	-175.8	115.7	0	0	111.2	F14 E18 V19 K20	F14-E16 PolarHBondContact O-N 3.29Å; F14-E16 VanDerWaalsContact O-N 3.15Å; E16-E18 PolarHBondContact O-N 3.37Å; E16-V19 PolarHBondContact O-N 3.25Å; E16-K20 WeakPolarHBondContact O-CB 3.43Å; E16-K20 WeakPolarHBondContact O-CG 3.44Å; E16-K20 PolarHBondContact O-N 2.98Å; E16-K20 WeakPolarHBondContact OE1-CE 3.49Å; E16-K20 IonicContact OE1-NZ 3Å; E16-K20 PolarHBondContact OE1-NZ 2.84Å
17	T	53.5	Low	46.4	Very low	85 Å²	85	105.6 Å²	105.6	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-59.3	-40	177.1	-15.6	0	0	0	0	114.1	S15 R21	S15-T17 PolarHBondContact O-N 2.79Å; T17-R21 WeakPolarHBondContact O-CB 3.45Å; T17-R21 WeakPolarHBondContact O-CG 3.32Å; T17-R21 PolarHBondContact O-N 3.11Å
18	E	56.9	Low	47.3	Very low	97 Å²	97	102.1 Å²	102.1	45%	0.453	50%	0.498	S	S	.	.	H	α-helix	trans	-72.2	-42.6	177.2	-84.6	174.3	131.4	0	0	112	S15 E16 K20 R21 E22	S15-E18 PolarHBondContact O-N 3.17Å; S15-E18 WeakPolarHBondContact OG-CG 3.16Å; S15-E18 PolarHBondContact OG-N 3.19Å; S15-E18 PolarHBondContact OG-OE2 3.14Å; E16-E18 PolarHBondContact O-N 3.37Å; E18-K20 VanDerWaalsContact C-N 3.32Å; E18-K20 PolarHBondContact O-N 2.85Å; E18-R21 PolarHBondContact O-N 3.32Å; E18-E22 PolarHBondContact O-N 3.46Å
19	V	57.3	Low	48.1	Very low	8 Å²	8	102.7 Å²	102.7	5%	0.048	50%	0.495	C	S	.	.	H	α-helix	trans	-61.4	-44.7	175.4	172.7	0	0	0	0	110.1	F14 S15 E16 E22 L23 L78 K83 A86	F14-V19 HydrophobicContact CB-CG2 4.26Å; S15-V19 PolarHBondContact O-N 3.29Å; E16-V19 PolarHBondContact O-N 3.25Å; V19-E22 PolarHBondContact O-N 3.33Å; V19-L23 HydrophobicContact CG1-CD1 3.75Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 WeakPolarHBondContact O-CG 3.5Å; V19-L23 PolarHBondContact O-N 2.76Å; V19-L78 HydrophobicContact CG1-CD1 4.25Å; V19-L78 HydrophobicContact CG1-CD2 3.67Å; V19-L78 HydrophobicContact CG2-CD2 4.42Å; V19-K83 WeakPolarHBondContact CG2-O 3.45Å; V19-A86 HydrophobicContact CG1-CB 4.05Å
20	K	57.9	Low	49.1	Very low	29 Å²	29	104.1 Å²	104.1	13%	0.126	50%	0.496	C	S	.	.	H	α-helix	trans	-62.8	-44.3	175.4	-74.1	175.9	-171.2	-179.7	0	112.2	E16 E18 E22 L23 N24 S36 I63	E16-K20 WeakPolarHBondContact O-CB 3.43Å; E16-K20 WeakPolarHBondContact O-CG 3.44Å; E16-K20 PolarHBondContact O-N 2.98Å; E16-K20 WeakPolarHBondContact OE1-CE 3.49Å; E16-K20 IonicContact OE1-NZ 3Å; E16-K20 PolarHBondContact OE1-NZ 2.84Å; E18-K20 VanDerWaalsContact C-N 3.32Å; E18-K20 PolarHBondContact O-N 2.85Å; K20-E22 VanDerWaalsContact C-N 3.32Å; K20-E22 PolarHBondContact O-N 2.87Å; K20-L23 PolarHBondContact O-N 2.96Å; K20-N24 VanDerWaalsContact O-CB 3.31Å; K20-N24 WeakPolarHBondContact O-CB 3.47Å; K20-N24 PolarHBondContact O-N 2.99Å; K20-S36 PolarHBondContact NZ-OG 3.45Å; K20-I63 HydrophobicContact CG-CD1 4.44Å
21	R	61.2	Low	50	Low	168 Å²	168	100 Å²	100	63%	0.634	47%	0.474	S	S	*	.	H	α-helix	trans	-59.2	-41.8	175.8	-86.6	-176.2	-167.1	166.1	5	112	T17 E18 N24 R25	T17-R21 WeakPolarHBondContact O-CB 3.45Å; T17-R21 WeakPolarHBondContact O-CG 3.32Å; T17-R21 PolarHBondContact O-N 3.11Å; E18-R21 PolarHBondContact O-N 3.32Å; R21-N24 PolarHBondContact O-N 3.3Å; R21-R25 WeakPolarHBondContact O-CG 3.39Å; R21-R25 PolarHBondContact O-N 3.29Å
22	E	59.2	Low	51.2	Low	58 Å²	58	100.3 Å²	100.3	27%	0.271	48%	0.477	S	S	.	.	H	α-helix	trans	-75.5	-34.8	179.5	-73.3	-54.7	168	0	0	113.9	E18 V19 K20 N24 R25 T26 F77	E18-E22 PolarHBondContact O-N 3.46Å; V19-E22 PolarHBondContact O-N 3.33Å; K20-E22 VanDerWaalsContact C-N 3.32Å; K20-E22 PolarHBondContact O-N 2.87Å; E22-N24 VanDerWaalsContact C-N 3.32Å; E22-R25 PolarHBondContact O-N 3.48Å; E22-R25 IonicContact OE1-CZ 3.1Å; E22-R25 IonicContact OE1-NH1 3.92Å; E22-R25 PolarHBondContact OE1-NH1 2.67Å; E22-R25 WeakPolarHBondContact OE2-CD 3.12Å; E22-R25 IonicContact OE2-NH1 2.63Å; E22-T26 PolarHBondContact O-N 3.05Å; E22-T26 VanDerWaalsContact O-N 3.11Å; E22-T26 PolarHBondContact O-OG1 3.46Å; E22-F77 HydrophobicContact CB-CE1 4.27Å; E22-F77 HydrophobicContact CB-CZ 4.44Å
23	L	59.7	Low	52.3	Low	14 Å²	14	92.3 Å²	92.3	7%	0.073	45%	0.445	C	S	.	.	H	α-helix	trans	-62.7	-40.5	168.8	-78.9	160.7	0	0	0	111.3	V19 K20 T26 K27 I63 C74 F88	V19-L23 HydrophobicContact CG1-CD1 3.75Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 WeakPolarHBondContact O-CG 3.5Å; V19-L23 PolarHBondContact O-N 2.76Å; K20-L23 PolarHBondContact O-N 2.96Å; L23-T26 WeakPolarHBondContact CA-OG1 3.41Å; L23-T26 CarbonylContact O-C 3.46Å; L23-T26 PolarHBondContact O-N 2.74Å; L23-T26 PolarHBondContact O-OG1 3.36Å; L23-K27 PolarHBondContact O-N 3.38Å; L23-I63 HydrophobicContact CD1-CD1 3.72Å; L23-C74 HydrophobicContact CD2-CB 3.94Å; L23-F88 HydrophobicContact CD1-CE1 3.98Å; L23-F88 HydrophobicContact CD1-CZ 4.07Å
24	N	60.7	Low	53.3	Low	85 Å²	85	84.4 Å²	84.4	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-68.1	-34.6	175.7	-77.9	-18.4	0	0	0	112.8	K20 R21 E22 T26 K27	K20-N24 VanDerWaalsContact O-CB 3.31Å; K20-N24 WeakPolarHBondContact O-CB 3.47Å; K20-N24 PolarHBondContact O-N 2.99Å; R21-N24 PolarHBondContact O-N 3.3Å; E22-N24 VanDerWaalsContact C-N 3.32Å; N24-T26 VanDerWaalsContact C-N 3.26Å; N24-T26 PolarHBondContact O-N 2.72Å; N24-K27 HydrophobicContact CB-CD 4.46Å; N24-K27 WeakPolarHBondContact O-CB 3.45Å; N24-K27 PolarHBondContact O-N 3.21Å; N24-K27 VanDerWaalsContact OD1-CD 3.24Å; N24-K27 WeakPolarHBondContact OD1-CD 3.25Å; N24-K27 WeakPolarHBondContact OD1-CE 3.39Å; N24-K27 PolarHBondContact OD1-NZ 2.78Å
25	R	55.2	Low	54.3	Low	180 Å²	180	81.3 Å²	81.3	68%	0.679	42%	0.415	S	S	*	.	H	α-helix	trans	-63.2	-34.3	171.4	-79.5	170.5	169.8	-174.1	-2.8	112	R21 E22	R21-R25 WeakPolarHBondContact O-CG 3.39Å; R21-R25 PolarHBondContact O-N 3.29Å; E22-R25 PolarHBondContact O-N 3.48Å; E22-R25 IonicContact OE1-CZ 3.1Å; E22-R25 IonicContact OE1-NH1 3.92Å; E22-R25 PolarHBondContact OE1-NH1 2.67Å; E22-R25 WeakPolarHBondContact OE2-CD 3.12Å; E22-R25 IonicContact OE2-NH1 2.63Å
26	T	50.1	Low	55	Low	58 Å²	58	78.9 Å²	78.9	36%	0.356	40%	0.397	S	S	.	.	H	α-helix	trans	-83.3	-17.6	177.1	37.1	0	0	0	0	114.2	E22 L23 N24 S28 R29 F77	E22-T26 PolarHBondContact O-N 3.05Å; E22-T26 VanDerWaalsContact O-N 3.11Å; E22-T26 PolarHBondContact O-OG1 3.46Å; L23-T26 WeakPolarHBondContact CA-OG1 3.41Å; L23-T26 CarbonylContact O-C 3.46Å; L23-T26 PolarHBondContact O-N 2.74Å; L23-T26 PolarHBondContact O-OG1 3.36Å; N24-T26 VanDerWaalsContact C-N 3.26Å; N24-T26 PolarHBondContact O-N 2.72Å; T26-S28 PolarHBondContact O-N 3.16Å; T26-R29 PolarHBondContact O-N 3.23Å; T26-F77 HydrophobicContact CG2-CE2 4.23Å; T26-F77 HydrophobicContact CG2-CZ 4.36Å
27	K	49.6	Very low	55.4	Low	78 Å²	78	75 Å²	75	34%	0.339	38%	0.379	S	S	.	.	H	α-helix	trans	-49	-32	173.5	-82.1	-177.5	173.6	178.2	0	113.4	L23 N24 R29 A33	L23-K27 PolarHBondContact O-N 3.38Å; N24-K27 HydrophobicContact CB-CD 4.46Å; N24-K27 WeakPolarHBondContact O-CB 3.45Å; N24-K27 PolarHBondContact O-N 3.21Å; N24-K27 VanDerWaalsContact OD1-CD 3.24Å; N24-K27 WeakPolarHBondContact OD1-CD 3.25Å; N24-K27 WeakPolarHBondContact OD1-CE 3.39Å; N24-K27 PolarHBondContact OD1-NZ 2.78Å; K27-R29 PolarHBondContact O-N 2.83Å; K27-A33 WeakPolarHBondContact CE-O 3.35Å; K27-A33 PolarHBondContact NZ-O 2.92Å; K27-A33 VanDerWaalsContact NZ-O 3.15Å
28	S	47.6	Very low	55.4	Low	113 Å²	113	73.9 Å²	73.9	79%	0.79	37%	0.368	S	S	*	.	H	α-helix	trans	-65.1	-14.5	178.7	176.9	0	0	0	0	114.4	T26	T26-S28 PolarHBondContact O-N 3.16Å
29	R	47.9	Very low	55.2	Low	212 Å²	212	74.6 Å²	74.6	80%	0.8	37%	0.372	S	S	*	.	H	α-helix	trans	-106.4	-46.3	-173.6	-82.5	-172	171.4	-177.2	-2.4	115.5	T26 K27	T26-R29 PolarHBondContact O-N 3.23Å; K27-R29 PolarHBondContact O-N 2.83Å
30	D	46.9	Very low	54.9	Low	121 Å²	121	75.2 Å²	75.2	65%	0.647	38%	0.377	S	S	*	.	H	α-helix	trans	-146.2	21.5	-157.1	-73.2	-56.4	0	0	0	118
31	G	50.3	Low	54.5	Low	30 Å²	30	81 Å²	81	31%	0.309	41%	0.41	S	S	.	.			trans	149.9	157.3	170.1	0	0	0	0	0	115.5	A33	G31-A33 PolarHBondContact O-N 3.21Å
32	N	57.1	Low	54.6	Low	124 Å²	124	74.2 Å²	74.2	66%	0.663	39%	0.387	S	S	*	.			trans	-89.5	91.6	-173.2	-77.3	-14.3	0	0	0	111.6	V34	N32-V34 PolarHBondContact O-N 3.27Å
33	A	54.5	Low	55.1	Low	16 Å²	16	72.6 Å²	72.6	13%	0.132	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	122.4	158.7	0	0	0	0	0	109	K27 G31 V65	K27-A33 WeakPolarHBondContact CE-O 3.35Å; K27-A33 PolarHBondContact NZ-O 2.92Å; K27-A33 VanDerWaalsContact NZ-O 3.15Å; G31-A33 PolarHBondContact O-N 3.21Å; A33-V65 HydrophobicContact CB-CG1 4.49Å
34	V	56.9	Low	55.9	Low	80 Å²	80	75 Å²	75	49%	0.485	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	-34.8	-171.9	-175.2	0	0	0	0	111.2	N32 V64 L91	N32-V34 PolarHBondContact O-N 3.27Å; V34-V64 HydrophobicContact CB-CB 4.38Å; V34-V64 HydrophobicContact CB-CG1 4.33Å; V34-V64 PolarHBondContact N-O 3.42Å; V34-L91 HydrophobicContact CG2-CD1 4.22Å
35	G	62.7	Low	57	Low	16 Å²	16	71.9 Å²	71.9	17%	0.165	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.4	-179.5	-177.2	0	0	0	0	0	111.3	V64	G35-V64 WeakPolarHBondContact O-CB 3.35Å; G35-V64 PolarHBondContact O-N 3.46Å
36	S	60.1	Low	58.2	Low	2 Å²	2	67.6 Å²	67.6	1%	0.014	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	154	165.8	52.5	0	0	0	0	110.6	K20 E38 E39 A40	K20-S36 PolarHBondContact NZ-OG 3.45Å; S36-E38 PolarHBondContact O-N 3.13Å; S36-E39 PolarHBondContact O-N 3.3Å; S36-E39 WeakPolarHBondContact OG-CB 3.47Å; S36-E39 VanDerWaalsContact OG-CD 3.25Å; S36-E39 WeakPolarHBondContact OG-CG 3.26Å; S36-E39 PolarHBondContact OG-OE2 3.38Å; S36-A40 PolarHBondContact O-N 3.28Å; S36-A40 VanDerWaalsContact O-N 3.14Å
37	L	57.6	Low	59.6	Low	1 Å²	1	70.3 Å²	70.3	1%	0.005	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.1	176.6	-72.9	162.3	0	0	0	111.9	G59 L60 N62 V64 A128 F129	L37-G59 WeakPolarHBondContact CD1-O 3.45Å; L37-L60 WeakPolarHBondContact CB-O 3.49Å; L37-L60 PolarHBondContact N-O 3.28Å; L37-N62 HydrophobicContact CD1-CB 4.5Å; L37-N62 PolarHBondContact N-O 3.14Å; L37-V64 HydrophobicContact CD1-CG2 4.46Å; L37-V64 HydrophobicContact CD2-CG2 3.56Å; L37-V64 HydrophobicContact CG-CG2 3.55Å; L37-A128 HydrophobicContact CD2-CB 4.06Å; L37-F129 HydrophobicContact CB-CE1 3.94Å; L37-F129 HydrophobicContact CB-CZ 3.96Å; L37-F129 HydrophobicContact CD1-CE1 4.49Å; L37-F129 HydrophobicContact CD2-CD1 4.37Å; L37-F129 HydrophobicContact CD2-CD2 4.39Å; L37-F129 HydrophobicContact CD2-CE1 3.75Å; L37-F129 HydrophobicContact CD2-CE2 3.79Å; L37-F129 HydrophobicContact CD2-CZ 3.36Å; L37-F129 HydrophobicContact CG-CE1 4.26Å; L37-F129 HydrophobicContact CG-CZ 4.21Å
38	E	53.3	Low	61.2	Low	61 Å²	61	72.3 Å²	72.3	29%	0.285	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-39.8	172.1	-69.6	-162.9	153.9	0	0	113.9	S36 L60 K182	S36-E38 PolarHBondContact O-N 3.13Å; E38-L60 HydrophobicContact CG-CB 3.63Å; E38-L60 PolarHBondContact N-O 2.85Å; E38-K182 VanDerWaalsContact CD-NZ 3.32Å; E38-K182 WeakPolarHBondContact OE1-CD 3.42Å; E38-K182 IonicContact OE1-NZ 2.74Å; E38-K182 PolarHBondContact OE1-NZ 3.25Å; E38-K182 IonicContact OE2-NZ 4Å; E38-K182 PolarHBondContact OE2-NZ 3.48Å
39	E	54.1	Low	63	Low	113 Å²	113	68.2 Å²	68.2	53%	0.528	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-10.7	-175.5	-74.8	167.5	164.5	0	0	113.9	S36 D41	S36-E39 PolarHBondContact O-N 3.3Å; S36-E39 WeakPolarHBondContact OG-CB 3.47Å; S36-E39 VanDerWaalsContact OG-CD 3.25Å; S36-E39 WeakPolarHBondContact OG-CG 3.26Å; S36-E39 PolarHBondContact OG-OE2 3.38Å; E39-D41 PolarHBondContact O-N 3.49Å
40	A	50.8	Low	64.7	Low	20 Å²	20	59 Å²	59	17%	0.165	33%	0.333	C	S	.	.			trans	-63.1	99.7	162.4	0	0	0	0	0	105.2	S36 T42 L125	S36-A40 PolarHBondContact O-N 3.28Å; S36-A40 VanDerWaalsContact O-N 3.14Å; A40-T42 WeakPolarHBondContact CA-OG1 3.45Å; A40-T42 WeakPolarHBondContact CB-OG1 3.47Å; A40-T42 PolarHBondContact O-N 3.06Å; A40-L125 HydrophobicContact CB-CD1 3.94Å
41	D	49.9	Very low	66.4	Low	152 Å²	152	54.8 Å²	54.8	81%	0.813	31%	0.311	S	S	*	.	S	Bend	trans	-58.8	31.7	173.4	-77.4	-36.5	0	0	0	112.7	E39	E39-D41 PolarHBondContact O-N 3.49Å
42	T	61.6	Low	68.2	Low	24 Å²	24	53.4 Å²	53.4	15%	0.147	30%	0.297	C	S	.	.			trans	-123	5	-151.8	-39.1	0	0	0	0	109.4	A40 V120 E121 D122 L125	A40-T42 WeakPolarHBondContact CA-OG1 3.45Å; A40-T42 WeakPolarHBondContact CB-OG1 3.47Å; A40-T42 PolarHBondContact O-N 3.06Å; T42-V120 HydrophobicContact CG2-CG1 4.22Å; T42-V120 CarbonylContact O-C 3.55Å; T42-V120 WeakPolarHBondContact O-CA 3.37Å; T42-E121 HydrophobicContact CG2-CB 3.56Å; T42-E121 HydrophobicContact CG2-CG 4.11Å; T42-E121 PolarHBondContact O-N 2.99Å; T42-D122 HydrophobicContact CG2-CB 3.87Å; T42-L125 HydrophobicContact CG2-CD1 4.28Å
43	I	70.9	Confident	69.6	Low	25 Å²	25	47.8 Å²	47.8	13%	0.128	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134.5	-178.1	-47.5	163.4	0	0	0	110.2	L118 R119 F129	I43-L118 HydrophobicContact CG2-CD1 3.35Å; I43-L118 HydrophobicContact CG2-CD2 4.45Å; I43-L118 HydrophobicContact CG2-CG 3.92Å; I43-R119 CarbonylContact C-O 3.22Å; I43-R119 VanDerWaalsContact CA-O 3.31Å; I43-R119 WeakPolarHBondContact CA-O 3.39Å; I43-F129 HydrophobicContact CD1-CD1 4.33Å; I43-F129 HydrophobicContact CD1-CE1 3.29Å; I43-F129 HydrophobicContact CD1-CE2 3.83Å; I43-F129 HydrophobicContact CD1-CZ 3.01Å; I43-F129 HydrophobicContact CG1-CE1 4.18Å; I43-F129 HydrophobicContact CG1-CE2 3.83Å; I43-F129 HydrophobicContact CG1-CZ 3.55Å
44	S	77.3	Confident	70.9	Confident	63 Å²	63	48.9 Å²	48.9	44%	0.441	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	138.3	162.4	53.1	0	0	0	0	110.6	R119	S44-R119 PolarHBondContact N-O 3.37Å; S44-R119 PolarHBondContact O-N 2.63Å; S44-R119 WeakPolarHBondContact OG-CB 3.35Å
45	I	81.8	Confident	72.2	Confident	20 Å²	20	47.4 Å²	47.4	10%	0.103	26%	0.264	C	S	.	.			trans	-130.3	149.2	168.4	-164.9	170.4	0	0	0	108.1	F53 L114	I45-F53 HydrophobicContact CD1-CB 3.55Å; I45-F53 HydrophobicContact CD1-CD2 3.76Å; I45-F53 HydrophobicContact CD1-CG 3.76Å; I45-L114 HydrophobicContact CD1-CD1 4.35Å
46	D	82	Confident	73.2	Confident	90 Å²	90	46.7 Å²	46.7	48%	0.481	26%	0.256	S	S	.	.			trans	-57.2	130.2	174	-172.4	-45	0	0	0	109.4	K48 Y49	D46-K48 PolarHBondContact O-N 3.4Å; D46-K48 WeakPolarHBondContact OD1-CB 3.33Å; D46-K48 PolarHBondContact OD1-N 3.35Å; D46-Y49 HydrophobicContact CB-CD2 3.75Å; D46-Y49 HydrophobicContact CB-CE2 3.97Å; D46-Y49 PolarHBondContact O-N 2.88Å
47	P	79.1	Confident	74.3	Confident	115 Å²	115	46.7 Å²	46.7	75%	0.747	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-50.9	-27.4	178.4	-27.5	33.9	0	0	0	113.9	Y49 D50	P47-Y49 PolarHBondContact O-N 3.23Å; P47-D50 PolarHBondContact O-N 3.46Å
48	K	83	Confident	75	Confident	120 Å²	120	52.2 Å²	52.2	52%	0.522	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-57.5	-30.1	174.9	-179.3	174.9	177.1	-174	0	112.9	D46 M161	D46-K48 PolarHBondContact O-N 3.4Å; D46-K48 WeakPolarHBondContact OD1-CB 3.33Å; D46-K48 PolarHBondContact OD1-N 3.35Å; K48-M161 HydrophobicContact CD-CE 4.37Å; K48-M161 HydrophobicContact CG-CE 3.71Å; K48-M161 WeakPolarHBondContact O-CE 2.96Å
49	Y	86	Confident	75.9	Confident	28 Å²	28	49.6 Å²	49.6	11%	0.11	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-109.4	2.8	-175.8	-48.6	-60.2	0	0	0	113.9	D46 P47 V51 A52 F53 L117 L138 M161	D46-Y49 HydrophobicContact CB-CD2 3.75Å; D46-Y49 HydrophobicContact CB-CE2 3.97Å; D46-Y49 PolarHBondContact O-N 2.88Å; P47-Y49 PolarHBondContact O-N 3.23Å; Y49-V51 PolarHBondContact O-N 2.87Å; Y49-A52 PolarHBondContact O-N 3.3Å; Y49-F53 WeakPolarHBondContact O-CB 3.3Å; Y49-F53 PolarHBondContact O-N 3.38Å; Y49-L117 HydrophobicContact CD1-CD1 4.35Å; Y49-L117 HydrophobicContact CD2-CD1 3.83Å; Y49-L117 HydrophobicContact CE1-CD1 4.44Å; Y49-L117 HydrophobicContact CE2-CD1 3.97Å; Y49-L117 HydrophobicContact CE2-CD2 4.43Å; Y49-L117 HydrophobicContact CG-CD1 4.04Å; Y49-L138 HydrophobicContact CD1-CD2 3.38Å; Y49-L138 HydrophobicContact CE1-CD2 3.55Å; Y49-L138 HydrophobicContact CG-CD2 4.25Å; Y49-M161 HydrophobicContact CD1-CE 3.81Å; Y49-M161 HydrophobicContact CD1-SD 3.76Å; Y49-M161 HydrophobicContact CE1-CE 4Å; Y49-M161 HydrophobicContact CE1-SD 3.98Å
50	D	83.1	Confident	76.9	Confident	18 Å²	18	44.8 Å²	44.8	10%	0.096	25%	0.249	C	C	.	.	H	α-helix	trans	-54.5	-47.9	-174.6	-172.7	47.7	0	0	0	112.2	P47 A52 F53 C54 G181	P47-D50 PolarHBondContact O-N 3.46Å; D50-A52 PolarHBondContact O-N 2.84Å; D50-F53 PolarHBondContact O-N 3.16Å; D50-C54 WeakPolarHBondContact O-CB 3.1Å; D50-C54 PolarHBondContact O-N 2.8Å; D50-C54 PolarHBondContact O-SG 3.08Å; D50-G181 PolarHBondContact OD2-N 2.95Å
51	V	83	Confident	78	Confident	33 Å²	33	47.2 Å²	47.2	20%	0.2	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-45.8	-179.8	179.7	0	0	0	0	111.9	Y49 F53 T55 A178	Y49-V51 PolarHBondContact O-N 2.87Å; V51-F53 VanDerWaalsContact C-N 3.32Å; V51-T55 WeakPolarHBondContact O-CB 3.31Å; V51-T55 PolarHBondContact O-N 3.5Å; V51-T55 VanDerWaalsContact O-N 3.08Å; V51-T55 PolarHBondContact O-OG1 3.36Å; V51-A178 HydrophobicContact CG1-CB 3.92Å; V51-A178 HydrophobicContact CG2-CB 4.17Å
52	A	86.9	Confident	79.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-40.1	178.7	0	0	0	0	0	111.1	Y49 D50 A56 L138 V159	Y49-A52 PolarHBondContact O-N 3.3Å; D50-A52 PolarHBondContact O-N 2.84Å; A52-A56 VanDerWaalsContact O-CB 3.22Å; A52-A56 WeakPolarHBondContact O-CB 3.44Å; A52-A56 PolarHBondContact O-N 3.45Å; A52-L138 HydrophobicContact CB-CD1 3.56Å; A52-V159 HydrophobicContact CB-CG1 4.05Å; A52-V159 HydrophobicContact CB-CG2 4.22Å
53	F	86.5	Confident	80.5	Confident	7 Å²	7	41 Å²	41	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-66.8	-51.6	177.3	179.6	-95.8	0	0	0	113.1	I45 Y49 D50 V51 T55 A56 C57 L60 L118 I133	I45-F53 HydrophobicContact CD1-CB 3.55Å; I45-F53 HydrophobicContact CD1-CD2 3.76Å; I45-F53 HydrophobicContact CD1-CG 3.76Å; Y49-F53 WeakPolarHBondContact O-CB 3.3Å; Y49-F53 PolarHBondContact O-N 3.38Å; D50-F53 PolarHBondContact O-N 3.16Å; V51-F53 VanDerWaalsContact C-N 3.32Å; F53-T55 PolarHBondContact O-N 2.98Å; F53-A56 PolarHBondContact O-N 3.31Å; F53-C57 HydrophobicContact CZ-CB 4.48Å; F53-C57 VanDerWaalsContact O-CB 3.27Å; F53-C57 WeakPolarHBondContact O-CB 3.39Å; F53-C57 PolarHBondContact O-N 3.41Å; F53-L60 HydrophobicContact CE1-CD1 4.22Å; F53-L60 HydrophobicContact CE1-CD2 4.16Å; F53-L60 HydrophobicContact CZ-CD2 4.34Å; F53-L118 HydrophobicContact CD2-CD1 4.02Å; F53-L118 HydrophobicContact CE1-CD1 4.43Å; F53-L118 HydrophobicContact CE2-CD1 3.24Å; F53-L118 HydrophobicContact CE2-CD2 4.45Å; F53-L118 HydrophobicContact CE2-CG 4.39Å; F53-L118 HydrophobicContact CZ-CD1 3.51Å; F53-I133 HydrophobicContact CD2-CD1 4.24Å; F53-I133 HydrophobicContact CE2-CD1 3.41Å; F53-I133 VanDerWaalsContact CE2-CD1 3.41Å; F53-I133 HydrophobicContact CE2-CG1 4.42Å; F53-I133 HydrophobicContact CZ-CD1 4.12Å
54	C	81.9	Confident	81	Confident	38 Å²	38	39.9 Å²	39.9	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-59.6	-33.7	178.3	-72.8	0	0	0	0	112	D50	D50-C54 WeakPolarHBondContact O-CB 3.1Å; D50-C54 PolarHBondContact O-N 2.8Å; D50-C54 PolarHBondContact O-SG 3.08Å
55	T	84	Confident	81.2	Confident	50 Å²	50	36.9 Å²	36.9	31%	0.307	20%	0.199	S	C	.	.	H	α-helix	trans	-78.1	-38.7	178.6	-52	0	0	0	0	112	V51 F53 C57 G163 L165	V51-T55 WeakPolarHBondContact O-CB 3.31Å; V51-T55 PolarHBondContact O-N 3.5Å; V51-T55 VanDerWaalsContact O-N 3.08Å; V51-T55 PolarHBondContact O-OG1 3.36Å; F53-T55 PolarHBondContact O-N 2.98Å; T55-C57 VanDerWaalsContact C-N 3.32Å; T55-C57 PolarHBondContact O-N 2.89Å; T55-G163 WeakPolarHBondContact CG2-O 3.46Å; T55-L165 HydrophobicContact CG2-CB 4.34Å
56	A	84.2	Confident	81.2	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-72.8	-22.7	177.4	0	0	0	0	0	113.4	A52 F53 L114 T136 R157 V159 L165	A52-A56 VanDerWaalsContact O-CB 3.22Å; A52-A56 WeakPolarHBondContact O-CB 3.44Å; A52-A56 PolarHBondContact O-N 3.45Å; F53-A56 PolarHBondContact O-N 3.31Å; A56-L114 HydrophobicContact CB-CD2 3.57Å; A56-T136 HydrophobicContact CB-CG2 4.19Å; A56-R157 PolarHBondContact O-NH1 3.19Å; A56-R157 PolarHBondContact O-NH2 3.48Å; A56-V159 HydrophobicContact CB-CB 4.36Å; A56-V159 HydrophobicContact CB-CG1 4.23Å; A56-V159 HydrophobicContact CB-CG2 4.45Å; A56-L165 HydrophobicContact CB-CD1 4.44Å
57	C	82.6	Confident	81.3	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.02	20%	0.199	C	C	.	.			trans	-103.4	75.1	-173.8	-155	0	0	0	0	112	F53 T55 G59 L60 V132 I133	F53-C57 HydrophobicContact CZ-CB 4.48Å; F53-C57 VanDerWaalsContact O-CB 3.27Å; F53-C57 WeakPolarHBondContact O-CB 3.39Å; F53-C57 PolarHBondContact O-N 3.41Å; T55-C57 VanDerWaalsContact C-N 3.32Å; T55-C57 PolarHBondContact O-N 2.89Å; C57-G59 PolarHBondContact O-N 3.2Å; C57-G59 VanDerWaalsContact O-N 3.14Å; C57-L60 HydrophobicContact CB-CD1 3.9Å; C57-L60 HydrophobicContact CB-CD2 4.17Å; C57-L60 HydrophobicContact CB-CG 3.73Å; C57-L60 WeakPolarHBondContact O-CG 3.36Å; C57-L60 VanDerWaalsContact SG-CD2 3.52Å; C57-L60 VanDerWaalsContact SG-CG 3.53Å; C57-V132 VanDerWaalsContact SG-CG1 3.53Å; C57-I133 HydrophobicContact CB-CG1 4.31Å
58	H	73.7	Confident	81.7	Confident	116 Å²	116	35.2 Å²	35.2	54%	0.537	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-5.6	179	-2.3	94.6	0	0	0	114.5	R157 L165 E167	H58-R157 PolarHBondContact CE1-NH2 2.96Å; H58-R157 PolarHBondContact NE2-NH2 3.17Å; H58-L165 WeakPolarHBondContact NE2-CD2 3.49Å; H58-E167 IonicContact CE1-OE1 2.83Å; H58-E167 PolarHBondContact CE1-OE1 3.26Å; H58-E167 IonicContact NE2-OE1 3.86Å
59	G	72.5	Confident	81.8	Confident	6 Å²	6	36.4 Å²	36.4	6%	0.062	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	10.7	-177.5	0	0	0	0	0	114.5	L37 C57 D61 N62	L37-G59 WeakPolarHBondContact CD1-O 3.45Å; C57-G59 PolarHBondContact O-N 3.2Å; C57-G59 VanDerWaalsContact O-N 3.14Å; G59-D61 PolarHBondContact O-N 3.14Å; G59-N62 WeakPolarHBondContact O-CB 3.49Å; G59-N62 PolarHBondContact O-N 2.96Å; G59-N62 PolarHBondContact O-ND2 3.22Å
60	L	74.3	Confident	81.6	Confident	13 Å²	13	35.8 Å²	35.8	7%	0.068	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.8	-179.8	-72.6	173.5	0	0	0	112.7	L37 E38 F53 C57 N62 F129	L37-L60 WeakPolarHBondContact CB-O 3.49Å; L37-L60 PolarHBondContact N-O 3.28Å; E38-L60 HydrophobicContact CG-CB 3.63Å; E38-L60 PolarHBondContact N-O 2.85Å; F53-L60 HydrophobicContact CE1-CD1 4.22Å; F53-L60 HydrophobicContact CE1-CD2 4.16Å; F53-L60 HydrophobicContact CZ-CD2 4.34Å; C57-L60 HydrophobicContact CB-CD1 3.9Å; C57-L60 HydrophobicContact CB-CD2 4.17Å; C57-L60 HydrophobicContact CB-CG 3.73Å; C57-L60 WeakPolarHBondContact O-CG 3.36Å; C57-L60 VanDerWaalsContact SG-CD2 3.52Å; C57-L60 VanDerWaalsContact SG-CG 3.53Å; L60-N62 PolarHBondContact O-N 3.5Å; L60-F129 HydrophobicContact CD2-CE1 4.06Å
61	D	74.1	Confident	81.6	Confident	70 Å²	70	35.2 Å²	35.2	37%	0.374	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-7.4	177.3	-54.2	-20.6	0	0	0	112.8	G59 I63	G59-D61 PolarHBondContact O-N 3.14Å; D61-I63 PolarHBondContact O-N 2.89Å
62	N	82.2	Confident	81.7	Confident	31 Å²	31	37.2 Å²	37.2	17%	0.166	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-67.5	134.8	-179.2	-65.8	-12.5	0	0	0	110.7	L37 G59 L60 T87 T89	L37-N62 HydrophobicContact CD1-CB 4.5Å; L37-N62 PolarHBondContact N-O 3.14Å; G59-N62 WeakPolarHBondContact O-CB 3.49Å; G59-N62 PolarHBondContact O-N 2.96Å; G59-N62 PolarHBondContact O-ND2 3.22Å; L60-N62 PolarHBondContact O-N 3.5Å; N62-T87 WeakPolarHBondContact CA-O 3.34Å; N62-T87 VanDerWaalsContact OD1-CB 3.32Å; N62-T87 WeakPolarHBondContact OD1-CB 3.47Å; N62-T87 WeakPolarHBondContact OD1-CG2 3.45Å; N62-T89 WeakPolarHBondContact CB-OG1 3.44Å
63	I	81.2	Confident	81.5	Confident	14 Å²	14	42.8 Å²	42.8	7%	0.072	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.6	177.4	-60.4	171.4	0	0	0	109.1	K20 L23 D61 V65 A86 T87 F88 T89	K20-I63 HydrophobicContact CG-CD1 4.44Å; L23-I63 HydrophobicContact CD1-CD1 3.72Å; D61-I63 PolarHBondContact O-N 2.89Å; I63-V65 HydrophobicContact CG2-CG1 4.49Å; I63-A86 HydrophobicContact CD1-CB 4.21Å; I63-T87 PolarHBondContact N-O 3.41Å; I63-F88 HydrophobicContact CB-CD1 3.69Å; I63-F88 HydrophobicContact CB-CE1 3.93Å; I63-F88 HydrophobicContact CD1-CD1 4.46Å; I63-F88 HydrophobicContact CD1-CE1 3.85Å; I63-F88 HydrophobicContact CD1-CZ 4.4Å; I63-F88 HydrophobicContact CG1-CE1 4.47Å; I63-F88 HydrophobicContact CG2-CD1 3.87Å; I63-F88 HydrophobicContact CG2-CE1 3.98Å; I63-F88 CarbonylContact O-C 3.5Å; I63-F88 WeakPolarHBondContact O-CA 3.45Å; I63-T89 PolarHBondContact O-N 3.27Å
64	V	80.6	Confident	81.1	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	123.8	179.7	-174.3	0	0	0	0	110	V34 G35 L37 T89 L91 L125	V34-V64 HydrophobicContact CB-CB 4.38Å; V34-V64 HydrophobicContact CB-CG1 4.33Å; V34-V64 PolarHBondContact N-O 3.42Å; G35-V64 WeakPolarHBondContact O-CB 3.35Å; G35-V64 PolarHBondContact O-N 3.46Å; L37-V64 HydrophobicContact CD1-CG2 4.46Å; L37-V64 HydrophobicContact CD2-CG2 3.56Å; L37-V64 HydrophobicContact CG-CG2 3.55Å; V64-T89 WeakPolarHBondContact CA-O 3.46Å; V64-L91 HydrophobicContact CG1-CD1 3.69Å; V64-L91 HydrophobicContact CG1-CD2 3.64Å; V64-L91 HydrophobicContact CG1-CG 3.51Å; V64-L125 HydrophobicContact CG1-CD2 4.04Å
65	V	82.8	Confident	81.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.4	176.1	-61.7	0	0	0	0	109.9	A33 I63 T70 F88 T89 C90 L91	A33-V65 HydrophobicContact CB-CG1 4.49Å; I63-V65 HydrophobicContact CG2-CG1 4.49Å; V65-T70 HydrophobicContact CB-CG2 4.25Å; V65-T70 HydrophobicContact CG1-CG2 4.35Å; V65-F88 HydrophobicContact CG1-CD1 3.89Å; V65-F88 HydrophobicContact CG2-CB 4.36Å; V65-T89 PolarHBondContact N-O 3.07Å; V65-C90 HydrophobicContact CG2-CB 4.13Å; V65-C90 VanDerWaalsContact CG2-SG 3.6Å; V65-C90 WeakPolarHBondContact O-CA 3.44Å; V65-L91 WeakPolarHBondContact O-CG 3.42Å; V65-L91 PolarHBondContact O-N 2.97Å
66	D	82.4	Confident	81.2	Confident	54 Å²	54	45.2 Å²	45.2	29%	0.289	24%	0.243	S	C	.	.	S	Bend	trans	-67.3	-45.9	-177.1	56	-1.5	0	0	0	113.6	T70 D92	D66-T70 VanDerWaalsContact OD1-CB 3.25Å; D66-T70 WeakPolarHBondContact OD1-CB 3.35Å; D66-T70 PolarHBondContact OD1-OG1 3.22Å; D66-D92 PolarHBondContact O-N 3.47Å; D66-D92 VanDerWaalsContact O-N 3.09Å
67	T	83.7	Confident	81	Confident	51 Å²	51	48.1 Å²	48.1	31%	0.313	26%	0.256	S	S	.	.	S	Bend	trans	-132.5	157.1	-173	69.9	0	0	0	0	112.8	E69 T70 G71 D92	T67-E69 PolarHBondContact O-N 2.97Å; T67-T70 PolarHBondContact O-N 3.49Å; T67-T70 PolarHBondContact OG1-N 3.29Å; T67-T70 PolarHBondContact OG1-OG1 3.15Å; T67-G71 PolarHBondContact O-N 3.07Å; T67-G71 VanDerWaalsContact O-N 3.12Å; T67-D92 WeakPolarHBondContact CA-OD1 3.44Å
68	L	87.3	Confident	80.9	Confident	84 Å²	84	48.5 Å²	48.5	44%	0.44	26%	0.257	S	S	.	.	H	α-helix	trans	-59.2	-33	173.3	-178.2	66	0	0	0	113	G71 T72 D92 K93	L68-G71 PolarHBondContact O-N 3.24Å; L68-T72 WeakPolarHBondContact O-CB 3.48Å; L68-T72 PolarHBondContact O-N 3.24Å; L68-T72 PolarHBondContact O-OG1 2.79Å; L68-D92 PolarHBondContact N-OD1 3.48Å; L68-D92 VanDerWaalsContact N-OD1 3.14Å; L68-D92 PolarHBondContact N-OD2 3.3Å; L68-K93 HydrophobicContact CB-CG 4.49Å
69	E	85.4	Confident	81.3	Confident	145 Å²	145	51.2 Å²	51.2	68%	0.678	27%	0.268	S	S	*	.	H	α-helix	trans	-64.1	-47.4	176.8	-74.9	-176.1	176.5	0	0	111.2	T67 G71 T72 K73	T67-E69 PolarHBondContact O-N 2.97Å; E69-G71 VanDerWaalsContact C-N 3.34Å; E69-G71 PolarHBondContact O-N 2.89Å; E69-T72 PolarHBondContact O-N 2.93Å; E69-K73 WeakPolarHBondContact O-CG 3.43Å; E69-K73 PolarHBondContact O-N 3.11Å
70	T	81	Confident	81.6	Confident	16 Å²	16	58.7 Å²	58.7	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-57.5	-47.5	174.5	-52.4	0	0	0	0	110.7	V65 D66 T67 T72 K73 C74	V65-T70 HydrophobicContact CB-CG2 4.25Å; V65-T70 HydrophobicContact CG1-CG2 4.35Å; D66-T70 VanDerWaalsContact OD1-CB 3.25Å; D66-T70 WeakPolarHBondContact OD1-CB 3.35Å; D66-T70 PolarHBondContact OD1-OG1 3.22Å; T67-T70 PolarHBondContact O-N 3.49Å; T67-T70 PolarHBondContact OG1-N 3.29Å; T67-T70 PolarHBondContact OG1-OG1 3.15Å; T70-T72 VanDerWaalsContact C-N 3.34Å; T70-T72 PolarHBondContact O-N 3.43Å; T70-K73 PolarHBondContact O-N 3.05Å; T70-C74 PolarHBondContact O-N 3.24Å; T70-C74 PolarHBondContact O-SG 3.01Å
71	G	83.9	Confident	81.7	Confident	5 Å²	5	60 Å²	60	5%	0.052	31%	0.314	C	S	.	.	H	α-helix	trans	-58.8	-42.6	177.1	0	0	0	0	0	113.3	T67 L68 E69 C74 V75	T67-G71 PolarHBondContact O-N 3.07Å; T67-G71 VanDerWaalsContact O-N 3.12Å; L68-G71 PolarHBondContact O-N 3.24Å; E69-G71 VanDerWaalsContact C-N 3.34Å; E69-G71 PolarHBondContact O-N 2.89Å; G71-C74 PolarHBondContact O-N 3.26Å; G71-V75 WeakPolarHBondContact O-CG2 3.25Å; G71-V75 PolarHBondContact O-N 3.22Å
72	T	85	Confident	81.8	Confident	76 Å²	76	65.1 Å²	65.1	47%	0.466	33%	0.333	S	S	.	.	H	α-helix	trans	-66.7	-38.7	178.8	-54.3	0	0	0	0	111.8	L68 E69 T70 V75 S76	L68-T72 WeakPolarHBondContact O-CB 3.48Å; L68-T72 PolarHBondContact O-N 3.24Å; L68-T72 PolarHBondContact O-OG1 2.79Å; E69-T72 PolarHBondContact O-N 2.93Å; T70-T72 VanDerWaalsContact C-N 3.34Å; T70-T72 PolarHBondContact O-N 3.43Å; T72-V75 PolarHBondContact O-N 3.24Å; T72-S76 WeakPolarHBondContact O-CB 3.47Å; T72-S76 PolarHBondContact O-N 3.16Å; T72-S76 PolarHBondContact O-OG 3.08Å
73	K	81.3	Confident	81.4	Confident	117 Å²	117	67.8 Å²	67.8	51%	0.509	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-45.5	172.7	-71.6	176.2	-176.8	178	0	111	E69 T70 V75 S76 F77	E69-K73 WeakPolarHBondContact O-CG 3.43Å; E69-K73 PolarHBondContact O-N 3.11Å; T70-K73 PolarHBondContact O-N 3.05Å; K73-V75 PolarHBondContact O-N 3.48Å; K73-S76 PolarHBondContact O-N 2.9Å; K73-F77 WeakPolarHBondContact O-CB 3.36Å; K73-F77 PolarHBondContact O-N 3.13Å
74	C	79.4	Confident	81.2	Confident	16 Å²	16	68.5 Å²	68.5	11%	0.108	35%	0.354	C	S	.	.	H	α-helix	trans	-60.3	-44.2	176.8	-65.6	0	0	0	0	112.4	L23 T70 G71 F77 L78 F88	L23-C74 HydrophobicContact CD2-CB 3.94Å; T70-C74 PolarHBondContact O-N 3.24Å; T70-C74 PolarHBondContact O-SG 3.01Å; G71-C74 PolarHBondContact O-N 3.26Å; C74-F77 WeakPolarHBondContact O-CB 3.47Å; C74-F77 PolarHBondContact O-N 3.03Å; C74-L78 WeakPolarHBondContact O-CG 3.29Å; C74-L78 PolarHBondContact O-N 3.42Å; C74-F88 HydrophobicContact CB-CD1 4.23Å; C74-F88 HydrophobicContact CB-CE1 3.64Å; C74-F88 HydrophobicContact CB-CE2 4.06Å; C74-F88 HydrophobicContact CB-CZ 3.54Å
75	V	84.2	Confident	81.1	Confident	77 Å²	77	78.4 Å²	78.4	47%	0.467	39%	0.391	S	S	.	.	H	α-helix	trans	-63.9	-43	176.2	172.6	0	0	0	0	111.5	G71 T72 K73 F77 L78 K79 F88	G71-V75 WeakPolarHBondContact O-CG2 3.25Å; G71-V75 PolarHBondContact O-N 3.22Å; T72-V75 PolarHBondContact O-N 3.24Å; K73-V75 PolarHBondContact O-N 3.48Å; V75-F77 VanDerWaalsContact C-N 3.32Å; V75-F77 PolarHBondContact O-N 2.91Å; V75-L78 PolarHBondContact O-N 3.08Å; V75-K79 WeakPolarHBondContact O-CB 3.29Å; V75-K79 PolarHBondContact O-N 2.96Å; V75-F88 HydrophobicContact CG2-CD2 3.77Å; V75-F88 HydrophobicContact CG2-CE2 3.83Å
76	S	83.1	Confident	81	Confident	52 Å²	52	80 Å²	80	36%	0.364	40%	0.404	S	S	.	.	H	α-helix	trans	-61.9	-41.7	177.6	-59.5	0	0	0	0	111.5	T72 K73 K79 Q80	T72-S76 WeakPolarHBondContact O-CB 3.47Å; T72-S76 PolarHBondContact O-N 3.16Å; T72-S76 PolarHBondContact O-OG 3.08Å; K73-S76 PolarHBondContact O-N 2.9Å; S76-K79 PolarHBondContact O-N 3.24Å; S76-Q80 WeakPolarHBondContact O-CB 3.44Å; S76-Q80 WeakPolarHBondContact O-CG 3.49Å; S76-Q80 PolarHBondContact O-N 2.84Å
77	F	80.2	Confident	81.1	Confident	62 Å²	62	81.7 Å²	81.7	27%	0.272	42%	0.416	S	S	.	.	H	α-helix	trans	-59.9	-49	174.4	174.8	-100.5	0	0	0	112	E22 T26 K73 C74 V75 K79 Q80 A81	E22-F77 HydrophobicContact CB-CE1 4.27Å; E22-F77 HydrophobicContact CB-CZ 4.44Å; T26-F77 HydrophobicContact CG2-CE2 4.23Å; T26-F77 HydrophobicContact CG2-CZ 4.36Å; K73-F77 WeakPolarHBondContact O-CB 3.36Å; K73-F77 PolarHBondContact O-N 3.13Å; C74-F77 WeakPolarHBondContact O-CB 3.47Å; C74-F77 PolarHBondContact O-N 3.03Å; V75-F77 VanDerWaalsContact C-N 3.32Å; V75-F77 PolarHBondContact O-N 2.91Å; F77-K79 VanDerWaalsContact C-N 3.27Å; F77-K79 PolarHBondContact O-N 3.23Å; F77-Q80 PolarHBondContact O-N 3.44Å; F77-A81 VanDerWaalsContact O-CB 3.27Å; F77-A81 WeakPolarHBondContact O-CB 3.4Å; F77-A81 PolarHBondContact O-N 3.21Å
78	L	80.3	Confident	81.2	Confident	10 Å²	10	80.8 Å²	80.8	5%	0.052	41%	0.408	C	S	.	.	H	α-helix	trans	-61.3	-36.8	178	-67.7	176.9	0	0	0	112.6	V19 C74 V75 K82 K83 A86 F88	V19-L78 HydrophobicContact CG1-CD1 4.25Å; V19-L78 HydrophobicContact CG1-CD2 3.67Å; V19-L78 HydrophobicContact CG2-CD2 4.42Å; C74-L78 WeakPolarHBondContact O-CG 3.29Å; C74-L78 PolarHBondContact O-N 3.42Å; V75-L78 PolarHBondContact O-N 3.08Å; L78-K82 WeakPolarHBondContact O-CA 3.48Å; L78-K82 PolarHBondContact O-N 3.36Å; L78-K83 HydrophobicContact CD2-CB 4.24Å; L78-K83 PolarHBondContact O-N 3.09Å; L78-A86 HydrophobicContact CD1-CB 3.77Å; L78-F88 HydrophobicContact CD1-CE2 3.94Å; L78-F88 HydrophobicContact CD1-CZ 3.86Å
79	K	81.5	Confident	81.2	Confident	173 Å²	173	77.2 Å²	77.2	75%	0.752	39%	0.39	S	S	*	.	H	α-helix	trans	-68.6	-44.2	177.3	-166.3	179.2	-178.4	-177.2	0	111.9	V75 S76 F77 K82	V75-K79 WeakPolarHBondContact O-CB 3.29Å; V75-K79 PolarHBondContact O-N 2.96Å; S76-K79 PolarHBondContact O-N 3.24Å; F77-K79 VanDerWaalsContact C-N 3.27Å; F77-K79 PolarHBondContact O-N 3.23Å; K79-K82 PolarHBondContact O-N 3.26Å
80	Q	79.1	Confident	81.3	Confident	163 Å²	163	71.3 Å²	71.3	76%	0.762	36%	0.364	S	S	*	.	H	α-helix	trans	-66.8	-43.3	177.2	-72.8	174	4	0	0	111.6	S76 F77 K82	S76-Q80 WeakPolarHBondContact O-CB 3.44Å; S76-Q80 WeakPolarHBondContact O-CG 3.49Å; S76-Q80 PolarHBondContact O-N 2.84Å; F77-Q80 PolarHBondContact O-N 3.44Å; Q80-K82 VanDerWaalsContact C-N 3.29Å; Q80-K82 PolarHBondContact O-N 3.49Å
81	A	77.7	Confident	81.5	Confident	41 Å²	41	71.8 Å²	71.8	34%	0.339	37%	0.366	S	S	.	.	H	α-helix	trans	-78.5	-10	-179.8	0	0	0	0	0	113.7	F77 K83	F77-A81 VanDerWaalsContact O-CB 3.27Å; F77-A81 WeakPolarHBondContact O-CB 3.4Å; F77-A81 PolarHBondContact O-N 3.21Å; A81-K83 HydrophobicContact CB-CB 4.38Å; A81-K83 HydrophobicContact CB-CG 3.68Å; A81-K83 PolarHBondContact O-N 2.88Å
82	K	75.8	Confident	81.6	Confident	177 Å²	177	74 Å²	74	77%	0.77	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	36.2	-173.9	-61.6	-178.8	179.8	177	0	113.3	L78 K79 Q80 G84	L78-K82 WeakPolarHBondContact O-CA 3.48Å; L78-K82 PolarHBondContact O-N 3.36Å; K79-K82 PolarHBondContact O-N 3.26Å; Q80-K82 VanDerWaalsContact C-N 3.29Å; Q80-K82 PolarHBondContact O-N 3.49Å; K82-G84 VanDerWaalsContact C-N 3.35Å; K82-G84 PolarHBondContact O-N 3.1Å
83	K	73.1	Confident	81.7	Confident	87 Å²	87	76 Å²	76	38%	0.378	38%	0.379	S	S	.	.			trans	-92.4	27.1	-173.9	-68.3	-68.3	-175.7	172	0	114.6	F14 V19 L78 A81	F14-K83 VanDerWaalsContact CD2-C 3.42Å; F14-K83 WeakPolarHBondContact CD2-O 3.33Å; V19-K83 WeakPolarHBondContact CG2-O 3.45Å; L78-K83 HydrophobicContact CD2-CB 4.24Å; L78-K83 PolarHBondContact O-N 3.09Å; A81-K83 HydrophobicContact CB-CB 4.38Å; A81-K83 HydrophobicContact CB-CG 3.68Å; A81-K83 PolarHBondContact O-N 2.88Å
84	G	76.6	Confident	82	Confident	29 Å²	29	71 Å²	71	30%	0.299	36%	0.358	S	S	.	.			trans	92	-153.7	178.2	0	0	0	0	0	114.2	K82	K82-G84 VanDerWaalsContact C-N 3.35Å; K82-G84 PolarHBondContact O-N 3.1Å
85	R	80.1	Confident	82.1	Confident	211 Å²	211	76.4 Å²	76.4	80%	0.796	38%	0.38	S	S	*	.			trans	-130	133.6	-174	-65.3	-177.4	177.6	-177.5	-0.7	109.7
86	A	79.9	Confident	82.2	Confident	33 Å²	33	81.8 Å²	81.8	27%	0.273	39%	0.392	S	S	.	.			trans	-133.3	157.5	171.1	0	0	0	0	0	109.2	V19 I63 L78 F88	V19-A86 HydrophobicContact CG1-CB 4.05Å; I63-A86 HydrophobicContact CD1-CB 4.21Å; L78-A86 HydrophobicContact CD1-CB 3.77Å; A86-F88 HydrophobicContact CB-CE2 4.06Å; A86-F88 HydrophobicContact CB-CZ 3.99Å
87	T	84.1	Confident	82.2	Confident	90 Å²	90	82.5 Å²	82.5	55%	0.552	39%	0.387	S	S	*	.			trans	-113.1	134.4	-179.6	-51.4	0	0	0	0	109	N62 I63	N62-T87 WeakPolarHBondContact CA-O 3.34Å; N62-T87 VanDerWaalsContact OD1-CB 3.32Å; N62-T87 WeakPolarHBondContact OD1-CB 3.47Å; N62-T87 WeakPolarHBondContact OD1-CG2 3.45Å; I63-T87 PolarHBondContact N-O 3.41Å
88	F	86.3	Confident	82.4	Confident	32 Å²	32	83.8 Å²	83.8	14%	0.14	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.3	-174.4	-58.8	-87.7	0	0	0	111.2	L23 I63 V65 C74 V75 L78 A86	L23-F88 HydrophobicContact CD1-CE1 3.98Å; L23-F88 HydrophobicContact CD1-CZ 4.07Å; I63-F88 HydrophobicContact CB-CD1 3.69Å; I63-F88 HydrophobicContact CB-CE1 3.93Å; I63-F88 HydrophobicContact CD1-CD1 4.46Å; I63-F88 HydrophobicContact CD1-CE1 3.85Å; I63-F88 HydrophobicContact CD1-CZ 4.4Å; I63-F88 HydrophobicContact CG1-CE1 4.47Å; I63-F88 HydrophobicContact CG2-CD1 3.87Å; I63-F88 HydrophobicContact CG2-CE1 3.98Å; I63-F88 CarbonylContact O-C 3.5Å; I63-F88 WeakPolarHBondContact O-CA 3.45Å; V65-F88 HydrophobicContact CG1-CD1 3.89Å; V65-F88 HydrophobicContact CG2-CB 4.36Å; C74-F88 HydrophobicContact CB-CD1 4.23Å; C74-F88 HydrophobicContact CB-CE1 3.64Å; C74-F88 HydrophobicContact CB-CE2 4.06Å; C74-F88 HydrophobicContact CB-CZ 3.54Å; V75-F88 HydrophobicContact CG2-CD2 3.77Å; V75-F88 HydrophobicContact CG2-CE2 3.83Å; L78-F88 HydrophobicContact CD1-CE2 3.94Å; L78-F88 HydrophobicContact CD1-CZ 3.86Å; A86-F88 HydrophobicContact CB-CE2 4.06Å; A86-F88 HydrophobicContact CB-CZ 3.99Å
89	T	86.5	Confident	82.6	Confident	10 Å²	10	88.3 Å²	88.3	6%	0.061	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.9	173.6	-55.5	0	0	0	0	108.9	N62 I63 V64 V65 V94 A128	N62-T89 WeakPolarHBondContact CB-OG1 3.44Å; I63-T89 PolarHBondContact O-N 3.27Å; V64-T89 WeakPolarHBondContact CA-O 3.46Å; V65-T89 PolarHBondContact N-O 3.07Å; T89-V94 HydrophobicContact CG2-CG1 3.87Å; T89-A128 HydrophobicContact CG2-CB 4.07Å
90	C	88.8	Confident	82.7	Confident	20 Å²	20	83.2 Å²	83.2	14%	0.135	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.5	-178	-53.5	0	0	0	0	110.5	V65 D92 K93 V94	V65-C90 HydrophobicContact CG2-CB 4.13Å; V65-C90 VanDerWaalsContact CG2-SG 3.6Å; V65-C90 WeakPolarHBondContact O-CA 3.44Å; C90-D92 VanDerWaalsContact C-N 3.33Å; C90-D92 VanDerWaalsContact CB-OD1 3.26Å; C90-D92 WeakPolarHBondContact CB-OD1 3.44Å; C90-D92 PolarHBondContact O-N 3.45Å; C90-K93 HydrophobicContact CB-CB 4.46Å; C90-K93 HydrophobicContact CB-CG 4.33Å; C90-K93 PolarHBondContact O-N 2.92Å; C90-K93 VanDerWaalsContact O-N 3.1Å; C90-V94 PolarHBondContact O-N 3.44Å
91	L	85.2	Confident	82.9	Confident	26 Å²	26	76.7 Å²	76.7	14%	0.136	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-40	-174.9	-72.8	176.6	0	0	0	112.4	V34 V64 V65 K93 V94 K95 L125 A128	V34-L91 HydrophobicContact CG2-CD1 4.22Å; V64-L91 HydrophobicContact CG1-CD1 3.69Å; V64-L91 HydrophobicContact CG1-CD2 3.64Å; V64-L91 HydrophobicContact CG1-CG 3.51Å; V65-L91 WeakPolarHBondContact O-CG 3.42Å; V65-L91 PolarHBondContact O-N 2.97Å; L91-K93 PolarHBondContact O-N 3.17Å; L91-V94 HydrophobicContact CD2-CG2 4.22Å; L91-V94 WeakPolarHBondContact O-CG2 3.17Å; L91-V94 PolarHBondContact O-N 3.41Å; L91-K95 PolarHBondContact O-N 3.41Å; L91-L125 HydrophobicContact CD2-CD2 4.16Å; L91-A128 HydrophobicContact CD2-CB 4.12Å
92	D	86.1	Confident	83.1	Confident	52 Å²	52	82.2 Å²	82.2	28%	0.278	39%	0.391	S	S	.	.	H	α-helix	trans	-56.5	-33.9	175.1	70.8	-42.7	0	0	0	113.6	D66 T67 L68 C90	D66-D92 PolarHBondContact O-N 3.47Å; D66-D92 VanDerWaalsContact O-N 3.09Å; T67-D92 WeakPolarHBondContact CA-OD1 3.44Å; L68-D92 PolarHBondContact N-OD1 3.48Å; L68-D92 VanDerWaalsContact N-OD1 3.14Å; L68-D92 PolarHBondContact N-OD2 3.3Å; C90-D92 VanDerWaalsContact C-N 3.33Å; C90-D92 VanDerWaalsContact CB-OD1 3.26Å; C90-D92 WeakPolarHBondContact CB-OD1 3.44Å; C90-D92 PolarHBondContact O-N 3.45Å
93	K	86.8	Confident	83.5	Confident	118 Å²	118	78.8 Å²	78.8	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-89.8	-25.6	-178.4	-59.9	-50.6	-179.9	-167.6	0	114.3	L68 C90 L91	L68-K93 HydrophobicContact CB-CG 4.49Å; C90-K93 HydrophobicContact CB-CB 4.46Å; C90-K93 HydrophobicContact CB-CG 4.33Å; C90-K93 PolarHBondContact O-N 2.92Å; C90-K93 VanDerWaalsContact O-N 3.1Å; L91-K93 PolarHBondContact O-N 3.17Å
94	V	86.8	Confident	83.8	Confident	13 Å²	13	80.3 Å²	80.3	8%	0.079	39%	0.392	C	S	.	.	H	α-helix	trans	-81.3	-14.6	177.3	-63.9	0	0	0	0	113.2	T89 C90 L91 R96 W97 A127 A128	T89-V94 HydrophobicContact CG2-CG1 3.87Å; C90-V94 PolarHBondContact O-N 3.44Å; L91-V94 HydrophobicContact CD2-CG2 4.22Å; L91-V94 WeakPolarHBondContact O-CG2 3.17Å; L91-V94 PolarHBondContact O-N 3.41Å; V94-R96 PolarHBondContact O-N 3.42Å; V94-W97 WeakPolarHBondContact O-CB 3.28Å; V94-W97 VanDerWaalsContact O-CD1 3.25Å; V94-W97 PolarHBondContact O-N 2.9Å; V94-A127 HydrophobicContact CG2-CB 4.27Å; V94-A128 HydrophobicContact CG2-CB 4.32Å
95	K	83.1	Confident	83.9	Confident	129 Å²	129	80.6 Å²	80.6	56%	0.561	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-51.1	-27.2	173.3	-78.9	-178.2	-178.7	-176.3	0	114.5	L91 W97 E98	L91-K95 PolarHBondContact O-N 3.41Å; K95-W97 PolarHBondContact O-N 3.47Å; K95-E98 WeakPolarHBondContact O-CB 3.5Å; K95-E98 WeakPolarHBondContact O-CG 3.5Å; K95-E98 PolarHBondContact O-N 2.92Å
96	R	84.6	Confident	84	Confident	189 Å²	189	75.9 Å²	75.9	71%	0.713	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-53.9	-25.1	174.5	73.5	-178.8	-175.1	179.7	-2.1	113.5	V94	V94-R96 PolarHBondContact O-N 3.42Å
97	W	84.7	Confident	84.1	Confident	68 Å²	68	76.9 Å²	76.9	26%	0.258	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-81.6	-12.6	-178.2	-65.6	121.9	0	0	0	114.3	V94 K95 S99 E100 M101 Y130	V94-W97 WeakPolarHBondContact O-CB 3.28Å; V94-W97 VanDerWaalsContact O-CD1 3.25Å; V94-W97 PolarHBondContact O-N 2.9Å; K95-W97 PolarHBondContact O-N 3.47Å; W97-S99 PolarHBondContact O-N 3.18Å; W97-S99 VanDerWaalsContact O-N 3.15Å; W97-E100 HydrophobicContact CE3-CB 4.06Å; W97-E100 HydrophobicContact CE3-CG 4.31Å; W97-E100 HydrophobicContact CZ3-CG 4.39Å; W97-E100 PolarHBondContact O-N 2.88Å; W97-E100 VanDerWaalsContact O-N 3.12Å; W97-M101 VanDerWaalsContact O-CB 3.24Å; W97-M101 WeakPolarHBondContact O-CB 3.39Å; W97-M101 PolarHBondContact O-N 3.32Å; W97-Y130 HydrophobicContact CB-CD1 3.68Å; W97-Y130 HydrophobicContact CB-CE1 4.32Å; W97-Y130 HydrophobicContact CD2-CD1 4.12Å; W97-Y130 HydrophobicContact CD2-CE1 4.21Å; W97-Y130 HydrophobicContact CE3-CD1 4.12Å; W97-Y130 AromaticContact CE3-CE1 3.75Å; W97-Y130 HydrophobicContact CE3-CE1 3.75Å; W97-Y130 AromaticContact CG-CD1 3.97Å; W97-Y130 HydrophobicContact CG-CD1 3.97Å; W97-Y130 HydrophobicContact CG-CE1 4.49Å; W97-Y130 HydrophobicContact CZ3-CE1 4.4Å
98	E	84.3	Confident	84	Confident	88 Å²	88	74 Å²	74	41%	0.411	37%	0.372	S	S	.	.	H	α-helix	trans	-57.4	-33.6	-177.5	-75	-179	-178.2	0	0	113.1	K95 K102 A127	K95-E98 WeakPolarHBondContact O-CB 3.5Å; K95-E98 WeakPolarHBondContact O-CG 3.5Å; K95-E98 PolarHBondContact O-N 2.92Å; E98-K102 WeakPolarHBondContact O-CG 3.42Å; E98-A127 HydrophobicContact CG-CB 4.29Å
99	S	83.6	Confident	83.6	Confident	105 Å²	105	83.9 Å²	83.9	73%	0.734	41%	0.408	S	S	*	.	H	α-helix	trans	-74.9	-44.4	176.9	-62.3	0	0	0	0	112.1	W97 K102	W97-S99 PolarHBondContact O-N 3.18Å; W97-S99 VanDerWaalsContact O-N 3.15Å; S99-K102 PolarHBondContact O-N 3.43Å
100	E	83.1	Confident	83.1	Confident	67 Å²	67	86.1 Å²	86.1	31%	0.313	43%	0.433	S	S	.	.	H	α-helix	trans	-69.1	-37.8	-178.4	-166.1	63.1	-147.8	0	0	111.7	W97 K102 R103 Y130	W97-E100 HydrophobicContact CE3-CB 4.06Å; W97-E100 HydrophobicContact CE3-CG 4.31Å; W97-E100 HydrophobicContact CZ3-CG 4.39Å; W97-E100 PolarHBondContact O-N 2.88Å; W97-E100 VanDerWaalsContact O-N 3.12Å; E100-K102 VanDerWaalsContact C-N 3.28Å; E100-K102 PolarHBondContact O-N 3.46Å; E100-R103 VanDerWaalsContact O-CB 3.3Å; E100-R103 WeakPolarHBondContact O-CB 3.48Å; E100-R103 PolarHBondContact O-N 2.98Å; E100-R103 VanDerWaalsContact O-N 3.13Å; E100-R103 IonicContact OE1-CZ 2.8Å; E100-R103 VanDerWaalsContact OE1-CZ 3.22Å; E100-R103 IonicContact OE1-NE 2.65Å; E100-R103 PolarHBondContact OE1-NE 3.14Å; E100-R103 IonicContact OE1-NH2 3.84Å; E100-R103 PolarHBondContact OE1-NH2 3.41Å; E100-R103 IonicContact OE2-NE 3.68Å; E100-Y130 HydrophobicContact CB-CE1 4.18Å; E100-Y130 HydrophobicContact CG-CE1 4.16Å
101	M	83	Confident	82.9	Confident	26 Å²	26	85.7 Å²	85.7	13%	0.128	43%	0.431	C	S	.	.	H	α-helix	trans	-56.1	-41.8	178.3	-178	-168.8	79.7	0	0	112.3	W97 R103 R113 F115 L126 Y130	W97-M101 VanDerWaalsContact O-CB 3.24Å; W97-M101 WeakPolarHBondContact O-CB 3.39Å; W97-M101 PolarHBondContact O-N 3.32Å; M101-R103 VanDerWaalsContact C-N 3.33Å; M101-R113 PolarHBondContact O-NH1 3.28Å; M101-R113 PolarHBondContact O-NH2 2.9Å; M101-F115 HydrophobicContact CG-CD1 4.18Å; M101-F115 HydrophobicContact CG-CE1 3.25Å; M101-F115 HydrophobicContact CG-CZ 3.52Å; M101-F115 HydrophobicContact SD-CE1 3.68Å; M101-F115 HydrophobicContact SD-CZ 3.44Å; M101-F115 WeakPolarHBondContact SD-CZ 3.41Å; M101-L126 HydrophobicContact SD-CB 3.87Å; M101-Y130 HydrophobicContact CB-CD1 4.29Å; M101-Y130 HydrophobicContact CB-CD2 4.07Å; M101-Y130 HydrophobicContact CB-CE2 4.46Å; M101-Y130 HydrophobicContact CB-CG 3.97Å; M101-Y130 HydrophobicContact CG-CD2 3.93Å; M101-Y130 HydrophobicContact CG-CG 4.07Å
102	K	83.1	Confident	83.1	Confident	156 Å²	156	90 Å²	90	68%	0.678	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-6.3	-177.5	-65.7	176.6	-177.3	174.3	0	113.5	E98 S99 E100	E98-K102 WeakPolarHBondContact O-CG 3.42Å; S99-K102 PolarHBondContact O-N 3.43Å; E100-K102 VanDerWaalsContact C-N 3.28Å; E100-K102 PolarHBondContact O-N 3.46Å
103	R	84.5	Confident	83.3	Confident	106 Å²	106	88.3 Å²	88.3	40%	0.4	44%	0.438	S	S	.	.	S	Bend	trans	-69	128.8	-177.6	-172.7	175	62.7	79.1	-2	110.2	E100 M101 L105	E100-R103 VanDerWaalsContact O-CB 3.3Å; E100-R103 WeakPolarHBondContact O-CB 3.48Å; E100-R103 PolarHBondContact O-N 2.98Å; E100-R103 VanDerWaalsContact O-N 3.13Å; E100-R103 IonicContact OE1-CZ 2.8Å; E100-R103 VanDerWaalsContact OE1-CZ 3.22Å; E100-R103 IonicContact OE1-NE 2.65Å; E100-R103 PolarHBondContact OE1-NE 3.14Å; E100-R103 IonicContact OE1-NH2 3.84Å; E100-R103 PolarHBondContact OE1-NH2 3.41Å; E100-R103 IonicContact OE2-NE 3.68Å; M101-R103 VanDerWaalsContact C-N 3.33Å; R103-L105 PolarHBondContact O-N 2.73Å
104	P	78.7	Confident	83.4	Confident	119 Å²	119	82.8 Å²	82.8	77%	0.773	41%	0.414	S	S	*	.			trans	-63.9	132.7	173	22.8	-30	0	0	0	110.7
105	L	79.7	Confident	83.5	Confident	34 Å²	34	82.9 Å²	82.9	18%	0.178	41%	0.413	C	S	.	.			trans	-113.3	127.1	-177.8	-78.9	152.4	0	0	0	110.6	R103 V107 R113 D135 W156	R103-L105 PolarHBondContact O-N 2.73Å; L105-V107 PolarHBondContact O-N 3.19Å; L105-V107 VanDerWaalsContact O-N 3.09Å; L105-R113 VanDerWaalsContact CD1-CZ 3.41Å; L105-R113 VanDerWaalsContact CD1-NE 3.26Å; L105-D135 HydrophobicContact CD1-CB 4.02Å; L105-D135 VanDerWaalsContact CD1-CG 3.42Å; L105-D135 WeakPolarHBondContact CD1-OD1 3.39Å; L105-W156 HydrophobicContact CD2-CH2 4.21Å; L105-W156 HydrophobicContact CD2-CZ3 4.27Å
106	S	81	Confident	83.7	Confident	113 Å²	113	81.6 Å²	81.6	79%	0.79	41%	0.413	S	S	*	.			trans	-77.5	91.5	170.1	-179.4	0	0	0	0	109.4
107	V	81.8	Confident	83.9	Confident	54 Å²	54	74.9 Å²	74.9	33%	0.327	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-78.8	139.9	178.6	-75.7	0	0	0	0	111.8	L105 L137	L105-V107 PolarHBondContact O-N 3.19Å; L105-V107 VanDerWaalsContact O-N 3.09Å; V107-L137 HydrophobicContact CB-CD2 4.49Å; V107-L137 HydrophobicContact CG1-CD2 3.51Å
108	P	81.6	Confident	83.9	Confident	30 Å²	30	72.4 Å²	72.4	20%	0.195	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-56.7	150.6	172.9	-26.2	36.2	0	0	0	112.7	G110 A111 L137 I148	P108-G110 PolarHBondContact O-N 3.32Å; P108-A111 WeakPolarHBondContact O-CB 3.28Å; P108-A111 PolarHBondContact O-N 3.47Å; P108-A111 VanDerWaalsContact O-N 3.08Å; P108-L137 HydrophobicContact CG-CD1 4.41Å; P108-I148 HydrophobicContact CB-CG2 4.38Å; P108-I148 HydrophobicContact CG-CG2 4.15Å
109	R	78.4	Confident	83.9	Confident	238 Å²	238	77.4 Å²	77.4	90%	0.898	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	130.8	179	-78	-174.5	176.5	-177.8	-0.6	111.4
110	G	76.2	Confident	83.7	Confident	58 Å²	58	73.7 Å²	73.7	60%	0.598	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-20.4	-179	0	0	0	0	0	114.2	P108	P108-G110 PolarHBondContact O-N 3.32Å
111	A	84.9	Confident	83.6	Confident	10 Å²	10	77.8 Å²	77.8	8%	0.083	39%	0.39	C	S	.	.			trans	-90	142.6	-175.8	0	0	0	0	0	112.9	P108 L137 I148	P108-A111 WeakPolarHBondContact O-CB 3.28Å; P108-A111 PolarHBondContact O-N 3.47Å; P108-A111 VanDerWaalsContact O-N 3.08Å; A111-L137 HydrophobicContact CB-CB 4.22Å; A111-L137 HydrophobicContact CB-CD1 4.04Å; A111-I148 HydrophobicContact CB-CD1 3.88Å
112	K	88.6	Confident	83.4	Confident	118 Å²	118	79.3 Å²	79.3	51%	0.513	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148	166.7	-63.1	-180	-174.4	175	0	109.6	L114 L137 L138	K112-L114 PolarHBondContact O-N 3.06Å; K112-L137 CarbonylContact O-C 3.57Å; K112-L137 WeakPolarHBondContact O-CA 3.37Å; K112-L138 PolarHBondContact N-O 2.7Å; K112-L138 PolarHBondContact O-N 3Å
113	R	90.2	Very high	83.3	Confident	16 Å²	16	76.3 Å²	76.3	6%	0.06	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	120.9	173.2	-172	-176.7	-177	-155.4	22.7	108.8	M101 L105 F115 D116 Y130 D135	M101-R113 PolarHBondContact O-NH1 3.28Å; M101-R113 PolarHBondContact O-NH2 2.9Å; L105-R113 VanDerWaalsContact CD1-CZ 3.41Å; L105-R113 VanDerWaalsContact CD1-NE 3.26Å; R113-F115 VanDerWaalsContact C-N 3.26Å; R113-F115 HydrophobicContact CG-CB 4.24Å; R113-F115 PolarHBondContact O-N 3.14Å; R113-D116 WeakPolarHBondContact CB-OD2 3.28Å; R113-D116 WeakPolarHBondContact CD-OD1 3.4Å; R113-D116 WeakPolarHBondContact CD-OD2 3.3Å; R113-D116 IonicContact CZ-OD1 2.83Å; R113-D116 IonicContact NE-OD1 3.23Å; R113-D116 IonicContact NH1-OD1 2.77Å; R113-D116 PolarHBondContact NH1-OD1 2.94Å; R113-D116 PolarHBondContact O-N 3.21Å; R113-Y130 PolarHBondContact NH2-OH 3.06Å; R113-D135 IonicContact CZ-OD1 3Å; R113-D135 VanDerWaalsContact CZ-OD1 3.26Å; R113-D135 IonicContact NE-OD1 2.85Å; R113-D135 PolarHBondContact NE-OD1 3.49Å; R113-D135 IonicContact NH2-OD1 2.87Å; R113-D135 PolarHBondContact NH2-OD1 3.31Å
114	L	89.6	Confident	83	Confident	1 Å²	1	78.3 Å²	78.3	1%	0.005	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-61.8	-35.9	-176.5	-178.5	63.1	0	0	0	112.2	I45 A56 K112 D116 L117 I133 T136 V159	I45-L114 HydrophobicContact CD1-CD1 4.35Å; A56-L114 HydrophobicContact CB-CD2 3.57Å; K112-L114 PolarHBondContact O-N 3.06Å; L114-D116 VanDerWaalsContact C-N 3.27Å; L114-D116 PolarHBondContact O-N 2.92Å; L114-L117 HydrophobicContact CD1-CD1 4.34Å; L114-L117 WeakPolarHBondContact O-CB 3.32Å; L114-L117 PolarHBondContact O-N 3.25Å; L114-L117 VanDerWaalsContact O-N 3.14Å; L114-I133 HydrophobicContact CD2-CG2 4.34Å; L114-T136 WeakPolarHBondContact CB-O 3.4Å; L114-T136 HydrophobicContact CD2-CG2 4.26Å; L114-T136 PolarHBondContact N-O 2.88Å; L114-V159 HydrophobicContact CD2-CG1 3.99Å
115	F	89	Confident	83.2	Confident	15 Å²	15	72.9 Å²	72.9	7%	0.066	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-59.1	-36.6	178.1	-177.6	-95.6	0	0	0	112.9	M101 R113 L117 L118 L126 F129 Y130 I133	M101-F115 HydrophobicContact CG-CD1 4.18Å; M101-F115 HydrophobicContact CG-CE1 3.25Å; M101-F115 HydrophobicContact CG-CZ 3.52Å; M101-F115 HydrophobicContact SD-CE1 3.68Å; M101-F115 HydrophobicContact SD-CZ 3.44Å; M101-F115 WeakPolarHBondContact SD-CZ 3.41Å; R113-F115 VanDerWaalsContact C-N 3.26Å; R113-F115 HydrophobicContact CG-CB 4.24Å; R113-F115 PolarHBondContact O-N 3.14Å; F115-L117 PolarHBondContact O-N 3.41Å; F115-L118 VanDerWaalsContact O-CB 3.27Å; F115-L118 WeakPolarHBondContact O-CB 3.42Å; F115-L118 PolarHBondContact O-N 3.34Å; F115-L118 VanDerWaalsContact O-N 3.15Å; F115-L126 HydrophobicContact CZ-CD2 4.05Å; F115-F129 HydrophobicContact CE2-CB 4.16Å; F115-Y130 AromaticContact CD1-CD2 3.98Å; F115-Y130 HydrophobicContact CD1-CD2 3.98Å; F115-Y130 AromaticContact CD2-CD2 3.81Å; F115-Y130 HydrophobicContact CD2-CD2 3.81Å; F115-Y130 HydrophobicContact CD2-CG 4.49Å; F115-Y130 HydrophobicContact CE1-CD2 4.12Å; F115-Y130 AromaticContact CE2-CD2 3.94Å; F115-Y130 HydrophobicContact CE2-CD2 3.94Å; F115-Y130 HydrophobicContact CE2-CG 4.27Å; F115-Y130 AromaticContact CG-CD2 3.83Å; F115-Y130 HydrophobicContact CG-CD2 3.83Å; F115-Y130 HydrophobicContact CZ-CD2 4.09Å; F115-Y130 HydrophobicContact CZ-CG 4.46Å; F115-I133 HydrophobicContact CB-CG2 4.31Å; F115-I133 HydrophobicContact CD2-CD1 4.49Å
116	D	88	Confident	83.5	Confident	103 Å²	103	73.3 Å²	73.3	55%	0.551	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-73.3	-12.2	-178.1	-57.7	-17.1	0	0	0	112.4	R113 L114 L118	R113-D116 WeakPolarHBondContact CB-OD2 3.28Å; R113-D116 WeakPolarHBondContact CD-OD1 3.4Å; R113-D116 WeakPolarHBondContact CD-OD2 3.3Å; R113-D116 IonicContact CZ-OD1 2.83Å; R113-D116 IonicContact NE-OD1 3.23Å; R113-D116 IonicContact NH1-OD1 2.77Å; R113-D116 PolarHBondContact NH1-OD1 2.94Å; R113-D116 PolarHBondContact O-N 3.21Å; L114-D116 VanDerWaalsContact C-N 3.27Å; L114-D116 PolarHBondContact O-N 2.92Å; D116-L118 VanDerWaalsContact C-N 3.35Å
117	L	87.3	Confident	83.7	Confident	48 Å²	48	68.1 Å²	68.1	25%	0.251	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-86.2	-9.1	175.2	-55.8	176.6	0	0	0	112.5	Y49 L114 F115 L138	Y49-L117 HydrophobicContact CD1-CD1 4.35Å; Y49-L117 HydrophobicContact CD2-CD1 3.83Å; Y49-L117 HydrophobicContact CE1-CD1 4.44Å; Y49-L117 HydrophobicContact CE2-CD1 3.97Å; Y49-L117 HydrophobicContact CE2-CD2 4.43Å; Y49-L117 HydrophobicContact CG-CD1 4.04Å; L114-L117 HydrophobicContact CD1-CD1 4.34Å; L114-L117 WeakPolarHBondContact O-CB 3.32Å; L114-L117 PolarHBondContact O-N 3.25Å; L114-L117 VanDerWaalsContact O-N 3.14Å; F115-L117 PolarHBondContact O-N 3.41Å; L117-L138 HydrophobicContact CD1-CD2 3.96Å
118	L	85	Confident	83.8	Confident	16 Å²	16	65.5 Å²	65.5	8%	0.084	32%	0.321	C	S	.	.			trans	-82.7	133	-178.3	-161.1	73.8	0	0	0	111	I43 F53 F115 D116 V120 F129 I133	I43-L118 HydrophobicContact CG2-CD1 3.35Å; I43-L118 HydrophobicContact CG2-CD2 4.45Å; I43-L118 HydrophobicContact CG2-CG 3.92Å; F53-L118 HydrophobicContact CD2-CD1 4.02Å; F53-L118 HydrophobicContact CE1-CD1 4.43Å; F53-L118 HydrophobicContact CE2-CD1 3.24Å; F53-L118 HydrophobicContact CE2-CD2 4.45Å; F53-L118 HydrophobicContact CE2-CG 4.39Å; F53-L118 HydrophobicContact CZ-CD1 3.51Å; F115-L118 VanDerWaalsContact O-CB 3.27Å; F115-L118 WeakPolarHBondContact O-CB 3.42Å; F115-L118 PolarHBondContact O-N 3.34Å; F115-L118 VanDerWaalsContact O-N 3.15Å; D116-L118 VanDerWaalsContact C-N 3.35Å; L118-V120 HydrophobicContact CD2-CG2 3.47Å; L118-V120 VanDerWaalsContact CD2-CG2 3.47Å; L118-V120 HydrophobicContact CG-CG2 3.84Å; L118-F129 HydrophobicContact CD2-CB 3.85Å; L118-F129 HydrophobicContact CD2-CD1 4.19Å; L118-F129 HydrophobicContact CD2-CD2 4.16Å; L118-F129 HydrophobicContact CD2-CG 3.78Å; L118-I133 HydrophobicContact CD2-CD1 4.48Å
119	R	84	Confident	84	Confident	192 Å²	192	64.1 Å²	64.1	73%	0.725	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	124	167.2	-66.5	-176.7	179.8	-136.6	-0.1	109	I43 S44	I43-R119 CarbonylContact C-O 3.22Å; I43-R119 VanDerWaalsContact CA-O 3.31Å; I43-R119 WeakPolarHBondContact CA-O 3.39Å; S44-R119 PolarHBondContact N-O 3.37Å; S44-R119 PolarHBondContact O-N 2.63Å; S44-R119 WeakPolarHBondContact OG-CB 3.35Å
120	V	81.4	Confident	84.5	Confident	27 Å²	27	52.9 Å²	52.9	16%	0.164	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.5	179.1	-172.9	0	0	0	0	109.6	T42 L118 D122 L125 L126 F129	T42-V120 HydrophobicContact CG2-CG1 4.22Å; T42-V120 CarbonylContact O-C 3.55Å; T42-V120 WeakPolarHBondContact O-CA 3.37Å; L118-V120 HydrophobicContact CD2-CG2 3.47Å; L118-V120 VanDerWaalsContact CD2-CG2 3.47Å; L118-V120 HydrophobicContact CG-CG2 3.84Å; V120-D122 WeakPolarHBondContact CG1-O 3.26Å; V120-L125 HydrophobicContact CG1-CB 4.11Å; V120-L126 HydrophobicContact CB-CD2 3.81Å; V120-L126 HydrophobicContact CB-CG 4.14Å; V120-L126 HydrophobicContact CG2-CD2 3.63Å; V120-L126 HydrophobicContact CG2-CG 4.38Å; V120-F129 HydrophobicContact CG1-CD2 4.41Å; V120-F129 HydrophobicContact CG1-CE2 4.25Å; V120-F129 HydrophobicContact CG2-CD2 3.94Å; V120-F129 HydrophobicContact CG2-CE2 4.29Å
121	E	78.9	Confident	85	Confident	154 Å²	154	51.7 Å²	51.7	72%	0.72	25%	0.252	S	S	*	.	S	Bend	trans	-74.4	-41.8	-179.2	-45.5	-178.1	144.9	0	0	112.9	T42 P123	T42-E121 HydrophobicContact CG2-CB 3.56Å; T42-E121 HydrophobicContact CG2-CG 4.11Å; T42-E121 PolarHBondContact O-N 2.99Å; E121-P123 WeakPolarHBondContact O-CD 3.3Å
122	D	80.5	Confident	85	Confident	57 Å²	57	52.4 Å²	52.4	31%	0.305	26%	0.255	S	S	.	.	S	Bend	trans	-90.7	110.2	173.5	-175.1	-4.7	0	0	0	110.4	T42 V120 K124 L125	T42-D122 HydrophobicContact CG2-CB 3.87Å; V120-D122 WeakPolarHBondContact CG1-O 3.26Å; D122-K124 PolarHBondContact O-N 3.36Å; D122-K124 VanDerWaalsContact O-N 3.08Å; D122-K124 WeakPolarHBondContact OD1-CB 3.48Å; D122-K124 WeakPolarHBondContact OD1-CG 2.88Å; D122-K124 PolarHBondContact OD1-N 2.92Å; D122-L125 HydrophobicContact CB-CD1 4.2Å; D122-L125 HydrophobicContact CB-CG 4.21Å; D122-L125 PolarHBondContact O-N 3.46Å; D122-L125 VanDerWaalsContact O-N 3.09Å
123	P	80.2	Confident	85	Confident	94 Å²	94	46.8 Å²	46.8	61%	0.61	23%	0.231	S	C	*	.	H	α-helix	trans	-59.9	-23.2	179.9	-22.3	34.1	0	0	0	113.8	E121 L125 L126	E121-P123 WeakPolarHBondContact O-CD 3.3Å; P123-L125 PolarHBondContact O-N 3.13Å; P123-L126 HydrophobicContact CB-CD1 4.39Å; P123-L126 WeakPolarHBondContact O-CB 3.43Å; P123-L126 PolarHBondContact O-N 3.27Å
124	K	78.9	Confident	84.9	Confident	148 Å²	148	47.6 Å²	47.6	64%	0.643	24%	0.238	S	C	*	.	H	α-helix	trans	-66.4	-29	178.9	-64.9	174.3	-177.6	170	0	112.2	D122	D122-K124 PolarHBondContact O-N 3.36Å; D122-K124 VanDerWaalsContact O-N 3.08Å; D122-K124 WeakPolarHBondContact OD1-CB 3.48Å; D122-K124 WeakPolarHBondContact OD1-CG 2.88Å; D122-K124 PolarHBondContact OD1-N 2.92Å
125	L	81.4	Confident	84.9	Confident	5 Å²	5	48 Å²	48	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-80	-17.8	-179.5	-62.5	179.8	0	0	0	112.6	A40 T42 V64 L91 V120 D122 P123 A127 A128 F129	A40-L125 HydrophobicContact CB-CD1 3.94Å; T42-L125 HydrophobicContact CG2-CD1 4.28Å; V64-L125 HydrophobicContact CG1-CD2 4.04Å; L91-L125 HydrophobicContact CD2-CD2 4.16Å; V120-L125 HydrophobicContact CG1-CB 4.11Å; D122-L125 HydrophobicContact CB-CD1 4.2Å; D122-L125 HydrophobicContact CB-CG 4.21Å; D122-L125 PolarHBondContact O-N 3.46Å; D122-L125 VanDerWaalsContact O-N 3.09Å; P123-L125 PolarHBondContact O-N 3.13Å; L125-A127 PolarHBondContact O-N 2.67Å; L125-A128 WeakPolarHBondContact O-CA 3.45Å; L125-A128 WeakPolarHBondContact O-CB 3.05Å; L125-A128 PolarHBondContact O-N 3.34Å; L125-F129 HydrophobicContact CB-CD2 4.24Å; L125-F129 HydrophobicContact CB-CE2 3.95Å; L125-F129 WeakPolarHBondContact O-CD2 3.41Å; L125-F129 PolarHBondContact O-N 3.01Å
126	L	85.9	Confident	85	Confident	42 Å²	42	47.3 Å²	47.3	22%	0.22	24%	0.237	C	C	.	.	H	α-helix	trans	-55	-41.4	177.9	-76.8	168.5	0	0	0	112.2	M101 F115 V120 P123 A128 F129 Y130	M101-L126 HydrophobicContact SD-CB 3.87Å; F115-L126 HydrophobicContact CZ-CD2 4.05Å; V120-L126 HydrophobicContact CB-CD2 3.81Å; V120-L126 HydrophobicContact CB-CG 4.14Å; V120-L126 HydrophobicContact CG2-CD2 3.63Å; V120-L126 HydrophobicContact CG2-CG 4.38Å; P123-L126 HydrophobicContact CB-CD1 4.39Å; P123-L126 WeakPolarHBondContact O-CB 3.43Å; P123-L126 PolarHBondContact O-N 3.27Å; L126-A128 VanDerWaalsContact C-N 3.3Å; L126-A128 PolarHBondContact O-N 3.33Å; L126-F129 PolarHBondContact O-N 3.49Å; L126-Y130 WeakPolarHBondContact O-CB 3.34Å; L126-Y130 PolarHBondContact O-N 3.2Å
127	A	85.4	Confident	85.2	Confident	4 Å²	4	42.4 Å²	42.4	3%	0.033	21%	0.211	C	C	.	.	H	α-helix	trans	-65	-33.9	177.1	0	0	0	0	0	112.5	V94 E98 L125 S131	V94-A127 HydrophobicContact CG2-CB 4.27Å; E98-A127 HydrophobicContact CG-CB 4.29Å; L125-A127 PolarHBondContact O-N 2.67Å; A127-S131 PolarHBondContact O-N 3.44Å
128	A	84.3	Confident	85.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.9	-46.3	175.1	0	0	0	0	0	111.1	L37 T89 L91 V94 L125 L126 Y130 S131	L37-A128 HydrophobicContact CD2-CB 4.06Å; T89-A128 HydrophobicContact CG2-CB 4.07Å; L91-A128 HydrophobicContact CD2-CB 4.12Å; V94-A128 HydrophobicContact CG2-CB 4.32Å; L125-A128 WeakPolarHBondContact O-CA 3.45Å; L125-A128 WeakPolarHBondContact O-CB 3.05Å; L125-A128 PolarHBondContact O-N 3.34Å; L126-A128 VanDerWaalsContact C-N 3.3Å; L126-A128 PolarHBondContact O-N 3.33Å; A128-Y130 VanDerWaalsContact C-N 3.34Å; A128-Y130 PolarHBondContact O-N 2.87Å; A128-S131 WeakPolarHBondContact O-CB 3.45Å; A128-S131 PolarHBondContact O-N 3.09Å; A128-S131 PolarHBondContact O-OG 2.86Å
129	F	86.3	Confident	85.8	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.8	-43.3	174.3	-75.5	-66.4	0	0	0	112.3	L37 I43 L60 F115 L118 V120 L125 L126 S131 V132 I133	L37-F129 HydrophobicContact CB-CE1 3.94Å; L37-F129 HydrophobicContact CB-CZ 3.96Å; L37-F129 HydrophobicContact CD1-CE1 4.49Å; L37-F129 HydrophobicContact CD2-CD1 4.37Å; L37-F129 HydrophobicContact CD2-CD2 4.39Å; L37-F129 HydrophobicContact CD2-CE1 3.75Å; L37-F129 HydrophobicContact CD2-CE2 3.79Å; L37-F129 HydrophobicContact CD2-CZ 3.36Å; L37-F129 HydrophobicContact CG-CE1 4.26Å; L37-F129 HydrophobicContact CG-CZ 4.21Å; I43-F129 HydrophobicContact CD1-CD1 4.33Å; I43-F129 HydrophobicContact CD1-CE1 3.29Å; I43-F129 HydrophobicContact CD1-CE2 3.83Å; I43-F129 HydrophobicContact CD1-CZ 3.01Å; I43-F129 HydrophobicContact CG1-CE1 4.18Å; I43-F129 HydrophobicContact CG1-CE2 3.83Å; I43-F129 HydrophobicContact CG1-CZ 3.55Å; L60-F129 HydrophobicContact CD2-CE1 4.06Å; F115-F129 HydrophobicContact CE2-CB 4.16Å; L118-F129 HydrophobicContact CD2-CB 3.85Å; L118-F129 HydrophobicContact CD2-CD1 4.19Å; L118-F129 HydrophobicContact CD2-CD2 4.16Å; L118-F129 HydrophobicContact CD2-CG 3.78Å; V120-F129 HydrophobicContact CG1-CD2 4.41Å; V120-F129 HydrophobicContact CG1-CE2 4.25Å; V120-F129 HydrophobicContact CG2-CD2 3.94Å; V120-F129 HydrophobicContact CG2-CE2 4.29Å; L125-F129 HydrophobicContact CB-CD2 4.24Å; L125-F129 HydrophobicContact CB-CE2 3.95Å; L125-F129 WeakPolarHBondContact O-CD2 3.41Å; L125-F129 PolarHBondContact O-N 3.01Å; L126-F129 PolarHBondContact O-N 3.49Å; F129-S131 VanDerWaalsContact C-N 3.25Å; F129-S131 PolarHBondContact O-N 3.06Å; F129-V132 PolarHBondContact O-N 3.21Å; F129-V132 VanDerWaalsContact O-N 3.12Å; F129-I133 HydrophobicContact CB-CD1 4.32Å; F129-I133 PolarHBondContact O-N 3.25Å
130	Y	89	Confident	86.1	Confident	3 Å²	3	36.4 Å²	36.4	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-35.4	177.5	-172.2	-95.8	0	0	0	111.8	W97 E100 M101 R113 F115 L126 A128 V132 T134 D135	W97-Y130 HydrophobicContact CB-CD1 3.68Å; W97-Y130 HydrophobicContact CB-CE1 4.32Å; W97-Y130 HydrophobicContact CD2-CD1 4.12Å; W97-Y130 HydrophobicContact CD2-CE1 4.21Å; W97-Y130 HydrophobicContact CE3-CD1 4.12Å; W97-Y130 AromaticContact CE3-CE1 3.75Å; W97-Y130 HydrophobicContact CE3-CE1 3.75Å; W97-Y130 AromaticContact CG-CD1 3.97Å; W97-Y130 HydrophobicContact CG-CD1 3.97Å; W97-Y130 HydrophobicContact CG-CE1 4.49Å; W97-Y130 HydrophobicContact CZ3-CE1 4.4Å; E100-Y130 HydrophobicContact CB-CE1 4.18Å; E100-Y130 HydrophobicContact CG-CE1 4.16Å; M101-Y130 HydrophobicContact CB-CD1 4.29Å; M101-Y130 HydrophobicContact CB-CD2 4.07Å; M101-Y130 HydrophobicContact CB-CE2 4.46Å; M101-Y130 HydrophobicContact CB-CG 3.97Å; M101-Y130 HydrophobicContact CG-CD2 3.93Å; M101-Y130 HydrophobicContact CG-CG 4.07Å; R113-Y130 PolarHBondContact NH2-OH 3.06Å; F115-Y130 AromaticContact CD1-CD2 3.98Å; F115-Y130 HydrophobicContact CD1-CD2 3.98Å; F115-Y130 AromaticContact CD2-CD2 3.81Å; F115-Y130 HydrophobicContact CD2-CD2 3.81Å; F115-Y130 HydrophobicContact CD2-CG 4.49Å; F115-Y130 HydrophobicContact CE1-CD2 4.12Å; F115-Y130 AromaticContact CE2-CD2 3.94Å; F115-Y130 HydrophobicContact CE2-CD2 3.94Å; F115-Y130 HydrophobicContact CE2-CG 4.27Å; F115-Y130 AromaticContact CG-CD2 3.83Å; F115-Y130 HydrophobicContact CG-CD2 3.83Å; F115-Y130 HydrophobicContact CZ-CD2 4.09Å; F115-Y130 HydrophobicContact CZ-CG 4.46Å; L126-Y130 WeakPolarHBondContact O-CB 3.34Å; L126-Y130 PolarHBondContact O-N 3.2Å; A128-Y130 VanDerWaalsContact C-N 3.34Å; A128-Y130 PolarHBondContact O-N 2.87Å; Y130-V132 PolarHBondContact O-N 2.97Å; Y130-T134 WeakPolarHBondContact O-CA 3.33Å; Y130-T134 PolarHBondContact O-N 2.71Å; Y130-D135 WeakPolarHBondContact CE2-OD1 3.36Å; Y130-D135 VanDerWaalsContact OH-CG 3.23Å; Y130-D135 PolarHBondContact OH-OD1 3.07Å; Y130-D135 PolarHBondContact OH-OD2 3.49Å
131	S	86.6	Confident	86.5	Confident	33 Å²	33	38.5 Å²	38.5	23%	0.231	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-26	177.5	81.3	0	0	0	0	114	A127 A128 F129	A127-S131 PolarHBondContact O-N 3.44Å; A128-S131 WeakPolarHBondContact O-CB 3.45Å; A128-S131 PolarHBondContact O-N 3.09Å; A128-S131 PolarHBondContact O-OG 2.86Å; F129-S131 VanDerWaalsContact C-N 3.25Å; F129-S131 PolarHBondContact O-N 3.06Å
132	V	85.7	Confident	86.9	Confident	24 Å²	24	33.4 Å²	33.4	15%	0.145	18%	0.178	C	C	.	.	H	α-helix	trans	-94.9	-45.7	-179.2	-179	0	0	0	0	111.3	C57 F129 Y130	C57-V132 VanDerWaalsContact SG-CG1 3.53Å; F129-V132 PolarHBondContact O-N 3.21Å; F129-V132 VanDerWaalsContact O-N 3.12Å; Y130-V132 PolarHBondContact O-N 2.97Å
133	I	87.8	Confident	87.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-82.1	-37	-175.7	-60.7	161.8	0	0	0	110.4	F53 C57 L114 F115 L118 F129 T136 R157	F53-I133 HydrophobicContact CD2-CD1 4.24Å; F53-I133 HydrophobicContact CE2-CD1 3.41Å; F53-I133 VanDerWaalsContact CE2-CD1 3.41Å; F53-I133 HydrophobicContact CE2-CG1 4.42Å; F53-I133 HydrophobicContact CZ-CD1 4.12Å; C57-I133 HydrophobicContact CB-CG1 4.31Å; L114-I133 HydrophobicContact CD2-CG2 4.34Å; F115-I133 HydrophobicContact CB-CG2 4.31Å; F115-I133 HydrophobicContact CD2-CD1 4.49Å; L118-I133 HydrophobicContact CD2-CD1 4.48Å; F129-I133 HydrophobicContact CB-CD1 4.32Å; F129-I133 PolarHBondContact O-N 3.25Å; I133-T136 WeakPolarHBondContact O-CB 3.48Å; I133-T136 PolarHBondContact O-N 3.36Å; I133-T136 PolarHBondContact O-OG1 3.15Å; I133-R157 PolarHBondContact O-NH1 3.35Å; I133-R157 VanDerWaalsContact O-NH1 3.16Å
134	T	88.4	Confident	87.8	Confident	34 Å²	34	33.2 Å²	33.2	21%	0.209	17%	0.171	C	C	.	.			trans	50.8	-149.8	-174.2	70.9	0	0	0	0	111.4	Y130 T136	Y130-T134 WeakPolarHBondContact O-CA 3.33Å; Y130-T134 PolarHBondContact O-N 2.71Å; T134-T136 PolarHBondContact O-N 3.27Å; T134-T136 VanDerWaalsContact O-N 3.07Å
135	D	89	Confident	88.3	Confident	9 Å²	9	26.2 Å²	26.2	5%	0.048	14%	0.14	C	C	.	.	S	Bend	trans	-87	64.7	174.2	-49	-42.4	0	0	0	111	L105 R113 Y130 R168	L105-D135 HydrophobicContact CD1-CB 4.02Å; L105-D135 VanDerWaalsContact CD1-CG 3.42Å; L105-D135 WeakPolarHBondContact CD1-OD1 3.39Å; R113-D135 IonicContact CZ-OD1 3Å; R113-D135 VanDerWaalsContact CZ-OD1 3.26Å; R113-D135 IonicContact NE-OD1 2.85Å; R113-D135 PolarHBondContact NE-OD1 3.49Å; R113-D135 IonicContact NH2-OD1 2.87Å; R113-D135 PolarHBondContact NH2-OD1 3.31Å; Y130-D135 WeakPolarHBondContact CE2-OD1 3.36Å; Y130-D135 VanDerWaalsContact OH-CG 3.23Å; Y130-D135 PolarHBondContact OH-OD1 3.07Å; Y130-D135 PolarHBondContact OH-OD2 3.49Å; D135-R168 IonicContact OD2-NH2 3.01Å
136	T	91.4	Very high	88.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130.7	171.4	-60.2	0	0	0	0	110	A56 L114 I133 T134 R157 V159	A56-T136 HydrophobicContact CB-CG2 4.19Å; L114-T136 WeakPolarHBondContact CB-O 3.4Å; L114-T136 HydrophobicContact CD2-CG2 4.26Å; L114-T136 PolarHBondContact N-O 2.88Å; I133-T136 WeakPolarHBondContact O-CB 3.48Å; I133-T136 PolarHBondContact O-N 3.36Å; I133-T136 PolarHBondContact O-OG1 3.15Å; T134-T136 PolarHBondContact O-N 3.27Å; T134-T136 VanDerWaalsContact O-N 3.07Å; T136-R157 WeakPolarHBondContact CA-O 3.38Å; T136-R157 HydrophobicContact CG2-CG 4.15Å; T136-R157 VanDerWaalsContact OG1-CD 3.32Å; T136-R157 WeakPolarHBondContact OG1-CD 3.27Å; T136-R157 PolarHBondContact OG1-NH1 3.42Å; T136-V159 HydrophobicContact CG2-CB 4.31Å; T136-V159 HydrophobicContact CG2-CG1 3.97Å
137	L	92.7	Very high	88.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	143.4	178	-57.4	-173.1	0	0	0	110.7	V107 P108 A111 K112 I148 W156 R157 V158 V159	V107-L137 HydrophobicContact CB-CD2 4.49Å; V107-L137 HydrophobicContact CG1-CD2 3.51Å; P108-L137 HydrophobicContact CG-CD1 4.41Å; A111-L137 HydrophobicContact CB-CB 4.22Å; A111-L137 HydrophobicContact CB-CD1 4.04Å; K112-L137 CarbonylContact O-C 3.57Å; K112-L137 WeakPolarHBondContact O-CA 3.37Å; L137-I148 HydrophobicContact CD1-CG2 3.71Å; L137-W156 HydrophobicContact CD1-CB 3.81Å; L137-W156 HydrophobicContact CD1-CD2 3.6Å; L137-W156 HydrophobicContact CD1-CE3 3.6Å; L137-W156 HydrophobicContact CD1-CG 3.69Å; L137-W156 HydrophobicContact CD1-CZ3 4.39Å; L137-W156 HydrophobicContact CD2-CE3 4.23Å; L137-W156 HydrophobicContact CD2-CZ3 4.48Å; L137-W156 HydrophobicContact CG-CB 4.4Å; L137-W156 HydrophobicContact CG-CD2 4.37Å; L137-W156 HydrophobicContact CG-CE3 3.92Å; L137-R157 PolarHBondContact N-O 3.13Å; L137-V158 HydrophobicContact CB-CG1 4.33Å; L137-V158 HydrophobicContact CB-CG2 4.35Å; L137-V158 CarbonylContact O-C 3.58Å; L137-V158 VanDerWaalsContact O-CA 3.28Å; L137-V158 WeakPolarHBondContact O-CA 3.1Å; L137-V159 PolarHBondContact O-N 3.46Å
138	L	92.4	Very high	88.9	Confident	11 Å²	11	35.3 Å²	35.3	6%	0.058	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.8	173.4	-176.2	69	0	0	0	109.5	Y49 A52 K112 L117 V159 M161	Y49-L138 HydrophobicContact CD1-CD2 3.38Å; Y49-L138 HydrophobicContact CE1-CD2 3.55Å; Y49-L138 HydrophobicContact CG-CD2 4.25Å; A52-L138 HydrophobicContact CB-CD1 3.56Å; K112-L138 PolarHBondContact N-O 2.7Å; K112-L138 PolarHBondContact O-N 3Å; L117-L138 HydrophobicContact CD1-CD2 3.96Å; L138-V159 CarbonylContact C-O 3.49Å; L138-V159 WeakPolarHBondContact CA-O 3.35Å; L138-V159 HydrophobicContact CD1-CG1 4.05Å; L138-M161 HydrophobicContact CD1-SD 3.83Å; L138-M161 HydrophobicContact CD2-SD 3.78Å; L138-M161 HydrophobicContact CG-SD 3.99Å
139	A	91.9	Very high	89	Confident	2 Å²	2	35.4 Å²	35.4	2%	0.017	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	153	174.2	0	0	0	0	0	110.3	E144 A145 I148 V158 V159 S160 M161	A139-E144 HydrophobicContact CB-CB 4.29Å; A139-E144 HydrophobicContact CB-CG 4Å; A139-A145 HydrophobicContact CB-CB 3.86Å; A139-I148 HydrophobicContact CB-CD1 4.04Å; A139-V158 HydrophobicContact CB-CG1 3.7Å; A139-V159 PolarHBondContact N-O 3.36Å; A139-S160 CarbonylContact O-C 3.58Å; A139-S160 VanDerWaalsContact O-CA 3.26Å; A139-S160 WeakPolarHBondContact O-CA 3.42Å; A139-M161 WeakPolarHBondContact O-CG 2.9Å; A139-M161 PolarHBondContact O-N 3.29Å
140	E	89.9	Confident	89	Confident	118 Å²	118	39.8 Å²	39.8	55%	0.551	19%	0.191	S	C	*	.	S	Bend	trans	-69.9	-40.1	179.6	-70	-71.9	170.5	0	0	111.8	E144 M161	E140-E144 WeakPolarHBondContact CB-OE2 3.31Å; E140-E144 PolarHBondContact N-OE2 3.44Å; E140-M161 WeakPolarHBondContact O-CB 3.29Å
141	D	89.4	Confident	88.6	Confident	70 Å²	70	46.8 Å²	46.8	37%	0.374	22%	0.223	S	C	.	.	S	Bend	trans	-142.7	175.6	-179	70.1	29.1	0	0	0	113.3	N143 E144 A145	D141-N143 VanDerWaalsContact C-N 3.29Å; D141-N143 PolarHBondContact O-N 3.46Å; D141-N143 WeakPolarHBondContact OD1-CA 3.42Å; D141-N143 WeakPolarHBondContact OD1-CB 3.34Å; D141-N143 PolarHBondContact OD1-N 2.86Å; D141-E144 PolarHBondContact O-N 3.06Å; D141-E144 WeakPolarHBondContact OD1-CB 3.27Å; D141-E144 PolarHBondContact OD1-N 3.05Å; D141-A145 WeakPolarHBondContact O-CB 3.45Å; D141-A145 PolarHBondContact O-N 3.39Å
142	L	87.7	Confident	87.7	Confident	47 Å²	47	47.4 Å²	47.4	25%	0.246	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-35.1	178.4	-172.8	59.7	0	0	0	113.4	A145 R146 E164	L142-A145 PolarHBondContact O-N 2.78Å; L142-R146 WeakPolarHBondContact O-CB 3.39Å; L142-R146 VanDerWaalsContact O-CG 3.29Å; L142-R146 WeakPolarHBondContact O-CG 3.4Å; L142-R146 PolarHBondContact O-N 3.36Å; L142-E164 WeakPolarHBondContact CB-OE2 3.43Å; L142-E164 HydrophobicContact CD1-CB 3.96Å; L142-E164 HydrophobicContact CD1-CG 4.43Å
143	N	89.5	Confident	87.1	Confident	117 Å²	117	50.4 Å²	50.4	63%	0.626	26%	0.264	S	S	*	.	H	α-helix	trans	-71.1	-44.2	-176.7	-72	-29.2	0	0	0	110.4	D141 A145 R146 R147	D141-N143 VanDerWaalsContact C-N 3.29Å; D141-N143 PolarHBondContact O-N 3.46Å; D141-N143 WeakPolarHBondContact OD1-CA 3.42Å; D141-N143 WeakPolarHBondContact OD1-CB 3.34Å; D141-N143 PolarHBondContact OD1-N 2.86Å; N143-A145 VanDerWaalsContact C-N 3.35Å; N143-R146 PolarHBondContact O-N 2.83Å; N143-R147 WeakPolarHBondContact O-CB 3.25Å; N143-R147 PolarHBondContact O-N 3.01Å
144	E	89.7	Confident	86.8	Confident	31 Å²	31	55.8 Å²	55.8	15%	0.145	29%	0.289	C	S	.	.	H	α-helix	trans	-63.4	-41.4	171.1	-179.7	165.5	-128.2	0	0	111.1	A139 E140 D141 R146 R147 I148	A139-E144 HydrophobicContact CB-CB 4.29Å; A139-E144 HydrophobicContact CB-CG 4Å; E140-E144 WeakPolarHBondContact CB-OE2 3.31Å; E140-E144 PolarHBondContact N-OE2 3.44Å; D141-E144 PolarHBondContact O-N 3.06Å; D141-E144 WeakPolarHBondContact OD1-CB 3.27Å; D141-E144 PolarHBondContact OD1-N 3.05Å; E144-R146 PolarHBondContact O-N 2.88Å; E144-R147 WeakPolarHBondContact O-CB 3.37Å; E144-R147 PolarHBondContact O-N 3.32Å; E144-R147 IonicContact OE1-CZ 2.63Å; E144-R147 IonicContact OE1-NH2 3.49Å; E144-R147 PolarHBondContact OE1-NH2 3.31Å; E144-I148 HydrophobicContact CG-CD1 3.59Å; E144-I148 HydrophobicContact CG-CG1 4.27Å; E144-I148 VanDerWaalsContact O-CG1 3.31Å; E144-I148 WeakPolarHBondContact O-CG1 3.46Å; E144-I148 PolarHBondContact O-N 3.45Å
145	A	89.4	Confident	86.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.5	-46.5	175.9	0	0	0	0	0	111.6	A139 D141 L142 N143 I148 A149 V158 I166	A139-A145 HydrophobicContact CB-CB 3.86Å; D141-A145 WeakPolarHBondContact O-CB 3.45Å; D141-A145 PolarHBondContact O-N 3.39Å; L142-A145 PolarHBondContact O-N 2.78Å; N143-A145 VanDerWaalsContact C-N 3.35Å; A145-I148 PolarHBondContact O-N 2.81Å; A145-A149 WeakPolarHBondContact O-CB 3.34Å; A145-A149 PolarHBondContact O-N 3.25Å; A145-V158 HydrophobicContact CB-CB 4.41Å; A145-V158 HydrophobicContact CB-CG1 3.88Å; A145-I166 HydrophobicContact CB-CD1 3.97Å
146	R	88.7	Confident	86.7	Confident	108 Å²	108	61.3 Å²	61.3	41%	0.408	31%	0.305	S	S	.	.	H	α-helix	trans	-63	-41.1	175	-74.7	175.3	175.7	-167.6	0.5	112.2	L142 N143 E144 F150 H151 I166	L142-R146 WeakPolarHBondContact O-CB 3.39Å; L142-R146 VanDerWaalsContact O-CG 3.29Å; L142-R146 WeakPolarHBondContact O-CG 3.4Å; L142-R146 PolarHBondContact O-N 3.36Å; N143-R146 PolarHBondContact O-N 2.83Å; E144-R146 PolarHBondContact O-N 2.88Å; R146-F150 HydrophobicContact CB-CD2 4.31Å; R146-F150 HydrophobicContact CG-CE2 4.37Å; R146-F150 WeakPolarHBondContact O-CB 3.42Å; R146-F150 WeakPolarHBondContact O-CD2 3.46Å; R146-F150 PolarHBondContact O-N 3.42Å; R146-F150 VanDerWaalsContact O-N 3.08Å; R146-H151 PolarHBondContact O-ND1 3.26Å; R146-I166 HydrophobicContact CG-CD1 3.87Å
147	R	88.4	Confident	86.8	Confident	130 Å²	130	61.7 Å²	61.7	49%	0.491	31%	0.307	S	S	.	.	H	α-helix	trans	-59.5	-51.2	176.1	-173.6	-174.4	66.4	-168.8	-3	110.5	N143 E144 H151	N143-R147 WeakPolarHBondContact O-CB 3.25Å; N143-R147 PolarHBondContact O-N 3.01Å; E144-R147 WeakPolarHBondContact O-CB 3.37Å; E144-R147 PolarHBondContact O-N 3.32Å; E144-R147 IonicContact OE1-CZ 2.63Å; E144-R147 IonicContact OE1-NH2 3.49Å; E144-R147 PolarHBondContact OE1-NH2 3.31Å; R147-H151 WeakPolarHBondContact O-CA 3.24Å; R147-H151 VanDerWaalsContact O-CB 3.24Å; R147-H151 WeakPolarHBondContact O-CB 3.32Å; R147-H151 PolarHBondContact O-N 3.45Å
148	I	88.4	Confident	86.8	Confident	4 Å²	4	61.7 Å²	61.7	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-46.3	-178.8	-65.1	162.1	0	0	0	110.9	P108 A111 L137 A139 E144 A145 F150 S152 W156 V158	P108-I148 HydrophobicContact CB-CG2 4.38Å; P108-I148 HydrophobicContact CG-CG2 4.15Å; A111-I148 HydrophobicContact CB-CD1 3.88Å; L137-I148 HydrophobicContact CD1-CG2 3.71Å; A139-I148 HydrophobicContact CB-CD1 4.04Å; E144-I148 HydrophobicContact CG-CD1 3.59Å; E144-I148 HydrophobicContact CG-CG1 4.27Å; E144-I148 VanDerWaalsContact O-CG1 3.31Å; E144-I148 WeakPolarHBondContact O-CG1 3.46Å; E144-I148 PolarHBondContact O-N 3.45Å; A145-I148 PolarHBondContact O-N 2.81Å; I148-F150 PolarHBondContact O-N 2.95Å; I148-S152 PolarHBondContact O-OG 2.9Å; I148-W156 HydrophobicContact CG2-CB 4.36Å; I148-V158 HydrophobicContact CB-CG1 4.47Å; I148-V158 HydrophobicContact CB-CG2 4.1Å; I148-V158 HydrophobicContact CG2-CG1 4.48Å; I148-V158 HydrophobicContact CG2-CG2 3.67Å
149	A	87.4	Confident	86.8	Confident	3 Å²	3	61.2 Å²	61.2	3%	0.025	30%	0.304	C	S	.	.	H	α-helix	trans	-65.8	-39.4	-174.7	0	0	0	0	0	113.3	A145 V158 I166	A145-A149 WeakPolarHBondContact O-CB 3.34Å; A145-A149 PolarHBondContact O-N 3.25Å; A149-V158 HydrophobicContact CB-CG2 3.87Å; A149-I166 HydrophobicContact CB-CB 4.23Å; A149-I166 HydrophobicContact CB-CD1 4.19Å; A149-I166 HydrophobicContact CB-CG2 3.75Å
150	F	86.6	Confident	86.8	Confident	92 Å²	92	61.1 Å²	61.1	40%	0.404	30%	0.303	S	S	.	.	H	α-helix	trans	-109.2	-25.7	-170.8	-59	-61.2	0	0	0	115.1	R146 I148 I166	R146-F150 HydrophobicContact CB-CD2 4.31Å; R146-F150 HydrophobicContact CG-CE2 4.37Å; R146-F150 WeakPolarHBondContact O-CB 3.42Å; R146-F150 WeakPolarHBondContact O-CD2 3.46Å; R146-F150 PolarHBondContact O-N 3.42Å; R146-F150 VanDerWaalsContact O-N 3.08Å; I148-F150 PolarHBondContact O-N 2.95Å; F150-I166 HydrophobicContact CE2-CD1 4.38Å; F150-I166 HydrophobicContact CE2-CG2 4.27Å; F150-I166 HydrophobicContact CZ-CG2 3.89Å
151	H	79.2	Confident	86.7	Confident	150 Å²	150	57 Å²	57	69%	0.694	29%	0.285	S	S	*	.	H	α-helix	trans	-106.7	-0.9	-168.2	-58.4	78.7	0	0	0	114.8	R146 R147 G153	R146-H151 PolarHBondContact O-ND1 3.26Å; R147-H151 WeakPolarHBondContact O-CA 3.24Å; R147-H151 VanDerWaalsContact O-CB 3.24Å; R147-H151 WeakPolarHBondContact O-CB 3.32Å; R147-H151 PolarHBondContact O-N 3.45Å; H151-G153 VanDerWaalsContact C-N 3.34Å; H151-G153 PolarHBondContact O-N 3.5Å
152	S	68.4	Low	86.5	Confident	45 Å²	45	61.1 Å²	61.1	32%	0.315	30%	0.299	S	S	.	.	S	Bend	trans	-91	16.2	-175.4	60.4	0	0	0	0	114.7	I148 Q154 W156	I148-S152 PolarHBondContact O-OG 2.9Å; S152-Q154 PolarHBondContact O-N 3.12Å; S152-Q154 PolarHBondContact OG-O 3.18Å; S152-W156 PolarHBondContact OG-NE1 3.45Å
153	G	72.4	Confident	86.4	Confident	88 Å²	88	59.3 Å²	59.3	91%	0.907	29%	0.291	S	S	*	.	S	Bend	trans	72.5	-35.3	-177.7	0	0	0	0	0	114.1	H151	H151-G153 VanDerWaalsContact C-N 3.34Å; H151-G153 PolarHBondContact O-N 3.5Å
154	Q	82.2	Confident	86.5	Confident	113 Å²	113	56.1 Å²	56.1	53%	0.528	27%	0.273	S	S	.	.	S	Bend	trans	-103.1	141.6	170.3	-177.8	172.4	-0.2	0	0	110.1	S152 W156	S152-Q154 PolarHBondContact O-N 3.12Å; S152-Q154 PolarHBondContact OG-O 3.18Å; Q154-W156 HydrophobicContact CG-CZ2 4.34Å
155	R	86.4	Confident	86.5	Confident	148 Å²	148	54.9 Å²	54.9	56%	0.558	27%	0.267	S	S	*	.			trans	-80.9	124.7	174.4	-68.9	-161.2	179.8	-167	0.8	111	R168 S169	R155-R168 VanDerWaalsContact CD-O 3.27Å; R155-R168 WeakPolarHBondContact CD-O 3.44Å; R155-S169 PolarHBondContact NH1-O 3.48Å
156	W	88.8	Confident	86.6	Confident	10 Å²	10	54.9 Å²	54.9	4%	0.038	27%	0.267	C	S	.	.			trans	-111.5	149.6	177.8	-64.2	89.8	0	0	0	111.3	L105 L137 I148 S152 Q154 V158	L105-W156 HydrophobicContact CD2-CH2 4.21Å; L105-W156 HydrophobicContact CD2-CZ3 4.27Å; L137-W156 HydrophobicContact CD1-CB 3.81Å; L137-W156 HydrophobicContact CD1-CD2 3.6Å; L137-W156 HydrophobicContact CD1-CE3 3.6Å; L137-W156 HydrophobicContact CD1-CG 3.69Å; L137-W156 HydrophobicContact CD1-CZ3 4.39Å; L137-W156 HydrophobicContact CD2-CE3 4.23Å; L137-W156 HydrophobicContact CD2-CZ3 4.48Å; L137-W156 HydrophobicContact CG-CB 4.4Å; L137-W156 HydrophobicContact CG-CD2 4.37Å; L137-W156 HydrophobicContact CG-CE3 3.92Å; I148-W156 HydrophobicContact CG2-CB 4.36Å; S152-W156 PolarHBondContact OG-NE1 3.45Å; Q154-W156 HydrophobicContact CG-CZ2 4.34Å; W156-V158 HydrophobicContact CB-CG2 3.86Å
157	R	92.5	Very high	86.8	Confident	9 Å²	9	52.1 Å²	52.1	3%	0.034	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	124	164.4	-170.5	168.6	-179.7	-114	-6.8	106.8	A56 H58 I133 T136 L137 L165 I166 E167 R168	A56-R157 PolarHBondContact O-NH1 3.19Å; A56-R157 PolarHBondContact O-NH2 3.48Å; H58-R157 PolarHBondContact CE1-NH2 2.96Å; H58-R157 PolarHBondContact NE2-NH2 3.17Å; I133-R157 PolarHBondContact O-NH1 3.35Å; I133-R157 VanDerWaalsContact O-NH1 3.16Å; T136-R157 WeakPolarHBondContact CA-O 3.38Å; T136-R157 HydrophobicContact CG2-CG 4.15Å; T136-R157 VanDerWaalsContact OG1-CD 3.32Å; T136-R157 WeakPolarHBondContact OG1-CD 3.27Å; T136-R157 PolarHBondContact OG1-NH1 3.42Å; L137-R157 PolarHBondContact N-O 3.13Å; R157-L165 HydrophobicContact CG-CD1 4.23Å; R157-I166 CarbonylContact C-O 3.59Å; R157-I166 WeakPolarHBondContact CA-O 3.49Å; R157-E167 VanDerWaalsContact CD-OE2 3.31Å; R157-E167 WeakPolarHBondContact CD-OE2 3.36Å; R157-E167 IonicContact CZ-OE1 2.87Å; R157-E167 VanDerWaalsContact NE-CD 3.27Å; R157-E167 IonicContact NE-OE1 3.97Å; R157-E167 PolarHBondContact NE-OE1 3.05Å; R157-E167 IonicContact NE-OE2 3.94Å; R157-E167 PolarHBondContact NE-OE2 2.84Å; R157-E167 IonicContact NH2-OE1 3.31Å; R157-E167 PolarHBondContact NH2-OE1 3.24Å; R157-R168 HydrophobicContact CB-CG 4.01Å
158	V	93.3	Very high	86.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	135	-172.8	-165.8	0	0	0	0	110.1	L137 A139 A145 I148 A149 W156 L165 I166	L137-V158 HydrophobicContact CB-CG1 4.33Å; L137-V158 HydrophobicContact CB-CG2 4.35Å; L137-V158 CarbonylContact O-C 3.58Å; L137-V158 VanDerWaalsContact O-CA 3.28Å; L137-V158 WeakPolarHBondContact O-CA 3.1Å; A139-V158 HydrophobicContact CB-CG1 3.7Å; A145-V158 HydrophobicContact CB-CB 4.41Å; A145-V158 HydrophobicContact CB-CG1 3.88Å; I148-V158 HydrophobicContact CB-CG1 4.47Å; I148-V158 HydrophobicContact CB-CG2 4.1Å; I148-V158 HydrophobicContact CG2-CG1 4.48Å; I148-V158 HydrophobicContact CG2-CG2 3.67Å; A149-V158 HydrophobicContact CB-CG2 3.87Å; W156-V158 HydrophobicContact CB-CG2 3.86Å; V158-L165 CarbonylContact O-C 3.47Å; V158-I166 PolarHBondContact N-O 2.88Å; V158-I166 PolarHBondContact O-N 3.03Å
159	V	92.5	Very high	86.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	136.7	172.9	68.3	0	0	0	0	109.6	A52 A56 L114 T136 L137 L138 A139 E164 L165	A52-V159 HydrophobicContact CB-CG1 4.05Å; A52-V159 HydrophobicContact CB-CG2 4.22Å; A56-V159 HydrophobicContact CB-CB 4.36Å; A56-V159 HydrophobicContact CB-CG1 4.23Å; A56-V159 HydrophobicContact CB-CG2 4.45Å; L114-V159 HydrophobicContact CD2-CG1 3.99Å; T136-V159 HydrophobicContact CG2-CB 4.31Å; T136-V159 HydrophobicContact CG2-CG1 3.97Å; L137-V159 PolarHBondContact O-N 3.46Å; L138-V159 CarbonylContact C-O 3.49Å; L138-V159 WeakPolarHBondContact CA-O 3.35Å; L138-V159 HydrophobicContact CD1-CG1 4.05Å; A139-V159 PolarHBondContact N-O 3.36Å; V159-E164 CarbonylContact C-O 3.17Å; V159-E164 VanDerWaalsContact CA-O 3.27Å; V159-E164 WeakPolarHBondContact CA-O 3.21Å; V159-L165 HydrophobicContact CB-CD1 3.97Å; V159-L165 HydrophobicContact CG2-CB 4.46Å; V159-L165 HydrophobicContact CG2-CD1 4.37Å
160	S	91.7	Very high	86.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	160.1	173.5	78.3	0	0	0	0	111.4	A139 K162 G163 E164	A139-S160 CarbonylContact O-C 3.58Å; A139-S160 VanDerWaalsContact O-CA 3.26Å; A139-S160 WeakPolarHBondContact O-CA 3.42Å; S160-K162 PolarHBondContact O-N 2.98Å; S160-K162 VanDerWaalsContact O-N 3.09Å; S160-K162 PolarHBondContact OG-N 2.81Å; S160-G163 PolarHBondContact O-N 3.06Å; S160-E164 WeakPolarHBondContact CB-OE2 3.35Å; S160-E164 PolarHBondContact N-O 3.29Å; S160-E164 WeakPolarHBondContact OG-CB 3.46Å; S160-E164 PolarHBondContact OG-N 3.07Å; S160-E164 PolarHBondContact OG-OE2 3.39Å
161	M	88.9	Confident	86.5	Confident	33 Å²	33	55.8 Å²	55.8	16%	0.163	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.3	172.9	-69.4	-64.1	-65.6	0	0	113.2	K48 Y49 L138 A139 E140 G163	K48-M161 HydrophobicContact CD-CE 4.37Å; K48-M161 HydrophobicContact CG-CE 3.71Å; K48-M161 WeakPolarHBondContact O-CE 2.96Å; Y49-M161 HydrophobicContact CD1-CE 3.81Å; Y49-M161 HydrophobicContact CD1-SD 3.76Å; Y49-M161 HydrophobicContact CE1-CE 4Å; Y49-M161 HydrophobicContact CE1-SD 3.98Å; L138-M161 HydrophobicContact CD1-SD 3.83Å; L138-M161 HydrophobicContact CD2-SD 3.78Å; L138-M161 HydrophobicContact CG-SD 3.99Å; A139-M161 WeakPolarHBondContact O-CG 2.9Å; A139-M161 PolarHBondContact O-N 3.29Å; E140-M161 WeakPolarHBondContact O-CB 3.29Å; M161-G163 VanDerWaalsContact C-N 3.33Å
162	K	85.1	Confident	86.8	Confident	156 Å²	156	53.6 Å²	53.6	68%	0.678	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.3	179.1	-64.4	-174.5	-179.6	179.2	0	113.8	S160	S160-K162 PolarHBondContact O-N 2.98Å; S160-K162 VanDerWaalsContact O-N 3.09Å; S160-K162 PolarHBondContact OG-N 2.81Å
163	G	86.1	Confident	87.3	Confident	8 Å²	8	53.9 Å²	53.9	8%	0.082	30%	0.297	C	S	.	.	S	Bend	trans	86.3	26	-179.4	0	0	0	0	0	114.3	T55 S160 M161	T55-G163 WeakPolarHBondContact CG2-O 3.46Å; S160-G163 PolarHBondContact O-N 3.06Å; M161-G163 VanDerWaalsContact C-N 3.33Å
164	E	89.9	Confident	87.5	Confident	50 Å²	50	52.6 Å²	52.6	23%	0.234	28%	0.284	C	S	.	.			trans	-90.4	120.2	170.7	-56.4	147.2	139.6	0	0	108.6	L142 V159 S160	L142-E164 WeakPolarHBondContact CB-OE2 3.43Å; L142-E164 HydrophobicContact CD1-CB 3.96Å; L142-E164 HydrophobicContact CD1-CG 4.43Å; V159-E164 CarbonylContact C-O 3.17Å; V159-E164 VanDerWaalsContact CA-O 3.27Å; V159-E164 WeakPolarHBondContact CA-O 3.21Å; S160-E164 WeakPolarHBondContact CB-OE2 3.35Å; S160-E164 PolarHBondContact N-O 3.29Å; S160-E164 WeakPolarHBondContact OG-CB 3.46Å; S160-E164 PolarHBondContact OG-N 3.07Å; S160-E164 PolarHBondContact OG-OE2 3.39Å
165	L	90.9	Very high	86.9	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	134	-174.9	178.6	71.7	0	0	0	111.1	T55 A56 H58 R157 V158 V159 M172 A173	T55-L165 HydrophobicContact CG2-CB 4.34Å; A56-L165 HydrophobicContact CB-CD1 4.44Å; H58-L165 WeakPolarHBondContact NE2-CD2 3.49Å; R157-L165 HydrophobicContact CG-CD1 4.23Å; V158-L165 CarbonylContact O-C 3.47Å; V159-L165 HydrophobicContact CB-CD1 3.97Å; V159-L165 HydrophobicContact CG2-CB 4.46Å; V159-L165 HydrophobicContact CG2-CD1 4.37Å; L165-M172 CarbonylContact O-C 3.57Å; L165-M172 WeakPolarHBondContact O-CA 3.49Å; L165-A173 HydrophobicContact CB-CB 4.39Å; L165-A173 PolarHBondContact N-O 3.42Å; L165-A173 PolarHBondContact O-N 3.42Å
166	I	91.1	Very high	85.7	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	116.9	171.6	-51	-176.9	0	0	0	108.1	A145 R146 A149 F150 R157 V158 M172	A145-I166 HydrophobicContact CB-CD1 3.97Å; R146-I166 HydrophobicContact CG-CD1 3.87Å; A149-I166 HydrophobicContact CB-CB 4.23Å; A149-I166 HydrophobicContact CB-CD1 4.19Å; A149-I166 HydrophobicContact CB-CG2 3.75Å; F150-I166 HydrophobicContact CE2-CD1 4.38Å; F150-I166 HydrophobicContact CE2-CG2 4.27Å; F150-I166 HydrophobicContact CZ-CG2 3.89Å; R157-I166 CarbonylContact C-O 3.59Å; R157-I166 WeakPolarHBondContact CA-O 3.49Å; V158-I166 PolarHBondContact N-O 2.88Å; V158-I166 PolarHBondContact O-N 3.03Å; I166-M172 HydrophobicContact CG1-CG 4.12Å; I166-M172 HydrophobicContact CG2-CG 4.32Å
167	E	92	Very high	84.1	Confident	50 Å²	50	55.1 Å²	55.1	23%	0.234	35%	0.349	C	S	.	.			trans	-78.9	156	177.3	-79.8	-66.6	167.8	0	0	112.4	H58 R157 S169 G170 V171	H58-E167 IonicContact CE1-OE1 2.83Å; H58-E167 PolarHBondContact CE1-OE1 3.26Å; H58-E167 IonicContact NE2-OE1 3.86Å; R157-E167 VanDerWaalsContact CD-OE2 3.31Å; R157-E167 WeakPolarHBondContact CD-OE2 3.36Å; R157-E167 IonicContact CZ-OE1 2.87Å; R157-E167 VanDerWaalsContact NE-CD 3.27Å; R157-E167 IonicContact NE-OE1 3.97Å; R157-E167 PolarHBondContact NE-OE1 3.05Å; R157-E167 IonicContact NE-OE2 3.94Å; R157-E167 PolarHBondContact NE-OE2 2.84Å; R157-E167 IonicContact NH2-OE1 3.31Å; R157-E167 PolarHBondContact NH2-OE1 3.24Å; E167-S169 WeakPolarHBondContact CB-OG 3.36Å; E167-S169 PolarHBondContact O-N 3.1Å; E167-S169 VanDerWaalsContact O-N 3.13Å; E167-G170 PolarHBondContact O-N 2.91Å; E167-V171 HydrophobicContact CB-CB 4.24Å; E167-V171 PolarHBondContact N-O 3.38Å
168	R	87.4	Confident	81.9	Confident	103 Å²	103	57.6 Å²	57.6	39%	0.389	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.5	175.2	-67.3	-178	-177.7	-174.6	-1.4	112.5	D135 R155 R157 G170	D135-R168 IonicContact OD2-NH2 3.01Å; R155-R168 VanDerWaalsContact CD-O 3.27Å; R155-R168 WeakPolarHBondContact CD-O 3.44Å; R157-R168 HydrophobicContact CB-CG 4.01Å; R168-G170 PolarHBondContact O-N 3.41Å
169	S	86	Confident	79.6	Confident	82 Å²	82	68.2 Å²	68.2	57%	0.573	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-18.2	175.5	57.6	0	0	0	0	113.3	R155 E167	R155-S169 PolarHBondContact NH1-O 3.48Å; E167-S169 WeakPolarHBondContact CB-OG 3.36Å; E167-S169 PolarHBondContact O-N 3.1Å; E167-S169 VanDerWaalsContact O-N 3.13Å
170	G	83.3	Confident	77.2	Confident	29 Å²	29	70.1 Å²	70.1	30%	0.299	43%	0.432	S	S	.	.	S	Bend	trans	95.3	3.3	-173.4	0	0	0	0	0	114.1	E167 R168	E167-G170 PolarHBondContact O-N 2.91Å; R168-G170 PolarHBondContact O-N 3.41Å
171	V	87.8	Confident	74.9	Confident	91 Å²	91	71.5 Å²	71.5	55%	0.552	45%	0.446	S	S	*	.			trans	-72.1	134.6	172.2	177.9	0	0	0	0	109.4	E167	E167-V171 HydrophobicContact CB-CB 4.24Å; E167-V171 PolarHBondContact N-O 3.38Å
172	M	85.7	Confident	72.7	Confident	104 Å²	104	76.3 Å²	76.3	51%	0.512	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	135.4	173.7	-62.7	-174.8	-72.7	0	0	109.7	L165 I166	L165-M172 CarbonylContact O-C 3.57Å; L165-M172 WeakPolarHBondContact O-CA 3.49Å; I166-M172 HydrophobicContact CG1-CG 4.12Å; I166-M172 HydrophobicContact CG2-CG 4.32Å
173	A	79.4	Confident	70.6	Confident	51 Å²	51	73 Å²	73	42%	0.421	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.5	171.4	0	0	0	0	0	109	L165	L165-A173 HydrophobicContact CB-CB 4.39Å; L165-A173 PolarHBondContact N-O 3.42Å; L165-A173 PolarHBondContact O-N 3.42Å
174	G	77.1	Confident	68.2	Low	61 Å²	61	75.7 Å²	75.7	63%	0.629	48%	0.483	S	S	*	.			trans	-176.8	162.6	-179.9	0	0	0	0	0	110.8
175	G	69.2	Low	65.6	Low	85 Å²	85	83.5 Å²	83.5	88%	0.876	51%	0.51	S	S	*	.			trans	112.8	141.6	-178.7	0	0	0	0	0	113.2
176	G	61.8	Low	62.8	Low	76 Å²	76	92.6 Å²	92.6	78%	0.784	55%	0.552	S	S	*	*	S	Bend	trans	110.3	163.7	-180	0	0	0	0	0	113.9	A178	G176-A178 PolarHBondContact O-N 2.96Å
177	I	54.2	Low	59.8	Low	163 Å²	163	95.6 Å²	95.6	84%	0.836	58%	0.583	S	S	*	*	S	Bend	trans	-59.7	125.4	171.2	-60.4	167.9	0	0	0	107.3	R179	I177-R179 PolarHBondContact O-N 3.23Å
178	A	45.7	Very low	56.7	Low	62 Å²	62	103 Å²	103	51%	0.512	61%	0.614	S	S	.	*			trans	-54.5	101.2	175.7	0	0	0	0	0	109	V51 G176 G180	V51-A178 HydrophobicContact CG1-CB 3.92Å; V51-A178 HydrophobicContact CG2-CB 4.17Å; G176-A178 PolarHBondContact O-N 2.96Å; A178-G180 PolarHBondContact O-N 3Å
179	R	46.6	Very low	54	Low	222 Å²	222	103.1 Å²	103.1	84%	0.838	64%	0.637	S	S	*	*			trans	-75.5	65.5	173.4	-69.9	-175.9	-174.5	162.1	1	108.7	I177	I177-R179 PolarHBondContact O-N 3.23Å
180	G	41.8	Very low	51.5	Low	41 Å²	41	105.7 Å²	105.7	42%	0.423	65%	0.649	S	S	.	*			trans	-72.4	139	156.2	0	0	0	0	0	108	A178	A178-G180 PolarHBondContact O-N 3Å
181	G	41.9	Very low	49	Very low	29 Å²	29	111.2 Å²	111.2	30%	0.299	67%	0.672	S	S	.	*			trans	120.8	13.8	170.5	0	0	0	0	0	117.8	D50 L183	D50-G181 PolarHBondContact OD2-N 2.95Å; G181-L183 VanDerWaalsContact C-N 3.34Å
182	K	44.6	Very low	46.7	Very low	134 Å²	134	112.2 Å²	112.2	58%	0.583	68%	0.68	S	S	*	*	S	Bend	trans	-70.3	-31.9	164.3	-85.3	-164.3	172.8	-165	0	112.3	E38	E38-K182 VanDerWaalsContact CD-NZ 3.32Å; E38-K182 WeakPolarHBondContact OE1-CD 3.42Å; E38-K182 IonicContact OE1-NZ 2.74Å; E38-K182 PolarHBondContact OE1-NZ 3.25Å; E38-K182 IonicContact OE2-NZ 4Å; E38-K182 PolarHBondContact OE2-NZ 3.48Å
183	L	40.7	Very low	44.3	Very low	86 Å²	86	116.6 Å²	116.6	45%	0.45	70%	0.697	S	S	.	*	S	Bend	trans	-93	-23.9	179.3	-127.8	72.4	0	0	0	114.1	G181	G181-L183 VanDerWaalsContact C-N 3.34Å
184	G	35.7	Very low	42.3	Very low	64 Å²	64	122.6 Å²	122.6	66%	0.66	72%	0.718	S	S	*	*	S	Bend	trans	-94.6	-0.6	-165	0	0	0	0	0	118.2
185	R	34	Very low	40.4	Very low	215 Å²	215	123.3 Å²	123.3	81%	0.811	72%	0.718	S	S	*	*			trans	-97.1	4.6	-168.6	-96.8	-173.8	178.6	-168.4	-1.1	117.3	G187	R185-G187 VanDerWaalsContact C-N 3.32Å; R185-G187 PolarHBondContact O-N 3.47Å
186	H	31.8	Very low	39	Very low	196 Å²	196	127.2 Å²	127.2	91%	0.907	72%	0.718	S	S	*	*	S	Bend	trans	-89.2	32.9	-178.2	-78.8	79.7	0	0	0	115.6
187	G	29.2	Very low	38.3	Very low	63 Å²	63	129.3 Å²	129.3	65%	0.649	71%	0.71	S	S	*	*			trans	177.2	77	172	0	0	0	0	0	116.4	R185	R185-G187 VanDerWaalsContact C-N 3.32Å; R185-G187 PolarHBondContact O-N 3.47Å
188	K	27	Very low	38	Very low	205 Å²	205	124.7 Å²	124.7	89%	0.891	69%	0.693	S	S	*	*			trans	-140.9	124.1	149.9	-79	-164.6	176.6	177.5	0	110.3
189	A	29.4	Very low	38.7	Very low	106 Å²	106	125.9 Å²	125.9	88%	0.876	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-59.3	139.2	-179.2	0	0	0	0	0	112
190	V	35.3	Very low	39.2	Very low	136 Å²	136	123.1 Å²	123.1	82%	0.824	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-76.8	126.9	177.8	176.7	0	0	0	0	109.3
191	D	30.8	Very low	40	Very low	145 Å²	145	124.9 Å²	124.9	78%	0.775	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-66.4	126.3	176	-103.3	-47	0	0	0	111.2	K193	D191-K193 VanDerWaalsContact C-N 3.33Å; D191-K193 PolarHBondContact O-N 2.95Å; D191-K193 VanDerWaalsContact O-N 3.16Å
192	P	38.1	Very low	40.9	Very low	112 Å²	112	126.8 Å²	126.8	73%	0.727	69%	0.694	S	S	*	*			trans	-81.9	17.5	-170.3	-13	29.4	0	0	0	117	M194	P192-M194 PolarHBondContact O-N 2.81Å
193	K	35.7	Very low	42.2	Very low	197 Å²	197	123.9 Å²	123.9	86%	0.857	69%	0.69	S	S	*	*			trans	-89.7	9.1	-169.3	-74.7	-169.7	179.3	179.5	0	117.2	D191	D191-K193 VanDerWaalsContact C-N 3.33Å; D191-K193 PolarHBondContact O-N 2.95Å; D191-K193 VanDerWaalsContact O-N 3.16Å
194	M	38.6	Very low	43.9	Very low	177 Å²	177	122.2 Å²	122.2	87%	0.872	69%	0.686	S	S	*	*			trans	-103.8	60.8	171.4	-67.8	-143.1	-147.5	0	0	112.3	P192	P192-M194 PolarHBondContact O-N 2.81Å
195	A	35.9	Very low	45.5	Very low	75 Å²	75	122.7 Å²	122.7	62%	0.62	67%	0.673	S	S	*	*			trans	-112.5	93.8	169.9	0	0	0	0	0	108
196	N	40.6	Very low	47.4	Very low	167 Å²	167	118.1 Å²	118.1	89%	0.893	66%	0.661	S	S	*	*			trans	163.3	74.8	155	-81.3	-18.2	0	0	0	109.3
197	I	47.3	Very low	49.7	Very low	120 Å²	120	118.6 Å²	118.6	62%	0.615	65%	0.654	S	S	*	*			trans	-111.9	121.8	168.4	-63.7	171.4	0	0	0	106.9	D201	I197-D201 HydrophobicContact CG2-CB 3.77Å
198	S	47.8	Very low	52.1	Low	66 Å²	66	120.9 Å²	120.9	46%	0.462	65%	0.648	S	S	.	*			trans	-78.7	154	-172.1	-179.4	0	0	0	0	111.1	K200 D201 I202	S198-K200 PolarHBondContact O-N 3.36Å; S198-K200 VanDerWaalsContact O-N 3.1Å; S198-D201 PolarHBondContact N-OD2 3.24Å; S198-D201 WeakPolarHBondContact O-CB 3.47Å; S198-D201 PolarHBondContact O-N 3.27Å; S198-I202 PolarHBondContact O-N 3.01Å
199	S	59.2	Low	54.5	Low	87 Å²	87	112.2 Å²	112.2	61%	0.608	61%	0.612	S	S	*	*	H	α-helix	trans	-59.3	-23.6	179.2	58.6	0	0	0	0	113.9	S203	S199-S203 PolarHBondContact O-N 3.47Å; S199-S203 PolarHBondContact O-OG 2.95Å
200	K	59	Low	57	Low	165 Å²	165	111.7 Å²	111.7	72%	0.717	59%	0.592	S	S	*	*	H	α-helix	trans	-70.9	-34.2	173.7	-76	-173.4	175.9	-179.5	0	113.2	S198 I202 S204	S198-K200 PolarHBondContact O-N 3.36Å; S198-K200 VanDerWaalsContact O-N 3.1Å; K200-I202 VanDerWaalsContact C-N 3.34Å; K200-S204 WeakPolarHBondContact O-CB 3.37Å; K200-S204 PolarHBondContact O-N 3.02Å; K200-S204 VanDerWaalsContact O-N 3.13Å; K200-S204 PolarHBondContact O-OG 3.31Å
201	D	57.4	Low	59.4	Low	77 Å²	77	109.5 Å²	109.5	41%	0.412	58%	0.576	S	S	.	*	H	α-helix	trans	-68.3	-41.5	177.9	-59.5	-38.6	0	0	0	109.3	I197 S198 S203 S204 L205	I197-D201 HydrophobicContact CG2-CB 3.77Å; S198-D201 PolarHBondContact N-OD2 3.24Å; S198-D201 WeakPolarHBondContact O-CB 3.47Å; S198-D201 PolarHBondContact O-N 3.27Å; D201-S203 PolarHBondContact O-N 2.96Å; D201-S204 PolarHBondContact O-N 3.01Å; D201-S204 PolarHBondContact O-OG 3.29Å; D201-L205 WeakPolarHBondContact O-CB 3.41Å; D201-L205 VanDerWaalsContact O-CD1 3.24Å; D201-L205 WeakPolarHBondContact O-CD1 3.46Å; D201-L205 PolarHBondContact O-N 3.4Å
202	I	60.7	Low	61.8	Low	69 Å²	69	107 Å²	107	35%	0.354	56%	0.558	S	S	.	*	H	α-helix	trans	-56.4	-53	176.3	-58.3	175.4	0	0	0	110.9	S198 K200 S204 L205 E206	S198-I202 PolarHBondContact O-N 3.01Å; K200-I202 VanDerWaalsContact C-N 3.34Å; I202-S204 VanDerWaalsContact C-N 3.29Å; I202-S204 PolarHBondContact O-N 3.49Å; I202-L205 PolarHBondContact O-N 3.39Å; I202-E206 HydrophobicContact CG2-CG 4.36Å; I202-E206 WeakPolarHBondContact O-CB 3.48Å; I202-E206 WeakPolarHBondContact O-CG 3.27Å; I202-E206 PolarHBondContact O-N 2.93Å
203	S	73.2	Confident	63.8	Low	73 Å²	73	108.5 Å²	108.5	51%	0.51	55%	0.549	S	S	.	.	H	α-helix	trans	-65.4	-32.1	-179.6	-55.8	0	0	0	0	113.1	S199 D201 R207	S199-S203 PolarHBondContact O-N 3.47Å; S199-S203 PolarHBondContact O-OG 2.95Å; D201-S203 PolarHBondContact O-N 2.96Å; S203-R207 PolarHBondContact O-N 3.27Å
204	S	74.4	Confident	66.1	Low	52 Å²	52	103.5 Å²	103.5	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-70.6	-39.2	175.6	76.6	0	0	0	0	112	K200 D201 I202 Q208	K200-S204 WeakPolarHBondContact O-CB 3.37Å; K200-S204 PolarHBondContact O-N 3.02Å; K200-S204 VanDerWaalsContact O-N 3.13Å; K200-S204 PolarHBondContact O-OG 3.31Å; D201-S204 PolarHBondContact O-N 3.01Å; D201-S204 PolarHBondContact O-OG 3.29Å; I202-S204 VanDerWaalsContact C-N 3.29Å; I202-S204 PolarHBondContact O-N 3.49Å; S204-Q208 WeakPolarHBondContact O-CG 3.22Å; S204-Q208 PolarHBondContact O-N 3.34Å; S204-Q208 VanDerWaalsContact O-N 3.1Å
205	L	71.1	Confident	68.4	Low	73 Å²	73	99.6 Å²	99.6	38%	0.382	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-44.5	174.9	-96.8	79.3	0	0	0	111	D201 I202 R207 Q208 V209	D201-L205 WeakPolarHBondContact O-CB 3.41Å; D201-L205 VanDerWaalsContact O-CD1 3.24Å; D201-L205 WeakPolarHBondContact O-CD1 3.46Å; D201-L205 PolarHBondContact O-N 3.4Å; I202-L205 PolarHBondContact O-N 3.39Å; L205-R207 VanDerWaalsContact C-N 3.26Å; L205-R207 PolarHBondContact O-N 2.54Å; L205-Q208 CarbonylContact O-C 3.51Å; L205-Q208 PolarHBondContact O-N 2.84Å; L205-Q208 VanDerWaalsContact O-N 3.08Å; L205-V209 WeakPolarHBondContact O-CB 3.39Å; L205-V209 WeakPolarHBondContact O-CG2 3.47Å; L205-V209 PolarHBondContact O-N 3.42Å
206	E	74	Confident	70.5	Confident	120 Å²	120	99.3 Å²	99.3	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-56.2	-42.5	176.3	-77.5	175.7	165	0	0	111.6	I202 V209 Q210	I202-E206 HydrophobicContact CG2-CG 4.36Å; I202-E206 WeakPolarHBondContact O-CB 3.48Å; I202-E206 WeakPolarHBondContact O-CG 3.27Å; I202-E206 PolarHBondContact O-N 2.93Å; E206-V209 PolarHBondContact O-N 2.89Å; E206-Q210 PolarHBondContact O-N 2.87Å
207	R	80	Confident	72.5	Confident	205 Å²	205	94.2 Å²	94.2	77%	0.774	48%	0.48	S	S	*	.	H	α-helix	trans	-66.3	-40.4	176.3	-173	175.1	173.5	160.1	-0.5	112.3	S203 L205 Q210 D211	S203-R207 PolarHBondContact O-N 3.27Å; L205-R207 VanDerWaalsContact C-N 3.26Å; L205-R207 PolarHBondContact O-N 2.54Å; R207-Q210 PolarHBondContact O-N 3.03Å; R207-D211 PolarHBondContact O-N 3.03Å
208	Q	79	Confident	74.4	Confident	111 Å²	111	95.3 Å²	95.3	52%	0.519	48%	0.48	S	S	.	.	H	α-helix	trans	-67	-40.6	175.5	-74.2	179.5	8.6	0	0	111.9	S204 L205 Q210 D211 F212	S204-Q208 WeakPolarHBondContact O-CG 3.22Å; S204-Q208 PolarHBondContact O-N 3.34Å; S204-Q208 VanDerWaalsContact O-N 3.1Å; L205-Q208 CarbonylContact O-C 3.51Å; L205-Q208 PolarHBondContact O-N 2.84Å; L205-Q208 VanDerWaalsContact O-N 3.08Å; Q208-Q210 VanDerWaalsContact C-N 3.29Å; Q208-Q210 PolarHBondContact O-N 3.33Å; Q208-D211 PolarHBondContact O-N 3.04Å; Q208-F212 HydrophobicContact CB-CD2 4.46Å; Q208-F212 HydrophobicContact CB-CE2 4.32Å; Q208-F212 WeakPolarHBondContact O-CD2 3.4Å; Q208-F212 WeakPolarHBondContact O-CG 3.35Å; Q208-F212 PolarHBondContact O-N 3.28Å
209	V	76.9	Confident	76	Confident	23 Å²	23	95 Å²	95	14%	0.139	48%	0.476	C	S	.	.	H	α-helix	trans	-59.2	-44.2	175.4	175.6	0	0	0	0	109.9	L205 E206 F212 R213 L419	L205-V209 WeakPolarHBondContact O-CB 3.39Å; L205-V209 WeakPolarHBondContact O-CG2 3.47Å; L205-V209 PolarHBondContact O-N 3.42Å; E206-V209 PolarHBondContact O-N 2.89Å; V209-F212 PolarHBondContact O-N 3.27Å; V209-R213 WeakPolarHBondContact O-CB 3.32Å; V209-R213 VanDerWaalsContact O-CG 3.3Å; V209-R213 WeakPolarHBondContact O-CG 3.36Å; V209-R213 PolarHBondContact O-N 2.83Å; V209-L419 HydrophobicContact CB-CD2 4.3Å; V209-L419 HydrophobicContact CG1-CD2 4.19Å; V209-L419 HydrophobicContact CG2-CD1 4.25Å; V209-L419 HydrophobicContact CG2-CD2 3.65Å; V209-L419 HydrophobicContact CG2-CG 4.1Å
210	Q	81.6	Confident	77.2	Confident	95 Å²	95	94.3 Å²	94.3	44%	0.444	47%	0.468	S	S	.	.	H	α-helix	trans	-65	-43.8	178.1	-170.7	57.7	33.8	0	0	111.8	E206 R207 Q208 F212 R213 D214	E206-Q210 PolarHBondContact O-N 2.87Å; R207-Q210 PolarHBondContact O-N 3.03Å; Q208-Q210 VanDerWaalsContact C-N 3.29Å; Q208-Q210 PolarHBondContact O-N 3.33Å; Q210-F212 PolarHBondContact O-N 3.05Å; Q210-R213 PolarHBondContact O-N 2.79Å; Q210-D214 PolarHBondContact NE2-OD1 3.07Å; Q210-D214 VanDerWaalsContact O-CG 3.3Å; Q210-D214 PolarHBondContact O-N 3.04Å
211	D	85.4	Confident	78.4	Confident	90 Å²	90	90.1 Å²	90.1	48%	0.481	46%	0.459	S	S	.	.	H	α-helix	trans	-63	-41.2	177.5	-159.4	58.2	0	0	0	111.7	R207 Q208 D214 Q215	R207-D211 PolarHBondContact O-N 3.03Å; Q208-D211 PolarHBondContact O-N 3.04Å; D211-D214 PolarHBondContact O-N 3.2Å; D211-Q215 WeakPolarHBondContact O-CB 3.24Å; D211-Q215 VanDerWaalsContact O-CG 3.25Å; D211-Q215 WeakPolarHBondContact O-CG 3.48Å; D211-Q215 PolarHBondContact O-N 2.91Å; D211-Q215 PolarHBondContact OD2-NE2 3.26Å
212	F	82	Confident	79.9	Confident	93 Å²	93	91.4 Å²	91.4	41%	0.408	46%	0.463	S	S	.	.	H	α-helix	trans	-67.1	-37.2	174.8	-74.6	-53.5	0	0	0	113	Q208 V209 Q210 D214 Q215 L216	Q208-F212 HydrophobicContact CB-CD2 4.46Å; Q208-F212 HydrophobicContact CB-CE2 4.32Å; Q208-F212 WeakPolarHBondContact O-CD2 3.4Å; Q208-F212 WeakPolarHBondContact O-CG 3.35Å; Q208-F212 PolarHBondContact O-N 3.28Å; V209-F212 PolarHBondContact O-N 3.27Å; Q210-F212 PolarHBondContact O-N 3.05Å; F212-D214 VanDerWaalsContact C-N 3.34Å; F212-Q215 PolarHBondContact O-N 2.9Å; F212-L216 VanDerWaalsContact O-CB 3.26Å; F212-L216 WeakPolarHBondContact O-CB 3.42Å; F212-L216 PolarHBondContact O-N 2.92Å
213	R	80.2	Confident	81	Confident	144 Å²	144	93.3 Å²	93.3	54%	0.543	47%	0.468	S	S	.	.	H	α-helix	trans	-63	-42.6	174.1	-78.1	175.1	177.2	172.9	0.1	111.3	V209 Q210 L216 A217	V209-R213 WeakPolarHBondContact O-CB 3.32Å; V209-R213 VanDerWaalsContact O-CG 3.3Å; V209-R213 WeakPolarHBondContact O-CG 3.36Å; V209-R213 PolarHBondContact O-N 2.83Å; Q210-R213 PolarHBondContact O-N 2.79Å; R213-L216 PolarHBondContact O-N 3.12Å; R213-A217 WeakPolarHBondContact O-CB 3.32Å; R213-A217 PolarHBondContact O-N 2.87Å
214	D	84	Confident	81.4	Confident	91 Å²	91	95.3 Å²	95.3	49%	0.487	47%	0.47	S	S	.	.	H	α-helix	trans	-67.9	-40.9	178.3	-67.6	-20.1	0	0	0	111.4	Q210 D211 F212 A217 K218	Q210-D214 PolarHBondContact NE2-OD1 3.07Å; Q210-D214 VanDerWaalsContact O-CG 3.3Å; Q210-D214 PolarHBondContact O-N 3.04Å; D211-D214 PolarHBondContact O-N 3.2Å; F212-D214 VanDerWaalsContact C-N 3.34Å; D214-A217 PolarHBondContact O-N 3.29Å; D214-K218 WeakPolarHBondContact O-CB 3.49Å; D214-K218 PolarHBondContact O-N 3.46Å
215	Q	86.1	Confident	82	Confident	95 Å²	95	95.1 Å²	95.1	44%	0.444	47%	0.471	S	S	.	.	H	α-helix	trans	-62	-43.2	172.8	-73	176.8	19.4	0	0	111.8	D211 F212 K218 V219	D211-Q215 WeakPolarHBondContact O-CB 3.24Å; D211-Q215 VanDerWaalsContact O-CG 3.25Å; D211-Q215 WeakPolarHBondContact O-CG 3.48Å; D211-Q215 PolarHBondContact O-N 2.91Å; D211-Q215 PolarHBondContact OD2-NE2 3.26Å; F212-Q215 PolarHBondContact O-N 2.9Å; Q215-K218 WeakPolarHBondContact O-CB 3.33Å; Q215-K218 PolarHBondContact O-N 3.18Å; Q215-V219 WeakPolarHBondContact O-CG2 3.39Å; Q215-V219 PolarHBondContact O-N 2.73Å
216	L	80.8	Confident	82.6	Confident	69 Å²	69	94.2 Å²	94.2	36%	0.361	47%	0.466	S	S	.	.	H	α-helix	trans	-67.7	-41.6	179.5	-164.2	150.1	0	0	0	111.5	F212 R213 K218 V219 V220 L416	F212-L216 VanDerWaalsContact O-CB 3.26Å; F212-L216 WeakPolarHBondContact O-CB 3.42Å; F212-L216 PolarHBondContact O-N 2.92Å; R213-L216 PolarHBondContact O-N 3.12Å; L216-K218 PolarHBondContact O-N 3.24Å; L216-V219 PolarHBondContact O-N 3.13Å; L216-V220 HydrophobicContact CD2-CG2 3.7Å; L216-V220 WeakPolarHBondContact O-CB 3.46Å; L216-V220 VanDerWaalsContact O-CG2 3.3Å; L216-V220 WeakPolarHBondContact O-CG2 3.35Å; L216-V220 PolarHBondContact O-N 3.5Å; L216-L416 HydrophobicContact CD1-CD1 3.21Å
217	A	82	Confident	83.1	Confident	60 Å²	60	93.5 Å²	93.5	50%	0.496	46%	0.463	S	S	.	.	H	α-helix	trans	-58.3	-39.1	173.2	0	0	0	0	0	111.5	R213 D214 S221	R213-A217 WeakPolarHBondContact O-CB 3.32Å; R213-A217 PolarHBondContact O-N 2.87Å; D214-A217 PolarHBondContact O-N 3.29Å; A217-S221 WeakPolarHBondContact O-CB 3.33Å; A217-S221 PolarHBondContact O-N 2.97Å
218	K	87	Confident	83.3	Confident	143 Å²	143	88.5 Å²	88.5	62%	0.622	45%	0.452	S	S	*	.	H	α-helix	trans	-66.6	-45.4	175.8	-165.2	178.1	-176.5	-179.3	0	112.3	D214 Q215 L216 S221 Q222	D214-K218 WeakPolarHBondContact O-CB 3.49Å; D214-K218 PolarHBondContact O-N 3.46Å; Q215-K218 WeakPolarHBondContact O-CB 3.33Å; Q215-K218 PolarHBondContact O-N 3.18Å; L216-K218 PolarHBondContact O-N 3.24Å; K218-S221 PolarHBondContact O-N 2.97Å; K218-Q222 VanDerWaalsContact O-CG 3.32Å; K218-Q222 WeakPolarHBondContact O-CG 3.41Å; K218-Q222 PolarHBondContact O-N 2.8Å
219	V	83	Confident	83.6	Confident	61 Å²	61	89 Å²	89	37%	0.37	45%	0.454	S	S	.	.	H	α-helix	trans	-66.6	-41.1	178.8	172.5	0	0	0	0	111.5	Q215 L216 S221 Q222 K223	Q215-V219 WeakPolarHBondContact O-CG2 3.39Å; Q215-V219 PolarHBondContact O-N 2.73Å; L216-V219 PolarHBondContact O-N 3.13Å; V219-S221 VanDerWaalsContact C-N 3.35Å; V219-Q222 PolarHBondContact O-N 3.08Å; V219-K223 WeakPolarHBondContact O-CB 3.48Å; V219-K223 PolarHBondContact O-N 3.12Å
220	V	83.2	Confident	83.8	Confident	71 Å²	71	90.5 Å²	90.5	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-62.9	-43.2	175.9	170.5	0	0	0	0	110.7	L216 K223 Q224	L216-V220 HydrophobicContact CD2-CG2 3.7Å; L216-V220 WeakPolarHBondContact O-CB 3.46Å; L216-V220 VanDerWaalsContact O-CG2 3.3Å; L216-V220 WeakPolarHBondContact O-CG2 3.35Å; L216-V220 PolarHBondContact O-N 3.5Å; V220-K223 PolarHBondContact O-N 2.52Å; V220-Q224 WeakPolarHBondContact O-CB 3.16Å; V220-Q224 PolarHBondContact O-N 3.38Å
221	S	85.2	Confident	83.8	Confident	78 Å²	78	87.3 Å²	87.3	55%	0.545	45%	0.453	S	S	.	.	H	α-helix	trans	-61.3	-43.7	174.5	-179.6	0	0	0	0	112.2	A217 K218 V219 Q224 A225	A217-S221 WeakPolarHBondContact O-CB 3.33Å; A217-S221 PolarHBondContact O-N 2.97Å; K218-S221 PolarHBondContact O-N 2.97Å; V219-S221 VanDerWaalsContact C-N 3.35Å; S221-Q224 PolarHBondContact O-N 3Å; S221-A225 PolarHBondContact O-N 3.35Å
222	Q	87.7	Confident	83.8	Confident	104 Å²	104	89.6 Å²	89.6	49%	0.486	46%	0.461	S	S	.	.	H	α-helix	trans	-63.5	-43.3	175.7	-75	175.7	-15.7	0	0	112.5	K218 V219 Q224 A225 I226	K218-Q222 VanDerWaalsContact O-CG 3.32Å; K218-Q222 WeakPolarHBondContact O-CG 3.41Å; K218-Q222 PolarHBondContact O-N 2.8Å; V219-Q222 PolarHBondContact O-N 3.08Å; Q222-Q224 VanDerWaalsContact C-N 3.31Å; Q222-Q224 PolarHBondContact O-N 3.37Å; Q222-A225 PolarHBondContact O-N 3.21Å; Q222-I226 VanDerWaalsContact O-CG1 3.3Å; Q222-I226 WeakPolarHBondContact O-CG1 3.37Å; Q222-I226 PolarHBondContact O-N 2.98Å
223	K	85	Confident	83.8	Confident	108 Å²	108	86.9 Å²	86.9	47%	0.47	46%	0.455	S	S	.	.	H	α-helix	trans	-58.2	-46.2	175.4	177.6	-175.8	167.2	-176.7	0	110.7	V219 V220 I226 E227	V219-K223 WeakPolarHBondContact O-CB 3.48Å; V219-K223 PolarHBondContact O-N 3.12Å; V220-K223 PolarHBondContact O-N 2.52Å; K223-I226 PolarHBondContact O-N 3.33Å; K223-E227 WeakPolarHBondContact CE-OE1 3.47Å; K223-E227 IonicContact NZ-OE1 3.05Å; K223-E227 WeakPolarHBondContact O-CG 3.3Å; K223-E227 PolarHBondContact O-N 2.9Å
224	Q	81.1	Confident	84	Confident	116 Å²	116	84.4 Å²	84.4	54%	0.542	45%	0.45	S	S	.	.	H	α-helix	trans	-66.4	-39.1	-177.9	-156	159.4	3.3	0	0	111.6	V220 S221 Q222 I226 E227 D228	V220-Q224 WeakPolarHBondContact O-CB 3.16Å; V220-Q224 PolarHBondContact O-N 3.38Å; S221-Q224 PolarHBondContact O-N 3Å; Q222-Q224 VanDerWaalsContact C-N 3.31Å; Q222-Q224 PolarHBondContact O-N 3.37Å; Q224-I226 PolarHBondContact O-N 2.99Å; Q224-E227 PolarHBondContact O-N 3.44Å; Q224-D228 PolarHBondContact O-N 3.25Å
225	A	85.7	Confident	84	Confident	48 Å²	48	84 Å²	84	40%	0.397	45%	0.448	S	S	.	.	H	α-helix	trans	-61.7	-41.4	172	0	0	0	0	0	112.6	S221 Q222 D228 E229	S221-A225 PolarHBondContact O-N 3.35Å; Q222-A225 PolarHBondContact O-N 3.21Å; A225-D228 PolarHBondContact O-N 3.5Å; A225-E229 WeakPolarHBondContact O-CG 3.44Å; A225-E229 PolarHBondContact O-N 2.87Å
226	I	84.7	Confident	84	Confident	53 Å²	53	82.1 Å²	82.1	27%	0.272	45%	0.448	S	S	.	.	H	α-helix	trans	-66.8	-40.8	176.4	-67.5	165.8	0	0	0	111.1	Q222 K223 Q224 D228 E229 M230	Q222-I226 VanDerWaalsContact O-CG1 3.3Å; Q222-I226 WeakPolarHBondContact O-CG1 3.37Å; Q222-I226 PolarHBondContact O-N 2.98Å; K223-I226 PolarHBondContact O-N 3.33Å; Q224-I226 PolarHBondContact O-N 2.99Å; I226-D228 VanDerWaalsContact C-N 3.33Å; I226-D228 PolarHBondContact O-N 3.29Å; I226-E229 PolarHBondContact O-N 3.29Å; I226-M230 HydrophobicContact CG2-CG 4.39Å; I226-M230 HydrophobicContact CG2-SD 4.31Å; I226-M230 WeakPolarHBondContact O-CB 3.34Å; I226-M230 WeakPolarHBondContact O-CG 3.22Å; I226-M230 PolarHBondContact O-N 2.89Å
227	E	85.1	Confident	84.4	Confident	105 Å²	105	81.2 Å²	81.2	49%	0.491	44%	0.443	S	S	.	.	H	α-helix	trans	-62.5	-40.4	176.2	-75.2	177.5	165.3	0	0	111.5	K223 Q224 M230 G231	K223-E227 WeakPolarHBondContact CE-OE1 3.47Å; K223-E227 IonicContact NZ-OE1 3.05Å; K223-E227 WeakPolarHBondContact O-CG 3.3Å; K223-E227 PolarHBondContact O-N 2.9Å; Q224-E227 PolarHBondContact O-N 3.44Å; E227-M230 PolarHBondContact O-N 3.06Å; E227-G231 PolarHBondContact O-N 2.98Å
228	D	82.9	Confident	84.3	Confident	101 Å²	101	85.5 Å²	85.5	54%	0.54	45%	0.447	S	S	.	.	H	α-helix	trans	-66.3	-43	174.7	-72.1	-23	0	0	0	111.9	Q224 A225 I226 G231 Q232	Q224-D228 PolarHBondContact O-N 3.25Å; A225-D228 PolarHBondContact O-N 3.5Å; I226-D228 VanDerWaalsContact C-N 3.33Å; I226-D228 PolarHBondContact O-N 3.29Å; D228-G231 PolarHBondContact O-N 3.2Å; D228-Q232 WeakPolarHBondContact O-CG 3.42Å; D228-Q232 PolarHBondContact O-N 3.42Å
229	E	86.1	Confident	84.2	Confident	120 Å²	120	85.3 Å²	85.3	56%	0.561	45%	0.448	S	S	*	.	H	α-helix	trans	-63.1	-41.6	174.8	-78.8	-176.6	-174.8	0	0	112.2	A225 I226 G231 Q232 A233	A225-E229 WeakPolarHBondContact O-CG 3.44Å; A225-E229 PolarHBondContact O-N 2.87Å; I226-E229 PolarHBondContact O-N 3.29Å; E229-G231 VanDerWaalsContact C-N 3.34Å; E229-Q232 PolarHBondContact O-N 3.13Å; E229-A233 WeakPolarHBondContact O-CB 3.37Å; E229-A233 PolarHBondContact O-N 3.5Å
230	M	81.1	Confident	84.3	Confident	55 Å²	55	83.6 Å²	83.6	27%	0.271	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-43.4	173.7	-77.8	-175.5	62.4	0	0	111.2	I226 E227 Q232 A233 E234 L402	I226-M230 HydrophobicContact CG2-CG 4.39Å; I226-M230 HydrophobicContact CG2-SD 4.31Å; I226-M230 WeakPolarHBondContact O-CB 3.34Å; I226-M230 WeakPolarHBondContact O-CG 3.22Å; I226-M230 PolarHBondContact O-N 2.89Å; E227-M230 PolarHBondContact O-N 3.06Å; M230-Q232 VanDerWaalsContact C-N 3.33Å; M230-Q232 PolarHBondContact O-N 2.67Å; M230-A233 PolarHBondContact O-N 3.44Å; M230-E234 WeakPolarHBondContact O-CB 3.49Å; M230-E234 WeakPolarHBondContact O-CG 3.38Å; M230-E234 PolarHBondContact O-N 2.78Å; M230-L402 HydrophobicContact SD-CD1 3.95Å
231	G	81.5	Confident	84.5	Confident	28 Å²	28	82.6 Å²	82.6	29%	0.289	43%	0.434	S	S	.	.	H	α-helix	trans	-60.3	-41.4	175.5	0	0	0	0	0	112.6	E227 D228 E229 N235	E227-G231 PolarHBondContact O-N 2.98Å; D228-G231 PolarHBondContact O-N 3.2Å; E229-G231 VanDerWaalsContact C-N 3.34Å; G231-N235 VanDerWaalsContact O-CG 3.27Å; G231-N235 PolarHBondContact O-N 3.03Å; G231-N235 VanDerWaalsContact O-N 3.13Å; G231-N235 PolarHBondContact O-ND2 3.47Å
232	Q	85.9	Confident	84.5	Confident	139 Å²	139	84.7 Å²	84.7	65%	0.65	44%	0.439	S	S	*	.	H	α-helix	trans	-66.1	-43.9	174.9	-70.3	177.7	21.9	0	0	112	D228 E229 M230 N235 A236	D228-Q232 WeakPolarHBondContact O-CG 3.42Å; D228-Q232 PolarHBondContact O-N 3.42Å; E229-Q232 PolarHBondContact O-N 3.13Å; M230-Q232 VanDerWaalsContact C-N 3.33Å; M230-Q232 PolarHBondContact O-N 2.67Å; Q232-N235 PolarHBondContact O-N 3.18Å; Q232-A236 WeakPolarHBondContact O-CB 3.17Å; Q232-A236 PolarHBondContact O-N 3.08Å
233	A	81.1	Confident	84.3	Confident	35 Å²	35	84.8 Å²	84.8	29%	0.289	44%	0.439	S	S	.	.	H	α-helix	trans	-64.3	-41	177.9	0	0	0	0	0	112.3	E229 M230 N235 A236 L237	E229-A233 WeakPolarHBondContact O-CB 3.37Å; E229-A233 PolarHBondContact O-N 3.5Å; M230-A233 PolarHBondContact O-N 3.44Å; A233-N235 VanDerWaalsContact C-N 3.35Å; A233-N235 PolarHBondContact O-N 2.93Å; A233-A236 PolarHBondContact O-N 3.32Å; A233-L237 WeakPolarHBondContact O-CB 3.45Å; A233-L237 PolarHBondContact O-N 3.42Å
234	E	85.6	Confident	84.3	Confident	93 Å²	93	84.4 Å²	84.4	44%	0.435	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-41.5	174.5	-79.7	-170.5	-173.1	0	0	112.2	M230 L237 R238	M230-E234 WeakPolarHBondContact O-CB 3.49Å; M230-E234 WeakPolarHBondContact O-CG 3.38Å; M230-E234 PolarHBondContact O-N 2.78Å; E234-L237 PolarHBondContact O-N 2.93Å; E234-R238 WeakPolarHBondContact O-CG 3.45Å; E234-R238 PolarHBondContact O-N 2.65Å; E234-R238 IonicContact OE2-CZ 3.37Å; E234-R238 IonicContact OE2-NH2 3.36Å; E234-R238 PolarHBondContact OE2-NH2 2.82Å; E234-R238 VanDerWaalsContact OE2-NH2 3.12Å
235	N	82.9	Confident	84.4	Confident	83 Å²	83	81.9 Å²	81.9	44%	0.444	43%	0.425	S	S	.	.	H	α-helix	trans	-67.1	-43.5	177.3	-71.8	-23.8	0	0	0	111.3	G231 Q232 A233 L237 R238 E239	G231-N235 VanDerWaalsContact O-CG 3.27Å; G231-N235 PolarHBondContact O-N 3.03Å; G231-N235 VanDerWaalsContact O-N 3.13Å; G231-N235 PolarHBondContact O-ND2 3.47Å; Q232-N235 PolarHBondContact O-N 3.18Å; A233-N235 VanDerWaalsContact C-N 3.35Å; A233-N235 PolarHBondContact O-N 2.93Å; N235-L237 VanDerWaalsContact C-N 3.29Å; N235-L237 PolarHBondContact O-N 2.95Å; N235-R238 PolarHBondContact O-N 3.37Å; N235-R238 PolarHBondContact OD1-NH1 3.49Å; N235-R238 VanDerWaalsContact OD1-NH1 3.08Å; N235-E239 WeakPolarHBondContact O-CG 3.37Å; N235-E239 PolarHBondContact O-N 3.44Å
236	A	87.4	Confident	84.3	Confident	55 Å²	55	83.8 Å²	83.8	46%	0.455	43%	0.428	S	S	.	.	H	α-helix	trans	-60	-39.2	174.4	0	0	0	0	0	112	Q232 A233 E239 A240	Q232-A236 WeakPolarHBondContact O-CB 3.17Å; Q232-A236 PolarHBondContact O-N 3.08Å; A233-A236 PolarHBondContact O-N 3.32Å; A236-E239 PolarHBondContact O-N 3.27Å; A236-A240 WeakPolarHBondContact O-CB 3.43Å; A236-A240 PolarHBondContact O-N 3.33Å
237	L	88.3	Confident	84.2	Confident	49 Å²	49	82.8 Å²	82.8	26%	0.257	42%	0.422	S	S	.	.	H	α-helix	trans	-65.3	-43.6	174.8	-176.8	63.9	0	0	0	111.7	A233 E234 N235 E239 A240 V241 I395	A233-L237 WeakPolarHBondContact O-CB 3.45Å; A233-L237 PolarHBondContact O-N 3.42Å; E234-L237 PolarHBondContact O-N 2.93Å; N235-L237 VanDerWaalsContact C-N 3.29Å; N235-L237 PolarHBondContact O-N 2.95Å; L237-E239 VanDerWaalsContact C-N 3.34Å; L237-E239 PolarHBondContact O-N 3.06Å; L237-A240 PolarHBondContact O-N 2.87Å; L237-V241 HydrophobicContact CD1-CG2 4.37Å; L237-V241 WeakPolarHBondContact O-CB 3.38Å; L237-V241 VanDerWaalsContact O-CG2 3.28Å; L237-V241 WeakPolarHBondContact O-CG2 3.28Å; L237-V241 PolarHBondContact O-N 2.93Å; L237-I395 HydrophobicContact CD2-CD1 4.3Å
238	R	80.6	Confident	84.1	Confident	150 Å²	150	85 Å²	85	57%	0.566	43%	0.426	S	S	*	.	H	α-helix	trans	-60.4	-43.5	175.9	-74.9	178.4	-169.9	124.6	12.5	111.7	E234 N235 V241 L242	E234-R238 WeakPolarHBondContact O-CG 3.45Å; E234-R238 PolarHBondContact O-N 2.65Å; E234-R238 IonicContact OE2-CZ 3.37Å; E234-R238 IonicContact OE2-NH2 3.36Å; E234-R238 PolarHBondContact OE2-NH2 2.82Å; E234-R238 VanDerWaalsContact OE2-NH2 3.12Å; N235-R238 PolarHBondContact O-N 3.37Å; N235-R238 PolarHBondContact OD1-NH1 3.49Å; N235-R238 VanDerWaalsContact OD1-NH1 3.08Å; R238-V241 PolarHBondContact O-N 2.98Å; R238-L242 WeakPolarHBondContact O-CB 3.39Å; R238-L242 PolarHBondContact O-N 3.12Å
239	E	85.2	Confident	84	Confident	139 Å²	139	86.8 Å²	86.8	65%	0.65	43%	0.431	S	S	*	.	H	α-helix	trans	-63	-45.4	176.1	-73.3	179.3	-177.3	0	0	111.8	N235 A236 L237 V241 L242 Q243	N235-E239 WeakPolarHBondContact O-CG 3.37Å; N235-E239 PolarHBondContact O-N 3.44Å; A236-E239 PolarHBondContact O-N 3.27Å; L237-E239 VanDerWaalsContact C-N 3.34Å; L237-E239 PolarHBondContact O-N 3.06Å; E239-V241 PolarHBondContact O-N 3.34Å; E239-L242 PolarHBondContact O-N 3.38Å; E239-Q243 WeakPolarHBondContact O-CB 3.47Å; E239-Q243 PolarHBondContact O-N 3.13Å
240	A	84.4	Confident	83.9	Confident	26 Å²	26	86.1 Å²	86.1	22%	0.215	43%	0.426	C	S	.	.	H	α-helix	trans	-63	-41.2	177.9	0	0	0	0	0	112.5	A236 L237 Q243 R244	A236-A240 WeakPolarHBondContact O-CB 3.43Å; A236-A240 PolarHBondContact O-N 3.33Å; L237-A240 PolarHBondContact O-N 2.87Å; A240-Q243 PolarHBondContact O-N 3.03Å; A240-R244 WeakPolarHBondContact O-CB 3.34Å; A240-R244 PolarHBondContact O-N 3.33Å
241	V	87	Confident	83.8	Confident	49 Å²	49	84.9 Å²	84.9	30%	0.297	42%	0.422	S	S	.	.	H	α-helix	trans	-64.8	-44.9	176	170.8	0	0	0	0	111.1	L237 R238 E239 Q243 R244 D245	L237-V241 HydrophobicContact CD1-CG2 4.37Å; L237-V241 WeakPolarHBondContact O-CB 3.38Å; L237-V241 VanDerWaalsContact O-CG2 3.28Å; L237-V241 WeakPolarHBondContact O-CG2 3.28Å; L237-V241 PolarHBondContact O-N 2.93Å; R238-V241 PolarHBondContact O-N 2.98Å; E239-V241 PolarHBondContact O-N 3.34Å; V241-Q243 VanDerWaalsContact C-N 3.3Å; V241-Q243 PolarHBondContact O-N 3.42Å; V241-R244 WeakPolarHBondContact O-CB 3.43Å; V241-R244 PolarHBondContact O-N 2.94Å; V241-D245 PolarHBondContact O-N 2.79Å
242	L	84.5	Confident	83.9	Confident	122 Å²	122	87.4 Å²	87.4	64%	0.639	43%	0.429	S	S	*	.	H	α-helix	trans	-59.3	-43.2	175.9	-177.6	68.1	0	0	0	111.2	R238 E239 D245 L246	R238-L242 WeakPolarHBondContact O-CB 3.39Å; R238-L242 PolarHBondContact O-N 3.12Å; E239-L242 PolarHBondContact O-N 3.38Å; L242-D245 PolarHBondContact O-N 3.5Å; L242-L246 WeakPolarHBondContact O-CB 3.4Å; L242-L246 PolarHBondContact O-N 3.3Å
243	Q	85	Confident	83.6	Confident	107 Å²	107	85 Å²	85	50%	0.5	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-42.5	177.8	-167.7	176.7	10.5	0	0	111.7	E239 A240 V241 L246 Q247	E239-Q243 WeakPolarHBondContact O-CB 3.47Å; E239-Q243 PolarHBondContact O-N 3.13Å; A240-Q243 PolarHBondContact O-N 3.03Å; V241-Q243 VanDerWaalsContact C-N 3.3Å; V241-Q243 PolarHBondContact O-N 3.42Å; Q243-L246 PolarHBondContact O-N 3.47Å; Q243-Q247 WeakPolarHBondContact O-CG 3.42Å; Q243-Q247 PolarHBondContact O-N 3.5Å
244	R	84.1	Confident	83.6	Confident	99 Å²	99	86 Å²	86	37%	0.374	42%	0.421	S	S	.	.	H	α-helix	trans	-59.3	-46.6	174.6	-176.8	-156.1	68.3	175.5	-4.3	111.5	A240 V241 L246 Q247 R248	A240-R244 WeakPolarHBondContact O-CB 3.34Å; A240-R244 PolarHBondContact O-N 3.33Å; V241-R244 WeakPolarHBondContact O-CB 3.43Å; V241-R244 PolarHBondContact O-N 2.94Å; R244-L246 VanDerWaalsContact C-N 3.31Å; R244-L246 PolarHBondContact O-N 3.46Å; R244-Q247 PolarHBondContact O-N 3.44Å; R244-R248 WeakPolarHBondContact O-CB 3.5Å; R244-R248 PolarHBondContact O-N 2.91Å
245	D	83.8	Confident	83.3	Confident	64 Å²	64	85 Å²	85	34%	0.342	42%	0.423	S	S	.	.	H	α-helix	trans	-65.5	-37.6	-178.7	-70.6	-8.4	0	0	0	111.5	V241 L242 R248 Q249	V241-D245 PolarHBondContact O-N 2.79Å; L242-D245 PolarHBondContact O-N 3.5Å; D245-R248 PolarHBondContact O-N 3.39Å; D245-Q249 WeakPolarHBondContact O-CG 3.34Å; D245-Q249 PolarHBondContact O-N 2.87Å
246	L	83.8	Confident	83.1	Confident	88 Å²	88	87.8 Å²	87.8	46%	0.461	43%	0.434	S	S	.	.	H	α-helix	trans	-65.2	-38.3	174.1	-163.7	128.1	0	0	0	112.2	L242 Q243 R244 K250	L242-L246 WeakPolarHBondContact O-CB 3.4Å; L242-L246 PolarHBondContact O-N 3.3Å; Q243-L246 PolarHBondContact O-N 3.47Å; R244-L246 VanDerWaalsContact C-N 3.31Å; R244-L246 PolarHBondContact O-N 3.46Å; L246-K250 WeakPolarHBondContact O-CG 3.4Å; L246-K250 PolarHBondContact O-N 2.85Å
247	Q	82.5	Confident	82.6	Confident	31 Å²	31	92.9 Å²	92.9	15%	0.145	44%	0.441	C	S	.	.	H	α-helix	trans	-69.2	-40.7	173.4	-66.3	-61.3	-9	0	0	111.8	Q243 R244 Q249 K250 T251	Q243-Q247 WeakPolarHBondContact O-CG 3.42Å; Q243-Q247 PolarHBondContact O-N 3.5Å; R244-Q247 PolarHBondContact O-N 3.44Å; Q247-Q249 VanDerWaalsContact C-N 3.33Å; Q247-Q249 PolarHBondContact O-N 3.19Å; Q247-K250 WeakPolarHBondContact O-CB 3.41Å; Q247-K250 PolarHBondContact O-N 3.06Å; Q247-K250 VanDerWaalsContact O-N 3.07Å; Q247-T251 PolarHBondContact O-N 3.45Å; Q247-T251 PolarHBondContact O-OG1 3.39Å; Q247-T251 VanDerWaalsContact O-OG1 3.1Å
248	R	82.2	Confident	82.3	Confident	151 Å²	151	96.5 Å²	96.5	57%	0.57	46%	0.455	S	S	*	.	H	α-helix	trans	-59.3	-43.4	176.7	-167.6	178.6	-179	-166.4	2.1	111.9	R244 D245 K250 T251 D252	R244-R248 WeakPolarHBondContact O-CB 3.5Å; R244-R248 PolarHBondContact O-N 2.91Å; D245-R248 PolarHBondContact O-N 3.39Å; R248-K250 VanDerWaalsContact C-N 3.31Å; R248-K250 PolarHBondContact O-N 2.79Å; R248-T251 PolarHBondContact O-N 3.13Å; R248-D252 VanDerWaalsContact O-CG 3.3Å; R248-D252 PolarHBondContact O-N 3.39Å
249	Q	81.6	Confident	82.3	Confident	140 Å²	140	91.9 Å²	91.9	65%	0.654	45%	0.445	S	S	*	.	H	α-helix	trans	-61	-37.6	174.4	-74.8	-174.9	-5.8	0	0	113	D245 Q247 N253	D245-Q249 WeakPolarHBondContact O-CG 3.34Å; D245-Q249 PolarHBondContact O-N 2.87Å; Q247-Q249 VanDerWaalsContact C-N 3.33Å; Q247-Q249 PolarHBondContact O-N 3.19Å; Q249-N253 WeakPolarHBondContact O-CB 3.4Å; Q249-N253 PolarHBondContact O-N 2.82Å
250	K	83.1	Confident	82	Confident	105 Å²	105	88.3 Å²	88.3	46%	0.457	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-44.3	174.4	-69.6	172.6	-178.1	175.7	0	111.1	L246 Q247 R248 N253 L254	L246-K250 WeakPolarHBondContact O-CG 3.4Å; L246-K250 PolarHBondContact O-N 2.85Å; Q247-K250 WeakPolarHBondContact O-CB 3.41Å; Q247-K250 PolarHBondContact O-N 3.06Å; Q247-K250 VanDerWaalsContact O-N 3.07Å; R248-K250 VanDerWaalsContact C-N 3.31Å; R248-K250 PolarHBondContact O-N 2.79Å; K250-N253 PolarHBondContact O-N 3.1Å; K250-L254 WeakPolarHBondContact O-CG 3.19Å; K250-L254 PolarHBondContact O-N 2.89Å
251	T	79.8	Confident	81.7	Confident	29 Å²	29	90.1 Å²	90.1	18%	0.178	44%	0.444	C	S	.	.	H	α-helix	trans	-62.7	-43.9	177	-52.3	0	0	0	0	111.6	Q247 R248 N253 L254 C255 L374	Q247-T251 PolarHBondContact O-N 3.45Å; Q247-T251 PolarHBondContact O-OG1 3.39Å; Q247-T251 VanDerWaalsContact O-OG1 3.1Å; R248-T251 PolarHBondContact O-N 3.13Å; T251-N253 PolarHBondContact O-N 2.94Å; T251-L254 PolarHBondContact O-N 2.8Å; T251-C255 PolarHBondContact O-N 2.88Å; T251-L374 HydrophobicContact CG2-CD1 4.38Å
252	D	82.2	Confident	81.4	Confident	82 Å²	82	92.5 Å²	92.5	44%	0.439	45%	0.452	S	S	.	.	H	α-helix	trans	-62.7	-41.8	177.8	-70.7	-21.3	0	0	0	111.7	R248 C255 Q256	R248-D252 VanDerWaalsContact O-CG 3.3Å; R248-D252 PolarHBondContact O-N 3.39Å; D252-C255 PolarHBondContact O-N 3.14Å; D252-Q256 WeakPolarHBondContact O-CG 3.47Å; D252-Q256 PolarHBondContact O-N 3.29Å
253	N	80.5	Confident	81.2	Confident	89 Å²	89	92.7 Å²	92.7	48%	0.476	45%	0.448	S	S	.	.	H	α-helix	trans	-63.3	-42.2	175	-169.3	-49.1	0	0	0	111.6	Q249 K250 T251 Q256 R257	Q249-N253 WeakPolarHBondContact O-CB 3.4Å; Q249-N253 PolarHBondContact O-N 2.82Å; K250-N253 PolarHBondContact O-N 3.1Å; T251-N253 PolarHBondContact O-N 2.94Å; N253-Q256 PolarHBondContact O-N 3.47Å; N253-R257 PolarHBondContact O-N 3.43Å
254	L	81.2	Confident	80.8	Confident	54 Å²	54	90.9 Å²	90.9	28%	0.283	44%	0.441	S	S	.	.	H	α-helix	trans	-64.6	-39.9	175.5	-73.3	171.1	0	0	0	112.2	K250 T251 R257 K258	K250-L254 WeakPolarHBondContact O-CG 3.19Å; K250-L254 PolarHBondContact O-N 2.89Å; T251-L254 PolarHBondContact O-N 2.8Å; L254-R257 PolarHBondContact O-N 3.46Å; L254-K258 WeakPolarHBondContact O-CB 3.2Å; L254-K258 PolarHBondContact O-N 3.18Å
255	C	78.6	Confident	80.4	Confident	73 Å²	73	89.6 Å²	89.6	49%	0.493	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-43	174.1	-84.6	0	0	0	0	112.2	T251 D252 R257 K258 S259	T251-C255 PolarHBondContact O-N 2.88Å; D252-C255 PolarHBondContact O-N 3.14Å; C255-R257 PolarHBondContact O-N 3.11Å; C255-K258 PolarHBondContact O-N 3.35Å; C255-S259 PolarHBondContact O-N 2.95Å
256	Q	79.3	Confident	80	Confident	142 Å²	142	92.6 Å²	92.6	66%	0.664	45%	0.453	S	S	*	.	H	α-helix	trans	-62.1	-42.9	174.6	-73	-179.9	0.1	0	0	111.9	D252 N253 S259 S260	D252-Q256 WeakPolarHBondContact O-CG 3.47Å; D252-Q256 PolarHBondContact O-N 3.29Å; N253-Q256 PolarHBondContact O-N 3.47Å; Q256-S259 PolarHBondContact O-N 3.35Å; Q256-S260 PolarHBondContact O-N 3Å
257	R	76.7	Confident	79.6	Confident	162 Å²	162	94.5 Å²	94.5	61%	0.611	46%	0.458	S	S	*	.	H	α-helix	trans	-63.8	-41.3	175.4	-77.6	173.2	64.4	-178.1	-0.7	112.1	N253 L254 C255 S260 V261	N253-R257 PolarHBondContact O-N 3.43Å; L254-R257 PolarHBondContact O-N 3.46Å; C255-R257 PolarHBondContact O-N 3.11Å; R257-S260 PolarHBondContact O-N 3.19Å; R257-V261 WeakPolarHBondContact O-CG2 3.47Å; R257-V261 PolarHBondContact O-N 3.35Å
258	K	81.8	Confident	79	Confident	124 Å²	124	97.8 Å²	97.8	54%	0.539	48%	0.475	S	S	.	.	H	α-helix	trans	-58.9	-48.6	175.7	-177.1	-178.1	170.5	-173	0	110.9	L254 C255 S260 V261 E262	L254-K258 WeakPolarHBondContact O-CB 3.2Å; L254-K258 PolarHBondContact O-N 3.18Å; C255-K258 PolarHBondContact O-N 3.35Å; K258-S260 VanDerWaalsContact C-N 3.32Å; K258-S260 PolarHBondContact O-N 3.11Å; K258-V261 PolarHBondContact O-N 3.06Å; K258-V261 VanDerWaalsContact O-N 3.17Å; K258-E262 WeakPolarHBondContact CE-OE1 3.43Å; K258-E262 WeakPolarHBondContact O-CG 3.24Å; K258-E262 PolarHBondContact O-N 2.92Å
259	S	80.4	Confident	78.5	Confident	53 Å²	53	95.9 Å²	95.9	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-61.8	-38.1	177.3	-178.8	0	0	0	0	112.8	C255 Q256 E262 K263	C255-S259 PolarHBondContact O-N 2.95Å; Q256-S259 PolarHBondContact O-N 3.35Å; S259-E262 PolarHBondContact O-N 3.29Å; S259-K263 WeakPolarHBondContact O-CG 2.96Å; S259-K263 PolarHBondContact O-N 3.23Å; S259-K263 VanDerWaalsContact O-N 3.13Å
260	S	79	Confident	78	Confident	64 Å²	64	96 Å²	96	45%	0.448	47%	0.473	S	S	.	.	H	α-helix	trans	-63.2	-44.5	174.3	-167.7	0	0	0	0	111.8	Q256 R257 K258 K263 D264	Q256-S260 PolarHBondContact O-N 3Å; R257-S260 PolarHBondContact O-N 3.19Å; K258-S260 VanDerWaalsContact C-N 3.32Å; K258-S260 PolarHBondContact O-N 3.11Å; S260-K263 PolarHBondContact O-N 3.13Å; S260-D264 PolarHBondContact O-N 2.67Å
261	V	78.2	Confident	77.1	Confident	65 Å²	65	94.2 Å²	94.2	39%	0.394	47%	0.474	S	S	.	.	H	α-helix	trans	-66.6	-38.7	178.8	171.7	0	0	0	0	111.4	R257 K258 K263 D264 I265	R257-V261 WeakPolarHBondContact O-CG2 3.47Å; R257-V261 PolarHBondContact O-N 3.35Å; K258-V261 PolarHBondContact O-N 3.06Å; K258-V261 VanDerWaalsContact O-N 3.17Å; V261-K263 VanDerWaalsContact C-N 3.34Å; V261-K263 PolarHBondContact O-N 2.88Å; V261-D264 PolarHBondContact O-N 3.32Å; V261-I265 HydrophobicContact CG1-CD1 3.93Å; V261-I265 HydrophobicContact CG1-CG1 4.36Å; V261-I265 VanDerWaalsContact O-CG1 3.3Å; V261-I265 WeakPolarHBondContact O-CG1 3.41Å; V261-I265 PolarHBondContact O-N 2.98Å
262	E	82.1	Confident	76.3	Confident	98 Å²	98	98.8 Å²	98.8	46%	0.458	49%	0.494	S	S	.	.	H	α-helix	trans	-60.7	-42.6	175	-75	170	168.6	0	0	111.6	K258 S259 D264 I265 E266	K258-E262 WeakPolarHBondContact CE-OE1 3.43Å; K258-E262 WeakPolarHBondContact O-CG 3.24Å; K258-E262 PolarHBondContact O-N 2.92Å; S259-E262 PolarHBondContact O-N 3.29Å; E262-D264 VanDerWaalsContact C-N 3.33Å; E262-D264 PolarHBondContact O-N 3.32Å; E262-I265 PolarHBondContact O-N 2.85Å; E262-E266 PolarHBondContact O-N 3.29Å
263	K	79.2	Confident	75.2	Confident	126 Å²	126	102.4 Å²	102.4	55%	0.548	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-37.2	173.6	-72.2	178.9	-177.7	180	0	112.9	S259 S260 V261 E266 K267	S259-K263 WeakPolarHBondContact O-CG 2.96Å; S259-K263 PolarHBondContact O-N 3.23Å; S259-K263 VanDerWaalsContact O-N 3.13Å; S260-K263 PolarHBondContact O-N 3.13Å; V261-K263 VanDerWaalsContact C-N 3.34Å; V261-K263 PolarHBondContact O-N 2.88Å; K263-E266 PolarHBondContact O-N 3.48Å; K263-K267 WeakPolarHBondContact O-CG 3.2Å; K263-K267 PolarHBondContact O-N 3.47Å; K263-K267 VanDerWaalsContact O-N 3.15Å
264	D	77.2	Confident	74.1	Confident	69 Å²	69	101.1 Å²	101.1	37%	0.369	50%	0.504	S	S	.	.	H	α-helix	trans	-71.9	-34.3	177.6	-67.5	-25.9	0	0	0	111.5	S260 V261 E262 K267 I268	S260-D264 PolarHBondContact O-N 2.67Å; V261-D264 PolarHBondContact O-N 3.32Å; E262-D264 VanDerWaalsContact C-N 3.33Å; E262-D264 PolarHBondContact O-N 3.32Å; D264-K267 PolarHBondContact O-N 2.97Å; D264-K267 IonicContact OD1-NZ 3.8Å; D264-K267 PolarHBondContact OD1-NZ 3.45Å; D264-I268 VanDerWaalsContact O-CG1 3.28Å; D264-I268 WeakPolarHBondContact O-CG1 3.18Å; D264-I268 PolarHBondContact O-N 2.87Å
265	I	75.8	Confident	73.1	Confident	72 Å²	72	101.6 Å²	101.6	37%	0.369	51%	0.511	S	S	.	.	H	α-helix	trans	-63.1	-43.9	171.2	-69.8	167.9	0	0	0	110.7	V261 E262 K267 I268 Q269	V261-I265 HydrophobicContact CG1-CD1 3.93Å; V261-I265 HydrophobicContact CG1-CG1 4.36Å; V261-I265 VanDerWaalsContact O-CG1 3.3Å; V261-I265 WeakPolarHBondContact O-CG1 3.41Å; V261-I265 PolarHBondContact O-N 2.98Å; E262-I265 PolarHBondContact O-N 2.85Å; I265-K267 VanDerWaalsContact C-N 3.33Å; I265-K267 PolarHBondContact O-N 3.47Å; I265-I268 PolarHBondContact O-N 2.83Å; I265-Q269 HydrophobicContact CG2-CG 4.39Å; I265-Q269 WeakPolarHBondContact O-CG 3.3Å; I265-Q269 PolarHBondContact O-N 3.42Å
266	E	75.8	Confident	72.3	Confident	127 Å²	127	102.7 Å²	102.7	59%	0.593	51%	0.512	S	S	*	.	H	α-helix	trans	-59.5	-42	175.5	-80.6	-176.1	164.5	0	0	112.3	E262 K263 Q269 Q270	E262-E266 PolarHBondContact O-N 3.29Å; K263-E266 PolarHBondContact O-N 3.48Å; E266-Q269 PolarHBondContact O-N 3Å; E266-Q270 PolarHBondContact O-N 2.88Å
267	K	75.1	Confident	71.7	Confident	129 Å²	129	100.7 Å²	100.7	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-62.9	-41.6	175.3	-70.9	172.7	-172.4	165.5	0	112.1	K263 D264 I265 Q270 S271	K263-K267 WeakPolarHBondContact O-CG 3.2Å; K263-K267 PolarHBondContact O-N 3.47Å; K263-K267 VanDerWaalsContact O-N 3.15Å; D264-K267 PolarHBondContact O-N 2.97Å; D264-K267 IonicContact OD1-NZ 3.8Å; D264-K267 PolarHBondContact OD1-NZ 3.45Å; I265-K267 VanDerWaalsContact C-N 3.33Å; I265-K267 PolarHBondContact O-N 3.47Å; K267-Q270 PolarHBondContact O-N 3.43Å; K267-S271 PolarHBondContact O-N 3.47Å; K267-S271 PolarHBondContact O-OG 3.41Å
268	I	70.3	Confident	71.1	Confident	99 Å²	99	97.8 Å²	97.8	51%	0.508	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-41.4	177.3	-67.8	165.6	0	0	0	110.4	D264 I265 Q270 S271 Q272	D264-I268 VanDerWaalsContact O-CG1 3.28Å; D264-I268 WeakPolarHBondContact O-CG1 3.18Å; D264-I268 PolarHBondContact O-N 2.87Å; I265-I268 PolarHBondContact O-N 2.83Å; I268-Q270 VanDerWaalsContact C-N 3.34Å; I268-Q270 PolarHBondContact O-N 2.67Å; I268-S271 WeakPolarHBondContact CA-OG 3.49Å; I268-S271 PolarHBondContact O-N 3.18Å; I268-S271 VanDerWaalsContact O-N 3.14Å; I268-S271 PolarHBondContact O-OG 3.05Å; I268-Q272 PolarHBondContact O-N 3.43Å
269	Q	71.8	Confident	70.4	Confident	112 Å²	112	97.1 Å²	97.1	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-64.3	-36.4	175.3	-74.2	180	-11.6	0	0	112.6	I265 E266 S271 Q272 K273	I265-Q269 HydrophobicContact CG2-CG 4.39Å; I265-Q269 WeakPolarHBondContact O-CG 3.3Å; I265-Q269 PolarHBondContact O-N 3.42Å; E266-Q269 PolarHBondContact O-N 3Å; Q269-S271 VanDerWaalsContact C-N 3.34Å; Q269-Q272 PolarHBondContact O-N 3.14Å; Q269-K273 PolarHBondContact O-N 3.38Å
270	Q	69.5	Low	70	Confident	141 Å²	141	101 Å²	101	66%	0.659	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-41.5	170.9	-79.2	-179.8	-7.4	0	0	111.7	E266 K267 I268 Q272 K273	E266-Q270 PolarHBondContact O-N 2.88Å; K267-Q270 PolarHBondContact O-N 3.43Å; I268-Q270 VanDerWaalsContact C-N 3.34Å; I268-Q270 PolarHBondContact O-N 2.67Å; Q270-Q272 VanDerWaalsContact C-N 3.33Å; Q270-Q272 PolarHBondContact O-N 2.88Å; Q270-K273 PolarHBondContact O-N 2.89Å
271	S	64.1	Low	69.6	Low	68 Å²	68	104.2 Å²	104.2	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-69.2	-27.1	175.5	61.3	0	0	0	0	114	K267 I268 Q269 S274	K267-S271 PolarHBondContact O-N 3.47Å; K267-S271 PolarHBondContact O-OG 3.41Å; I268-S271 WeakPolarHBondContact CA-OG 3.49Å; I268-S271 PolarHBondContact O-N 3.18Å; I268-S271 VanDerWaalsContact O-N 3.14Å; I268-S271 PolarHBondContact O-OG 3.05Å; Q269-S271 VanDerWaalsContact C-N 3.34Å; S271-S274 WeakPolarHBondContact CA-OG 3.38Å; S271-S274 PolarHBondContact O-N 3.19Å; S271-S274 PolarHBondContact O-OG 3.07Å
272	Q	63.2	Low	69.3	Low	126 Å²	126	105.6 Å²	105.6	59%	0.589	52%	0.523	S	S	*	.	H	α-helix	trans	-67.6	-37.2	171.9	-96.8	-173.6	-26.2	0	0	112.5	I268 Q269 Q270 S274 S275 D276	I268-Q272 PolarHBondContact O-N 3.43Å; Q269-Q272 PolarHBondContact O-N 3.14Å; Q270-Q272 VanDerWaalsContact C-N 3.33Å; Q270-Q272 PolarHBondContact O-N 2.88Å; Q272-S274 VanDerWaalsContact C-N 3.25Å; Q272-S274 PolarHBondContact O-N 3.18Å; Q272-S275 WeakPolarHBondContact O-CA 3.46Å; Q272-S275 WeakPolarHBondContact O-CB 3.36Å; Q272-S275 PolarHBondContact O-N 3.32Å; Q272-D276 PolarHBondContact O-N 3.08Å
273	K	59.1	Low	68.8	Low	158 Å²	158	109 Å²	109	69%	0.687	53%	0.532	S	S	*	.	H	α-helix	trans	-60.7	-33.6	176.3	-76.1	-176.1	175.6	-180	0	113.1	Q269 Q270 S275 D276	Q269-K273 PolarHBondContact O-N 3.38Å; Q270-K273 PolarHBondContact O-N 2.89Å; K273-S275 PolarHBondContact O-N 3.39Å; K273-D276 PolarHBondContact O-N 3.43Å
274	S	59	Low	68.7	Low	62 Å²	62	106.8 Å²	106.8	43%	0.434	53%	0.529	S	S	.	.	H	α-helix	trans	-68.1	-22.8	172.1	24.1	0	0	0	0	113.4	S271 Q272 D277 L278	S271-S274 WeakPolarHBondContact CA-OG 3.38Å; S271-S274 PolarHBondContact O-N 3.19Å; S271-S274 PolarHBondContact O-OG 3.07Å; Q272-S274 VanDerWaalsContact C-N 3.25Å; Q272-S274 PolarHBondContact O-N 3.18Å; S274-D277 PolarHBondContact O-N 3.32Å; S274-L278 WeakPolarHBondContact O-CD1 3.47Å; S274-L278 PolarHBondContact O-N 2.99Å
275	S	59.8	Low	68.5	Low	63 Å²	63	107.4 Å²	107.4	44%	0.441	54%	0.535	S	S	.	.	H	α-helix	trans	-72.2	-32.7	176.3	-155.2	0	0	0	0	112.1	Q272 K273 D277 L278 E279	Q272-S275 WeakPolarHBondContact O-CA 3.46Å; Q272-S275 WeakPolarHBondContact O-CB 3.36Å; Q272-S275 PolarHBondContact O-N 3.32Å; K273-S275 PolarHBondContact O-N 3.39Å; S275-D277 VanDerWaalsContact C-N 3.26Å; S275-D277 PolarHBondContact O-N 2.99Å; S275-L278 PolarHBondContact O-N 2.84Å; S275-E279 PolarHBondContact O-N 3.2Å; S275-E279 VanDerWaalsContact O-N 3.09Å
276	D	61.4	Low	68.4	Low	97 Å²	97	109.3 Å²	109.3	52%	0.519	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-29.7	175.8	-71.1	-13.5	0	0	0	112.2	Q272 K273 K280	Q272-D276 PolarHBondContact O-N 3.08Å; K273-D276 PolarHBondContact O-N 3.43Å; D276-K280 PolarHBondContact O-N 2.98Å
277	D	66.6	Low	68.4	Low	99 Å²	99	107.9 Å²	107.9	53%	0.529	54%	0.539	S	S	.	.	H	α-helix	trans	-72.9	-38	175	-74.4	-28.1	0	0	0	111.6	S274 S275 E279 K280 E281	S274-D277 PolarHBondContact O-N 3.32Å; S275-D277 VanDerWaalsContact C-N 3.26Å; S275-D277 PolarHBondContact O-N 2.99Å; D277-E279 PolarHBondContact O-N 2.85Å; D277-K280 PolarHBondContact O-N 2.81Å; D277-K280 IonicContact OD1-NZ 2.88Å; D277-E281 PolarHBondContact O-N 3.39Å
278	L	64	Low	68.6	Low	102 Å²	102	106.9 Å²	106.9	53%	0.534	54%	0.536	S	S	.	.	H	α-helix	trans	-64.4	-36.6	173	-92.3	117	0	0	0	112.6	S274 S275 K280 E281 I282	S274-L278 WeakPolarHBondContact O-CD1 3.47Å; S274-L278 PolarHBondContact O-N 2.99Å; S275-L278 PolarHBondContact O-N 2.84Å; L278-K280 VanDerWaalsContact C-N 3.27Å; L278-K280 PolarHBondContact O-N 2.87Å; L278-E281 PolarHBondContact O-N 2.88Å; L278-I282 WeakPolarHBondContact O-CG1 3.36Å; L278-I282 PolarHBondContact O-N 3.09Å
279	E	67.4	Low	68.7	Low	109 Å²	109	105.6 Å²	105.6	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-63.4	-32	175.2	-77.6	-168.3	174	0	0	112.7	S275 D277 R283	S275-E279 PolarHBondContact O-N 3.2Å; S275-E279 VanDerWaalsContact O-N 3.09Å; D277-E279 PolarHBondContact O-N 2.85Å; E279-R283 WeakPolarHBondContact O-CG 3.4Å; E279-R283 PolarHBondContact O-N 3.11Å
280	K	70.9	Confident	68.8	Low	134 Å²	134	106.3 Å²	106.3	58%	0.583	53%	0.534	S	S	*	.	H	α-helix	trans	-70.5	-38.6	173.9	-71	175.3	-171.3	158.3	0	112.2	D276 D277 L278 R283 T284	D276-K280 PolarHBondContact O-N 2.98Å; D277-K280 PolarHBondContact O-N 2.81Å; D277-K280 IonicContact OD1-NZ 2.88Å; L278-K280 VanDerWaalsContact C-N 3.27Å; L278-K280 PolarHBondContact O-N 2.87Å; K280-R283 PolarHBondContact O-N 3.12Å; K280-T284 PolarHBondContact O-N 3.36Å; K280-T284 VanDerWaalsContact O-N 3.13Å; K280-T284 PolarHBondContact O-OG1 3.48Å
281	E	71.1	Confident	69.2	Low	132 Å²	132	104.9 Å²	104.9	62%	0.617	53%	0.531	S	S	*	.	H	α-helix	trans	-63.9	-43.8	175.4	-77	-176.3	161.7	0	0	111.4	D277 L278 R283 T284 V285	D277-E281 PolarHBondContact O-N 3.39Å; L278-E281 PolarHBondContact O-N 2.88Å; E281-R283 PolarHBondContact O-N 3.21Å; E281-T284 WeakPolarHBondContact O-CB 3.43Å; E281-T284 PolarHBondContact O-N 3.42Å; E281-V285 WeakPolarHBondContact O-CG2 3.3Å; E281-V285 PolarHBondContact O-N 3.21Å
282	I	71.2	Confident	69.5	Low	94 Å²	94	107.9 Å²	107.9	48%	0.482	54%	0.535	S	S	.	.	H	α-helix	trans	-58.2	-48.1	176.8	-68.3	169.5	0	0	0	111	L278 T284 V285 E286	L278-I282 WeakPolarHBondContact O-CG1 3.36Å; L278-I282 PolarHBondContact O-N 3.09Å; I282-T284 PolarHBondContact O-N 3.01Å; I282-V285 PolarHBondContact O-N 2.91Å; I282-V285 VanDerWaalsContact O-N 3.16Å; I282-E286 HydrophobicContact CG2-CG 4.34Å; I282-E286 WeakPolarHBondContact O-CG 3.47Å; I282-E286 PolarHBondContact O-N 3.4Å
283	R	72.6	Confident	69.8	Low	169 Å²	169	107.7 Å²	107.7	64%	0.638	54%	0.535	S	S	*	.	H	α-helix	trans	-60.6	-31.7	176.7	-73.2	-178.3	-175.1	-157.9	3.8	113	E279 K280 E281 N287	E279-R283 WeakPolarHBondContact O-CG 3.4Å; E279-R283 PolarHBondContact O-N 3.11Å; K280-R283 PolarHBondContact O-N 3.12Å; E281-R283 PolarHBondContact O-N 3.21Å; R283-N287 PolarHBondContact O-N 2.74Å; R283-N287 PolarHBondContact O-ND2 2.82Å; R283-N287 VanDerWaalsContact O-ND2 3.15Å
284	T	76.7	Confident	70.4	Confident	81 Å²	81	107.1 Å²	107.1	50%	0.497	53%	0.532	S	S	.	.	H	α-helix	trans	-69.6	-43.5	177.7	-53	0	0	0	0	110.6	K280 E281 I282 N287 Q288	K280-T284 PolarHBondContact O-N 3.36Å; K280-T284 VanDerWaalsContact O-N 3.13Å; K280-T284 PolarHBondContact O-OG1 3.48Å; E281-T284 WeakPolarHBondContact O-CB 3.43Å; E281-T284 PolarHBondContact O-N 3.42Å; I282-T284 PolarHBondContact O-N 3.01Å; T284-N287 PolarHBondContact O-N 3.4Å; T284-Q288 PolarHBondContact O-N 3.06Å
285	V	72.7	Confident	70.9	Confident	82 Å²	82	108.7 Å²	108.7	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-67.1	-42.9	176.8	176.2	0	0	0	0	111.4	E281 I282 N287 Q288 V289	E281-V285 WeakPolarHBondContact O-CG2 3.3Å; E281-V285 PolarHBondContact O-N 3.21Å; I282-V285 PolarHBondContact O-N 2.91Å; I282-V285 VanDerWaalsContact O-N 3.16Å; V285-N287 VanDerWaalsContact C-N 3.26Å; V285-N287 PolarHBondContact O-N 2.87Å; V285-Q288 WeakPolarHBondContact O-CB 3.29Å; V285-Q288 PolarHBondContact O-N 3.28Å; V285-Q288 VanDerWaalsContact O-N 3.07Å; V285-V289 HydrophobicContact CG1-CG2 4.49Å; V285-V289 WeakPolarHBondContact O-CG2 3.12Å; V285-V289 PolarHBondContact O-N 3.41Å
286	E	73.8	Confident	71.1	Confident	111 Å²	111	111.8 Å²	111.8	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-58.7	-37.2	176.3	-74.5	-178.8	160.1	0	0	112.6	I282 V289 K290	I282-E286 HydrophobicContact CG2-CG 4.34Å; I282-E286 WeakPolarHBondContact O-CG 3.47Å; I282-E286 PolarHBondContact O-N 3.4Å; E286-V289 PolarHBondContact O-N 3.09Å; E286-K290 PolarHBondContact O-N 3.42Å; E286-K290 VanDerWaalsContact O-N 3.11Å
287	N	76.1	Confident	71.4	Confident	98 Å²	98	113.7 Å²	113.7	52%	0.524	55%	0.546	S	S	.	.	H	α-helix	trans	-69.5	-35.7	175.7	-75.8	-30.1	0	0	0	112.6	R283 T284 V285 L291	R283-N287 PolarHBondContact O-N 2.74Å; R283-N287 PolarHBondContact O-ND2 2.82Å; R283-N287 VanDerWaalsContact O-ND2 3.15Å; T284-N287 PolarHBondContact O-N 3.4Å; V285-N287 VanDerWaalsContact C-N 3.26Å; V285-N287 PolarHBondContact O-N 2.87Å; N287-L291 PolarHBondContact O-N 3.07Å; N287-L291 VanDerWaalsContact O-N 3.08Å
288	Q	79.3	Confident	71.2	Confident	107 Å²	107	116 Å²	116	50%	0.5	55%	0.551	S	S	.	*	H	α-helix	trans	-66.4	-42.8	174.2	-72.5	179.1	-12.3	0	0	111.4	T284 V285 K290 L291 F292	T284-Q288 PolarHBondContact O-N 3.06Å; V285-Q288 WeakPolarHBondContact O-CB 3.29Å; V285-Q288 PolarHBondContact O-N 3.28Å; V285-Q288 VanDerWaalsContact O-N 3.07Å; Q288-K290 PolarHBondContact O-N 3.48Å; Q288-L291 WeakPolarHBondContact O-CB 3.24Å; Q288-L291 PolarHBondContact O-N 3.03Å; Q288-L291 VanDerWaalsContact O-N 3.16Å; Q288-F292 HydrophobicContact CB-CE2 4.36Å; Q288-F292 WeakPolarHBondContact O-CD2 3.49Å; Q288-F292 PolarHBondContact O-N 3.19Å
289	V	72.7	Confident	71.1	Confident	73 Å²	73	117.7 Å²	117.7	44%	0.442	55%	0.554	S	S	.	*	H	α-helix	trans	-59.1	-46.2	176.1	174.4	0	0	0	0	110.7	V285 E286 L291 F292 E293	V285-V289 HydrophobicContact CG1-CG2 4.49Å; V285-V289 WeakPolarHBondContact O-CG2 3.12Å; V285-V289 PolarHBondContact O-N 3.41Å; E286-V289 PolarHBondContact O-N 3.09Å; V289-L291 VanDerWaalsContact C-N 3.31Å; V289-L291 PolarHBondContact O-N 3.41Å; V289-F292 PolarHBondContact O-N 3.21Å; V289-E293 WeakPolarHBondContact O-CG 3.48Å; V289-E293 PolarHBondContact O-N 2.97Å
290	K	74.3	Confident	70.8	Confident	126 Å²	126	117 Å²	117	55%	0.548	55%	0.553	S	S	.	*	H	α-helix	trans	-63.1	-33.2	175.8	-78.1	-179.6	179.5	171.4	0	114	E286 Q288 K294	E286-K290 PolarHBondContact O-N 3.42Å; E286-K290 VanDerWaalsContact O-N 3.11Å; Q288-K290 PolarHBondContact O-N 3.48Å; K290-K294 PolarHBondContact O-N 2.86Å
291	L	76.3	Confident	70.2	Confident	112 Å²	112	115.2 Å²	115.2	59%	0.586	55%	0.554	S	S	*	*	H	α-helix	trans	-65.7	-45.5	174.4	-106.6	148.2	0	0	0	110.7	N287 Q288 V289 K294 E295	N287-L291 PolarHBondContact O-N 3.07Å; N287-L291 VanDerWaalsContact O-N 3.08Å; Q288-L291 WeakPolarHBondContact O-CB 3.24Å; Q288-L291 PolarHBondContact O-N 3.03Å; Q288-L291 VanDerWaalsContact O-N 3.16Å; V289-L291 VanDerWaalsContact C-N 3.31Å; V289-L291 PolarHBondContact O-N 3.41Å; L291-K294 PolarHBondContact O-N 3.38Å; L291-E295 PolarHBondContact O-N 2.9Å; L291-E295 VanDerWaalsContact O-N 3.13Å
292	F	71.7	Confident	69.5	Low	130 Å²	130	114.8 Å²	114.8	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-68.8	-34.7	177.7	-70.3	-53.8	0	0	0	113.2	Q288 V289 K294 E295 H296	Q288-F292 HydrophobicContact CB-CE2 4.36Å; Q288-F292 WeakPolarHBondContact O-CD2 3.49Å; Q288-F292 PolarHBondContact O-N 3.19Å; V289-F292 PolarHBondContact O-N 3.21Å; F292-K294 VanDerWaalsContact C-N 3.29Å; F292-K294 PolarHBondContact O-N 3.49Å; F292-E295 WeakPolarHBondContact CD1-OE2 3.46Å; F292-E295 PolarHBondContact O-N 2.89Å; F292-H296 WeakPolarHBondContact O-CB 3.48Å; F292-H296 PolarHBondContact O-N 3.25Å
293	E	68.8	Low	68.8	Low	122 Å²	122	116.1 Å²	116.1	57%	0.57	56%	0.556	S	S	*	*	H	α-helix	trans	-60.2	-38.9	172.5	-76.3	176.6	162.4	0	0	111.8	V289 H296 E297	V289-E293 WeakPolarHBondContact O-CG 3.48Å; V289-E293 PolarHBondContact O-N 2.97Å; E293-H296 WeakPolarHBondContact O-CB 3.25Å; E293-H296 PolarHBondContact O-N 3.41Å; E293-E297 PolarHBondContact O-N 3.01Å
294	K	71.7	Confident	67.9	Low	146 Å²	146	112 Å²	112	64%	0.635	55%	0.554	S	S	*	*	H	α-helix	trans	-70.2	-35.8	175.3	-75.2	-177.6	177.1	-178.8	0	113.3	K290 L291 F292 H296 K298	K290-K294 PolarHBondContact O-N 2.86Å; L291-K294 PolarHBondContact O-N 3.38Å; F292-K294 VanDerWaalsContact C-N 3.29Å; F292-K294 PolarHBondContact O-N 3.49Å; K294-H296 VanDerWaalsContact C-N 3.32Å; K294-K298 PolarHBondContact O-N 3.5Å
295	E	69.8	Low	66.8	Low	95 Å²	95	112.1 Å²	112.1	44%	0.444	56%	0.557	S	S	.	*	H	α-helix	trans	-66.2	-38.8	172.4	-72.3	-174.1	159.8	0	0	110.9	L291 F292 E297 K298 F299	L291-E295 PolarHBondContact O-N 2.9Å; L291-E295 VanDerWaalsContact O-N 3.13Å; F292-E295 WeakPolarHBondContact CD1-OE2 3.46Å; F292-E295 PolarHBondContact O-N 2.89Å; E295-E297 PolarHBondContact O-N 3.26Å; E295-K298 WeakPolarHBondContact O-CB 3.29Å; E295-K298 PolarHBondContact O-N 3.45Å; E295-F299 WeakPolarHBondContact O-CD2 3.37Å; E295-F299 PolarHBondContact O-N 3.39Å
296	H	64.6	Low	65.7	Low	128 Å²	128	112.9 Å²	112.9	59%	0.593	56%	0.558	S	S	*	*	H	α-helix	trans	-61.7	-43.8	176.6	-169.7	62.7	0	0	0	112.3	F292 E293 K294 K298 F299 L300	F292-H296 WeakPolarHBondContact O-CB 3.48Å; F292-H296 PolarHBondContact O-N 3.25Å; E293-H296 WeakPolarHBondContact O-CB 3.25Å; E293-H296 PolarHBondContact O-N 3.41Å; K294-H296 VanDerWaalsContact C-N 3.32Å; H296-K298 VanDerWaalsContact C-N 3.31Å; H296-K298 PolarHBondContact O-N 2.97Å; H296-F299 PolarHBondContact O-N 3.32Å; H296-L300 PolarHBondContact O-N 2.87Å
297	E	66.4	Low	64.5	Low	137 Å²	137	111.5 Å²	111.5	64%	0.64	56%	0.558	S	S	*	*	H	α-helix	trans	-60.1	-40.3	175.3	-117.2	-166	163.5	0	0	112.3	E293 E295 L300 T301	E293-E297 PolarHBondContact O-N 3.01Å; E295-E297 PolarHBondContact O-N 3.26Å; E297-L300 WeakPolarHBondContact O-CB 3.39Å; E297-L300 PolarHBondContact O-N 2.95Å; E297-T301 PolarHBondContact O-N 2.92Å
298	K	64.1	Low	63.3	Low	149 Å²	149	115.2 Å²	115.2	65%	0.648	57%	0.572	S	S	*	*	H	α-helix	trans	-63.3	-46.2	176.4	-72.9	179.9	178.7	-178.1	0	111.8	K294 E295 H296 L300 T301 E302	K294-K298 PolarHBondContact O-N 3.5Å; E295-K298 WeakPolarHBondContact O-CB 3.29Å; E295-K298 PolarHBondContact O-N 3.45Å; H296-K298 VanDerWaalsContact C-N 3.31Å; H296-K298 PolarHBondContact O-N 2.97Å; K298-L300 VanDerWaalsContact C-N 3.26Å; K298-L300 PolarHBondContact O-N 3.25Å; K298-T301 PolarHBondContact O-N 3.03Å; K298-T301 VanDerWaalsContact O-N 3.16Å; K298-T301 PolarHBondContact O-OG1 3.37Å; K298-E302 PolarHBondContact O-N 3.44Å
299	F	61.1	Low	61.9	Low	136 Å²	136	117.9 Å²	117.9	60%	0.596	58%	0.582	S	S	*	*	H	α-helix	trans	-62.9	-33.7	176.9	-77.2	-62.5	0	0	0	112.7	E295 H296 T301 E302 Q303	E295-F299 WeakPolarHBondContact O-CD2 3.37Å; E295-F299 PolarHBondContact O-N 3.39Å; H296-F299 PolarHBondContact O-N 3.32Å; F299-T301 VanDerWaalsContact C-N 3.31Å; F299-T301 PolarHBondContact O-N 2.97Å; F299-E302 PolarHBondContact O-N 3.08Å; F299-Q303 PolarHBondContact O-N 2.83Å; F299-Q303 VanDerWaalsContact O-N 3.17Å
300	L	60.8	Low	60.5	Low	94 Å²	94	118.1 Å²	118.1	49%	0.492	58%	0.579	S	S	.	*	H	α-helix	trans	-65.3	-35.4	176.4	-155.9	73.9	0	0	0	111.9	H296 E297 K298	H296-L300 PolarHBondContact O-N 2.87Å; E297-L300 WeakPolarHBondContact O-CB 3.39Å; E297-L300 PolarHBondContact O-N 2.95Å; K298-L300 VanDerWaalsContact C-N 3.26Å; K298-L300 PolarHBondContact O-N 3.25Å
301	T	58.6	Low	59.1	Low	98 Å²	98	119.3 Å²	119.3	60%	0.601	59%	0.586	S	S	*	*	H	α-helix	trans	-74.8	-29	176.8	56.1	0	0	0	0	114.3	E297 K298 F299 S304	E297-T301 PolarHBondContact O-N 2.92Å; K298-T301 PolarHBondContact O-N 3.03Å; K298-T301 VanDerWaalsContact O-N 3.16Å; K298-T301 PolarHBondContact O-OG1 3.37Å; F299-T301 VanDerWaalsContact C-N 3.31Å; F299-T301 PolarHBondContact O-N 2.97Å; T301-S304 PolarHBondContact O-OG 2.97Å
302	E	56.1	Low	57.7	Low	122 Å²	122	125.5 Å²	125.5	57%	0.57	60%	0.602	S	S	*	*	H	α-helix	trans	-72.7	-34.6	172.8	-77	-175.5	160.6	0	0	111.8	K298 F299 S304 S305	K298-E302 PolarHBondContact O-N 3.44Å; F299-E302 PolarHBondContact O-N 3.08Å; E302-S304 VanDerWaalsContact C-N 3.3Å; E302-S304 PolarHBondContact O-N 3.41Å; E302-S305 PolarHBondContact O-N 3.24Å; E302-S305 PolarHBondContact O-OG 3.32Å
303	Q	55.8	Low	56.7	Low	122 Å²	122	123.7 Å²	123.7	57%	0.57	60%	0.598	S	S	*	*	H	α-helix	trans	-62.3	-34.6	-177.6	-166.4	174.9	26.7	0	0	113	F299 S305 L306 T307	F299-Q303 PolarHBondContact O-N 2.83Å; F299-Q303 VanDerWaalsContact O-N 3.17Å; Q303-S305 VanDerWaalsContact C-N 3.25Å; Q303-S305 PolarHBondContact O-N 3.48Å; Q303-L306 PolarHBondContact O-N 3.01Å; Q303-T307 PolarHBondContact O-N 3.35Å
304	S	53.9	Low	55.8	Low	84 Å²	84	123 Å²	123	59%	0.587	60%	0.595	S	S	*	*	H	α-helix	trans	-71.6	-15.2	179.9	58.7	0	0	0	0	114.3	T301 E302 T307	T301-S304 PolarHBondContact O-OG 2.97Å; E302-S304 VanDerWaalsContact C-N 3.3Å; E302-S304 PolarHBondContact O-N 3.41Å; S304-T307 PolarHBondContact O-OG1 2.91Å
305	S	54.3	Low	54.7	Low	82 Å²	82	123.1 Å²	123.1	57%	0.573	60%	0.602	S	S	*	*	H	α-helix	trans	-87.1	-20.9	173.8	73.1	0	0	0	0	113.1	E302 Q303	E302-S305 PolarHBondContact O-N 3.24Å; E302-S305 PolarHBondContact O-OG 3.32Å; Q303-S305 VanDerWaalsContact C-N 3.25Å; Q303-S305 PolarHBondContact O-N 3.48Å
306	L	50	Low	53.7	Low	99 Å²	99	125.6 Å²	125.6	52%	0.518	61%	0.614	S	S	.	*	H	α-helix	trans	-89.4	-19.2	-178	-83.8	153.2	0	0	0	112.8	Q303 E308 K309 M310	Q303-L306 PolarHBondContact O-N 3.01Å; L306-E308 VanDerWaalsContact C-N 3.28Å; L306-E308 PolarHBondContact O-N 3.35Å; L306-K309 PolarHBondContact O-N 3.28Å; L306-M310 WeakPolarHBondContact O-CG 3.37Å; L306-M310 PolarHBondContact O-N 3.5Å
307	T	48.3	Very low	52.8	Low	82 Å²	82	122.4 Å²	122.4	50%	0.503	60%	0.601	S	S	.	*	H	α-helix	trans	-60.7	-29.7	179.9	38	0	0	0	0	113.8	Q303 S304 M310	Q303-T307 PolarHBondContact O-N 3.35Å; S304-T307 PolarHBondContact O-OG1 2.91Å; T307-M310 PolarHBondContact O-N 3.19Å
308	E	50.6	Low	52	Low	175 Å²	175	119.4 Å²	119.4	82%	0.818	60%	0.595	S	S	*	*	H	α-helix	trans	-70	-31.2	176.3	-96.4	-174.2	168.3	0	0	113.7	L306 M310	L306-E308 VanDerWaalsContact C-N 3.28Å; L306-E308 PolarHBondContact O-N 3.35Å; E308-M310 VanDerWaalsContact C-N 3.29Å
309	K	49.4	Very low	51.6	Low	164 Å²	164	120 Å²	120	71%	0.713	60%	0.6	S	S	*	*	H	α-helix	trans	-80.9	-15.7	177.7	-68.2	-178.2	-175.7	173.7	0	112.3	L306	L306-K309 PolarHBondContact O-N 3.28Å
310	M	43.9	Very low	51.3	Low	77 Å²	77	119.8 Å²	119.8	38%	0.379	60%	0.599	S	S	.	*	H	α-helix	trans	-79.5	-18.3	-174.2	-73.8	177.2	62.3	0	0	114	L306 T307 E308 R312 L313 Q314 L317	L306-M310 WeakPolarHBondContact O-CG 3.37Å; L306-M310 PolarHBondContact O-N 3.5Å; T307-M310 PolarHBondContact O-N 3.19Å; E308-M310 VanDerWaalsContact C-N 3.29Å; M310-R312 VanDerWaalsContact C-N 3.27Å; M310-R312 PolarHBondContact O-N 3Å; M310-L313 CarbonylContact O-C 3.5Å; M310-L313 WeakPolarHBondContact O-CA 3.24Å; M310-L313 PolarHBondContact O-N 2.77Å; M310-Q314 PolarHBondContact O-N 2.87Å; M310-L317 HydrophobicContact CE-CD1 4.47Å; M310-L317 HydrophobicContact CE-CD2 4.21Å
311	E	44.7	Very low	51.1	Low	151 Å²	151	117.8 Å²	117.8	71%	0.706	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-33.4	-179.1	-138.3	-178.9	-163.7	0	0	112.1	Q314	E311-Q314 WeakPolarHBondContact O-CB 3.06Å; E311-Q314 PolarHBondContact O-N 3Å
312	R	47.5	Very low	51.2	Low	242 Å²	242	119.3 Å²	119.3	91%	0.913	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-28.9	173.3	-72.9	-174.8	178.1	-175.4	0.1	113.3	M310 Q314	M310-R312 VanDerWaalsContact C-N 3.27Å; M310-R312 PolarHBondContact O-N 3Å; R312-Q314 VanDerWaalsContact C-N 3.35Å
313	L	49.5	Very low	51.7	Low	93 Å²	93	119.4 Å²	119.4	49%	0.487	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	-9.8	174.7	-79.8	164.9	0	0	0	112.3	M310 N315 Q316 L317	M310-L313 CarbonylContact O-C 3.5Å; M310-L313 WeakPolarHBondContact O-CA 3.24Å; M310-L313 PolarHBondContact O-N 2.77Å; L313-N315 PolarHBondContact O-N 3.09Å; L313-N315 VanDerWaalsContact O-N 3.14Å; L313-Q316 CarbonylContact O-C 3.57Å; L313-Q316 WeakPolarHBondContact O-CA 3.32Å; L313-Q316 PolarHBondContact O-N 3.02Å; L313-L317 WeakPolarHBondContact O-CB 3.48Å; L313-L317 PolarHBondContact O-N 2.75Å
314	Q	50.5	Low	52.2	Low	107 Å²	107	115.9 Å²	115.9	50%	0.5	59%	0.587	S	S	.	*	H	α-helix	trans	-58.4	-29.7	-175	-164.3	161.4	-27.3	0	0	113.5	M310 E311 R312 L317 S318	M310-Q314 PolarHBondContact O-N 2.87Å; E311-Q314 WeakPolarHBondContact O-CB 3.06Å; E311-Q314 PolarHBondContact O-N 3Å; R312-Q314 VanDerWaalsContact C-N 3.35Å; Q314-L317 WeakPolarHBondContact O-CB 3.37Å; Q314-L317 PolarHBondContact O-N 2.88Å; Q314-S318 PolarHBondContact O-N 2.83Å
315	N	48.6	Very low	52.9	Low	149 Å²	149	115 Å²	115	80%	0.797	58%	0.578	S	S	*	*	H	α-helix	trans	-75.2	-29.5	174.5	-74	-14.4	0	0	0	113.4	L313	L313-N315 PolarHBondContact O-N 3.09Å; L313-N315 VanDerWaalsContact O-N 3.14Å
316	Q	49.8	Very low	53.6	Low	147 Å²	147	112.9 Å²	112.9	69%	0.687	57%	0.569	S	S	*	*	H	α-helix	trans	-83.5	-19.6	168	-68.7	-175.7	-21.4	0	0	111.6	L313	L313-Q316 CarbonylContact O-C 3.57Å; L313-Q316 WeakPolarHBondContact O-CA 3.32Å; L313-Q316 PolarHBondContact O-N 3.02Å
317	L	45.1	Very low	54.6	Low	61 Å²	61	115.4 Å²	115.4	32%	0.319	57%	0.572	S	S	.	*	H	α-helix	trans	-72.1	-38.4	-177.9	-157.2	81.3	0	0	0	111.3	M310 L313 Q314 E319 K320 T321	M310-L317 HydrophobicContact CE-CD1 4.47Å; M310-L317 HydrophobicContact CE-CD2 4.21Å; L313-L317 WeakPolarHBondContact O-CB 3.48Å; L313-L317 PolarHBondContact O-N 2.75Å; Q314-L317 WeakPolarHBondContact O-CB 3.37Å; Q314-L317 PolarHBondContact O-N 2.88Å; L317-E319 CarbonylContact O-C 3.49Å; L317-E319 PolarHBondContact O-N 3.24Å; L317-K320 CarbonylContact O-C 3.58Å; L317-K320 VanDerWaalsContact O-CA 3.32Å; L317-K320 WeakPolarHBondContact O-CA 3.25Å; L317-K320 PolarHBondContact O-N 3.28Å; L317-T321 PolarHBondContact O-N 2.82Å; L317-T321 PolarHBondContact O-OG1 3.19Å
318	S	49.5	Very low	55.8	Low	73 Å²	73	116.1 Å²	116.1	51%	0.51	57%	0.571	S	S	.	*	H	α-helix	trans	-48.4	-37.3	-173.8	66.1	0	0	0	0	114.4	Q314 T321	Q314-S318 PolarHBondContact O-N 2.83Å; S318-T321 WeakPolarHBondContact CA-OG1 2.84Å
319	E	55.4	Low	57	Low	163 Å²	163	114 Å²	114	76%	0.762	56%	0.561	S	S	*	*	H	α-helix	trans	-72.3	-40.9	174.5	-121.7	174.1	-177.4	0	0	113	L317	L317-E319 CarbonylContact O-C 3.49Å; L317-E319 PolarHBondContact O-N 3.24Å
320	K	55.9	Low	58.3	Low	131 Å²	131	109.1 Å²	109.1	57%	0.57	55%	0.548	S	S	*	.	H	α-helix	trans	-74.5	-28.4	174.4	-78	-79.2	177	-173.1	0	113.1	L317 N322 Q323 A324	L317-K320 CarbonylContact O-C 3.58Å; L317-K320 VanDerWaalsContact O-CA 3.32Å; L317-K320 WeakPolarHBondContact O-CA 3.25Å; L317-K320 PolarHBondContact O-N 3.28Å; K320-N322 VanDerWaalsContact C-N 3.32Å; K320-N322 PolarHBondContact O-N 3.44Å; K320-Q323 WeakPolarHBondContact O-CB 3.25Å; K320-Q323 PolarHBondContact O-N 3.2Å; K320-Q323 VanDerWaalsContact O-N 3.11Å; K320-A324 PolarHBondContact O-N 3.16Å
321	T	56	Low	60.1	Low	52 Å²	52	112.1 Å²	112.1	32%	0.319	56%	0.555	S	S	.	*	H	α-helix	trans	-66.3	-37.9	178.8	-28	0	0	0	0	110.1	L317 S318 Q323 A324 V325	L317-T321 PolarHBondContact O-N 2.82Å; L317-T321 PolarHBondContact O-OG1 3.19Å; S318-T321 WeakPolarHBondContact CA-OG1 2.84Å; T321-Q323 VanDerWaalsContact C-N 3.27Å; T321-Q323 PolarHBondContact O-N 2.87Å; T321-A324 PolarHBondContact O-N 2.95Å; T321-V325 HydrophobicContact CG2-CG2 4.28Å; T321-V325 WeakPolarHBondContact O-CB 2.92Å; T321-V325 VanDerWaalsContact O-CG2 3.26Å; T321-V325 WeakPolarHBondContact O-CG2 3.09Å; T321-V325 PolarHBondContact O-N 3.36Å
322	N	61.5	Low	61.7	Low	129 Å²	129	110 Å²	110	69%	0.69	55%	0.548	S	S	*	.	H	α-helix	trans	-62.5	-35.4	173.4	-74.7	-19.5	0	0	0	111.9	K320 G326	K320-N322 VanDerWaalsContact C-N 3.32Å; K320-N322 PolarHBondContact O-N 3.44Å; N322-G326 PolarHBondContact O-N 2.91Å; N322-G326 VanDerWaalsContact O-N 3.14Å
323	Q	66.4	Low	63.2	Low	125 Å²	125	106 Å²	106	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-69.3	-44.1	172	-68.6	-179.3	-3.1	0	0	112.1	K320 T321 G326 W327	K320-Q323 WeakPolarHBondContact O-CB 3.25Å; K320-Q323 PolarHBondContact O-N 3.2Å; K320-Q323 VanDerWaalsContact O-N 3.11Å; T321-Q323 VanDerWaalsContact C-N 3.27Å; T321-Q323 PolarHBondContact O-N 2.87Å; Q323-G326 PolarHBondContact O-N 2.77Å; Q323-W327 WeakPolarHBondContact O-CB 2.95Å; Q323-W327 PolarHBondContact O-N 3.23Å
324	A	66.3	Low	64.8	Low	47 Å²	47	105.9 Å²	105.9	39%	0.388	54%	0.537	S	S	.	.	H	α-helix	trans	-67.8	-42.6	-179.1	0	0	0	0	0	112.5	K320 T321 W327 I328	K320-A324 PolarHBondContact O-N 3.16Å; T321-A324 PolarHBondContact O-N 2.95Å; A324-W327 PolarHBondContact O-N 3.45Å; A324-I328 WeakPolarHBondContact O-CB 3.46Å; A324-I328 VanDerWaalsContact O-CG1 3.25Å; A324-I328 WeakPolarHBondContact O-CG1 3.38Å; A324-I328 PolarHBondContact O-N 3.27Å
325	V	68	Low	66.1	Low	66 Å²	66	104.3 Å²	104.3	40%	0.4	54%	0.537	S	S	.	.	H	α-helix	trans	-63.8	-43.3	175.3	172.6	0	0	0	0	110.2	T321 W327 I328 Q329	T321-V325 HydrophobicContact CG2-CG2 4.28Å; T321-V325 WeakPolarHBondContact O-CB 2.92Å; T321-V325 VanDerWaalsContact O-CG2 3.26Å; T321-V325 WeakPolarHBondContact O-CG2 3.09Å; T321-V325 PolarHBondContact O-N 3.36Å; V325-W327 VanDerWaalsContact C-N 3.33Å; V325-W327 PolarHBondContact O-N 3.08Å; V325-I328 PolarHBondContact O-N 2.92Å; V325-Q329 HydrophobicContact CG1-CG 4.33Å; V325-Q329 WeakPolarHBondContact O-CB 3.48Å; V325-Q329 VanDerWaalsContact O-CG 3.3Å; V325-Q329 WeakPolarHBondContact O-CG 3.5Å; V325-Q329 PolarHBondContact O-N 3.18Å
326	G	69.4	Low	67.7	Low	37 Å²	37	101.5 Å²	101.5	38%	0.381	52%	0.522	S	S	.	.	H	α-helix	trans	-60.3	-42.6	174	0	0	0	0	0	112.5	N322 Q323 Q329 S330	N322-G326 PolarHBondContact O-N 2.91Å; N322-G326 VanDerWaalsContact O-N 3.14Å; Q323-G326 PolarHBondContact O-N 2.77Å; G326-Q329 PolarHBondContact O-N 3.01Å; G326-S330 WeakPolarHBondContact O-CB 3.41Å; G326-S330 PolarHBondContact O-N 3.25Å
327	W	70.6	Confident	69.1	Low	153 Å²	153	97 Å²	97	58%	0.58	51%	0.51	S	S	*	.	H	α-helix	trans	-66.5	-43.4	176.9	-173.5	84.2	0	0	0	112.5	Q323 A324 V325 S330 R331	Q323-W327 WeakPolarHBondContact O-CB 2.95Å; Q323-W327 PolarHBondContact O-N 3.23Å; A324-W327 PolarHBondContact O-N 3.45Å; V325-W327 VanDerWaalsContact C-N 3.33Å; V325-W327 PolarHBondContact O-N 3.08Å; W327-S330 WeakPolarHBondContact O-CB 3.13Å; W327-S330 PolarHBondContact O-N 3.34Å; W327-R331 WeakPolarHBondContact O-CB 3.47Å; W327-R331 PolarHBondContact O-N 3.47Å
328	I	73.6	Confident	71	Confident	96 Å²	96	96.5 Å²	96.5	49%	0.492	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-42.9	176.1	-68.7	166.8	0	0	0	110.7	A324 V325 S330 R331 L332	A324-I328 WeakPolarHBondContact O-CB 3.46Å; A324-I328 VanDerWaalsContact O-CG1 3.25Å; A324-I328 WeakPolarHBondContact O-CG1 3.38Å; A324-I328 PolarHBondContact O-N 3.27Å; V325-I328 PolarHBondContact O-N 2.92Å; I328-S330 VanDerWaalsContact C-N 3.31Å; I328-S330 PolarHBondContact O-N 3.38Å; I328-R331 PolarHBondContact O-N 2.98Å; I328-L332 VanDerWaalsContact O-CB 3.31Å; I328-L332 WeakPolarHBondContact O-CB 3.28Å; I328-L332 PolarHBondContact O-N 3.32Å
329	Q	76.5	Confident	72.6	Confident	130 Å²	130	99.3 Å²	99.3	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-62.5	-39.6	175.6	-77.5	179.2	-13.6	0	0	111.6	V325 G326 K333	V325-Q329 HydrophobicContact CG1-CG 4.33Å; V325-Q329 WeakPolarHBondContact O-CB 3.48Å; V325-Q329 VanDerWaalsContact O-CG 3.3Å; V325-Q329 WeakPolarHBondContact O-CG 3.5Å; V325-Q329 PolarHBondContact O-N 3.18Å; G326-Q329 PolarHBondContact O-N 3.01Å; Q329-K333 WeakPolarHBondContact O-CB 3.49Å; Q329-K333 PolarHBondContact O-N 3.44Å
330	S	76.6	Confident	73.8	Confident	62 Å²	62	98.6 Å²	98.6	43%	0.434	52%	0.516	S	S	.	.	H	α-helix	trans	-61.8	-47.9	172.4	-166.3	0	0	0	0	111.1	G326 W327 I328 L332 K333 D334	G326-S330 WeakPolarHBondContact O-CB 3.41Å; G326-S330 PolarHBondContact O-N 3.25Å; W327-S330 WeakPolarHBondContact O-CB 3.13Å; W327-S330 PolarHBondContact O-N 3.34Å; I328-S330 VanDerWaalsContact C-N 3.31Å; I328-S330 PolarHBondContact O-N 3.38Å; S330-L332 VanDerWaalsContact C-N 3.34Å; S330-L332 PolarHBondContact O-N 2.93Å; S330-K333 WeakPolarHBondContact O-CB 3.44Å; S330-K333 PolarHBondContact O-N 3.42Å; S330-K333 VanDerWaalsContact O-N 3.14Å; S330-D334 PolarHBondContact O-N 3.33Å
331	R	80.8	Confident	75.2	Confident	140 Å²	140	96.3 Å²	96.3	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-40.9	179.3	-147.1	87.2	171.7	177.3	-0.2	112.2	W327 I328 K333 D334 C335	W327-R331 WeakPolarHBondContact O-CB 3.47Å; W327-R331 PolarHBondContact O-N 3.47Å; I328-R331 PolarHBondContact O-N 2.98Å; R331-K333 VanDerWaalsContact C-N 3.32Å; R331-D334 PolarHBondContact O-N 3.47Å; R331-C335 WeakPolarHBondContact O-CB 3.38Å; R331-C335 PolarHBondContact O-N 3.47Å; R331-C335 PolarHBondContact O-SG 2.96Å
332	L	79.2	Confident	76.6	Confident	107 Å²	107	98.7 Å²	98.7	56%	0.56	52%	0.524	S	S	*	.	H	α-helix	trans	-66.3	-36.8	176.8	-164.6	112.8	0	0	0	110.9	I328 S330 N336	I328-L332 VanDerWaalsContact O-CB 3.31Å; I328-L332 WeakPolarHBondContact O-CB 3.28Å; I328-L332 PolarHBondContact O-N 3.32Å; S330-L332 VanDerWaalsContact C-N 3.34Å; S330-L332 PolarHBondContact O-N 2.93Å; L332-N336 VanDerWaalsContact O-CB 3.25Å; L332-N336 WeakPolarHBondContact O-CB 3.48Å; L332-N336 VanDerWaalsContact O-CG 3.23Å; L332-N336 PolarHBondContact O-N 3.23Å; L332-N336 PolarHBondContact O-ND2 3.08Å; L332-N336 VanDerWaalsContact O-ND2 3.08Å
333	K	79.1	Confident	77.8	Confident	157 Å²	157	96 Å²	96	68%	0.683	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-41.7	172.9	-171.1	179.5	178.4	-175.6	0	111.4	Q329 S330 R331 A337	Q329-K333 WeakPolarHBondContact O-CB 3.49Å; Q329-K333 PolarHBondContact O-N 3.44Å; S330-K333 WeakPolarHBondContact O-CB 3.44Å; S330-K333 PolarHBondContact O-N 3.42Å; S330-K333 VanDerWaalsContact O-N 3.14Å; R331-K333 VanDerWaalsContact C-N 3.32Å; K333-A337 WeakPolarHBondContact O-CB 3.5Å; K333-A337 PolarHBondContact O-N 3.37Å
334	D	82.6	Confident	78.6	Confident	92 Å²	92	92.6 Å²	92.6	49%	0.492	50%	0.501	S	S	.	.	H	α-helix	trans	-66.7	-45.6	177.1	-62.2	-25.1	0	0	0	111.6	S330 R331 A337 A338	S330-D334 PolarHBondContact O-N 3.33Å; R331-D334 PolarHBondContact O-N 3.47Å; D334-A337 WeakPolarHBondContact O-CB 3.24Å; D334-A337 PolarHBondContact O-N 3.11Å; D334-A338 PolarHBondContact O-N 3.4Å
335	C	76.7	Confident	79.6	Confident	74 Å²	74	93.8 Å²	93.8	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-63.4	-42.6	175.5	-74.8	0	0	0	0	112.1	R331 A337 A338 M339	R331-C335 WeakPolarHBondContact O-CB 3.38Å; R331-C335 PolarHBondContact O-N 3.47Å; R331-C335 PolarHBondContact O-SG 2.96Å; C335-A337 VanDerWaalsContact C-N 3.28Å; C335-A337 PolarHBondContact O-N 3.41Å; C335-A338 PolarHBondContact O-N 2.81Å; C335-M339 WeakPolarHBondContact O-CB 3.35Å; C335-M339 WeakPolarHBondContact O-CG 3.38Å; C335-M339 PolarHBondContact O-N 2.86Å
336	N	82	Confident	80.5	Confident	90 Å²	90	95.8 Å²	95.8	48%	0.481	51%	0.511	S	S	.	.	H	α-helix	trans	-64.9	-34.7	175.6	-78.7	-33.9	0	0	0	112	L332 K340	L332-N336 VanDerWaalsContact O-CB 3.25Å; L332-N336 WeakPolarHBondContact O-CB 3.48Å; L332-N336 VanDerWaalsContact O-CG 3.23Å; L332-N336 PolarHBondContact O-N 3.23Å; L332-N336 PolarHBondContact O-ND2 3.08Å; L332-N336 VanDerWaalsContact O-ND2 3.08Å; N336-K340 VanDerWaalsContact O-CB 3.29Å; N336-K340 WeakPolarHBondContact O-CB 3.38Å; N336-K340 PolarHBondContact O-N 3.37Å
337	A	80.4	Confident	81.2	Confident	53 Å²	53	99.8 Å²	99.8	44%	0.438	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-47.4	173	0	0	0	0	0	110.9	K333 D334 C335 K340 T341	K333-A337 WeakPolarHBondContact O-CB 3.5Å; K333-A337 PolarHBondContact O-N 3.37Å; D334-A337 WeakPolarHBondContact O-CB 3.24Å; D334-A337 PolarHBondContact O-N 3.11Å; C335-A337 VanDerWaalsContact C-N 3.28Å; C335-A337 PolarHBondContact O-N 3.41Å; A337-K340 WeakPolarHBondContact O-CB 3.36Å; A337-K340 PolarHBondContact O-N 3.45Å; A337-T341 PolarHBondContact O-N 2.97Å; A337-T341 PolarHBondContact O-OG1 3.45Å; A337-T341 VanDerWaalsContact O-OG1 3.08Å
338	A	85.1	Confident	81.9	Confident	50 Å²	50	96.4 Å²	96.4	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-48.1	177.1	0	0	0	0	0	112.4	D334 C335 K340 T341 D342	D334-A338 PolarHBondContact O-N 3.4Å; C335-A338 PolarHBondContact O-N 2.81Å; A338-K340 PolarHBondContact O-N 3.43Å; A338-T341 WeakPolarHBondContact O-CB 3.28Å; A338-T341 PolarHBondContact O-N 2.96Å; A338-T341 VanDerWaalsContact O-N 3.1Å; A338-D342 PolarHBondContact O-N 3.42Å
339	M	81.8	Confident	82.6	Confident	132 Å²	132	96.7 Å²	96.7	65%	0.65	51%	0.51	S	S	*	.	H	α-helix	trans	-60	-35.3	176.3	-72.7	-176.9	108.9	0	0	112.4	C335 S343	C335-M339 WeakPolarHBondContact O-CB 3.35Å; C335-M339 WeakPolarHBondContact O-CG 3.38Å; C335-M339 PolarHBondContact O-N 2.86Å; M339-S343 VanDerWaalsContact O-CB 3.29Å; M339-S343 WeakPolarHBondContact O-CB 3.3Å; M339-S343 PolarHBondContact O-N 2.94Å
340	K	82.4	Confident	83.3	Confident	148 Å²	148	95.6 Å²	95.6	64%	0.643	51%	0.505	S	S	*	.	H	α-helix	trans	-68.5	-43.2	175.5	-168.8	171.5	-175.5	177.9	0	111.3	N336 A337 A338 S343 D344	N336-K340 VanDerWaalsContact O-CB 3.29Å; N336-K340 WeakPolarHBondContact O-CB 3.38Å; N336-K340 PolarHBondContact O-N 3.37Å; A337-K340 WeakPolarHBondContact O-CB 3.36Å; A337-K340 PolarHBondContact O-N 3.45Å; A338-K340 PolarHBondContact O-N 3.43Å; K340-S343 PolarHBondContact O-N 2.82Å; K340-D344 PolarHBondContact O-N 2.96Å
341	T	85.2	Confident	83.7	Confident	82 Å²	82	99.2 Å²	99.2	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-59.9	-48	174.5	-57.6	0	0	0	0	111.5	A337 A338 S343 D344 V345	A337-T341 PolarHBondContact O-N 2.97Å; A337-T341 PolarHBondContact O-OG1 3.45Å; A337-T341 VanDerWaalsContact O-OG1 3.08Å; A338-T341 WeakPolarHBondContact O-CB 3.28Å; A338-T341 PolarHBondContact O-N 2.96Å; A338-T341 VanDerWaalsContact O-N 3.1Å; T341-S343 VanDerWaalsContact C-N 3.35Å; T341-S343 PolarHBondContact O-N 3.45Å; T341-D344 PolarHBondContact O-N 3.09Å; T341-D344 VanDerWaalsContact O-N 3.17Å; T341-V345 WeakPolarHBondContact O-CG2 3.38Å; T341-V345 PolarHBondContact O-N 3.49Å
342	D	85.1	Confident	84.1	Confident	102 Å²	102	94.8 Å²	94.8	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-39.3	179.2	-69.9	-12.7	0	0	0	111.9	A338 D344 V345 L346	A338-D342 PolarHBondContact O-N 3.42Å; D342-D344 VanDerWaalsContact C-N 3.32Å; D342-D344 PolarHBondContact O-N 3.5Å; D342-V345 PolarHBondContact O-N 3.02Å; D342-L346 WeakPolarHBondContact O-CB 3.4Å; D342-L346 PolarHBondContact O-N 3.39Å
343	S	85.1	Confident	84.6	Confident	72 Å²	72	93.4 Å²	93.4	50%	0.503	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-37.4	174	179.9	0	0	0	0	112.5	M339 K340 T341 R347	M339-S343 VanDerWaalsContact O-CB 3.29Å; M339-S343 WeakPolarHBondContact O-CB 3.3Å; M339-S343 PolarHBondContact O-N 2.94Å; K340-S343 PolarHBondContact O-N 2.82Å; T341-S343 VanDerWaalsContact C-N 3.35Å; T341-S343 PolarHBondContact O-N 3.45Å; S343-R347 WeakPolarHBondContact O-CB 3.41Å; S343-R347 PolarHBondContact O-N 3.21Å; S343-R347 VanDerWaalsContact O-N 3.14Å
344	D	83.8	Confident	85.1	Confident	54 Å²	54	90.7 Å²	90.7	29%	0.289	49%	0.486	S	S	.	.	H	α-helix	trans	-70	-41.2	176	-77.7	-38.8	0	0	0	111	K340 T341 D342 R347 D348	K340-D344 PolarHBondContact O-N 2.96Å; T341-D344 PolarHBondContact O-N 3.09Å; T341-D344 VanDerWaalsContact O-N 3.17Å; D342-D344 VanDerWaalsContact C-N 3.32Å; D342-D344 PolarHBondContact O-N 3.5Å; D344-R347 PolarHBondContact O-N 3.38Å; D344-R347 IonicContact OD1-CZ 3.22Å; D344-R347 IonicContact OD1-NH1 3.96Å; D344-R347 PolarHBondContact OD1-NH1 3.31Å; D344-R347 IonicContact OD1-NH2 2.76Å; D344-R347 PolarHBondContact OD1-NH2 3.32Å; D344-D348 PolarHBondContact O-N 3.39Å
345	V	88.3	Confident	85.4	Confident	72 Å²	72	94 Å²	94	44%	0.436	50%	0.496	S	S	.	.	H	α-helix	trans	-62.6	-45.4	175.7	171.4	0	0	0	0	111.7	T341 D342 R347 D348 L349	T341-V345 WeakPolarHBondContact O-CG2 3.38Å; T341-V345 PolarHBondContact O-N 3.49Å; D342-V345 PolarHBondContact O-N 3.02Å; V345-R347 VanDerWaalsContact C-N 3.32Å; V345-R347 PolarHBondContact O-N 2.99Å; V345-D348 PolarHBondContact O-N 2.96Å; V345-L349 HydrophobicContact CG1-CD1 3.89Å; V345-L349 PolarHBondContact O-N 3.18Å
346	L	87	Confident	86	Confident	108 Å²	108	95.2 Å²	95.2	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-58.9	-43.2	174.3	-92.6	162.9	0	0	0	111.7	D342 D348 L349 E350	D342-L346 WeakPolarHBondContact O-CB 3.4Å; D342-L346 PolarHBondContact O-N 3.39Å; L346-D348 VanDerWaalsContact C-N 3.3Å; L346-D348 PolarHBondContact O-N 2.9Å; L346-L349 PolarHBondContact O-N 3.23Å; L346-E350 WeakPolarHBondContact O-CG 3.48Å; L346-E350 PolarHBondContact O-N 3.41Å
347	R	83.1	Confident	86.5	Confident	121 Å²	121	95.2 Å²	95.2	46%	0.457	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-36.6	177.1	-170.2	-179.1	67.9	-142.2	-13.3	111.8	S343 D344 V345 R351	S343-R347 WeakPolarHBondContact O-CB 3.41Å; S343-R347 PolarHBondContact O-N 3.21Å; S343-R347 VanDerWaalsContact O-N 3.14Å; D344-R347 PolarHBondContact O-N 3.38Å; D344-R347 IonicContact OD1-CZ 3.22Å; D344-R347 IonicContact OD1-NH1 3.96Å; D344-R347 PolarHBondContact OD1-NH1 3.31Å; D344-R347 IonicContact OD1-NH2 2.76Å; D344-R347 PolarHBondContact OD1-NH2 3.32Å; V345-R347 VanDerWaalsContact C-N 3.32Å; V345-R347 PolarHBondContact O-N 2.99Å; R347-R351 VanDerWaalsContact NE-NH2 3.13Å; R347-R351 WeakPolarHBondContact O-CB 3.47Å; R347-R351 VanDerWaalsContact O-CG 3.28Å; R347-R351 WeakPolarHBondContact O-CG 3.37Å; R347-R351 PolarHBondContact O-N 3.49Å; R347-R351 VanDerWaalsContact O-N 3.13Å
348	D	85.9	Confident	86.8	Confident	83 Å²	83	98.2 Å²	98.2	44%	0.444	50%	0.497	S	S	.	.	H	α-helix	trans	-70.6	-41.5	176.9	-72.3	-15.4	0	0	0	112.3	D344 V345 L346 R351 A352	D344-D348 PolarHBondContact O-N 3.39Å; V345-D348 PolarHBondContact O-N 2.96Å; L346-D348 VanDerWaalsContact C-N 3.3Å; L346-D348 PolarHBondContact O-N 2.9Å; D348-R351 WeakPolarHBondContact O-CB 3.38Å; D348-R351 PolarHBondContact O-N 3.47Å; D348-R351 IonicContact OD1-CZ 2.8Å; D348-R351 IonicContact OD1-NE 3.23Å; D348-R351 PolarHBondContact OD1-NE 2.92Å; D348-R351 IonicContact OD1-NH2 3.7Å; D348-R351 PolarHBondContact OD1-NH2 3.44Å; D348-A352 PolarHBondContact O-N 2.95Å
349	L	88.1	Confident	86.9	Confident	102 Å²	102	99 Å²	99	53%	0.534	50%	0.499	S	S	.	.	H	α-helix	trans	-62.2	-46	173.5	-81.5	158.5	0	0	0	111.9	V345 L346 R351 A352 V353	V345-L349 HydrophobicContact CG1-CD1 3.89Å; V345-L349 PolarHBondContact O-N 3.18Å; L346-L349 PolarHBondContact O-N 3.23Å; L349-R351 VanDerWaalsContact C-N 3.26Å; L349-R351 PolarHBondContact O-N 3.05Å; L349-A352 WeakPolarHBondContact O-CB 3.44Å; L349-A352 PolarHBondContact O-N 2.85Å; L349-V353 WeakPolarHBondContact O-CG2 3.45Å; L349-V353 PolarHBondContact O-N 3.01Å
350	E	90.6	Very high	87.4	Confident	107 Å²	107	96.9 Å²	96.9	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-59.3	-38.1	174.7	-79.4	-169.6	-167.7	0	0	112.4	L346 K354	L346-E350 WeakPolarHBondContact O-CG 3.48Å; L346-E350 PolarHBondContact O-N 3.41Å; E350-K354 WeakPolarHBondContact O-CB 3.27Å; E350-K354 VanDerWaalsContact O-CG 3.28Å; E350-K354 WeakPolarHBondContact O-CG 3.47Å; E350-K354 PolarHBondContact O-N 2.75Å; E350-K354 IonicContact OE2-NZ 3.39Å; E350-K354 PolarHBondContact OE2-NZ 3.39Å
351	R	84.8	Confident	87.8	Confident	138 Å²	138	93.4 Å²	93.4	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-65.2	-40.3	174.7	-78	-171	-82	-157.1	1.7	111.3	R347 D348 L349 K355	R347-R351 VanDerWaalsContact NE-NH2 3.13Å; R347-R351 WeakPolarHBondContact O-CB 3.47Å; R347-R351 VanDerWaalsContact O-CG 3.28Å; R347-R351 WeakPolarHBondContact O-CG 3.37Å; R347-R351 PolarHBondContact O-N 3.49Å; R347-R351 VanDerWaalsContact O-N 3.13Å; D348-R351 WeakPolarHBondContact O-CB 3.38Å; D348-R351 PolarHBondContact O-N 3.47Å; D348-R351 IonicContact OD1-CZ 2.8Å; D348-R351 IonicContact OD1-NE 3.23Å; D348-R351 PolarHBondContact OD1-NE 2.92Å; D348-R351 IonicContact OD1-NH2 3.7Å; D348-R351 PolarHBondContact OD1-NH2 3.44Å; L349-R351 VanDerWaalsContact C-N 3.26Å; L349-R351 PolarHBondContact O-N 3.05Å; R351-K355 PolarHBondContact O-N 3.45Å; R351-K355 VanDerWaalsContact O-N 3.09Å
352	A	90.2	Very high	87.8	Confident	46 Å²	46	94.1 Å²	94.1	38%	0.38	48%	0.484	S	S	.	.	H	α-helix	trans	-65.1	-48.4	176.9	0	0	0	0	0	112	D348 L349 K354 K355 I356	D348-A352 PolarHBondContact O-N 2.95Å; L349-A352 WeakPolarHBondContact O-CB 3.44Å; L349-A352 PolarHBondContact O-N 2.85Å; A352-K354 PolarHBondContact O-N 2.88Å; A352-K355 WeakPolarHBondContact O-CB 3.37Å; A352-K355 PolarHBondContact O-N 3.13Å; A352-I356 WeakPolarHBondContact O-CG1 3.33Å; A352-I356 PolarHBondContact O-N 2.74Å
353	V	90.6	Very high	88	Confident	79 Å²	79	92.3 Å²	92.3	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-58.1	-48	176.8	173.6	0	0	0	0	110.8	L349 K355 I356 D357	L349-V353 WeakPolarHBondContact O-CG2 3.45Å; L349-V353 PolarHBondContact O-N 3.01Å; V353-K355 PolarHBondContact O-N 3.28Å; V353-I356 WeakPolarHBondContact O-CB 3.44Å; V353-I356 PolarHBondContact O-N 3.49Å; V353-D357 PolarHBondContact O-N 3.01Å
354	K	88.4	Confident	88.3	Confident	100 Å²	100	92.2 Å²	92.2	44%	0.435	47%	0.474	S	S	.	.	H	α-helix	trans	-61.7	-29.1	176.8	-73.9	168.9	-175	155.9	0	113.4	E350 A352 R358	E350-K354 WeakPolarHBondContact O-CB 3.27Å; E350-K354 VanDerWaalsContact O-CG 3.28Å; E350-K354 WeakPolarHBondContact O-CG 3.47Å; E350-K354 PolarHBondContact O-N 2.75Å; E350-K354 IonicContact OE2-NZ 3.39Å; E350-K354 PolarHBondContact OE2-NZ 3.39Å; A352-K354 PolarHBondContact O-N 2.88Å; K354-R358 VanDerWaalsContact O-CG 3.26Å; K354-R358 WeakPolarHBondContact O-CG 3.17Å; K354-R358 PolarHBondContact O-N 2.87Å; K354-R358 PolarHBondContact O-NE 3.37Å
355	K	89.1	Confident	88.5	Confident	161 Å²	161	91.8 Å²	91.8	70%	0.7	48%	0.476	S	S	*	.	H	α-helix	trans	-73	-41.6	174.7	-173.4	-180	178.5	-178.8	0	110.6	R351 A352 V353 R358 S359	R351-K355 PolarHBondContact O-N 3.45Å; R351-K355 VanDerWaalsContact O-N 3.09Å; A352-K355 WeakPolarHBondContact O-CB 3.37Å; A352-K355 PolarHBondContact O-N 3.13Å; V353-K355 PolarHBondContact O-N 3.28Å; K355-R358 PolarHBondContact O-N 3.03Å; K355-S359 PolarHBondContact O-N 2.85Å
356	I	90	Very high	88.6	Confident	100 Å²	100	94.8 Å²	94.8	51%	0.513	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-46.8	175.5	-66.4	167.7	0	0	0	110.2	A352 V353 R358 S359 I360	A352-I356 WeakPolarHBondContact O-CG1 3.33Å; A352-I356 PolarHBondContact O-N 2.74Å; V353-I356 WeakPolarHBondContact O-CB 3.44Å; V353-I356 PolarHBondContact O-N 3.49Å; I356-R358 VanDerWaalsContact C-N 3.32Å; I356-R358 PolarHBondContact O-N 3.41Å; I356-S359 CarbonylContact O-C 3.47Å; I356-S359 WeakPolarHBondContact O-CA 3.42Å; I356-S359 WeakPolarHBondContact O-CB 3.43Å; I356-S359 PolarHBondContact O-N 2.88Å; I356-I360 HydrophobicContact CG2-CD1 3.79Å; I356-I360 HydrophobicContact CG2-CG1 4.31Å; I356-I360 WeakPolarHBondContact O-CG1 3.29Å; I356-I360 PolarHBondContact O-N 3.37Å
357	D	91.2	Very high	88.7	Confident	90 Å²	90	92.3 Å²	92.3	48%	0.481	47%	0.47	S	S	.	.	H	α-helix	trans	-58.7	-41.2	177.9	-72.3	-28.5	0	0	0	112.9	V353 S359 I360 C361	V353-D357 PolarHBondContact O-N 3.01Å; D357-S359 VanDerWaalsContact C-N 3.33Å; D357-I360 PolarHBondContact O-N 3.45Å; D357-C361 WeakPolarHBondContact O-CB 3.46Å; D357-C361 PolarHBondContact O-N 3.08Å
358	R	87.4	Confident	89	Confident	116 Å²	116	92.1 Å²	92.1	44%	0.438	47%	0.474	S	S	.	.	H	α-helix	trans	-65	-39.4	174.6	-71	174.8	-149.8	-179.1	6.5	111.7	K354 K355 I356 C361 N362	K354-R358 VanDerWaalsContact O-CG 3.26Å; K354-R358 WeakPolarHBondContact O-CG 3.17Å; K354-R358 PolarHBondContact O-N 2.87Å; K354-R358 PolarHBondContact O-NE 3.37Å; K355-R358 PolarHBondContact O-N 3.03Å; I356-R358 VanDerWaalsContact C-N 3.32Å; I356-R358 PolarHBondContact O-N 3.41Å; R358-C361 PolarHBondContact O-N 2.94Å; R358-N362 WeakPolarHBondContact O-CB 3.42Å; R358-N362 VanDerWaalsContact O-CG 3.23Å; R358-N362 PolarHBondContact O-N 3.43Å; R358-N362 PolarHBondContact O-ND2 3.34Å
359	S	88.1	Confident	89.1	Confident	67 Å²	67	95.6 Å²	95.6	47%	0.469	48%	0.481	S	S	.	.	H	α-helix	trans	-64.2	-43.3	175.7	-167.3	0	0	0	0	111.1	K355 I356 D357 N362 C363	K355-S359 PolarHBondContact O-N 2.85Å; I356-S359 CarbonylContact O-C 3.47Å; I356-S359 WeakPolarHBondContact O-CA 3.42Å; I356-S359 WeakPolarHBondContact O-CB 3.43Å; I356-S359 PolarHBondContact O-N 2.88Å; D357-S359 VanDerWaalsContact C-N 3.33Å; S359-N362 PolarHBondContact O-N 2.9Å; S359-C363 WeakPolarHBondContact O-CB 3.48Å; S359-C363 PolarHBondContact O-N 3.42Å; S359-C363 PolarHBondContact O-SG 3.38Å; S359-C363 VanDerWaalsContact O-SG 3.36Å
360	I	90.9	Very high	89.1	Confident	86 Å²	86	92.7 Å²	92.7	44%	0.441	47%	0.472	S	S	.	.	H	α-helix	trans	-60.8	-50.3	175.6	-68.1	169.6	0	0	0	110.1	I356 D357 N362 C363 V364	I356-I360 HydrophobicContact CG2-CD1 3.79Å; I356-I360 HydrophobicContact CG2-CG1 4.31Å; I356-I360 WeakPolarHBondContact O-CG1 3.29Å; I356-I360 PolarHBondContact O-N 3.37Å; D357-I360 PolarHBondContact O-N 3.45Å; I360-N362 VanDerWaalsContact C-N 3.34Å; I360-N362 PolarHBondContact O-N 2.88Å; I360-C363 WeakPolarHBondContact O-CB 3.29Å; I360-C363 PolarHBondContact O-N 2.87Å; I360-C363 VanDerWaalsContact O-N 3.1Å; I360-V364 HydrophobicContact CG2-CG2 4.33Å; I360-V364 WeakPolarHBondContact O-CG2 3.38Å; I360-V364 PolarHBondContact O-N 2.9Å
361	C	90.1	Very high	89.1	Confident	75 Å²	75	96 Å²	96	51%	0.507	48%	0.48	S	S	.	.	H	α-helix	trans	-57.2	-46.2	178.4	-172.4	0	0	0	0	111.8	D357 R358 C363 V364 S365	D357-C361 WeakPolarHBondContact O-CB 3.46Å; D357-C361 PolarHBondContact O-N 3.08Å; R358-C361 PolarHBondContact O-N 2.94Å; C361-C363 VanDerWaalsContact C-N 3.34Å; C361-C363 PolarHBondContact O-N 2.96Å; C361-V364 PolarHBondContact O-N 3.2Å; C361-S365 PolarHBondContact O-N 3.18Å; C361-S365 PolarHBondContact O-OG 3.41Å
362	N	86.6	Confident	89.3	Confident	98 Å²	98	96.6 Å²	96.6	52%	0.524	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-39.4	175.9	-75	-14.4	0	0	0	112.6	R358 S359 I360 K366	R358-N362 WeakPolarHBondContact O-CB 3.42Å; R358-N362 VanDerWaalsContact O-CG 3.23Å; R358-N362 PolarHBondContact O-N 3.43Å; R358-N362 PolarHBondContact O-ND2 3.34Å; S359-N362 PolarHBondContact O-N 2.9Å; I360-N362 VanDerWaalsContact C-N 3.34Å; I360-N362 PolarHBondContact O-N 2.88Å; N362-K366 WeakPolarHBondContact O-CB 3.32Å; N362-K366 VanDerWaalsContact O-CG 3.24Å; N362-K366 WeakPolarHBondContact O-CG 3.48Å; N362-K366 PolarHBondContact O-N 3.35Å
363	C	88.9	Confident	89.3	Confident	64 Å²	64	97.4 Å²	97.4	43%	0.432	49%	0.491	S	S	.	.	H	α-helix	trans	-65.8	-43.5	175.5	-77.7	0	0	0	0	111.6	S359 I360 C361 K366 I367	S359-C363 WeakPolarHBondContact O-CB 3.48Å; S359-C363 PolarHBondContact O-N 3.42Å; S359-C363 PolarHBondContact O-SG 3.38Å; S359-C363 VanDerWaalsContact O-SG 3.36Å; I360-C363 WeakPolarHBondContact O-CB 3.29Å; I360-C363 PolarHBondContact O-N 2.87Å; I360-C363 VanDerWaalsContact O-N 3.1Å; C361-C363 VanDerWaalsContact C-N 3.34Å; C361-C363 PolarHBondContact O-N 2.96Å; C363-K366 PolarHBondContact O-N 3.37Å; C363-I367 VanDerWaalsContact O-CG1 3.25Å; C363-I367 WeakPolarHBondContact O-CG1 3.48Å; C363-I367 PolarHBondContact O-N 3.32Å
364	V	92	Very high	89.3	Confident	69 Å²	69	96 Å²	96	42%	0.418	48%	0.48	S	S	.	.	H	α-helix	trans	-59.6	-50.1	176.6	172.1	0	0	0	0	110.8	I360 C361 K366 I367 E368	I360-V364 HydrophobicContact CG2-CG2 4.33Å; I360-V364 WeakPolarHBondContact O-CG2 3.38Å; I360-V364 PolarHBondContact O-N 2.9Å; C361-V364 PolarHBondContact O-N 3.2Å; V364-K366 VanDerWaalsContact C-N 3.27Å; V364-K366 PolarHBondContact O-N 3.46Å; V364-I367 WeakPolarHBondContact O-CB 3.39Å; V364-I367 PolarHBondContact O-N 3.02Å; V364-E368 PolarHBondContact O-N 3.13Å
365	S	86.6	Confident	89.3	Confident	45 Å²	45	95.6 Å²	95.6	32%	0.315	48%	0.48	S	S	.	.	H	α-helix	trans	-64.5	-29.9	177.4	-53.2	0	0	0	0	113.1	C361 R369	C361-S365 PolarHBondContact O-N 3.18Å; C361-S365 PolarHBondContact O-OG 3.41Å; S365-R369 WeakPolarHBondContact O-CG 3.2Å; S365-R369 PolarHBondContact O-N 3.33Å; S365-R369 PolarHBondContact O-NE 3.23Å
366	K	90.5	Very high	89.3	Confident	135 Å²	135	93.6 Å²	93.6	59%	0.587	47%	0.473	S	S	*	.	H	α-helix	trans	-69.8	-38.5	171.6	-76.5	174.3	-178.2	-179.9	0	111.6	N362 C363 V364 A370	N362-K366 WeakPolarHBondContact O-CB 3.32Å; N362-K366 VanDerWaalsContact O-CG 3.24Å; N362-K366 WeakPolarHBondContact O-CG 3.48Å; N362-K366 PolarHBondContact O-N 3.35Å; C363-K366 PolarHBondContact O-N 3.37Å; V364-K366 VanDerWaalsContact C-N 3.27Å; V364-K366 PolarHBondContact O-N 3.46Å; K366-A370 WeakPolarHBondContact O-CB 3.42Å; K366-A370 PolarHBondContact O-N 2.83Å
367	I	89.3	Confident	89.2	Confident	57 Å²	57	89.5 Å²	89.5	29%	0.292	46%	0.455	S	S	.	.	H	α-helix	trans	-66.7	-44	177.2	-70.6	164.2	0	0	0	110.7	C363 V364 A370 R371	C363-I367 VanDerWaalsContact O-CG1 3.25Å; C363-I367 WeakPolarHBondContact O-CG1 3.48Å; C363-I367 PolarHBondContact O-N 3.32Å; V364-I367 WeakPolarHBondContact O-CB 3.39Å; V364-I367 PolarHBondContact O-N 3.02Å; I367-A370 PolarHBondContact O-N 3.12Å; I367-R371 HydrophobicContact CG2-CG 4.44Å; I367-R371 WeakPolarHBondContact O-CG 3.45Å; I367-R371 PolarHBondContact O-N 3.08Å
368	E	90.4	Very high	89.2	Confident	117 Å²	117	90.4 Å²	90.4	55%	0.547	46%	0.456	S	S	.	.	H	α-helix	trans	-60.7	-49	177.2	-74.1	176.6	160	0	0	111.8	V364 A370 R371 E372	V364-E368 PolarHBondContact O-N 3.13Å; E368-A370 VanDerWaalsContact C-N 3.29Å; E368-A370 PolarHBondContact O-N 3.44Å; E368-R371 WeakPolarHBondContact O-CB 3.49Å; E368-R371 PolarHBondContact O-N 3.31Å; E368-R371 VanDerWaalsContact O-N 3.13Å; E368-E372 PolarHBondContact O-N 3.49Å
369	R	88.1	Confident	89.3	Confident	156 Å²	156	92.4 Å²	92.4	59%	0.589	46%	0.463	S	S	*	.	H	α-helix	trans	-59.7	-38.5	175.4	-72.9	-177.6	-67.8	-145.6	-1.6	112.9	S365 S373	S365-R369 WeakPolarHBondContact O-CG 3.2Å; S365-R369 PolarHBondContact O-N 3.33Å; S365-R369 PolarHBondContact O-NE 3.23Å; R369-S373 WeakPolarHBondContact O-CB 3.41Å; R369-S373 PolarHBondContact O-N 3.31Å; R369-S373 PolarHBondContact O-OG 2.85Å
370	A	86.9	Confident	89.4	Confident	41 Å²	41	93.1 Å²	93.1	34%	0.339	46%	0.459	S	S	.	.	H	α-helix	trans	-67.9	-38.3	176.6	0	0	0	0	0	112	K366 I367 E368 S373 L374	K366-A370 WeakPolarHBondContact O-CB 3.42Å; K366-A370 PolarHBondContact O-N 2.83Å; I367-A370 PolarHBondContact O-N 3.12Å; E368-A370 VanDerWaalsContact C-N 3.29Å; E368-A370 PolarHBondContact O-N 3.44Å; A370-S373 PolarHBondContact O-N 3.28Å; A370-L374 WeakPolarHBondContact O-CB 3.39Å; A370-L374 PolarHBondContact O-N 2.79Å
371	R	90.1	Very high	89.2	Confident	177 Å²	177	91.9 Å²	91.9	67%	0.668	45%	0.452	S	S	*	.	H	α-helix	trans	-65.3	-43	175.2	-75.9	176.6	177.6	-178.7	-0.5	112	I367 E368 L374 H375	I367-R371 HydrophobicContact CG2-CG 4.44Å; I367-R371 WeakPolarHBondContact O-CG 3.45Å; I367-R371 PolarHBondContact O-N 3.08Å; E368-R371 WeakPolarHBondContact O-CB 3.49Å; E368-R371 PolarHBondContact O-N 3.31Å; E368-R371 VanDerWaalsContact O-N 3.13Å; R371-L374 WeakPolarHBondContact O-CB 3.38Å; R371-L374 PolarHBondContact O-N 2.92Å; R371-H375 WeakPolarHBondContact O-CB 3.31Å; R371-H375 PolarHBondContact O-N 3.1Å
372	E	89.8	Confident	89.2	Confident	149 Å²	149	94.9 Å²	94.9	70%	0.696	46%	0.459	S	S	*	.	H	α-helix	trans	-66.6	-40	177.6	-171.7	143.6	-146.3	0	0	111.8	E368 L374 H375 Q376	E368-E372 PolarHBondContact O-N 3.49Å; E372-L374 VanDerWaalsContact C-N 3.34Å; E372-L374 PolarHBondContact O-N 3.23Å; E372-H375 PolarHBondContact O-N 3.08Å; E372-Q376 PolarHBondContact O-N 3.32Å
373	S	89.5	Confident	89.4	Confident	64 Å²	64	94 Å²	94	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-63.2	-39.5	173.3	-56.4	0	0	0	0	112.2	R369 A370 Q376 A377	R369-S373 WeakPolarHBondContact O-CB 3.41Å; R369-S373 PolarHBondContact O-N 3.31Å; R369-S373 PolarHBondContact O-OG 2.85Å; A370-S373 PolarHBondContact O-N 3.28Å; S373-Q376 PolarHBondContact O-N 3.35Å; S373-A377 WeakPolarHBondContact O-CB 3.33Å; S373-A377 PolarHBondContact O-N 2.99Å
374	L	90.5	Very high	89.5	Confident	48 Å²	48	92.1 Å²	92.1	25%	0.251	44%	0.443	S	S	.	.	H	α-helix	trans	-63	-48.1	175.5	-174.9	74.2	0	0	0	110.8	T251 A370 R371 E372 Q376 A377 E378	T251-L374 HydrophobicContact CG2-CD1 4.38Å; A370-L374 WeakPolarHBondContact O-CB 3.39Å; A370-L374 PolarHBondContact O-N 2.79Å; R371-L374 WeakPolarHBondContact O-CB 3.38Å; R371-L374 PolarHBondContact O-N 2.92Å; E372-L374 VanDerWaalsContact C-N 3.34Å; E372-L374 PolarHBondContact O-N 3.23Å; L374-Q376 VanDerWaalsContact C-N 3.29Å; L374-Q376 PolarHBondContact O-N 2.97Å; L374-A377 WeakPolarHBondContact O-CB 3.38Å; L374-A377 PolarHBondContact O-N 2.88Å; L374-A377 VanDerWaalsContact O-N 3.11Å; L374-E378 WeakPolarHBondContact O-CG 3.46Å; L374-E378 PolarHBondContact O-N 2.91Å
375	H	90.1	Very high	89.4	Confident	92 Å²	92	93.5 Å²	93.5	43%	0.426	45%	0.445	S	S	.	.	H	α-helix	trans	-62.4	-35.7	178.5	-169.7	-59.8	0	0	0	112.2	R371 E372 R379	R371-H375 WeakPolarHBondContact O-CB 3.31Å; R371-H375 PolarHBondContact O-N 3.1Å; E372-H375 PolarHBondContact O-N 3.08Å; H375-R379 PolarHBondContact CE1-NE 2.74Å; H375-R379 PolarHBondContact CE1-NH2 3.49Å; H375-R379 VanDerWaalsContact CE1-NH2 3.29Å; H375-R379 PolarHBondContact O-N 3.13Å
376	Q	89	Confident	89.7	Confident	119 Å²	119	96.4 Å²	96.4	56%	0.556	45%	0.453	S	S	*	.	H	α-helix	trans	-67.3	-42	173.8	-170.7	-179.8	16.9	0	0	111.5	E372 S373 L374 R379 Q380	E372-Q376 PolarHBondContact O-N 3.32Å; S373-Q376 PolarHBondContact O-N 3.35Å; L374-Q376 VanDerWaalsContact C-N 3.29Å; L374-Q376 PolarHBondContact O-N 2.97Å; Q376-R379 PolarHBondContact O-N 2.92Å; Q376-Q380 WeakPolarHBondContact O-CG 3.47Å; Q376-Q380 PolarHBondContact O-N 3.39Å
377	A	87.1	Confident	89.7	Confident	15 Å²	15	96.1 Å²	96.1	12%	0.124	45%	0.452	C	S	.	.	H	α-helix	trans	-65.2	-40.5	177.2	0	0	0	0	0	112.1	S373 L374 Q380 M381	S373-A377 WeakPolarHBondContact O-CB 3.33Å; S373-A377 PolarHBondContact O-N 2.99Å; L374-A377 WeakPolarHBondContact O-CB 3.38Å; L374-A377 PolarHBondContact O-N 2.88Å; L374-A377 VanDerWaalsContact O-N 3.11Å; A377-Q380 PolarHBondContact O-N 2.82Å; A377-M381 WeakPolarHBondContact O-CG 3.33Å; A377-M381 PolarHBondContact O-N 2.75Å
378	E	91.4	Very high	89.8	Confident	108 Å²	108	95.1 Å²	95.1	51%	0.505	45%	0.447	S	S	.	.	H	α-helix	trans	-60.8	-45.9	175.5	-73.9	171.8	167.4	0	0	111.7	L374 Q380 M381 E382	L374-E378 WeakPolarHBondContact O-CG 3.46Å; L374-E378 PolarHBondContact O-N 2.91Å; E378-Q380 VanDerWaalsContact C-N 3.33Å; E378-Q380 PolarHBondContact O-N 2.89Å; E378-M381 WeakPolarHBondContact O-CB 3.4Å; E378-M381 PolarHBondContact O-N 2.84Å; E378-E382 PolarHBondContact O-N 3.08Å
379	R	89.3	Confident	89.8	Confident	159 Å²	159	97.6 Å²	97.6	60%	0.6	45%	0.451	S	S	*	.	H	α-helix	trans	-59.4	-42	173.2	-76.3	-178.7	174.5	157.8	7.1	112.4	H375 Q376 M381 E382 T383	H375-R379 PolarHBondContact CE1-NE 2.74Å; H375-R379 PolarHBondContact CE1-NH2 3.49Å; H375-R379 VanDerWaalsContact CE1-NH2 3.29Å; H375-R379 PolarHBondContact O-N 3.13Å; Q376-R379 PolarHBondContact O-N 2.92Å; R379-M381 VanDerWaalsContact C-N 3.34Å; R379-E382 PolarHBondContact O-N 3.23Å; R379-T383 WeakPolarHBondContact O-CG2 3.34Å; R379-T383 PolarHBondContact O-N 3.29Å; R379-T383 VanDerWaalsContact O-N 3.11Å
380	Q	90.6	Very high	89.9	Confident	81 Å²	81	93.5 Å²	93.5	38%	0.379	44%	0.444	S	S	.	.	H	α-helix	trans	-65	-40.3	177.5	-74.3	-179	-12.9	0	0	111.6	Q376 A377 E378 T383 L384	Q376-Q380 WeakPolarHBondContact O-CG 3.47Å; Q376-Q380 PolarHBondContact O-N 3.39Å; A377-Q380 PolarHBondContact O-N 2.82Å; E378-Q380 VanDerWaalsContact C-N 3.33Å; E378-Q380 PolarHBondContact O-N 2.89Å; Q380-T383 PolarHBondContact O-N 3.48Å; Q380-T383 PolarHBondContact O-OG1 3.11Å; Q380-L384 WeakPolarHBondContact O-CG 3.26Å; Q380-L384 PolarHBondContact O-N 3.08Å
381	M	86.1	Confident	90	Very high	60 Å²	60	93.9 Å²	93.9	30%	0.296	44%	0.442	S	S	.	.	H	α-helix	trans	-60.2	-46.6	175.1	-75.4	-176.6	62.5	0	0	111.6	A377 E378 R379 T383 L384 E385	A377-M381 WeakPolarHBondContact O-CG 3.33Å; A377-M381 PolarHBondContact O-N 2.75Å; E378-M381 WeakPolarHBondContact O-CB 3.4Å; E378-M381 PolarHBondContact O-N 2.84Å; R379-M381 VanDerWaalsContact C-N 3.34Å; M381-T383 VanDerWaalsContact C-N 3.34Å; M381-T383 PolarHBondContact O-N 2.9Å; M381-L384 PolarHBondContact O-N 3.38Å; M381-L384 VanDerWaalsContact O-N 3.12Å; M381-E385 WeakPolarHBondContact O-CG 3.36Å; M381-E385 PolarHBondContact O-N 2.81Å
382	E	91.3	Very high	90	Very high	138 Å²	138	89.2 Å²	89.2	65%	0.645	43%	0.43	S	S	*	.	H	α-helix	trans	-58.8	-44.3	177.4	-171.4	175.7	-158.6	0	0	111.9	E378 R379 L384 E385 E386	E378-E382 PolarHBondContact O-N 3.08Å; R379-E382 PolarHBondContact O-N 3.23Å; E382-L384 VanDerWaalsContact C-N 3.32Å; E382-L384 PolarHBondContact O-N 2.93Å; E382-E385 PolarHBondContact O-N 3.42Å; E382-E386 PolarHBondContact O-N 2.9Å; E382-E386 VanDerWaalsContact O-N 3.09Å
383	T	90.5	Very high	90	Very high	79 Å²	79	85 Å²	85	49%	0.485	42%	0.417	S	S	.	.	H	α-helix	trans	-65.5	-33.3	176.5	62.7	0	0	0	0	113.6	R379 Q380 M381 K387	R379-T383 WeakPolarHBondContact O-CG2 3.34Å; R379-T383 PolarHBondContact O-N 3.29Å; R379-T383 VanDerWaalsContact O-N 3.11Å; Q380-T383 PolarHBondContact O-N 3.48Å; Q380-T383 PolarHBondContact O-OG1 3.11Å; M381-T383 VanDerWaalsContact C-N 3.34Å; M381-T383 PolarHBondContact O-N 2.9Å; T383-K387 WeakPolarHBondContact O-CG 3.28Å; T383-K387 PolarHBondContact O-N 3.43Å
384	L	89.9	Confident	90	Very high	26 Å²	26	89.9 Å²	89.9	14%	0.136	43%	0.426	C	S	.	.	H	α-helix	trans	-74.4	-38	177.2	-74.7	172.4	0	0	0	111.3	Q380 M381 E382 E386 K387 I388	Q380-L384 WeakPolarHBondContact O-CG 3.26Å; Q380-L384 PolarHBondContact O-N 3.08Å; M381-L384 PolarHBondContact O-N 3.38Å; M381-L384 VanDerWaalsContact O-N 3.12Å; E382-L384 VanDerWaalsContact C-N 3.32Å; E382-L384 PolarHBondContact O-N 2.93Å; L384-E386 VanDerWaalsContact C-N 3.33Å; L384-E386 PolarHBondContact O-N 3.43Å; L384-K387 PolarHBondContact O-N 2.98Å; L384-I388 VanDerWaalsContact O-CG1 3.29Å; L384-I388 WeakPolarHBondContact O-CG1 3.45Å; L384-I388 PolarHBondContact O-N 3.37Å
385	E	91.2	Very high	89.9	Confident	97 Å²	97	90.2 Å²	90.2	45%	0.453	43%	0.427	S	S	.	.	H	α-helix	trans	-62.1	-41	174.9	-74.5	-179.8	179.5	0	0	111.7	M381 E382 I388 R389	M381-E385 WeakPolarHBondContact O-CG 3.36Å; M381-E385 PolarHBondContact O-N 2.81Å; E382-E385 PolarHBondContact O-N 3.42Å; E385-I388 PolarHBondContact O-N 3.08Å; E385-R389 WeakPolarHBondContact O-CG 3.46Å; E385-R389 PolarHBondContact O-N 2.93Å
386	E	91.4	Very high	89.9	Confident	106 Å²	106	89 Å²	89	50%	0.495	43%	0.429	S	S	.	.	H	α-helix	trans	-65.2	-42.4	174.7	-169.6	60.1	-161.7	0	0	111.7	E382 L384 I388 R389 T390	E382-E386 PolarHBondContact O-N 2.9Å; E382-E386 VanDerWaalsContact O-N 3.09Å; L384-E386 VanDerWaalsContact C-N 3.33Å; L384-E386 PolarHBondContact O-N 3.43Å; E386-I388 VanDerWaalsContact C-N 3.34Å; E386-I388 PolarHBondContact O-N 2.86Å; E386-R389 PolarHBondContact O-N 3.04Å; E386-T390 WeakPolarHBondContact O-CG2 3.34Å; E386-T390 PolarHBondContact O-N 2.65Å; E386-T390 PolarHBondContact O-OG1 3.29Å
387	K	91.3	Very high	89.9	Confident	130 Å²	130	89.2 Å²	89.2	57%	0.565	43%	0.43	S	S	*	.	H	α-helix	trans	-60.5	-42	174.5	-75.3	177.1	-179.2	-178.1	0	112.3	T383 L384 T390 T391	T383-K387 WeakPolarHBondContact O-CG 3.28Å; T383-K387 PolarHBondContact O-N 3.43Å; L384-K387 PolarHBondContact O-N 2.98Å; K387-T390 WeakPolarHBondContact CA-OG1 3.04Å; K387-T390 PolarHBondContact O-N 2.99Å; K387-T390 PolarHBondContact O-OG1 3.45Å; K387-T391 WeakPolarHBondContact O-CB 3.48Å; K387-T391 PolarHBondContact O-N 3.3Å; K387-T391 PolarHBondContact O-OG1 3.28Å
388	I	90.5	Very high	89.9	Confident	36 Å²	36	91.1 Å²	91.1	19%	0.185	44%	0.438	C	S	.	.	H	α-helix	trans	-61	-47.4	175.9	-69.7	165.2	0	0	0	110	L384 E385 E386 T390 T391 D392	L384-I388 VanDerWaalsContact O-CG1 3.29Å; L384-I388 WeakPolarHBondContact O-CG1 3.45Å; L384-I388 PolarHBondContact O-N 3.37Å; E385-I388 PolarHBondContact O-N 3.08Å; E386-I388 VanDerWaalsContact C-N 3.34Å; E386-I388 PolarHBondContact O-N 2.86Å; I388-T390 PolarHBondContact O-N 2.93Å; I388-T391 PolarHBondContact O-N 3.17Å; I388-T391 VanDerWaalsContact O-N 3.08Å; I388-D392 PolarHBondContact O-N 3.47Å
389	R	90.8	Very high	89.9	Confident	168 Å²	168	90.3 Å²	90.3	63%	0.634	44%	0.436	S	S	*	.	H	α-helix	trans	-58.4	-43.8	177.1	-72.1	175.8	-178.3	-173.7	2.7	112.9	E385 E386 T391 S393	E385-R389 WeakPolarHBondContact O-CG 3.46Å; E385-R389 PolarHBondContact O-N 2.93Å; E386-R389 PolarHBondContact O-N 3.04Å; R389-T391 VanDerWaalsContact C-N 3.29Å; R389-T391 PolarHBondContact O-N 2.96Å; R389-S393 PolarHBondContact O-N 3.33Å; R389-S393 VanDerWaalsContact O-N 3.11Å
390	T	90.6	Very high	89.9	Confident	71 Å²	71	86.1 Å²	86.1	44%	0.436	43%	0.429	S	S	.	.	H	α-helix	trans	-66.7	-31.3	177	61.3	0	0	0	0	112.8	E386 K387 I388 S393 R394	E386-T390 WeakPolarHBondContact O-CG2 3.34Å; E386-T390 PolarHBondContact O-N 2.65Å; E386-T390 PolarHBondContact O-OG1 3.29Å; K387-T390 WeakPolarHBondContact CA-OG1 3.04Å; K387-T390 PolarHBondContact O-N 2.99Å; K387-T390 PolarHBondContact O-OG1 3.45Å; I388-T390 PolarHBondContact O-N 2.93Å; T390-S393 PolarHBondContact O-OG 3.44Å; T390-R394 PolarHBondContact O-N 2.92Å
391	T	89.2	Confident	89.7	Confident	48 Å²	48	89.3 Å²	89.3	29%	0.294	44%	0.437	S	S	.	.	H	α-helix	trans	-76.9	-42.8	179	-52.1	0	0	0	0	110.9	K387 I388 R389 S393 R394 I395	K387-T391 WeakPolarHBondContact O-CB 3.48Å; K387-T391 PolarHBondContact O-N 3.3Å; K387-T391 PolarHBondContact O-OG1 3.28Å; I388-T391 PolarHBondContact O-N 3.17Å; I388-T391 VanDerWaalsContact O-N 3.08Å; R389-T391 VanDerWaalsContact C-N 3.29Å; R389-T391 PolarHBondContact O-N 2.96Å; T391-S393 VanDerWaalsContact C-N 3.32Å; T391-S393 PolarHBondContact O-N 2.99Å; T391-R394 WeakPolarHBondContact O-CB 3.34Å; T391-R394 PolarHBondContact O-N 2.95Å; T391-R394 VanDerWaalsContact O-N 3.13Å; T391-I395 HydrophobicContact CG2-CD1 4.13Å; T391-I395 WeakPolarHBondContact O-CG1 3.47Å; T391-I395 PolarHBondContact O-N 3.05Å
392	D	89.9	Confident	89.6	Confident	79 Å²	79	89.7 Å²	89.7	42%	0.422	44%	0.44	S	S	.	.	H	α-helix	trans	-62.6	-38.4	176.4	-77.5	-20.2	0	0	0	112.1	I388 R394 I395 S396	I388-D392 PolarHBondContact O-N 3.47Å; D392-R394 VanDerWaalsContact C-N 3.34Å; D392-I395 PolarHBondContact O-N 3.23Å; D392-S396 WeakPolarHBondContact O-CB 3.44Å; D392-S396 PolarHBondContact O-N 2.84Å; D392-S396 PolarHBondContact O-OG 2.88Å
393	S	89.9	Confident	89.3	Confident	60 Å²	60	90.1 Å²	90.1	42%	0.42	44%	0.442	S	S	.	.	H	α-helix	trans	-65.1	-38.6	174.2	78.2	0	0	0	0	111.7	R389 T390 T391 S396 Q397	R389-S393 PolarHBondContact O-N 3.33Å; R389-S393 VanDerWaalsContact O-N 3.11Å; T390-S393 PolarHBondContact O-OG 3.44Å; T391-S393 VanDerWaalsContact C-N 3.32Å; T391-S393 PolarHBondContact O-N 2.99Å; S393-S396 PolarHBondContact O-N 3.34Å; S393-Q397 WeakPolarHBondContact O-CG 3.46Å; S393-Q397 PolarHBondContact O-N 2.76Å
394	R	89.8	Confident	89.1	Confident	168 Å²	168	90.9 Å²	90.9	63%	0.634	44%	0.44	S	S	*	.	H	α-helix	trans	-65.5	-45	175.7	-167	79	77.3	144	7.2	111.9	T390 T391 D392 S396 Q397 L398	T390-R394 PolarHBondContact O-N 2.92Å; T391-R394 WeakPolarHBondContact O-CB 3.34Å; T391-R394 PolarHBondContact O-N 2.95Å; T391-R394 VanDerWaalsContact O-N 3.13Å; D392-R394 VanDerWaalsContact C-N 3.34Å; R394-S396 VanDerWaalsContact C-N 3.28Å; R394-S396 PolarHBondContact O-N 2.95Å; R394-Q397 WeakPolarHBondContact O-CB 3.41Å; R394-Q397 PolarHBondContact O-N 3.09Å; R394-L398 HydrophobicContact CG-CD1 4.42Å; R394-L398 WeakPolarHBondContact O-CG 3.45Å; R394-L398 PolarHBondContact O-N 3.29Å
395	I	89	Confident	88.9	Confident	54 Å²	54	92.3 Å²	92.3	28%	0.277	45%	0.448	S	S	.	.	H	α-helix	trans	-59.2	-43.7	176.6	-70.1	168.2	0	0	0	109.9	L237 T391 D392 Q397 L398 L399	L237-I395 HydrophobicContact CD2-CD1 4.3Å; T391-I395 HydrophobicContact CG2-CD1 4.13Å; T391-I395 WeakPolarHBondContact O-CG1 3.47Å; T391-I395 PolarHBondContact O-N 3.05Å; D392-I395 PolarHBondContact O-N 3.23Å; I395-Q397 PolarHBondContact O-N 3.43Å; I395-L398 PolarHBondContact O-N 3.44Å; I395-L399 HydrophobicContact CG2-CD1 4.03Å; I395-L399 HydrophobicContact CG2-CG 4.42Å; I395-L399 WeakPolarHBondContact O-CG 3.38Å; I395-L399 PolarHBondContact O-N 2.78Å
396	S	88.1	Confident	88.5	Confident	68 Å²	68	90.7 Å²	90.7	48%	0.476	44%	0.444	S	S	.	.	H	α-helix	trans	-62.8	-40.2	178.3	-57.8	0	0	0	0	112.5	D392 S393 R394 T400	D392-S396 WeakPolarHBondContact O-CB 3.44Å; D392-S396 PolarHBondContact O-N 2.84Å; D392-S396 PolarHBondContact O-OG 2.88Å; S393-S396 PolarHBondContact O-N 3.34Å; R394-S396 VanDerWaalsContact C-N 3.28Å; R394-S396 PolarHBondContact O-N 2.95Å; S396-T400 PolarHBondContact O-N 2.83Å; S396-T400 VanDerWaalsContact O-N 3.1Å; S396-T400 PolarHBondContact O-OG1 3.23Å
397	Q	89.8	Confident	88.2	Confident	122 Å²	122	89 Å²	89	57%	0.57	44%	0.443	S	S	*	.	H	α-helix	trans	-63.2	-43.8	173.9	-72.8	173.1	-5	0	0	112	S393 R394 I395 T400 R401	S393-Q397 WeakPolarHBondContact O-CG 3.46Å; S393-Q397 PolarHBondContact O-N 2.76Å; R394-Q397 WeakPolarHBondContact O-CB 3.41Å; R394-Q397 PolarHBondContact O-N 3.09Å; I395-Q397 PolarHBondContact O-N 3.43Å; Q397-T400 PolarHBondContact O-N 2.8Å; Q397-R401 PolarHBondContact O-N 2.8Å
398	L	88.2	Confident	87.9	Confident	56 Å²	56	88.5 Å²	88.5	29%	0.293	44%	0.442	S	S	.	.	H	α-helix	trans	-65.8	-39.6	178.8	-70.6	172.5	0	0	0	112.3	R394 I395 T400 R401 L402	R394-L398 HydrophobicContact CG-CD1 4.42Å; R394-L398 WeakPolarHBondContact O-CG 3.45Å; R394-L398 PolarHBondContact O-N 3.29Å; I395-L398 PolarHBondContact O-N 3.44Å; L398-T400 VanDerWaalsContact C-N 3.33Å; L398-T400 PolarHBondContact O-N 3.48Å; L398-R401 WeakPolarHBondContact O-CB 3.2Å; L398-R401 PolarHBondContact O-N 2.79Å; L398-L402 PolarHBondContact O-N 2.58Å
399	L	89.6	Confident	87.4	Confident	90 Å²	90	90.1 Å²	90.1	47%	0.471	45%	0.451	S	S	.	.	H	α-helix	trans	-63	-40.4	174.7	-74.1	172.6	0	0	0	112	I395 R401 L402 Q403	I395-L399 HydrophobicContact CG2-CD1 4.03Å; I395-L399 HydrophobicContact CG2-CG 4.42Å; I395-L399 WeakPolarHBondContact O-CG 3.38Å; I395-L399 PolarHBondContact O-N 2.78Å; L399-R401 VanDerWaalsContact C-N 3.32Å; L399-L402 PolarHBondContact O-N 3.44Å; L399-Q403 WeakPolarHBondContact O-CG 3.28Å; L399-Q403 PolarHBondContact O-N 3.21Å
400	T	89.4	Confident	87	Confident	71 Å²	71	88.2 Å²	88.2	44%	0.436	45%	0.449	S	S	.	.	H	α-helix	trans	-62.9	-42.7	175	-48	0	0	0	0	110.4	S396 Q397 L398 L402 Q403 E404	S396-T400 PolarHBondContact O-N 2.83Å; S396-T400 VanDerWaalsContact O-N 3.1Å; S396-T400 PolarHBondContact O-OG1 3.23Å; Q397-T400 PolarHBondContact O-N 2.8Å; L398-T400 VanDerWaalsContact C-N 3.33Å; L398-T400 PolarHBondContact O-N 3.48Å; T400-L402 PolarHBondContact O-N 2.82Å; T400-Q403 WeakPolarHBondContact O-CB 3.36Å; T400-Q403 PolarHBondContact O-N 2.92Å; T400-Q403 VanDerWaalsContact O-N 3.17Å; T400-E404 WeakPolarHBondContact O-CG 3.48Å; T400-E404 PolarHBondContact O-N 3.36Å
401	R	88.1	Confident	86.7	Confident	148 Å²	148	88.1 Å²	88.1	56%	0.558	46%	0.455	S	S	*	.	H	α-helix	trans	-63.2	-39	177.1	-160.1	70.1	177.6	166.4	-1.9	112.9	Q397 L398 L399 Q403 E404 L405	Q397-R401 PolarHBondContact O-N 2.8Å; L398-R401 WeakPolarHBondContact O-CB 3.2Å; L398-R401 PolarHBondContact O-N 2.79Å; L399-R401 VanDerWaalsContact C-N 3.32Å; R401-Q403 VanDerWaalsContact C-N 3.35Å; R401-E404 IonicContact CZ-OE2 2.7Å; R401-E404 IonicContact NH1-OE2 2.92Å; R401-E404 PolarHBondContact NH1-OE2 3.37Å; R401-E404 PolarHBondContact O-N 2.62Å; R401-L405 HydrophobicContact CG-CD1 4.16Å; R401-L405 WeakPolarHBondContact O-CG 3.39Å; R401-L405 PolarHBondContact O-N 2.82Å
402	L	83.7	Confident	86.4	Confident	69 Å²	69	90.1 Å²	90.1	36%	0.361	46%	0.464	S	S	.	.	H	α-helix	trans	-63.4	-41.9	173.8	-92.6	170.6	0	0	0	111.5	M230 L398 L399 T400 E404 L405 T406	M230-L402 HydrophobicContact SD-CD1 3.95Å; L398-L402 PolarHBondContact O-N 2.58Å; L399-L402 PolarHBondContact O-N 3.44Å; T400-L402 PolarHBondContact O-N 2.82Å; L402-E404 VanDerWaalsContact C-N 3.31Å; L402-E404 PolarHBondContact O-N 2.85Å; L402-L405 PolarHBondContact O-N 2.92Å; L402-T406 PolarHBondContact O-N 2.74Å; L402-T406 PolarHBondContact O-OG1 2.84Å
403	Q	85.3	Confident	86	Confident	147 Å²	147	91 Å²	91	69%	0.687	47%	0.468	S	S	*	.	H	α-helix	trans	-63.9	-35.1	175.8	-73.9	-179.5	-18	0	0	112.6	L399 T400 R401 P407	L399-Q403 WeakPolarHBondContact O-CG 3.28Å; L399-Q403 PolarHBondContact O-N 3.21Å; T400-Q403 WeakPolarHBondContact O-CB 3.36Å; T400-Q403 PolarHBondContact O-N 2.92Å; T400-Q403 VanDerWaalsContact O-N 3.17Å; R401-Q403 VanDerWaalsContact C-N 3.35Å; Q403-P407 WeakPolarHBondContact O-CD 3.47Å
404	E	86.1	Confident	85.7	Confident	95 Å²	95	91.5 Å²	91.5	44%	0.444	47%	0.469	S	S	.	.	H	α-helix	trans	-67	-40.8	173.6	-70.2	173.1	178	0	0	112.5	T400 R401 L402 P407	T400-E404 WeakPolarHBondContact O-CG 3.48Å; T400-E404 PolarHBondContact O-N 3.36Å; R401-E404 IonicContact CZ-OE2 2.7Å; R401-E404 IonicContact NH1-OE2 2.92Å; R401-E404 PolarHBondContact NH1-OE2 3.37Å; R401-E404 PolarHBondContact O-N 2.62Å; L402-E404 VanDerWaalsContact C-N 3.31Å; L402-E404 PolarHBondContact O-N 2.85Å; E404-P407 VanDerWaalsContact O-CD 3.31Å; E404-P407 WeakPolarHBondContact O-CD 3.32Å; E404-P407 VanDerWaalsContact O-CG 3.3Å; E404-P407 WeakPolarHBondContact O-CG 3.31Å
405	L	84.1	Confident	85.2	Confident	55 Å²	55	91.5 Å²	91.5	29%	0.288	47%	0.47	S	S	.	.	H	α-helix	trans	-80.1	-26.1	-176.2	-74.7	162.4	0	0	0	114	R401 L402 E408 I409	R401-L405 HydrophobicContact CG-CD1 4.16Å; R401-L405 WeakPolarHBondContact O-CG 3.39Å; R401-L405 PolarHBondContact O-N 2.82Å; L402-L405 PolarHBondContact O-N 2.92Å; L405-E408 PolarHBondContact O-N 2.79Å; L405-I409 WeakPolarHBondContact O-CG1 3.27Å; L405-I409 PolarHBondContact O-N 2.98Å; L405-I409 VanDerWaalsContact O-N 3.12Å
406	T	84.8	Confident	84.7	Confident	63 Å²	63	92.7 Å²	92.7	39%	0.387	48%	0.476	S	S	.	.	H	α-helix	trans	-57.3	-48.8	-179.5	-52.8	0	0	0	0	113.3	L402 E408 I409 E410	L402-T406 PolarHBondContact O-N 2.74Å; L402-T406 PolarHBondContact O-OG1 2.84Å; T406-E408 VanDerWaalsContact C-N 3.31Å; T406-E408 PolarHBondContact O-N 3.09Å; T406-I409 PolarHBondContact O-N 3.05Å; T406-E410 WeakPolarHBondContact O-CG 3.45Å; T406-E410 PolarHBondContact O-N 2.95Å
407	P	84.4	Confident	84.5	Confident	72 Å²	72	96.2 Å²	96.2	47%	0.468	48%	0.483	S	S	.	.	H	α-helix	trans	-66.3	-29.6	177.6	25.8	-35.2	0	0	0	113.2	Q403 E404 E410 A411	Q403-P407 WeakPolarHBondContact O-CD 3.47Å; E404-P407 VanDerWaalsContact O-CD 3.31Å; E404-P407 WeakPolarHBondContact O-CD 3.32Å; E404-P407 VanDerWaalsContact O-CG 3.3Å; E404-P407 WeakPolarHBondContact O-CG 3.31Å; P407-E410 PolarHBondContact O-N 3.5Å; P407-A411 WeakPolarHBondContact O-CB 3.33Å; P407-A411 PolarHBondContact O-N 3.43Å
408	E	84.5	Confident	84.2	Confident	118 Å²	118	96.1 Å²	96.1	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-64.7	-43.4	174	-66.5	-178.2	-161.8	0	0	111	L405 T406 A411 I412	L405-E408 PolarHBondContact O-N 2.79Å; T406-E408 VanDerWaalsContact C-N 3.31Å; T406-E408 PolarHBondContact O-N 3.09Å; E408-A411 PolarHBondContact O-N 3.35Å; E408-I412 WeakPolarHBondContact O-CD1 3.5Å; E408-I412 VanDerWaalsContact O-CG1 3.28Å; E408-I412 WeakPolarHBondContact O-CG1 3.26Å; E408-I412 PolarHBondContact O-N 2.93Å
409	I	80.4	Confident	83.7	Confident	70 Å²	70	95.8 Å²	95.8	36%	0.359	48%	0.481	S	S	.	.	H	α-helix	trans	-64.8	-44.4	175.7	-65.2	170.2	0	0	0	110.7	L405 T406 A411 I412 L413	L405-I409 WeakPolarHBondContact O-CG1 3.27Å; L405-I409 PolarHBondContact O-N 2.98Å; L405-I409 VanDerWaalsContact O-N 3.12Å; T406-I409 PolarHBondContact O-N 3.05Å; I409-A411 VanDerWaalsContact C-N 3.27Å; I409-A411 PolarHBondContact O-N 3.39Å; I409-I412 PolarHBondContact O-N 3.39Å; I409-L413 HydrophobicContact CG2-CD1 4.41Å; I409-L413 WeakPolarHBondContact O-CG 3.35Å; I409-L413 PolarHBondContact O-N 2.85Å; I409-L413 VanDerWaalsContact O-N 3.13Å
410	E	82.7	Confident	83.3	Confident	128 Å²	128	96.6 Å²	96.6	60%	0.598	49%	0.485	S	S	*	.	H	α-helix	trans	-63.5	-32.6	178.4	-73	-177.5	168.4	0	0	112.6	T406 P407 P414	T406-E410 WeakPolarHBondContact O-CG 3.45Å; T406-E410 PolarHBondContact O-N 2.95Å; P407-E410 PolarHBondContact O-N 3.5Å; E410-P414 WeakPolarHBondContact O-CD 3.2Å
411	A	83.4	Confident	83	Confident	69 Å²	69	99.5 Å²	99.5	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-71.5	-31	174.5	0	0	0	0	0	113.2	P407 E408 I409 P414	P407-A411 WeakPolarHBondContact O-CB 3.33Å; P407-A411 PolarHBondContact O-N 3.43Å; E408-A411 PolarHBondContact O-N 3.35Å; I409-A411 VanDerWaalsContact C-N 3.27Å; I409-A411 PolarHBondContact O-N 3.39Å; A411-P414 WeakPolarHBondContact O-CD 3.28Å
412	I	82.7	Confident	82.9	Confident	91 Å²	91	97.4 Å²	97.4	47%	0.467	49%	0.49	S	S	.	.	H	α-helix	trans	-79.3	-35.1	-178.9	-67.7	165.8	0	0	0	111.9	E408 I409 R415 L416	E408-I412 WeakPolarHBondContact O-CD1 3.5Å; E408-I412 VanDerWaalsContact O-CG1 3.28Å; E408-I412 WeakPolarHBondContact O-CG1 3.26Å; E408-I412 PolarHBondContact O-N 2.93Å; I409-I412 PolarHBondContact O-N 3.39Å; I412-R415 PolarHBondContact O-N 3.46Å; I412-L416 PolarHBondContact O-N 3.3Å
413	L	82.5	Confident	82.6	Confident	97 Å²	97	96.3 Å²	96.3	51%	0.508	49%	0.487	S	S	.	.	H	α-helix	trans	-55	-47.1	-177.6	-78.8	172.9	0	0	0	116.1	I409 R415 L416 K417	I409-L413 HydrophobicContact CG2-CD1 4.41Å; I409-L413 WeakPolarHBondContact O-CG 3.35Å; I409-L413 PolarHBondContact O-N 2.85Å; I409-L413 VanDerWaalsContact O-N 3.13Å; L413-R415 VanDerWaalsContact C-N 3.32Å; L413-L416 PolarHBondContact O-N 2.93Å; L413-K417 PolarHBondContact O-N 3.01Å
414	P	83.2	Confident	82.4	Confident	70 Å²	70	91.9 Å²	91.9	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-65.5	-38.3	178.3	23.3	-31.8	0	0	0	111.7	E410 A411 L416 K417 E418	E410-P414 WeakPolarHBondContact O-CD 3.2Å; A411-P414 WeakPolarHBondContact O-CD 3.28Å; P414-L416 VanDerWaalsContact C-N 3.27Å; P414-L416 PolarHBondContact O-N 2.97Å; P414-K417 WeakPolarHBondContact O-CB 3.04Å; P414-K417 PolarHBondContact O-N 3.25Å; P414-K417 VanDerWaalsContact O-N 3.12Å; P414-E418 PolarHBondContact O-N 3.42Å
415	R	78.9	Confident	82.3	Confident	169 Å²	169	90.1 Å²	90.1	64%	0.638	47%	0.474	S	S	*	.	H	α-helix	trans	-65.3	-33.4	178.9	-159.6	161.7	-173.1	168.1	-0.2	112.2	I412 L413 L419	I412-R415 PolarHBondContact O-N 3.46Å; L413-R415 VanDerWaalsContact C-N 3.32Å; R415-L419 WeakPolarHBondContact O-CB 3.44Å; R415-L419 PolarHBondContact O-N 3.39Å
416	L	79.3	Confident	82.2	Confident	79 Å²	79	92.8 Å²	92.8	41%	0.414	49%	0.488	S	S	.	.	H	α-helix	trans	-69.2	-36.2	174.1	-160.7	149.3	0	0	0	112.2	L216 I412 L413 P414 L419 D420	L216-L416 HydrophobicContact CD1-CD1 3.21Å; I412-L416 PolarHBondContact O-N 3.3Å; L413-L416 PolarHBondContact O-N 2.93Å; P414-L416 VanDerWaalsContact C-N 3.27Å; P414-L416 PolarHBondContact O-N 2.97Å; L416-L419 PolarHBondContact O-N 3.33Å; L416-D420 WeakPolarHBondContact O-CB 3.23Å; L416-D420 PolarHBondContact O-N 3.22Å
417	K	82.7	Confident	81.9	Confident	141 Å²	141	95.6 Å²	95.6	61%	0.613	50%	0.496	S	S	*	.	H	α-helix	trans	-68.1	-44.7	176	-72.2	-176.6	179.8	179.4	0	112.8	L413 P414 L419 D420 E421	L413-K417 PolarHBondContact O-N 3.01Å; P414-K417 WeakPolarHBondContact O-CB 3.04Å; P414-K417 PolarHBondContact O-N 3.25Å; P414-K417 VanDerWaalsContact O-N 3.12Å; K417-L419 PolarHBondContact O-N 2.89Å; K417-D420 PolarHBondContact O-N 2.98Å; K417-E421 WeakPolarHBondContact O-CG 3.31Å; K417-E421 PolarHBondContact O-N 3.44Å
418	E	83.5	Confident	81.8	Confident	121 Å²	121	98.4 Å²	98.4	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-56.3	-44.6	174.5	-73.9	177	171.5	0	0	110.4	P414 E421 E422	P414-E418 PolarHBondContact O-N 3.42Å; E418-E421 PolarHBondContact O-N 2.98Å; E418-E422 WeakPolarHBondContact O-CG 3.29Å; E418-E422 PolarHBondContact O-N 3.49Å
419	L	78	Confident	81.9	Confident	49 Å²	49	102 Å²	102	26%	0.257	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-38.3	179.6	-148.6	71.1	0	0	0	112.9	V209 R415 L416 K417 E422 T423	V209-L419 HydrophobicContact CB-CD2 4.3Å; V209-L419 HydrophobicContact CG1-CD2 4.19Å; V209-L419 HydrophobicContact CG2-CD1 4.25Å; V209-L419 HydrophobicContact CG2-CD2 3.65Å; V209-L419 HydrophobicContact CG2-CG 4.1Å; R415-L419 WeakPolarHBondContact O-CB 3.44Å; R415-L419 PolarHBondContact O-N 3.39Å; L416-L419 PolarHBondContact O-N 3.33Å; K417-L419 PolarHBondContact O-N 2.89Å; L419-E422 PolarHBondContact O-N 3.13Å; L419-T423 PolarHBondContact O-N 3.25Å; L419-T423 PolarHBondContact O-OG1 3.49Å
420	D	80.9	Confident	81.9	Confident	106 Å²	106	103.7 Å²	103.7	57%	0.567	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-42.3	176.5	-164.8	53.4	0	0	0	111.3	L416 K417 T423 S424	L416-D420 WeakPolarHBondContact O-CB 3.23Å; L416-D420 PolarHBondContact O-N 3.22Å; K417-D420 PolarHBondContact O-N 2.98Å; D420-T423 VanDerWaalsContact CA-OG1 3.3Å; D420-T423 WeakPolarHBondContact CA-OG1 3.33Å; D420-T423 PolarHBondContact O-N 3.36Å; D420-T423 PolarHBondContact O-OG1 2.99Å; D420-S424 WeakPolarHBondContact O-CB 3.44Å; D420-S424 PolarHBondContact O-N 2.7Å
421	E	84.5	Confident	81.8	Confident	133 Å²	133	103.9 Å²	103.9	62%	0.621	52%	0.522	S	S	*	.	H	α-helix	trans	-61.6	-42.5	174	-71.9	179.2	-175.8	0	0	111.6	K417 E418 S424 A425	K417-E421 WeakPolarHBondContact O-CG 3.31Å; K417-E421 PolarHBondContact O-N 3.44Å; E418-E421 PolarHBondContact O-N 2.98Å; E421-S424 PolarHBondContact O-N 3.45Å; E421-A425 WeakPolarHBondContact O-CB 3.36Å; E421-A425 PolarHBondContact O-N 2.92Å
422	E	85.3	Confident	81.7	Confident	103 Å²	103	103 Å²	103	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-45.4	174.9	-74.3	178.6	-177.9	0	0	112.3	E418 L419 S424 A425 L426	E418-E422 WeakPolarHBondContact O-CG 3.29Å; E418-E422 PolarHBondContact O-N 3.49Å; L419-E422 PolarHBondContact O-N 3.13Å; E422-S424 PolarHBondContact O-N 2.97Å; E422-A425 PolarHBondContact O-N 2.66Å; E422-L426 PolarHBondContact O-N 3.12Å
423	T	77.9	Confident	81.7	Confident	47 Å²	47	104 Å²	104	29%	0.288	52%	0.52	S	S	.	.	H	α-helix	trans	-63.5	-40.5	176	36	0	0	0	0	112.3	L419 D420 A425 L426 E427	L419-T423 PolarHBondContact O-N 3.25Å; L419-T423 PolarHBondContact O-OG1 3.49Å; D420-T423 VanDerWaalsContact CA-OG1 3.3Å; D420-T423 WeakPolarHBondContact CA-OG1 3.33Å; D420-T423 PolarHBondContact O-N 3.36Å; D420-T423 PolarHBondContact O-OG1 2.99Å; T423-A425 VanDerWaalsContact C-N 3.34Å; T423-A425 PolarHBondContact O-N 2.86Å; T423-L426 PolarHBondContact O-N 3.49Å; T423-E427 WeakPolarHBondContact O-CG 2.88Å; T423-E427 PolarHBondContact O-N 3.24Å
424	S	81.4	Confident	81.7	Confident	53 Å²	53	103 Å²	103	37%	0.371	52%	0.516	S	S	.	.	H	α-helix	trans	-64.5	-39.7	176.9	-168.9	0	0	0	0	111.8	D420 E421 E422 L426 E427 Q428	D420-S424 WeakPolarHBondContact O-CB 3.44Å; D420-S424 PolarHBondContact O-N 2.7Å; E421-S424 PolarHBondContact O-N 3.45Å; E422-S424 PolarHBondContact O-N 2.97Å; S424-L426 VanDerWaalsContact C-N 3.34Å; S424-E427 PolarHBondContact O-N 3.07Å; S424-Q428 WeakPolarHBondContact O-CG 3.3Å; S424-Q428 PolarHBondContact O-N 2.77Å
425	A	84.2	Confident	81.5	Confident	58 Å²	58	102 Å²	102	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-40	174	0	0	0	0	0	111.9	E421 E422 T423 R429	E421-A425 WeakPolarHBondContact O-CB 3.36Å; E421-A425 PolarHBondContact O-N 2.92Å; E422-A425 PolarHBondContact O-N 2.66Å; T423-A425 VanDerWaalsContact C-N 3.34Å; T423-A425 PolarHBondContact O-N 2.86Å; A425-R429 WeakPolarHBondContact O-CB 3.37Å; A425-R429 PolarHBondContact O-N 3.21Å; A425-R429 VanDerWaalsContact O-N 3.15Å
426	L	80.6	Confident	81.8	Confident	112 Å²	112	100 Å²	100	59%	0.586	51%	0.511	S	S	*	.	H	α-helix	trans	-65.4	-43.5	174.9	-116.4	92.1	0	0	0	112.2	E422 T423 S424 R429 L430	E422-L426 PolarHBondContact O-N 3.12Å; T423-L426 PolarHBondContact O-N 3.49Å; S424-L426 VanDerWaalsContact C-N 3.34Å; L426-R429 WeakPolarHBondContact O-CB 3.3Å; L426-R429 PolarHBondContact O-N 3.33Å; L426-R429 VanDerWaalsContact O-N 3.16Å; L426-L430 WeakPolarHBondContact O-CB 3.3Å; L426-L430 PolarHBondContact O-N 3.01Å
427	E	79.8	Confident	82	Confident	122 Å²	122	101.4 Å²	101.4	57%	0.57	52%	0.519	S	S	*	.	H	α-helix	trans	-61.7	-44	178.4	-77.5	-177.9	172.8	0	0	112	T423 S424 R429 L430 Q431	T423-E427 WeakPolarHBondContact O-CG 2.88Å; T423-E427 PolarHBondContact O-N 3.24Å; S424-E427 PolarHBondContact O-N 3.07Å; E427-R429 VanDerWaalsContact C-N 3.26Å; E427-R429 PolarHBondContact O-N 2.86Å; E427-L430 PolarHBondContact O-N 3.22Å; E427-Q431 WeakPolarHBondContact O-CG 3.45Å; E427-Q431 PolarHBondContact O-N 2.91Å
428	Q	82.3	Confident	81.9	Confident	131 Å²	131	100.1 Å²	100.1	61%	0.612	52%	0.517	S	S	*	.	H	α-helix	trans	-60.7	-38.7	174.6	-72.9	-179.7	13.3	0	0	111.5	S424 Q431 A432	S424-Q428 WeakPolarHBondContact O-CG 3.3Å; S424-Q428 PolarHBondContact O-N 2.77Å; Q428-Q431 PolarHBondContact O-N 3.23Å; Q428-A432 PolarHBondContact O-N 3.49Å
429	R	84.9	Confident	81.8	Confident	193 Å²	193	99.4 Å²	99.4	73%	0.728	52%	0.517	S	S	*	.	H	α-helix	trans	-69.3	-38.1	177.9	-163.7	159.8	-171.2	153.8	1	112.3	A425 L426 E427 Q431 A432 L433	A425-R429 WeakPolarHBondContact O-CB 3.37Å; A425-R429 PolarHBondContact O-N 3.21Å; A425-R429 VanDerWaalsContact O-N 3.15Å; L426-R429 WeakPolarHBondContact O-CB 3.3Å; L426-R429 PolarHBondContact O-N 3.33Å; L426-R429 VanDerWaalsContact O-N 3.16Å; E427-R429 VanDerWaalsContact C-N 3.26Å; E427-R429 PolarHBondContact O-N 2.86Å; R429-Q431 VanDerWaalsContact C-N 3.35Å; R429-A432 PolarHBondContact O-N 2.94Å; R429-L433 PolarHBondContact O-N 3.16Å
430	L	81.4	Confident	81.9	Confident	105 Å²	105	102.9 Å²	102.9	55%	0.55	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-41.6	174	-156	170	0	0	0	110.5	L426 E427 L433 N434	L426-L430 WeakPolarHBondContact O-CB 3.3Å; L426-L430 PolarHBondContact O-N 3.01Å; E427-L430 PolarHBondContact O-N 3.22Å; L430-L433 PolarHBondContact O-N 3.08Å; L430-N434 WeakPolarHBondContact CD2-ND2 3.44Å; L430-N434 WeakPolarHBondContact O-CB 3.45Å; L430-N434 PolarHBondContact O-N 2.75Å
431	Q	79.7	Confident	82	Confident	133 Å²	133	103 Å²	103	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-62.3	-43.2	174	-73.1	177.4	7.5	0	0	112.6	E427 Q428 R429 N434 A435	E427-Q431 WeakPolarHBondContact O-CG 3.45Å; E427-Q431 PolarHBondContact O-N 2.91Å; Q428-Q431 PolarHBondContact O-N 3.23Å; R429-Q431 VanDerWaalsContact C-N 3.35Å; Q431-N434 PolarHBondContact O-N 3.12Å; Q431-A435 PolarHBondContact O-N 2.95Å
432	A	83.3	Confident	81.7	Confident	51 Å²	51	99.9 Å²	99.9	42%	0.421	53%	0.529	S	S	.	.	H	α-helix	trans	-61.1	-45.6	175.5	0	0	0	0	0	111.6	Q428 R429 N434 A435 E436	Q428-A432 PolarHBondContact O-N 3.49Å; R429-A432 PolarHBondContact O-N 2.94Å; A432-N434 VanDerWaalsContact C-N 3.33Å; A432-N434 PolarHBondContact O-N 3.21Å; A432-A435 WeakPolarHBondContact O-CB 3.45Å; A432-A435 PolarHBondContact O-N 2.77Å; A432-E436 PolarHBondContact O-N 3.42Å
433	L	82.2	Confident	81.4	Confident	110 Å²	110	97.3 Å²	97.3	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-64	-37.9	177.4	-134.6	79.7	0	0	0	112.3	R429 L430 A435 E436 L437	R429-L433 PolarHBondContact O-N 3.16Å; L430-L433 PolarHBondContact O-N 3.08Å; L433-A435 VanDerWaalsContact C-N 3.35Å; L433-E436 PolarHBondContact O-N 3.41Å; L433-L437 WeakPolarHBondContact O-CB 3.39Å; L433-L437 PolarHBondContact O-N 3.31Å
434	N	81.5	Confident	81.5	Confident	78 Å²	78	101.3 Å²	101.3	42%	0.417	54%	0.539	S	S	.	.	H	α-helix	trans	-66.6	-36	174.8	-83.2	-19.6	0	0	0	112.2	L430 Q431 A432 L437 I438	L430-N434 WeakPolarHBondContact CD2-ND2 3.44Å; L430-N434 WeakPolarHBondContact O-CB 3.45Å; L430-N434 PolarHBondContact O-N 2.75Å; Q431-N434 PolarHBondContact O-N 3.12Å; A432-N434 VanDerWaalsContact C-N 3.33Å; A432-N434 PolarHBondContact O-N 3.21Å; N434-L437 WeakPolarHBondContact O-CB 3.21Å; N434-L437 PolarHBondContact O-N 3.4Å; N434-I438 VanDerWaalsContact O-CG1 3.25Å; N434-I438 WeakPolarHBondContact O-CG1 3.19Å; N434-I438 PolarHBondContact O-N 2.93Å
435	A	80.3	Confident	81.5	Confident	49 Å²	49	104.9 Å²	104.9	41%	0.405	55%	0.548	S	S	.	.	H	α-helix	trans	-64.6	-45.9	173.6	0	0	0	0	0	111	Q431 A432 L433 L437 I438 D439	Q431-A435 PolarHBondContact O-N 2.95Å; A432-A435 WeakPolarHBondContact O-CB 3.45Å; A432-A435 PolarHBondContact O-N 2.77Å; L433-A435 VanDerWaalsContact C-N 3.35Å; A435-L437 VanDerWaalsContact C-N 3.28Å; A435-L437 PolarHBondContact O-N 2.89Å; A435-I438 PolarHBondContact O-N 2.93Å; A435-I438 VanDerWaalsContact O-N 3.12Å; A435-D439 PolarHBondContact O-N 3.38Å
436	E	85.4	Confident	81.3	Confident	125 Å²	125	106 Å²	106	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-59	-39.9	173.6	-71	177.9	-171.2	0	0	112	A432 L433 D439 L440	A432-E436 PolarHBondContact O-N 3.42Å; L433-E436 PolarHBondContact O-N 3.41Å; E436-D439 PolarHBondContact O-N 2.93Å; E436-L440 VanDerWaalsContact O-CB 3.29Å; E436-L440 WeakPolarHBondContact O-CB 3.22Å; E436-L440 PolarHBondContact O-N 3.29Å
437	L	81.5	Confident	81.2	Confident	110 Å²	110	105.4 Å²	105.4	58%	0.576	55%	0.553	S	S	*	*	H	α-helix	trans	-63.4	-41.7	175.6	-167.2	92.3	0	0	0	111.6	L433 N434 A435 L440 N441	L433-L437 WeakPolarHBondContact O-CB 3.39Å; L433-L437 PolarHBondContact O-N 3.31Å; N434-L437 WeakPolarHBondContact O-CB 3.21Å; N434-L437 PolarHBondContact O-N 3.4Å; A435-L437 VanDerWaalsContact C-N 3.28Å; A435-L437 PolarHBondContact O-N 2.89Å; L437-L440 PolarHBondContact O-N 3.17Å; L437-N441 WeakPolarHBondContact O-CB 3.43Å; L437-N441 PolarHBondContact O-N 2.89Å
438	I	81.5	Confident	81.2	Confident	113 Å²	113	103.2 Å²	103.2	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-64.2	-45.6	176.9	-69.8	163.5	0	0	0	110.3	N434 A435 N441 S442	N434-I438 VanDerWaalsContact O-CG1 3.25Å; N434-I438 WeakPolarHBondContact O-CG1 3.19Å; N434-I438 PolarHBondContact O-N 2.93Å; A435-I438 PolarHBondContact O-N 2.93Å; A435-I438 VanDerWaalsContact O-N 3.12Å; I438-N441 PolarHBondContact O-N 3.28Å; I438-S442 WeakPolarHBondContact O-CB 3.36Å; I438-S442 PolarHBondContact O-N 3.43Å
439	D	81.3	Confident	81.1	Confident	106 Å²	106	100.9 Å²	100.9	57%	0.567	54%	0.535	S	S	*	.	H	α-helix	trans	-61.9	-45.7	178.2	-72.6	-19.5	0	0	0	110.7	A435 E436 N441 S442 A443	A435-D439 PolarHBondContact O-N 3.38Å; E436-D439 PolarHBondContact O-N 2.93Å; D439-N441 VanDerWaalsContact C-N 3.34Å; D439-N441 PolarHBondContact O-N 3.37Å; D439-S442 PolarHBondContact O-N 3.44Å; D439-S442 PolarHBondContact O-OG 2.83Å; D439-A443 PolarHBondContact O-N 3.13Å
440	L	80.2	Confident	80.9	Confident	123 Å²	123	96 Å²	96	64%	0.644	52%	0.52	S	S	*	.	H	α-helix	trans	-62.9	-40.4	176.7	-169.7	65.8	0	0	0	111.9	E436 L437 S442 A443 F444	E436-L440 VanDerWaalsContact O-CB 3.29Å; E436-L440 WeakPolarHBondContact O-CB 3.22Å; E436-L440 PolarHBondContact O-N 3.29Å; L437-L440 PolarHBondContact O-N 3.17Å; L440-S442 VanDerWaalsContact C-N 3.34Å; L440-A443 PolarHBondContact O-N 2.84Å; L440-F444 WeakPolarHBondContact O-CB 3.45Å; L440-F444 PolarHBondContact O-N 3.12Å
441	N	82.2	Confident	80.9	Confident	107 Å²	107	96.4 Å²	96.4	57%	0.572	52%	0.519	S	S	*	.	H	α-helix	trans	-69.9	-33.1	178	-156.3	20.4	0	0	0	111.6	L437 I438 D439 K445	L437-N441 WeakPolarHBondContact O-CB 3.43Å; L437-N441 PolarHBondContact O-N 2.89Å; I438-N441 PolarHBondContact O-N 3.28Å; D439-N441 VanDerWaalsContact C-N 3.34Å; D439-N441 PolarHBondContact O-N 3.37Å; N441-K445 WeakPolarHBondContact O-CB 3.34Å; N441-K445 PolarHBondContact O-N 3.29Å
442	S	79.1	Confident	80.9	Confident	69 Å²	69	95.7 Å²	95.7	48%	0.483	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-41.4	172.8	81.4	0	0	0	0	112	I438 D439 L440 K445 S446	I438-S442 WeakPolarHBondContact O-CB 3.36Å; I438-S442 PolarHBondContact O-N 3.43Å; D439-S442 PolarHBondContact O-N 3.44Å; D439-S442 PolarHBondContact O-OG 2.83Å; L440-S442 VanDerWaalsContact C-N 3.34Å; S442-K445 PolarHBondContact O-N 3.39Å; S442-S446 PolarHBondContact O-N 2.93Å
443	A	79.3	Confident	80.7	Confident	49 Å²	49	101.2 Å²	101.2	41%	0.405	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-44	174.4	0	0	0	0	0	111.2	D439 L440 K445 S446 V447	D439-A443 PolarHBondContact O-N 3.13Å; L440-A443 PolarHBondContact O-N 2.84Å; A443-K445 VanDerWaalsContact C-N 3.32Å; A443-K445 PolarHBondContact O-N 3.35Å; A443-S446 WeakPolarHBondContact O-CB 3.02Å; A443-S446 PolarHBondContact O-N 3.32Å; A443-V447 WeakPolarHBondContact O-CG2 3.49Å; A443-V447 PolarHBondContact O-N 2.85Å
444	F	79.9	Confident	80.4	Confident	130 Å²	130	100.4 Å²	100.4	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-58.7	-44.2	174.4	-177.3	-97.2	0	0	0	111.5	L440 S446 V447 Q448	L440-F444 WeakPolarHBondContact O-CB 3.45Å; L440-F444 PolarHBondContact O-N 3.12Å; F444-S446 PolarHBondContact O-N 2.99Å; F444-V447 PolarHBondContact O-N 3.39Å; F444-Q448 WeakPolarHBondContact O-CB 3.36Å; F444-Q448 PolarHBondContact O-N 3.04Å
445	K	80	Confident	80.2	Confident	128 Å²	128	101.2 Å²	101.2	56%	0.557	52%	0.524	S	S	*	.	H	α-helix	trans	-63.6	-39.8	176.6	-168.3	168.6	-177.7	175.8	0	112.4	N441 S442 A443 V447 Q448 D449	N441-K445 WeakPolarHBondContact O-CB 3.34Å; N441-K445 PolarHBondContact O-N 3.29Å; S442-K445 PolarHBondContact O-N 3.39Å; A443-K445 VanDerWaalsContact C-N 3.32Å; A443-K445 PolarHBondContact O-N 3.35Å; K445-V447 VanDerWaalsContact C-N 3.35Å; K445-V447 PolarHBondContact O-N 3.3Å; K445-Q448 PolarHBondContact O-N 3Å; K445-D449 WeakPolarHBondContact O-CB 3.31Å; K445-D449 PolarHBondContact O-N 3.01Å
446	S	80.3	Confident	80.1	Confident	81 Å²	81	101.8 Å²	101.8	57%	0.566	53%	0.528	S	S	*	.	H	α-helix	trans	-62.4	-41.4	173.9	-172.7	0	0	0	0	112.2	S442 A443 F444 Q448 D449 E450	S442-S446 PolarHBondContact O-N 2.93Å; A443-S446 WeakPolarHBondContact O-CB 3.02Å; A443-S446 PolarHBondContact O-N 3.32Å; F444-S446 PolarHBondContact O-N 2.99Å; S446-Q448 VanDerWaalsContact C-N 3.34Å; S446-D449 PolarHBondContact O-N 2.94Å; S446-E450 PolarHBondContact O-N 3.05Å
447	V	79.1	Confident	79.7	Confident	101 Å²	101	100 Å²	100	61%	0.612	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-40.1	175.4	172.7	0	0	0	0	110.6	A443 F444 K445 E450 E451	A443-V447 WeakPolarHBondContact O-CG2 3.49Å; A443-V447 PolarHBondContact O-N 2.85Å; F444-V447 PolarHBondContact O-N 3.39Å; K445-V447 VanDerWaalsContact C-N 3.35Å; K445-V447 PolarHBondContact O-N 3.3Å; V447-E450 PolarHBondContact O-N 3.38Å; V447-E451 WeakPolarHBondContact O-CB 3.47Å; V447-E451 PolarHBondContact O-N 3.15Å
448	Q	79.7	Confident	79.4	Confident	75 Å²	75	98.1 Å²	98.1	35%	0.35	51%	0.514	S	S	.	.	H	α-helix	trans	-67.5	-37.5	178	-164.6	-177.2	13.2	0	0	112.6	F444 K445 S446 E451 K452	F444-Q448 WeakPolarHBondContact O-CB 3.36Å; F444-Q448 PolarHBondContact O-N 3.04Å; K445-Q448 PolarHBondContact O-N 3Å; S446-Q448 VanDerWaalsContact C-N 3.34Å; Q448-E451 PolarHBondContact O-N 3.14Å; Q448-K452 WeakPolarHBondContact O-CG 3.45Å; Q448-K452 PolarHBondContact O-N 3.25Å
449	D	80.8	Confident	79	Confident	83 Å²	83	95.6 Å²	95.6	44%	0.444	51%	0.507	S	S	.	.	H	α-helix	trans	-68.7	-37.5	175.1	-73.9	-23.3	0	0	0	111.1	K445 S446 K452 R453	K445-D449 WeakPolarHBondContact O-CB 3.31Å; K445-D449 PolarHBondContact O-N 3.01Å; S446-D449 PolarHBondContact O-N 2.94Å; D449-K452 PolarHBondContact O-N 2.94Å; D449-R453 WeakPolarHBondContact O-CB 3.45Å; D449-R453 PolarHBondContact O-N 3.36Å
450	E	80.1	Confident	78.7	Confident	89 Å²	89	95.4 Å²	95.4	42%	0.416	50%	0.503	S	S	.	.	H	α-helix	trans	-68.2	-39.7	173.1	-168.2	60.7	-159.8	0	0	112	S446 V447 K452 R453 L454	S446-E450 PolarHBondContact O-N 3.05Å; V447-E450 PolarHBondContact O-N 3.38Å; E450-K452 PolarHBondContact O-N 3.33Å; E450-R453 WeakPolarHBondContact O-CB 3.32Å; E450-R453 PolarHBondContact O-N 3.15Å; E450-R453 VanDerWaalsContact O-N 3.14Å; E450-L454 HydrophobicContact CG-CD1 4.39Å; E450-L454 WeakPolarHBondContact O-CG 3.28Å; E450-L454 PolarHBondContact O-N 3.21Å
451	E	81.2	Confident	78.1	Confident	114 Å²	114	94.1 Å²	94.1	53%	0.533	50%	0.496	S	S	.	.	H	α-helix	trans	-57.5	-47.4	172.4	-175.8	-168.7	-164.2	0	0	110.9	V447 Q448 R453 L454 L455	V447-E451 WeakPolarHBondContact O-CB 3.47Å; V447-E451 PolarHBondContact O-N 3.15Å; Q448-E451 PolarHBondContact O-N 3.14Å; E451-R453 VanDerWaalsContact C-N 3.29Å; E451-R453 PolarHBondContact O-N 2.86Å; E451-L454 PolarHBondContact O-N 3.35Å; E451-L455 HydrophobicContact CG-CD1 4.05Å; E451-L455 WeakPolarHBondContact O-CB 3.37Å; E451-L455 PolarHBondContact O-N 3.05Å
452	K	79.2	Confident	77.4	Confident	118 Å²	118	94.3 Å²	94.3	51%	0.513	49%	0.493	S	S	.	.	H	α-helix	trans	-60.9	-38.6	175.2	-75.9	175.7	-175.2	169.4	0	112.2	Q448 D449 E450 L455 A456	Q448-K452 WeakPolarHBondContact O-CG 3.45Å; Q448-K452 PolarHBondContact O-N 3.25Å; D449-K452 PolarHBondContact O-N 2.94Å; E450-K452 PolarHBondContact O-N 3.33Å; K452-L455 PolarHBondContact O-N 3.33Å; K452-A456 WeakPolarHBondContact O-CB 3.42Å; K452-A456 PolarHBondContact O-N 3.47Å
453	R	79.2	Confident	76.8	Confident	167 Å²	167	96.9 Å²	96.9	63%	0.63	50%	0.498	S	S	*	.	H	α-helix	trans	-65.6	-45	178.4	-151.5	-179	-166.6	-177.8	2.9	111.3	D449 E450 E451 A456 I457	D449-R453 WeakPolarHBondContact O-CB 3.45Å; D449-R453 PolarHBondContact O-N 3.36Å; E450-R453 WeakPolarHBondContact O-CB 3.32Å; E450-R453 PolarHBondContact O-N 3.15Å; E450-R453 VanDerWaalsContact O-N 3.14Å; E451-R453 VanDerWaalsContact C-N 3.29Å; E451-R453 PolarHBondContact O-N 2.86Å; R453-A456 PolarHBondContact O-N 3.46Å; R453-I457 WeakPolarHBondContact O-CG1 3.49Å; R453-I457 PolarHBondContact O-N 3.42Å
454	L	77.1	Confident	76	Confident	94 Å²	94	97.6 Å²	97.6	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-42.3	174.2	-72.8	168	0	0	0	111.4	E450 E451 A456 I457 V458	E450-L454 HydrophobicContact CG-CD1 4.39Å; E450-L454 WeakPolarHBondContact O-CG 3.28Å; E450-L454 PolarHBondContact O-N 3.21Å; E451-L454 PolarHBondContact O-N 3.35Å; L454-A456 VanDerWaalsContact C-N 3.35Å; L454-A456 PolarHBondContact O-N 3.33Å; L454-I457 PolarHBondContact O-N 2.67Å; L454-V458 VanDerWaalsContact O-CG2 3.29Å; L454-V458 WeakPolarHBondContact O-CG2 3.45Å; L454-V458 PolarHBondContact O-N 3.18Å
455	L	77.8	Confident	75	Confident	95 Å²	95	96.4 Å²	96.4	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-43.6	173.5	-87.5	159.1	0	0	0	111.8	E451 K452 V458 S459	E451-L455 HydrophobicContact CG-CD1 4.05Å; E451-L455 WeakPolarHBondContact O-CB 3.37Å; E451-L455 PolarHBondContact O-N 3.05Å; K452-L455 PolarHBondContact O-N 3.33Å; L455-V458 PolarHBondContact O-N 2.86Å; L455-S459 PolarHBondContact O-N 3.24Å; L455-S459 PolarHBondContact O-OG 2.98Å
456	A	76.7	Confident	74	Confident	60 Å²	60	98.2 Å²	98.2	50%	0.496	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-40.8	175.8	0	0	0	0	0	112	K452 R453 L454 V458 S459 Q460	K452-A456 WeakPolarHBondContact O-CB 3.42Å; K452-A456 PolarHBondContact O-N 3.47Å; R453-A456 PolarHBondContact O-N 3.46Å; L454-A456 VanDerWaalsContact C-N 3.35Å; L454-A456 PolarHBondContact O-N 3.33Å; A456-V458 VanDerWaalsContact C-N 3.35Å; A456-S459 PolarHBondContact O-N 3.24Å; A456-Q460 WeakPolarHBondContact O-CB 3.37Å; A456-Q460 PolarHBondContact O-N 3.22Å
457	I	76.8	Confident	72.3	Confident	89 Å²	89	98.3 Å²	98.3	46%	0.456	51%	0.506	S	S	.	.	H	α-helix	trans	-63.2	-42.4	173.7	-68.1	164.8	0	0	0	110.6	R453 L454 Q460 L461	R453-I457 WeakPolarHBondContact O-CG1 3.49Å; R453-I457 PolarHBondContact O-N 3.42Å; L454-I457 PolarHBondContact O-N 2.67Å; I457-Q460 PolarHBondContact O-N 3.2Å; I457-L461 HydrophobicContact CG2-CD1 3.8Å; I457-L461 HydrophobicContact CG2-CG 4.3Å; I457-L461 WeakPolarHBondContact O-CB 3.45Å; I457-L461 VanDerWaalsContact O-CG 3.26Å; I457-L461 WeakPolarHBondContact O-CG 3.44Å; I457-L461 PolarHBondContact O-N 2.92Å
458	V	75.5	Confident	70.5	Confident	69 Å²	69	102 Å²	102	42%	0.418	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-44.2	177	169.6	0	0	0	0	110.8	L454 L455 A456 L461 Q462	L454-V458 VanDerWaalsContact O-CG2 3.29Å; L454-V458 WeakPolarHBondContact O-CG2 3.45Å; L454-V458 PolarHBondContact O-N 3.18Å; L455-V458 PolarHBondContact O-N 2.86Å; A456-V458 VanDerWaalsContact C-N 3.35Å; V458-L461 PolarHBondContact O-N 3.32Å; V458-Q462 HydrophobicContact CG1-CG 4.39Å; V458-Q462 WeakPolarHBondContact O-CB 3.24Å; V458-Q462 VanDerWaalsContact O-CG 3.23Å; V458-Q462 WeakPolarHBondContact O-CG 3.33Å; V458-Q462 PolarHBondContact O-N 3.46Å
459	S	74.1	Confident	68.5	Low	61 Å²	61	107.4 Å²	107.4	43%	0.427	54%	0.537	S	S	.	.	H	α-helix	trans	-62.4	-43	175.3	-66.9	0	0	0	0	111.8	L455 A456 Q462 E463	L455-S459 PolarHBondContact O-N 3.24Å; L455-S459 PolarHBondContact O-OG 2.98Å; A456-S459 PolarHBondContact O-N 3.24Å; S459-Q462 WeakPolarHBondContact O-CB 3.27Å; S459-Q462 PolarHBondContact O-N 2.85Å; S459-E463 PolarHBondContact O-N 2.84Å
460	Q	73.8	Confident	66.3	Low	101 Å²	101	111.6 Å²	111.6	47%	0.472	56%	0.558	S	S	.	*	H	α-helix	trans	-61.9	-47.6	175.1	-171	65.7	47.3	0	0	111.1	A456 I457 Q462 E463 D464	A456-Q460 WeakPolarHBondContact O-CB 3.37Å; A456-Q460 PolarHBondContact O-N 3.22Å; I457-Q460 PolarHBondContact O-N 3.2Å; Q460-Q462 VanDerWaalsContact C-N 3.28Å; Q460-Q462 PolarHBondContact O-N 2.83Å; Q460-E463 CarbonylContact O-C 3.54Å; Q460-E463 WeakPolarHBondContact O-CB 3.15Å; Q460-E463 PolarHBondContact O-N 2.87Å; Q460-E463 VanDerWaalsContact O-N 3.13Å; Q460-D464 PolarHBondContact NE2-OD1 3.39Å; Q460-D464 VanDerWaalsContact NE2-OD1 3.15Å; Q460-D464 WeakPolarHBondContact O-CB 3.45Å; Q460-D464 PolarHBondContact O-N 3.14Å
461	L	69	Low	63.9	Low	96 Å²	96	114.3 Å²	114.3	50%	0.503	57%	0.571	S	S	.	*	H	α-helix	trans	-62.9	-35	176	-74.1	169.2	0	0	0	112	I457 V458 D464 V465	I457-L461 HydrophobicContact CG2-CD1 3.8Å; I457-L461 HydrophobicContact CG2-CG 4.3Å; I457-L461 WeakPolarHBondContact O-CB 3.45Å; I457-L461 VanDerWaalsContact O-CG 3.26Å; I457-L461 WeakPolarHBondContact O-CG 3.44Å; I457-L461 PolarHBondContact O-N 2.92Å; V458-L461 PolarHBondContact O-N 3.32Å; L461-D464 PolarHBondContact O-N 3.04Å; L461-V465 WeakPolarHBondContact O-CB 3.42Å; L461-V465 WeakPolarHBondContact O-CG2 3.33Å; L461-V465 PolarHBondContact O-N 3.38Å
462	Q	67.6	Low	61.5	Low	111 Å²	111	116 Å²	116	52%	0.519	58%	0.583	S	S	.	*	H	α-helix	trans	-68.4	-36.6	174.2	-77.8	177.1	-14.7	0	0	112	V458 S459 Q460 K466	V458-Q462 HydrophobicContact CG1-CG 4.39Å; V458-Q462 WeakPolarHBondContact O-CB 3.24Å; V458-Q462 VanDerWaalsContact O-CG 3.23Å; V458-Q462 WeakPolarHBondContact O-CG 3.33Å; V458-Q462 PolarHBondContact O-N 3.46Å; S459-Q462 WeakPolarHBondContact O-CB 3.27Å; S459-Q462 PolarHBondContact O-N 2.85Å; Q460-Q462 VanDerWaalsContact C-N 3.28Å; Q460-Q462 PolarHBondContact O-N 2.83Å; Q462-K466 VanDerWaalsContact O-CG 3.31Å; Q462-K466 WeakPolarHBondContact O-CG 3.19Å; Q462-K466 PolarHBondContact O-N 3.5Å
463	E	66	Low	59.1	Low	123 Å²	123	116.7 Å²	116.7	58%	0.575	59%	0.592	S	S	*	*	H	α-helix	trans	-68.2	-43.7	170.8	-94.3	176.3	164	0	0	111.8	S459 Q460 V465 K466 S467	S459-E463 PolarHBondContact O-N 2.84Å; Q460-E463 CarbonylContact O-C 3.54Å; Q460-E463 WeakPolarHBondContact O-CB 3.15Å; Q460-E463 PolarHBondContact O-N 2.87Å; Q460-E463 VanDerWaalsContact O-N 3.13Å; E463-V465 VanDerWaalsContact C-N 3.3Å; E463-V465 PolarHBondContact O-N 3.3Å; E463-K466 CarbonylContact O-C 3.53Å; E463-K466 WeakPolarHBondContact O-CA 3.46Å; E463-K466 WeakPolarHBondContact O-CB 3.27Å; E463-K466 PolarHBondContact O-N 2.97Å; E463-S467 PolarHBondContact O-N 2.88Å
464	D	62.3	Low	56.9	Low	64 Å²	64	112.8 Å²	112.8	34%	0.342	60%	0.595	S	S	.	*	H	α-helix	trans	-61.6	-39.8	176.4	-63.9	-15.1	0	0	0	110.7	Q460 L461 K466 S467 F468	Q460-D464 PolarHBondContact NE2-OD1 3.39Å; Q460-D464 VanDerWaalsContact NE2-OD1 3.15Å; Q460-D464 WeakPolarHBondContact O-CB 3.45Å; Q460-D464 PolarHBondContact O-N 3.14Å; L461-D464 PolarHBondContact O-N 3.04Å; D464-K466 VanDerWaalsContact C-N 3.34Å; D464-S467 WeakPolarHBondContact CA-OG 3.37Å; D464-S467 PolarHBondContact O-N 3.05Å; D464-S467 PolarHBondContact O-OG 3.23Å; D464-F468 WeakPolarHBondContact O-CD2 3.42Å; D464-F468 PolarHBondContact O-N 3.24Å; D464-F468 VanDerWaalsContact O-N 3.17Å
465	V	59.2	Low	54.8	Low	106 Å²	106	115.2 Å²	115.2	64%	0.642	61%	0.609	S	S	*	*	H	α-helix	trans	-66.1	-35.5	173.1	168.4	0	0	0	0	111.5	L461 E463 F468	L461-V465 WeakPolarHBondContact O-CB 3.42Å; L461-V465 WeakPolarHBondContact O-CG2 3.33Å; L461-V465 PolarHBondContact O-N 3.38Å; E463-V465 VanDerWaalsContact C-N 3.3Å; E463-V465 PolarHBondContact O-N 3.3Å; V465-F468 PolarHBondContact O-N 3.18Å
466	K	57.6	Low	52.5	Low	165 Å²	165	118.3 Å²	118.3	72%	0.717	63%	0.625	S	S	*	*	H	α-helix	trans	-72.1	-30.4	173	-74.6	174.8	-176.5	178.1	0	112	Q462 E463 D464 F468	Q462-K466 VanDerWaalsContact O-CG 3.31Å; Q462-K466 WeakPolarHBondContact O-CG 3.19Å; Q462-K466 PolarHBondContact O-N 3.5Å; E463-K466 CarbonylContact O-C 3.53Å; E463-K466 WeakPolarHBondContact O-CA 3.46Å; E463-K466 WeakPolarHBondContact O-CB 3.27Å; E463-K466 PolarHBondContact O-N 2.97Å; D464-K466 VanDerWaalsContact C-N 3.34Å; K466-F468 VanDerWaalsContact C-N 3.25Å; K466-F468 PolarHBondContact O-N 3.38Å
467	S	46.2	Very low	50.5	Low	83 Å²	83	124.4 Å²	124.4	58%	0.58	64%	0.643	S	S	*	*	H	α-helix	trans	-78.8	-4.9	176.6	75.3	0	0	0	0	113.5	E463 D464 K469	E463-S467 PolarHBondContact O-N 2.88Å; D464-S467 WeakPolarHBondContact CA-OG 3.37Å; D464-S467 PolarHBondContact O-N 3.05Å; D464-S467 PolarHBondContact O-OG 3.23Å; S467-K469 PolarHBondContact O-N 2.9Å
468	F	40.1	Very low	48.6	Very low	180 Å²	180	125.2 Å²	125.2	79%	0.789	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	15.3	170.2	-101.3	-78.8	0	0	0	114.7	D464 V465 K466	D464-F468 WeakPolarHBondContact O-CD2 3.42Å; D464-F468 PolarHBondContact O-N 3.24Å; D464-F468 VanDerWaalsContact O-N 3.17Å; V465-F468 PolarHBondContact O-N 3.18Å; K466-F468 VanDerWaalsContact C-N 3.25Å; K466-F468 PolarHBondContact O-N 3.38Å
469	K	38.7	Very low	46.3	Very low	187 Å²	187	130.5 Å²	130.5	81%	0.813	67%	0.672	S	S	*	*	S	Bend	trans	-97.8	101.1	159.5	-75.3	-173.2	178.4	-179.4	0	110.6	S467	S467-K469 PolarHBondContact O-N 2.9Å
470	L	34.7	Very low	44.3	Very low	171 Å²	171	134.9 Å²	134.9	90%	0.895	69%	0.691	S	S	*	*			trans	41.5	84.8	134.9	-148.7	75.4	0	0	0	117.1
471	H	28.9	Very low	42.2	Very low	147 Å²	147	135.7 Å²	135.7	68%	0.681	70%	0.698	S	S	*	*			trans	33.4	103.9	132.6	-148.1	78.5	0	0	0	120	L473	H471-L473 WeakPolarHBondContact NE2-CD1 3.32Å
472	D	30.3	Very low	40.7	Very low	148 Å²	148	137.1 Å²	137.1	79%	0.791	71%	0.713	S	S	*	*			trans	-166.2	95.1	131.1	-109.6	-16.4	0	0	0	105.6
473	L	28.8	Very low	39.1	Very low	134 Å²	134	141.3 Å²	141.3	70%	0.702	73%	0.729	S	S	*	*				56.4	128.5	94	-74.2	174.2	0	0	0	115.2	H471	H471-L473 WeakPolarHBondContact NE2-CD1 3.32Å
474	A	33.4	Very low	37.5	Very low	84 Å²	84	145.1 Å²	145.1	69%	0.694	74%	0.744	S	S	*	*			trans	84.4	118.1	176.5	0	0	0	0	0	114.2
475	D	32.6	Very low	36.3	Very low	146 Å²	146	150.8 Å²	150.8	78%	0.781	77%	0.768	S	S	*	*			cis	-161.5	115.6	16.8	-76.6	-46.8	0	0	0	107.8
476	L	29.6	Very low	35.1	Very low	160 Å²	160	150.7 Å²	150.7	84%	0.838	77%	0.773	S	S	*	*				23.9	120.7	112.8	-65.3	170	0	0	0	116.4
477	Q	34.8	Very low	34.4	Very low	187 Å²	187	148.3 Å²	148.3	87%	0.874	78%	0.777	S	S	*	*			trans	151.4	157.8	133.1	-81.7	-178.9	11.5	0	0	112.6
478	P	37.2	Very low	34.1	Very low	106 Å²	106	147.6 Å²	147.6	69%	0.688	77%	0.771	S	S	*	*				-122.7	148.7	-74.6	21.8	0.5	0	0	0	113	N480	P478-N480 PolarHBondContact O-N 3.45Å
479	F	28.3	Very low	34.4	Very low	181 Å²	181	142.9 Å²	142.9	79%	0.794	75%	0.754	S	S	*	*			trans	-51.9	117.5	166.7	-170.5	-108.3	0	0	0	112.2	L481	F479-L481 HydrophobicContact CD1-CD1 3.88Å; F479-L481 HydrophobicContact CD2-CD1 4.2Å; F479-L481 HydrophobicContact CE1-CD1 3.3Å; F479-L481 HydrophobicContact CE1-CD2 4.31Å; F479-L481 HydrophobicContact CE1-CG 4.34Å; F479-L481 HydrophobicContact CE2-CD1 3.64Å; F479-L481 HydrophobicContact CG-CD1 4.31Å; F479-L481 HydrophobicContact CZ-CD1 3.16Å; F479-L481 HydrophobicContact CZ-CD2 4.41Å; F479-L481 HydrophobicContact CZ-CG 4.4Å
480	N	31.9	Very low	34.9	Very low	152 Å²	152	138.6 Å²	138.6	81%	0.813	74%	0.744	S	S	*	*			trans	-128.6	101.2	169.9	-111.7	-23.5	0	0	0	110.1	P478 P482	P478-N480 PolarHBondContact O-N 3.45Å; N480-P482 WeakPolarHBondContact O-CD 3.47Å
481	L	28.9	Very low	35.4	Very low	119 Å²	119	136.6 Å²	136.6	62%	0.623	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-72.2	123	171.7	-104.3	59.4	0	0	0	110.2	F479 K483	F479-L481 HydrophobicContact CD1-CD1 3.88Å; F479-L481 HydrophobicContact CD2-CD1 4.2Å; F479-L481 HydrophobicContact CE1-CD1 3.3Å; F479-L481 HydrophobicContact CE1-CD2 4.31Å; F479-L481 HydrophobicContact CE1-CG 4.34Å; F479-L481 HydrophobicContact CE2-CD1 3.64Å; F479-L481 HydrophobicContact CG-CD1 4.31Å; F479-L481 HydrophobicContact CZ-CD1 3.16Å; F479-L481 HydrophobicContact CZ-CD2 4.41Å; F479-L481 HydrophobicContact CZ-CG 4.4Å; L481-K483 PolarHBondContact O-N 3.17Å
482	P	36.7	Very low	36.1	Very low	126 Å²	126	133.1 Å²	133.1	82%	0.818	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-68.4	130.3	172.6	-17.1	30.7	0	0	0	111.5	N480	N480-P482 WeakPolarHBondContact O-CD 3.47Å
483	K	34.5	Very low	37	Very low	198 Å²	198	134.3 Å²	134.3	86%	0.861	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-68.8	136.9	178.9	-68	172	-177	175.3	0	111.5	L481 Q485	L481-K483 PolarHBondContact O-N 3.17Å; K483-Q485 PolarHBondContact O-N 2.97Å
484	K	32.5	Very low	37.7	Very low	204 Å²	204	133.7 Å²	133.7	89%	0.887	71%	0.71	S	S	*	*			trans	-45.3	124.5	165.9	-65.3	169.9	173.8	177.1	0	112.2
485	Q	37.6	Very low	38.4	Very low	182 Å²	182	132.3 Å²	132.3	85%	0.85	70%	0.695	S	S	*	*			trans	-129.9	110	157.4	-74.3	-173.2	-4.9	0	0	108.3	K483	K483-Q485 PolarHBondContact O-N 2.97Å
486	S	34.6	Very low	39.2	Very low	105 Å²	105	131.5 Å²	131.5	73%	0.734	68%	0.684	S	S	*	*			trans	-109.6	25.4	-156.7	-170.1	0	0	0	0	114.3
487	S	42.8	Very low	39.9	Very low	115 Å²	115	131.2 Å²	131.2	80%	0.804	68%	0.677	S	S	*	*	S	Bend	trans	-132	-1	-173	-51.8	0	0	0	0	115.7
488	S	39.2	Very low	40.5	Very low	67 Å²	67	126.1 Å²	126.1	47%	0.469	66%	0.658	S	S	.	*	S	Bend	trans	-100.4	-13.5	172.2	-162.6	0	0	0	0	112.9	T490 I491 N492	S488-T490 VanDerWaalsContact C-N 3.32Å; S488-T490 PolarHBondContact O-N 3.43Å; S488-I491 PolarHBondContact O-N 3.23Å; S488-N492 WeakPolarHBondContact O-CB 3.46Å; S488-N492 PolarHBondContact O-N 2.86Å
489	D	46.2	Very low	40.8	Very low	81 Å²	81	125.2 Å²	125.2	43%	0.433	65%	0.648	S	S	.	*	H	α-helix	trans	-66.5	-28.1	-172.8	-74.1	-13.2	0	0	0	114	R493	D489-R493 WeakPolarHBondContact O-CB 3.35Å; D489-R493 WeakPolarHBondContact O-CD 3.49Å; D489-R493 WeakPolarHBondContact O-CG 3.33Å; D489-R493 PolarHBondContact O-N 3.43Å
490	T	48.9	Very low	41.5	Very low	97 Å²	97	125.7 Å²	125.7	60%	0.595	65%	0.646	S	S	*	*	H	α-helix	trans	-77.7	-38.7	-179	-38.3	0	0	0	0	112	S488 R493 L494	S488-T490 VanDerWaalsContact C-N 3.32Å; S488-T490 PolarHBondContact O-N 3.43Å; T490-R493 PolarHBondContact O-N 3.13Å; T490-L494 PolarHBondContact O-N 2.89Å; T490-L494 VanDerWaalsContact O-N 3.17Å
491	I	44.9	Very low	42.1	Very low	129 Å²	129	123.7 Å²	123.7	66%	0.662	63%	0.634	S	S	*	*	H	α-helix	trans	-72.9	-41	175.8	-62.4	175.4	0	0	0	109.6	S488 R493 L494 S495	S488-I491 PolarHBondContact O-N 3.23Å; I491-R493 VanDerWaalsContact C-N 3.29Å; I491-R493 PolarHBondContact O-N 2.92Å; I491-L494 PolarHBondContact O-N 2.91Å; I491-S495 PolarHBondContact O-N 3.34Å
492	N	45.5	Very low	42.7	Very low	74 Å²	74	125.1 Å²	125.1	40%	0.396	64%	0.636	S	S	.	*	H	α-helix	trans	-66	-27.7	171.5	-82.6	-12.6	0	0	0	112.8	S488 K496	S488-N492 WeakPolarHBondContact O-CB 3.46Å; S488-N492 PolarHBondContact O-N 2.86Å; N492-K496 WeakPolarHBondContact O-CA 3.3Å; N492-K496 WeakPolarHBondContact O-CB 3.43Å; N492-K496 WeakPolarHBondContact O-CG 3.47Å; N492-K496 PolarHBondContact O-N 3.35Å
493	R	48.5	Very low	42.9	Very low	173 Å²	173	126.6 Å²	126.6	65%	0.653	63%	0.63	S	S	*	*	H	α-helix	trans	-69.7	-39.7	173.2	-85.2	169.5	-169.7	172	5.8	111.8	D489 T490 I491 F497	D489-R493 WeakPolarHBondContact O-CB 3.35Å; D489-R493 WeakPolarHBondContact O-CD 3.49Å; D489-R493 WeakPolarHBondContact O-CG 3.33Å; D489-R493 PolarHBondContact O-N 3.43Å; T490-R493 PolarHBondContact O-N 3.13Å; I491-R493 VanDerWaalsContact C-N 3.29Å; I491-R493 PolarHBondContact O-N 2.92Å; R493-F497 VanDerWaalsContact O-CB 3.31Å; R493-F497 WeakPolarHBondContact O-CB 3.45Å; R493-F497 PolarHBondContact O-N 3.24Å
494	L	44.4	Very low	43.3	Very low	122 Å²	122	122.3 Å²	122.3	64%	0.639	62%	0.616	S	S	*	*	H	α-helix	trans	-72.3	-42.7	177.8	-90.8	152.9	0	0	0	112.1	T490 I491 F497 V498	T490-L494 PolarHBondContact O-N 2.89Å; T490-L494 VanDerWaalsContact O-N 3.17Å; I491-L494 PolarHBondContact O-N 2.91Å; L494-F497 PolarHBondContact O-N 2.89Å; L494-V498 PolarHBondContact O-N 3.47Å; L494-V498 VanDerWaalsContact O-N 3.14Å
495	S	47.2	Very low	43.8	Very low	55 Å²	55	115 Å²	115	39%	0.385	60%	0.599	S	S	.	*	H	α-helix	trans	-61.9	-46.5	170.9	137.5	0	0	0	0	110.7	I491 F497 V498 D499	I491-S495 PolarHBondContact O-N 3.34Å; S495-F497 VanDerWaalsContact C-N 3.26Å; S495-F497 PolarHBondContact O-N 3.24Å; S495-V498 PolarHBondContact O-N 3.38Å; S495-V498 VanDerWaalsContact O-N 3.16Å; S495-D499 PolarHBondContact O-N 3.1Å; S495-D499 PolarHBondContact OG-OD2 3.22Å
496	K	49.7	Very low	44.2	Very low	128 Å²	128	112.2 Å²	112.2	56%	0.557	59%	0.59	S	S	*	*	H	α-helix	trans	-61.3	-32.7	174.4	-78	179.2	175.2	-175.3	0	112.8	N492 D499 Y500	N492-K496 WeakPolarHBondContact O-CA 3.3Å; N492-K496 WeakPolarHBondContact O-CB 3.43Å; N492-K496 WeakPolarHBondContact O-CG 3.47Å; N492-K496 PolarHBondContact O-N 3.35Å; K496-D499 PolarHBondContact O-N 3.38Å; K496-Y500 HydrophobicContact CB-CD2 4.49Å; K496-Y500 WeakPolarHBondContact O-CB 3.4Å; K496-Y500 WeakPolarHBondContact O-CD2 3.26Å; K496-Y500 PolarHBondContact O-N 3.04Å
497	F	44.1	Very low	44.9	Very low	155 Å²	155	110.6 Å²	110.6	68%	0.68	58%	0.578	S	S	*	*	H	α-helix	trans	-69.7	-34.9	178.8	-151.3	-90.3	0	0	0	112.1	R493 L494 S495	R493-F497 VanDerWaalsContact O-CB 3.31Å; R493-F497 WeakPolarHBondContact O-CB 3.45Å; R493-F497 PolarHBondContact O-N 3.24Å; L494-F497 PolarHBondContact O-N 2.89Å; S495-F497 VanDerWaalsContact C-N 3.26Å; S495-F497 PolarHBondContact O-N 3.24Å
498	V	46.3	Very low	45	Very low	80 Å²	80	109.3 Å²	109.3	49%	0.485	57%	0.565	S	S	.	*	H	α-helix	trans	-72.9	-39.6	173.1	177.9	0	0	0	0	110.5	L494 S495 Y500 L501	L494-V498 PolarHBondContact O-N 3.47Å; L494-V498 VanDerWaalsContact O-N 3.14Å; S495-V498 PolarHBondContact O-N 3.38Å; S495-V498 VanDerWaalsContact O-N 3.16Å; V498-Y500 VanDerWaalsContact C-N 3.32Å; V498-Y500 PolarHBondContact O-N 3.31Å; V498-L501 WeakPolarHBondContact O-CB 3.25Å; V498-L501 PolarHBondContact O-N 3.26Å; V498-L501 VanDerWaalsContact O-N 3.15Å
499	D	44.4	Very low	45.5	Very low	87 Å²	87	113.2 Å²	113.2	47%	0.465	58%	0.58	S	S	.	*	H	α-helix	trans	-66.9	-32.3	175	-63.4	-25.6	0	0	0	111.3	S495 K496 L501 F502	S495-D499 PolarHBondContact O-N 3.1Å; S495-D499 PolarHBondContact OG-OD2 3.22Å; K496-D499 PolarHBondContact O-N 3.38Å; D499-L501 PolarHBondContact O-N 3.09Å; D499-F502 CarbonylContact O-C 3.52Å; D499-F502 WeakPolarHBondContact O-CA 3.33Å; D499-F502 PolarHBondContact O-N 3.14Å
500	Y	43.5	Very low	45.7	Very low	191 Å²	191	113.9 Å²	113.9	75%	0.749	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-19.7	173.7	-95.1	-70.8	0	0	0	114	K496 V498	K496-Y500 HydrophobicContact CB-CD2 4.49Å; K496-Y500 WeakPolarHBondContact O-CB 3.4Å; K496-Y500 WeakPolarHBondContact O-CD2 3.26Å; K496-Y500 PolarHBondContact O-N 3.04Å; V498-Y500 VanDerWaalsContact C-N 3.32Å; V498-Y500 PolarHBondContact O-N 3.31Å
501	L	44.2	Very low	45.4	Very low	110 Å²	110	115.4 Å²	115.4	58%	0.576	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-24.6	171.9	-79.5	158.1	0	0	0	112	V498 D499 F503	V498-L501 WeakPolarHBondContact O-CB 3.25Å; V498-L501 PolarHBondContact O-N 3.26Å; V498-L501 VanDerWaalsContact O-N 3.15Å; D499-L501 PolarHBondContact O-N 3.09Å; L501-F503 PolarHBondContact O-N 3.34Å
502	F	42.1	Very low	45.9	Very low	148 Å²	148	115.5 Å²	115.5	65%	0.649	60%	0.602	S	S	*	*	S	Bend	trans	-96	82.9	167.2	-67.1	-81.1	0	0	0	107.6	D499 D504	D499-F502 CarbonylContact O-C 3.52Å; D499-F502 WeakPolarHBondContact O-CA 3.33Å; D499-F502 PolarHBondContact O-N 3.14Å; F502-D504 PolarHBondContact O-N 2.82Å
503	F	40.6	Very low	46.3	Very low	158 Å²	158	117.9 Å²	117.9	69%	0.693	62%	0.619	S	S	*	*			trans	-58.1	87.4	170.7	-161.3	-89.7	0	0	0	108.5	L501 G505 C507	L501-F503 PolarHBondContact O-N 3.34Å; F503-G505 PolarHBondContact O-N 2.95Å; F503-C507 HydrophobicContact CZ-CB 4.48Å
504	D	41.5	Very low	46.5	Very low	107 Å²	107	113.4 Å²	113.4	57%	0.572	61%	0.612	S	S	*	*			trans	-58	125.7	174.2	-85.4	-25.7	0	0	0	105.9	F502 D506	F502-D504 PolarHBondContact O-N 2.82Å; D504-D506 PolarHBondContact O-N 2.9Å
505	G	44.7	Very low	47	Very low	52 Å²	52	110.9 Å²	110.9	54%	0.536	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-58.7	-2.9	-178.3	0	0	0	0	0	114.1	F503 C507 V508	F503-G505 PolarHBondContact O-N 2.95Å; G505-C507 VanDerWaalsContact C-N 3.26Å; G505-C507 PolarHBondContact O-N 2.79Å; G505-V508 WeakPolarHBondContact O-CG2 3.44Å; G505-V508 PolarHBondContact O-N 3.27Å
506	D	46.1	Very low	47.4	Very low	122 Å²	122	113.7 Å²	113.7	65%	0.652	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-72.7	-13.1	-175.4	-64.8	-5.5	0	0	0	113.5	D504 V508 D509	D504-D506 PolarHBondContact O-N 2.9Å; D506-V508 PolarHBondContact O-N 3.12Å; D506-D509 PolarHBondContact O-N 3.33Å
507	C	47.3	Very low	47.8	Very low	72 Å²	72	114.3 Å²	114.3	49%	0.486	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-65.9	-22.6	174.7	-44.6	0	0	0	0	112.7	F503 G505 D509	F503-C507 HydrophobicContact CZ-CB 4.48Å; G505-C507 VanDerWaalsContact C-N 3.26Å; G505-C507 PolarHBondContact O-N 2.79Å; C507-D509 VanDerWaalsContact C-N 3.34Å
508	V	45.9	Very low	48.4	Very low	88 Å²	88	109 Å²	109	53%	0.533	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-76	-26.6	-173.8	-166.5	0	0	0	0	111.2	G505 D506 S510 L511	G505-V508 WeakPolarHBondContact O-CG2 3.44Å; G505-V508 PolarHBondContact O-N 3.27Å; D506-V508 PolarHBondContact O-N 3.12Å; V508-S510 PolarHBondContact O-N 3.23Å; V508-L511 HydrophobicContact CG1-CD1 4.27Å; V508-L511 PolarHBondContact O-N 2.93Å
509	D	49.2	Very low	48.8	Very low	148 Å²	148	108.7 Å²	108.7	79%	0.791	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-73.8	-12.6	178.9	-76.3	-13	0	0	0	113.6	D506 C507 L511	D506-D509 PolarHBondContact O-N 3.33Å; C507-D509 VanDerWaalsContact C-N 3.34Å; D509-L511 VanDerWaalsContact C-N 3.3Å
510	S	49.8	Very low	49.4	Very low	96 Å²	96	112.5 Å²	112.5	67%	0.671	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-84.2	-2.4	174.3	-62.3	0	0	0	0	113.7	V508 V512	V508-S510 PolarHBondContact O-N 3.23Å; S510-V512 VanDerWaalsContact C-N 3.28Å; S510-V512 PolarHBondContact O-N 3.45Å
511	L	44.5	Very low	50.3	Low	128 Å²	128	110.3 Å²	110.3	67%	0.67	62%	0.621	S	S	*	*			trans	-74.9	86.6	171.4	-72.5	166.4	0	0	0	108.9	V508 D509 V513	V508-L511 HydrophobicContact CG1-CD1 4.27Å; V508-L511 PolarHBondContact O-N 2.93Å; D509-L511 VanDerWaalsContact C-N 3.3Å; L511-V513 PolarHBondContact O-N 3.38Å
512	V	55.4	Low	50.9	Low	131 Å²	131	107.8 Å²	107.8	79%	0.794	61%	0.607	S	S	*	*			trans	-61.6	98.9	170.2	-178.5	0	0	0	0	108	S510 P514	S510-V512 VanDerWaalsContact C-N 3.28Å; S510-V512 PolarHBondContact O-N 3.45Å; V512-P514 VanDerWaalsContact O-CD 3.32Å; V512-P514 WeakPolarHBondContact O-CD 3.39Å
513	V	52.2	Low	52.1	Low	124 Å²	124	105 Å²	105	75%	0.752	60%	0.599	S	S	*	*			trans	-75.3	115.7	169.3	-174.9	0	0	0	0	106.6	L511 S515	L511-V513 PolarHBondContact O-N 3.38Å; V513-S515 PolarHBondContact O-N 3.41Å
514	P	54.2	Low	53.4	Low	79 Å²	79	103.6 Å²	103.6	51%	0.513	60%	0.596	S	S	.	*			trans	-58.2	135.8	178.8	-20.2	31.3	0	0	0	110.2	V512 I519	V512-P514 VanDerWaalsContact O-CD 3.32Å; V512-P514 WeakPolarHBondContact O-CD 3.39Å; P514-I519 HydrophobicContact CB-CG1 4.33Å
515	S	53.5	Low	54.6	Low	70 Å²	70	105.3 Å²	105.3	49%	0.49	60%	0.601	S	S	.	*			trans	-61.4	148.7	172.6	57.4	0	0	0	0	110.3	V513 E517 A518 I519	V513-S515 PolarHBondContact O-N 3.41Å; S515-E517 PolarHBondContact O-N 2.96Å; S515-E517 VanDerWaalsContact O-N 3.16Å; S515-A518 WeakPolarHBondContact O-CB 3.46Å; S515-A518 PolarHBondContact O-N 2.93Å; S515-I519 PolarHBondContact O-N 2.81Å
516	T	56.9	Low	55.7	Low	113 Å²	113	108 Å²	108	69%	0.693	60%	0.599	S	S	*	*	H	α-helix	trans	-54	-35.1	-179.4	24	0	0	0	0	113.1	A518 I519 E520	T516-A518 PolarHBondContact O-N 2.98Å; T516-I519 WeakPolarHBondContact O-CB 3.39Å; T516-I519 PolarHBondContact O-N 3.46Å; T516-I519 VanDerWaalsContact O-N 3.15Å; T516-E520 PolarHBondContact O-N 2.82Å; T516-E520 VanDerWaalsContact O-N 3.15Å
517	E	56.6	Low	56.6	Low	141 Å²	141	105.6 Å²	105.6	66%	0.659	59%	0.586	S	S	*	*	H	α-helix	trans	-65.2	-34.6	177.5	-63.5	175.2	176.8	0	0	113.3	S515 I519 E520 N521	S515-E517 PolarHBondContact O-N 2.96Å; S515-E517 VanDerWaalsContact O-N 3.16Å; E517-I519 VanDerWaalsContact C-N 3.25Å; E517-I519 PolarHBondContact O-N 3.46Å; E517-E520 PolarHBondContact O-N 2.96Å; E517-N521 PolarHBondContact O-N 3.26Å; E517-N521 PolarHBondContact O-ND2 2.77Å
518	A	57	Low	57.9	Low	44 Å²	44	108.5 Å²	108.5	36%	0.364	59%	0.59	S	S	.	*	H	α-helix	trans	-70.1	-27.6	175.9	0	0	0	0	0	111.5	S515 T516 L522	S515-A518 WeakPolarHBondContact O-CB 3.46Å; S515-A518 PolarHBondContact O-N 2.93Å; T516-A518 PolarHBondContact O-N 2.98Å; A518-L522 WeakPolarHBondContact O-CD1 3.46Å; A518-L522 VanDerWaalsContact O-CG 3.28Å; A518-L522 WeakPolarHBondContact O-CG 3.37Å
519	I	54.7	Low	59.2	Low	73 Å²	73	109.8 Å²	109.8	37%	0.374	59%	0.591	S	S	.	*	H	α-helix	trans	-75.7	-38.1	177.3	-54.7	175.6	0	0	0	110.8	P514 S515 T516 E517 N521 L522 L527	P514-I519 HydrophobicContact CB-CG1 4.33Å; S515-I519 PolarHBondContact O-N 2.81Å; T516-I519 WeakPolarHBondContact O-CB 3.39Å; T516-I519 PolarHBondContact O-N 3.46Å; T516-I519 VanDerWaalsContact O-N 3.15Å; E517-I519 VanDerWaalsContact C-N 3.25Å; E517-I519 PolarHBondContact O-N 3.46Å; I519-N521 VanDerWaalsContact C-N 3.34Å; I519-N521 PolarHBondContact O-N 3.29Å; I519-L522 PolarHBondContact O-N 3.24Å; I519-L527 HydrophobicContact CG2-CD1 4.01Å
520	E	57.4	Low	60.4	Low	167 Å²	167	106.9 Å²	106.9	78%	0.78	57%	0.574	S	S	*	*	H	α-helix	trans	-68	-32	178.2	-73.3	-175.3	167.5	0	0	113.2	T516 E517 L522	T516-E520 PolarHBondContact O-N 2.82Å; T516-E520 VanDerWaalsContact O-N 3.15Å; E517-E520 PolarHBondContact O-N 2.96Å; E520-L522 VanDerWaalsContact C-N 3.35Å
521	N	61.8	Low	61.6	Low	146 Å²	146	104.8 Å²	104.8	78%	0.781	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-4.1	177.9	-72.9	-46.9	0	0	0	114.2	E517 I519	E517-N521 PolarHBondContact O-N 3.26Å; E517-N521 PolarHBondContact O-ND2 2.77Å; I519-N521 VanDerWaalsContact C-N 3.34Å; I519-N521 PolarHBondContact O-N 3.29Å
522	L	58	Low	63.1	Low	57 Å²	57	105.4 Å²	105.4	30%	0.298	56%	0.56	S	S	.	*	S	Bend	trans	-78.8	127.4	176.2	-85.8	161.1	0	0	0	110	A518 I519 E520 M524 Q526 L527	A518-L522 WeakPolarHBondContact O-CD1 3.46Å; A518-L522 VanDerWaalsContact O-CG 3.28Å; A518-L522 WeakPolarHBondContact O-CG 3.37Å; I519-L522 PolarHBondContact O-N 3.24Å; E520-L522 VanDerWaalsContact C-N 3.35Å; L522-M524 PolarHBondContact O-N 2.87Å; L522-Q526 HydrophobicContact CD2-CB 4.23Å; L522-Q526 VanDerWaalsContact CD2-OE1 3.25Å; L522-L527 HydrophobicContact CB-CD1 3.8Å; L522-L527 HydrophobicContact CB-CG 4.49Å
523	D	66.5	Low	64	Low	90 Å²	90	103.3 Å²	103.3	48%	0.481	55%	0.545	S	S	.	.			trans	-55.8	137.1	174.1	-177	10.9	0	0	0	110	Q525 Q526 L527	D523-Q525 PolarHBondContact O-N 2.97Å; D523-Q526 HydrophobicContact CB-CG 4.38Å; D523-Q526 PolarHBondContact O-N 3.37Å; D523-L527 PolarHBondContact O-N 3.28Å; D523-L527 VanDerWaalsContact O-N 3.09Å
524	M	67.3	Low	64.8	Low	127 Å²	127	102.7 Å²	102.7	63%	0.626	54%	0.537	S	S	*	.	H	α-helix	trans	-58.3	-23	-174.9	-135.3	-99.6	-79.7	0	0	111.8	L522 K528	L522-M524 PolarHBondContact O-N 2.87Å; M524-K528 WeakPolarHBondContact O-CG 3.34Å; M524-K528 PolarHBondContact O-N 3.26Å
525	Q	68.1	Low	65.7	Low	144 Å²	144	106.6 Å²	106.6	67%	0.673	55%	0.545	S	S	*	.	H	α-helix	trans	-72.8	-46.3	171.4	-63.8	-169.4	-4.3	0	0	113.1	D523 L527 K528 E529	D523-Q525 PolarHBondContact O-N 2.97Å; Q525-L527 VanDerWaalsContact C-N 3.31Å; Q525-L527 PolarHBondContact O-N 3.27Å; Q525-K528 WeakPolarHBondContact O-CB 3.26Å; Q525-K528 PolarHBondContact O-N 3.24Å; Q525-E529 PolarHBondContact O-N 2.91Å
526	Q	66.8	Low	66.5	Low	108 Å²	108	112.6 Å²	112.6	51%	0.505	56%	0.557	S	S	.	*	H	α-helix	trans	-63.8	-38.8	178.6	-68.2	-176.4	-11.9	0	0	111.5	L522 D523 K528 E529 I530	L522-Q526 HydrophobicContact CD2-CB 4.23Å; L522-Q526 VanDerWaalsContact CD2-OE1 3.25Å; D523-Q526 HydrophobicContact CB-CG 4.38Å; D523-Q526 PolarHBondContact O-N 3.37Å; Q526-K528 VanDerWaalsContact C-N 3.32Å; Q526-K528 PolarHBondContact O-N 3.45Å; Q526-E529 WeakPolarHBondContact O-CB 3.44Å; Q526-E529 PolarHBondContact O-N 3.04Å; Q526-I530 WeakPolarHBondContact O-CG1 3.46Å; Q526-I530 PolarHBondContact O-N 3.38Å
527	L	65.5	Low	66.9	Low	71 Å²	71	112.2 Å²	112.2	37%	0.372	55%	0.551	S	S	.	*	H	α-helix	trans	-61.4	-39.9	175.2	-122.8	142.7	0	0	0	111.9	I519 L522 D523 Q525 A531	I519-L527 HydrophobicContact CG2-CD1 4.01Å; L522-L527 HydrophobicContact CB-CD1 3.8Å; L522-L527 HydrophobicContact CB-CG 4.49Å; D523-L527 PolarHBondContact O-N 3.28Å; D523-L527 VanDerWaalsContact O-N 3.09Å; Q525-L527 VanDerWaalsContact C-N 3.31Å; Q525-L527 PolarHBondContact O-N 3.27Å; L527-A531 WeakPolarHBondContact O-CB 3.21Å; L527-A531 PolarHBondContact O-N 3.31Å
528	K	75.1	Confident	67.3	Low	133 Å²	133	115.3 Å²	115.3	58%	0.578	56%	0.556	S	S	*	*	H	α-helix	trans	-66.4	-39.7	173.6	-77.6	175.8	-178.2	175	0	112.4	M524 Q525 Q526 A531 K532	M524-K528 WeakPolarHBondContact O-CG 3.34Å; M524-K528 PolarHBondContact O-N 3.26Å; Q525-K528 WeakPolarHBondContact O-CB 3.26Å; Q525-K528 PolarHBondContact O-N 3.24Å; Q526-K528 VanDerWaalsContact C-N 3.32Å; Q526-K528 PolarHBondContact O-N 3.45Å; K528-A531 PolarHBondContact O-N 3.02Å; K528-K532 VanDerWaalsContact O-CB 3.26Å; K528-K532 WeakPolarHBondContact O-CB 3.48Å; K528-K532 PolarHBondContact O-N 3.32Å
529	E	73.8	Confident	67.7	Low	116 Å²	116	116.1 Å²	116.1	54%	0.542	57%	0.569	S	S	.	*	H	α-helix	trans	-62.6	-50	177.4	-160.9	84.4	-156.6	0	0	111	Q525 Q526 A531 K532 N533	Q525-E529 PolarHBondContact O-N 2.91Å; Q526-E529 WeakPolarHBondContact O-CB 3.44Å; Q526-E529 PolarHBondContact O-N 3.04Å; E529-A531 PolarHBondContact O-N 3.32Å; E529-K532 WeakPolarHBondContact O-CB 3.5Å; E529-K532 PolarHBondContact O-N 3.47Å; E529-N533 PolarHBondContact O-N 3.27Å
530	I	73.1	Confident	68.1	Low	86 Å²	86	117.3 Å²	117.3	44%	0.441	58%	0.584	S	S	.	*	H	α-helix	trans	-62.3	-45	177.9	-65	167.2	0	0	0	110.1	Q526 K532 N533 L534	Q526-I530 WeakPolarHBondContact O-CG1 3.46Å; Q526-I530 PolarHBondContact O-N 3.38Å; I530-K532 VanDerWaalsContact C-N 3.29Å; I530-K532 PolarHBondContact O-N 2.92Å; I530-N533 PolarHBondContact O-N 3.01Å; I530-L534 HydrophobicContact CG2-CD1 4.07Å; I530-L534 HydrophobicContact CG2-CG 4.37Å; I530-L534 WeakPolarHBondContact O-CB 3.46Å; I530-L534 WeakPolarHBondContact O-CG 3.48Å; I530-L534 PolarHBondContact O-N 2.85Å
531	A	74.5	Confident	68.1	Low	53 Å²	53	114.1 Å²	114.1	44%	0.438	57%	0.571	S	S	.	*	H	α-helix	trans	-62	-36.8	176.5	0	0	0	0	0	112.3	L527 K528 E529 K535	L527-A531 WeakPolarHBondContact O-CB 3.21Å; L527-A531 PolarHBondContact O-N 3.31Å; K528-A531 PolarHBondContact O-N 3.02Å; E529-A531 PolarHBondContact O-N 3.32Å; A531-K535 WeakPolarHBondContact O-CB 3.42Å; A531-K535 PolarHBondContact O-N 3.37Å
532	K	77.7	Confident	68	Low	141 Å²	141	112 Å²	112	61%	0.613	57%	0.568	S	S	*	*	H	α-helix	trans	-67.8	-44.5	175.4	-172.3	-176.8	-179.5	-174.1	0	111.2	K528 E529 I530 K535 R536	K528-K532 VanDerWaalsContact O-CB 3.26Å; K528-K532 WeakPolarHBondContact O-CB 3.48Å; K528-K532 PolarHBondContact O-N 3.32Å; E529-K532 WeakPolarHBondContact O-CB 3.5Å; E529-K532 PolarHBondContact O-N 3.47Å; I530-K532 VanDerWaalsContact C-N 3.29Å; I530-K532 PolarHBondContact O-N 2.92Å; K532-K535 WeakPolarHBondContact O-CB 3.21Å; K532-K535 PolarHBondContact O-N 3.24Å; K532-R536 WeakPolarHBondContact O-CB 3.4Å; K532-R536 PolarHBondContact O-N 3.23Å
533	N	73.3	Confident	68.1	Low	87 Å²	87	113.5 Å²	113.5	47%	0.465	58%	0.581	S	S	.	*	H	α-helix	trans	-63.6	-45.8	175.9	-79.2	-18.7	0	0	0	111.7	E529 I530 K535 R536 L537	E529-N533 PolarHBondContact O-N 3.27Å; I530-N533 PolarHBondContact O-N 3.01Å; N533-K535 VanDerWaalsContact C-N 3.34Å; N533-K535 PolarHBondContact O-N 2.75Å; N533-R536 WeakPolarHBondContact O-CB 3.39Å; N533-R536 PolarHBondContact O-N 3.05Å; N533-R536 VanDerWaalsContact O-N 3.13Å; N533-L537 WeakPolarHBondContact O-CB 3.38Å; N533-L537 PolarHBondContact O-N 3.47Å
534	L	69.8	Low	68.1	Low	111 Å²	111	113.8 Å²	113.8	58%	0.581	58%	0.583	S	S	*	*	H	α-helix	trans	-61	-41.3	174.2	-75.4	176.6	0	0	0	111.5	I530 R536 L537 R538	I530-L534 HydrophobicContact CG2-CD1 4.07Å; I530-L534 HydrophobicContact CG2-CG 4.37Å; I530-L534 WeakPolarHBondContact O-CB 3.46Å; I530-L534 WeakPolarHBondContact O-CG 3.48Å; I530-L534 PolarHBondContact O-N 2.85Å; L534-R536 VanDerWaalsContact C-N 3.34Å; L534-R536 PolarHBondContact O-N 2.98Å; L534-L537 PolarHBondContact O-N 3.15Å; L534-R538 VanDerWaalsContact O-CB 3.31Å; L534-R538 WeakPolarHBondContact O-CB 3.42Å; L534-R538 PolarHBondContact O-N 3.37Å
535	K	73.4	Confident	68.3	Low	161 Å²	161	113.6 Å²	113.6	70%	0.7	58%	0.584	S	S	*	*	H	α-helix	trans	-60.7	-42.2	172.4	-100.3	-177.2	175.5	177.2	0	112.3	A531 K532 N533 R538 G539	A531-K535 WeakPolarHBondContact O-CB 3.42Å; A531-K535 PolarHBondContact O-N 3.37Å; K532-K535 WeakPolarHBondContact O-CB 3.21Å; K532-K535 PolarHBondContact O-N 3.24Å; N533-K535 VanDerWaalsContact C-N 3.34Å; N533-K535 PolarHBondContact O-N 2.75Å; K535-R538 PolarHBondContact O-N 3.12Å; K535-G539 PolarHBondContact O-N 3.46Å
536	R	69.7	Low	68.7	Low	195 Å²	195	112 Å²	112	74%	0.736	58%	0.58	S	S	*	*	H	α-helix	trans	-66.5	-41.8	178.9	-151	179.8	-176.8	-154.5	-1.5	110.8	K532 N533 L534 G539 S540	K532-R536 WeakPolarHBondContact O-CB 3.4Å; K532-R536 PolarHBondContact O-N 3.23Å; N533-R536 WeakPolarHBondContact O-CB 3.39Å; N533-R536 PolarHBondContact O-N 3.05Å; N533-R536 VanDerWaalsContact O-N 3.13Å; L534-R536 VanDerWaalsContact C-N 3.34Å; L534-R536 PolarHBondContact O-N 2.98Å; R536-G539 PolarHBondContact O-N 3.42Å; R536-S540 WeakPolarHBondContact O-CB 3.5Å; R536-S540 PolarHBondContact O-N 3.19Å
537	L	66	Low	69	Low	106 Å²	106	109 Å²	109	56%	0.555	57%	0.574	S	S	*	*	H	α-helix	trans	-66.7	-43.3	175.8	-145	99.6	0	0	0	111.3	N533 L534 G539 S540 L541	N533-L537 WeakPolarHBondContact O-CB 3.38Å; N533-L537 PolarHBondContact O-N 3.47Å; L534-L537 PolarHBondContact O-N 3.15Å; L537-G539 VanDerWaalsContact C-N 3.25Å; L537-G539 PolarHBondContact O-N 3.04Å; L537-S540 PolarHBondContact O-N 2.88Å; L537-L541 HydrophobicContact CD2-CD1 4.18Å; L537-L541 HydrophobicContact CG-CD1 3.89Å; L537-L541 WeakPolarHBondContact O-CB 3.45Å; L537-L541 PolarHBondContact O-N 3.23Å
538	R	63.6	Low	69.6	Low	205 Å²	205	109.2 Å²	109.2	77%	0.774	58%	0.578	S	S	*	*	H	α-helix	trans	-65	-27.7	172.9	-121.1	177.9	64.5	-177	2.7	113.3	L534 K535 L541	L534-R538 VanDerWaalsContact O-CB 3.31Å; L534-R538 WeakPolarHBondContact O-CB 3.42Å; L534-R538 PolarHBondContact O-N 3.37Å; K535-R538 PolarHBondContact O-N 3.12Å; R538-L541 VanDerWaalsContact O-O 3.08Å
539	G	65.7	Low	69.7	Low	62 Å²	62	108.2 Å²	108.2	64%	0.639	58%	0.575	S	S	*	*	H	α-helix	trans	-77.5	-34.2	173.7	0	0	0	0	0	112.3	K535 R536 L537	K535-G539 PolarHBondContact O-N 3.46Å; R536-G539 PolarHBondContact O-N 3.42Å; L537-G539 VanDerWaalsContact C-N 3.25Å; L537-G539 PolarHBondContact O-N 3.04Å
540	S	64.1	Low	69.8	Low	97 Å²	97	106.8 Å²	106.8	68%	0.678	57%	0.568	S	S	*	*	H	α-helix	trans	-83.5	-39.6	-179.9	-179.3	0	0	0	0	113.2	R536 L537	R536-S540 WeakPolarHBondContact O-CB 3.5Å; R536-S540 PolarHBondContact O-N 3.19Å; L537-S540 PolarHBondContact O-N 2.88Å
541	L	55.9	Low	70.3	Confident	100 Å²	100	109.1 Å²	109.1	52%	0.524	57%	0.573	S	S	.	*			trans	-94.5	91.1	168.7	-78.3	95.2	0	0	0	106.8	L537 R538 P543	L537-L541 HydrophobicContact CD2-CD1 4.18Å; L537-L541 HydrophobicContact CG-CD1 3.89Å; L537-L541 WeakPolarHBondContact O-CB 3.45Å; L537-L541 PolarHBondContact O-N 3.23Å; R538-L541 VanDerWaalsContact O-O 3.08Å; L541-P543 WeakPolarHBondContact O-CD 3.48Å
542	S	59.5	Low	70.5	Confident	102 Å²	102	115 Å²	115	71%	0.713	58%	0.584	S	S	*	*			trans	-84.6	85.9	148.2	49.7	0	0	0	0	106.2	D544	S542-D544 PolarHBondContact O-N 3.29Å; S542-D544 VanDerWaalsContact O-N 3.12Å
543	P	60.3	Low	70.8	Confident	88 Å²	88	114.3 Å²	114.3	57%	0.571	58%	0.583	S	S	*	*			trans	-57.3	124.1	173.5	25.4	-32.4	0	0	0	107.2	L541 L545	L541-P543 WeakPolarHBondContact O-CD 3.48Å; P543-L545 VanDerWaalsContact C-N 3.27Å; P543-L545 HydrophobicContact CG-CD2 4.46Å; P543-L545 PolarHBondContact O-N 2.92Å
544	D	67.6	Low	71	Confident	96 Å²	96	118.2 Å²	118.2	51%	0.513	59%	0.591	S	S	.	*			trans	-72.7	90.4	176.4	-173.8	12.3	0	0	0	108.5	S542 N546 A547	S542-D544 PolarHBondContact O-N 3.29Å; S542-D544 VanDerWaalsContact O-N 3.12Å; D544-N546 PolarHBondContact O-N 3.19Å; D544-N546 WeakPolarHBondContact OD1-CB 3.47Å; D544-N546 PolarHBondContact OD1-N 2.89Å; D544-N546 VanDerWaalsContact OD1-N 3.15Å; D544-N546 PolarHBondContact OD1-ND2 3.4Å; D544-A547 HydrophobicContact CB-CB 4.34Å; D544-A547 WeakPolarHBondContact O-CB 3.32Å; D544-A547 PolarHBondContact O-N 3.39Å; D544-A547 VanDerWaalsContact O-N 3.09Å
545	L	70	Confident	71.7	Confident	123 Å²	123	114.6 Å²	114.6	64%	0.644	58%	0.577	S	S	*	*	H	α-helix	trans	-61.3	-22.8	177.9	-60.7	177.6	0	0	0	111	P543 A547 V548 E549	P543-L545 VanDerWaalsContact C-N 3.27Å; P543-L545 HydrophobicContact CG-CD2 4.46Å; P543-L545 PolarHBondContact O-N 2.92Å; L545-A547 VanDerWaalsContact C-N 3.32Å; L545-A547 PolarHBondContact O-N 2.94Å; L545-V548 PolarHBondContact O-N 3.05Å; L545-E549 PolarHBondContact O-N 2.99Å
546	N	76.7	Confident	72.3	Confident	110 Å²	110	109.9 Å²	109.9	59%	0.588	57%	0.568	S	S	*	*	H	α-helix	trans	-67.7	-32.3	176.6	-53.8	-38.6	0	0	0	111.6	D544 V548 E549 E550	D544-N546 PolarHBondContact O-N 3.19Å; D544-N546 WeakPolarHBondContact OD1-CB 3.47Å; D544-N546 PolarHBondContact OD1-N 2.89Å; D544-N546 VanDerWaalsContact OD1-N 3.15Å; D544-N546 PolarHBondContact OD1-ND2 3.4Å; N546-V548 VanDerWaalsContact C-N 3.28Å; N546-V548 PolarHBondContact O-N 3.23Å; N546-E549 PolarHBondContact O-N 3.45Å; N546-E550 VanDerWaalsContact O-CB 3.32Å; N546-E550 WeakPolarHBondContact O-CB 3.18Å; N546-E550 PolarHBondContact O-N 2.9Å
547	A	74.4	Confident	72.9	Confident	46 Å²	46	104.2 Å²	104.2	38%	0.38	56%	0.555	S	S	.	*	H	α-helix	trans	-63.8	-34.1	177.7	0	0	0	0	0	112.2	D544 L545 Y551	D544-A547 HydrophobicContact CB-CB 4.34Å; D544-A547 WeakPolarHBondContact O-CB 3.32Å; D544-A547 PolarHBondContact O-N 3.39Å; D544-A547 VanDerWaalsContact O-N 3.09Å; L545-A547 VanDerWaalsContact C-N 3.32Å; L545-A547 PolarHBondContact O-N 2.94Å; A547-Y551 VanDerWaalsContact O-CB 3.3Å; A547-Y551 WeakPolarHBondContact O-CB 3.21Å; A547-Y551 PolarHBondContact O-N 2.89Å
548	V	78.2	Confident	73.8	Confident	76 Å²	76	106.5 Å²	106.5	46%	0.461	56%	0.557	S	S	.	*	H	α-helix	trans	-70.2	-42.2	175.2	180	0	0	0	0	110.6	L545 N546 Y551 R552	L545-V548 PolarHBondContact O-N 3.05Å; N546-V548 VanDerWaalsContact C-N 3.28Å; N546-V548 PolarHBondContact O-N 3.23Å; V548-Y551 PolarHBondContact O-N 3.36Å; V548-R552 VanDerWaalsContact O-CG 3.32Å; V548-R552 WeakPolarHBondContact O-CG 3.37Å; V548-R552 PolarHBondContact O-N 2.93Å
549	E	77	Confident	74.8	Confident	111 Å²	111	101.3 Å²	101.3	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-64.4	-44	174.2	-74.2	-173.5	172.4	0	0	111.8	L545 N546 Y551 R552 Q553	L545-E549 PolarHBondContact O-N 2.99Å; N546-E549 PolarHBondContact O-N 3.45Å; E549-Y551 PolarHBondContact O-N 2.96Å; E549-R552 PolarHBondContact O-N 3.08Å; E549-Q553 WeakPolarHBondContact O-CB 3.48Å; E549-Q553 VanDerWaalsContact O-CG 3.27Å; E549-Q553 WeakPolarHBondContact O-CG 3.42Å; E549-Q553 PolarHBondContact O-N 3Å
550	E	76.3	Confident	75.7	Confident	86 Å²	86	104.9 Å²	104.9	40%	0.402	54%	0.539	S	S	.	.	H	α-helix	trans	-62.2	-43.3	176.5	-173.1	-179.8	-170.5	0	0	111.3	N546 Q553 R554	N546-E550 VanDerWaalsContact O-CB 3.32Å; N546-E550 WeakPolarHBondContact O-CB 3.18Å; N546-E550 PolarHBondContact O-N 2.9Å; E550-Q553 PolarHBondContact O-N 3.45Å; E550-R554 HydrophobicContact CG-CG 4.4Å; E550-R554 WeakPolarHBondContact O-CB 3.5Å; E550-R554 WeakPolarHBondContact O-CG 3.41Å; E550-R554 PolarHBondContact O-N 2.85Å; E550-R554 IonicContact OE1-CZ 3.93Å; E550-R554 IonicContact OE1-NE 2.82Å; E550-R554 PolarHBondContact OE1-NE 2.68Å; E550-R554 VanDerWaalsContact OE1-NE 3.1Å; E550-R554 IonicContact OE1-NH1 3.77Å; E550-R554 IonicContact OE1-NH2 3.12Å; E550-R554 PolarHBondContact OE1-NH2 2.87Å
551	Y	81.9	Confident	76.8	Confident	135 Å²	135	106.2 Å²	106.2	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-59.7	-47.7	173.2	172.8	-102.9	0	0	0	111.4	A547 V548 E549 Q553 R554 A555	A547-Y551 VanDerWaalsContact O-CB 3.3Å; A547-Y551 WeakPolarHBondContact O-CB 3.21Å; A547-Y551 PolarHBondContact O-N 2.89Å; V548-Y551 PolarHBondContact O-N 3.36Å; E549-Y551 PolarHBondContact O-N 2.96Å; Y551-Q553 VanDerWaalsContact C-N 3.31Å; Y551-Q553 PolarHBondContact O-N 3.29Å; Y551-R554 PolarHBondContact O-N 3.09Å; Y551-A555 WeakPolarHBondContact O-CB 3.4Å; Y551-A555 PolarHBondContact O-N 2.65Å
552	R	80.5	Confident	78.3	Confident	177 Å²	177	104.8 Å²	104.8	67%	0.668	53%	0.526	S	S	*	.	H	α-helix	trans	-59.2	-42.5	177	-75.2	175.5	179	-178.7	0.9	111.5	V548 E549 A556	V548-R552 VanDerWaalsContact O-CG 3.32Å; V548-R552 WeakPolarHBondContact O-CG 3.37Å; V548-R552 PolarHBondContact O-N 2.93Å; E549-R552 PolarHBondContact O-N 3.08Å; R552-A556 VanDerWaalsContact O-CB 3.28Å; R552-A556 WeakPolarHBondContact O-CB 3.49Å; R552-A556 PolarHBondContact O-N 2.99Å
553	Q	82	Confident	79.8	Confident	127 Å²	127	105.6 Å²	105.6	59%	0.593	52%	0.516	S	S	*	.	H	α-helix	trans	-64.4	-50.2	176.8	-71.2	174.8	18.1	0	0	111.5	E549 E550 Y551 A556 V557	E549-Q553 WeakPolarHBondContact O-CB 3.48Å; E549-Q553 VanDerWaalsContact O-CG 3.27Å; E549-Q553 WeakPolarHBondContact O-CG 3.42Å; E549-Q553 PolarHBondContact O-N 3Å; E550-Q553 PolarHBondContact O-N 3.45Å; Y551-Q553 VanDerWaalsContact C-N 3.31Å; Y551-Q553 PolarHBondContact O-N 3.29Å; Q553-A556 PolarHBondContact O-N 3.24Å; Q553-V557 WeakPolarHBondContact O-CG2 3.27Å; Q553-V557 PolarHBondContact O-N 2.95Å
554	R	79.2	Confident	81.2	Confident	168 Å²	168	105.9 Å²	105.9	63%	0.634	51%	0.51	S	S	*	.	H	α-helix	trans	-63.8	-41.6	178.9	-74.5	-179.4	179.8	-168.1	0.6	112.2	E550 Y551 V557 Y558	E550-R554 HydrophobicContact CG-CG 4.4Å; E550-R554 WeakPolarHBondContact O-CB 3.5Å; E550-R554 WeakPolarHBondContact O-CG 3.41Å; E550-R554 PolarHBondContact O-N 2.85Å; E550-R554 IonicContact OE1-CZ 3.93Å; E550-R554 IonicContact OE1-NE 2.82Å; E550-R554 PolarHBondContact OE1-NE 2.68Å; E550-R554 VanDerWaalsContact OE1-NE 3.1Å; E550-R554 IonicContact OE1-NH1 3.77Å; E550-R554 IonicContact OE1-NH2 3.12Å; E550-R554 PolarHBondContact OE1-NH2 2.87Å; Y551-R554 PolarHBondContact O-N 3.09Å; R554-V557 PolarHBondContact O-N 2.88Å; R554-Y558 WeakPolarHBondContact O-CB 3.08Å; R554-Y558 PolarHBondContact O-N 3.25Å
555	A	84.5	Confident	82.2	Confident	36 Å²	36	105.7 Å²	105.7	30%	0.298	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-40.8	175.8	0	0	0	0	0	111.6	Y551 Y558 H559	Y551-A555 WeakPolarHBondContact O-CB 3.4Å; Y551-A555 PolarHBondContact O-N 2.65Å; A555-Y558 PolarHBondContact O-N 2.91Å; A555-H559 VanDerWaalsContact O-CB 3.32Å; A555-H559 WeakPolarHBondContact O-CB 3.5Å; A555-H559 PolarHBondContact O-N 2.88Å
556	A	84.3	Confident	83.1	Confident	61 Å²	61	103.8 Å²	103.8	50%	0.504	50%	0.502	S	S	.	.	H	α-helix	trans	-64	-43.8	174.9	0	0	0	0	0	112.1	R552 Q553 H559 K560	R552-A556 VanDerWaalsContact O-CB 3.28Å; R552-A556 WeakPolarHBondContact O-CB 3.49Å; R552-A556 PolarHBondContact O-N 2.99Å; Q553-A556 PolarHBondContact O-N 3.24Å; A556-H559 PolarHBondContact O-N 3.38Å; A556-K560 WeakPolarHBondContact O-CB 3.39Å; A556-K560 PolarHBondContact O-N 3.34Å
557	V	83	Confident	83.8	Confident	76 Å²	76	102.2 Å²	102.2	46%	0.461	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-47	175.5	170.5	0	0	0	0	111	Q553 R554 H559 K560 F561	Q553-V557 WeakPolarHBondContact O-CG2 3.27Å; Q553-V557 PolarHBondContact O-N 2.95Å; R554-V557 PolarHBondContact O-N 2.88Å; V557-H559 VanDerWaalsContact C-N 3.35Å; V557-H559 PolarHBondContact O-N 3.39Å; V557-K560 WeakPolarHBondContact O-CB 3.47Å; V557-K560 PolarHBondContact O-N 3.14Å; V557-F561 HydrophobicContact CG1-CD2 3.58Å; V557-F561 HydrophobicContact CG1-CE2 3.37Å; V557-F561 VanDerWaalsContact O-CD2 3.26Å; V557-F561 WeakPolarHBondContact O-CD2 3.34Å; V557-F561 PolarHBondContact O-N 3.19Å
558	Y	85	Confident	84.5	Confident	154 Å²	154	104.7 Å²	104.7	60%	0.604	51%	0.507	S	S	*	.	H	α-helix	trans	-57.2	-47.1	175.3	173.2	-100.6	0	0	0	111.6	R554 A555 K560 F561 L562	R554-Y558 WeakPolarHBondContact O-CB 3.08Å; R554-Y558 PolarHBondContact O-N 3.25Å; A555-Y558 PolarHBondContact O-N 2.91Å; Y558-K560 VanDerWaalsContact C-N 3.3Å; Y558-K560 PolarHBondContact O-N 2.84Å; Y558-F561 PolarHBondContact O-N 3.5Å; Y558-L562 HydrophobicContact CE1-CD2 4.31Å; Y558-L562 WeakPolarHBondContact O-CB 3.32Å; Y558-L562 PolarHBondContact O-N 2.97Å
559	H	85	Confident	85.1	Confident	97 Å²	97	104.2 Å²	104.2	45%	0.449	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-35.4	179	-168.1	74.9	0	0	0	112.3	A555 A556 V557 K563	A555-H559 VanDerWaalsContact O-CB 3.32Å; A555-H559 WeakPolarHBondContact O-CB 3.5Å; A555-H559 PolarHBondContact O-N 2.88Å; A556-H559 PolarHBondContact O-N 3.38Å; V557-H559 VanDerWaalsContact C-N 3.35Å; V557-H559 PolarHBondContact O-N 3.39Å; H559-K563 WeakPolarHBondContact NE2-CE 3.45Å; H559-K563 PolarHBondContact NE2-NZ 2.91Å; H559-K563 VanDerWaalsContact NE2-NZ 3.11Å; H559-K563 WeakPolarHBondContact O-CG 3.41Å; H559-K563 PolarHBondContact O-N 3.46Å; H559-K563 VanDerWaalsContact O-N 3.08Å
560	K	85.4	Confident	85.9	Confident	137 Å²	137	103 Å²	103	60%	0.596	50%	0.504	S	S	*	.	H	α-helix	trans	-64.4	-46.7	172.5	-175.1	-178.2	178.5	-177.8	0	111.6	A556 V557 Y558 K563 Q564	A556-K560 WeakPolarHBondContact O-CB 3.39Å; A556-K560 PolarHBondContact O-N 3.34Å; V557-K560 WeakPolarHBondContact O-CB 3.47Å; V557-K560 PolarHBondContact O-N 3.14Å; Y558-K560 VanDerWaalsContact C-N 3.3Å; Y558-K560 PolarHBondContact O-N 2.84Å; K560-K563 PolarHBondContact O-N 3.38Å; K560-Q564 WeakPolarHBondContact O-CG 3.34Å; K560-Q564 PolarHBondContact O-N 3.26Å
561	F	85.4	Confident	86.6	Confident	124 Å²	124	103.2 Å²	103.2	54%	0.544	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-42.1	177.2	-79.9	-60.1	0	0	0	112.3	V557 Y558 K563 Q564 V565	V557-F561 HydrophobicContact CG1-CD2 3.58Å; V557-F561 HydrophobicContact CG1-CE2 3.37Å; V557-F561 VanDerWaalsContact O-CD2 3.26Å; V557-F561 WeakPolarHBondContact O-CD2 3.34Å; V557-F561 PolarHBondContact O-N 3.19Å; Y558-F561 PolarHBondContact O-N 3.5Å; F561-K563 VanDerWaalsContact C-N 3.31Å; F561-K563 PolarHBondContact O-N 3.03Å; F561-Q564 PolarHBondContact O-N 3.49Å; F561-Q564 VanDerWaalsContact O-N 3.13Å; F561-V565 WeakPolarHBondContact O-CG2 3.14Å; F561-V565 PolarHBondContact O-N 3.39Å
562	L	89.2	Confident	87.1	Confident	70 Å²	70	102.9 Å²	102.9	37%	0.366	51%	0.511	S	S	.	.	H	α-helix	trans	-59	-43.8	176.2	-172.6	67.3	0	0	0	111.2	Y558 Q564 V565 N566	Y558-L562 HydrophobicContact CE1-CD2 4.31Å; Y558-L562 WeakPolarHBondContact O-CB 3.32Å; Y558-L562 PolarHBondContact O-N 2.97Å; L562-Q564 PolarHBondContact O-N 3.01Å; L562-V565 PolarHBondContact O-N 3Å; L562-N566 WeakPolarHBondContact O-CB 3.36Å; L562-N566 PolarHBondContact O-N 3.39Å; L562-N566 PolarHBondContact O-ND2 2.94Å
563	K	90.1	Very high	87.7	Confident	120 Å²	120	99.7 Å²	99.7	52%	0.522	50%	0.504	S	S	.	.	H	α-helix	trans	-60.6	-43.6	173.6	-78.1	179.3	176.3	167.9	0	112.6	H559 K560 F561 T567	H559-K563 WeakPolarHBondContact NE2-CE 3.45Å; H559-K563 PolarHBondContact NE2-NZ 2.91Å; H559-K563 VanDerWaalsContact NE2-NZ 3.11Å; H559-K563 WeakPolarHBondContact O-CG 3.41Å; H559-K563 PolarHBondContact O-N 3.46Å; H559-K563 VanDerWaalsContact O-N 3.08Å; K560-K563 PolarHBondContact O-N 3.38Å; F561-K563 VanDerWaalsContact C-N 3.31Å; F561-K563 PolarHBondContact O-N 3.03Å; K563-T567 WeakPolarHBondContact O-CB 3.25Å; K563-T567 PolarHBondContact O-N 3.44Å; K563-T567 PolarHBondContact O-OG1 3.42Å
564	Q	88.8	Confident	88.2	Confident	94 Å²	94	101.1 Å²	101.1	44%	0.439	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-46.3	178.3	-73	177.4	-16.2	0	0	111.8	K560 F561 L562 N566 T567 V568	K560-Q564 WeakPolarHBondContact O-CG 3.34Å; K560-Q564 PolarHBondContact O-N 3.26Å; F561-Q564 PolarHBondContact O-N 3.49Å; F561-Q564 VanDerWaalsContact O-N 3.13Å; L562-Q564 PolarHBondContact O-N 3.01Å; Q564-N566 PolarHBondContact O-N 2.94Å; Q564-T567 PolarHBondContact O-N 3.3Å; Q564-V568 WeakPolarHBondContact O-CG2 3.31Å; Q564-V568 PolarHBondContact O-N 3.45Å
565	V	89.2	Confident	88.9	Confident	91 Å²	91	96 Å²	96	55%	0.552	50%	0.497	S	S	*	.	H	α-helix	trans	-60.5	-46.3	177.7	171	0	0	0	0	110.8	F561 L562 T567 V568 S569	F561-V565 WeakPolarHBondContact O-CG2 3.14Å; F561-V565 PolarHBondContact O-N 3.39Å; L562-V565 PolarHBondContact O-N 3Å; V565-T567 VanDerWaalsContact C-N 3.34Å; V565-T567 PolarHBondContact O-N 3.26Å; V565-V568 PolarHBondContact O-N 2.94Å; V565-S569 WeakPolarHBondContact O-CB 3.47Å; V565-S569 PolarHBondContact O-N 3.4Å
566	N	90	Very high	89.3	Confident	83 Å²	83	96.9 Å²	96.9	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-60.8	-44.1	176.3	-69.2	-11	0	0	0	111.3	L562 Q564 V568 S569 D570	L562-N566 WeakPolarHBondContact O-CB 3.36Å; L562-N566 PolarHBondContact O-N 3.39Å; L562-N566 PolarHBondContact O-ND2 2.94Å; Q564-N566 PolarHBondContact O-N 2.94Å; N566-V568 VanDerWaalsContact C-N 3.35Å; N566-V568 PolarHBondContact O-N 2.87Å; N566-S569 WeakPolarHBondContact O-CB 3.4Å; N566-S569 PolarHBondContact O-N 3.13Å; N566-D570 PolarHBondContact O-N 3.23Å
567	T	90.4	Very high	89.8	Confident	78 Å²	78	98.3 Å²	98.3	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-42.7	178	-55.2	0	0	0	0	112.2	K563 Q564 V565 L571	K563-T567 WeakPolarHBondContact O-CB 3.25Å; K563-T567 PolarHBondContact O-N 3.44Å; K563-T567 PolarHBondContact O-OG1 3.42Å; Q564-T567 PolarHBondContact O-N 3.3Å; V565-T567 VanDerWaalsContact C-N 3.34Å; V565-T567 PolarHBondContact O-N 3.26Å; T567-L571 HydrophobicContact CG2-CD1 4.35Å; T567-L571 WeakPolarHBondContact O-CG 3.39Å; T567-L571 PolarHBondContact O-N 2.78Å
568	V	90	Very high	90.4	Very high	97 Å²	97	101.3 Å²	101.3	59%	0.588	50%	0.501	S	S	*	.	H	α-helix	trans	-68.8	-40.4	177.9	172.4	0	0	0	0	111	Q564 V565 N566 L571 H572	Q564-V568 WeakPolarHBondContact O-CG2 3.31Å; Q564-V568 PolarHBondContact O-N 3.45Å; V565-V568 PolarHBondContact O-N 2.94Å; N566-V568 VanDerWaalsContact C-N 3.35Å; N566-V568 PolarHBondContact O-N 2.87Å; V568-L571 PolarHBondContact O-N 3.45Å; V568-H572 WeakPolarHBondContact O-CB 3.44Å; V568-H572 PolarHBondContact O-N 3.49Å
569	S	90.7	Very high	90.8	Very high	66 Å²	66	101.9 Å²	101.9	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-46.9	174.9	-168	0	0	0	0	111.2	V565 N566 L571 H572 E573	V565-S569 WeakPolarHBondContact O-CB 3.47Å; V565-S569 PolarHBondContact O-N 3.4Å; N566-S569 WeakPolarHBondContact O-CB 3.4Å; N566-S569 PolarHBondContact O-N 3.13Å; S569-L571 VanDerWaalsContact C-N 3.32Å; S569-L571 PolarHBondContact O-N 2.72Å; S569-H572 PolarHBondContact O-N 2.98Å; S569-E573 WeakPolarHBondContact O-CB 3.49Å; S569-E573 PolarHBondContact O-N 3.49Å
570	D	92.7	Very high	91.2	Very high	86 Å²	86	101.1 Å²	101.1	46%	0.46	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-34.7	178.1	-65.7	-14	0	0	0	112.5	N566 R574	N566-D570 PolarHBondContact O-N 3.23Å; D570-R574 WeakPolarHBondContact O-CB 3.33Å; D570-R574 VanDerWaalsContact O-CG 3.27Å; D570-R574 WeakPolarHBondContact O-CG 3.48Å; D570-R574 PolarHBondContact O-N 3.05Å; D570-R574 VanDerWaalsContact O-N 3.13Å; D570-R574 PolarHBondContact O-NE 2.96Å
571	L	91	Very high	91.7	Very high	90 Å²	90	98.7 Å²	98.7	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-68.7	-44.2	174.2	-77.5	168.9	0	0	0	111.6	T567 V568 S569 R574 A575	T567-L571 HydrophobicContact CG2-CD1 4.35Å; T567-L571 WeakPolarHBondContact O-CG 3.39Å; T567-L571 PolarHBondContact O-N 2.78Å; V568-L571 PolarHBondContact O-N 3.45Å; S569-L571 VanDerWaalsContact C-N 3.32Å; S569-L571 PolarHBondContact O-N 2.72Å; L571-R574 PolarHBondContact O-N 3.27Å; L571-A575 WeakPolarHBondContact O-CB 3.46Å; L571-A575 PolarHBondContact O-N 3.1Å
572	H	92.5	Very high	92.1	Very high	128 Å²	128	96 Å²	96	59%	0.593	49%	0.486	S	S	*	.	H	α-helix	trans	-62.3	-47.4	177.5	178.8	68.8	0	0	0	111.2	V568 S569 R574 A575 V576	V568-H572 WeakPolarHBondContact O-CB 3.44Å; V568-H572 PolarHBondContact O-N 3.49Å; S569-H572 PolarHBondContact O-N 2.98Å; H572-R574 VanDerWaalsContact C-N 3.35Å; H572-R574 PolarHBondContact O-N 3.43Å; H572-A575 PolarHBondContact O-N 3.04Å; H572-A575 VanDerWaalsContact O-N 3.17Å; H572-V576 WeakPolarHBondContact O-CG2 3.45Å; H572-V576 PolarHBondContact O-N 3.45Å
573	E	92.8	Very high	92.2	Very high	111 Å²	111	94.5 Å²	94.5	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-60.5	-43.7	178.1	-174.2	173.2	178.4	0	0	111.6	S569 A575 V576 N577	S569-E573 WeakPolarHBondContact O-CB 3.49Å; S569-E573 PolarHBondContact O-N 3.49Å; E573-A575 PolarHBondContact O-N 3.45Å; E573-V576 PolarHBondContact O-N 3.15Å; E573-N577 WeakPolarHBondContact O-CB 3.27Å; E573-N577 PolarHBondContact O-N 2.94Å; E573-N577 PolarHBondContact O-ND2 3.02Å
574	R	93.7	Very high	92.2	Very high	156 Å²	156	95.6 Å²	95.6	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-60.7	-42.8	173.9	-78.1	-175.2	-71.1	171.4	-8	112.7	D570 L571 H572 N577 R578	D570-R574 WeakPolarHBondContact O-CB 3.33Å; D570-R574 VanDerWaalsContact O-CG 3.27Å; D570-R574 WeakPolarHBondContact O-CG 3.48Å; D570-R574 PolarHBondContact O-N 3.05Å; D570-R574 VanDerWaalsContact O-N 3.13Å; D570-R574 PolarHBondContact O-NE 2.96Å; L571-R574 PolarHBondContact O-N 3.27Å; H572-R574 VanDerWaalsContact C-N 3.35Å; H572-R574 PolarHBondContact O-N 3.43Å; R574-N577 PolarHBondContact O-N 2.93Å; R574-R578 VanDerWaalsContact O-CB 3.31Å; R574-R578 WeakPolarHBondContact O-CB 3.32Å; R574-R578 PolarHBondContact O-N 2.86Å
575	A	92.5	Very high	92.5	Very high	61 Å²	61	95 Å²	95	50%	0.504	49%	0.485	S	S	.	.	H	α-helix	trans	-65.5	-42.7	178.9	0	0	0	0	0	111.9	L571 H572 E573 R578 Y579	L571-A575 WeakPolarHBondContact O-CB 3.46Å; L571-A575 PolarHBondContact O-N 3.1Å; H572-A575 PolarHBondContact O-N 3.04Å; H572-A575 VanDerWaalsContact O-N 3.17Å; E573-A575 PolarHBondContact O-N 3.45Å; A575-R578 PolarHBondContact O-N 2.99Å; A575-Y579 WeakPolarHBondContact O-CB 3.48Å; A575-Y579 PolarHBondContact O-N 3.18Å
576	V	93.9	Very high	92.7	Very high	55 Å²	55	97.5 Å²	97.5	33%	0.333	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-45.2	176.6	170.9	0	0	0	0	110.9	H572 E573 R578 Y579 N580	H572-V576 WeakPolarHBondContact O-CG2 3.45Å; H572-V576 PolarHBondContact O-N 3.45Å; E573-V576 PolarHBondContact O-N 3.15Å; V576-R578 VanDerWaalsContact C-N 3.32Å; V576-R578 PolarHBondContact O-N 3.31Å; V576-Y579 PolarHBondContact O-N 3.33Å; V576-N580 WeakPolarHBondContact O-CB 3.4Å; V576-N580 PolarHBondContact O-N 2.83Å; V576-N580 PolarHBondContact O-ND2 3.21Å
577	N	95	Very high	92.7	Very high	90 Å²	90	96.9 Å²	96.9	48%	0.481	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-42.3	176.8	-72.9	-21.1	0	0	0	111.4	E573 R574 N580 E581	E573-N577 WeakPolarHBondContact O-CB 3.27Å; E573-N577 PolarHBondContact O-N 2.94Å; E573-N577 PolarHBondContact O-ND2 3.02Å; R574-N577 PolarHBondContact O-N 2.93Å; N577-N580 PolarHBondContact O-N 2.96Å; N577-E581 WeakPolarHBondContact O-CB 3.21Å; N577-E581 PolarHBondContact O-N 2.82Å
578	R	94.6	Very high	92.8	Very high	139 Å²	139	97.6 Å²	97.6	53%	0.525	48%	0.477	S	S	.	.	H	α-helix	trans	-64.4	-42.7	176.1	-178.4	58.9	-179.6	146.7	4.2	112.4	R574 A575 V576 E581 V582	R574-R578 VanDerWaalsContact O-CB 3.31Å; R574-R578 WeakPolarHBondContact O-CB 3.32Å; R574-R578 PolarHBondContact O-N 2.86Å; A575-R578 PolarHBondContact O-N 2.99Å; V576-R578 VanDerWaalsContact C-N 3.32Å; V576-R578 PolarHBondContact O-N 3.31Å; R578-E581 IonicContact CZ-OE2 3.83Å; R578-E581 IonicContact NH1-OE2 3.74Å; R578-E581 PolarHBondContact NH1-OE2 3.43Å; R578-E581 PolarHBondContact O-N 3.11Å; R578-V582 WeakPolarHBondContact O-CG2 3.41Å; R578-V582 PolarHBondContact O-N 3.39Å
579	Y	93.6	Very high	92.8	Very high	166 Å²	166	99.8 Å²	99.8	65%	0.651	48%	0.48	S	S	*	.	H	α-helix	trans	-59.6	-48.7	175.5	170.1	-95.4	0	0	0	111.2	A575 V576 E581 V582 A583	A575-Y579 WeakPolarHBondContact O-CB 3.48Å; A575-Y579 PolarHBondContact O-N 3.18Å; V576-Y579 PolarHBondContact O-N 3.33Å; Y579-E581 VanDerWaalsContact C-N 3.33Å; Y579-E581 PolarHBondContact O-N 2.94Å; Y579-V582 PolarHBondContact O-N 3.42Å; Y579-A583 VanDerWaalsContact O-CB 3.23Å; Y579-A583 WeakPolarHBondContact O-CB 3.3Å; Y579-A583 PolarHBondContact O-N 2.95Å
580	N	94.1	Very high	92.9	Very high	82 Å²	82	100.2 Å²	100.2	44%	0.439	47%	0.474	S	S	.	.	H	α-helix	trans	-63.5	-38.6	179.6	-71.2	-28	0	0	0	112.1	V576 N577 R584	V576-N580 WeakPolarHBondContact O-CB 3.4Å; V576-N580 PolarHBondContact O-N 2.83Å; V576-N580 PolarHBondContact O-ND2 3.21Å; N577-N580 PolarHBondContact O-N 2.96Å; N580-R584 VanDerWaalsContact O-CB 3.29Å; N580-R584 WeakPolarHBondContact O-CB 3.05Å; N580-R584 PolarHBondContact O-N 2.88Å
581	E	94.6	Very high	92.8	Very high	86 Å²	86	97.7 Å²	97.7	40%	0.402	46%	0.46	S	S	.	.	H	α-helix	trans	-62.3	-50.6	175.4	-175.9	-169.2	-159.5	0	0	111.7	N577 R578 Y579 A583 R584 L585	N577-E581 WeakPolarHBondContact O-CB 3.21Å; N577-E581 PolarHBondContact O-N 2.82Å; R578-E581 IonicContact CZ-OE2 3.83Å; R578-E581 IonicContact NH1-OE2 3.74Å; R578-E581 PolarHBondContact NH1-OE2 3.43Å; R578-E581 PolarHBondContact O-N 3.11Å; Y579-E581 VanDerWaalsContact C-N 3.33Å; Y579-E581 PolarHBondContact O-N 2.94Å; E581-A583 PolarHBondContact O-N 3.35Å; E581-R584 PolarHBondContact O-N 3.42Å; E581-L585 HydrophobicContact CG-CD1 4.25Å; E581-L585 WeakPolarHBondContact O-CG 3.42Å; E581-L585 PolarHBondContact O-N 3.47Å
582	V	94.7	Very high	92.9	Very high	66 Å²	66	96.8 Å²	96.8	40%	0.4	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-41	179.2	174.7	0	0	0	0	111.2	R578 Y579 R584 L585 R586	R578-V582 WeakPolarHBondContact O-CG2 3.41Å; R578-V582 PolarHBondContact O-N 3.39Å; Y579-V582 PolarHBondContact O-N 3.42Å; V582-R584 VanDerWaalsContact C-N 3.32Å; V582-R584 PolarHBondContact O-N 2.74Å; V582-L585 PolarHBondContact O-N 3.32Å; V582-R586 WeakPolarHBondContact O-CB 3.5Å; V582-R586 PolarHBondContact O-N 2.98Å
583	A	90.5	Very high	92.8	Very high	39 Å²	39	90.9 Å²	90.9	32%	0.322	43%	0.432	S	S	.	.	H	α-helix	trans	-61.1	-42	176.6	0	0	0	0	0	111.4	Y579 E581 H587	Y579-A583 VanDerWaalsContact O-CB 3.23Å; Y579-A583 WeakPolarHBondContact O-CB 3.3Å; Y579-A583 PolarHBondContact O-N 2.95Å; E581-A583 PolarHBondContact O-N 3.35Å; A583-H587 WeakPolarHBondContact O-CB 3.37Å; A583-H587 PolarHBondContact O-N 3.49Å; A583-H587 VanDerWaalsContact O-N 3.08Å
584	R	91.1	Very high	92.8	Very high	144 Å²	144	86.9 Å²	86.9	54%	0.543	41%	0.413	S	S	.	.	H	α-helix	trans	-64.1	-50.4	175.3	-171	-173.4	70.6	-161.4	-4.1	111.6	N580 E581 V582 R586 H587 E588	N580-R584 VanDerWaalsContact O-CB 3.29Å; N580-R584 WeakPolarHBondContact O-CB 3.05Å; N580-R584 PolarHBondContact O-N 2.88Å; E581-R584 PolarHBondContact O-N 3.42Å; V582-R584 VanDerWaalsContact C-N 3.32Å; V582-R584 PolarHBondContact O-N 2.74Å; R584-R586 VanDerWaalsContact C-N 3.33Å; R584-R586 PolarHBondContact O-N 3.23Å; R584-H587 PolarHBondContact O-N 3.43Å; R584-H587 VanDerWaalsContact O-N 3.11Å; R584-E588 WeakPolarHBondContact CD-OE1 3.41Å; R584-E588 HydrophobicContact CG-CG 4.3Å; R584-E588 VanDerWaalsContact CG-OE1 3.28Å; R584-E588 WeakPolarHBondContact CG-OE1 3.45Å; R584-E588 IonicContact NE-OE1 2.75Å; R584-E588 WeakPolarHBondContact O-CG 3.3Å; R584-E588 PolarHBondContact O-N 3.37Å
585	L	94.6	Very high	92.7	Very high	82 Å²	82	84.7 Å²	84.7	43%	0.429	41%	0.409	S	S	.	.	H	α-helix	trans	-58.2	-44.8	179.6	-72.9	171.7	0	0	0	111.9	E581 V582 H587 E588 E589	E581-L585 HydrophobicContact CG-CD1 4.25Å; E581-L585 WeakPolarHBondContact O-CG 3.42Å; E581-L585 PolarHBondContact O-N 3.47Å; V582-L585 PolarHBondContact O-N 3.32Å; L585-H587 VanDerWaalsContact C-N 3.32Å; L585-H587 PolarHBondContact O-N 2.9Å; L585-E588 PolarHBondContact O-N 2.93Å; L585-E589 WeakPolarHBondContact O-CB 3.42Å; L585-E589 PolarHBondContact O-N 3.36Å
586	R	93.5	Very high	92.8	Very high	143 Å²	143	87.5 Å²	87.5	54%	0.54	41%	0.41	S	S	.	.	H	α-helix	trans	-59.4	-43.9	175.7	-179.6	-171.5	171.4	-158	-0.8	111.6	V582 R584 F590 F625	V582-R586 WeakPolarHBondContact O-CB 3.5Å; V582-R586 PolarHBondContact O-N 2.98Å; R584-R586 VanDerWaalsContact C-N 3.33Å; R584-R586 PolarHBondContact O-N 3.23Å; R586-F590 WeakPolarHBondContact O-CB 3.03Å; R586-F590 PolarHBondContact O-N 3.3Å; R586-F590 VanDerWaalsContact O-N 3.08Å; R586-F625 HydrophobicContact CG-CE1 4.35Å; R586-F625 HydrophobicContact CG-CZ 3.86Å; R586-F625 VanDerWaalsContact NH2-CG 3.31Å
587	H	90.2	Very high	92.8	Very high	70 Å²	70	85.9 Å²	85.9	32%	0.324	40%	0.399	S	S	.	.	H	α-helix	trans	-66.2	-49.1	179.4	-177	74.1	0	0	0	111.2	A583 R584 L585 E589 F590 I591	A583-H587 WeakPolarHBondContact O-CB 3.37Å; A583-H587 PolarHBondContact O-N 3.49Å; A583-H587 VanDerWaalsContact O-N 3.08Å; R584-H587 PolarHBondContact O-N 3.43Å; R584-H587 VanDerWaalsContact O-N 3.11Å; L585-H587 VanDerWaalsContact C-N 3.32Å; L585-H587 PolarHBondContact O-N 2.9Å; H587-E589 PolarHBondContact O-N 2.88Å; H587-F590 PolarHBondContact O-N 3.22Å; H587-I591 VanDerWaalsContact O-CG1 3.28Å; H587-I591 WeakPolarHBondContact O-CG1 3.24Å; H587-I591 PolarHBondContact O-N 2.97Å
588	E	92.1	Very high	92.7	Very high	93 Å²	93	82.4 Å²	82.4	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-58.4	-49	178.3	-73	172.8	-178.2	0	0	111.8	R584 L585 F590 I591 V592	R584-E588 WeakPolarHBondContact CD-OE1 3.41Å; R584-E588 HydrophobicContact CG-CG 4.3Å; R584-E588 VanDerWaalsContact CG-OE1 3.28Å; R584-E588 WeakPolarHBondContact CG-OE1 3.45Å; R584-E588 IonicContact NE-OE1 2.75Å; R584-E588 WeakPolarHBondContact O-CG 3.3Å; R584-E588 PolarHBondContact O-N 3.37Å; L585-E588 PolarHBondContact O-N 2.93Å; E588-F590 VanDerWaalsContact C-N 3.33Å; E588-F590 PolarHBondContact O-N 3.08Å; E588-I591 PolarHBondContact O-N 3.08Å; E588-V592 WeakPolarHBondContact O-CB 3.42Å; E588-V592 VanDerWaalsContact O-CG2 3.26Å; E588-V592 WeakPolarHBondContact O-CG2 3.43Å; E588-V592 PolarHBondContact O-N 3.36Å
589	E	90.9	Very high	92.7	Very high	142 Å²	142	80.8 Å²	80.8	66%	0.664	38%	0.384	S	S	*	.	H	α-helix	trans	-63	-40.4	179.4	-171.2	179.4	179.8	0	0	111.9	L585 H587 G593	L585-E589 WeakPolarHBondContact O-CB 3.42Å; L585-E589 PolarHBondContact O-N 3.36Å; H587-E589 PolarHBondContact O-N 2.88Å; E589-G593 PolarHBondContact O-N 3.45Å
590	F	92	Very high	92.7	Very high	75 Å²	75	74.5 Å²	74.5	33%	0.329	36%	0.36	S	S	.	.	H	α-helix	trans	-66.1	-45.5	177.5	179.6	-98.5	0	0	0	112.3	R586 H587 E588 G593 F594 F618 P624 F625	R586-F590 WeakPolarHBondContact O-CB 3.03Å; R586-F590 PolarHBondContact O-N 3.3Å; R586-F590 VanDerWaalsContact O-N 3.08Å; H587-F590 PolarHBondContact O-N 3.22Å; E588-F590 VanDerWaalsContact C-N 3.33Å; E588-F590 PolarHBondContact O-N 3.08Å; F590-G593 PolarHBondContact O-N 2.84Å; F590-F594 VanDerWaalsContact O-CB 3.29Å; F590-F594 WeakPolarHBondContact O-CB 3.34Å; F590-F594 PolarHBondContact O-N 2.77Å; F590-F618 AromaticContact CE1-CE1 3.6Å; F590-F618 HydrophobicContact CE1-CE1 3.6Å; F590-F618 HydrophobicContact CE1-CZ 4.12Å; F590-F618 HydrophobicContact CZ-CE1 4.26Å; F590-P624 HydrophobicContact CD1-CB 4.29Å; F590-P624 HydrophobicContact CD1-CG 4.35Å; F590-P624 HydrophobicContact CE1-CB 3.85Å; F590-P624 HydrophobicContact CE1-CG 4.41Å; F590-F625 HydrophobicContact CB-CE1 4.02Å; F590-F625 HydrophobicContact CB-CZ 4.1Å; F590-F625 AromaticContact CD1-CE1 3.98Å; F590-F625 HydrophobicContact CD1-CE1 3.98Å; F590-F625 HydrophobicContact CD1-CZ 4.32Å; F590-F625 HydrophobicContact CD2-CE1 4.06Å; F590-F625 HydrophobicContact CE1-CE1 4.49Å; F590-F625 AromaticContact CG-CE1 3.74Å; F590-F625 HydrophobicContact CG-CE1 3.74Å; F590-F625 HydrophobicContact CG-CZ 4.2Å
591	I	91.5	Very high	92.7	Very high	34 Å²	34	70.6 Å²	70.6	17%	0.174	34%	0.339	C	S	.	.	H	α-helix	trans	-63.7	-46.7	178.9	-66.9	-61.7	0	0	0	110.6	H587 E588 G593 F594 E595 F618	H587-I591 VanDerWaalsContact O-CG1 3.28Å; H587-I591 WeakPolarHBondContact O-CG1 3.24Å; H587-I591 PolarHBondContact O-N 2.97Å; E588-I591 PolarHBondContact O-N 3.08Å; I591-G593 VanDerWaalsContact C-N 3.27Å; I591-G593 PolarHBondContact O-N 3.21Å; I591-F594 PolarHBondContact O-N 3.39Å; I591-E595 HydrophobicContact CG2-CG 4.28Å; I591-E595 WeakPolarHBondContact O-CG 2.91Å; I591-E595 PolarHBondContact O-N 3.2Å; I591-F618 HydrophobicContact CD1-CE2 3.57Å; I591-F618 HydrophobicContact CD1-CZ 3.5Å
592	V	91.7	Very high	92.7	Very high	71 Å²	71	69.8 Å²	69.8	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-59.2	-40.6	176.9	170.9	0	0	0	0	111.3	E588 K596	E588-V592 WeakPolarHBondContact O-CB 3.42Å; E588-V592 VanDerWaalsContact O-CG2 3.26Å; E588-V592 WeakPolarHBondContact O-CG2 3.43Å; E588-V592 PolarHBondContact O-N 3.36Å; V592-K596 HydrophobicContact CG1-CD 4.39Å; V592-K596 WeakPolarHBondContact O-CG 3.39Å; V592-K596 PolarHBondContact O-N 3.18Å
593	G	91.8	Very high	92.5	Very high	4 Å²	4	71.5 Å²	71.5	4%	0.041	34%	0.338	C	S	.	.	H	α-helix	trans	-66.9	-45.8	175.8	0	0	0	0	0	112.8	E589 F590 I591 K596 I597 Y665	E589-G593 PolarHBondContact O-N 3.45Å; F590-G593 PolarHBondContact O-N 2.84Å; I591-G593 VanDerWaalsContact C-N 3.27Å; I591-G593 PolarHBondContact O-N 3.21Å; G593-K596 PolarHBondContact O-N 2.83Å; G593-I597 WeakPolarHBondContact O-CD1 3.42Å; G593-I597 VanDerWaalsContact O-CG1 3.28Å; G593-I597 WeakPolarHBondContact O-CG1 3.06Å; G593-I597 PolarHBondContact O-N 3.33Å; G593-Y665 WeakPolarHBondContact CA-OH 3.31Å
594	F	92.9	Very high	92.6	Very high	26 Å²	26	69.8 Å²	69.8	11%	0.114	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-45.9	-179.8	-178.2	-92.4	0	0	0	112.3	F590 I591 K596 I597 A598 L616 F618 V629	F590-F594 VanDerWaalsContact O-CB 3.29Å; F590-F594 WeakPolarHBondContact O-CB 3.34Å; F590-F594 PolarHBondContact O-N 2.77Å; I591-F594 PolarHBondContact O-N 3.39Å; F594-K596 VanDerWaalsContact C-N 3.33Å; F594-K596 PolarHBondContact O-N 3.49Å; F594-I597 PolarHBondContact O-N 3.47Å; F594-A598 WeakPolarHBondContact O-CB 3.4Å; F594-A598 PolarHBondContact O-N 2.86Å; F594-L616 HydrophobicContact CE1-CB 4.4Å; F594-L616 HydrophobicContact CE2-CB 4.27Å; F594-L616 HydrophobicContact CZ-CB 3.75Å; F594-F618 HydrophobicContact CB-CE1 4.34Å; F594-F618 HydrophobicContact CB-CZ 3.93Å; F594-F618 AromaticContact CD1-CE1 3.64Å; F594-F618 HydrophobicContact CD1-CE1 3.64Å; F594-F618 AromaticContact CD1-CE2 3.73Å; F594-F618 HydrophobicContact CD1-CE2 3.73Å; F594-F618 AromaticContact CD1-CZ 3.11Å; F594-F618 HydrophobicContact CD1-CZ 3.11Å; F594-F618 AromaticContact CD2-CE1 3.64Å; F594-F618 HydrophobicContact CD2-CE1 3.64Å; F594-F618 AromaticContact CD2-CZ 3.95Å; F594-F618 HydrophobicContact CD2-CZ 3.95Å; F594-F618 HydrophobicContact CE1-CD1 4.29Å; F594-F618 HydrophobicContact CE1-CD2 4.34Å; F594-F618 AromaticContact CE1-CE1 3.69Å; F594-F618 HydrophobicContact CE1-CE1 3.69Å; F594-F618 AromaticContact CE1-CE2 3.78Å; F594-F618 HydrophobicContact CE1-CE2 3.78Å; F594-F618 AromaticContact CE1-CZ 3.43Å; F594-F618 HydrophobicContact CE1-CZ 3.43Å; F594-F618 VanDerWaalsContact CE1-CZ 3.43Å; F594-F618 HydrophobicContact CE2-CD1 4.31Å; F594-F618 AromaticContact CE2-CE1 3.72Å; F594-F618 HydrophobicContact CE2-CE1 3.72Å; F594-F618 HydrophobicContact CE2-CZ 4.23Å; F594-F618 AromaticContact CG-CE1 3.59Å; F594-F618 HydrophobicContact CG-CE1 3.59Å; F594-F618 HydrophobicContact CG-CE2 4.41Å; F594-F618 AromaticContact CG-CZ 3.37Å; F594-F618 HydrophobicContact CG-CZ 3.37Å; F594-F618 HydrophobicContact CZ-CD1 4.1Å; F594-F618 AromaticContact CZ-CE1 3.71Å; F594-F618 HydrophobicContact CZ-CE1 3.71Å; F594-F618 AromaticContact CZ-CZ 3.97Å; F594-F618 HydrophobicContact CZ-CZ 3.97Å; F594-V629 HydrophobicContact CD2-CG1 4.44Å; F594-V629 HydrophobicContact CE2-CB 4.26Å; F594-V629 HydrophobicContact CE2-CG1 3.62Å; F594-V629 HydrophobicContact CZ-CG1 4.22Å
595	E	91.8	Very high	92.7	Very high	111 Å²	111	63 Å²	63	52%	0.519	30%	0.298	S	S	.	.	H	α-helix	trans	-60.5	-42.4	178.2	-73.3	178.6	169.3	0	0	111.7	I591 A598 I599	I591-E595 HydrophobicContact CG2-CG 4.28Å; I591-E595 WeakPolarHBondContact O-CG 2.91Å; I591-E595 PolarHBondContact O-N 3.2Å; E595-A598 PolarHBondContact O-N 2.94Å; E595-I599 VanDerWaalsContact O-CG1 3.3Å; E595-I599 WeakPolarHBondContact O-CG1 3.44Å; E595-I599 PolarHBondContact O-N 2.91Å
596	K	93.3	Very high	92.5	Very high	120 Å²	120	64.6 Å²	64.6	52%	0.522	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-45.2	175.2	-74.4	173.9	178	-179.9	0	111.8	V592 G593 F594 A598 K600 Y665	V592-K596 HydrophobicContact CG1-CD 4.39Å; V592-K596 WeakPolarHBondContact O-CG 3.39Å; V592-K596 PolarHBondContact O-N 3.18Å; G593-K596 PolarHBondContact O-N 2.83Å; F594-K596 VanDerWaalsContact C-N 3.33Å; F594-K596 PolarHBondContact O-N 3.49Å; K596-A598 VanDerWaalsContact C-N 3.34Å; K596-A598 PolarHBondContact O-N 3.2Å; K596-K600 WeakPolarHBondContact O-CB 3.43Å; K596-K600 PolarHBondContact O-N 3.21Å; K596-Y665 HydrophobicContact CB-CD2 4.06Å; K596-Y665 HydrophobicContact CB-CE2 4.35Å; K596-Y665 HydrophobicContact CD-CD2 4.2Å; K596-Y665 HydrophobicContact CD-CE2 3.9Å
597	I	94.8	Very high	92.3	Very high	20 Å²	20	61.6 Å²	61.6	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-40.6	177.2	-66.8	158.9	0	0	0	110.6	G593 F594 K600 L601 L616 F658 A661 L662 Y665	G593-I597 WeakPolarHBondContact O-CD1 3.42Å; G593-I597 VanDerWaalsContact O-CG1 3.28Å; G593-I597 WeakPolarHBondContact O-CG1 3.06Å; G593-I597 PolarHBondContact O-N 3.33Å; F594-I597 PolarHBondContact O-N 3.47Å; I597-K600 PolarHBondContact O-N 3.13Å; I597-L601 VanDerWaalsContact O-CB 3.25Å; I597-L601 WeakPolarHBondContact O-CB 3.39Å; I597-L601 PolarHBondContact O-N 3.03Å; I597-L616 HydrophobicContact CG2-CD1 4.28Å; I597-F658 HydrophobicContact CG2-CD2 4.36Å; I597-F658 HydrophobicContact CG2-CE2 3.84Å; I597-A661 HydrophobicContact CG2-CB 4.24Å; I597-L662 HydrophobicContact CD1-CD2 3.77Å; I597-L662 HydrophobicContact CG1-CD2 4.29Å; I597-L662 HydrophobicContact CG2-CD2 4.01Å; I597-Y665 HydrophobicContact CD1-CD1 4.11Å; I597-Y665 HydrophobicContact CD1-CG 4.11Å; I597-Y665 HydrophobicContact CG1-CD1 4.43Å; I597-Y665 HydrophobicContact CG1-CD2 4.38Å; I597-Y665 HydrophobicContact CG1-CG 3.93Å
598	A	93.5	Very high	92.2	Very high	17 Å²	17	58.2 Å²	58.2	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-45.9	179.6	0	0	0	0	0	112.2	F594 E595 K596 K600 L601 K602 L616	F594-A598 WeakPolarHBondContact O-CB 3.4Å; F594-A598 PolarHBondContact O-N 2.86Å; E595-A598 PolarHBondContact O-N 2.94Å; K596-A598 VanDerWaalsContact C-N 3.34Å; K596-A598 PolarHBondContact O-N 3.2Å; A598-K600 VanDerWaalsContact C-N 3.3Å; A598-K600 PolarHBondContact O-N 2.96Å; A598-L601 PolarHBondContact O-N 3.18Å; A598-K602 PolarHBondContact O-N 2.87Å; A598-L616 HydrophobicContact CB-CB 4.08Å; A598-L616 HydrophobicContact CB-CD1 4.5Å
599	I	94.3	Very high	92	Very high	105 Å²	105	54.8 Å²	54.8	54%	0.538	26%	0.262	S	S	.	.	H	α-helix	trans	-58.9	-46.8	173.7	-67.7	165.9	0	0	0	109.5	E595 K602 E603	E595-I599 VanDerWaalsContact O-CG1 3.3Å; E595-I599 WeakPolarHBondContact O-CG1 3.44Å; E595-I599 PolarHBondContact O-N 2.91Å; I599-K602 WeakPolarHBondContact O-CB 3.4Å; I599-K602 PolarHBondContact O-N 3.16Å; I599-E603 PolarHBondContact O-N 3.32Å
600	K	92.7	Very high	91.5	Very high	35 Å²	35	53.9 Å²	53.9	15%	0.152	26%	0.259	C	S	.	.	H	α-helix	trans	-68.5	-41.1	-176.4	-170.7	57.4	166.4	-152.1	0	113.5	K596 I597 A598 K602 E603 I604 A661 E664	K596-K600 WeakPolarHBondContact O-CB 3.43Å; K596-K600 PolarHBondContact O-N 3.21Å; I597-K600 PolarHBondContact O-N 3.13Å; A598-K600 VanDerWaalsContact C-N 3.3Å; A598-K600 PolarHBondContact O-N 2.96Å; K600-K602 PolarHBondContact O-N 3.15Å; K600-E603 HydrophobicContact CD-CB 4.26Å; K600-E603 VanDerWaalsContact CD-OE2 3.25Å; K600-E603 WeakPolarHBondContact CD-OE2 3.24Å; K600-E603 IonicContact NZ-OE2 3.79Å; K600-E603 PolarHBondContact NZ-OE2 3.1Å; K600-E603 PolarHBondContact O-N 2.63Å; K600-E603 VanDerWaalsContact O-N 3.16Å; K600-I604 HydrophobicContact CD-CD1 4.13Å; K600-I604 HydrophobicContact CD-CG1 4.09Å; K600-I604 HydrophobicContact CG-CD1 3.59Å; K600-I604 HydrophobicContact CG-CG1 4.02Å; K600-I604 WeakPolarHBondContact O-CG1 3.49Å; K600-I604 PolarHBondContact O-N 2.83Å; K600-A661 HydrophobicContact CB-CB 4.2Å; K600-A661 HydrophobicContact CG-CB 4.26Å; K600-E664 WeakPolarHBondContact CD-OE2 3.48Å; K600-E664 WeakPolarHBondContact CE-OE1 3.36Å; K600-E664 WeakPolarHBondContact CE-OE2 3.26Å; K600-E664 HydrophobicContact CG-CB 4.16Å; K600-E664 WeakPolarHBondContact CG-OE2 3.44Å; K600-E664 VanDerWaalsContact NZ-CD 3.32Å; K600-E664 IonicContact NZ-OE1 3.19Å; K600-E664 PolarHBondContact NZ-OE1 3.16Å; K600-E664 IonicContact NZ-OE2 3.35Å; K600-E664 PolarHBondContact NZ-OE2 3.48Å
601	L	95	Very high	91.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-53.1	-43.6	174.2	167.9	67.4	0	0	0	110.8	I597 A598 I604 Y605 A614 L616 F631 F658 A661	I597-L601 VanDerWaalsContact O-CB 3.25Å; I597-L601 WeakPolarHBondContact O-CB 3.39Å; I597-L601 PolarHBondContact O-N 3.03Å; A598-L601 PolarHBondContact O-N 3.18Å; L601-I604 PolarHBondContact O-N 3.37Å; L601-Y605 WeakPolarHBondContact O-CB 3.49Å; L601-Y605 PolarHBondContact O-N 3.46Å; L601-A614 HydrophobicContact CD1-CB 4.34Å; L601-A614 HydrophobicContact CD2-CB 4.24Å; L601-A614 HydrophobicContact CG-CB 3.94Å; L601-L616 HydrophobicContact CB-CD1 4.47Å; L601-L616 HydrophobicContact CD2-CB 4.43Å; L601-L616 HydrophobicContact CD2-CD1 3.34Å; L601-L616 HydrophobicContact CD2-CG 3.47Å; L601-L616 VanDerWaalsContact CD2-CG 3.47Å; L601-F631 HydrophobicContact CD1-CE2 4.08Å; L601-F631 HydrophobicContact CD1-CZ 3.93Å; L601-F631 HydrophobicContact CD2-CD2 4.03Å; L601-F631 HydrophobicContact CD2-CE2 3.57Å; L601-F631 HydrophobicContact CD2-CZ 4.17Å; L601-F631 HydrophobicContact CG-CE2 4.32Å; L601-F658 HydrophobicContact CD1-CB 3.96Å; L601-F658 HydrophobicContact CD1-CD2 4.42Å; L601-F658 HydrophobicContact CD2-CD2 4.33Å; L601-A661 HydrophobicContact CB-CB 3.89Å
602	K	93.1	Very high	91.1	Very high	69 Å²	69	51.1 Å²	51.1	30%	0.3	26%	0.26	S	S	.	.	H	α-helix	trans	-62.7	-44.7	179.4	-165.9	168.4	-173.2	161.9	0	111.9	A598 I599 K600 R606 D613	A598-K602 PolarHBondContact O-N 2.87Å; I599-K602 WeakPolarHBondContact O-CB 3.4Å; I599-K602 PolarHBondContact O-N 3.16Å; K600-K602 PolarHBondContact O-N 3.15Å; K602-R606 VanDerWaalsContact O-CB 3.3Å; K602-R606 WeakPolarHBondContact O-CB 3.37Å; K602-R606 VanDerWaalsContact O-CD 3.32Å; K602-R606 WeakPolarHBondContact O-CD 3.48Å; K602-R606 WeakPolarHBondContact O-CG 3.4Å; K602-R606 PolarHBondContact O-N 3.4Å; K602-R606 VanDerWaalsContact O-N 3.09Å; K602-D613 WeakPolarHBondContact CE-OD1 3.32Å; K602-D613 VanDerWaalsContact CG-OD1 3.24Å; K602-D613 WeakPolarHBondContact CG-OD1 3.38Å
603	E	91.7	Very high	91.2	Very high	102 Å²	102	48.3 Å²	48.3	48%	0.477	24%	0.243	S	C	.	.	H	α-helix	trans	-61.8	-49.7	175.4	-67.1	178.3	179	0	0	112.1	I599 K600 R606 L607	I599-E603 PolarHBondContact O-N 3.32Å; K600-E603 HydrophobicContact CD-CB 4.26Å; K600-E603 VanDerWaalsContact CD-OE2 3.25Å; K600-E603 WeakPolarHBondContact CD-OE2 3.24Å; K600-E603 IonicContact NZ-OE2 3.79Å; K600-E603 PolarHBondContact NZ-OE2 3.1Å; K600-E603 PolarHBondContact O-N 2.63Å; K600-E603 VanDerWaalsContact O-N 3.16Å; E603-R606 PolarHBondContact O-N 2.89Å; E603-L607 WeakPolarHBondContact O-CB 3.49Å; E603-L607 PolarHBondContact O-N 3.41Å
604	I	91.6	Very high	91.3	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.015	24%	0.241	C	C	.	.	H	α-helix	trans	-66.4	-45.1	-176.7	-64.7	175	0	0	0	110.4	K600 L601 R606 L607 L608 F660 A661 Y691	K600-I604 HydrophobicContact CD-CD1 4.13Å; K600-I604 HydrophobicContact CD-CG1 4.09Å; K600-I604 HydrophobicContact CG-CD1 3.59Å; K600-I604 HydrophobicContact CG-CG1 4.02Å; K600-I604 WeakPolarHBondContact O-CG1 3.49Å; K600-I604 PolarHBondContact O-N 2.83Å; L601-I604 PolarHBondContact O-N 3.37Å; I604-R606 VanDerWaalsContact C-N 3.33Å; I604-R606 PolarHBondContact O-N 3.44Å; I604-L607 WeakPolarHBondContact O-CB 3.49Å; I604-L607 PolarHBondContact O-N 2.97Å; I604-L608 HydrophobicContact CG2-CD1 3.97Å; I604-L608 HydrophobicContact CG2-CG 4.13Å; I604-L608 WeakPolarHBondContact O-CG 3.5Å; I604-L608 PolarHBondContact O-N 3.36Å; I604-F660 HydrophobicContact CD1-CB 3.72Å; I604-F660 HydrophobicContact CG2-CB 4.17Å; I604-F660 HydrophobicContact CG2-CD2 4.33Å; I604-A661 HydrophobicContact CD1-CB 4.23Å; I604-Y691 WeakPolarHBondContact CD1-OH 3.44Å; I604-Y691 HydrophobicContact CG2-CE1 4.38Å
605	Y	93.6	Very high	91.4	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-64.1	-39.6	179.7	-171.7	-98.8	0	0	0	111.8	L601 L607 L608 T609 D613 A614 V633 L653 S654 S657	L601-Y605 WeakPolarHBondContact O-CB 3.49Å; L601-Y605 PolarHBondContact O-N 3.46Å; Y605-L607 VanDerWaalsContact C-N 3.33Å; Y605-L607 PolarHBondContact O-N 3.1Å; Y605-L608 PolarHBondContact O-N 3.3Å; Y605-T609 HydrophobicContact CD1-CG2 4.27Å; Y605-T609 HydrophobicContact CD2-CG2 4.25Å; Y605-T609 HydrophobicContact CE1-CG2 3.86Å; Y605-T609 HydrophobicContact CE2-CG2 3.8Å; Y605-T609 HydrophobicContact CG-CG2 4.47Å; Y605-T609 WeakPolarHBondContact O-CB 3.46Å; Y605-T609 PolarHBondContact O-N 2.82Å; Y605-T609 PolarHBondContact O-OG1 3.35Å; Y605-D613 VanDerWaalsContact CD1-C 3.46Å; Y605-D613 WeakPolarHBondContact CD1-O 3.28Å; Y605-D613 VanDerWaalsContact CE1-O 3.24Å; Y605-D613 WeakPolarHBondContact CE1-O 3.32Å; Y605-A614 HydrophobicContact CD1-CB 3.74Å; Y605-A614 HydrophobicContact CD2-CB 4.41Å; Y605-A614 HydrophobicContact CE1-CB 4.49Å; Y605-A614 HydrophobicContact CG-CB 3.67Å; Y605-V633 HydrophobicContact CE1-CB 4.15Å; Y605-V633 HydrophobicContact CE2-CB 4.39Å; Y605-V633 HydrophobicContact CE2-CG1 4.29Å; Y605-L653 HydrophobicContact CD2-CD2 3.72Å; Y605-L653 HydrophobicContact CE2-CD2 3.53Å; Y605-S654 VanDerWaalsContact CE2-OG 3.3Å; Y605-S654 WeakPolarHBondContact CE2-OG 3.42Å; Y605-S657 WeakPolarHBondContact CD2-OG 3.08Å
606	R	91.5	Very high	91.4	Very high	114 Å²	114	44.7 Å²	44.7	43%	0.43	23%	0.227	S	C	.	.	H	α-helix	trans	-59.7	-42.8	173.4	-81.2	167	-178.9	-152.3	-5.7	112	K602 E603 I604 M610 G611 G612 D613	K602-R606 VanDerWaalsContact O-CB 3.3Å; K602-R606 WeakPolarHBondContact O-CB 3.37Å; K602-R606 VanDerWaalsContact O-CD 3.32Å; K602-R606 WeakPolarHBondContact O-CD 3.48Å; K602-R606 WeakPolarHBondContact O-CG 3.4Å; K602-R606 PolarHBondContact O-N 3.4Å; K602-R606 VanDerWaalsContact O-N 3.09Å; E603-R606 PolarHBondContact O-N 2.89Å; I604-R606 VanDerWaalsContact C-N 3.33Å; I604-R606 PolarHBondContact O-N 3.44Å; R606-M610 WeakPolarHBondContact O-CA 3.38Å; R606-M610 PolarHBondContact O-N 3.29Å; R606-G611 PolarHBondContact O-N 3.11Å; R606-G611 VanDerWaalsContact O-N 3.13Å; R606-G612 WeakPolarHBondContact CG-O 3.33Å; R606-D613 IonicContact CZ-OD1 3.55Å; R606-D613 VanDerWaalsContact CZ-OD1 3.31Å; R606-D613 IonicContact CZ-OD2 3.21Å; R606-D613 IonicContact NE-OD1 3.26Å; R606-D613 PolarHBondContact NE-OD1 3.36Å; R606-D613 IonicContact NE-OD2 3.36Å; R606-D613 VanDerWaalsContact NH2-CG 3.28Å; R606-D613 IonicContact NH2-OD1 3.63Å; R606-D613 PolarHBondContact NH2-OD1 3.38Å; R606-D613 IonicContact NH2-OD2 3.63Å; R606-D613 PolarHBondContact NH2-OD2 3.26Å
607	L	88.7	Confident	91.2	Very high	80 Å²	80	44.1 Å²	44.1	42%	0.419	23%	0.226	S	C	.	.	H	α-helix	trans	-65.8	-48.8	178	-180	63.9	0	0	0	111.5	E603 I604 Y605 T609 M610 Y691	E603-L607 WeakPolarHBondContact O-CB 3.49Å; E603-L607 PolarHBondContact O-N 3.41Å; I604-L607 WeakPolarHBondContact O-CB 3.49Å; I604-L607 PolarHBondContact O-N 2.97Å; Y605-L607 VanDerWaalsContact C-N 3.33Å; Y605-L607 PolarHBondContact O-N 3.1Å; L607-T609 PolarHBondContact O-N 3.33Å; L607-M610 PolarHBondContact O-N 2.98Å; L607-Y691 HydrophobicContact CD2-CD2 3.62Å; L607-Y691 HydrophobicContact CD2-CE2 3.81Å
608	L	88.5	Confident	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.6	-33.5	-177.3	-66.4	-172.3	0	0	0	112.9	I604 Y605 L653 S657 F660 I687 I688 Y691	I604-L608 HydrophobicContact CG2-CD1 3.97Å; I604-L608 HydrophobicContact CG2-CG 4.13Å; I604-L608 WeakPolarHBondContact O-CG 3.5Å; I604-L608 PolarHBondContact O-N 3.36Å; Y605-L608 PolarHBondContact O-N 3.3Å; L608-L653 HydrophobicContact CB-CD1 4.27Å; L608-L653 HydrophobicContact CB-CD2 3.79Å; L608-L653 HydrophobicContact CB-CG 4.11Å; L608-S657 WeakPolarHBondContact CD1-OG 3.32Å; L608-F660 HydrophobicContact CD1-CD2 4.33Å; L608-F660 HydrophobicContact CD1-CE2 4.44Å; L608-I687 HydrophobicContact CD2-CG2 3.88Å; L608-I688 HydrophobicContact CD1-CG1 4.38Å; L608-I688 HydrophobicContact CD2-CG1 3.93Å; L608-Y691 HydrophobicContact CD2-CD1 4.38Å; L608-Y691 HydrophobicContact CD2-CG 4.25Å
609	T	86.6	Confident	90.6	Very high	21 Å²	21	46.5 Å²	46.5	13%	0.129	24%	0.237	C	C	.	.	H	α-helix	trans	-96.5	-0.7	179.4	59.2	0	0	0	0	114.9	Y605 L607 G611 G612 L653	Y605-T609 HydrophobicContact CD1-CG2 4.27Å; Y605-T609 HydrophobicContact CD2-CG2 4.25Å; Y605-T609 HydrophobicContact CE1-CG2 3.86Å; Y605-T609 HydrophobicContact CE2-CG2 3.8Å; Y605-T609 HydrophobicContact CG-CG2 4.47Å; Y605-T609 WeakPolarHBondContact O-CB 3.46Å; Y605-T609 PolarHBondContact O-N 2.82Å; Y605-T609 PolarHBondContact O-OG1 3.35Å; L607-T609 PolarHBondContact O-N 3.33Å; T609-G611 VanDerWaalsContact C-N 3.31Å; T609-G611 PolarHBondContact O-N 2.95Å; T609-G612 WeakPolarHBondContact OG1-CA 3.39Å; T609-G612 PolarHBondContact OG1-N 2.96Å; T609-L653 HydrophobicContact CG2-CD1 4.15Å; T609-L653 HydrophobicContact CG2-CD2 3.24Å; T609-L653 HydrophobicContact CG2-CG 4.33Å
610	M	81.8	Confident	90.2	Very high	123 Å²	123	44.5 Å²	44.5	61%	0.606	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.8	45.1	-175.2	-61.4	-69.1	-178.3	0	0	113.4	R606 L607 I687	R606-M610 WeakPolarHBondContact O-CA 3.38Å; R606-M610 PolarHBondContact O-N 3.29Å; L607-M610 PolarHBondContact O-N 2.98Å; M610-I687 HydrophobicContact CE-CD1 3.92Å; M610-I687 HydrophobicContact CE-CG1 4.06Å; M610-I687 HydrophobicContact CE-CG2 4.46Å; M610-I687 HydrophobicContact CG-CD1 4.1Å
611	G	84.4	Confident	89.5	Confident	49 Å²	49	49.5 Å²	49.5	51%	0.505	25%	0.254	S	S	.	.	S	Bend	trans	126.5	7.7	173.8	0	0	0	0	0	117.1	R606 T609	R606-G611 PolarHBondContact O-N 3.11Å; R606-G611 VanDerWaalsContact O-N 3.13Å; T609-G611 VanDerWaalsContact C-N 3.31Å; T609-G611 PolarHBondContact O-N 2.95Å
612	G	90.1	Very high	88.9	Confident	2 Å²	2	53.9 Å²	53.9	2%	0.021	29%	0.29	C	S	.	.			trans	-70.6	172.5	164.8	0	0	0	0	0	112.2	R606 T609 R634	R606-G612 WeakPolarHBondContact CG-O 3.33Å; T609-G612 WeakPolarHBondContact OG1-CA 3.39Å; T609-G612 PolarHBondContact OG1-N 2.96Å; G612-R634 CarbonylContact C-O 3.57Å; G612-R634 WeakPolarHBondContact CA-O 3.42Å
613	D	94.2	Very high	88.4	Confident	12 Å²	12	54 Å²	54	6%	0.064	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	150.8	175.9	-140.6	-3	0	0	0	110.9	K602 Y605 R606 V633 R634 W640	K602-D613 WeakPolarHBondContact CE-OD1 3.32Å; K602-D613 VanDerWaalsContact CG-OD1 3.24Å; K602-D613 WeakPolarHBondContact CG-OD1 3.38Å; Y605-D613 VanDerWaalsContact CD1-C 3.46Å; Y605-D613 WeakPolarHBondContact CD1-O 3.28Å; Y605-D613 VanDerWaalsContact CE1-O 3.24Å; Y605-D613 WeakPolarHBondContact CE1-O 3.32Å; R606-D613 IonicContact CZ-OD1 3.55Å; R606-D613 VanDerWaalsContact CZ-OD1 3.31Å; R606-D613 IonicContact CZ-OD2 3.21Å; R606-D613 IonicContact NE-OD1 3.26Å; R606-D613 PolarHBondContact NE-OD1 3.36Å; R606-D613 IonicContact NE-OD2 3.36Å; R606-D613 VanDerWaalsContact NH2-CG 3.28Å; R606-D613 IonicContact NH2-OD1 3.63Å; R606-D613 PolarHBondContact NH2-OD1 3.38Å; R606-D613 IonicContact NH2-OD2 3.63Å; R606-D613 PolarHBondContact NH2-OD2 3.26Å; D613-V633 CarbonylContact O-C 3.58Å; D613-V633 WeakPolarHBondContact O-CA 3.18Å; D613-R634 HydrophobicContact CB-CB 4.33Å; D613-R634 PolarHBondContact N-O 3.23Å; D613-R634 PolarHBondContact O-N 2.97Å; D613-R634 IonicContact OD2-NH2 2.73Å; D613-W640 HydrophobicContact CB-CH2 3.78Å; D613-W640 HydrophobicContact CB-CZ2 4.14Å
614	A	94.1	Very high	87.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	146.1	179.3	0	0	0	0	0	110	L601 Y605 F631 V633	L601-A614 HydrophobicContact CD1-CB 4.34Å; L601-A614 HydrophobicContact CD2-CB 4.24Å; L601-A614 HydrophobicContact CG-CB 3.94Å; Y605-A614 HydrophobicContact CD1-CB 3.74Å; Y605-A614 HydrophobicContact CD2-CB 4.41Å; Y605-A614 HydrophobicContact CE1-CB 4.49Å; Y605-A614 HydrophobicContact CG-CB 3.67Å; A614-F631 HydrophobicContact CB-CE2 4.29Å; A614-V633 HydrophobicContact CB-CG1 4.02Å
615	D	93.8	Very high	87.7	Confident	56 Å²	56	52.8 Å²	52.8	30%	0.299	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.4	179.9	-145.7	-7.1	0	0	0	112	S632 W640	D615-S632 PolarHBondContact N-O 2.87Å; D615-S632 PolarHBondContact O-N 3.39Å; D615-S632 VanDerWaalsContact O-N 3.09Å; D615-S632 VanDerWaalsContact O-O 3.13Å; D615-W640 HydrophobicContact CB-CH2 4.18Å; D615-W640 HydrophobicContact CB-CZ3 3.98Å
616	L	91.8	Very high	87.3	Confident	8 Å²	8	57 Å²	57	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	116	-179.9	-90.2	169.9	0	0	0	108.9	F594 I597 A598 L601 V629 Y630 F631 F658	F594-L616 HydrophobicContact CE1-CB 4.4Å; F594-L616 HydrophobicContact CE2-CB 4.27Å; F594-L616 HydrophobicContact CZ-CB 3.75Å; I597-L616 HydrophobicContact CG2-CD1 4.28Å; A598-L616 HydrophobicContact CB-CB 4.08Å; A598-L616 HydrophobicContact CB-CD1 4.5Å; L601-L616 HydrophobicContact CB-CD1 4.47Å; L601-L616 HydrophobicContact CD2-CB 4.43Å; L601-L616 HydrophobicContact CD2-CD1 3.34Å; L601-L616 HydrophobicContact CD2-CG 3.47Å; L601-L616 VanDerWaalsContact CD2-CG 3.47Å; L616-V629 HydrophobicContact CD2-CG2 4.33Å; L616-Y630 WeakPolarHBondContact CA-O 3.42Å; L616-F631 HydrophobicContact CD2-CB 3.98Å; L616-F631 HydrophobicContact CD2-CD2 4.28Å; L616-F631 HydrophobicContact CD2-CG 4.27Å; L616-F631 HydrophobicContact CG-CD2 4.43Å; L616-F658 HydrophobicContact CD1-CD2 3.95Å; L616-F658 HydrophobicContact CD1-CE2 3.61Å; L616-F658 HydrophobicContact CD2-CE2 4.44Å
617	E	88.5	Confident	86.7	Confident	108 Å²	108	57.7 Å²	57.7	51%	0.505	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	149.9	-178.4	-64.4	-179.2	161.2	0	0	110.8	V629 Y630	E617-V629 CarbonylContact O-C 3.6Å; E617-V629 WeakPolarHBondContact O-CA 3.16Å; E617-Y630 PolarHBondContact N-O 2.78Å; E617-Y630 PolarHBondContact O-N 2.77Å
618	F	89.1	Confident	86.7	Confident	40 Å²	40	55.4 Å²	55.4	18%	0.175	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	143.2	170.8	-61.6	-61.2	0	0	0	110.7	F590 I591 F594 P624 V629	F590-F618 AromaticContact CE1-CE1 3.6Å; F590-F618 HydrophobicContact CE1-CE1 3.6Å; F590-F618 HydrophobicContact CE1-CZ 4.12Å; F590-F618 HydrophobicContact CZ-CE1 4.26Å; I591-F618 HydrophobicContact CD1-CE2 3.57Å; I591-F618 HydrophobicContact CD1-CZ 3.5Å; F594-F618 HydrophobicContact CB-CE1 4.34Å; F594-F618 HydrophobicContact CB-CZ 3.93Å; F594-F618 AromaticContact CD1-CE1 3.64Å; F594-F618 HydrophobicContact CD1-CE1 3.64Å; F594-F618 AromaticContact CD1-CE2 3.73Å; F594-F618 HydrophobicContact CD1-CE2 3.73Å; F594-F618 AromaticContact CD1-CZ 3.11Å; F594-F618 HydrophobicContact CD1-CZ 3.11Å; F594-F618 AromaticContact CD2-CE1 3.64Å; F594-F618 HydrophobicContact CD2-CE1 3.64Å; F594-F618 AromaticContact CD2-CZ 3.95Å; F594-F618 HydrophobicContact CD2-CZ 3.95Å; F594-F618 HydrophobicContact CE1-CD1 4.29Å; F594-F618 HydrophobicContact CE1-CD2 4.34Å; F594-F618 AromaticContact CE1-CE1 3.69Å; F594-F618 HydrophobicContact CE1-CE1 3.69Å; F594-F618 AromaticContact CE1-CE2 3.78Å; F594-F618 HydrophobicContact CE1-CE2 3.78Å; F594-F618 AromaticContact CE1-CZ 3.43Å; F594-F618 HydrophobicContact CE1-CZ 3.43Å; F594-F618 VanDerWaalsContact CE1-CZ 3.43Å; F594-F618 HydrophobicContact CE2-CD1 4.31Å; F594-F618 AromaticContact CE2-CE1 3.72Å; F594-F618 HydrophobicContact CE2-CE1 3.72Å; F594-F618 HydrophobicContact CE2-CZ 4.23Å; F594-F618 AromaticContact CG-CE1 3.59Å; F594-F618 HydrophobicContact CG-CE1 3.59Å; F594-F618 HydrophobicContact CG-CE2 4.41Å; F594-F618 AromaticContact CG-CZ 3.37Å; F594-F618 HydrophobicContact CG-CZ 3.37Å; F594-F618 HydrophobicContact CZ-CD1 4.1Å; F594-F618 AromaticContact CZ-CE1 3.71Å; F594-F618 HydrophobicContact CZ-CE1 3.71Å; F594-F618 AromaticContact CZ-CZ 3.97Å; F594-F618 HydrophobicContact CZ-CZ 3.97Å; F618-P624 HydrophobicContact CD1-CB 4Å; F618-P624 HydrophobicContact CE1-CB 4.13Å; F618-P624 HydrophobicContact CG-CB 4.48Å; F618-V629 HydrophobicContact CD1-CG1 4.05Å; F618-V629 HydrophobicContact CE1-CG1 4.37Å
619	V	88.1	Confident	86.7	Confident	48 Å²	48	58.7 Å²	58.7	29%	0.291	34%	0.338	S	S	.	.	S	Bend	trans	-69.8	-40.2	169.7	-179	0	0	0	0	110.2	E627 G628 Y630	V619-E627 HydrophobicContact CB-CB 3.66Å; V619-E627 HydrophobicContact CG1-CB 3.54Å; V619-E627 HydrophobicContact CG1-CG 4.33Å; V619-E627 HydrophobicContact CG2-CB 4.49Å; V619-G628 WeakPolarHBondContact CG2-O 3.27Å; V619-G628 PolarHBondContact N-O 2.97Å; V619-G628 VanDerWaalsContact N-O 3.09Å; V619-Y630 HydrophobicContact CB-CD2 4.41Å; V619-Y630 HydrophobicContact CB-CE2 3.97Å; V619-Y630 HydrophobicContact CG1-CE2 3.89Å; V619-Y630 HydrophobicContact CG2-CD1 4.26Å; V619-Y630 HydrophobicContact CG2-CD2 3.81Å; V619-Y630 HydrophobicContact CG2-CE1 4.06Å; V619-Y630 HydrophobicContact CG2-CE2 3.61Å; V619-Y630 HydrophobicContact CG2-CG 4.13Å
620	D	84.7	Confident	86.8	Confident	63 Å²	63	62.3 Å²	62.3	34%	0.337	35%	0.35	S	S	.	.			trans	-131.4	119.5	172.8	-177.8	8.8	0	0	0	110.3	A622 N623 P624	D620-A622 WeakPolarHBondContact OD1-CB 3.49Å; D620-A622 PolarHBondContact OD1-N 3.39Å; D620-N623 CarbonylContact O-C 3.45Å; D620-N623 PolarHBondContact OD2-N 2.91Å; D620-P624 WeakPolarHBondContact O-CA 3.46Å
621	I	79.1	Confident	87.4	Confident	140 Å²	140	57.6 Å²	57.6	72%	0.718	33%	0.326	S	S	*	.	S	Bend	trans	-73.9	-31.8	178.8	-56.3	170.7	0	0	0	110.6
622	A	81.2	Confident	87.8	Confident	91 Å²	91	56.4 Å²	56.4	75%	0.752	31%	0.31	S	S	*	.	S	Bend	trans	-73.3	-33.8	-177.9	0	0	0	0	0	111.9	D620	D620-A622 WeakPolarHBondContact OD1-CB 3.49Å; D620-A622 PolarHBondContact OD1-N 3.39Å
623	N	83.1	Confident	88	Confident	73 Å²	73	56.3 Å²	56.3	39%	0.39	31%	0.309	S	S	.	.			trans	-138.9	83.5	177.7	-168.5	-4.5	0	0	0	112.3	D620 F625 T626	D620-N623 CarbonylContact O-C 3.45Å; D620-N623 PolarHBondContact OD2-N 2.91Å; N623-F625 PolarHBondContact O-N 3.5Å; N623-T626 VanDerWaalsContact CG-OG1 3.25Å; N623-T626 PolarHBondContact ND2-OG1 3.49Å; N623-T626 PolarHBondContact O-N 2.88Å; N623-T626 PolarHBondContact OD1-OG1 3.31Å
624	P	82.1	Confident	87.9	Confident	7 Å²	7	60.3 Å²	60.3	5%	0.045	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-8.3	-172.3	26.1	-35.5	0	0	0	114.9	F590 F618 D620	F590-P624 HydrophobicContact CD1-CB 4.29Å; F590-P624 HydrophobicContact CD1-CG 4.35Å; F590-P624 HydrophobicContact CE1-CB 3.85Å; F590-P624 HydrophobicContact CE1-CG 4.41Å; F618-P624 HydrophobicContact CD1-CB 4Å; F618-P624 HydrophobicContact CE1-CB 4.13Å; F618-P624 HydrophobicContact CG-CB 4.48Å; D620-P624 WeakPolarHBondContact O-CA 3.46Å
625	F	87.3	Confident	87.6	Confident	72 Å²	72	60.4 Å²	60.4	32%	0.316	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.4	-174.9	-54.4	-67.3	0	0	0	114.7	R586 F590 N623	R586-F625 HydrophobicContact CG-CE1 4.35Å; R586-F625 HydrophobicContact CG-CZ 3.86Å; R586-F625 VanDerWaalsContact NH2-CG 3.31Å; F590-F625 HydrophobicContact CB-CE1 4.02Å; F590-F625 HydrophobicContact CB-CZ 4.1Å; F590-F625 AromaticContact CD1-CE1 3.98Å; F590-F625 HydrophobicContact CD1-CE1 3.98Å; F590-F625 HydrophobicContact CD1-CZ 4.32Å; F590-F625 HydrophobicContact CD2-CE1 4.06Å; F590-F625 HydrophobicContact CE1-CE1 4.49Å; F590-F625 AromaticContact CG-CE1 3.74Å; F590-F625 HydrophobicContact CG-CE1 3.74Å; F590-F625 HydrophobicContact CG-CZ 4.2Å; N623-F625 PolarHBondContact O-N 3.5Å
626	T	83.8	Confident	87.3	Confident	90 Å²	90	60.7 Å²	60.7	55%	0.552	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-50.5	-170.2	-48.3	0	0	0	0	112.8	N623	N623-T626 VanDerWaalsContact CG-OG1 3.25Å; N623-T626 PolarHBondContact ND2-OG1 3.49Å; N623-T626 PolarHBondContact O-N 2.88Å; N623-T626 PolarHBondContact OD1-OG1 3.31Å
627	E	80.4	Confident	86.9	Confident	128 Å²	128	70.9 Å²	70.9	60%	0.598	37%	0.373	S	S	*	.	S	Bend	trans	-103.2	-11.7	-168.1	-65.5	-69	158.8	0	0	113.8	V619	V619-E627 HydrophobicContact CB-CB 3.66Å; V619-E627 HydrophobicContact CG1-CB 3.54Å; V619-E627 HydrophobicContact CG1-CG 4.33Å; V619-E627 HydrophobicContact CG2-CB 4.49Å
628	G	87.3	Confident	86.9	Confident	33 Å²	33	71 Å²	71	34%	0.34	37%	0.372	S	S	.	.			trans	86.3	-152.3	178	0	0	0	0	0	114.8	V619	V619-G628 WeakPolarHBondContact CG2-O 3.27Å; V619-G628 PolarHBondContact N-O 2.97Å; V619-G628 VanDerWaalsContact N-O 3.09Å
629	V	88.8	Confident	87	Confident	68 Å²	68	72.7 Å²	72.7	41%	0.412	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.5	-169.8	-58.5	0	0	0	0	112.3	F594 L616 E617 F618	F594-V629 HydrophobicContact CD2-CG1 4.44Å; F594-V629 HydrophobicContact CE2-CB 4.26Å; F594-V629 HydrophobicContact CE2-CG1 3.62Å; F594-V629 HydrophobicContact CZ-CG1 4.22Å; L616-V629 HydrophobicContact CD2-CG2 4.33Å; E617-V629 CarbonylContact O-C 3.6Å; E617-V629 WeakPolarHBondContact O-CA 3.16Å; F618-V629 HydrophobicContact CD1-CG1 4.05Å; F618-V629 HydrophobicContact CE1-CG1 4.37Å
630	Y	90	Very high	87.2	Confident	97 Å²	97	75.8 Å²	75.8	38%	0.38	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.4	171	-71.4	-54.7	0	0	0	110.5	L616 E617 V619 K642	L616-Y630 WeakPolarHBondContact CA-O 3.42Å; E617-Y630 PolarHBondContact N-O 2.78Å; E617-Y630 PolarHBondContact O-N 2.77Å; V619-Y630 HydrophobicContact CB-CD2 4.41Å; V619-Y630 HydrophobicContact CB-CE2 3.97Å; V619-Y630 HydrophobicContact CG1-CE2 3.89Å; V619-Y630 HydrophobicContact CG2-CD1 4.26Å; V619-Y630 HydrophobicContact CG2-CD2 3.81Å; V619-Y630 HydrophobicContact CG2-CE1 4.06Å; V619-Y630 HydrophobicContact CG2-CE2 3.61Å; V619-Y630 HydrophobicContact CG2-CG 4.13Å; Y630-K642 VanDerWaalsContact CE1-NZ 3.31Å
631	F	93.1	Very high	87.5	Confident	25 Å²	25	76.8 Å²	76.8	11%	0.11	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	109.4	171.1	-176.5	-161.1	0	0	0	110.3	L601 A614 L616 V633 I643 S654 F658	L601-F631 HydrophobicContact CD1-CE2 4.08Å; L601-F631 HydrophobicContact CD1-CZ 3.93Å; L601-F631 HydrophobicContact CD2-CD2 4.03Å; L601-F631 HydrophobicContact CD2-CE2 3.57Å; L601-F631 HydrophobicContact CD2-CZ 4.17Å; L601-F631 HydrophobicContact CG-CE2 4.32Å; A614-F631 HydrophobicContact CB-CE2 4.29Å; L616-F631 HydrophobicContact CD2-CB 3.98Å; L616-F631 HydrophobicContact CD2-CD2 4.28Å; L616-F631 HydrophobicContact CD2-CG 4.27Å; L616-F631 HydrophobicContact CG-CD2 4.43Å; F631-V633 HydrophobicContact CD2-CG1 4.06Å; F631-V633 HydrophobicContact CE2-CG1 3.33Å; F631-V633 HydrophobicContact CZ-CG1 3.72Å; F631-I643 HydrophobicContact CD1-CB 4.34Å; F631-I643 HydrophobicContact CD1-CD1 3.7Å; F631-I643 HydrophobicContact CE1-CD1 3.81Å; F631-I643 PolarHBondContact O-N 3.45Å; F631-S654 WeakPolarHBondContact CZ-O 3.45Å; F631-F658 HydrophobicContact CE1-CB 3.96Å; F631-F658 HydrophobicContact CE1-CG 4.46Å; F631-F658 HydrophobicContact CZ-CB 4.2Å
632	S	93.4	Very high	88.1	Confident	24 Å²	24	74.5 Å²	74.5	17%	0.168	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.6	-178.9	-62.4	0	0	0	0	110.3	D615 K641	D615-S632 PolarHBondContact N-O 2.87Å; D615-S632 PolarHBondContact O-N 3.39Å; D615-S632 VanDerWaalsContact O-N 3.09Å; D615-S632 VanDerWaalsContact O-O 3.13Å; S632-K641 WeakPolarHBondContact CA-O 3.43Å
633	V	93.6	Very high	88.4	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	154	178.5	-55.1	0	0	0	0	111.1	Y605 D613 A614 F631 K641 L646	Y605-V633 HydrophobicContact CE1-CB 4.15Å; Y605-V633 HydrophobicContact CE2-CB 4.39Å; Y605-V633 HydrophobicContact CE2-CG1 4.29Å; D613-V633 CarbonylContact O-C 3.58Å; D613-V633 WeakPolarHBondContact O-CA 3.18Å; A614-V633 HydrophobicContact CB-CG1 4.02Å; F631-V633 HydrophobicContact CD2-CG1 4.06Å; F631-V633 HydrophobicContact CE2-CG1 3.33Å; F631-V633 HydrophobicContact CZ-CG1 3.72Å; V633-K641 PolarHBondContact N-O 3.36Å; V633-K641 PolarHBondContact O-N 2.9Å; V633-L646 HydrophobicContact CG2-CD1 3.3Å; V633-L646 HydrophobicContact CG2-CD2 3.58Å; V633-L646 HydrophobicContact CG2-CG 3.99Å
634	R	92.8	Very high	88.6	Confident	95 Å²	95	73.1 Å²	73.1	36%	0.358	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	98.8	174.6	-174.3	-178.5	67.8	174.3	-1.4	108.5	G612 D613 K638 W640	G612-R634 CarbonylContact C-O 3.57Å; G612-R634 WeakPolarHBondContact CA-O 3.42Å; D613-R634 HydrophobicContact CB-CB 4.33Å; D613-R634 PolarHBondContact N-O 3.23Å; D613-R634 PolarHBondContact O-N 2.97Å; D613-R634 IonicContact OD2-NH2 2.73Å; R634-K638 WeakPolarHBondContact CG-O 3.46Å; R634-W640 HydrophobicContact CB-CD2 3.68Å; R634-W640 HydrophobicContact CB-CE3 3.74Å; R634-W640 HydrophobicContact CB-CG 4.2Å; R634-W640 HydrophobicContact CB-CH2 4.25Å; R634-W640 HydrophobicContact CB-CZ2 4.18Å; R634-W640 HydrophobicContact CB-CZ3 4.04Å; R634-W640 HydrophobicContact CG-CD2 4.43Å
635	P	88.7	Confident	88.9	Confident	3 Å²	3	78 Å²	78	2%	0.019	39%	0.393	C	S	.	.			trans	-59.6	158.1	170.4	-19	31.2	0	0	0	111.1	K637 K638 L646 E650	P635-K637 PolarHBondContact O-N 3.01Å; P635-K638 HydrophobicContact CB-CB 4.25Å; P635-K638 HydrophobicContact CB-CD 4.06Å; P635-K638 HydrophobicContact CB-CG 4.41Å; P635-K638 HydrophobicContact CG-CB 4.47Å; P635-K638 HydrophobicContact CG-CD 4.28Å; P635-K638 PolarHBondContact O-N 3.18Å; P635-K638 VanDerWaalsContact O-N 3.11Å; P635-L646 HydrophobicContact CG-CD2 4.32Å; P635-E650 HydrophobicContact CG-CG 4.35Å
636	P	85.9	Confident	88.9	Confident	62 Å²	62	75.6 Å²	75.6	40%	0.403	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	133.5	-179.8	23.5	-33.5	0	0	0	111	K638	P636-K638 PolarHBondContact O-N 3.43Å
637	K	84.6	Confident	89.1	Confident	221 Å²	221	74.2 Å²	74.2	96%	0.961	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	17.4	-178.8	-51.4	177.1	-178.2	176.1	0	115.2	P635	P635-K637 PolarHBondContact O-N 3.01Å
638	K	87.8	Confident	89.4	Confident	112 Å²	112	70.5 Å²	70.5	49%	0.487	37%	0.373	S	S	.	.	S	Bend	trans	-119.4	174.3	176.2	-63.7	-171.9	-171.5	170.7	0	112.1	R634 P635 P636 E650	R634-K638 WeakPolarHBondContact CG-O 3.46Å; P635-K638 HydrophobicContact CB-CB 4.25Å; P635-K638 HydrophobicContact CB-CD 4.06Å; P635-K638 HydrophobicContact CB-CG 4.41Å; P635-K638 HydrophobicContact CG-CB 4.47Å; P635-K638 HydrophobicContact CG-CD 4.28Å; P635-K638 PolarHBondContact O-N 3.18Å; P635-K638 VanDerWaalsContact O-N 3.11Å; P636-K638 PolarHBondContact O-N 3.43Å; K638-E650 IonicContact NZ-OE1 3.22Å; K638-E650 PolarHBondContact NZ-OE1 2.96Å
639	S	90.4	Very high	89.3	Confident	74 Å²	74	70 Å²	70	52%	0.517	37%	0.368	S	S	.	.			trans	-84.2	162.6	174.8	65.7	0	0	0	0	112.2	K641	S639-K641 PolarHBondContact O-N 3.33Å
640	W	93.6	Very high	89.2	Confident	113 Å²	113	68.4 Å²	68.4	43%	0.428	36%	0.356	S	S	.	.			trans	-59.8	132.6	169.8	-69.4	101.6	0	0	0	111.1	D613 D615 R634	D613-W640 HydrophobicContact CB-CH2 3.78Å; D613-W640 HydrophobicContact CB-CZ2 4.14Å; D615-W640 HydrophobicContact CB-CH2 4.18Å; D615-W640 HydrophobicContact CB-CZ3 3.98Å; R634-W640 HydrophobicContact CB-CD2 3.68Å; R634-W640 HydrophobicContact CB-CE3 3.74Å; R634-W640 HydrophobicContact CB-CG 4.2Å; R634-W640 HydrophobicContact CB-CH2 4.25Å; R634-W640 HydrophobicContact CB-CZ2 4.18Å; R634-W640 HydrophobicContact CB-CZ3 4.04Å; R634-W640 HydrophobicContact CG-CD2 4.43Å
641	K	91.2	Very high	89.2	Confident	84 Å²	84	68.7 Å²	68.7	37%	0.365	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	147.1	176.4	-69.4	-174.9	177.6	-174.3	0	110.3	S632 V633 S639 L646	S632-K641 WeakPolarHBondContact CA-O 3.43Å; V633-K641 PolarHBondContact N-O 3.36Å; V633-K641 PolarHBondContact O-N 2.9Å; S639-K641 PolarHBondContact O-N 3.33Å; K641-L646 HydrophobicContact CB-CD2 3.88Å; K641-L646 HydrophobicContact CD-CD2 4.4Å
642	K	91.3	Very high	89	Confident	93 Å²	93	69.5 Å²	69.5	40%	0.404	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	149.9	168.3	-66	-172.3	177	-171.2	0	110	Y630 C644 N645	Y630-K642 VanDerWaalsContact CE1-NZ 3.31Å; K642-C644 PolarHBondContact O-N 2.9Å; K642-N645 PolarHBondContact O-N 3.15Å
643	I	87.3	Confident	88.9	Confident	45 Å²	45	68.6 Å²	68.6	23%	0.231	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-52.4	-32.3	-177.8	-171.8	166	0	0	0	114.6	F631 N645 L646 K651	F631-I643 HydrophobicContact CD1-CB 4.34Å; F631-I643 HydrophobicContact CD1-CD1 3.7Å; F631-I643 HydrophobicContact CE1-CD1 3.81Å; F631-I643 PolarHBondContact O-N 3.45Å; I643-N645 PolarHBondContact O-N 3.48Å; I643-L646 HydrophobicContact CB-CD1 4.48Å; I643-L646 HydrophobicContact CG1-CD1 4.32Å; I643-K651 HydrophobicContact CD1-CG 4.47Å; I643-K651 HydrophobicContact CG1-CG 4Å
644	C	86.9	Confident	88.8	Confident	89 Å²	89	68.6 Å²	68.6	60%	0.601	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-66.5	-22	178	50.6	0	0	0	0	114.3	K642	K642-C644 PolarHBondContact O-N 2.9Å
645	N	89	Confident	88.7	Confident	111 Å²	111	66.1 Å²	66.1	59%	0.594	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-105.8	12.1	-174.4	-66	-15.6	0	0	0	113.4	K642 I643	K642-N645 PolarHBondContact O-N 3.15Å; I643-N645 PolarHBondContact O-N 3.48Å
646	L	87.9	Confident	88.8	Confident	20 Å²	20	66.5 Å²	66.5	11%	0.105	36%	0.358	C	S	.	.	S	Bend	trans	-87.8	161.5	178.3	-63.1	173.4	0	0	0	111.8	V633 P635 K641 I643 E650 K651	V633-L646 HydrophobicContact CG2-CD1 3.3Å; V633-L646 HydrophobicContact CG2-CD2 3.58Å; V633-L646 HydrophobicContact CG2-CG 3.99Å; P635-L646 HydrophobicContact CG-CD2 4.32Å; K641-L646 HydrophobicContact CB-CD2 3.88Å; K641-L646 HydrophobicContact CD-CD2 4.4Å; I643-L646 HydrophobicContact CB-CD1 4.48Å; I643-L646 HydrophobicContact CG1-CD1 4.32Å; L646-E650 HydrophobicContact CB-CB 4.01Å; L646-E650 HydrophobicContact CD2-CB 4.5Å; L646-K651 HydrophobicContact CB-CB 4.27Å
647	S	87.9	Confident	89.1	Confident	61 Å²	61	63.5 Å²	63.5	43%	0.427	34%	0.339	S	S	.	.			trans	-66.9	164	169.4	79.3	0	0	0	0	111.1	G649 E650 K651	S647-G649 PolarHBondContact O-N 3.46Å; S647-E650 PolarHBondContact N-OE2 3.09Å; S647-E650 PolarHBondContact O-N 3.24Å; S647-E650 WeakPolarHBondContact OG-CB 3.3Å; S647-E650 VanDerWaalsContact OG-CG 3.27Å; S647-E650 WeakPolarHBondContact OG-CG 3.32Å; S647-E650 PolarHBondContact OG-N 3.15Å; S647-K651 VanDerWaalsContact O-CB 3.22Å; S647-K651 WeakPolarHBondContact O-CB 3.31Å; S647-K651 PolarHBondContact O-N 3.36Å
648	G	85.6	Confident	89.5	Confident	50 Å²	50	55.7 Å²	55.7	52%	0.515	31%	0.305	S	S	.	.	H	α-helix	trans	-55.2	-49.2	179.5	0	0	0	0	0	113.4	K651 T652	G648-K651 PolarHBondContact O-N 3.17Å; G648-T652 PolarHBondContact O-N 2.94Å; G648-T652 PolarHBondContact O-OG1 3.4Å; G648-T652 VanDerWaalsContact O-OG1 3.13Å
649	G	85.6	Confident	89.6	Confident	23 Å²	23	53.8 Å²	53.8	24%	0.237	30%	0.3	C	S	.	.	H	α-helix	trans	-67.8	-40.6	178.3	0	0	0	0	0	113.4	S647 K651 T652 L653 A679	S647-G649 PolarHBondContact O-N 3.46Å; G649-K651 VanDerWaalsContact C-N 3.35Å; G649-K651 PolarHBondContact O-N 3.4Å; G649-T652 PolarHBondContact O-N 3.22Å; G649-L653 PolarHBondContact O-N 3.37Å; G649-A679 VanDerWaalsContact CA-O 3.32Å; G649-A679 WeakPolarHBondContact CA-O 3.2Å
650	E	87.5	Confident	89.6	Confident	35 Å²	35	50.4 Å²	50.4	16%	0.164	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-43.5	175.1	-73.4	173	173.6	0	0	111.1	P635 K638 L646 S647 T652 L653 S654	P635-E650 HydrophobicContact CG-CG 4.35Å; K638-E650 IonicContact NZ-OE1 3.22Å; K638-E650 PolarHBondContact NZ-OE1 2.96Å; L646-E650 HydrophobicContact CB-CB 4.01Å; L646-E650 HydrophobicContact CD2-CB 4.5Å; S647-E650 PolarHBondContact N-OE2 3.09Å; S647-E650 PolarHBondContact O-N 3.24Å; S647-E650 WeakPolarHBondContact OG-CB 3.3Å; S647-E650 VanDerWaalsContact OG-CG 3.27Å; S647-E650 WeakPolarHBondContact OG-CG 3.32Å; S647-E650 PolarHBondContact OG-N 3.15Å; E650-T652 PolarHBondContact O-N 3.33Å; E650-L653 PolarHBondContact O-N 3.33Å; E650-S654 WeakPolarHBondContact O-CB 3.4Å; E650-S654 PolarHBondContact O-N 3.41Å; E650-S654 PolarHBondContact O-OG 3.23Å
651	K	89.6	Confident	89.5	Confident	103 Å²	103	45 Å²	45	45%	0.448	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-45.3	176.8	-174.4	178.5	178.9	-176.1	0	111.3	I643 L646 S647 G648 G649 S654 S655	I643-K651 HydrophobicContact CD1-CG 4.47Å; I643-K651 HydrophobicContact CG1-CG 4Å; L646-K651 HydrophobicContact CB-CB 4.27Å; S647-K651 VanDerWaalsContact O-CB 3.22Å; S647-K651 WeakPolarHBondContact O-CB 3.31Å; S647-K651 PolarHBondContact O-N 3.36Å; G648-K651 PolarHBondContact O-N 3.17Å; G649-K651 VanDerWaalsContact C-N 3.35Å; G649-K651 PolarHBondContact O-N 3.4Å; K651-S654 PolarHBondContact O-N 2.84Å; K651-S655 WeakPolarHBondContact O-CB 3.05Å; K651-S655 PolarHBondContact O-N 3.27Å; K651-S655 PolarHBondContact O-OG 2.88Å
652	T	89.5	Confident	89.5	Confident	41 Å²	41	44.4 Å²	44.4	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-45.5	176.5	-62	0	0	0	0	111.2	G648 G649 E650 S655 L656 I676 L680	G648-T652 PolarHBondContact O-N 2.94Å; G648-T652 PolarHBondContact O-OG1 3.4Å; G648-T652 VanDerWaalsContact O-OG1 3.13Å; G649-T652 PolarHBondContact O-N 3.22Å; E650-T652 PolarHBondContact O-N 3.33Å; T652-S655 PolarHBondContact O-N 3.4Å; T652-L656 VanDerWaalsContact O-CB 3.22Å; T652-L656 WeakPolarHBondContact O-CB 3.29Å; T652-L656 PolarHBondContact O-N 2.96Å; T652-I676 WeakPolarHBondContact CG2-O 3.49Å; T652-L680 HydrophobicContact CG2-CD1 4.26Å; T652-L680 HydrophobicContact CG2-CD2 4Å; T652-L680 HydrophobicContact CG2-CG 4.07Å
653	L	90	Very high	89.2	Confident	6 Å²	6	42.2 Å²	42.2	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-66.9	-41.7	179.7	-166.3	152.8	0	0	0	111.9	Y605 L608 T609 G649 E650 L656 S657 L680 N684	Y605-L653 HydrophobicContact CD2-CD2 3.72Å; Y605-L653 HydrophobicContact CE2-CD2 3.53Å; L608-L653 HydrophobicContact CB-CD1 4.27Å; L608-L653 HydrophobicContact CB-CD2 3.79Å; L608-L653 HydrophobicContact CB-CG 4.11Å; T609-L653 HydrophobicContact CG2-CD1 4.15Å; T609-L653 HydrophobicContact CG2-CD2 3.24Å; T609-L653 HydrophobicContact CG2-CG 4.33Å; G649-L653 PolarHBondContact O-N 3.37Å; E650-L653 PolarHBondContact O-N 3.33Å; L653-L656 PolarHBondContact O-N 3.37Å; L653-S657 WeakPolarHBondContact O-CB 3.25Å; L653-S657 PolarHBondContact O-N 3.12Å; L653-S657 PolarHBondContact O-OG 3.36Å; L653-L680 HydrophobicContact CB-CD2 4.44Å; L653-N684 HydrophobicContact CD1-CB 4.27Å; L653-N684 WeakPolarHBondContact CD1-OD1 3.16Å
654	S	91.5	Very high	89.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-47	173.4	-60.5	0	0	0	0	111.9	Y605 F631 E650 K651 S657 F658	Y605-S654 VanDerWaalsContact CE2-OG 3.3Å; Y605-S654 WeakPolarHBondContact CE2-OG 3.42Å; F631-S654 WeakPolarHBondContact CZ-O 3.45Å; E650-S654 WeakPolarHBondContact O-CB 3.4Å; E650-S654 PolarHBondContact O-N 3.41Å; E650-S654 PolarHBondContact O-OG 3.23Å; K651-S654 PolarHBondContact O-N 2.84Å; S654-S657 PolarHBondContact O-N 2.95Å; S654-F658 PolarHBondContact O-N 3.14Å; S654-F658 VanDerWaalsContact O-N 3.07Å
655	S	91.5	Very high	89.1	Confident	43 Å²	43	45.2 Å²	45.2	30%	0.301	25%	0.247	S	C	.	.	H	α-helix	trans	-62.1	-44.7	176.8	-72	0	0	0	0	112	K651 T652 S657 F658 I659	K651-S655 WeakPolarHBondContact O-CB 3.05Å; K651-S655 PolarHBondContact O-N 3.27Å; K651-S655 PolarHBondContact O-OG 2.88Å; T652-S655 PolarHBondContact O-N 3.4Å; S655-S657 VanDerWaalsContact C-N 3.34Å; S655-S657 PolarHBondContact O-N 3.41Å; S655-F658 PolarHBondContact O-N 3.26Å; S655-I659 VanDerWaalsContact O-CG1 3.3Å; S655-I659 WeakPolarHBondContact O-CG1 3.14Å; S655-I659 PolarHBondContact O-N 3.48Å
656	L	90.3	Very high	89	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-40.3	179.5	-168.2	70.1	0	0	0	111.3	T652 L653 F658 I659 F660 I676 I688	T652-L656 VanDerWaalsContact O-CB 3.22Å; T652-L656 WeakPolarHBondContact O-CB 3.29Å; T652-L656 PolarHBondContact O-N 2.96Å; L653-L656 PolarHBondContact O-N 3.37Å; L656-F658 VanDerWaalsContact C-N 3.28Å; L656-F658 PolarHBondContact O-N 2.8Å; L656-I659 PolarHBondContact O-N 3.01Å; L656-F660 HydrophobicContact CD1-CE2 3.95Å; L656-F660 HydrophobicContact CD1-CZ 4.02Å; L656-F660 HydrophobicContact CD2-CD2 4.45Å; L656-F660 HydrophobicContact CD2-CE2 3.59Å; L656-F660 HydrophobicContact CD2-CZ 4.12Å; L656-F660 HydrophobicContact CG-CD2 3.85Å; L656-F660 HydrophobicContact CG-CE2 3.37Å; L656-F660 HydrophobicContact CG-CZ 3.95Å; L656-F660 WeakPolarHBondContact O-CD2 3.5Å; L656-F660 WeakPolarHBondContact O-CG 3.15Å; L656-F660 PolarHBondContact O-N 3.12Å; L656-I676 HydrophobicContact CD1-CD1 4.19Å; L656-I676 HydrophobicContact CD2-CD1 4.41Å; L656-I688 HydrophobicContact CD2-CB 4.47Å; L656-I688 HydrophobicContact CD2-CD1 3.63Å; L656-I688 HydrophobicContact CD2-CG1 3.95Å; L656-I688 HydrophobicContact CD2-CG2 3.64Å
657	S	91.5	Very high	88.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-42.1	173.7	-54.9	0	0	0	0	111.9	Y605 L608 L653 S654 S655 F660 A661	Y605-S657 WeakPolarHBondContact CD2-OG 3.08Å; L608-S657 WeakPolarHBondContact CD1-OG 3.32Å; L653-S657 WeakPolarHBondContact O-CB 3.25Å; L653-S657 PolarHBondContact O-N 3.12Å; L653-S657 PolarHBondContact O-OG 3.36Å; S654-S657 PolarHBondContact O-N 2.95Å; S655-S657 VanDerWaalsContact C-N 3.34Å; S655-S657 PolarHBondContact O-N 3.41Å; S657-F660 PolarHBondContact O-N 2.88Å; S657-A661 WeakPolarHBondContact O-CB 3.32Å; S657-A661 PolarHBondContact O-N 3.16Å
658	F	93.5	Very high	88.8	Confident	57 Å²	57	52.6 Å²	52.6	25%	0.25	28%	0.276	C	S	.	.	H	α-helix	trans	-68.7	-42.3	177.4	-176.9	-125.3	0	0	0	112.4	I597 L601 L616 F631 S654 S655 L656 F660 A661 L662	I597-F658 HydrophobicContact CG2-CD2 4.36Å; I597-F658 HydrophobicContact CG2-CE2 3.84Å; L601-F658 HydrophobicContact CD1-CB 3.96Å; L601-F658 HydrophobicContact CD1-CD2 4.42Å; L601-F658 HydrophobicContact CD2-CD2 4.33Å; L616-F658 HydrophobicContact CD1-CD2 3.95Å; L616-F658 HydrophobicContact CD1-CE2 3.61Å; L616-F658 HydrophobicContact CD2-CE2 4.44Å; F631-F658 HydrophobicContact CE1-CB 3.96Å; F631-F658 HydrophobicContact CE1-CG 4.46Å; F631-F658 HydrophobicContact CZ-CB 4.2Å; S654-F658 PolarHBondContact O-N 3.14Å; S654-F658 VanDerWaalsContact O-N 3.07Å; S655-F658 PolarHBondContact O-N 3.26Å; L656-F658 VanDerWaalsContact C-N 3.28Å; L656-F658 PolarHBondContact O-N 2.8Å; F658-F660 VanDerWaalsContact C-N 3.34Å; F658-F660 PolarHBondContact O-N 2.88Å; F658-A661 WeakPolarHBondContact O-CB 3.21Å; F658-A661 PolarHBondContact O-N 2.81Å; F658-L662 HydrophobicContact CD1-CD1 4.17Å; F658-L662 HydrophobicContact CE1-CD1 3.81Å; F658-L662 HydrophobicContact CE1-CG 4.45Å; F658-L662 HydrophobicContact CE2-CD1 4.41Å; F658-L662 HydrophobicContact CE2-CD2 4.22Å; F658-L662 HydrophobicContact CE2-CG 4.17Å; F658-L662 HydrophobicContact CZ-CD1 3.95Å; F658-L662 HydrophobicContact CZ-CD2 4.14Å; F658-L662 HydrophobicContact CZ-CG 4.15Å; F658-L662 WeakPolarHBondContact O-CG 3.35Å; F658-L662 PolarHBondContact O-N 3.44Å
659	I	91	Very high	88.8	Confident	72 Å²	72	54.9 Å²	54.9	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-57.9	-47.6	174	-72	168.4	0	0	0	110.3	S655 L656 A661 L662 H663	S655-I659 VanDerWaalsContact O-CG1 3.3Å; S655-I659 WeakPolarHBondContact O-CG1 3.14Å; S655-I659 PolarHBondContact O-N 3.48Å; L656-I659 PolarHBondContact O-N 3.01Å; I659-A661 VanDerWaalsContact C-N 3.34Å; I659-A661 PolarHBondContact O-N 3.22Å; I659-L662 WeakPolarHBondContact O-CB 3.44Å; I659-L662 PolarHBondContact O-N 2.65Å; I659-H663 VanDerWaalsContact CG2-CD2 3.49Å; I659-H663 WeakPolarHBondContact CG2-CD2 3.5Å; I659-H663 WeakPolarHBondContact CG2-NE2 3.39Å; I659-H663 PolarHBondContact O-CD2 3.18Å; I659-H663 VanDerWaalsContact O-CG 3.24Å; I659-H663 PolarHBondContact O-N 3.24Å
660	F	89.4	Confident	89	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-64.3	-34.9	176.4	-68.5	-49.6	0	0	0	113.5	I604 L608 L656 S657 F658 H663 E664 M673 I688 Y691 V692 L695	I604-F660 HydrophobicContact CD1-CB 3.72Å; I604-F660 HydrophobicContact CG2-CB 4.17Å; I604-F660 HydrophobicContact CG2-CD2 4.33Å; L608-F660 HydrophobicContact CD1-CD2 4.33Å; L608-F660 HydrophobicContact CD1-CE2 4.44Å; L656-F660 HydrophobicContact CD1-CE2 3.95Å; L656-F660 HydrophobicContact CD1-CZ 4.02Å; L656-F660 HydrophobicContact CD2-CD2 4.45Å; L656-F660 HydrophobicContact CD2-CE2 3.59Å; L656-F660 HydrophobicContact CD2-CZ 4.12Å; L656-F660 HydrophobicContact CG-CD2 3.85Å; L656-F660 HydrophobicContact CG-CE2 3.37Å; L656-F660 HydrophobicContact CG-CZ 3.95Å; L656-F660 WeakPolarHBondContact O-CD2 3.5Å; L656-F660 WeakPolarHBondContact O-CG 3.15Å; L656-F660 PolarHBondContact O-N 3.12Å; S657-F660 PolarHBondContact O-N 2.88Å; F658-F660 VanDerWaalsContact C-N 3.34Å; F658-F660 PolarHBondContact O-N 2.88Å; F660-H663 WeakPolarHBondContact O-CB 3.07Å; F660-H663 PolarHBondContact O-N 2.93Å; F660-E664 PolarHBondContact O-N 3.26Å; F660-M673 HydrophobicContact CE1-CE 3.75Å; F660-M673 HydrophobicContact CZ-CE 4.33Å; F660-I688 HydrophobicContact CE2-CG2 4.49Å; F660-Y691 HydrophobicContact CB-CE1 4.05Å; F660-Y691 HydrophobicContact CD1-CE1 4.05Å; F660-Y691 AromaticContact CD2-CD1 3.91Å; F660-Y691 HydrophobicContact CD2-CD1 3.91Å; F660-Y691 AromaticContact CD2-CE1 3.55Å; F660-Y691 HydrophobicContact CD2-CE1 3.55Å; F660-Y691 HydrophobicContact CE1-CD1 4.5Å; F660-Y691 HydrophobicContact CE1-CE1 4.33Å; F660-Y691 AromaticContact CE2-CD1 3.72Å; F660-Y691 HydrophobicContact CE2-CD1 3.72Å; F660-Y691 AromaticContact CE2-CE1 3.85Å; F660-Y691 HydrophobicContact CE2-CE1 3.85Å; F660-Y691 HydrophobicContact CG-CD1 4.38Å; F660-Y691 AromaticContact CG-CE1 3.67Å; F660-Y691 HydrophobicContact CG-CE1 3.67Å; F660-Y691 HydrophobicContact CZ-CD1 4.08Å; F660-Y691 HydrophobicContact CZ-CE1 4.26Å; F660-V692 HydrophobicContact CE1-CG2 4.31Å; F660-V692 HydrophobicContact CZ-CG2 3.8Å; F660-L695 HydrophobicContact CD1-CD1 3.98Å; F660-L695 HydrophobicContact CE1-CD1 4.08Å
661	A	91.6	Very high	89	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-65	-41.5	174.4	0	0	0	0	0	112	I597 K600 L601 I604 S657 F658 I659 H663 E664 Y665	I597-A661 HydrophobicContact CG2-CB 4.24Å; K600-A661 HydrophobicContact CB-CB 4.2Å; K600-A661 HydrophobicContact CG-CB 4.26Å; L601-A661 HydrophobicContact CB-CB 3.89Å; I604-A661 HydrophobicContact CD1-CB 4.23Å; S657-A661 WeakPolarHBondContact O-CB 3.32Å; S657-A661 PolarHBondContact O-N 3.16Å; F658-A661 WeakPolarHBondContact O-CB 3.21Å; F658-A661 PolarHBondContact O-N 2.81Å; I659-A661 VanDerWaalsContact C-N 3.34Å; I659-A661 PolarHBondContact O-N 3.22Å; A661-H663 VanDerWaalsContact C-N 3.29Å; A661-H663 PolarHBondContact O-N 2.71Å; A661-E664 PolarHBondContact O-N 2.92Å; A661-Y665 PolarHBondContact O-N 3.23Å
662	L	90.6	Very high	89.1	Confident	70 Å²	70	59.6 Å²	59.6	37%	0.366	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-39	172.8	-67.9	172.3	0	0	0	111.5	I597 F658 I659 Y665 R666	I597-L662 HydrophobicContact CD1-CD2 3.77Å; I597-L662 HydrophobicContact CG1-CD2 4.29Å; I597-L662 HydrophobicContact CG2-CD2 4.01Å; F658-L662 HydrophobicContact CD1-CD1 4.17Å; F658-L662 HydrophobicContact CE1-CD1 3.81Å; F658-L662 HydrophobicContact CE1-CG 4.45Å; F658-L662 HydrophobicContact CE2-CD1 4.41Å; F658-L662 HydrophobicContact CE2-CD2 4.22Å; F658-L662 HydrophobicContact CE2-CG 4.17Å; F658-L662 HydrophobicContact CZ-CD1 3.95Å; F658-L662 HydrophobicContact CZ-CD2 4.14Å; F658-L662 HydrophobicContact CZ-CG 4.15Å; F658-L662 WeakPolarHBondContact O-CG 3.35Å; F658-L662 PolarHBondContact O-N 3.44Å; I659-L662 WeakPolarHBondContact O-CB 3.44Å; I659-L662 PolarHBondContact O-N 2.65Å; L662-Y665 PolarHBondContact O-N 2.84Å; L662-R666 PolarHBondContact O-N 3.27Å; L662-R666 VanDerWaalsContact O-N 3.08Å
663	H	85.2	Confident	89	Confident	47 Å²	47	58.4 Å²	58.4	22%	0.218	30%	0.295	C	S	.	.	H	α-helix	trans	-67.3	-34.7	178	-68.8	-42.8	0	0	0	113.6	I659 F660 A661 Y665 R666 P667 Y671	I659-H663 VanDerWaalsContact CG2-CD2 3.49Å; I659-H663 WeakPolarHBondContact CG2-CD2 3.5Å; I659-H663 WeakPolarHBondContact CG2-NE2 3.39Å; I659-H663 PolarHBondContact O-CD2 3.18Å; I659-H663 VanDerWaalsContact O-CG 3.24Å; I659-H663 PolarHBondContact O-N 3.24Å; F660-H663 WeakPolarHBondContact O-CB 3.07Å; F660-H663 PolarHBondContact O-N 2.93Å; A661-H663 VanDerWaalsContact C-N 3.29Å; A661-H663 PolarHBondContact O-N 2.71Å; H663-Y665 VanDerWaalsContact C-N 3.34Å; H663-R666 CarbonylContact O-C 3.48Å; H663-P667 WeakPolarHBondContact O-CA 2.92Å; H663-Y671 HydrophobicContact CB-CE1 4.49Å; H663-Y671 AromaticContact CE1-CD1 3.78Å; H663-Y671 AromaticContact CE1-CE1 3.29Å; H663-Y671 WeakPolarHBondContact CE1-CE1 3.35Å; H663-Y671 AromaticContact CG-CE1 3.73Å; H663-Y671 AromaticContact CG-CZ 3.97Å; H663-Y671 AromaticContact ND1-CE1 3.24Å; H663-Y671 WeakPolarHBondContact ND1-CE1 3.4Å; H663-Y671 AromaticContact ND1-CZ 3.81Å; H663-Y671 AromaticContact NE2-CD1 3.97Å; H663-Y671 AromaticContact NE2-CE1 3.78Å
664	E	84.7	Confident	89.1	Confident	96 Å²	96	63.4 Å²	63.4	45%	0.449	32%	0.322	S	S	.	.	H	α-helix	trans	-68.9	-37.5	174.8	-161.8	-166.6	-139	0	0	111.4	K600 F660 A661	K600-E664 WeakPolarHBondContact CD-OE2 3.48Å; K600-E664 WeakPolarHBondContact CE-OE1 3.36Å; K600-E664 WeakPolarHBondContact CE-OE2 3.26Å; K600-E664 HydrophobicContact CG-CB 4.16Å; K600-E664 WeakPolarHBondContact CG-OE2 3.44Å; K600-E664 VanDerWaalsContact NZ-CD 3.32Å; K600-E664 IonicContact NZ-OE1 3.19Å; K600-E664 PolarHBondContact NZ-OE1 3.16Å; K600-E664 IonicContact NZ-OE2 3.35Å; K600-E664 PolarHBondContact NZ-OE2 3.48Å; F660-E664 PolarHBondContact O-N 3.26Å; A661-E664 PolarHBondContact O-N 2.92Å
665	Y	87.6	Confident	89	Confident	101 Å²	101	68.9 Å²	68.9	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-43.7	177.4	-176.6	-105.8	0	0	0	112.2	G593 K596 I597 A661 L662 H663	G593-Y665 WeakPolarHBondContact CA-OH 3.31Å; K596-Y665 HydrophobicContact CB-CD2 4.06Å; K596-Y665 HydrophobicContact CB-CE2 4.35Å; K596-Y665 HydrophobicContact CD-CD2 4.2Å; K596-Y665 HydrophobicContact CD-CE2 3.9Å; I597-Y665 HydrophobicContact CD1-CD1 4.11Å; I597-Y665 HydrophobicContact CD1-CG 4.11Å; I597-Y665 HydrophobicContact CG1-CD1 4.43Å; I597-Y665 HydrophobicContact CG1-CD2 4.38Å; I597-Y665 HydrophobicContact CG1-CG 3.93Å; A661-Y665 PolarHBondContact O-N 3.23Å; L662-Y665 PolarHBondContact O-N 2.84Å; H663-Y665 VanDerWaalsContact C-N 3.34Å
666	R	86.5	Confident	88.8	Confident	201 Å²	201	68.6 Å²	68.6	76%	0.758	34%	0.342	S	S	*	.	S	Bend	trans	-135.5	90	176.7	-165.9	-178.3	-174.3	153	2.6	110.9	L662 H663 S668	L662-R666 PolarHBondContact O-N 3.27Å; L662-R666 VanDerWaalsContact O-N 3.08Å; H663-R666 CarbonylContact O-C 3.48Å; R666-S668 PolarHBondContact O-N 2.83Å
667	P	85.5	Confident	88.6	Confident	94 Å²	94	68.4 Å²	68.4	61%	0.61	34%	0.341	S	S	*	.			trans	-69.1	132	-176.2	26.7	-33.7	0	0	0	111.2	H663	H663-P667 WeakPolarHBondContact O-CA 2.92Å
668	S	87	Confident	88.4	Confident	53 Å²	53	71.8 Å²	71.8	37%	0.371	37%	0.369	S	S	.	.			trans	-93.4	148.3	167	-57	0	0	0	0	110.4	R666 F670 Y671 A699	R666-S668 PolarHBondContact O-N 2.83Å; S668-F670 VanDerWaalsContact C-N 3.35Å; S668-F670 PolarHBondContact O-N 2.87Å; S668-Y671 PolarHBondContact N-OH 2.85Å; S668-Y671 VanDerWaalsContact O-CE2 3.25Å; S668-Y671 WeakPolarHBondContact O-CE2 3.46Å; S668-Y671 VanDerWaalsContact O-CZ 3.29Å; S668-Y671 PolarHBondContact O-OH 3.49Å; S668-A699 WeakPolarHBondContact O-CB 3.29Å
669	P	86.2	Confident	88	Confident	97 Å²	97	71.4 Å²	71.4	63%	0.63	38%	0.377	S	S	*	.	S	Bend	trans	-71.2	-27.3	-175.8	25.5	-32.7	0	0	0	113.8	Q700	P669-Q700 PolarHBondContact O-N 2.87Å
670	F	88.4	Confident	87.9	Confident	138 Å²	138	68.5 Å²	68.5	61%	0.605	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	148.4	178.9	70	-90.3	0	0	0	111.3	S668 Q700	S668-F670 VanDerWaalsContact C-N 3.35Å; S668-F670 PolarHBondContact O-N 2.87Å; F670-Q700 CarbonylContact C-O 3.37Å; F670-Q700 WeakPolarHBondContact CA-O 3.42Å; F670-Q700 HydrophobicContact CB-CB 4.47Å
671	Y	87.5	Confident	87.8	Confident	22 Å²	22	72.4 Å²	72.4	9%	0.086	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	135.2	179	-60.9	-71.7	0	0	0	110.7	H663 S668 A699 Q700 F701 V702	H663-Y671 HydrophobicContact CB-CE1 4.49Å; H663-Y671 AromaticContact CE1-CD1 3.78Å; H663-Y671 AromaticContact CE1-CE1 3.29Å; H663-Y671 WeakPolarHBondContact CE1-CE1 3.35Å; H663-Y671 AromaticContact CG-CE1 3.73Å; H663-Y671 AromaticContact CG-CZ 3.97Å; H663-Y671 AromaticContact ND1-CE1 3.24Å; H663-Y671 WeakPolarHBondContact ND1-CE1 3.4Å; H663-Y671 AromaticContact ND1-CZ 3.81Å; H663-Y671 AromaticContact NE2-CD1 3.97Å; H663-Y671 AromaticContact NE2-CE1 3.78Å; S668-Y671 PolarHBondContact N-OH 2.85Å; S668-Y671 VanDerWaalsContact O-CE2 3.25Å; S668-Y671 WeakPolarHBondContact O-CE2 3.46Å; S668-Y671 VanDerWaalsContact O-CZ 3.29Å; S668-Y671 PolarHBondContact O-OH 3.49Å; Y671-A699 HydrophobicContact CD2-CB 3.78Å; Y671-A699 HydrophobicContact CE2-CB 3.37Å; Y671-Q700 PolarHBondContact N-O 2.86Å; Y671-F701 HydrophobicContact CD2-CD1 4.02Å; Y671-F701 HydrophobicContact CD2-CD2 4.33Å; Y671-F701 AromaticContact CD2-CE1 3.53Å; Y671-F701 HydrophobicContact CD2-CE1 3.53Å; Y671-F701 AromaticContact CD2-CE2 3.88Å; Y671-F701 HydrophobicContact CD2-CE2 3.88Å; Y671-F701 HydrophobicContact CD2-CG 4.4Å; Y671-F701 AromaticContact CD2-CZ 3.46Å; Y671-F701 HydrophobicContact CD2-CZ 3.46Å; Y671-F701 VanDerWaalsContact CD2-CZ 3.46Å; Y671-F701 HydrophobicContact CE2-CE1 4.27Å; Y671-F701 HydrophobicContact CE2-CE2 4.3Å; Y671-F701 AromaticContact CE2-CZ 3.83Å; Y671-F701 HydrophobicContact CE2-CZ 3.83Å; Y671-F701 HydrophobicContact CG-CD1 4.23Å; Y671-F701 AromaticContact CG-CE1 3.89Å; Y671-F701 HydrophobicContact CG-CE1 3.89Å; Y671-F701 HydrophobicContact CG-CZ 4.27Å; Y671-V702 PolarHBondContact O-N 3.27Å
672	V	91.7	Very high	87.4	Confident	101 Å²	101	79.5 Å²	79.5	61%	0.612	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.3	122.4	173.4	-174.7	0	0	0	0	108.1	V702	V672-V702 CarbonylContact C-O 3.42Å; V672-V702 WeakPolarHBondContact CA-O 3.41Å; V672-V702 HydrophobicContact CG2-CB 4.37Å
673	M	88.8	Confident	87.2	Confident	16 Å²	16	80.8 Å²	80.8	8%	0.079	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	107.5	-177.4	-68.9	176.8	176.2	0	0	109	F660 I676 F701 V702 V703 V704	F660-M673 HydrophobicContact CE1-CE 3.75Å; F660-M673 HydrophobicContact CZ-CE 4.33Å; M673-I676 HydrophobicContact CB-CD1 4.11Å; M673-I676 HydrophobicContact CB-CG1 4.32Å; M673-I676 HydrophobicContact CB-CG2 3.86Å; M673-I676 HydrophobicContact CG-CD1 4.41Å; M673-I676 HydrophobicContact CG-CG2 4.38Å; M673-I676 HydrophobicContact SD-CD1 3.81Å; M673-F701 HydrophobicContact CE-CD1 4.16Å; M673-F701 HydrophobicContact CE-CE1 3.88Å; M673-F701 HydrophobicContact SD-CD1 4.27Å; M673-F701 HydrophobicContact SD-CE1 4.5Å; M673-V702 PolarHBondContact N-O 2.83Å; M673-V703 HydrophobicContact CB-CG1 4.47Å; M673-V703 HydrophobicContact CB-CG2 4.36Å; M673-V703 WeakPolarHBondContact O-CA 3.31Å; M673-V704 PolarHBondContact O-N 3.39Å
674	D	91.7	Very high	87.3	Confident	110 Å²	110	80.2 Å²	80.2	59%	0.588	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	119	-178.6	-165.3	17	0	0	0	110.5	I676 V704	D674-I676 VanDerWaalsContact C-N 3.26Å; D674-I676 PolarHBondContact O-N 3.37Å; D674-I676 VanDerWaalsContact O-N 3.14Å; D674-V704 WeakPolarHBondContact OD1-CB 3.48Å; D674-V704 WeakPolarHBondContact OD1-CG1 3.48Å
675	E	89.1	Confident	87.4	Confident	115 Å²	115	75.6 Å²	75.6	54%	0.537	40%	0.395	S	S	.	.	S	Bend	trans	51.7	35.1	175.3	-62.1	-171.1	161.7	0	0	115.3	D677 A678 V704	E675-D677 PolarHBondContact O-N 3.33Å; E675-D677 VanDerWaalsContact O-N 3.12Å; E675-A678 PolarHBondContact O-N 2.96Å; E675-V704 PolarHBondContact N-O 3.17Å
676	I	87.2	Confident	87.5	Confident	38 Å²	38	73.5 Å²	73.5	20%	0.195	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.5	-179	60.7	162	0	0	0	113.9	T652 L656 M673 D674 F710	T652-I676 WeakPolarHBondContact CG2-O 3.49Å; L656-I676 HydrophobicContact CD1-CD1 4.19Å; L656-I676 HydrophobicContact CD2-CD1 4.41Å; M673-I676 HydrophobicContact CB-CD1 4.11Å; M673-I676 HydrophobicContact CB-CG1 4.32Å; M673-I676 HydrophobicContact CB-CG2 3.86Å; M673-I676 HydrophobicContact CG-CD1 4.41Å; M673-I676 HydrophobicContact CG-CG2 4.38Å; M673-I676 HydrophobicContact SD-CD1 3.81Å; D674-I676 VanDerWaalsContact C-N 3.26Å; D674-I676 PolarHBondContact O-N 3.37Å; D674-I676 VanDerWaalsContact O-N 3.14Å; I676-F710 HydrophobicContact CD1-CZ 4.18Å
677	D	86.3	Confident	87.5	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.027	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-1.1	-173.6	59.7	-16	0	0	0	114	E675 A679 L680 V685 S705 R707 F710	E675-D677 PolarHBondContact O-N 3.33Å; E675-D677 VanDerWaalsContact O-N 3.12Å; D677-A679 PolarHBondContact O-N 3.21Å; D677-A679 VanDerWaalsContact O-N 3.13Å; D677-L680 PolarHBondContact O-N 2.96Å; D677-L680 VanDerWaalsContact O-N 3.08Å; D677-V685 HydrophobicContact CB-CG2 3.94Å; D677-S705 WeakPolarHBondContact OD2-CB 3.41Å; D677-S705 PolarHBondContact OD2-OG 3.48Å; D677-R707 HydrophobicContact CB-CG 4.28Å; D677-R707 VanDerWaalsContact OD2-CB 3.29Å; D677-R707 WeakPolarHBondContact OD2-CB 3.21Å; D677-R707 WeakPolarHBondContact OD2-CG 3.36Å; D677-F710 HydrophobicContact CB-CD2 4.3Å; D677-F710 HydrophobicContact CB-CE2 3.87Å
678	A	86.2	Confident	87.8	Confident	71 Å²	71	60.4 Å²	60.4	59%	0.587	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-35	-175.5	0	0	0	0	0	113.6	E675	E675-A678 PolarHBondContact O-N 2.96Å
679	A	86.7	Confident	87.8	Confident	50 Å²	50	58 Å²	58	41%	0.413	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	1.8	-177.3	0	0	0	0	0	114.4	G649 D677	G649-A679 VanDerWaalsContact CA-O 3.32Å; G649-A679 WeakPolarHBondContact CA-O 3.2Å; D677-A679 PolarHBondContact O-N 3.21Å; D677-A679 VanDerWaalsContact O-N 3.13Å
680	L	87.5	Confident	87.9	Confident	10 Å²	10	55.5 Å²	55.5	5%	0.052	30%	0.298	C	S	.	.			trans	-102.6	150.6	-172.6	-59.3	180	0	0	0	111.6	T652 L653 D677 N684 V685 I688	T652-L680 HydrophobicContact CG2-CD1 4.26Å; T652-L680 HydrophobicContact CG2-CD2 4Å; T652-L680 HydrophobicContact CG2-CG 4.07Å; L653-L680 HydrophobicContact CB-CD2 4.44Å; D677-L680 PolarHBondContact O-N 2.96Å; D677-L680 VanDerWaalsContact O-N 3.08Å; L680-N684 HydrophobicContact CB-CB 4.49Å; L680-V685 HydrophobicContact CB-CG2 3.66Å; L680-I688 HydrophobicContact CD1-CD1 3.24Å
681	D	87.3	Confident	87.9	Confident	84 Å²	84	50 Å²	50	45%	0.449	27%	0.274	S	S	.	.			trans	-82.1	165.2	170.8	61.4	25	0	0	0	111.4	H683 N684 V685	D681-H683 PolarHBondContact O-N 3.49Å; D681-H683 PolarHBondContact OD1-N 3.26Å; D681-N684 VanDerWaalsContact CG-ND2 3.28Å; D681-N684 PolarHBondContact O-N 3.48Å; D681-N684 VanDerWaalsContact OD1-CB 3.27Å; D681-N684 WeakPolarHBondContact OD1-CB 3.38Å; D681-N684 VanDerWaalsContact OD1-CG 3.26Å; D681-N684 PolarHBondContact OD1-N 2.8Å; D681-N684 PolarHBondContact OD1-ND2 3.43Å; D681-N684 PolarHBondContact OD2-ND2 2.93Å; D681-V685 WeakPolarHBondContact O-CB 3.41Å; D681-V685 WeakPolarHBondContact O-CG2 3.4Å; D681-V685 PolarHBondContact O-N 3.26Å
682	F	84.7	Confident	88	Confident	150 Å²	150	49.3 Å²	49.3	66%	0.658	27%	0.272	S	S	*	.	H	α-helix	trans	-56.8	-34.8	-176.7	71.9	-87.5	0	0	0	113	V685 D686	F682-V685 PolarHBondContact O-N 3.29Å; F682-D686 PolarHBondContact O-N 3.3Å
683	H	86	Confident	87.7	Confident	98 Å²	98	47 Å²	47	45%	0.454	26%	0.26	S	S	.	.	H	α-helix	trans	-68.8	-48.1	-178.7	-178.4	61.6	0	0	0	111.8	D681 V685 D686 I687	D681-H683 PolarHBondContact O-N 3.49Å; D681-H683 PolarHBondContact OD1-N 3.26Å; H683-V685 VanDerWaalsContact C-N 3.31Å; H683-V685 PolarHBondContact O-N 2.74Å; H683-D686 PolarHBondContact O-N 3.21Å; H683-I687 WeakPolarHBondContact O-CG1 3.42Å; H683-I687 PolarHBondContact O-N 2.89Å; H683-I687 VanDerWaalsContact O-N 3.12Å
684	N	86.1	Confident	87.6	Confident	34 Å²	34	52.5 Å²	52.5	18%	0.182	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-35.5	176.7	-69.8	-57.5	0	0	0	111.4	L653 L680 D681 I687 I688	L653-N684 HydrophobicContact CD1-CB 4.27Å; L653-N684 WeakPolarHBondContact CD1-OD1 3.16Å; L680-N684 HydrophobicContact CB-CB 4.49Å; D681-N684 VanDerWaalsContact CG-ND2 3.28Å; D681-N684 PolarHBondContact O-N 3.48Å; D681-N684 VanDerWaalsContact OD1-CB 3.27Å; D681-N684 WeakPolarHBondContact OD1-CB 3.38Å; D681-N684 VanDerWaalsContact OD1-CG 3.26Å; D681-N684 PolarHBondContact OD1-N 2.8Å; D681-N684 PolarHBondContact OD1-ND2 3.43Å; D681-N684 PolarHBondContact OD2-ND2 2.93Å; N684-I687 PolarHBondContact O-N 3.39Å; N684-I688 WeakPolarHBondContact O-CB 3.47Å; N684-I688 WeakPolarHBondContact O-CD1 3.4Å; N684-I688 VanDerWaalsContact O-CG1 3.24Å; N684-I688 WeakPolarHBondContact O-CG1 3.42Å; N684-I688 PolarHBondContact O-N 3.24Å
685	V	88.5	Confident	87.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.4	-45.7	174.7	172.3	0	0	0	0	111.2	D677 L680 D681 F682 H683 I688 G689 R707 E709 F710	D677-V685 HydrophobicContact CB-CG2 3.94Å; L680-V685 HydrophobicContact CB-CG2 3.66Å; D681-V685 WeakPolarHBondContact O-CB 3.41Å; D681-V685 WeakPolarHBondContact O-CG2 3.4Å; D681-V685 PolarHBondContact O-N 3.26Å; F682-V685 PolarHBondContact O-N 3.29Å; H683-V685 VanDerWaalsContact C-N 3.31Å; H683-V685 PolarHBondContact O-N 2.74Å; V685-I688 PolarHBondContact O-N 3.5Å; V685-G689 PolarHBondContact O-N 2.88Å; V685-R707 HydrophobicContact CG1-CB 4.08Å; V685-R707 HydrophobicContact CG1-CG 4.38Å; V685-E709 HydrophobicContact CG1-CB 3.89Å; V685-F710 HydrophobicContact CG1-CD2 3.5Å; V685-F710 HydrophobicContact CG1-CE2 3.67Å
686	D	88.9	Confident	87.1	Confident	57 Å²	57	47.1 Å²	47.1	31%	0.305	26%	0.263	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176.8	-176.4	56.9	0	0	0	111.7	F682 H683 I688 G689 S690 K713	F682-D686 PolarHBondContact O-N 3.3Å; H683-D686 PolarHBondContact O-N 3.21Å; D686-I688 PolarHBondContact O-N 2.85Å; D686-G689 PolarHBondContact O-N 3.47Å; D686-S690 WeakPolarHBondContact O-CB 3.26Å; D686-S690 PolarHBondContact O-N 3.05Å; D686-S690 PolarHBondContact O-OG 3.48Å; D686-K713 WeakPolarHBondContact OD1-CE 3.49Å; D686-K713 IonicContact OD1-NZ 2.79Å; D686-K713 PolarHBondContact OD1-NZ 2.86Å
687	I	87.3	Confident	86.9	Confident	18 Å²	18	50.1 Å²	50.1	9%	0.092	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-46.5	176	-66	166.6	0	0	0	110.9	L608 M610 H683 N684 S690 Y691	L608-I687 HydrophobicContact CD2-CG2 3.88Å; M610-I687 HydrophobicContact CE-CD1 3.92Å; M610-I687 HydrophobicContact CE-CG1 4.06Å; M610-I687 HydrophobicContact CE-CG2 4.46Å; M610-I687 HydrophobicContact CG-CD1 4.1Å; H683-I687 WeakPolarHBondContact O-CG1 3.42Å; H683-I687 PolarHBondContact O-N 2.89Å; H683-I687 VanDerWaalsContact O-N 3.12Å; N684-I687 PolarHBondContact O-N 3.39Å; I687-S690 PolarHBondContact O-N 3.25Å; I687-Y691 WeakPolarHBondContact O-CB 3.37Å; I687-Y691 PolarHBondContact O-N 2.84Å
688	I	89.8	Confident	86.7	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-67.6	-41.9	179.1	-67.1	160.2	0	0	0	110.6	L608 L656 F660 L680 N684 V685 D686 S690 Y691 V692 F710	L608-I688 HydrophobicContact CD1-CG1 4.38Å; L608-I688 HydrophobicContact CD2-CG1 3.93Å; L656-I688 HydrophobicContact CD2-CB 4.47Å; L656-I688 HydrophobicContact CD2-CD1 3.63Å; L656-I688 HydrophobicContact CD2-CG1 3.95Å; L656-I688 HydrophobicContact CD2-CG2 3.64Å; F660-I688 HydrophobicContact CE2-CG2 4.49Å; L680-I688 HydrophobicContact CD1-CD1 3.24Å; N684-I688 WeakPolarHBondContact O-CB 3.47Å; N684-I688 WeakPolarHBondContact O-CD1 3.4Å; N684-I688 VanDerWaalsContact O-CG1 3.24Å; N684-I688 WeakPolarHBondContact O-CG1 3.42Å; N684-I688 PolarHBondContact O-N 3.24Å; V685-I688 PolarHBondContact O-N 3.5Å; D686-I688 PolarHBondContact O-N 2.85Å; I688-S690 VanDerWaalsContact C-N 3.33Å; I688-S690 PolarHBondContact O-N 3.44Å; I688-Y691 PolarHBondContact O-N 2.79Å; I688-Y691 VanDerWaalsContact O-N 3.13Å; I688-V692 HydrophobicContact CG2-CG2 4.15Å; I688-V692 WeakPolarHBondContact O-CB 3.44Å; I688-V692 WeakPolarHBondContact O-CG2 3.45Å; I688-V692 PolarHBondContact O-N 3.38Å; I688-F710 HydrophobicContact CB-CZ 4.32Å; I688-F710 HydrophobicContact CG2-CE1 4.4Å; I688-F710 HydrophobicContact CG2-CZ 3.72Å
689	G	88.5	Confident	86.6	Confident	2 Å²	2	55 Å²	55	2%	0.021	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-45.4	176.3	0	0	0	0	0	111.7	V685 D686 V692 S693	V685-G689 PolarHBondContact O-N 2.88Å; D686-G689 PolarHBondContact O-N 3.47Å; G689-V692 PolarHBondContact O-N 3.27Å; G689-S693 WeakPolarHBondContact O-CB 3.44Å; G689-S693 PolarHBondContact O-N 3.13Å
690	S	87.6	Confident	86.8	Confident	45 Å²	45	59.6 Å²	59.6	32%	0.315	31%	0.31	S	S	.	.	H	α-helix	trans	-63.2	-39.7	172.6	-79.5	0	0	0	0	112.8	D686 I687 I688 S693 Q694	D686-S690 WeakPolarHBondContact O-CB 3.26Å; D686-S690 PolarHBondContact O-N 3.05Å; D686-S690 PolarHBondContact O-OG 3.48Å; I687-S690 PolarHBondContact O-N 3.25Å; I688-S690 VanDerWaalsContact C-N 3.33Å; I688-S690 PolarHBondContact O-N 3.44Å; S690-S693 PolarHBondContact O-N 2.92Å; S690-Q694 WeakPolarHBondContact O-CG 3.44Å; S690-Q694 PolarHBondContact O-N 2.87Å
691	Y	88.7	Confident	86.9	Confident	23 Å²	23	60.9 Å²	60.9	9%	0.09	32%	0.316	C	S	.	.	H	α-helix	trans	-66	-46.8	176.9	-177.5	-109.5	0	0	0	112.2	I604 L607 L608 F660 I687 I688 S693 Q694 L695	I604-Y691 WeakPolarHBondContact CD1-OH 3.44Å; I604-Y691 HydrophobicContact CG2-CE1 4.38Å; L607-Y691 HydrophobicContact CD2-CD2 3.62Å; L607-Y691 HydrophobicContact CD2-CE2 3.81Å; L608-Y691 HydrophobicContact CD2-CD1 4.38Å; L608-Y691 HydrophobicContact CD2-CG 4.25Å; F660-Y691 HydrophobicContact CB-CE1 4.05Å; F660-Y691 HydrophobicContact CD1-CE1 4.05Å; F660-Y691 AromaticContact CD2-CD1 3.91Å; F660-Y691 HydrophobicContact CD2-CD1 3.91Å; F660-Y691 AromaticContact CD2-CE1 3.55Å; F660-Y691 HydrophobicContact CD2-CE1 3.55Å; F660-Y691 HydrophobicContact CE1-CD1 4.5Å; F660-Y691 HydrophobicContact CE1-CE1 4.33Å; F660-Y691 AromaticContact CE2-CD1 3.72Å; F660-Y691 HydrophobicContact CE2-CD1 3.72Å; F660-Y691 AromaticContact CE2-CE1 3.85Å; F660-Y691 HydrophobicContact CE2-CE1 3.85Å; F660-Y691 HydrophobicContact CG-CD1 4.38Å; F660-Y691 AromaticContact CG-CE1 3.67Å; F660-Y691 HydrophobicContact CG-CE1 3.67Å; F660-Y691 HydrophobicContact CZ-CD1 4.08Å; F660-Y691 HydrophobicContact CZ-CE1 4.26Å; I687-Y691 WeakPolarHBondContact O-CB 3.37Å; I687-Y691 PolarHBondContact O-N 2.84Å; I688-Y691 PolarHBondContact O-N 2.79Å; I688-Y691 VanDerWaalsContact O-N 3.13Å; Y691-S693 VanDerWaalsContact C-N 3.3Å; Y691-S693 PolarHBondContact O-N 3.49Å; Y691-Q694 WeakPolarHBondContact O-CB 3.32Å; Y691-Q694 PolarHBondContact O-N 3.32Å; Y691-L695 HydrophobicContact CD1-CD1 4.05Å; Y691-L695 HydrophobicContact CE1-CD1 3.5Å; Y691-L695 HydrophobicContact CE1-CG 4.2Å; Y691-L695 PolarHBondContact O-N 2.92Å
692	V	89	Confident	87.1	Confident	8 Å²	8	60.7 Å²	60.7	5%	0.048	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-43.6	174.7	171.8	0	0	0	0	110.1	F660 I688 G689 Q694 L695 T696 F701 V703 F710	F660-V692 HydrophobicContact CE1-CG2 4.31Å; F660-V692 HydrophobicContact CZ-CG2 3.8Å; I688-V692 HydrophobicContact CG2-CG2 4.15Å; I688-V692 WeakPolarHBondContact O-CB 3.44Å; I688-V692 WeakPolarHBondContact O-CG2 3.45Å; I688-V692 PolarHBondContact O-N 3.38Å; G689-V692 PolarHBondContact O-N 3.27Å; V692-Q694 PolarHBondContact O-N 3.45Å; V692-L695 PolarHBondContact O-N 2.89Å; V692-T696 WeakPolarHBondContact O-CG2 3.37Å; V692-T696 PolarHBondContact O-N 3.14Å; V692-T696 VanDerWaalsContact O-N 3.08Å; V692-F701 HydrophobicContact CG1-CB 4.1Å; V692-F701 HydrophobicContact CG1-CD1 3.79Å; V692-F701 HydrophobicContact CG1-CD2 4.38Å; V692-F701 HydrophobicContact CG1-CE1 4.31Å; V692-F701 HydrophobicContact CG1-CG 3.83Å; V692-V703 HydrophobicContact CG1-CG2 4.46Å; V692-F710 HydrophobicContact CG2-CE1 4.49Å
693	S	86.2	Confident	87.3	Confident	53 Å²	53	55.7 Å²	55.7	37%	0.371	30%	0.299	S	S	.	.	H	α-helix	trans	-58.8	-26.9	175.7	-177.7	0	0	0	0	113.6	G689 S690 Y691 T696	G689-S693 WeakPolarHBondContact O-CB 3.44Å; G689-S693 PolarHBondContact O-N 3.13Å; S690-S693 PolarHBondContact O-N 2.92Å; Y691-S693 VanDerWaalsContact C-N 3.3Å; Y691-S693 PolarHBondContact O-N 3.49Å; S693-T696 PolarHBondContact O-OG1 3.46Å
694	Q	85.7	Confident	87.6	Confident	130 Å²	130	54.4 Å²	54.4	61%	0.607	30%	0.298	S	S	*	.	H	α-helix	trans	-78.6	-35.9	173.5	-69.2	173.5	4.4	0	0	111.7	S690 Y691 V692 T696 S697	S690-Q694 WeakPolarHBondContact O-CG 3.44Å; S690-Q694 PolarHBondContact O-N 2.87Å; Y691-Q694 WeakPolarHBondContact O-CB 3.32Å; Y691-Q694 PolarHBondContact O-N 3.32Å; V692-Q694 PolarHBondContact O-N 3.45Å; Q694-T696 VanDerWaalsContact C-N 3.28Å; Q694-T696 PolarHBondContact O-N 3.4Å; Q694-S697 PolarHBondContact O-OG 2.99Å
695	L	86.2	Confident	87.8	Confident	41 Å²	41	53.1 Å²	53.1	22%	0.215	29%	0.291	C	S	.	.	H	α-helix	trans	-71.5	-20.3	178.9	-65.5	-178	0	0	0	113.5	F660 Y691 V692 S697 K698 A699 F701	F660-L695 HydrophobicContact CD1-CD1 3.98Å; F660-L695 HydrophobicContact CE1-CD1 4.08Å; Y691-L695 HydrophobicContact CD1-CD1 4.05Å; Y691-L695 HydrophobicContact CE1-CD1 3.5Å; Y691-L695 HydrophobicContact CE1-CG 4.2Å; Y691-L695 PolarHBondContact O-N 2.92Å; V692-L695 PolarHBondContact O-N 2.89Å; L695-S697 PolarHBondContact O-N 3.36Å; L695-S697 VanDerWaalsContact O-N 3.08Å; L695-K698 PolarHBondContact O-N 2.99Å; L695-A699 PolarHBondContact O-N 3.43Å; L695-F701 HydrophobicContact CB-CE2 3.63Å; L695-F701 HydrophobicContact CB-CZ 3.66Å; L695-F701 HydrophobicContact CD1-CZ 4.09Å
696	T	84.6	Confident	87.7	Confident	71 Å²	71	60 Å²	60	44%	0.436	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-20.9	178	60.5	0	0	0	0	113.7	V692 S693 Q694 K698 A699 F701	V692-T696 WeakPolarHBondContact O-CG2 3.37Å; V692-T696 PolarHBondContact O-N 3.14Å; V692-T696 VanDerWaalsContact O-N 3.08Å; S693-T696 PolarHBondContact O-OG1 3.46Å; Q694-T696 VanDerWaalsContact C-N 3.28Å; Q694-T696 PolarHBondContact O-N 3.4Å; T696-K698 PolarHBondContact O-N 3.46Å; T696-A699 CarbonylContact C-O 3.57Å; T696-A699 VanDerWaalsContact CA-O 3.28Å; T696-A699 WeakPolarHBondContact CA-O 3.33Å; T696-A699 VanDerWaalsContact O-O 3.1Å; T696-F701 HydrophobicContact CG2-CD2 3.97Å
697	S	82.7	Confident	87.7	Confident	102 Å²	102	62.5 Å²	62.5	71%	0.713	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.7	173.3	59.3	0	0	0	0	113.7	Q694 L695	Q694-S697 PolarHBondContact O-OG 2.99Å; L695-S697 PolarHBondContact O-N 3.36Å; L695-S697 VanDerWaalsContact O-N 3.08Å
698	K	82	Confident	87.6	Confident	166 Å²	166	64.8 Å²	64.8	72%	0.722	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	-25.5	-176.6	-64.4	-178.6	-178.5	178	0	113.5	L695 T696	L695-K698 PolarHBondContact O-N 2.99Å; T696-K698 PolarHBondContact O-N 3.46Å
699	A	85.7	Confident	87.4	Confident	12 Å²	12	66.8 Å²	66.8	10%	0.099	36%	0.359	C	S	.	.	S	Bend	trans	-151.4	159.8	-174.1	0	0	0	0	0	112	S668 Y671 L695 T696 F701	S668-A699 WeakPolarHBondContact O-CB 3.29Å; Y671-A699 HydrophobicContact CD2-CB 3.78Å; Y671-A699 HydrophobicContact CE2-CB 3.37Å; L695-A699 PolarHBondContact O-N 3.43Å; T696-A699 CarbonylContact C-O 3.57Å; T696-A699 VanDerWaalsContact CA-O 3.28Å; T696-A699 WeakPolarHBondContact CA-O 3.33Å; T696-A699 VanDerWaalsContact O-O 3.1Å; A699-F701 HydrophobicContact CB-CE2 4.05Å; A699-F701 WeakPolarHBondContact O-CD2 3.38Å
700	Q	89.6	Confident	87.3	Confident	146 Å²	146	67.4 Å²	67.4	68%	0.682	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.2	177.1	-63.8	-177.4	0.4	0	0	110.8	P669 F670 Y671	P669-Q700 PolarHBondContact O-N 2.87Å; F670-Q700 CarbonylContact C-O 3.37Å; F670-Q700 WeakPolarHBondContact CA-O 3.42Å; F670-Q700 HydrophobicContact CB-CB 4.47Å; Y671-Q700 PolarHBondContact N-O 2.86Å
701	F	89.6	Confident	87.3	Confident	38 Å²	38	69.3 Å²	69.3	17%	0.167	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.9	178.7	-72.4	-96.7	0	0	0	110.3	Y671 M673 V692 L695 T696 A699 V703	Y671-F701 HydrophobicContact CD2-CD1 4.02Å; Y671-F701 HydrophobicContact CD2-CD2 4.33Å; Y671-F701 AromaticContact CD2-CE1 3.53Å; Y671-F701 HydrophobicContact CD2-CE1 3.53Å; Y671-F701 AromaticContact CD2-CE2 3.88Å; Y671-F701 HydrophobicContact CD2-CE2 3.88Å; Y671-F701 HydrophobicContact CD2-CG 4.4Å; Y671-F701 AromaticContact CD2-CZ 3.46Å; Y671-F701 HydrophobicContact CD2-CZ 3.46Å; Y671-F701 VanDerWaalsContact CD2-CZ 3.46Å; Y671-F701 HydrophobicContact CE2-CE1 4.27Å; Y671-F701 HydrophobicContact CE2-CE2 4.3Å; Y671-F701 AromaticContact CE2-CZ 3.83Å; Y671-F701 HydrophobicContact CE2-CZ 3.83Å; Y671-F701 HydrophobicContact CG-CD1 4.23Å; Y671-F701 AromaticContact CG-CE1 3.89Å; Y671-F701 HydrophobicContact CG-CE1 3.89Å; Y671-F701 HydrophobicContact CG-CZ 4.27Å; M673-F701 HydrophobicContact CE-CD1 4.16Å; M673-F701 HydrophobicContact CE-CE1 3.88Å; M673-F701 HydrophobicContact SD-CD1 4.27Å; M673-F701 HydrophobicContact SD-CE1 4.5Å; V692-F701 HydrophobicContact CG1-CB 4.1Å; V692-F701 HydrophobicContact CG1-CD1 3.79Å; V692-F701 HydrophobicContact CG1-CD2 4.38Å; V692-F701 HydrophobicContact CG1-CE1 4.31Å; V692-F701 HydrophobicContact CG1-CG 3.83Å; L695-F701 HydrophobicContact CB-CE2 3.63Å; L695-F701 HydrophobicContact CB-CZ 3.66Å; L695-F701 HydrophobicContact CD1-CZ 4.09Å; T696-F701 HydrophobicContact CG2-CD2 3.97Å; A699-F701 HydrophobicContact CB-CE2 4.05Å; A699-F701 WeakPolarHBondContact O-CD2 3.38Å; F701-V703 HydrophobicContact CB-CG2 4.47Å
702	V	91	Very high	87	Confident	79 Å²	79	75 Å²	75	48%	0.479	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	107.4	168.2	-179.6	0	0	0	0	106.8	Y671 V672 M673	Y671-V702 PolarHBondContact O-N 3.27Å; V672-V702 CarbonylContact C-O 3.42Å; V672-V702 WeakPolarHBondContact CA-O 3.41Å; V672-V702 HydrophobicContact CG2-CB 4.37Å; M673-V702 PolarHBondContact N-O 2.83Å
703	V	90.7	Very high	86.8	Confident	45 Å²	45	78.1 Å²	78.1	27%	0.273	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	122.6	-179.7	-175.1	0	0	0	0	108.7	M673 V692 F701 F710	M673-V703 HydrophobicContact CB-CG1 4.47Å; M673-V703 HydrophobicContact CB-CG2 4.36Å; M673-V703 WeakPolarHBondContact O-CA 3.31Å; V692-V703 HydrophobicContact CG1-CG2 4.46Å; F701-V703 HydrophobicContact CB-CG2 4.47Å; V703-F710 HydrophobicContact CG1-CD1 4.09Å; V703-F710 HydrophobicContact CG1-CE1 4.18Å; V703-F710 HydrophobicContact CG1-CG 4.47Å
704	V	92.1	Very high	86.8	Confident	71 Å²	71	77.7 Å²	77.7	43%	0.43	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	113.9	169.1	-175.8	0	0	0	0	106.7	M673 D674 E675	M673-V704 PolarHBondContact O-N 3.39Å; D674-V704 WeakPolarHBondContact OD1-CB 3.48Å; D674-V704 WeakPolarHBondContact OD1-CG1 3.48Å; E675-V704 PolarHBondContact N-O 3.17Å
705	S	89.7	Confident	86.8	Confident	7 Å²	7	74.7 Å²	74.7	5%	0.049	39%	0.391	C	S	.	.			trans	-142.8	158.1	-176	162.3	0	0	0	0	108.5	D677 R707 Y711	D677-S705 WeakPolarHBondContact OD2-CB 3.41Å; D677-S705 PolarHBondContact OD2-OG 3.48Å; S705-R707 PolarHBondContact OG-N 2.88Å; S705-Y711 VanDerWaalsContact O-CE1 3.31Å; S705-Y711 WeakPolarHBondContact O-CE1 3.46Å; S705-Y711 VanDerWaalsContact O-CZ 3.28Å; S705-Y711 PolarHBondContact O-OH 2.87Å
706	L	86.3	Confident	87	Confident	146 Å²	146	77.7 Å²	77.7	76%	0.764	40%	0.403	S	S	*	.	S	Bend	trans	-108.7	5.9	169.8	-64.4	177.7	0	0	0	112.6	Y711	L706-Y711 VanDerWaalsContact CA-OH 3.27Å; L706-Y711 WeakPolarHBondContact CA-OH 3.34Å
707	R	88.3	Confident	87.3	Confident	108 Å²	108	77.1 Å²	77.1	41%	0.408	40%	0.396	S	S	.	.			trans	-97.9	130.1	-176	-63.6	-66.9	-172.2	-152.5	-0.3	110.4	D677 V685 S705 E709 F710	D677-R707 HydrophobicContact CB-CG 4.28Å; D677-R707 VanDerWaalsContact OD2-CB 3.29Å; D677-R707 WeakPolarHBondContact OD2-CB 3.21Å; D677-R707 WeakPolarHBondContact OD2-CG 3.36Å; V685-R707 HydrophobicContact CG1-CB 4.08Å; V685-R707 HydrophobicContact CG1-CG 4.38Å; S705-R707 PolarHBondContact OG-N 2.88Å; R707-E709 VanDerWaalsContact C-N 3.26Å; R707-E709 WeakPolarHBondContact CB-OE2 3.33Å; R707-E709 PolarHBondContact O-N 3.48Å; R707-F710 PolarHBondContact O-N 3.5Å
708	C	86	Confident	87.6	Confident	67 Å²	67	76.9 Å²	76.9	45%	0.453	39%	0.386	S	S	.	.	H	α-helix	trans	-66.6	-29.9	-177.9	51.2	0	0	0	0	112.7	F710 Y711 E712	C708-F710 PolarHBondContact O-N 3.38Å; C708-Y711 HydrophobicContact CB-CD2 4.46Å; C708-Y711 WeakPolarHBondContact O-CB 3.47Å; C708-Y711 PolarHBondContact O-N 2.81Å; C708-E712 WeakPolarHBondContact O-CG 3.26Å; C708-E712 PolarHBondContact O-N 2.96Å
709	E	85.5	Confident	87.9	Confident	42 Å²	42	70.5 Å²	70.5	20%	0.196	37%	0.368	C	S	.	.	H	α-helix	trans	-60.2	-33.6	179.8	-59.3	84.7	171	0	0	112.1	V685 R707 K713	V685-E709 HydrophobicContact CG1-CB 3.89Å; R707-E709 VanDerWaalsContact C-N 3.26Å; R707-E709 WeakPolarHBondContact CB-OE2 3.33Å; R707-E709 PolarHBondContact O-N 3.48Å; E709-K713 WeakPolarHBondContact O-CG 3.35Å
710	F	86.5	Confident	88	Confident	16 Å²	16	74.6 Å²	74.6	7%	0.07	39%	0.391	C	S	.	.	H	α-helix	trans	-71.8	-41.6	172.4	-97.2	-73.2	0	0	0	112.2	I676 D677 V685 I688 V692 V703 R707 C708 E712 K713 S714	I676-F710 HydrophobicContact CD1-CZ 4.18Å; D677-F710 HydrophobicContact CB-CD2 4.3Å; D677-F710 HydrophobicContact CB-CE2 3.87Å; V685-F710 HydrophobicContact CG1-CD2 3.5Å; V685-F710 HydrophobicContact CG1-CE2 3.67Å; I688-F710 HydrophobicContact CB-CZ 4.32Å; I688-F710 HydrophobicContact CG2-CE1 4.4Å; I688-F710 HydrophobicContact CG2-CZ 3.72Å; V692-F710 HydrophobicContact CG2-CE1 4.49Å; V703-F710 HydrophobicContact CG1-CD1 4.09Å; V703-F710 HydrophobicContact CG1-CE1 4.18Å; V703-F710 HydrophobicContact CG1-CG 4.47Å; R707-F710 PolarHBondContact O-N 3.5Å; C708-F710 PolarHBondContact O-N 3.38Å; F710-E712 VanDerWaalsContact C-N 3.31Å; F710-E712 PolarHBondContact O-N 3.42Å; F710-K713 PolarHBondContact O-N 3.39Å; F710-S714 PolarHBondContact O-N 2.97Å
711	Y	86.5	Confident	87.9	Confident	84 Å²	84	72.8 Å²	72.8	33%	0.329	38%	0.379	S	S	.	.	H	α-helix	trans	-63.4	-39.6	-179	-52.8	-27.1	0	0	0	111.7	S705 L706 C708 K713 S714 L717	S705-Y711 VanDerWaalsContact O-CE1 3.31Å; S705-Y711 WeakPolarHBondContact O-CE1 3.46Å; S705-Y711 VanDerWaalsContact O-CZ 3.28Å; S705-Y711 PolarHBondContact O-OH 2.87Å; L706-Y711 VanDerWaalsContact CA-OH 3.27Å; L706-Y711 WeakPolarHBondContact CA-OH 3.34Å; C708-Y711 HydrophobicContact CB-CD2 4.46Å; C708-Y711 WeakPolarHBondContact O-CB 3.47Å; C708-Y711 PolarHBondContact O-N 2.81Å; Y711-K713 PolarHBondContact O-N 3.32Å; Y711-S714 PolarHBondContact O-N 3.48Å; Y711-L717 HydrophobicContact CD1-CD1 3.8Å; Y711-L717 HydrophobicContact CE1-CD1 4.36Å; Y711-L717 HydrophobicContact CG-CD1 3.99Å
712	E	83.3	Confident	87.9	Confident	144 Å²	144	74.8 Å²	74.8	67%	0.673	39%	0.388	S	S	*	.	H	α-helix	trans	-62.2	-26	-180	-74.2	-180	-174.9	0	0	113.3	C708 F710	C708-E712 WeakPolarHBondContact O-CG 3.26Å; C708-E712 PolarHBondContact O-N 2.96Å; F710-E712 VanDerWaalsContact C-N 3.31Å; F710-E712 PolarHBondContact O-N 3.42Å
713	K	83.7	Confident	87.8	Confident	73 Å²	73	74 Å²	74	32%	0.317	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-8.6	176.6	-50.5	-57.5	-175	-169.8	0	113.4	D686 E709 F710 Y711	D686-K713 WeakPolarHBondContact OD1-CE 3.49Å; D686-K713 IonicContact OD1-NZ 2.79Å; D686-K713 PolarHBondContact OD1-NZ 2.86Å; E709-K713 WeakPolarHBondContact O-CG 3.35Å; F710-K713 PolarHBondContact O-N 3.39Å; Y711-K713 PolarHBondContact O-N 3.32Å
714	S	86.6	Confident	87.7	Confident	43 Å²	43	82.9 Å²	82.9	30%	0.301	41%	0.412	S	S	.	.			trans	-88.8	132.5	-174.2	-169.5	0	0	0	0	112.2	F710 Y711 F716 V734	F710-S714 PolarHBondContact O-N 2.97Å; Y711-S714 PolarHBondContact O-N 3.48Å; S714-F716 VanDerWaalsContact C-N 3.32Å; S714-F716 PolarHBondContact OG-N 2.83Å; S714-F716 PolarHBondContact OG-O 2.84Å; S714-V734 WeakPolarHBondContact O-CG2 3.23Å
715	P	87.2	Confident	87.3	Confident	67 Å²	67	85.3 Å²	85.3	44%	0.435	42%	0.422	S	S	.	.	S	Bend	trans	-70.2	-29.4	172.4	26.8	-32.5	0	0	0	112.9	V734	P715-V734 PolarHBondContact O-N 3.37Å
716	F	89.8	Confident	86.9	Confident	105 Å²	105	90.2 Å²	90.2	46%	0.461	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.3	179.7	-64.1	-81.7	0	0	0	110	S714 M731 L732 N733	S714-F716 VanDerWaalsContact C-N 3.32Å; S714-F716 PolarHBondContact OG-N 2.83Å; S714-F716 PolarHBondContact OG-O 2.84Å; F716-M731 HydrophobicContact CD1-CG 4.42Å; F716-M731 HydrophobicContact CD1-SD 3.89Å; F716-M731 HydrophobicContact CE1-SD 4.39Å; F716-L732 WeakPolarHBondContact CA-O 3.34Å; F716-N733 HydrophobicContact CD1-CB 4.17Å; F716-N733 HydrophobicContact CE1-CB 4.01Å; F716-N733 WeakPolarHBondContact CE1-ND2 3.33Å
717	L	89.8	Confident	87	Confident	58 Å²	58	87.9 Å²	87.9	30%	0.304	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.3	174	-173.9	67.9	0	0	0	108.8	Y711 L732 V734	Y711-L717 HydrophobicContact CD1-CD1 3.8Å; Y711-L717 HydrophobicContact CE1-CD1 4.36Å; Y711-L717 HydrophobicContact CG-CD1 3.99Å; L717-L732 HydrophobicContact CB-CB 4.41Å; L717-L732 PolarHBondContact N-O 3.26Å; L717-L732 PolarHBondContact O-N 3.34Å; L717-V734 HydrophobicContact CB-CG2 4.46Å
718	I	89.8	Confident	86.9	Confident	97 Å²	97	86.1 Å²	86.1	50%	0.497	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	103.6	175.2	-59.6	176.6	0	0	0	107.4	V720 I729 M731	I718-V720 HydrophobicContact CG2-CG2 4.46Å; I718-I729 HydrophobicContact CG2-CG2 3.4Å; I718-I729 VanDerWaalsContact CG2-CG2 3.4Å; I718-M731 HydrophobicContact CG1-CG 4.27Å
719	G	88.2	Confident	87	Confident	33 Å²	33	88.6 Å²	88.6	34%	0.34	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	117.1	175	0	0	0	0	0	110.4	Q730	G719-Q730 PolarHBondContact N-O 3Å; G719-Q730 PolarHBondContact O-N 3.18Å
720	V	88	Confident	87.1	Confident	97 Å²	97	91.5 Å²	91.5	59%	0.588	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.8	172.3	-174.8	0	0	0	0	108.6	I718 T727 I729	I718-V720 HydrophobicContact CG2-CG2 4.46Å; V720-T727 HydrophobicContact CG1-CG2 3.47Å; V720-T727 VanDerWaalsContact CG1-CG2 3.47Å; V720-I729 HydrophobicContact CG2-CG1 4.38Å
721	Y	86.9	Confident	87.1	Confident	109 Å²	109	96 Å²	96	43%	0.427	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	164.5	179.9	65.9	-74.7	0	0	0	110.4	V723 L728 Q730	Y721-V723 HydrophobicContact CD2-CG2 3.59Å; Y721-V723 HydrophobicContact CE2-CG2 3.47Å; Y721-V723 VanDerWaalsContact CE2-CG2 3.47Å; Y721-L728 HydrophobicContact CD1-CB 4.39Å; Y721-L728 HydrophobicContact CD2-CB 4.46Å; Y721-L728 HydrophobicContact CE1-CB 3.9Å; Y721-L728 HydrophobicContact CE2-CB 4Å; Y721-L728 HydrophobicContact CE2-CD1 3.94Å; Y721-L728 PolarHBondContact N-O 2.92Å; Y721-L728 PolarHBondContact O-N 3.16Å; Y721-Q730 HydrophobicContact CE1-CB 3.77Å
722	K	89.9	Confident	87	Confident	79 Å²	79	95.3 Å²	95.3	34%	0.343	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	117.7	-172.2	-175.8	162.2	169.7	176.1	0	110.7	N725 N726	K722-N725 VanDerWaalsContact CE-CA 3.41Å; K722-N725 VanDerWaalsContact CE-O 3.3Å; K722-N725 WeakPolarHBondContact CE-O 3.28Å; K722-N725 WeakPolarHBondContact CE-OD1 3.46Å; K722-N725 PolarHBondContact NZ-OD1 3.36Å; K722-N726 CarbonylContact C-O 3.42Å; K722-N726 WeakPolarHBondContact CA-O 3.14Å
723	V	88.2	Confident	87.2	Confident	64 Å²	64	91.2 Å²	91.2	39%	0.388	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.1	178.9	-179.8	0	0	0	0	108.9	Y721 N725 N726 L728	Y721-V723 HydrophobicContact CD2-CG2 3.59Å; Y721-V723 HydrophobicContact CE2-CG2 3.47Å; Y721-V723 VanDerWaalsContact CE2-CG2 3.47Å; V723-N725 PolarHBondContact O-N 3.18Å; V723-N726 PolarHBondContact N-O 3.43Å; V723-N726 PolarHBondContact O-N 3.44Å; V723-L728 HydrophobicContact CB-CD1 3.79Å; V723-L728 HydrophobicContact CG2-CD1 3.82Å
724	R	89.6	Confident	87.1	Confident	231 Å²	231	89.6 Å²	89.6	87%	0.872	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	44.7	-179.8	-63.5	179	-178.4	173.2	0.8	113.7	N726	R724-N726 PolarHBondContact O-N 3.02Å; R724-N726 VanDerWaalsContact O-N 3.12Å
725	N	84	Confident	86.7	Confident	122 Å²	122	90.7 Å²	90.7	65%	0.652	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	2.8	-177	-127.3	16.5	0	0	0	116.6	K722 V723	K722-N725 VanDerWaalsContact CE-CA 3.41Å; K722-N725 VanDerWaalsContact CE-O 3.3Å; K722-N725 WeakPolarHBondContact CE-O 3.28Å; K722-N725 WeakPolarHBondContact CE-OD1 3.46Å; K722-N725 PolarHBondContact NZ-OD1 3.36Å; V723-N725 PolarHBondContact O-N 3.18Å
726	N	81.3	Confident	86.2	Confident	110 Å²	110	94.4 Å²	94.4	59%	0.588	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.2	174.7	-63.5	-14.3	0	0	0	110.2	K722 V723 R724	K722-N726 CarbonylContact C-O 3.42Å; K722-N726 WeakPolarHBondContact CA-O 3.14Å; V723-N726 PolarHBondContact N-O 3.43Å; V723-N726 PolarHBondContact O-N 3.44Å; R724-N726 PolarHBondContact O-N 3.02Å; R724-N726 VanDerWaalsContact O-N 3.12Å
727	T	87.2	Confident	85.5	Confident	96 Å²	96	93.4 Å²	93.4	59%	0.589	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.3	172.4	-57.9	0	0	0	0	108.5	V720	V720-T727 HydrophobicContact CG1-CG2 3.47Å; V720-T727 VanDerWaalsContact CG1-CG2 3.47Å
728	L	87	Confident	84.8	Confident	71 Å²	71	95.1 Å²	95.1	37%	0.372	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	142	172.1	-63.7	180	0	0	0	108.8	Y721 V723	Y721-L728 HydrophobicContact CD1-CB 4.39Å; Y721-L728 HydrophobicContact CD2-CB 4.46Å; Y721-L728 HydrophobicContact CE1-CB 3.9Å; Y721-L728 HydrophobicContact CE2-CB 4Å; Y721-L728 HydrophobicContact CE2-CD1 3.94Å; Y721-L728 PolarHBondContact N-O 2.92Å; Y721-L728 PolarHBondContact O-N 3.16Å; V723-L728 HydrophobicContact CB-CD1 3.79Å; V723-L728 HydrophobicContact CG2-CD1 3.82Å
729	I	88.3	Confident	84	Confident	119 Å²	119	97.1 Å²	97.1	61%	0.61	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.8	180	-56.9	176.6	0	0	0	106.2	I718 V720	I718-I729 HydrophobicContact CG2-CG2 3.4Å; I718-I729 VanDerWaalsContact CG2-CG2 3.4Å; V720-I729 HydrophobicContact CG2-CG1 4.38Å
730	Q	87.3	Confident	83.1	Confident	103 Å²	103	98.4 Å²	98.4	48%	0.481	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.7	172.5	-177	65.7	57.2	0	0	108.8	G719 Y721	G719-Q730 PolarHBondContact N-O 3Å; G719-Q730 PolarHBondContact O-N 3.18Å; Y721-Q730 HydrophobicContact CE1-CB 3.77Å
731	M	86.1	Confident	82	Confident	112 Å²	112	96.9 Å²	96.9	55%	0.552	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	133.4	168.9	-167.7	-165.4	-61.2	0	0	109.2	F716 I718	F716-M731 HydrophobicContact CD1-CG 4.42Å; F716-M731 HydrophobicContact CD1-SD 3.89Å; F716-M731 HydrophobicContact CE1-SD 4.39Å; I718-M731 HydrophobicContact CG1-CG 4.27Å
732	L	85.5	Confident	80.8	Confident	69 Å²	69	99.5 Å²	99.5	36%	0.361	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.5	171.4	-179.9	67.8	0	0	0	108.8	F716 L717 F737	F716-L732 WeakPolarHBondContact CA-O 3.34Å; L717-L732 HydrophobicContact CB-CB 4.41Å; L717-L732 PolarHBondContact N-O 3.26Å; L717-L732 PolarHBondContact O-N 3.34Å; L732-F737 HydrophobicContact CD1-CB 4.04Å; L732-F737 HydrophobicContact CD1-CD2 4.03Å; L732-F737 HydrophobicContact CD1-CG 4.18Å
733	N	86.4	Confident	78.9	Confident	57 Å²	57	98.6 Å²	98.6	31%	0.305	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	109.8	167.7	-178.6	-37.1	0	0	0	108.4	F716 S735 R736 F737	F716-N733 HydrophobicContact CD1-CB 4.17Å; F716-N733 HydrophobicContact CE1-CB 4.01Å; F716-N733 WeakPolarHBondContact CE1-ND2 3.33Å; N733-S735 PolarHBondContact O-N 3.39Å; N733-S735 PolarHBondContact OD1-N 3.24Å; N733-R736 HydrophobicContact CB-CB 4.07Å; N733-R736 PolarHBondContact O-N 3.38Å; N733-R736 PolarHBondContact OD1-N 3.2Å; N733-R736 VanDerWaalsContact OD1-N 3.08Å; N733-F737 WeakPolarHBondContact O-CB 3.34Å; N733-F737 PolarHBondContact O-N 2.85Å
734	V	81.6	Confident	76.9	Confident	40 Å²	40	99.5 Å²	99.5	24%	0.242	50%	0.495	C	S	.	.	H	α-helix	trans	-65.5	-40.3	-172.3	-179.6	0	0	0	0	111.1	S714 P715 L717 F737 L738	S714-V734 WeakPolarHBondContact O-CG2 3.23Å; P715-V734 PolarHBondContact O-N 3.37Å; L717-V734 HydrophobicContact CB-CG2 4.46Å; V734-F737 PolarHBondContact O-N 2.82Å; V734-L738 HydrophobicContact CG1-CD1 4.04Å; V734-L738 HydrophobicContact CG1-CG 4.46Å; V734-L738 WeakPolarHBondContact O-CG 3.46Å; V734-L738 PolarHBondContact O-N 2.98Å
735	S	78	Confident	75	Confident	65 Å²	65	100.5 Å²	100.5	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-47.5	178.4	-55.2	0	0	0	0	111.8	N733 F737 L738 E739	N733-S735 PolarHBondContact O-N 3.39Å; N733-S735 PolarHBondContact OD1-N 3.24Å; S735-F737 VanDerWaalsContact C-N 3.31Å; S735-F737 PolarHBondContact O-N 2.82Å; S735-L738 PolarHBondContact O-N 3.09Å; S735-E739 PolarHBondContact O-N 2.88Å
736	R	78.3	Confident	73.1	Confident	146 Å²	146	102.3 Å²	102.3	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-63.5	-38.5	177.9	-169.7	175.2	-178.8	170.7	-0.5	111.6	N733 E739 M740	N733-R736 HydrophobicContact CB-CB 4.07Å; N733-R736 PolarHBondContact O-N 3.38Å; N733-R736 PolarHBondContact OD1-N 3.2Å; N733-R736 VanDerWaalsContact OD1-N 3.08Å; R736-E739 PolarHBondContact O-N 3.35Å; R736-M740 VanDerWaalsContact O-CG 3.32Å; R736-M740 WeakPolarHBondContact O-CG 3.49Å; R736-M740 PolarHBondContact O-N 3.42Å
737	F	74.9	Confident	71.2	Confident	83 Å²	83	101.3 Å²	101.3	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-66.9	-39.4	176.5	-175.6	-97.9	0	0	0	112.7	L732 N733 V734 S735 M740 T741	L732-F737 HydrophobicContact CD1-CB 4.04Å; L732-F737 HydrophobicContact CD1-CD2 4.03Å; L732-F737 HydrophobicContact CD1-CG 4.18Å; N733-F737 WeakPolarHBondContact O-CB 3.34Å; N733-F737 PolarHBondContact O-N 2.85Å; V734-F737 PolarHBondContact O-N 2.82Å; S735-F737 VanDerWaalsContact C-N 3.31Å; S735-F737 PolarHBondContact O-N 2.82Å; F737-M740 PolarHBondContact O-N 3.42Å; F737-T741 HydrophobicContact CD1-CG2 4.34Å; F737-T741 HydrophobicContact CE1-CG2 3.9Å; F737-T741 HydrophobicContact CZ-CG2 4Å; F737-T741 WeakPolarHBondContact O-CG2 3.33Å; F737-T741 PolarHBondContact O-N 3.49Å; F737-T741 PolarHBondContact O-OG1 3.46Å
738	L	73.9	Confident	69.1	Low	95 Å²	95	99.4 Å²	99.4	50%	0.497	50%	0.501	S	S	.	.	H	α-helix	trans	-66	-36.4	175.1	-75.4	169.7	0	0	0	112.3	V734 S735 T741 K742	V734-L738 HydrophobicContact CG1-CD1 4.04Å; V734-L738 HydrophobicContact CG1-CG 4.46Å; V734-L738 WeakPolarHBondContact O-CG 3.46Å; V734-L738 PolarHBondContact O-N 2.98Å; S735-L738 PolarHBondContact O-N 3.09Å; L738-T741 WeakPolarHBondContact CA-OG1 3.43Å; L738-T741 PolarHBondContact O-N 3.35Å; L738-T741 PolarHBondContact O-OG1 3.15Å; L738-T741 VanDerWaalsContact O-OG1 3.07Å; L738-K742 WeakPolarHBondContact O-CG 3.49Å; L738-K742 PolarHBondContact O-N 3.46Å
739	E	74.5	Confident	66.9	Low	138 Å²	138	104.6 Å²	104.6	65%	0.645	53%	0.526	S	S	*	.	H	α-helix	trans	-65.3	-41.8	173.1	-73.3	174.4	178.9	0	0	112	S735 R736 T741 K742	S735-E739 PolarHBondContact O-N 2.88Å; R736-E739 PolarHBondContact O-N 3.35Å; E739-T741 VanDerWaalsContact C-N 3.29Å; E739-T741 PolarHBondContact O-N 3.47Å; E739-K742 PolarHBondContact O-N 3.22Å
740	M	67.5	Low	64.8	Low	60 Å²	60	107.2 Å²	107.2	30%	0.296	54%	0.535	S	S	.	.	H	α-helix	trans	-66.3	-29.4	176.7	-72.5	176	52.6	0	0	113.5	R736 F737 I743 M759	R736-M740 VanDerWaalsContact O-CG 3.32Å; R736-M740 WeakPolarHBondContact O-CG 3.49Å; R736-M740 PolarHBondContact O-N 3.42Å; F737-M740 PolarHBondContact O-N 3.42Å; M740-I743 WeakPolarHBondContact O-CG1 3.42Å; M740-M759 HydrophobicContact CE-CE 4.31Å; M740-M759 HydrophobicContact CE-SD 3.1Å; M740-M759 WeakPolarHBondContact CE-SD 3.39Å; M740-M759 HydrophobicContact CG-CE 4.47Å; M740-M759 HydrophobicContact CG-SD 4.36Å; M740-M759 HydrophobicContact SD-CE 4.3Å; M740-M759 HydrophobicContact SD-SD 3.7Å; M740-M759 VanDerWaalsContact SD-SD 3.7Å
741	T	66.4	Low	62.7	Low	65 Å²	65	107.2 Å²	107.2	40%	0.399	54%	0.538	S	S	.	.	H	α-helix	trans	-87.3	-14.9	177.6	50.2	0	0	0	0	113.4	F737 L738 E739 I743	F737-T741 HydrophobicContact CD1-CG2 4.34Å; F737-T741 HydrophobicContact CE1-CG2 3.9Å; F737-T741 HydrophobicContact CZ-CG2 4Å; F737-T741 WeakPolarHBondContact O-CG2 3.33Å; F737-T741 PolarHBondContact O-N 3.49Å; F737-T741 PolarHBondContact O-OG1 3.46Å; L738-T741 WeakPolarHBondContact CA-OG1 3.43Å; L738-T741 PolarHBondContact O-N 3.35Å; L738-T741 PolarHBondContact O-OG1 3.15Å; L738-T741 VanDerWaalsContact O-OG1 3.07Å; E739-T741 VanDerWaalsContact C-N 3.29Å; E739-T741 PolarHBondContact O-N 3.47Å; T741-I743 PolarHBondContact O-N 3.15Å
742	K	61.5	Low	60.6	Low	165 Å²	165	104.4 Å²	104.4	72%	0.717	53%	0.526	S	S	*	.			trans	-71.5	55.7	162.2	-73.6	177.9	-177	177.1	0	110.2	L738 E739	L738-K742 WeakPolarHBondContact O-CG 3.49Å; L738-K742 PolarHBondContact O-N 3.46Å; E739-K742 PolarHBondContact O-N 3.22Å
743	I	50.5	Low	58.5	Low	60 Å²	60	104.5 Å²	104.5	31%	0.308	54%	0.537	S	S	.	.			trans	-65.7	125.5	166.6	-55.3	176.4	0	0	0	105.7	M740 T741 R745 N752	M740-I743 WeakPolarHBondContact O-CG1 3.42Å; T741-I743 PolarHBondContact O-N 3.15Å; I743-R745 PolarHBondContact O-N 3.15Å; I743-N752 WeakPolarHBondContact CD1-OD1 3.31Å
744	P	45.6	Very low	56.5	Low	82 Å²	82	105.8 Å²	105.8	53%	0.532	55%	0.546	S	S	.	.			trans	-55.3	130.1	176.3	20.9	-29.3	0	0	0	108.1	D746 I747	P744-D746 PolarHBondContact O-N 2.82Å; P744-I747 HydrophobicContact CG-CD1 4.09Å; P744-I747 HydrophobicContact CG-CG1 4.42Å; P744-I747 PolarHBondContact O-N 3.37Å
745	R	48.4	Very low	54.6	Low	253 Å²	253	106.7 Å²	106.7	96%	0.955	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-3	-174.8	-78.4	-175.3	175.5	177.4	-1.1	114.9	I743	I743-R745 PolarHBondContact O-N 3.15Å
746	D	44.6	Very low	52.8	Low	159 Å²	159	108.7 Å²	108.7	85%	0.85	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	6.5	-173.1	-75.5	-20.9	0	0	0	115.8	P744	P744-D746 PolarHBondContact O-N 2.82Å
747	I	42.6	Very low	51	Low	90 Å²	90	109.7 Å²	109.7	46%	0.462	57%	0.567	S	S	.	*	S	Bend	trans	-104.4	112.5	172.7	-52.8	177.1	0	0	0	109.3	P744 D751	P744-I747 HydrophobicContact CG-CD1 4.09Å; P744-I747 HydrophobicContact CG-CG1 4.42Å; P744-I747 PolarHBondContact O-N 3.37Å; I747-D751 HydrophobicContact CG2-CB 4.32Å
748	G	41.7	Very low	49.4	Very low	56 Å²	56	111.1 Å²	111.1	58%	0.577	58%	0.578	S	S	*	*			trans	-52.7	148.3	-178.5	0	0	0	0	0	112.9	H750	G748-H750 PolarHBondContact O-N 3.25Å
749	M	41.3	Very low	48	Very low	179 Å²	179	110.9 Å²	110.9	88%	0.882	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	1.2	-166	-66.4	-154.9	131.7	0	0	117.8
750	H	44.5	Very low	46.4	Very low	175 Å²	175	110.5 Å²	110.5	81%	0.81	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-26.1	-177.7	-125.8	38.5	0	0	0	114.5	G748	G748-H750 PolarHBondContact O-N 3.25Å
751	D	43.5	Very low	45.1	Very low	102 Å²	102	114.5 Å²	114.5	55%	0.545	60%	0.6	S	S	.	*	S	Bend	trans	-93.8	-9.3	-174.1	-72.5	-22.3	0	0	0	114.9	I747 A753 V754 A755	I747-D751 HydrophobicContact CG2-CB 4.32Å; D751-A753 VanDerWaalsContact C-N 3.25Å; D751-A753 PolarHBondContact O-N 2.86Å; D751-V754 PolarHBondContact O-N 3.38Å; D751-A755 PolarHBondContact O-N 2.87Å
752	N	41.2	Very low	43.6	Very low	54 Å²	54	118.6 Å²	118.6	29%	0.289	62%	0.615	S	S	.	*	H	α-helix	trans	-63.7	-29.3	179	-74.1	-5.4	0	0	0	113	I743 F756	I743-N752 WeakPolarHBondContact CD1-OD1 3.31Å; N752-F756 WeakPolarHBondContact O-CD2 3.47Å
753	A	42.2	Very low	42.5	Very low	71 Å²	71	115.6 Å²	115.6	59%	0.587	61%	0.611	S	S	*	*	H	α-helix	trans	-73.6	-28.3	-178.7	0	0	0	0	0	113	D751 K757	D751-A753 VanDerWaalsContact C-N 3.25Å; D751-A753 PolarHBondContact O-N 2.86Å; A753-K757 PolarHBondContact O-N 3.47Å
754	V	45	Very low	41.8	Very low	84 Å²	84	121.1 Å²	121.1	51%	0.509	64%	0.635	S	S	.	*	H	α-helix	trans	-80	-38.2	-177.7	-177.7	0	0	0	0	110.8	D751 F756 K757 N758	D751-V754 PolarHBondContact O-N 3.38Å; V754-F756 PolarHBondContact O-N 2.75Å; V754-K757 PolarHBondContact O-N 2.94Å; V754-N758 PolarHBondContact O-N 3.13Å
755	A	40.6	Very low	41.3	Very low	58 Å²	58	121.9 Å²	121.9	48%	0.479	64%	0.643	S	S	.	*	H	α-helix	trans	-62	-41.1	176	0	0	0	0	0	112.4	D751 K757	D751-A755 PolarHBondContact O-N 2.87Å; A755-K757 VanDerWaalsContact C-N 3.33Å; A755-K757 PolarHBondContact O-N 3.22Å
756	F	39.6	Very low	40.5	Very low	107 Å²	107	117.3 Å²	117.3	47%	0.469	64%	0.636	S	S	.	*	H	α-helix	trans	-66.8	-31.5	177.4	-95.2	-85.5	0	0	0	113.4	N752 V754	N752-F756 WeakPolarHBondContact O-CD2 3.47Å; V754-F756 PolarHBondContact O-N 2.75Å
757	K	41.2	Very low	39.9	Very low	168 Å²	168	117.1 Å²	117.1	73%	0.73	64%	0.635	S	S	*	*	H	α-helix	trans	-76.7	-36.4	-177.9	-115.3	-178.3	179.6	-179.3	0	113.2	A753 V754 A755 M759	A753-K757 PolarHBondContact O-N 3.47Å; V754-K757 PolarHBondContact O-N 2.94Å; A755-K757 VanDerWaalsContact C-N 3.33Å; A755-K757 PolarHBondContact O-N 3.22Å; K757-M759 VanDerWaalsContact C-N 3.29Å; K757-M759 PolarHBondContact O-N 2.76Å
758	N	41.8	Very low	39.6	Very low	113 Å²	113	122.2 Å²	122.2	60%	0.604	67%	0.67	S	S	*	*	H	α-helix	trans	-75.9	-16.5	-179	-75.3	-10.8	0	0	0	113.3	V754	V754-N758 PolarHBondContact O-N 3.13Å
759	M	44.1	Very low	39.5	Very low	90 Å²	90	125.6 Å²	125.6	44%	0.443	68%	0.675	S	S	.	*	H	α-helix	trans	-86.9	-17.7	-177.1	-77.7	-175.7	156.8	0	0	115.3	M740 K757 N761 E762	M740-M759 HydrophobicContact CE-CE 4.31Å; M740-M759 HydrophobicContact CE-SD 3.1Å; M740-M759 WeakPolarHBondContact CE-SD 3.39Å; M740-M759 HydrophobicContact CG-CE 4.47Å; M740-M759 HydrophobicContact CG-SD 4.36Å; M740-M759 HydrophobicContact SD-CE 4.3Å; M740-M759 HydrophobicContact SD-SD 3.7Å; M740-M759 VanDerWaalsContact SD-SD 3.7Å; K757-M759 VanDerWaalsContact C-N 3.29Å; K757-M759 PolarHBondContact O-N 2.76Å; M759-N761 PolarHBondContact O-N 3.17Å; M759-E762 PolarHBondContact O-N 3.39Å
760	N	39.9	Very low	39.4	Very low	129 Å²	129	122.7 Å²	122.7	69%	0.69	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-9.8	172.8	-82.7	-6.9	0	0	0	113.4
761	N	40.2	Very low	39.1	Very low	144 Å²	144	119.8 Å²	119.8	77%	0.77	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-8.3	179.7	-75.8	-7.4	0	0	0	114	M759	M759-N761 PolarHBondContact O-N 3.17Å
762	E	36.1	Very low	38.8	Very low	152 Å²	152	120.9 Å²	120.9	71%	0.71	66%	0.662	S	S	*	*			trans	-107.5	5.5	-178.5	-77.3	-171	174.1	0	0	114.5	M759 E764	M759-E762 PolarHBondContact O-N 3.39Å; E762-E764 VanDerWaalsContact C-N 3.27Å; E762-E764 PolarHBondContact O-N 3.05Å
763	T	38.1	Very low	38.7	Very low	101 Å²	101	125.1 Å²	125.1	62%	0.62	69%	0.686	S	S	*	*			trans	-75.3	87.7	166.8	44.2	0	0	0	0	108.9	S765	T763-S765 PolarHBondContact O-N 3.01Å; T763-S765 VanDerWaalsContact O-N 3.12Å
764	E	35.7	Very low	38.5	Very low	177 Å²	177	128.7 Å²	128.7	83%	0.827	69%	0.692	S	S	*	*			trans	-45.8	117.9	162.3	-75.8	179.7	157.7	0	0	108.3	E762 L766	E762-E764 VanDerWaalsContact C-N 3.27Å; E762-E764 PolarHBondContact O-N 3.05Å; E764-L766 VanDerWaalsContact C-N 3.3Å; E764-L766 PolarHBondContact O-N 3Å
765	S	34.1	Very low	38	Very low	98 Å²	98	131.9 Å²	131.9	69%	0.685	71%	0.705	S	S	*	*			trans	-58.9	96.1	168	48.2	0	0	0	0	108	T763 D767	T763-S765 PolarHBondContact O-N 3.01Å; T763-S765 VanDerWaalsContact O-N 3.12Å; S765-D767 PolarHBondContact O-N 3.47Å
766	L	32.5	Very low	37.8	Very low	156 Å²	156	137.5 Å²	137.5	82%	0.817	72%	0.723	S	S	*	*			trans	-66	89.8	157.4	-91.8	138.1	0	0	0	106.4	E764 V768	E764-L766 VanDerWaalsContact C-N 3.3Å; E764-L766 PolarHBondContact O-N 3Å; L766-V768 PolarHBondContact O-N 3.42Å
767	D	32.8	Very low	37.6	Very low	155 Å²	155	140.1 Å²	140.1	83%	0.829	74%	0.744	S	S	*	*			trans	-58.3	104.9	160.8	-78.8	-28.8	0	0	0	107.1	S765	S765-D767 PolarHBondContact O-N 3.47Å
768	V	35.5	Very low	37.3	Very low	198 Å²	198	137.5 Å²	137.5	100%	1.2	75%	0.745	S	S	*	*			trans	-119.9	0	164.4	178.4	0	0	0	0	108.2	L766	L766-V768 PolarHBondContact O-N 3.42Å

Retrieved 768 of 768 residues in 267.7 ms (Link to these results)

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