A0A077Z428_TRITR Loading...

GN3L Grn1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z428, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 535 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	67.2	Low	85.4	Confident	159 Å²	159	124.9 Å²	124.9	78%	0.783	57%	0.573	S	S	*	*				0	127.1	0	-91.1	-150.2	-87.2	0	0	110.1	L5 R6 I9	M1-L5 HydrophobicContact CG-CD2 3.93Å; M1-L5 HydrophobicContact SD-CD2 4.01Å; M1-L5 HydrophobicContact SD-CG 4.35Å; M1-R6 HydrophobicContact CB-CG 4.47Å; M1-I9 HydrophobicContact SD-CD1 3.7Å
2	T	80.2	Confident	86.1	Confident	93 Å²	93	127.7 Å²	127.7	57%	0.571	58%	0.582	S	S	*	*			trans	-75.3	154.1	178.2	61.2	0	0	0	0	112.3	R4 L5 R6	T2-R4 PolarHBondContact O-N 3.27Å; T2-L5 WeakPolarHBondContact O-CB 3.31Å; T2-L5 PolarHBondContact O-N 2.93Å; T2-L5 WeakPolarHBondContact OG1-CB 3.45Å; T2-L5 PolarHBondContact OG1-N 3.21Å; T2-R6 PolarHBondContact O-N 2.98Å
3	C	78.7	Confident	86.7	Confident	103 Å²	103	123.3 Å²	123.3	70%	0.696	57%	0.571	S	S	*	*	H	α-helix	trans	-56.7	-37.7	175.9	-66.9	0	0	0	0	112.3	L5 R6 Y7	C3-L5 VanDerWaalsContact C-N 3.34Å; C3-L5 PolarHBondContact O-N 3.44Å; C3-R6 PolarHBondContact O-N 3.27Å; C3-Y7 PolarHBondContact O-N 3.02Å
4	R	87.2	Confident	87	Confident	187 Å²	187	124.4 Å²	124.4	71%	0.706	57%	0.567	S	S	*	*	H	α-helix	trans	-60.2	-42	174.7	-170.3	178.1	-176.2	-169.8	1.1	112.1	T2 K8	T2-R4 PolarHBondContact O-N 3.27Å; R4-K8 WeakPolarHBondContact O-CB 3.39Å; R4-K8 WeakPolarHBondContact O-CG 3.11Å; R4-K8 PolarHBondContact O-N 3.23Å
5	L	86.7	Confident	87.4	Confident	79 Å²	79	124 Å²	124	41%	0.414	57%	0.566	S	S	.	*	H	α-helix	trans	-68.9	-43	176.8	-173.3	63.5	0	0	0	111.2	M1 T2 C3 Y7 K8 I9	M1-L5 HydrophobicContact CG-CD2 3.93Å; M1-L5 HydrophobicContact SD-CD2 4.01Å; M1-L5 HydrophobicContact SD-CG 4.35Å; T2-L5 WeakPolarHBondContact O-CB 3.31Å; T2-L5 PolarHBondContact O-N 2.93Å; T2-L5 WeakPolarHBondContact OG1-CB 3.45Å; T2-L5 PolarHBondContact OG1-N 3.21Å; C3-L5 VanDerWaalsContact C-N 3.34Å; C3-L5 PolarHBondContact O-N 3.44Å; L5-Y7 PolarHBondContact O-N 3.49Å; L5-K8 PolarHBondContact O-N 2.79Å; L5-I9 HydrophobicContact CG-CD1 4.04Å; L5-I9 VanDerWaalsContact O-CG1 3.28Å; L5-I9 WeakPolarHBondContact O-CG1 3.35Å; L5-I9 PolarHBondContact O-N 3.09Å
6	R	84.9	Confident	87.8	Confident	156 Å²	156	122.3 Å²	122.3	59%	0.589	56%	0.559	S	S	*	*	H	α-helix	trans	-57.2	-46.3	174.5	-70.7	-178.2	177.2	179.2	-0.2	111.8	M1 T2 C3 I9 Q10	M1-R6 HydrophobicContact CB-CG 4.47Å; T2-R6 PolarHBondContact O-N 2.98Å; C3-R6 PolarHBondContact O-N 3.27Å; R6-I9 PolarHBondContact O-N 3.31Å; R6-Q10 WeakPolarHBondContact O-CB 3.38Å; R6-Q10 PolarHBondContact O-N 2.76Å
7	Y	89	Confident	88.1	Confident	135 Å²	135	119.6 Å²	119.6	53%	0.529	55%	0.55	S	S	.	*	H	α-helix	trans	-65.4	-41.5	177.8	-171.8	-101.1	0	0	0	112.3	C3 L5 I9 Q10 R11	C3-Y7 PolarHBondContact O-N 3.02Å; L5-Y7 PolarHBondContact O-N 3.49Å; Y7-I9 PolarHBondContact O-N 3.08Å; Y7-Q10 PolarHBondContact O-N 2.73Å; Y7-R11 WeakPolarHBondContact O-CB 3.5Å; Y7-R11 PolarHBondContact O-N 2.75Å
8	K	91	Very high	88.3	Confident	116 Å²	116	122.3 Å²	122.3	50%	0.504	56%	0.555	S	S	.	*	H	α-helix	trans	-59.3	-44.4	173.6	-82.3	-175.7	176.2	-176.3	0	111.7	R4 L5 R11 K12	R4-K8 WeakPolarHBondContact O-CB 3.39Å; R4-K8 WeakPolarHBondContact O-CG 3.11Å; R4-K8 PolarHBondContact O-N 3.23Å; L5-K8 PolarHBondContact O-N 2.79Å; K8-R11 PolarHBondContact O-N 3Å; K8-K12 WeakPolarHBondContact O-CB 3.33Å; K8-K12 WeakPolarHBondContact O-CG 3.5Å; K8-K12 PolarHBondContact O-N 3Å
9	I	92.3	Very high	88.5	Confident	78 Å²	78	123.3 Å²	123.3	40%	0.4	56%	0.558	S	S	.	*	H	α-helix	trans	-62.1	-49.9	176.1	-67.5	164.7	0	0	0	109.9	M1 L5 R6 Y7 R11 K12 V13	M1-I9 HydrophobicContact SD-CD1 3.7Å; L5-I9 HydrophobicContact CG-CD1 4.04Å; L5-I9 VanDerWaalsContact O-CG1 3.28Å; L5-I9 WeakPolarHBondContact O-CG1 3.35Å; L5-I9 PolarHBondContact O-N 3.09Å; R6-I9 PolarHBondContact O-N 3.31Å; Y7-I9 PolarHBondContact O-N 3.08Å; I9-R11 VanDerWaalsContact C-N 3.31Å; I9-R11 PolarHBondContact O-N 3.23Å; I9-K12 PolarHBondContact O-N 3.45Å; I9-K12 VanDerWaalsContact O-N 3.17Å; I9-V13 HydrophobicContact CG2-CG2 4.26Å; I9-V13 VanDerWaalsContact O-CG2 3.3Å; I9-V13 WeakPolarHBondContact O-CG2 3.33Å; I9-V13 PolarHBondContact O-N 3.37Å
10	Q	89.8	Confident	88.6	Confident	109 Å²	109	123.1 Å²	123.1	51%	0.509	56%	0.556	S	S	.	*	H	α-helix	trans	-63.1	-36.3	-177.9	-148.5	-171.1	33.8	0	0	112.5	R6 Y7 R14	R6-Q10 WeakPolarHBondContact O-CB 3.38Å; R6-Q10 PolarHBondContact O-N 2.76Å; Y7-Q10 PolarHBondContact O-N 2.73Å; Q10-R14 WeakPolarHBondContact O-CB 3.43Å; Q10-R14 WeakPolarHBondContact O-CG 3.42Å; Q10-R14 PolarHBondContact O-N 3.43Å; Q10-R14 VanDerWaalsContact OE1-NH2 3.11Å
11	R	92.2	Very high	88.6	Confident	159 Å²	159	126 Å²	126	60%	0.6	56%	0.563	S	S	*	*	H	α-helix	trans	-66.7	-46	173.8	-169.4	-179.8	126.6	173.5	-1.5	111.3	Y7 K8 I9 V13 R14 E15	Y7-R11 WeakPolarHBondContact O-CB 3.5Å; Y7-R11 PolarHBondContact O-N 2.75Å; K8-R11 PolarHBondContact O-N 3Å; I9-R11 VanDerWaalsContact C-N 3.31Å; I9-R11 PolarHBondContact O-N 3.23Å; R11-V13 VanDerWaalsContact C-N 3.34Å; R11-V13 PolarHBondContact O-N 3.14Å; R11-R14 PolarHBondContact O-N 2.88Å; R11-E15 WeakPolarHBondContact O-CB 3.36Å; R11-E15 PolarHBondContact O-N 2.87Å
12	K	93.7	Very high	89.5	Confident	158 Å²	158	124.2 Å²	124.2	69%	0.687	55%	0.551	S	S	*	*	H	α-helix	trans	-60.3	-41.3	174.7	-76.9	-173.6	175.7	-171.6	0	112	K8 I9 E15 H16	K8-K12 WeakPolarHBondContact O-CB 3.33Å; K8-K12 WeakPolarHBondContact O-CG 3.5Å; K8-K12 PolarHBondContact O-N 3Å; I9-K12 PolarHBondContact O-N 3.45Å; I9-K12 VanDerWaalsContact O-N 3.17Å; K12-E15 PolarHBondContact O-N 2.96Å; K12-H16 VanDerWaalsContact O-CB 3.31Å; K12-H16 WeakPolarHBondContact O-CB 3.36Å; K12-H16 PolarHBondContact O-N 3.25Å
13	V	94.3	Very high	89.8	Confident	71 Å²	71	124.3 Å²	124.3	43%	0.43	54%	0.544	S	S	.	.	H	α-helix	trans	-64.3	-45	175.9	171.6	0	0	0	0	111.3	I9 R11 E15 H16 N17	I9-V13 HydrophobicContact CG2-CG2 4.26Å; I9-V13 VanDerWaalsContact O-CG2 3.3Å; I9-V13 WeakPolarHBondContact O-CG2 3.33Å; I9-V13 PolarHBondContact O-N 3.37Å; R11-V13 VanDerWaalsContact C-N 3.34Å; R11-V13 PolarHBondContact O-N 3.14Å; V13-E15 VanDerWaalsContact C-N 3.33Å; V13-E15 PolarHBondContact O-N 3.41Å; V13-H16 PolarHBondContact O-N 3.29Å; V13-N17 WeakPolarHBondContact O-CB 3.47Å; V13-N17 VanDerWaalsContact O-CG 3.26Å; V13-N17 PolarHBondContact O-N 3.45Å
14	R	91.5	Very high	89.9	Confident	138 Å²	138	124.7 Å²	124.7	52%	0.521	54%	0.536	S	S	.	.	H	α-helix	trans	-59.9	-43.4	175.4	-83.8	-173.6	-104.5	174.5	-8.3	111.9	Q10 R11 N17 R18	Q10-R14 WeakPolarHBondContact O-CB 3.43Å; Q10-R14 WeakPolarHBondContact O-CG 3.42Å; Q10-R14 PolarHBondContact O-N 3.43Å; Q10-R14 VanDerWaalsContact OE1-NH2 3.11Å; R11-R14 PolarHBondContact O-N 2.88Å; R14-N17 PolarHBondContact O-N 2.87Å; R14-R18 WeakPolarHBondContact O-CB 3.46Å; R14-R18 PolarHBondContact O-N 3.21Å
15	E	92.4	Very high	89.4	Confident	119 Å²	119	124 Å²	124	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-67.4	-44	179.7	-169	165.7	-164.8	0	0	112.2	R11 K12 V13 N17 R18 K19	R11-E15 WeakPolarHBondContact O-CB 3.36Å; R11-E15 PolarHBondContact O-N 2.87Å; K12-E15 PolarHBondContact O-N 2.96Å; V13-E15 VanDerWaalsContact C-N 3.33Å; V13-E15 PolarHBondContact O-N 3.41Å; E15-N17 PolarHBondContact O-N 3.01Å; E15-R18 WeakPolarHBondContact O-CB 3.46Å; E15-R18 PolarHBondContact O-N 3.22Å; E15-K19 PolarHBondContact O-N 3.39Å
16	H	94	Very high	88.9	Confident	97 Å²	97	127.5 Å²	127.5	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-59.3	-45.7	172.3	171.8	-87.9	0	0	0	112.1	K12 V13 R18 K19 K20	K12-H16 VanDerWaalsContact O-CB 3.31Å; K12-H16 WeakPolarHBondContact O-CB 3.36Å; K12-H16 PolarHBondContact O-N 3.25Å; V13-H16 PolarHBondContact O-N 3.29Å; H16-R18 VanDerWaalsContact C-N 3.35Å; H16-R18 PolarHBondContact O-N 3.47Å; H16-K19 PolarHBondContact O-N 3.26Å; H16-K19 VanDerWaalsContact O-N 3.17Å; H16-K20 VanDerWaalsContact CE1-CD 3.48Å; H16-K20 WeakPolarHBondContact CE1-CD 3.27Å; H16-K20 WeakPolarHBondContact CE1-CE 3.43Å; H16-K20 PolarHBondContact O-N 3.21Å
17	N	92.5	Very high	88.3	Confident	77 Å²	77	126.9 Å²	126.9	41%	0.412	55%	0.547	S	S	.	.	H	α-helix	trans	-66.7	-35.4	177.9	-72	-12.8	0	0	0	112.3	V13 R14 E15 K19 R21	V13-N17 WeakPolarHBondContact O-CB 3.47Å; V13-N17 VanDerWaalsContact O-CG 3.26Å; V13-N17 PolarHBondContact O-N 3.45Å; R14-N17 PolarHBondContact O-N 2.87Å; E15-N17 PolarHBondContact O-N 3.01Å; N17-K19 VanDerWaalsContact C-N 3.34Å; N17-R21 WeakPolarHBondContact O-CB 3.46Å; N17-R21 WeakPolarHBondContact O-CG 3.36Å; N17-R21 PolarHBondContact O-N 2.93Å
18	R	91.8	Very high	87.2	Confident	168 Å²	168	125.1 Å²	125.1	63%	0.634	54%	0.544	S	S	*	.	H	α-helix	trans	-63.1	-41.1	171.9	-174.7	-176.8	-179.4	-157.7	1.8	111	R14 E15 H16 K22	R14-R18 WeakPolarHBondContact O-CB 3.46Å; R14-R18 PolarHBondContact O-N 3.21Å; E15-R18 WeakPolarHBondContact O-CB 3.46Å; E15-R18 PolarHBondContact O-N 3.22Å; H16-R18 VanDerWaalsContact C-N 3.35Å; H16-R18 PolarHBondContact O-N 3.47Å; R18-K22 PolarHBondContact O-N 3.09Å
19	K	92	Very high	85.4	Confident	140 Å²	140	126.8 Å²	126.8	61%	0.609	55%	0.551	S	S	*	*	H	α-helix	trans	-66.9	-47.4	176.5	-162.8	178	178.4	-175.9	0	111.3	E15 H16 N17 R21 K22 E23	E15-K19 PolarHBondContact O-N 3.39Å; H16-K19 PolarHBondContact O-N 3.26Å; H16-K19 VanDerWaalsContact O-N 3.17Å; N17-K19 VanDerWaalsContact C-N 3.34Å; K19-R21 PolarHBondContact O-N 2.73Å; K19-K22 WeakPolarHBondContact O-CB 3.43Å; K19-K22 PolarHBondContact O-N 2.97Å; K19-K22 VanDerWaalsContact O-N 3.08Å; K19-E23 WeakPolarHBondContact CE-OE1 3.26Å; K19-E23 PolarHBondContact O-N 3.46Å
20	K	90.5	Very high	83.2	Confident	120 Å²	120	128 Å²	128	52%	0.522	56%	0.562	S	S	.	*	H	α-helix	trans	-55.8	-44.3	172.8	-83.8	-166.3	170.8	-178.1	0	112.6	H16 K22 E23 Q24	H16-K20 VanDerWaalsContact CE1-CD 3.48Å; H16-K20 WeakPolarHBondContact CE1-CD 3.27Å; H16-K20 WeakPolarHBondContact CE1-CE 3.43Å; H16-K20 PolarHBondContact O-N 3.21Å; K20-K22 PolarHBondContact O-N 3.43Å; K20-E23 PolarHBondContact O-N 3.19Å; K20-Q24 VanDerWaalsContact O-CB 3.27Å; K20-Q24 WeakPolarHBondContact O-CB 3.4Å; K20-Q24 PolarHBondContact O-N 3.09Å
21	R	88	Confident	80.8	Confident	185 Å²	185	131.4 Å²	131.4	70%	0.698	58%	0.575	S	S	*	*	H	α-helix	trans	-63.5	-38.2	175.3	-77.5	179	177.7	-176.4	-0.2	112.8	N17 K19 R25	N17-R21 WeakPolarHBondContact O-CB 3.46Å; N17-R21 WeakPolarHBondContact O-CG 3.36Å; N17-R21 PolarHBondContact O-N 2.93Å; K19-R21 PolarHBondContact O-N 2.73Å; R21-R25 WeakPolarHBondContact O-CB 3.41Å; R21-R25 VanDerWaalsContact O-CG 3.28Å; R21-R25 WeakPolarHBondContact O-CG 3.49Å; R21-R25 PolarHBondContact O-N 2.95Å
22	K	86.3	Confident	78.4	Confident	121 Å²	121	127.2 Å²	127.2	53%	0.526	57%	0.57	S	S	.	*	H	α-helix	trans	-67.4	-43.2	175.6	-80.1	-175.5	175.6	-174.3	0	111.7	R18 K19 K20 R25 K26	R18-K22 PolarHBondContact O-N 3.09Å; K19-K22 WeakPolarHBondContact O-CB 3.43Å; K19-K22 PolarHBondContact O-N 2.97Å; K19-K22 VanDerWaalsContact O-N 3.08Å; K20-K22 PolarHBondContact O-N 3.43Å; K22-R25 PolarHBondContact O-N 3.13Å; K22-K26 WeakPolarHBondContact O-CG 3.45Å; K22-K26 PolarHBondContact O-N 2.75Å
23	E	86.2	Confident	75.4	Confident	95 Å²	95	123 Å²	123	44%	0.444	57%	0.571	S	S	.	*	H	α-helix	trans	-66.2	-40.8	176.1	-76.1	171.8	-168.7	0	0	111.8	K19 K20 K26 K27	K19-E23 WeakPolarHBondContact CE-OE1 3.26Å; K19-E23 PolarHBondContact O-N 3.46Å; K20-E23 PolarHBondContact O-N 3.19Å; E23-K26 CarbonylContact O-C 3.24Å; E23-K26 WeakPolarHBondContact O-CB 3.37Å; E23-K26 PolarHBondContact O-N 3.23Å; E23-K26 VanDerWaalsContact O-N 3.16Å; E23-K27 WeakPolarHBondContact O-CG 3.4Å; E23-K27 PolarHBondContact O-N 3.22Å
24	Q	81.3	Confident	72.3	Confident	111 Å²	111	123.1 Å²	123.1	52%	0.519	59%	0.587	S	S	.	*	H	α-helix	trans	-62.9	-45.1	173.9	-171.3	-179.9	-13.4	0	0	111.1	K20 K26 K27 E28	K20-Q24 VanDerWaalsContact O-CB 3.27Å; K20-Q24 WeakPolarHBondContact O-CB 3.4Å; K20-Q24 PolarHBondContact O-N 3.09Å; Q24-K26 VanDerWaalsContact C-N 3.28Å; Q24-K26 PolarHBondContact O-N 2.98Å; Q24-K27 CarbonylContact O-C 3.53Å; Q24-K27 PolarHBondContact O-N 3.29Å; Q24-K27 VanDerWaalsContact O-N 3.17Å; Q24-E28 HydrophobicContact CG-CG 4.47Å; Q24-E28 WeakPolarHBondContact CG-OE1 3.35Å; Q24-E28 PolarHBondContact NE2-OE1 3.23Å; Q24-E28 WeakPolarHBondContact O-CB 3.3Å; Q24-E28 VanDerWaalsContact O-CG 3.31Å; Q24-E28 WeakPolarHBondContact O-CG 3.33Å; Q24-E28 PolarHBondContact O-N 3.14Å
25	R	77.8	Confident	69.1	Low	172 Å²	172	118 Å²	118	65%	0.649	58%	0.578	S	S	*	*	H	α-helix	trans	-61.5	-34.3	172.4	-76.4	176.8	178.3	-168.4	-0.9	112.7	R21 K22 K29	R21-R25 WeakPolarHBondContact O-CB 3.41Å; R21-R25 VanDerWaalsContact O-CG 3.28Å; R21-R25 WeakPolarHBondContact O-CG 3.49Å; R21-R25 PolarHBondContact O-N 2.95Å; K22-R25 PolarHBondContact O-N 3.13Å; R25-K29 WeakPolarHBondContact O-CB 3.47Å; R25-K29 WeakPolarHBondContact O-CG 3.4Å; R25-K29 PolarHBondContact O-N 3.31Å
26	K	75.2	Confident	66.2	Low	152 Å²	152	115.6 Å²	115.6	66%	0.661	58%	0.584	S	S	*	*	H	α-helix	trans	-69.2	-42.7	173.2	-80.4	-173.4	176.3	-172.3	0	111.4	K22 E23 Q24 K29 T30	K22-K26 WeakPolarHBondContact O-CG 3.45Å; K22-K26 PolarHBondContact O-N 2.75Å; E23-K26 CarbonylContact O-C 3.24Å; E23-K26 WeakPolarHBondContact O-CB 3.37Å; E23-K26 PolarHBondContact O-N 3.23Å; E23-K26 VanDerWaalsContact O-N 3.16Å; Q24-K26 VanDerWaalsContact C-N 3.28Å; Q24-K26 PolarHBondContact O-N 2.98Å; K26-K29 CarbonylContact O-C 3.15Å; K26-K29 PolarHBondContact O-N 3.46Å; K26-T30 WeakPolarHBondContact O-CG2 3.46Å; K26-T30 PolarHBondContact O-N 2.87Å; K26-T30 PolarHBondContact O-OG1 3.39Å; K26-T30 VanDerWaalsContact O-OG1 3.1Å
27	K	72.4	Confident	63.3	Low	144 Å²	144	119.2 Å²	119.2	63%	0.626	61%	0.606	S	S	*	*	H	α-helix	trans	-64.6	-40.4	174.5	-75.5	-176.1	178.4	-176.6	0	111.9	E23 Q24 K29 T30 K31	E23-K27 WeakPolarHBondContact O-CG 3.4Å; E23-K27 PolarHBondContact O-N 3.22Å; Q24-K27 CarbonylContact O-C 3.53Å; Q24-K27 PolarHBondContact O-N 3.29Å; Q24-K27 VanDerWaalsContact O-N 3.17Å; K27-K29 VanDerWaalsContact C-N 3.35Å; K27-T30 WeakPolarHBondContact CA-OG1 3.36Å; K27-T30 PolarHBondContact O-N 3.36Å; K27-T30 PolarHBondContact O-OG1 3.36Å; K27-T30 VanDerWaalsContact O-OG1 3.13Å; K27-K31 VanDerWaalsContact O-CB 3.23Å; K27-K31 WeakPolarHBondContact O-CB 3.42Å; K27-K31 VanDerWaalsContact O-CG 3.25Å; K27-K31 WeakPolarHBondContact O-CG 3.38Å; K27-K31 PolarHBondContact O-N 3.15Å
28	E	67	Low	60.3	Low	98 Å²	98	118.4 Å²	118.4	46%	0.458	62%	0.616	S	S	.	*	H	α-helix	trans	-65.2	-40.9	172.4	-75	166.7	-172.1	0	0	110.2	Q24 K31 S32	Q24-E28 HydrophobicContact CG-CG 4.47Å; Q24-E28 WeakPolarHBondContact CG-OE1 3.35Å; Q24-E28 PolarHBondContact NE2-OE1 3.23Å; Q24-E28 WeakPolarHBondContact O-CB 3.3Å; Q24-E28 VanDerWaalsContact O-CG 3.31Å; Q24-E28 WeakPolarHBondContact O-CG 3.33Å; Q24-E28 PolarHBondContact O-N 3.14Å; E28-K31 CarbonylContact O-C 3.54Å; E28-K31 PolarHBondContact O-N 2.93Å; E28-S32 WeakPolarHBondContact O-CA 3.48Å; E28-S32 WeakPolarHBondContact O-CB 3.36Å; E28-S32 PolarHBondContact O-N 3.4Å; E28-S32 PolarHBondContact O-OG 3.36Å
29	K	52.7	Low	57.5	Low	151 Å²	151	117 Å²	117	66%	0.657	62%	0.619	S	S	*	*	H	α-helix	trans	-73.7	-19	173.5	-78.5	-176.2	177.7	-164.2	0	114.9	R25 K26 K27 S32 G33	R25-K29 WeakPolarHBondContact O-CB 3.47Å; R25-K29 WeakPolarHBondContact O-CG 3.4Å; R25-K29 PolarHBondContact O-N 3.31Å; K26-K29 CarbonylContact O-C 3.15Å; K26-K29 PolarHBondContact O-N 3.46Å; K27-K29 VanDerWaalsContact C-N 3.35Å; K29-S32 WeakPolarHBondContact CA-OG 3.27Å; K29-G33 WeakPolarHBondContact O-CA 3.28Å; K29-G33 PolarHBondContact O-N 2.88Å
30	T	46.3	Very low	54.9	Low	102 Å²	102	117.8 Å²	117.8	63%	0.626	62%	0.623	S	S	*	*	H	α-helix	trans	-88.1	-33.4	169.3	48.1	0	0	0	0	110.3	K26 K27 S32 G34	K26-T30 WeakPolarHBondContact O-CG2 3.46Å; K26-T30 PolarHBondContact O-N 2.87Å; K26-T30 PolarHBondContact O-OG1 3.39Å; K26-T30 VanDerWaalsContact O-OG1 3.1Å; K27-T30 WeakPolarHBondContact CA-OG1 3.36Å; K27-T30 PolarHBondContact O-N 3.36Å; K27-T30 PolarHBondContact O-OG1 3.36Å; K27-T30 VanDerWaalsContact O-OG1 3.13Å; T30-S32 VanDerWaalsContact C-N 3.34Å; T30-G34 PolarHBondContact O-N 3.36Å; T30-G34 VanDerWaalsContact O-N 3.14Å
31	K	39.4	Very low	52.2	Low	181 Å²	181	121.5 Å²	121.5	79%	0.787	64%	0.639	S	S	*	*	H	α-helix	trans	-66.6	-31.1	167.1	-74.1	-176.5	175.6	-168.8	0	113	K27 E28	K27-K31 VanDerWaalsContact O-CB 3.23Å; K27-K31 WeakPolarHBondContact O-CB 3.42Å; K27-K31 VanDerWaalsContact O-CG 3.25Å; K27-K31 WeakPolarHBondContact O-CG 3.38Å; K27-K31 PolarHBondContact O-N 3.15Å; E28-K31 CarbonylContact O-C 3.54Å; E28-K31 PolarHBondContact O-N 2.93Å
32	S	41.2	Very low	49.9	Very low	72 Å²	72	118.4 Å²	118.4	50%	0.503	64%	0.635	S	S	.	*	H	α-helix	trans	-104.3	-20.7	178	68.8	0	0	0	0	114	E28 K29 T30 G35	E28-S32 WeakPolarHBondContact O-CA 3.48Å; E28-S32 WeakPolarHBondContact O-CB 3.36Å; E28-S32 PolarHBondContact O-N 3.4Å; E28-S32 PolarHBondContact O-OG 3.36Å; K29-S32 WeakPolarHBondContact CA-OG 3.27Å; T30-S32 VanDerWaalsContact C-N 3.34Å; S32-G35 CarbonylContact O-C 3.4Å; S32-G35 VanDerWaalsContact O-C 3.24Å; S32-G35 PolarHBondContact O-N 3.17Å
33	G	31.4	Very low	47.8	Very low	68 Å²	68	120 Å²	120	70%	0.701	65%	0.645	S	S	*	*	H	α-helix	trans	-92.8	-5.9	177.2	0	0	0	0	0	114	K29	K29-G33 WeakPolarHBondContact O-CA 3.28Å; K29-G33 PolarHBondContact O-N 2.88Å
34	G	28.4	Very low	45.9	Very low	75 Å²	75	122.1 Å²	122.1	77%	0.773	65%	0.654	S	S	*	*	S	Bend	trans	-96.7	2.1	154.7	0	0	0	0	0	113.2	T30	T30-G34 PolarHBondContact O-N 3.36Å; T30-G34 VanDerWaalsContact O-N 3.14Å
35	G	25.1	Very low	44.5	Very low	31 Å²	31	118.5 Å²	118.5	32%	0.32	64%	0.64	S	S	.	*			trans	-135.3	64.2	-172.2	0	0	0	0	0	111.1	S32 L37	S32-G35 CarbonylContact O-C 3.4Å; S32-G35 VanDerWaalsContact O-C 3.24Å; S32-G35 PolarHBondContact O-N 3.17Å; G35-L37 PolarHBondContact O-N 3.38Å; G35-L37 VanDerWaalsContact O-N 3.08Å
36	G	30.6	Very low	43	Very low	67 Å²	67	113.7 Å²	113.7	69%	0.691	63%	0.631	S	S	*	*	S	Bend	trans	-53.8	117.2	151.3	0	0	0	0	0	105.9	G38	G36-G38 VanDerWaalsContact C-N 3.26Å; G36-G38 PolarHBondContact O-N 3.42Å
37	L	34.1	Very low	42.2	Very low	174 Å²	174	112.7 Å²	112.7	91%	0.911	63%	0.633	S	S	*	*	S	Bend	trans	13.2	75.7	-179.7	-74.8	158	0	0	0	111	G35 I39	G35-L37 PolarHBondContact O-N 3.38Å; G35-L37 VanDerWaalsContact O-N 3.08Å; L37-I39 PolarHBondContact O-N 3.17Å
38	G	28.2	Very low	42.2	Very low	60 Å²	60	110.8 Å²	110.8	62%	0.619	64%	0.638	S	S	*	*			trans	-55	105.3	170.5	0	0	0	0	0	104.3	G36 K40	G36-G38 VanDerWaalsContact C-N 3.26Å; G36-G38 PolarHBondContact O-N 3.42Å; G38-K40 PolarHBondContact O-N 3.02Å
39	I	33.8	Very low	42.2	Very low	137 Å²	137	108.1 Å²	108.1	70%	0.703	63%	0.629	S	S	*	*			trans	-43.5	101.6	150.4	-64	169.4	0	0	0	101.1	L37 K41 L42	L37-I39 PolarHBondContact O-N 3.17Å; I39-K41 PolarHBondContact O-N 3.06Å; I39-L42 HydrophobicContact CG2-CD1 4.47Å; I39-L42 HydrophobicContact CG2-CG 4.1Å
40	K	36.8	Very low	43.2	Very low	157 Å²	157	106.1 Å²	106.1	68%	0.683	63%	0.632	S	S	*	*			trans	-42.7	119.8	165.4	-73.8	178.9	173.2	-173.5	0	102.4	G38 L42	G38-K40 PolarHBondContact O-N 3.02Å; K40-L42 WeakPolarHBondContact O-CA 3.31Å; K40-L42 PolarHBondContact O-N 3.5Å
41	K	34.1	Very low	44.5	Very low	199 Å²	199	107.3 Å²	107.3	87%	0.865	63%	0.628	S	S	*	*	S	Bend	trans	-29.7	108.7	176.5	-89.1	-177.8	173.3	-176.7	0	105.2	I39 E43	I39-K41 PolarHBondContact O-N 3.06Å; K41-E43 VanDerWaalsContact C-N 3.32Å; K41-E43 WeakPolarHBondContact O-CA 3.1Å; K41-E43 PolarHBondContact O-N 3.3Å
42	L	39	Very low	46	Very low	119 Å²	119	101.3 Å²	101.3	62%	0.623	60%	0.602	S	S	*	*			trans	-41.8	109.3	-169.3	-98.6	153.4	0	0	0	105.4	I39 K40 H44	I39-L42 HydrophobicContact CG2-CD1 4.47Å; I39-L42 HydrophobicContact CG2-CG 4.1Å; K40-L42 WeakPolarHBondContact O-CA 3.31Å; K40-L42 PolarHBondContact O-N 3.5Å; L42-H44 PolarHBondContact O-N 2.84Å
43	E	43.3	Very low	47.6	Very low	155 Å²	155	105.8 Å²	105.8	72%	0.724	62%	0.615	S	S	*	*			trans	-58.7	102.5	-178.7	-80.9	167.6	178.8	0	0	103	K41 V45	K41-E43 VanDerWaalsContact C-N 3.32Å; K41-E43 WeakPolarHBondContact O-CA 3.1Å; K41-E43 PolarHBondContact O-N 3.3Å; E43-V45 PolarHBondContact O-N 2.84Å
44	H	46.2	Very low	49.8	Very low	139 Å²	139	108.5 Å²	108.5	64%	0.644	61%	0.61	S	S	*	*			trans	23.8	94.2	173.3	-169.4	76.8	0	0	0	114.7	L42 P46	L42-H44 PolarHBondContact O-N 2.84Å; H44-P46 WeakPolarHBondContact O-CD 3.42Å
45	V	50.9	Low	52	Low	36 Å²	36	109.1 Å²	109.1	22%	0.218	60%	0.595	C	S	.	*			trans	-56.1	113.3	162.5	179.9	0	0	0	0	106.5	E43 N47 C49 K52	E43-V45 PolarHBondContact O-N 2.84Å; V45-N47 PolarHBondContact O-N 2.88Å; V45-C49 HydrophobicContact CG1-CB 3.6Å; V45-K52 HydrophobicContact CB-CD 4.21Å; V45-K52 HydrophobicContact CB-CG 4.18Å; V45-K52 HydrophobicContact CG1-CB 4.12Å; V45-K52 HydrophobicContact CG1-CD 4.01Å; V45-K52 HydrophobicContact CG1-CG 3.82Å; V45-K52 PolarHBondContact O-NZ 3.13Å; V45-K52 VanDerWaalsContact O-NZ 3.09Å
46	P	46.2	Very low	54.4	Low	71 Å²	71	112.1 Å²	112.1	46%	0.461	60%	0.603	S	S	.	*			trans	-54.4	141.1	-177.4	-24.9	34.7	0	0	0	109.4	H44 S48 C49	H44-P46 WeakPolarHBondContact O-CD 3.42Å; P46-S48 PolarHBondContact O-N 3.27Å; P46-C49 PolarHBondContact O-N 2.84Å
47	N	60.1	Low	56.8	Low	131 Å²	131	115.7 Å²	115.7	70%	0.701	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-12.5	-180	-82.8	-7.4	0	0	0	113.7	V45 C49 K52	V45-N47 PolarHBondContact O-N 2.88Å; N47-C49 VanDerWaalsContact C-N 3.31Å; N47-C49 PolarHBondContact O-N 3.32Å; N47-K52 PolarHBondContact OD1-NZ 3.48Å
48	S	72.1	Confident	58.9	Low	104 Å²	104	113.8 Å²	113.8	73%	0.727	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-4.3	174.5	51.4	0	0	0	0	115	P46 P50	P46-S48 PolarHBondContact O-N 3.27Å; S48-P50 VanDerWaalsContact O-CD 3.31Å; S48-P50 WeakPolarHBondContact O-CD 3.45Å
49	C	66.5	Low	61.1	Low	42 Å²	42	113.5 Å²	113.5	28%	0.284	58%	0.58	S	S	.	*			trans	-79.7	114.3	180	-173.4	0	0	0	0	111.5	V45 P46 N47 F51 K52	V45-C49 HydrophobicContact CG1-CB 3.6Å; P46-C49 PolarHBondContact O-N 2.84Å; N47-C49 VanDerWaalsContact C-N 3.31Å; N47-C49 PolarHBondContact O-N 3.32Å; C49-F51 VanDerWaalsContact C-N 3.26Å; C49-F51 PolarHBondContact O-N 2.94Å; C49-K52 HydrophobicContact CB-CB 4.29Å; C49-K52 WeakPolarHBondContact O-CB 3.27Å; C49-K52 PolarHBondContact O-N 3.49Å
50	P	72.6	Confident	63.3	Low	108 Å²	108	112.2 Å²	112.2	70%	0.701	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-24.8	-172.3	22.8	-32	0	0	0	114.2	S48	S48-P50 VanDerWaalsContact O-CD 3.31Å; S48-P50 WeakPolarHBondContact O-CD 3.45Å
51	F	74.1	Confident	65.3	Low	127 Å²	127	112.8 Å²	112.8	56%	0.557	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	21.5	-177.6	-49.6	-70.7	0	0	0	112.9	C49 Q53 E54 L55	C49-F51 VanDerWaalsContact C-N 3.26Å; C49-F51 PolarHBondContact O-N 2.94Å; F51-Q53 VanDerWaalsContact C-N 3.27Å; F51-Q53 PolarHBondContact O-N 2.74Å; F51-E54 PolarHBondContact O-N 3.21Å; F51-L55 WeakPolarHBondContact O-CG 3.28Å; F51-L55 PolarHBondContact O-N 3.26Å
52	K	71.5	Confident	67.3	Low	55 Å²	55	106.6 Å²	106.6	24%	0.239	55%	0.551	C	S	.	*	H	α-helix	trans	-53.4	-42.4	-176.5	176.8	174.3	176.4	170.8	0	113	V45 N47 C49 L56	V45-K52 HydrophobicContact CB-CD 4.21Å; V45-K52 HydrophobicContact CB-CG 4.18Å; V45-K52 HydrophobicContact CG1-CB 4.12Å; V45-K52 HydrophobicContact CG1-CD 4.01Å; V45-K52 HydrophobicContact CG1-CG 3.82Å; V45-K52 PolarHBondContact O-NZ 3.13Å; V45-K52 VanDerWaalsContact O-NZ 3.09Å; N47-K52 PolarHBondContact OD1-NZ 3.48Å; C49-K52 HydrophobicContact CB-CB 4.29Å; C49-K52 WeakPolarHBondContact O-CB 3.27Å; C49-K52 PolarHBondContact O-N 3.49Å; K52-L56 HydrophobicContact CG-CD1 3.93Å; K52-L56 WeakPolarHBondContact O-CB 3.38Å; K52-L56 WeakPolarHBondContact O-CD1 3.17Å; K52-L56 WeakPolarHBondContact O-CG 3.38Å; K52-L56 PolarHBondContact O-N 2.86Å; K52-L56 VanDerWaalsContact O-N 3.08Å
53	Q	74.2	Confident	69.2	Low	166 Å²	166	108.1 Å²	108.1	78%	0.776	55%	0.552	S	S	*	*	H	α-helix	trans	-69.9	-42.1	-175.9	-149	168	6.3	0	0	111.4	F51 L56 E57	F51-Q53 VanDerWaalsContact C-N 3.27Å; F51-Q53 PolarHBondContact O-N 2.74Å; Q53-L56 PolarHBondContact O-N 3.4Å; Q53-E57 PolarHBondContact O-N 3.26Å
54	E	78.7	Confident	71.1	Confident	126 Å²	126	108.1 Å²	108.1	59%	0.589	55%	0.546	S	S	*	.	H	α-helix	trans	-65.9	-41.6	176.2	-167.7	174.1	-170.5	0	0	111.9	F51 L56 E57 Q58	F51-E54 PolarHBondContact O-N 3.21Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 2.93Å; E54-E57 PolarHBondContact O-N 3.48Å; E54-Q58 WeakPolarHBondContact O-CB 3.27Å; E54-Q58 PolarHBondContact O-N 3.15Å
55	L	74.6	Confident	72.8	Confident	88 Å²	88	105.5 Å²	105.5	46%	0.461	53%	0.534	S	S	.	.	H	α-helix	trans	-61.5	-39.7	174.1	-76.9	165.3	0	0	0	112.5	F51 A59	F51-L55 WeakPolarHBondContact O-CG 3.28Å; F51-L55 PolarHBondContact O-N 3.26Å; L55-A59 WeakPolarHBondContact O-CB 3.15Å; L55-A59 PolarHBondContact O-N 2.87Å; L55-A59 VanDerWaalsContact O-N 3.14Å
56	L	74.5	Confident	74	Confident	94 Å²	94	108.4 Å²	108.4	49%	0.492	55%	0.545	S	S	.	.	H	α-helix	trans	-65.8	-44.3	176	-79.7	158.6	0	0	0	111.3	K52 Q53 E54 A59 E60	K52-L56 HydrophobicContact CG-CD1 3.93Å; K52-L56 WeakPolarHBondContact O-CB 3.38Å; K52-L56 WeakPolarHBondContact O-CD1 3.17Å; K52-L56 WeakPolarHBondContact O-CG 3.38Å; K52-L56 PolarHBondContact O-N 2.86Å; K52-L56 VanDerWaalsContact O-N 3.08Å; Q53-L56 PolarHBondContact O-N 3.4Å; E54-L56 VanDerWaalsContact C-N 3.33Å; E54-L56 PolarHBondContact O-N 2.93Å; L56-A59 PolarHBondContact O-N 3Å; L56-E60 PolarHBondContact O-N 3.39Å
57	E	80.7	Confident	75.7	Confident	142 Å²	142	110.7 Å²	110.7	66%	0.664	55%	0.55	S	S	*	.	H	α-helix	trans	-66.3	-42	179	-171.6	171.9	-170.1	0	0	112.2	Q53 E54 A59 E60 R61	Q53-E57 PolarHBondContact O-N 3.26Å; E54-E57 PolarHBondContact O-N 3.48Å; E57-A59 VanDerWaalsContact C-N 3.31Å; E57-A59 PolarHBondContact O-N 3.48Å; E57-E60 PolarHBondContact O-N 2.98Å; E57-R61 WeakPolarHBondContact O-CB 3.49Å; E57-R61 PolarHBondContact O-N 3.3Å
58	Q	78.6	Confident	77	Confident	134 Å²	134	111 Å²	111	63%	0.626	55%	0.545	S	S	*	.	H	α-helix	trans	-61.5	-40	175.8	-166.7	177.9	22.5	0	0	111.7	E54 R61 S62	E54-Q58 WeakPolarHBondContact O-CB 3.27Å; E54-Q58 PolarHBondContact O-N 3.15Å; Q58-R61 PolarHBondContact O-N 2.73Å; Q58-S62 WeakPolarHBondContact O-CB 3.47Å; Q58-S62 PolarHBondContact O-N 3.46Å
59	A	74.9	Confident	77.3	Confident	54 Å²	54	115 Å²	115	45%	0.446	54%	0.544	S	S	.	.	H	α-helix	trans	-66.1	-42.1	175.3	0	0	0	0	0	112.2	L55 L56 E57 K63	L55-A59 WeakPolarHBondContact O-CB 3.15Å; L55-A59 PolarHBondContact O-N 2.87Å; L55-A59 VanDerWaalsContact O-N 3.14Å; L56-A59 PolarHBondContact O-N 3Å; E57-A59 VanDerWaalsContact C-N 3.31Å; E57-A59 PolarHBondContact O-N 3.48Å; A59-K63 WeakPolarHBondContact O-CB 3.27Å; A59-K63 PolarHBondContact O-N 3.02Å; A59-K63 VanDerWaalsContact O-N 3.09Å
60	E	79.5	Confident	77.9	Confident	109 Å²	109	119.8 Å²	119.8	51%	0.509	56%	0.556	S	S	.	*	H	α-helix	trans	-62.4	-44.3	174.2	-79.8	-161	-172	0	0	112.2	L56 E57 K63 R64	L56-E60 PolarHBondContact O-N 3.39Å; E57-E60 PolarHBondContact O-N 2.98Å; E60-K63 PolarHBondContact O-N 2.96Å; E60-R64 WeakPolarHBondContact O-CG 3.23Å; E60-R64 PolarHBondContact O-N 3.15Å; E60-R64 IonicContact OE2-CZ 2.73Å; E60-R64 IonicContact OE2-NH2 3.97Å; E60-R64 PolarHBondContact OE2-NH2 3.48Å
61	R	79.5	Confident	78.5	Confident	169 Å²	169	120.8 Å²	120.8	64%	0.638	55%	0.551	S	S	*	*	H	α-helix	trans	-61.2	-47.9	178.1	-174.3	176.7	177	166.3	3.8	111.5	E57 Q58 K63 R64 E65	E57-R61 WeakPolarHBondContact O-CB 3.49Å; E57-R61 PolarHBondContact O-N 3.3Å; Q58-R61 PolarHBondContact O-N 2.73Å; R61-K63 PolarHBondContact O-N 3.13Å; R61-R64 PolarHBondContact O-N 3.39Å; R61-E65 IonicContact NE-OE1 2.67Å; R61-E65 PolarHBondContact NE-OE1 3.27Å; R61-E65 WeakPolarHBondContact O-CG 3.38Å; R61-E65 PolarHBondContact O-N 3.04Å
62	S	75.3	Confident	79.2	Confident	70 Å²	70	119.6 Å²	119.6	49%	0.49	55%	0.55	S	S	.	.	H	α-helix	trans	-58.2	-38.1	176.2	-175.5	0	0	0	0	112	Q58 E65 E66	Q58-S62 WeakPolarHBondContact O-CB 3.47Å; Q58-S62 PolarHBondContact O-N 3.46Å; S62-E65 PolarHBondContact O-N 2.97Å; S62-E66 PolarHBondContact O-N 2.95Å
63	K	79.3	Confident	79.7	Confident	150 Å²	150	121.9 Å²	121.9	65%	0.652	56%	0.564	S	S	*	*	H	α-helix	trans	-68.8	-43.5	178.5	-166.8	-177.4	178.1	-170.3	0	112	A59 E60 R61 E65 E66 E67	A59-K63 WeakPolarHBondContact O-CB 3.27Å; A59-K63 PolarHBondContact O-N 3.02Å; A59-K63 VanDerWaalsContact O-N 3.09Å; E60-K63 PolarHBondContact O-N 2.96Å; R61-K63 PolarHBondContact O-N 3.13Å; K63-E65 VanDerWaalsContact C-N 3.32Å; K63-E65 PolarHBondContact O-N 3.31Å; K63-E66 PolarHBondContact O-N 3.35Å; K63-E67 WeakPolarHBondContact O-CB 3.32Å; K63-E67 PolarHBondContact O-N 3.45Å
64	R	82.3	Confident	80.2	Confident	156 Å²	156	120.6 Å²	120.6	59%	0.589	56%	0.556	S	S	*	*	H	α-helix	trans	-62.3	-39.2	174.7	-69.6	179.3	-166.6	166.4	9.8	111.6	E60 R61 K68	E60-R64 WeakPolarHBondContact O-CG 3.23Å; E60-R64 PolarHBondContact O-N 3.15Å; E60-R64 IonicContact OE2-CZ 2.73Å; E60-R64 IonicContact OE2-NH2 3.97Å; E60-R64 PolarHBondContact OE2-NH2 3.48Å; R61-R64 PolarHBondContact O-N 3.39Å; R64-K68 WeakPolarHBondContact O-CG 3.44Å; R64-K68 PolarHBondContact O-N 3.18Å
65	E	82.5	Confident	80.5	Confident	84 Å²	84	117 Å²	117	39%	0.393	55%	0.547	S	S	.	.	H	α-helix	trans	-67.6	-41.5	177	-73	177.1	-169.5	0	0	112.4	R61 S62 K63 R69	R61-E65 IonicContact NE-OE1 2.67Å; R61-E65 PolarHBondContact NE-OE1 3.27Å; R61-E65 WeakPolarHBondContact O-CG 3.38Å; R61-E65 PolarHBondContact O-N 3.04Å; S62-E65 PolarHBondContact O-N 2.97Å; K63-E65 VanDerWaalsContact C-N 3.32Å; K63-E65 PolarHBondContact O-N 3.31Å; E65-R69 WeakPolarHBondContact O-CB 3.48Å; E65-R69 WeakPolarHBondContact O-CG 3.36Å; E65-R69 PolarHBondContact O-N 2.89Å
66	E	76.8	Confident	80.8	Confident	96 Å²	96	118 Å²	118	45%	0.449	55%	0.55	S	S	.	.	H	α-helix	trans	-65.1	-40.1	175.7	-163.6	-171.2	160.7	0	0	111.8	S62 K63 R69 R70	S62-E66 PolarHBondContact O-N 2.95Å; K63-E66 PolarHBondContact O-N 3.35Å; E66-R69 PolarHBondContact O-N 2.96Å; E66-R70 WeakPolarHBondContact O-CG 3.39Å; E66-R70 PolarHBondContact O-N 3.24Å; E66-R70 IonicContact OE1-CZ 3.67Å; E66-R70 IonicContact OE1-NE 2.86Å; E66-R70 PolarHBondContact OE1-NE 3.02Å; E66-R70 IonicContact OE1-NH2 3.88Å; E66-R70 PolarHBondContact OE1-NH2 3.01Å
67	E	81.8	Confident	81	Confident	120 Å²	120	117.6 Å²	117.6	56%	0.561	55%	0.547	S	S	*	.	H	α-helix	trans	-63.6	-48.5	176.9	-171.9	164.9	-152.8	0	0	111.7	K63 R69 R70 E71	K63-E67 WeakPolarHBondContact O-CB 3.32Å; K63-E67 PolarHBondContact O-N 3.45Å; E67-R69 VanDerWaalsContact C-N 3.33Å; E67-R69 PolarHBondContact O-N 2.88Å; E67-R70 WeakPolarHBondContact O-CB 3.33Å; E67-R70 PolarHBondContact O-N 3.29Å; E67-R70 VanDerWaalsContact O-N 3.11Å; E67-E71 PolarHBondContact O-N 3.38Å
68	K	86.8	Confident	80.9	Confident	138 Å²	138	120.3 Å²	120.3	60%	0.6	55%	0.552	S	S	*	*	H	α-helix	trans	-56.7	-44	173.2	-74.5	179.2	179.9	-176.1	0	112	R64 R70 E71 I72	R64-K68 WeakPolarHBondContact O-CG 3.44Å; R64-K68 PolarHBondContact O-N 3.18Å; K68-R70 VanDerWaalsContact C-N 3.34Å; K68-R70 PolarHBondContact O-N 3.31Å; K68-E71 PolarHBondContact O-N 2.96Å; K68-I72 VanDerWaalsContact O-CG1 3.29Å; K68-I72 WeakPolarHBondContact O-CG1 3.47Å; K68-I72 PolarHBondContact O-N 3.17Å
69	R	79.3	Confident	80.8	Confident	186 Å²	186	121.7 Å²	121.7	70%	0.702	56%	0.556	S	S	*	*	H	α-helix	trans	-60.7	-41.9	176	-77.6	178	-179.3	-170	2.6	112	E65 E66 E67 I72 L73	E65-R69 WeakPolarHBondContact O-CB 3.48Å; E65-R69 WeakPolarHBondContact O-CG 3.36Å; E65-R69 PolarHBondContact O-N 2.89Å; E66-R69 PolarHBondContact O-N 2.96Å; E67-R69 VanDerWaalsContact C-N 3.33Å; E67-R69 PolarHBondContact O-N 2.88Å; R69-I72 PolarHBondContact O-N 3.49Å; R69-L73 WeakPolarHBondContact O-CB 3.42Å; R69-L73 PolarHBondContact O-N 3.39Å
70	R	78.8	Confident	80.6	Confident	144 Å²	144	124.6 Å²	124.6	54%	0.543	56%	0.56	S	S	.	*	H	α-helix	trans	-66.2	-37.5	177.2	-75.6	179.4	-179	-163.4	4.5	112.3	E66 E67 K68 K74	E66-R70 WeakPolarHBondContact O-CG 3.39Å; E66-R70 PolarHBondContact O-N 3.24Å; E66-R70 IonicContact OE1-CZ 3.67Å; E66-R70 IonicContact OE1-NE 2.86Å; E66-R70 PolarHBondContact OE1-NE 3.02Å; E66-R70 IonicContact OE1-NH2 3.88Å; E66-R70 PolarHBondContact OE1-NH2 3.01Å; E67-R70 WeakPolarHBondContact O-CB 3.33Å; E67-R70 PolarHBondContact O-N 3.29Å; E67-R70 VanDerWaalsContact O-N 3.11Å; K68-R70 VanDerWaalsContact C-N 3.34Å; K68-R70 PolarHBondContact O-N 3.31Å; R70-K74 WeakPolarHBondContact O-CB 3.46Å; R70-K74 WeakPolarHBondContact O-CG 3.35Å; R70-K74 PolarHBondContact O-N 3.37Å
71	E	85.6	Confident	80	Confident	128 Å²	128	126.5 Å²	126.5	60%	0.598	57%	0.567	S	S	*	*	H	α-helix	trans	-66	-45.3	175	-74	-168.9	146.4	0	0	112.2	E67 K68 L73 K74 A75	E67-E71 PolarHBondContact O-N 3.38Å; K68-E71 PolarHBondContact O-N 2.96Å; E71-L73 VanDerWaalsContact C-N 3.33Å; E71-L73 PolarHBondContact O-N 2.96Å; E71-K74 PolarHBondContact O-N 2.83Å; E71-A75 WeakPolarHBondContact O-CB 3.21Å; E71-A75 PolarHBondContact O-N 3.44Å
72	I	88.3	Confident	79.3	Confident	103 Å²	103	124.9 Å²	124.9	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-58	-46.6	175.4	-67.6	165.1	0	0	0	110.6	K68 R69 K74 A75 Q76	K68-I72 VanDerWaalsContact O-CG1 3.29Å; K68-I72 WeakPolarHBondContact O-CG1 3.47Å; K68-I72 PolarHBondContact O-N 3.17Å; R69-I72 PolarHBondContact O-N 3.49Å; I72-K74 PolarHBondContact O-N 2.97Å; I72-A75 PolarHBondContact O-N 3.48Å; I72-Q76 PolarHBondContact O-N 3.2Å
73	L	82.3	Confident	78.6	Confident	102 Å²	102	125.2 Å²	125.2	53%	0.534	57%	0.568	S	S	.	*	H	α-helix	trans	-61.8	-43.3	177.9	-167.5	84.8	0	0	0	111.8	R69 E71 A75 Q76 L77	R69-L73 WeakPolarHBondContact O-CB 3.42Å; R69-L73 PolarHBondContact O-N 3.39Å; E71-L73 VanDerWaalsContact C-N 3.33Å; E71-L73 PolarHBondContact O-N 2.96Å; L73-A75 VanDerWaalsContact C-N 3.34Å; L73-A75 PolarHBondContact O-N 2.72Å; L73-Q76 PolarHBondContact O-N 3.27Å; L73-L77 HydrophobicContact CG-CD1 4.37Å; L73-L77 WeakPolarHBondContact O-CG 3.25Å; L73-L77 PolarHBondContact O-N 2.96Å
74	K	84.9	Confident	77.5	Confident	140 Å²	140	124.6 Å²	124.6	61%	0.609	57%	0.568	S	S	*	*	H	α-helix	trans	-64.7	-37.7	176.4	-78.2	177.1	-178.9	174.4	0	112	R70 E71 I72 R78	R70-K74 WeakPolarHBondContact O-CB 3.46Å; R70-K74 WeakPolarHBondContact O-CG 3.35Å; R70-K74 PolarHBondContact O-N 3.37Å; E71-K74 PolarHBondContact O-N 2.83Å; I72-K74 PolarHBondContact O-N 2.97Å; K74-R78 WeakPolarHBondContact O-CB 3.23Å; K74-R78 WeakPolarHBondContact O-CG 3.29Å; K74-R78 PolarHBondContact O-N 3.28Å
75	A	83.4	Confident	76.4	Confident	50 Å²	50	125 Å²	125	41%	0.413	57%	0.574	S	S	.	*	H	α-helix	trans	-66.1	-41.7	175.9	0	0	0	0	0	111.6	E71 I72 L73 R78 K79	E71-A75 WeakPolarHBondContact O-CB 3.21Å; E71-A75 PolarHBondContact O-N 3.44Å; I72-A75 PolarHBondContact O-N 3.48Å; L73-A75 VanDerWaalsContact C-N 3.34Å; L73-A75 PolarHBondContact O-N 2.72Å; A75-R78 PolarHBondContact O-N 3.36Å; A75-K79 PolarHBondContact O-N 2.75Å
76	Q	81.5	Confident	76	Confident	110 Å²	110	126.1 Å²	126.1	51%	0.514	58%	0.582	S	S	.	*	H	α-helix	trans	-61	-49.3	173	-77.1	178.6	-23.3	0	0	111.8	I72 L73 R78 K79 E80	I72-Q76 PolarHBondContact O-N 3.2Å; L73-Q76 PolarHBondContact O-N 3.27Å; Q76-R78 PolarHBondContact O-N 3.37Å; Q76-K79 WeakPolarHBondContact O-CB 3.39Å; Q76-K79 PolarHBondContact O-N 2.97Å; Q76-E80 PolarHBondContact O-N 2.96Å
77	L	79.3	Confident	75.9	Confident	84 Å²	84	128 Å²	128	44%	0.44	60%	0.595	S	S	.	*	H	α-helix	trans	-61.4	-32.2	177.1	-71.3	169.4	0	0	0	112.7	L73 K81	L73-L77 HydrophobicContact CG-CD1 4.37Å; L73-L77 WeakPolarHBondContact O-CG 3.25Å; L73-L77 PolarHBondContact O-N 2.96Å; L77-K81 WeakPolarHBondContact O-CB 3.46Å; L77-K81 WeakPolarHBondContact O-CG 3.34Å; L77-K81 PolarHBondContact O-N 2.79Å
78	R	77.4	Confident	75.8	Confident	199 Å²	199	130 Å²	130	75%	0.751	60%	0.604	S	S	*	*	H	α-helix	trans	-69.2	-41.2	172.7	-81.7	-178.9	173.8	-179.1	-1.5	111.8	K74 A75 Q76 K81 H82	K74-R78 WeakPolarHBondContact O-CB 3.23Å; K74-R78 WeakPolarHBondContact O-CG 3.29Å; K74-R78 PolarHBondContact O-N 3.28Å; A75-R78 PolarHBondContact O-N 3.36Å; Q76-R78 PolarHBondContact O-N 3.37Å; R78-K81 PolarHBondContact O-N 3.41Å; R78-H82 WeakPolarHBondContact O-CB 3.5Å; R78-H82 PolarHBondContact O-N 2.78Å
79	K	76.9	Confident	75.2	Confident	163 Å²	163	126 Å²	126	71%	0.709	60%	0.597	S	S	*	*	H	α-helix	trans	-62.4	-45.4	174.5	-73.6	-175.9	177.5	-173.8	0	111.5	A75 Q76 K81 H82 S83	A75-K79 PolarHBondContact O-N 2.75Å; Q76-K79 WeakPolarHBondContact O-CB 3.39Å; Q76-K79 PolarHBondContact O-N 2.97Å; K79-K81 PolarHBondContact O-N 2.71Å; K79-H82 PolarHBondContact O-N 2.8Å; K79-H82 VanDerWaalsContact O-N 3.08Å; K79-S83 PolarHBondContact O-N 2.83Å; K79-S83 PolarHBondContact O-OG 3.33Å
80	E	70.2	Confident	75	Confident	116 Å²	116	121.6 Å²	121.6	54%	0.542	59%	0.587	S	S	.	*	H	α-helix	trans	-61.4	-41	175.7	-71.7	-178.1	168.4	0	0	112.7	Q76 H82 S83 Q84	Q76-E80 PolarHBondContact O-N 2.96Å; E80-H82 VanDerWaalsContact C-N 3.28Å; E80-H82 PolarHBondContact O-N 2.94Å; E80-S83 PolarHBondContact O-OG 3.29Å; E80-Q84 WeakPolarHBondContact O-CG 3.48Å; E80-Q84 PolarHBondContact O-N 2.78Å
81	K	68.1	Low	75.1	Confident	148 Å²	148	118 Å²	118	64%	0.643	58%	0.581	S	S	*	*	H	α-helix	trans	-67	-30.8	174.2	-77.7	-176.8	178.8	-172.7	0	112.7	L77 R78 K79	L77-K81 WeakPolarHBondContact O-CB 3.46Å; L77-K81 WeakPolarHBondContact O-CG 3.34Å; L77-K81 PolarHBondContact O-N 2.79Å; R78-K81 PolarHBondContact O-N 3.41Å; K79-K81 PolarHBondContact O-N 2.71Å
82	H	64.1	Low	75	Confident	136 Å²	136	113.4 Å²	113.4	63%	0.63	57%	0.568	S	S	*	*	H	α-helix	trans	-76.7	-37.9	178.8	-151	0.3	0	0	0	111.7	R78 K79 E80 Q84 K85	R78-H82 WeakPolarHBondContact O-CB 3.5Å; R78-H82 PolarHBondContact O-N 2.78Å; K79-H82 PolarHBondContact O-N 2.8Å; K79-H82 VanDerWaalsContact O-N 3.08Å; E80-H82 VanDerWaalsContact C-N 3.28Å; E80-H82 PolarHBondContact O-N 2.94Å; H82-Q84 VanDerWaalsContact C-N 3.26Å; H82-Q84 PolarHBondContact O-N 3.43Å; H82-K85 WeakPolarHBondContact O-CB 3.28Å; H82-K85 PolarHBondContact O-N 2.94Å
83	S	60.9	Low	74.5	Confident	77 Å²	77	111 Å²	111	54%	0.538	56%	0.56	S	S	.	*	H	α-helix	trans	-67.4	-24.7	174.5	67.1	0	0	0	0	113.1	K79 E80 K85	K79-S83 PolarHBondContact O-N 2.83Å; K79-S83 PolarHBondContact O-OG 3.33Å; E80-S83 PolarHBondContact O-OG 3.29Å; S83-K85 PolarHBondContact O-N 3.19Å
84	Q	55.3	Low	74.4	Confident	136 Å²	136	107.9 Å²	107.9	64%	0.636	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-9.7	173.1	-80.7	-177.4	-3.7	0	0	114.7	E80 H82 D86	E80-Q84 WeakPolarHBondContact O-CG 3.48Å; E80-Q84 PolarHBondContact O-N 2.78Å; H82-Q84 VanDerWaalsContact C-N 3.26Å; H82-Q84 PolarHBondContact O-N 3.43Å; Q84-D86 VanDerWaalsContact C-N 3.34Å
85	K	60.8	Low	74.5	Confident	164 Å²	164	107.5 Å²	107.5	71%	0.713	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-11.5	178.9	-69.1	-171.3	178.6	-177.3	0	113.8	H82 S83 L87	H82-K85 WeakPolarHBondContact O-CB 3.28Å; H82-K85 PolarHBondContact O-N 2.94Å; S83-K85 PolarHBondContact O-N 3.19Å; K85-L87 PolarHBondContact O-N 2.93Å
86	D	73.4	Confident	74.3	Confident	108 Å²	108	108.4 Å²	108.4	58%	0.578	55%	0.553	S	S	*	*			trans	-75.1	113.2	175.2	-131.7	-15.7	0	0	0	108.8	Q84 E88 A89 L90	Q84-D86 VanDerWaalsContact C-N 3.34Å; D86-E88 PolarHBondContact O-N 3.39Å; D86-A89 HydrophobicContact CB-CB 4.01Å; D86-A89 PolarHBondContact O-N 3.46Å; D86-A89 VanDerWaalsContact O-N 3.15Å; D86-L90 PolarHBondContact O-N 3.2Å; D86-L90 VanDerWaalsContact O-N 3.09Å
87	L	74.5	Confident	74.2	Confident	136 Å²	136	110.3 Å²	110.3	71%	0.712	56%	0.555	S	S	*	*	H	α-helix	trans	-57.3	-37.2	-175.3	-169.1	76	0	0	0	110.6	K85 L90 V91	K85-L87 PolarHBondContact O-N 2.93Å; L87-L90 PolarHBondContact O-N 3.04Å; L87-V91 WeakPolarHBondContact O-CG2 3.31Å; L87-V91 PolarHBondContact O-N 3.25Å
88	E	78.9	Confident	74.4	Confident	161 Å²	161	111.2 Å²	111.2	75%	0.752	56%	0.557	S	S	*	*	H	α-helix	trans	-66	-43.2	179.3	-165.7	166.1	-163.4	0	0	112.2	D86 L90 V91 G92	D86-E88 PolarHBondContact O-N 3.39Å; E88-L90 VanDerWaalsContact C-N 3.28Å; E88-L90 PolarHBondContact O-N 3.08Å; E88-V91 PolarHBondContact O-N 2.75Å; E88-G92 PolarHBondContact O-N 3.3Å
89	A	74.7	Confident	74.7	Confident	55 Å²	55	108.6 Å²	108.6	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-35	174.1	0	0	0	0	0	111.9	D86 S93	D86-A89 HydrophobicContact CB-CB 4.01Å; D86-A89 PolarHBondContact O-N 3.46Å; D86-A89 VanDerWaalsContact O-N 3.15Å; A89-S93 VanDerWaalsContact O-CB 3.23Å; A89-S93 WeakPolarHBondContact O-CB 3.48Å; A89-S93 PolarHBondContact O-N 2.84Å
90	L	74.8	Confident	74.6	Confident	94 Å²	94	109.3 Å²	109.3	49%	0.492	55%	0.549	S	S	.	.	H	α-helix	trans	-70.1	-42.6	177.7	-165.5	144.5	0	0	0	111.8	D86 L87 E88 S93 A94	D86-L90 PolarHBondContact O-N 3.2Å; D86-L90 VanDerWaalsContact O-N 3.09Å; L87-L90 PolarHBondContact O-N 3.04Å; E88-L90 VanDerWaalsContact C-N 3.28Å; E88-L90 PolarHBondContact O-N 3.08Å; L90-S93 PolarHBondContact O-N 2.95Å; L90-A94 WeakPolarHBondContact O-CB 3.25Å; L90-A94 PolarHBondContact O-N 3.45Å
91	V	82.5	Confident	74.9	Confident	68 Å²	68	108.9 Å²	108.9	41%	0.412	55%	0.546	S	S	.	.	H	α-helix	trans	-64.7	-47.5	174.6	173.3	0	0	0	0	110.6	L87 E88 S93 A94 Q95	L87-V91 WeakPolarHBondContact O-CG2 3.31Å; L87-V91 PolarHBondContact O-N 3.25Å; E88-V91 PolarHBondContact O-N 2.75Å; V91-S93 VanDerWaalsContact C-N 3.31Å; V91-S93 PolarHBondContact O-N 3.11Å; V91-A94 WeakPolarHBondContact O-CB 3.46Å; V91-A94 PolarHBondContact O-N 3.36Å; V91-A94 VanDerWaalsContact O-N 3.09Å; V91-Q95 HydrophobicContact CG1-CG 4.4Å; V91-Q95 WeakPolarHBondContact O-CG 3.1Å; V91-Q95 PolarHBondContact O-N 3.37Å
92	G	82.1	Confident	75.5	Confident	31 Å²	31	105.2 Å²	105.2	32%	0.32	53%	0.533	S	S	.	.	H	α-helix	trans	-60.7	-39	177	0	0	0	0	0	112.7	E88 S96	E88-G92 PolarHBondContact O-N 3.3Å; G92-S96 WeakPolarHBondContact O-CB 3.36Å; G92-S96 PolarHBondContact O-N 3.14Å; G92-S96 PolarHBondContact O-OG 2.99Å
93	S	78.2	Confident	76.1	Confident	53 Å²	53	102 Å²	102	37%	0.371	52%	0.521	S	S	.	.	H	α-helix	trans	-65.7	-41	172.8	-173.7	0	0	0	0	112.2	A89 L90 V91 S96 R97	A89-S93 VanDerWaalsContact O-CB 3.23Å; A89-S93 WeakPolarHBondContact O-CB 3.48Å; A89-S93 PolarHBondContact O-N 2.84Å; L90-S93 PolarHBondContact O-N 2.95Å; V91-S93 VanDerWaalsContact C-N 3.31Å; V91-S93 PolarHBondContact O-N 3.11Å; S93-S96 PolarHBondContact O-N 2.95Å; S93-R97 WeakPolarHBondContact O-CG 3.4Å; S93-R97 PolarHBondContact O-N 3.31Å
94	A	80.8	Confident	76.5	Confident	37 Å²	37	102.6 Å²	102.6	31%	0.306	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-47.2	177.2	0	0	0	0	0	111.9	L90 V91 S96 R97 Q98	L90-A94 WeakPolarHBondContact O-CB 3.25Å; L90-A94 PolarHBondContact O-N 3.45Å; V91-A94 WeakPolarHBondContact O-CB 3.46Å; V91-A94 PolarHBondContact O-N 3.36Å; V91-A94 VanDerWaalsContact O-N 3.09Å; A94-S96 PolarHBondContact O-N 3.28Å; A94-R97 PolarHBondContact O-N 3.43Å; A94-Q98 PolarHBondContact O-N 2.83Å
95	Q	86.5	Confident	77.2	Confident	132 Å²	132	102.8 Å²	102.8	62%	0.617	52%	0.518	S	S	*	.	H	α-helix	trans	-61.6	-42.2	176.2	-71.9	176.8	-22.2	0	0	111.9	V91 R97 Q98 K99	V91-Q95 HydrophobicContact CG1-CG 4.4Å; V91-Q95 WeakPolarHBondContact O-CG 3.1Å; V91-Q95 PolarHBondContact O-N 3.37Å; Q95-R97 VanDerWaalsContact C-N 3.3Å; Q95-R97 PolarHBondContact O-N 3.26Å; Q95-Q98 PolarHBondContact O-N 3.34Å; Q95-K99 PolarHBondContact O-N 3.33Å
96	S	79.2	Confident	77.4	Confident	69 Å²	69	103 Å²	103	48%	0.483	52%	0.522	S	S	.	.	H	α-helix	trans	-62.7	-36.1	175.8	-62.7	0	0	0	0	112.6	G92 S93 A94 R100	G92-S96 WeakPolarHBondContact O-CB 3.36Å; G92-S96 PolarHBondContact O-N 3.14Å; G92-S96 PolarHBondContact O-OG 2.99Å; S93-S96 PolarHBondContact O-N 2.95Å; A94-S96 PolarHBondContact O-N 3.28Å; S96-R100 WeakPolarHBondContact O-CB 3.36Å; S96-R100 VanDerWaalsContact O-CG 3.28Å; S96-R100 WeakPolarHBondContact O-CG 3.49Å; S96-R100 PolarHBondContact O-N 3.14Å
97	R	80.4	Confident	76.7	Confident	150 Å²	150	101.6 Å²	101.6	57%	0.566	51%	0.511	S	S	*	.	H	α-helix	trans	-71.1	-38	174.2	-74	-174.3	-59.5	-129	-0.5	112.2	S93 A94 Q95 F101	S93-R97 WeakPolarHBondContact O-CG 3.4Å; S93-R97 PolarHBondContact O-N 3.31Å; A94-R97 PolarHBondContact O-N 3.43Å; Q95-R97 VanDerWaalsContact C-N 3.3Å; Q95-R97 PolarHBondContact O-N 3.26Å; R97-F101 WeakPolarHBondContact O-CB 3.46Å; R97-F101 PolarHBondContact O-N 2.99Å
98	Q	81.7	Confident	75.8	Confident	103 Å²	103	98.1 Å²	98.1	48%	0.481	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-50.6	177	-172	61.3	39.7	0	0	110.6	A94 Q95 R100 F101 D102	A94-Q98 PolarHBondContact O-N 2.83Å; Q95-Q98 PolarHBondContact O-N 3.34Å; Q98-R100 VanDerWaalsContact C-N 3.32Å; Q98-R100 PolarHBondContact O-N 3.46Å; Q98-F101 WeakPolarHBondContact O-CA 3.39Å; Q98-F101 WeakPolarHBondContact O-CB 3.36Å; Q98-F101 PolarHBondContact O-N 3.24Å; Q98-D102 PolarHBondContact NE2-OD1 2.77Å; Q98-D102 VanDerWaalsContact O-CG 3.31Å; Q98-D102 PolarHBondContact O-N 2.85Å
99	K	83.5	Confident	74.7	Confident	143 Å²	143	93.6 Å²	93.6	62%	0.622	49%	0.488	S	S	*	.	H	α-helix	trans	-56.4	-45.7	176.9	-172.3	176.8	179.8	179.1	0	112.1	Q95 F101 D102 D103	Q95-K99 PolarHBondContact O-N 3.33Å; K99-F101 VanDerWaalsContact C-N 3.27Å; K99-F101 PolarHBondContact O-N 3.43Å; K99-D102 PolarHBondContact O-N 2.84Å; K99-D103 PolarHBondContact O-N 2.82Å
100	R	75.7	Confident	73.2	Confident	178 Å²	178	96.1 Å²	96.1	67%	0.672	49%	0.494	S	S	*	.	H	α-helix	trans	-59.6	-36.7	174.5	-77.2	177.5	-177.8	-170.6	2	112.9	S96 Q98 L104	S96-R100 WeakPolarHBondContact O-CB 3.36Å; S96-R100 VanDerWaalsContact O-CG 3.28Å; S96-R100 WeakPolarHBondContact O-CG 3.49Å; S96-R100 PolarHBondContact O-N 3.14Å; Q98-R100 VanDerWaalsContact C-N 3.32Å; Q98-R100 PolarHBondContact O-N 3.46Å; R100-L104 WeakPolarHBondContact O-CB 3.37Å; R100-L104 WeakPolarHBondContact O-CD1 3.14Å; R100-L104 WeakPolarHBondContact O-CG 3.37Å; R100-L104 PolarHBondContact O-N 2.8Å; R100-L104 VanDerWaalsContact O-N 3.11Å
101	F	76.9	Confident	72	Confident	108 Å²	108	95.5 Å²	95.5	47%	0.474	49%	0.491	S	S	.	.	H	α-helix	trans	-70	-41.6	178.4	179.1	-98.5	0	0	0	111.5	R97 Q98 K99 L104 Q105	R97-F101 WeakPolarHBondContact O-CB 3.46Å; R97-F101 PolarHBondContact O-N 2.99Å; Q98-F101 WeakPolarHBondContact O-CA 3.39Å; Q98-F101 WeakPolarHBondContact O-CB 3.36Å; Q98-F101 PolarHBondContact O-N 3.24Å; K99-F101 VanDerWaalsContact C-N 3.27Å; K99-F101 PolarHBondContact O-N 3.43Å; F101-L104 PolarHBondContact O-N 3Å; F101-Q105 HydrophobicContact CE1-CG 4.17Å; F101-Q105 HydrophobicContact CZ-CG 4.34Å; F101-Q105 PolarHBondContact O-N 3.41Å
102	D	80.1	Confident	70.6	Confident	70 Å²	70	95 Å²	95	37%	0.374	49%	0.486	S	S	.	.	H	α-helix	trans	-66.1	-41.9	177.2	-58.1	-27	0	0	0	110.9	Q98 K99 L104 Q105 Q106	Q98-D102 PolarHBondContact NE2-OD1 2.77Å; Q98-D102 VanDerWaalsContact O-CG 3.31Å; Q98-D102 PolarHBondContact O-N 2.85Å; K99-D102 PolarHBondContact O-N 2.84Å; D102-L104 VanDerWaalsContact C-N 3.29Å; D102-L104 PolarHBondContact O-N 3.43Å; D102-Q105 PolarHBondContact O-N 2.82Å; D102-Q105 VanDerWaalsContact O-N 3.1Å; D102-Q106 PolarHBondContact O-N 3.06Å; D102-Q106 VanDerWaalsContact O-N 3.17Å
103	D	77	Confident	69	Low	70 Å²	70	96 Å²	96	37%	0.374	48%	0.483	S	S	.	.	H	α-helix	trans	-60.1	-37.5	173.2	-65.8	-19.7	0	0	0	112	K99 Q105 K107	K99-D103 PolarHBondContact O-N 2.82Å; D103-Q105 VanDerWaalsContact C-N 3.35Å; D103-K107 WeakPolarHBondContact O-CG 3.3Å; D103-K107 PolarHBondContact O-N 3.03Å
104	L	69	Low	67.5	Low	88 Å²	88	98.3 Å²	98.3	46%	0.461	49%	0.491	S	S	.	.	H	α-helix	trans	-71.1	-28.4	176.6	-75	164.5	0	0	0	112.3	R100 F101 D102 L112	R100-L104 WeakPolarHBondContact O-CB 3.37Å; R100-L104 WeakPolarHBondContact O-CD1 3.14Å; R100-L104 WeakPolarHBondContact O-CG 3.37Å; R100-L104 PolarHBondContact O-N 2.8Å; R100-L104 VanDerWaalsContact O-N 3.11Å; F101-L104 PolarHBondContact O-N 3Å; D102-L104 VanDerWaalsContact C-N 3.29Å; D102-L104 PolarHBondContact O-N 3.43Å; L104-L112 HydrophobicContact CB-CD2 4.36Å; L104-L112 HydrophobicContact CD2-CD2 3.27Å; L104-L112 HydrophobicContact CG-CD2 4.39Å
105	Q	70.2	Confident	66	Low	140 Å²	140	99.9 Å²	99.9	65%	0.654	49%	0.491	S	S	*	.	H	α-helix	trans	-76.1	-31.4	176.6	-74.7	-138.5	25.2	0	0	113.1	F101 D102 D103 K107	F101-Q105 HydrophobicContact CE1-CG 4.17Å; F101-Q105 HydrophobicContact CZ-CG 4.34Å; F101-Q105 PolarHBondContact O-N 3.41Å; D102-Q105 PolarHBondContact O-N 2.82Å; D102-Q105 VanDerWaalsContact O-N 3.1Å; D103-Q105 VanDerWaalsContact C-N 3.35Å; Q105-K107 VanDerWaalsContact C-N 3.32Å
106	Q	66.1	Low	64.2	Low	170 Å²	170	95.3 Å²	95.3	79%	0.794	47%	0.474	S	S	*	.	H	α-helix	trans	-75.1	-23.1	178.3	-70	-177.1	1.4	0	0	113	D102	D102-Q106 PolarHBondContact O-N 3.06Å; D102-Q106 VanDerWaalsContact O-N 3.17Å
107	K	56.9	Low	62.6	Low	77 Å²	77	94 Å²	94	34%	0.335	46%	0.462	S	S	.	.	S	Bend	trans	-74.2	135.1	177.9	-74.5	174.6	179.7	178.9	0	110.9	D103 Q105 D111 L112 E115	D103-K107 WeakPolarHBondContact O-CG 3.3Å; D103-K107 PolarHBondContact O-N 3.03Å; Q105-K107 VanDerWaalsContact C-N 3.32Å; K107-D111 HydrophobicContact CB-CB 4.21Å; K107-L112 HydrophobicContact CB-CD2 3.78Å; K107-L112 HydrophobicContact CB-CG 3.81Å; K107-L112 HydrophobicContact CD-CD2 3.92Å; K107-L112 HydrophobicContact CG-CD2 4.48Å; K107-E115 IonicContact NZ-OE1 3.79Å; K107-E115 IonicContact NZ-OE2 3.88Å; K107-E115 PolarHBondContact NZ-OE2 2.76Å
108	S	56.9	Low	60.8	Low	63 Å²	63	89 Å²	89	44%	0.441	45%	0.45	S	S	.	.			trans	-59.6	151.5	170.9	-179.5	0	0	0	0	110.1	N110 D111 L112	S108-N110 PolarHBondContact O-N 3.47Å; S108-N110 VanDerWaalsContact O-N 3.1Å; S108-D111 WeakPolarHBondContact CB-OD2 3.3Å; S108-D111 PolarHBondContact N-OD2 3.38Å; S108-D111 PolarHBondContact O-N 3.12Å; S108-L112 PolarHBondContact O-N 2.64Å; S108-L112 VanDerWaalsContact O-N 3.09Å
109	A	55.3	Low	59.1	Low	66 Å²	66	90.3 Å²	90.3	55%	0.545	45%	0.454	S	S	.	.	H	α-helix	trans	-53.5	-33.4	176.3	0	0	0	0	0	111.9	I113	A109-I113 WeakPolarHBondContact O-CD1 3.46Å; A109-I113 WeakPolarHBondContact O-CG1 3.23Å; A109-I113 PolarHBondContact O-N 2.73Å; A109-I113 VanDerWaalsContact O-N 3.15Å
110	N	42.4	Very low	57.4	Low	108 Å²	108	86 Å²	86	58%	0.578	44%	0.44	S	S	*	.	H	α-helix	trans	-67.3	-43.3	175.4	-69.4	-12.8	0	0	0	112.1	S108 L112 I113 I114	S108-N110 PolarHBondContact O-N 3.47Å; S108-N110 VanDerWaalsContact O-N 3.1Å; N110-L112 PolarHBondContact O-N 3.3Å; N110-I113 WeakPolarHBondContact O-CB 3.34Å; N110-I113 PolarHBondContact O-N 3Å; N110-I114 VanDerWaalsContact O-CG1 3.24Å; N110-I114 WeakPolarHBondContact O-CG1 3.2Å; N110-I114 PolarHBondContact O-N 2.74Å
111	D	50.5	Low	56.1	Low	82 Å²	82	79.3 Å²	79.3	44%	0.439	42%	0.419	S	S	.	.	H	α-helix	trans	-66.1	-38.6	179.7	-60.1	-31.9	0	0	0	112	K107 S108 I113 I114 E115	K107-D111 HydrophobicContact CB-CB 4.21Å; S108-D111 WeakPolarHBondContact CB-OD2 3.3Å; S108-D111 PolarHBondContact N-OD2 3.38Å; S108-D111 PolarHBondContact O-N 3.12Å; D111-I113 VanDerWaalsContact C-N 3.33Å; D111-I114 PolarHBondContact O-N 2.86Å; D111-E115 WeakPolarHBondContact O-CB 3.16Å; D111-E115 PolarHBondContact O-N 2.84Å
112	L	53.5	Low	54.7	Low	56 Å²	56	80.4 Å²	80.4	29%	0.293	43%	0.426	S	S	.	.	H	α-helix	trans	-64.3	-38.2	174.3	-68.7	175.2	0	0	0	112.3	L104 K107 S108 N110 S116	L104-L112 HydrophobicContact CB-CD2 4.36Å; L104-L112 HydrophobicContact CD2-CD2 3.27Å; L104-L112 HydrophobicContact CG-CD2 4.39Å; K107-L112 HydrophobicContact CB-CD2 3.78Å; K107-L112 HydrophobicContact CB-CG 3.81Å; K107-L112 HydrophobicContact CD-CD2 3.92Å; K107-L112 HydrophobicContact CG-CD2 4.48Å; S108-L112 PolarHBondContact O-N 2.64Å; S108-L112 VanDerWaalsContact O-N 3.09Å; N110-L112 PolarHBondContact O-N 3.3Å; L112-S116 VanDerWaalsContact O-CB 3.24Å; L112-S116 WeakPolarHBondContact O-CB 3.47Å; L112-S116 PolarHBondContact O-N 3.17Å; L112-S116 VanDerWaalsContact O-N 3.11Å; L112-S116 PolarHBondContact O-OG 3.26Å
113	I	48.9	Very low	53.7	Low	52 Å²	52	82.9 Å²	82.9	27%	0.267	44%	0.439	S	S	.	.	H	α-helix	trans	-65.2	-52.5	174.6	-70.9	165.2	0	0	0	108.6	A109 N110 D111 E115 S116 L117 A297	A109-I113 WeakPolarHBondContact O-CD1 3.46Å; A109-I113 WeakPolarHBondContact O-CG1 3.23Å; A109-I113 PolarHBondContact O-N 2.73Å; A109-I113 VanDerWaalsContact O-N 3.15Å; N110-I113 WeakPolarHBondContact O-CB 3.34Å; N110-I113 PolarHBondContact O-N 3Å; D111-I113 VanDerWaalsContact C-N 3.33Å; I113-E115 PolarHBondContact O-N 2.93Å; I113-S116 CarbonylContact O-C 3.41Å; I113-S116 PolarHBondContact O-N 3.06Å; I113-S116 VanDerWaalsContact O-N 3.1Å; I113-S116 PolarHBondContact O-OG 3.35Å; I113-L117 HydrophobicContact CG2-CD1 3.73Å; I113-L117 HydrophobicContact CG2-CG 4.32Å; I113-L117 VanDerWaalsContact O-CG 3.24Å; I113-L117 WeakPolarHBondContact O-CG 3.47Å; I113-L117 PolarHBondContact O-N 3.3Å; I113-A297 HydrophobicContact CG2-CB 4.31Å
114	I	45.8	Very low	52.9	Low	103 Å²	103	80.7 Å²	80.7	53%	0.528	43%	0.426	S	S	.	.	H	α-helix	trans	-57.1	-48	-179.6	-67	163.5	0	0	0	111.5	N110 D111 S116 L117 S118	N110-I114 VanDerWaalsContact O-CG1 3.24Å; N110-I114 WeakPolarHBondContact O-CG1 3.2Å; N110-I114 PolarHBondContact O-N 2.74Å; D111-I114 PolarHBondContact O-N 2.86Å; I114-S116 VanDerWaalsContact C-N 3.29Å; I114-S116 PolarHBondContact O-N 3.29Å; I114-L117 CarbonylContact O-C 3.56Å; I114-L117 WeakPolarHBondContact O-CA 3.43Å; I114-L117 WeakPolarHBondContact O-CB 3.27Å; I114-L117 PolarHBondContact O-N 2.78Å; I114-S118 PolarHBondContact O-N 2.86Å
115	E	48.7	Very low	52.9	Low	69 Å²	69	77.9 Å²	77.9	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-66.7	-32.2	178.4	-168.7	-175.8	168.8	0	0	112.4	K107 D111 I113 L117 S118 K119	K107-E115 IonicContact NZ-OE1 3.79Å; K107-E115 IonicContact NZ-OE2 3.88Å; K107-E115 PolarHBondContact NZ-OE2 2.76Å; D111-E115 WeakPolarHBondContact O-CB 3.16Å; D111-E115 PolarHBondContact O-N 2.84Å; I113-E115 PolarHBondContact O-N 2.93Å; E115-L117 PolarHBondContact O-N 3.15Å; E115-S118 WeakPolarHBondContact CA-OG 3.49Å; E115-S118 PolarHBondContact O-OG 2.78Å; E115-K119 IonicContact OE1-NZ 2.78Å
116	S	48.7	Very low	52.9	Low	37 Å²	37	75.4 Å²	75.4	26%	0.259	41%	0.407	S	S	.	.	H	α-helix	trans	-74	-17.6	173.8	84.5	0	0	0	0	113.4	L112 I113 I114 P120 K310	L112-S116 VanDerWaalsContact O-CB 3.24Å; L112-S116 WeakPolarHBondContact O-CB 3.47Å; L112-S116 PolarHBondContact O-N 3.17Å; L112-S116 VanDerWaalsContact O-N 3.11Å; L112-S116 PolarHBondContact O-OG 3.26Å; I113-S116 CarbonylContact O-C 3.41Å; I113-S116 PolarHBondContact O-N 3.06Å; I113-S116 VanDerWaalsContact O-N 3.1Å; I113-S116 PolarHBondContact O-OG 3.35Å; I114-S116 VanDerWaalsContact C-N 3.29Å; I114-S116 PolarHBondContact O-N 3.29Å; S116-P120 WeakPolarHBondContact O-CD 3.32Å; S116-P120 VanDerWaalsContact O-CG 3.32Å; S116-P120 WeakPolarHBondContact O-CG 3.28Å; S116-K310 PolarHBondContact OG-NZ 2.6Å
117	L	45.7	Very low	53.2	Low	42 Å²	42	68 Å²	68	22%	0.22	38%	0.375	C	S	.	.	H	α-helix	trans	-88.5	-38.2	172.1	-65.7	170.2	0	0	0	111.4	I113 I114 E115 K119 P120 V121 L300 I306	I113-L117 HydrophobicContact CG2-CD1 3.73Å; I113-L117 HydrophobicContact CG2-CG 4.32Å; I113-L117 VanDerWaalsContact O-CG 3.24Å; I113-L117 WeakPolarHBondContact O-CG 3.47Å; I113-L117 PolarHBondContact O-N 3.3Å; I114-L117 CarbonylContact O-C 3.56Å; I114-L117 WeakPolarHBondContact O-CA 3.43Å; I114-L117 WeakPolarHBondContact O-CB 3.27Å; I114-L117 PolarHBondContact O-N 2.78Å; E115-L117 PolarHBondContact O-N 3.15Å; L117-K119 PolarHBondContact O-N 3.46Å; L117-P120 VanDerWaalsContact O-CD 3.29Å; L117-P120 WeakPolarHBondContact O-CD 3.36Å; L117-V121 VanDerWaalsContact O-CB 3.25Å; L117-V121 WeakPolarHBondContact O-CB 3.4Å; L117-V121 WeakPolarHBondContact O-CG2 3.49Å; L117-V121 PolarHBondContact O-N 3.46Å; L117-L300 HydrophobicContact CD1-CD1 4.24Å; L117-I306 HydrophobicContact CD1-CD1 4.29Å; L117-I306 HydrophobicContact CD2-CD1 3.58Å; L117-I306 HydrophobicContact CD2-CG1 3.66Å; L117-I306 HydrophobicContact CG-CD1 4.5Å
118	S	43.5	Very low	54.2	Low	44 Å²	44	64.4 Å²	64.4	31%	0.308	36%	0.36	S	S	.	.	H	α-helix	trans	-62.5	-43.6	-174.7	62.5	0	0	0	0	112.8	I114 E115 V121 E122	I114-S118 PolarHBondContact O-N 2.86Å; E115-S118 WeakPolarHBondContact CA-OG 3.49Å; E115-S118 PolarHBondContact O-OG 2.78Å; S118-V121 PolarHBondContact O-N 3.45Å; S118-E122 WeakPolarHBondContact O-CG 3.37Å; S118-E122 PolarHBondContact O-N 2.98Å
119	K	45.9	Very low	55.4	Low	130 Å²	130	67.6 Å²	67.6	57%	0.565	36%	0.362	S	S	*	.	H	α-helix	trans	-62.2	-49.9	178.9	-65.8	179.3	-173.4	173.7	0	112.8	E115 L117 D123	E115-K119 IonicContact OE1-NZ 2.78Å; L117-K119 PolarHBondContact O-N 3.46Å; K119-D123 PolarHBondContact O-N 3.46Å
120	P	48	Very low	56.7	Low	53 Å²	53	71.7 Å²	71.7	34%	0.344	36%	0.363	S	S	.	.	H	α-helix	trans	-60.8	-41	170.7	-23.7	32	0	0	0	113.7	S116 L117 D123 F124	S116-P120 WeakPolarHBondContact O-CD 3.32Å; S116-P120 VanDerWaalsContact O-CG 3.32Å; S116-P120 WeakPolarHBondContact O-CG 3.28Å; L117-P120 VanDerWaalsContact O-CD 3.29Å; L117-P120 WeakPolarHBondContact O-CD 3.36Å; P120-D123 WeakPolarHBondContact O-CB 3.48Å; P120-D123 PolarHBondContact O-N 3.44Å; P120-F124 VanDerWaalsContact C-CD2 3.44Å; P120-F124 HydrophobicContact CB-CD2 4.14Å; P120-F124 HydrophobicContact CB-CE2 3.69Å; P120-F124 WeakPolarHBondContact O-CD2 3.35Å; P120-F124 WeakPolarHBondContact O-CE2 3.4Å; P120-F124 VanDerWaalsContact O-CG 3.31Å; P120-F124 WeakPolarHBondContact O-CG 3.31Å; P120-F124 PolarHBondContact O-N 2.64Å
121	V	47.7	Very low	58.6	Low	38 Å²	38	66.6 Å²	66.6	23%	0.23	34%	0.336	C	S	.	.	H	α-helix	trans	-66.5	-39.9	-175.7	170.1	0	0	0	0	112.2	L117 S118 F124 T125	L117-V121 VanDerWaalsContact O-CB 3.25Å; L117-V121 WeakPolarHBondContact O-CB 3.4Å; L117-V121 WeakPolarHBondContact O-CG2 3.49Å; L117-V121 PolarHBondContact O-N 3.46Å; S118-V121 PolarHBondContact O-N 3.45Å; V121-F124 PolarHBondContact O-N 3.4Å; V121-T125 PolarHBondContact O-N 3.09Å; V121-T125 PolarHBondContact O-OG1 3.05Å
122	E	48.7	Very low	60.4	Low	130 Å²	130	62.9 Å²	62.9	61%	0.607	32%	0.316	S	S	*	.	H	α-helix	trans	-60.5	-47.1	172.4	-75.8	175.7	-173.7	0	0	111.1	S118 F124 T125 V126	S118-E122 WeakPolarHBondContact O-CG 3.37Å; S118-E122 PolarHBondContact O-N 2.98Å; E122-F124 VanDerWaalsContact C-N 3.3Å; E122-F124 PolarHBondContact O-N 3.01Å; E122-T125 PolarHBondContact O-N 3.43Å; E122-V126 WeakPolarHBondContact O-CG2 3.15Å; E122-V126 PolarHBondContact O-N 3.42Å
123	D	58.1	Low	62	Low	122 Å²	122	68.2 Å²	68.2	65%	0.652	34%	0.337	S	S	*	.	H	α-helix	trans	-58.8	-40.6	175.7	-76.7	-18.3	0	0	0	111.7	K119 P120 A127	K119-D123 PolarHBondContact O-N 3.46Å; P120-D123 WeakPolarHBondContact O-CB 3.48Å; P120-D123 PolarHBondContact O-N 3.44Å; D123-A127 WeakPolarHBondContact O-CB 3.47Å; D123-A127 PolarHBondContact O-N 2.85Å
124	F	61.3	Low	63.8	Low	25 Å²	25	69 Å²	69	11%	0.11	34%	0.342	C	S	.	.	H	α-helix	trans	-70.6	-40.2	178.9	-70.5	-56.6	0	0	0	112.9	P120 V121 E122 V126 A127 L128 P285 G286	P120-F124 VanDerWaalsContact C-CD2 3.44Å; P120-F124 HydrophobicContact CB-CD2 4.14Å; P120-F124 HydrophobicContact CB-CE2 3.69Å; P120-F124 WeakPolarHBondContact O-CD2 3.35Å; P120-F124 WeakPolarHBondContact O-CE2 3.4Å; P120-F124 VanDerWaalsContact O-CG 3.31Å; P120-F124 WeakPolarHBondContact O-CG 3.31Å; P120-F124 PolarHBondContact O-N 2.64Å; V121-F124 PolarHBondContact O-N 3.4Å; E122-F124 VanDerWaalsContact C-N 3.3Å; E122-F124 PolarHBondContact O-N 3.01Å; F124-V126 VanDerWaalsContact C-N 3.32Å; F124-V126 PolarHBondContact O-N 3.23Å; F124-A127 PolarHBondContact O-N 3.3Å; F124-L128 WeakPolarHBondContact O-CB 3.47Å; F124-L128 PolarHBondContact O-N 3.17Å; F124-P285 HydrophobicContact CD1-CB 4.3Å; F124-P285 HydrophobicContact CE1-CB 4.24Å; F124-G286 WeakPolarHBondContact CD1-O 3.47Å; F124-G286 WeakPolarHBondContact CE1-O 3.43Å
125	T	67.9	Low	65.9	Low	29 Å²	29	64.1 Å²	64.1	18%	0.178	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-37.9	178.7	-54	0	0	0	0	111	V121 E122 R129 M289	V121-T125 PolarHBondContact O-N 3.09Å; V121-T125 PolarHBondContact O-OG1 3.05Å; E122-T125 PolarHBondContact O-N 3.43Å; T125-R129 WeakPolarHBondContact O-CB 3.36Å; T125-R129 WeakPolarHBondContact O-CG 3.37Å; T125-R129 PolarHBondContact O-N 2.79Å; T125-R129 VanDerWaalsContact O-N 3.1Å; T125-R129 PolarHBondContact O-NE 3.35Å; T125-M289 HydrophobicContact CG2-CE 4.4Å
126	V	69.9	Low	68	Low	87 Å²	87	63.1 Å²	63.1	53%	0.527	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-43.5	172.9	173.3	0	0	0	0	110.7	E122 F124 R129 R130	E122-V126 WeakPolarHBondContact O-CG2 3.15Å; E122-V126 PolarHBondContact O-N 3.42Å; F124-V126 VanDerWaalsContact C-N 3.32Å; F124-V126 PolarHBondContact O-N 3.23Å; V126-R129 PolarHBondContact O-N 3.01Å; V126-R130 WeakPolarHBondContact O-CB 3.48Å; V126-R130 PolarHBondContact O-N 3.08Å
127	A	72	Confident	70	Confident	16 Å²	16	61.3 Å²	61.3	13%	0.132	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-44.5	176.7	0	0	0	0	0	112.4	D123 F124 R130 V131 P285	D123-A127 WeakPolarHBondContact O-CB 3.47Å; D123-A127 PolarHBondContact O-N 2.85Å; F124-A127 PolarHBondContact O-N 3.3Å; A127-R130 WeakPolarHBondContact O-CB 2.95Å; A127-R130 PolarHBondContact O-N 3.25Å; A127-V131 WeakPolarHBondContact O-CG2 3.34Å; A127-V131 PolarHBondContact O-N 2.9Å; A127-P285 HydrophobicContact CB-CG 3.89Å
128	L	77.9	Confident	72.3	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-57.5	-53.1	175.8	176.7	68.3	0	0	0	110.5	F124 R130 V131 V132 V155 M158 V249 V287 M289	F124-L128 WeakPolarHBondContact O-CB 3.47Å; F124-L128 PolarHBondContact O-N 3.17Å; L128-R130 PolarHBondContact O-N 3.28Å; L128-V131 PolarHBondContact O-N 3.4Å; L128-V132 HydrophobicContact CD1-CG2 4.12Å; L128-V132 HydrophobicContact CG-CG2 4.32Å; L128-V132 WeakPolarHBondContact O-CG2 3.44Å; L128-V132 PolarHBondContact O-N 2.73Å; L128-V155 HydrophobicContact CD1-CG1 4.06Å; L128-V155 HydrophobicContact CD2-CG1 4.47Å; L128-V155 HydrophobicContact CD2-CG2 3.92Å; L128-M158 HydrophobicContact CD2-CE 3.8Å; L128-M158 HydrophobicContact CD2-SD 3.65Å; L128-M158 HydrophobicContact CG-SD 4Å; L128-V249 HydrophobicContact CD1-CG1 3.68Å; L128-V287 HydrophobicContact CB-CG1 3.98Å; L128-V287 HydrophobicContact CB-CG2 3.86Å; L128-V287 HydrophobicContact CD1-CB 4.46Å; L128-V287 HydrophobicContact CD1-CG1 4.31Å; L128-V287 HydrophobicContact CD1-CG2 3.88Å; L128-V287 HydrophobicContact CD2-CG1 4.07Å; L128-V287 HydrophobicContact CG-CG1 4.31Å; L128-V287 HydrophobicContact CG-CG2 4.39Å; L128-M289 HydrophobicContact CD2-CE 4.01Å; L128-M289 HydrophobicContact CD2-SD 4.25Å
129	R	83.1	Confident	74.6	Confident	130 Å²	130	57.6 Å²	57.6	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-56.2	-38.3	178.4	-79.5	-176.8	-85.3	167	-12.5	112.1	T125 V126 K133 M158	T125-R129 WeakPolarHBondContact O-CB 3.36Å; T125-R129 WeakPolarHBondContact O-CG 3.37Å; T125-R129 PolarHBondContact O-N 2.79Å; T125-R129 VanDerWaalsContact O-N 3.1Å; T125-R129 PolarHBondContact O-NE 3.35Å; V126-R129 PolarHBondContact O-N 3.01Å; R129-K133 WeakPolarHBondContact O-CB 2.9Å; R129-K133 VanDerWaalsContact O-CG 3.26Å; R129-K133 WeakPolarHBondContact O-CG 3.5Å; R129-K133 PolarHBondContact O-N 2.67Å; R129-K133 VanDerWaalsContact O-N 3.08Å; R129-M158 HydrophobicContact CG-CE 4.41Å; R129-M158 HydrophobicContact CG-SD 3.89Å
130	R	81.9	Confident	76.8	Confident	151 Å²	151	51.5 Å²	51.5	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-64.7	-42.7	175.4	-176.7	176.4	178.8	174.5	0.9	112.1	V126 A127 L128 K133 L134	V126-R130 WeakPolarHBondContact O-CB 3.48Å; V126-R130 PolarHBondContact O-N 3.08Å; A127-R130 WeakPolarHBondContact O-CB 2.95Å; A127-R130 PolarHBondContact O-N 3.25Å; L128-R130 PolarHBondContact O-N 3.28Å; R130-K133 PolarHBondContact O-N 3.38Å; R130-L134 HydrophobicContact CG-CD1 3.94Å; R130-L134 VanDerWaalsContact O-CG 3.27Å; R130-L134 WeakPolarHBondContact O-CG 3.44Å; R130-L134 PolarHBondContact O-N 3.02Å; R130-L134 VanDerWaalsContact O-N 3.09Å
131	V	83.6	Confident	78.7	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-68.7	-44.8	-178.7	174.7	0	0	0	0	110.7	A127 L128 K133 L134 S135 L138 V270 I282	A127-V131 WeakPolarHBondContact O-CG2 3.34Å; A127-V131 PolarHBondContact O-N 2.9Å; L128-V131 PolarHBondContact O-N 3.4Å; V131-K133 VanDerWaalsContact C-N 3.31Å; V131-K133 PolarHBondContact O-N 2.87Å; V131-L134 PolarHBondContact O-N 3.36Å; V131-S135 VanDerWaalsContact O-CB 3.3Å; V131-S135 WeakPolarHBondContact O-CB 3.48Å; V131-S135 PolarHBondContact O-N 2.88Å; V131-S135 PolarHBondContact O-OG 3.46Å; V131-L138 HydrophobicContact CG1-CD1 4.05Å; V131-V270 HydrophobicContact CG2-CG2 4.29Å; V131-I282 HydrophobicContact CG1-CG2 4.45Å
132	V	88.5	Confident	80.7	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.03	23%	0.229	C	C	.	.	H	α-helix	trans	-58.6	-43.5	175.1	175.7	0	0	0	0	110.8	L128 L134 S135 I159 A162 K164	L128-V132 HydrophobicContact CD1-CG2 4.12Å; L128-V132 HydrophobicContact CG-CG2 4.32Å; L128-V132 WeakPolarHBondContact O-CG2 3.44Å; L128-V132 PolarHBondContact O-N 2.73Å; V132-L134 PolarHBondContact O-N 2.71Å; V132-S135 PolarHBondContact O-N 3.47Å; V132-I159 HydrophobicContact CG1-CG1 4.49Å; V132-I159 HydrophobicContact CG2-CG1 3.97Å; V132-A162 HydrophobicContact CG1-CB 3.64Å; V132-K164 HydrophobicContact CG1-CG 4.1Å; V132-K164 WeakPolarHBondContact O-CE 3.45Å
133	K	87.3	Confident	82.5	Confident	167 Å²	167	42.4 Å²	42.4	73%	0.726	20%	0.203	S	C	*	.	H	α-helix	trans	-61.9	-42	176.9	-77.8	179.8	179.1	-170.3	0	113.5	R129 R130 V131	R129-K133 WeakPolarHBondContact O-CB 2.9Å; R129-K133 VanDerWaalsContact O-CG 3.26Å; R129-K133 WeakPolarHBondContact O-CG 3.5Å; R129-K133 PolarHBondContact O-N 2.67Å; R129-K133 VanDerWaalsContact O-N 3.08Å; R130-K133 PolarHBondContact O-N 3.38Å; V131-K133 VanDerWaalsContact C-N 3.31Å; V131-K133 PolarHBondContact O-N 2.87Å
134	L	86.7	Confident	83.9	Confident	69 Å²	69	36.6 Å²	36.6	36%	0.361	17%	0.171	S	C	.	.	H	α-helix	trans	-79.8	-17.9	-176.2	-68.2	173	0	0	0	113.7	R130 V131 V132 R245 V270 I282	R130-L134 HydrophobicContact CG-CD1 3.94Å; R130-L134 VanDerWaalsContact O-CG 3.27Å; R130-L134 WeakPolarHBondContact O-CG 3.44Å; R130-L134 PolarHBondContact O-N 3.02Å; R130-L134 VanDerWaalsContact O-N 3.09Å; V131-L134 PolarHBondContact O-N 3.36Å; V132-L134 PolarHBondContact O-N 2.71Å; L134-R245 WeakPolarHBondContact O-CB 3.45Å; L134-R245 VanDerWaalsContact O-CD 3.23Å; L134-R245 WeakPolarHBondContact O-CD 3.33Å; L134-V270 HydrophobicContact CD1-CG1 4.49Å; L134-I282 HydrophobicContact CB-CD1 3.58Å; L134-I282 WeakPolarHBondContact O-CD1 3.48Å
135	S	90.2	Very high	84.9	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.168	C	C	.	.			trans	-97.1	152.4	-174.3	-51.2	0	0	0	0	111.7	V131 V132 K164 G247 I282	V131-S135 VanDerWaalsContact O-CB 3.3Å; V131-S135 WeakPolarHBondContact O-CB 3.48Å; V131-S135 PolarHBondContact O-N 2.88Å; V131-S135 PolarHBondContact O-OG 3.46Å; V132-S135 PolarHBondContact O-N 3.47Å; S135-K164 VanDerWaalsContact O-CD 3.23Å; S135-K164 WeakPolarHBondContact O-CD 3.44Å; S135-K164 WeakPolarHBondContact O-CE 3.21Å; S135-K164 PolarHBondContact O-NZ 3.18Å; S135-G247 WeakPolarHBondContact OG-CA 3.33Å; S135-G247 PolarHBondContact OG-N 3Å; S135-G247 VanDerWaalsContact OG-N 3.15Å; S135-I282 WeakPolarHBondContact OG-CD1 3.46Å
136	D	91	Very high	85.5	Confident	48 Å²	48	36.9 Å²	36.9	26%	0.257	17%	0.172	S	C	.	.	S	Bend	trans	-94.2	-39.7	168.3	-57.9	-60.9	0	0	0	110.5	R165 I244 R245	D136-R165 PolarHBondContact O-N 2.78Å; D136-I244 WeakPolarHBondContact OD2-CA 3.47Å; D136-R245 PolarHBondContact N-O 3.02Å; D136-R245 PolarHBondContact OD2-N 2.9Å
137	I	92.4	Very high	86.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140	178	-49.5	173.7	0	0	0	108.5	R165 V167 L231 Y234 I244 R245 I246 G247 F405	I137-R165 CarbonylContact C-O 3.47Å; I137-R165 WeakPolarHBondContact CA-O 3.41Å; I137-R165 HydrophobicContact CG1-CB 4.31Å; I137-R165 HydrophobicContact CG2-CB 4.33Å; I137-V167 HydrophobicContact CG2-CG2 3.87Å; I137-L231 HydrophobicContact CD1-CD2 3.71Å; I137-L231 HydrophobicContact CG2-CD2 4.23Å; I137-Y234 HydrophobicContact CD1-CD1 3.36Å; I137-Y234 HydrophobicContact CD1-CD2 4.45Å; I137-Y234 HydrophobicContact CD1-CE1 3.53Å; I137-Y234 HydrophobicContact CD1-CG 3.84Å; I137-Y234 HydrophobicContact CG1-CD1 4.15Å; I137-Y234 HydrophobicContact CG1-CE1 3.8Å; I137-I244 HydrophobicContact CD1-CD1 3.85Å; I137-R245 PolarHBondContact N-O 3.38Å; I137-I246 CarbonylContact O-C 3.6Å; I137-I246 VanDerWaalsContact O-CA 3.27Å; I137-I246 WeakPolarHBondContact O-CA 3.42Å; I137-G247 PolarHBondContact O-N 3.32Å; I137-F405 HydrophobicContact CD1-CE1 4.43Å
138	L	92	Very high	87.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.2	174	-73.9	-58.7	0	0	0	109	V131 I159 K164 R165 L166 V167 G247 V249	V131-L138 HydrophobicContact CG1-CD1 4.05Å; L138-I159 HydrophobicContact CB-CD1 3.74Å; L138-I159 HydrophobicContact CB-CG1 4.37Å; L138-I159 HydrophobicContact CB-CG2 4.3Å; L138-I159 HydrophobicContact CD2-CG1 4.46Å; L138-I159 HydrophobicContact CD2-CG2 4.13Å; L138-I159 HydrophobicContact CG-CD1 3.81Å; L138-I159 HydrophobicContact CG-CG1 3.98Å; L138-I159 HydrophobicContact CG-CG2 4.28Å; L138-K164 HydrophobicContact CD2-CB 3.84Å; L138-K164 HydrophobicContact CD2-CG 4.29Å; L138-R165 PolarHBondContact N-O 2.73Å; L138-L166 HydrophobicContact CB-CD1 4.3Å; L138-L166 CarbonylContact O-C 3.55Å; L138-L166 WeakPolarHBondContact O-CA 3.33Å; L138-V167 PolarHBondContact O-N 3.07Å; L138-G247 CarbonylContact C-O 3.52Å; L138-G247 VanDerWaalsContact CA-O 3.3Å; L138-G247 WeakPolarHBondContact CA-O 3.29Å; L138-V249 HydrophobicContact CB-CG2 4.43Å; L138-V249 HydrophobicContact CD1-CG1 4.08Å
139	L	92.8	Very high	87.1	Confident	8 Å²	8	36.1 Å²	36.1	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	114.4	171.2	-56	-176.1	0	0	0	108.9	I141 V167 V169 L227 L231 I246 G247 I248 V249	L139-I141 HydrophobicContact CB-CD1 4.29Å; L139-V167 CarbonylContact C-O 3.53Å; L139-V167 VanDerWaalsContact CA-O 3.3Å; L139-V167 WeakPolarHBondContact CA-O 3.32Å; L139-V167 HydrophobicContact CD2-CB 3.74Å; L139-V167 HydrophobicContact CD2-CG1 4.13Å; L139-V167 HydrophobicContact CD2-CG2 4.47Å; L139-V169 HydrophobicContact CB-CG2 4.09Å; L139-V169 HydrophobicContact CD1-CG2 4.41Å; L139-V169 HydrophobicContact CD2-CG2 4.29Å; L139-V169 HydrophobicContact CG-CG2 4.48Å; L139-L227 HydrophobicContact CD1-CD1 4.42Å; L139-L227 HydrophobicContact CD1-CD2 3.98Å; L139-L227 HydrophobicContact CD2-CD1 4.1Å; L139-L231 HydrophobicContact CD2-CD2 4.38Å; L139-I246 HydrophobicContact CD1-CG2 3.66Å; L139-I246 HydrophobicContact CD2-CG2 4.14Å; L139-I246 HydrophobicContact CG-CG2 3.49Å; L139-I246 VanDerWaalsContact CG-CG2 3.49Å; L139-G247 PolarHBondContact N-O 3.3Å; L139-I248 HydrophobicContact CB-CG1 4.43Å; L139-I248 HydrophobicContact CD1-CG1 4.47Å; L139-V249 PolarHBondContact O-N 2.87Å
140	E	91.3	Very high	87	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.009	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	116.4	171	-173.8	170.2	-168.3	0	0	110.4	L142 R151 S152 E156 L166 V167 L168 V169 V249	E140-L142 HydrophobicContact CG-CD2 3.93Å; E140-L142 PolarHBondContact O-N 2.74Å; E140-R151 WeakPolarHBondContact OE1-CA 3.44Å; E140-S152 PolarHBondContact OE1-N 2.82Å; E140-E156 WeakPolarHBondContact OE2-CG 3.16Å; E140-L166 HydrophobicContact CB-CD1 3.86Å; E140-V167 PolarHBondContact N-O 3.43Å; E140-L168 HydrophobicContact CB-CD2 3.96Å; E140-V169 PolarHBondContact O-N 3Å; E140-V249 WeakPolarHBondContact CA-O 3.47Å; E140-V249 HydrophobicContact CB-CG2 3.87Å; E140-V249 HydrophobicContact CG-CG2 4.27Å
141	I	89.3	Confident	87.1	Confident	19 Å²	19	25.6 Å²	25.6	10%	0.097	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115	-177.9	-48	-54.1	0	0	0	110.1	L139 V169 N171 I248 V249 L252	L139-I141 HydrophobicContact CB-CD1 4.29Å; I141-V169 HydrophobicContact CD1-CB 3.73Å; I141-V169 HydrophobicContact CD1-CG1 4.1Å; I141-V169 HydrophobicContact CD1-CG2 4.1Å; I141-N171 HydrophobicContact CG2-CB 3.85Å; I141-I248 HydrophobicContact CD1-CG2 4.01Å; I141-I248 HydrophobicContact CG1-CG2 3.58Å; I141-V249 PolarHBondContact N-O 3.13Å; I141-L252 HydrophobicContact CG2-CB 4.07Å; I141-L252 HydrophobicContact CG2-CD2 3.88Å
142	L	89.3	Confident	87	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	151.1	177.8	-50.6	-178.5	0	0	0	111	E140 P147 R151 L168 V169 N171 L188	E140-L142 HydrophobicContact CG-CD2 3.93Å; E140-L142 PolarHBondContact O-N 2.74Å; L142-P147 HydrophobicContact CD1-CB 4.21Å; L142-R151 HydrophobicContact CD1-CG 4.16Å; L142-R151 HydrophobicContact CD2-CB 4.48Å; L142-R151 HydrophobicContact CD2-CG 3.61Å; L142-L168 HydrophobicContact CD1-CB 4.12Å; L142-L168 HydrophobicContact CD1-CD1 4.25Å; L142-L168 HydrophobicContact CD1-CD2 4.38Å; L142-L168 HydrophobicContact CD1-CG 4.48Å; L142-V169 PolarHBondContact N-O 3.36Å; L142-N171 WeakPolarHBondContact O-CB 3.23Å; L142-N171 PolarHBondContact O-N 2.81Å; L142-L188 HydrophobicContact CD1-CD1 4.04Å; L142-L188 HydrophobicContact CD1-CD2 4.36Å
143	D	85.4	Confident	86.8	Confident	11 Å²	11	29.2 Å²	29.2	6%	0.059	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123	166.4	-168.9	-43	0	0	0	108.9	R145 D146 P147 S150 P374	D143-R145 PolarHBondContact O-N 3.37Å; D143-R145 WeakPolarHBondContact OD1-CB 3.11Å; D143-R145 IonicContact OD1-CZ 3.44Å; D143-R145 PolarHBondContact OD1-N 3.23Å; D143-R145 VanDerWaalsContact OD1-N 3.08Å; D143-R145 IonicContact OD1-NE 2.77Å; D143-R145 PolarHBondContact OD1-NE 2.83Å; D143-R145 IonicContact OD1-NH2 3.67Å; D143-R145 IonicContact OD2-CZ 2.73Å; D143-R145 IonicContact OD2-NE 3.74Å; D143-R145 IonicContact OD2-NH2 2.79Å; D143-R145 PolarHBondContact OD2-NH2 3.46Å; D143-D146 CarbonylContact O-C 3.57Å; D143-D146 PolarHBondContact O-N 2.73Å; D143-D146 VanDerWaalsContact O-N 3.07Å; D143-P147 VanDerWaalsContact O-N 3.15Å; D143-S150 PolarHBondContact N-OG 3.1Å; D143-P374 WeakPolarHBondContact OD2-CB 3.31Å; D143-P374 VanDerWaalsContact OD2-CG 3.3Å; D143-P374 WeakPolarHBondContact OD2-CG 3.15Å
144	A	88.7	Confident	86.5	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.4	-176.8	0	0	0	0	0	114.3	M170 N171 I173 I176	A144-M170 HydrophobicContact CB-CG 3.63Å; A144-M170 HydrophobicContact CB-SD 4.14Å; A144-N171 VanDerWaalsContact CB-O 3.25Å; A144-N171 WeakPolarHBondContact CB-O 3.41Å; A144-N171 PolarHBondContact N-O 3.1Å; A144-I173 HydrophobicContact CB-CG2 4.19Å; A144-I176 HydrophobicContact CB-CD1 3.89Å; A144-I176 HydrophobicContact CB-CG1 4Å; A144-I176 WeakPolarHBondContact O-CD1 3.33Å
145	R	83	Confident	86.4	Confident	12 Å²	12	22.9 Å²	22.9	5%	0.045	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-29.1	178.4	-62.6	172.4	-62.2	137.5	29.9	113	D143 L175 I176 P374 Y381 Y382 C383	D143-R145 PolarHBondContact O-N 3.37Å; D143-R145 WeakPolarHBondContact OD1-CB 3.11Å; D143-R145 IonicContact OD1-CZ 3.44Å; D143-R145 PolarHBondContact OD1-N 3.23Å; D143-R145 VanDerWaalsContact OD1-N 3.08Å; D143-R145 IonicContact OD1-NE 2.77Å; D143-R145 PolarHBondContact OD1-NE 2.83Å; D143-R145 IonicContact OD1-NH2 3.67Å; D143-R145 IonicContact OD2-CZ 2.73Å; D143-R145 IonicContact OD2-NE 3.74Å; D143-R145 IonicContact OD2-NH2 2.79Å; D143-R145 PolarHBondContact OD2-NH2 3.46Å; R145-L175 HydrophobicContact CG-CB 3.93Å; R145-L175 HydrophobicContact CG-CD1 4.35Å; R145-I176 HydrophobicContact CB-CG2 4.28Å; R145-I176 HydrophobicContact CG-CG2 3.64Å; R145-P374 VanDerWaalsContact CZ-CB 3.42Å; R145-Y381 HydrophobicContact CB-CE2 4.25Å; R145-Y381 WeakPolarHBondContact CB-O 3.45Å; R145-Y381 WeakPolarHBondContact CD-O 3.41Å; R145-Y381 VanDerWaalsContact CG-O 3.27Å; R145-Y381 WeakPolarHBondContact CG-O 3.4Å; R145-Y381 PolarHBondContact NH1-OH 3.01Å; R145-Y381 PolarHBondContact NH2-OH 3.22Å; R145-Y382 CarbonylContact O-C 3.55Å; R145-Y382 WeakPolarHBondContact O-CA 3.46Å; R145-C383 PolarHBondContact O-N 2.95Å
146	D	80.5	Confident	86.4	Confident	47 Å²	47	23.2 Å²	23.2	25%	0.251	13%	0.134	S	C	.	.			trans	-149.6	77.6	177.4	177.8	15.4	0	0	0	109.1	D143 G149 S150	D143-D146 CarbonylContact O-C 3.57Å; D143-D146 PolarHBondContact O-N 2.73Å; D143-D146 VanDerWaalsContact O-N 3.07Å; D146-G149 WeakPolarHBondContact OD1-CA 3.33Å; D146-G149 PolarHBondContact OD1-N 2.87Å; D146-G149 WeakPolarHBondContact OD2-CA 3.22Å; D146-S150 WeakPolarHBondContact O-CB 3.34Å; D146-S150 PolarHBondContact O-N 3.24Å; D146-S150 PolarHBondContact O-OG 2.93Å
147	P	90	Very high	86.3	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.8	-43.7	-178.7	-27.1	38.4	0	0	0	112.4	L142 D143 S150 R151 M170 W184 L188	L142-P147 HydrophobicContact CD1-CB 4.21Å; D143-P147 VanDerWaalsContact O-N 3.15Å; P147-S150 WeakPolarHBondContact O-CB 3.46Å; P147-S150 PolarHBondContact O-N 3.49Å; P147-R151 WeakPolarHBondContact O-CG 2.99Å; P147-R151 PolarHBondContact O-N 3.23Å; P147-M170 HydrophobicContact CG-SD 3.96Å; P147-W184 HydrophobicContact CB-CD2 4.3Å; P147-W184 HydrophobicContact CB-CE3 4.02Å; P147-W184 HydrophobicContact CB-CZ3 4.2Å; P147-W184 HydrophobicContact CG-CD2 3.62Å; P147-W184 HydrophobicContact CG-CE3 3.87Å; P147-W184 HydrophobicContact CG-CG 3.98Å; P147-W184 HydrophobicContact CG-CH2 4.49Å; P147-W184 HydrophobicContact CG-CZ2 4.26Å; P147-W184 HydrophobicContact CG-CZ3 4.31Å; P147-L188 HydrophobicContact CB-CD1 4.23Å
148	L	86.1	Confident	86	Confident	61 Å²	61	27 Å²	27	32%	0.319	15%	0.154	S	C	.	.	H	α-helix	trans	-65.7	-44	-179.4	-68.9	-179.9	0	0	0	112.3	S150 R151 W184 Y187 P386	L148-S150 PolarHBondContact O-N 3.42Å; L148-R151 PolarHBondContact O-N 3.07Å; L148-W184 HydrophobicContact CD1-CH2 3.91Å; L148-W184 HydrophobicContact CD1-CZ3 4.12Å; L148-W184 HydrophobicContact CD2-CZ3 4.42Å; L148-W184 HydrophobicContact CG-CH2 3.78Å; L148-W184 HydrophobicContact CG-CZ3 3.76Å; L148-Y187 HydrophobicContact CD2-CE1 4.05Å; L148-P386 HydrophobicContact CD1-CG 4.05Å
149	G	77.1	Confident	86	Confident	27 Å²	27	27 Å²	27	28%	0.278	15%	0.154	S	C	.	.	H	α-helix	trans	-69.2	-11.3	176.9	0	0	0	0	0	114.4	D146	D146-G149 WeakPolarHBondContact OD1-CA 3.33Å; D146-G149 PolarHBondContact OD1-N 2.87Å; D146-G149 WeakPolarHBondContact OD2-CA 3.22Å
150	S	80.6	Confident	85.8	Confident	18 Å²	18	29.2 Å²	29.2	13%	0.126	17%	0.166	C	C	.	.	H	α-helix	trans	-92.9	-17.8	174.7	-59	0	0	0	0	114.1	D143 D146 P147 L148 N251	D143-S150 PolarHBondContact N-OG 3.1Å; D146-S150 WeakPolarHBondContact O-CB 3.34Å; D146-S150 PolarHBondContact O-N 3.24Å; D146-S150 PolarHBondContact O-OG 2.93Å; P147-S150 WeakPolarHBondContact O-CB 3.46Å; P147-S150 PolarHBondContact O-N 3.49Å; L148-S150 PolarHBondContact O-N 3.42Å; S150-N251 PolarHBondContact O-ND2 2.83Å
151	R	83.8	Confident	85.8	Confident	42 Å²	42	37 Å²	37	16%	0.158	20%	0.202	C	C	.	.			trans	-73.8	157.9	-178.8	-76.8	177.8	71	-177.2	-0.7	112.6	E140 L142 P147 L148 E156 E191	E140-R151 WeakPolarHBondContact OE1-CA 3.44Å; L142-R151 HydrophobicContact CD1-CG 4.16Å; L142-R151 HydrophobicContact CD2-CB 4.48Å; L142-R151 HydrophobicContact CD2-CG 3.61Å; P147-R151 WeakPolarHBondContact O-CG 2.99Å; P147-R151 PolarHBondContact O-N 3.23Å; L148-R151 PolarHBondContact O-N 3.07Å; R151-E156 IonicContact CZ-OE1 3.9Å; R151-E156 IonicContact CZ-OE2 2.82Å; R151-E156 IonicContact NE-OE1 3.65Å; R151-E156 PolarHBondContact NE-OE1 3.45Å; R151-E156 IonicContact NE-OE2 3.72Å; R151-E156 IonicContact NH2-OE1 3.3Å; R151-E156 PolarHBondContact NH2-OE1 2.83Å; R151-E156 IonicContact NH2-OE2 2.84Å; R151-E156 PolarHBondContact NH2-OE2 3.01Å; R151-E191 IonicContact CZ-OE1 3.75Å; R151-E191 IonicContact CZ-OE2 3.55Å; R151-E191 VanDerWaalsContact NH1-CD 3.31Å; R151-E191 IonicContact NH1-OE1 3.57Å; R151-E191 PolarHBondContact NH1-OE1 3.08Å; R151-E191 IonicContact NH1-OE2 3.69Å; R151-E191 PolarHBondContact NH1-OE2 3.38Å; R151-E191 IonicContact NH2-OE1 2.8Å; R151-E191 IonicContact NH2-OE2 2.75Å; R151-E191 PolarHBondContact NH2-OE2 3.19Å
152	S	81.4	Confident	85.8	Confident	20 Å²	20	38.3 Å²	38.3	14%	0.14	22%	0.216	C	C	.	.			trans	-134.8	97.8	172	-172.2	0	0	0	0	112.1	E140 Q154 V155 E156	E140-S152 PolarHBondContact OE1-N 2.82Å; S152-Q154 PolarHBondContact O-N 3.41Å; S152-V155 WeakPolarHBondContact O-CA 3.26Å; S152-V155 WeakPolarHBondContact O-CB 3.24Å; S152-V155 PolarHBondContact O-N 3.29Å; S152-V155 WeakPolarHBondContact OG-CG2 3.45Å; S152-E156 WeakPolarHBondContact O-CG 3.5Å; S152-E156 PolarHBondContact O-N 3Å
153	A	83.7	Confident	85.9	Confident	63 Å²	63	40.7 Å²	40.7	52%	0.521	24%	0.24	S	C	.	.	H	α-helix	trans	-52.1	-34.1	177.8	0	0	0	0	0	113.7	E156 N157	A153-E156 PolarHBondContact O-N 3.41Å; A153-N157 WeakPolarHBondContact O-CB 3.28Å; A153-N157 PolarHBondContact O-N 3.43Å; A153-N157 PolarHBondContact O-ND2 2.73Å; A153-N157 PolarHBondContact O-OD1 3.14Å
154	Q	81.8	Confident	86.1	Confident	95 Å²	95	42.1 Å²	42.1	44%	0.444	25%	0.246	S	C	.	.	H	α-helix	trans	-67.4	-38.8	176.4	-175.1	-179.8	-3.6	0	0	112.6	S152 M158 M289	S152-Q154 PolarHBondContact O-N 3.41Å; Q154-M158 WeakPolarHBondContact O-CB 3.3Å; Q154-M158 PolarHBondContact O-N 3.37Å; Q154-M158 VanDerWaalsContact O-N 3.13Å; Q154-M289 HydrophobicContact CG-CE 4.28Å
155	V	84.7	Confident	86.3	Confident	8 Å²	8	44.5 Å²	44.5	5%	0.048	26%	0.255	C	S	.	.	H	α-helix	trans	-69.3	-44.4	176.1	175.4	0	0	0	0	109.7	L128 S152 M158 I159 V249 M289	L128-V155 HydrophobicContact CD1-CG1 4.06Å; L128-V155 HydrophobicContact CD2-CG1 4.47Å; L128-V155 HydrophobicContact CD2-CG2 3.92Å; S152-V155 WeakPolarHBondContact O-CA 3.26Å; S152-V155 WeakPolarHBondContact O-CB 3.24Å; S152-V155 PolarHBondContact O-N 3.29Å; S152-V155 WeakPolarHBondContact OG-CG2 3.45Å; V155-M158 PolarHBondContact O-N 3.26Å; V155-I159 HydrophobicContact CG1-CD1 3.71Å; V155-I159 HydrophobicContact CG1-CG1 4.45Å; V155-I159 WeakPolarHBondContact O-CD1 3.47Å; V155-I159 WeakPolarHBondContact O-CG1 3.47Å; V155-I159 PolarHBondContact O-N 3.37Å; V155-V249 HydrophobicContact CG1-CB 4.29Å; V155-V249 HydrophobicContact CG1-CG1 4.49Å; V155-V249 HydrophobicContact CG1-CG2 4.15Å; V155-M289 HydrophobicContact CG2-CG 3.62Å
156	E	89.9	Confident	86.8	Confident	6 Å²	6	44 Å²	44	3%	0.028	25%	0.253	C	S	.	.	H	α-helix	trans	-58.1	-50.4	177.3	-62.7	176.7	-159.8	0	0	111.3	E140 R151 S152 A153 M158 I159 L160 L166 Y192	E140-E156 WeakPolarHBondContact OE2-CG 3.16Å; R151-E156 IonicContact CZ-OE1 3.9Å; R151-E156 IonicContact CZ-OE2 2.82Å; R151-E156 IonicContact NE-OE1 3.65Å; R151-E156 PolarHBondContact NE-OE1 3.45Å; R151-E156 IonicContact NE-OE2 3.72Å; R151-E156 IonicContact NH2-OE1 3.3Å; R151-E156 PolarHBondContact NH2-OE1 2.83Å; R151-E156 IonicContact NH2-OE2 2.84Å; R151-E156 PolarHBondContact NH2-OE2 3.01Å; S152-E156 WeakPolarHBondContact O-CG 3.5Å; S152-E156 PolarHBondContact O-N 3Å; A153-E156 PolarHBondContact O-N 3.41Å; E156-M158 PolarHBondContact O-N 3.43Å; E156-I159 WeakPolarHBondContact O-CB 3.44Å; E156-I159 PolarHBondContact O-N 3.35Å; E156-I159 VanDerWaalsContact O-N 3.12Å; E156-L160 WeakPolarHBondContact O-CG 3.41Å; E156-L160 PolarHBondContact O-N 3.49Å; E156-L166 HydrophobicContact CB-CD2 4.14Å; E156-L166 HydrophobicContact CG-CD2 3.72Å; E156-Y192 WeakPolarHBondContact OE2-CE2 3.48Å
157	N	88.4	Confident	87.5	Confident	86 Å²	86	41.7 Å²	41.7	46%	0.46	24%	0.241	S	C	.	.	H	α-helix	trans	-58.8	-44.2	176.7	-71.2	-11.2	0	0	0	112.1	A153 I159 L160 E161	A153-N157 WeakPolarHBondContact O-CB 3.28Å; A153-N157 PolarHBondContact O-N 3.43Å; A153-N157 PolarHBondContact O-ND2 2.73Å; A153-N157 PolarHBondContact O-OD1 3.14Å; N157-I159 VanDerWaalsContact C-N 3.27Å; N157-I159 PolarHBondContact O-N 2.91Å; N157-L160 PolarHBondContact O-N 3.46Å; N157-E161 WeakPolarHBondContact O-CB 3.45Å; N157-E161 WeakPolarHBondContact O-CG 3.23Å; N157-E161 PolarHBondContact O-N 3.06Å
158	M	86.7	Confident	87.7	Confident	41 Å²	41	41.7 Å²	41.7	20%	0.202	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-36.3	177.5	-176.5	-173.9	-58.4	0	0	112.5	L128 R129 Q154 V155 E156 A162 M289	L128-M158 HydrophobicContact CD2-CE 3.8Å; L128-M158 HydrophobicContact CD2-SD 3.65Å; L128-M158 HydrophobicContact CG-SD 4Å; R129-M158 HydrophobicContact CG-CE 4.41Å; R129-M158 HydrophobicContact CG-SD 3.89Å; Q154-M158 WeakPolarHBondContact O-CB 3.3Å; Q154-M158 PolarHBondContact O-N 3.37Å; Q154-M158 VanDerWaalsContact O-N 3.13Å; V155-M158 PolarHBondContact O-N 3.26Å; E156-M158 PolarHBondContact O-N 3.43Å; M158-A162 VanDerWaalsContact O-CB 3.32Å; M158-A162 WeakPolarHBondContact O-CB 3.26Å; M158-A162 PolarHBondContact O-N 3.37Å; M158-M289 HydrophobicContact CE-CE 4.37Å
159	I	90.6	Very high	88.1	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69.3	-44.4	178.3	-69.7	166.2	0	0	0	110.2	V132 L138 V155 E156 N157 A162 G163 K164 L166 V249	V132-I159 HydrophobicContact CG1-CG1 4.49Å; V132-I159 HydrophobicContact CG2-CG1 3.97Å; L138-I159 HydrophobicContact CB-CD1 3.74Å; L138-I159 HydrophobicContact CB-CG1 4.37Å; L138-I159 HydrophobicContact CB-CG2 4.3Å; L138-I159 HydrophobicContact CD2-CG1 4.46Å; L138-I159 HydrophobicContact CD2-CG2 4.13Å; L138-I159 HydrophobicContact CG-CD1 3.81Å; L138-I159 HydrophobicContact CG-CG1 3.98Å; L138-I159 HydrophobicContact CG-CG2 4.28Å; V155-I159 HydrophobicContact CG1-CD1 3.71Å; V155-I159 HydrophobicContact CG1-CG1 4.45Å; V155-I159 WeakPolarHBondContact O-CD1 3.47Å; V155-I159 WeakPolarHBondContact O-CG1 3.47Å; V155-I159 PolarHBondContact O-N 3.37Å; E156-I159 WeakPolarHBondContact O-CB 3.44Å; E156-I159 PolarHBondContact O-N 3.35Å; E156-I159 VanDerWaalsContact O-N 3.12Å; N157-I159 VanDerWaalsContact C-N 3.27Å; N157-I159 PolarHBondContact O-N 2.91Å; I159-A162 PolarHBondContact O-N 2.98Å; I159-G163 PolarHBondContact O-N 3.39Å; I159-K164 HydrophobicContact CG2-CB 3.86Å; I159-K164 PolarHBondContact O-N 2.88Å; I159-L166 HydrophobicContact CD1-CD1 4Å; I159-L166 HydrophobicContact CG2-CB 4.21Å; I159-V249 HydrophobicContact CD1-CG2 4.2Å
160	L	90.1	Very high	88.9	Confident	56 Å²	56	37.7 Å²	37.7	29%	0.293	21%	0.214	S	C	.	.	H	α-helix	trans	-65	-46.3	178.1	-68.8	-179.6	0	0	0	112.3	E156 N157 A162 G163 Y192 M401	E156-L160 WeakPolarHBondContact O-CG 3.41Å; E156-L160 PolarHBondContact O-N 3.49Å; N157-L160 PolarHBondContact O-N 3.46Å; L160-A162 PolarHBondContact O-N 3.27Å; L160-G163 WeakPolarHBondContact O-CA 3.08Å; L160-G163 PolarHBondContact O-N 3.34Å; L160-Y192 HydrophobicContact CD1-CE1 4.28Å; L160-Y192 WeakPolarHBondContact CD1-OH 3.15Å; L160-Y192 HydrophobicContact CD2-CE1 4.26Å; L160-M401 HydrophobicContact CD2-CE 3.52Å; L160-M401 HydrophobicContact CD2-SD 3.93Å
161	E	89.9	Confident	89.4	Confident	164 Å²	164	37.6 Å²	37.6	77%	0.766	21%	0.211	S	C	*	.	H	α-helix	trans	-60	-32.6	175.7	-74.5	174	-174.3	0	0	112.3	N157 G163	N157-E161 WeakPolarHBondContact O-CB 3.45Å; N157-E161 WeakPolarHBondContact O-CG 3.23Å; N157-E161 PolarHBondContact O-N 3.06Å; E161-G163 PolarHBondContact O-N 3.16Å
162	A	90.8	Very high	89.4	Confident	48 Å²	48	37.1 Å²	37.1	40%	0.397	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	3.2	175	0	0	0	0	0	113.7	V132 M158 I159 L160 K164	V132-A162 HydrophobicContact CG1-CB 3.64Å; M158-A162 VanDerWaalsContact O-CB 3.32Å; M158-A162 WeakPolarHBondContact O-CB 3.26Å; M158-A162 PolarHBondContact O-N 3.37Å; I159-A162 PolarHBondContact O-N 2.98Å; L160-A162 PolarHBondContact O-N 3.27Å; A162-K164 HydrophobicContact CB-CG 3.92Å; A162-K164 PolarHBondContact O-N 2.95Å
163	G	89.9	Confident	89.7	Confident	49 Å²	49	36.2 Å²	36.2	51%	0.505	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	21.4	-178.4	0	0	0	0	0	113.6	I159 L160 E161	I159-G163 PolarHBondContact O-N 3.39Å; L160-G163 WeakPolarHBondContact O-CA 3.08Å; L160-G163 PolarHBondContact O-N 3.34Å; E161-G163 PolarHBondContact O-N 3.16Å
164	K	91.2	Very high	89.7	Confident	41 Å²	41	35.3 Å²	35.3	18%	0.178	19%	0.19	C	C	.	.			trans	-91.7	163.4	-179.5	-54.3	-53.1	-173.6	157.9	0	110.4	V132 S135 L138 I159 A162	V132-K164 HydrophobicContact CG1-CG 4.1Å; V132-K164 WeakPolarHBondContact O-CE 3.45Å; S135-K164 VanDerWaalsContact O-CD 3.23Å; S135-K164 WeakPolarHBondContact O-CD 3.44Å; S135-K164 WeakPolarHBondContact O-CE 3.21Å; S135-K164 PolarHBondContact O-NZ 3.18Å; L138-K164 HydrophobicContact CD2-CB 3.84Å; L138-K164 HydrophobicContact CD2-CG 4.29Å; I159-K164 HydrophobicContact CG2-CB 3.86Å; I159-K164 PolarHBondContact O-N 2.88Å; A162-K164 HydrophobicContact CB-CG 3.92Å; A162-K164 PolarHBondContact O-N 2.95Å
165	R	92.2	Very high	89.6	Confident	50 Å²	50	33.4 Å²	33.4	19%	0.189	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	146.1	175.8	-58.1	-50	-178.3	-140	8.5	111.2	D136 I137 L138 Y234 E404 F405	D136-R165 PolarHBondContact O-N 2.78Å; I137-R165 CarbonylContact C-O 3.47Å; I137-R165 WeakPolarHBondContact CA-O 3.41Å; I137-R165 HydrophobicContact CG1-CB 4.31Å; I137-R165 HydrophobicContact CG2-CB 4.33Å; L138-R165 PolarHBondContact N-O 2.73Å; R165-Y234 HydrophobicContact CG-CE2 3.7Å; R165-E404 WeakPolarHBondContact CD-OE2 3.41Å; R165-E404 IonicContact CZ-OE1 3.26Å; R165-E404 IonicContact CZ-OE2 3.8Å; R165-E404 IonicContact NE-OE1 3.74Å; R165-E404 PolarHBondContact NE-OE1 2.9Å; R165-E404 IonicContact NE-OE2 3.84Å; R165-E404 PolarHBondContact NE-OE2 3.16Å; R165-E404 IonicContact NH2-OE1 2.73Å; R165-E404 PolarHBondContact NH2-OE1 3.22Å; R165-E404 IonicContact NH2-OE2 2.82Å; R165-F405 HydrophobicContact CB-CE2 4.22Å; R165-F405 HydrophobicContact CB-CZ 3.99Å; R165-F405 HydrophobicContact CG-CE2 4.43Å; R165-F405 HydrophobicContact CG-CZ 4.45Å
166	L	93.5	Very high	89.6	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	134.5	177.7	-179.7	62.6	0	0	0	109.1	L138 E140 E156 I159 L168 Y192 P193	L138-L166 HydrophobicContact CB-CD1 4.3Å; L138-L166 CarbonylContact O-C 3.55Å; L138-L166 WeakPolarHBondContact O-CA 3.33Å; E140-L166 HydrophobicContact CB-CD1 3.86Å; E156-L166 HydrophobicContact CB-CD2 4.14Å; E156-L166 HydrophobicContact CG-CD2 3.72Å; I159-L166 HydrophobicContact CD1-CD1 4Å; I159-L166 HydrophobicContact CG2-CB 4.21Å; L166-L168 HydrophobicContact CD2-CD2 4.17Å; L166-L168 HydrophobicContact CG-CD2 4.25Å; L166-Y192 HydrophobicContact CB-CD1 4.09Å; L166-Y192 HydrophobicContact CB-CE1 4.36Å; L166-Y192 HydrophobicContact CD2-CD1 3.92Å; L166-Y192 HydrophobicContact CD2-CD2 4.03Å; L166-Y192 HydrophobicContact CD2-CE1 3.87Å; L166-Y192 HydrophobicContact CD2-CE2 3.97Å; L166-Y192 HydrophobicContact CD2-CG 4Å; L166-Y192 HydrophobicContact CG-CD1 4.29Å; L166-Y192 HydrophobicContact CG-CG 4.41Å; L166-P193 WeakPolarHBondContact O-CD 3.46Å
167	V	94.4	Very high	89.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.4	170	176.8	0	0	0	0	108	I137 L138 L139 E140 P193 L227 L230 F405	I137-V167 HydrophobicContact CG2-CG2 3.87Å; L138-V167 PolarHBondContact O-N 3.07Å; L139-V167 CarbonylContact C-O 3.53Å; L139-V167 VanDerWaalsContact CA-O 3.3Å; L139-V167 WeakPolarHBondContact CA-O 3.32Å; L139-V167 HydrophobicContact CD2-CB 3.74Å; L139-V167 HydrophobicContact CD2-CG1 4.13Å; L139-V167 HydrophobicContact CD2-CG2 4.47Å; E140-V167 PolarHBondContact N-O 3.43Å; V167-P193 CarbonylContact C-O 3.51Å; V167-P193 WeakPolarHBondContact CA-O 3.48Å; V167-P193 HydrophobicContact CG1-CB 4.47Å; V167-P193 WeakPolarHBondContact CG1-O 3.33Å; V167-P193 HydrophobicContact CG2-CB 4.33Å; V167-L227 HydrophobicContact CG1-CD1 4.44Å; V167-L230 HydrophobicContact CG1-CD2 4.13Å; V167-F405 HydrophobicContact CG2-CD1 4.25Å; V167-F405 HydrophobicContact CG2-CE1 3.55Å; V167-F405 HydrophobicContact CG2-CE2 4.48Å; V167-F405 HydrophobicContact CG2-CZ 3.69Å
168	L	94.9	Very high	89.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	131.5	177.4	-56.1	-179	0	0	0	110.1	E140 L142 L166 L188 Y192 P193 A194 V195	E140-L168 HydrophobicContact CB-CD2 3.96Å; L142-L168 HydrophobicContact CD1-CB 4.12Å; L142-L168 HydrophobicContact CD1-CD1 4.25Å; L142-L168 HydrophobicContact CD1-CD2 4.38Å; L142-L168 HydrophobicContact CD1-CG 4.48Å; L166-L168 HydrophobicContact CD2-CD2 4.17Å; L166-L168 HydrophobicContact CG-CD2 4.25Å; L168-L188 HydrophobicContact CD1-CB 4.09Å; L168-L188 HydrophobicContact CD1-CD2 4.03Å; L168-L188 HydrophobicContact CD1-CG 4.46Å; L168-Y192 HydrophobicContact CD1-CD2 4.07Å; L168-Y192 HydrophobicContact CD1-CG 4.48Å; L168-Y192 HydrophobicContact CD2-CD2 4.47Å; L168-Y192 HydrophobicContact CG-CD2 4.38Å; L168-Y192 HydrophobicContact CG-CG 4.47Å; L168-P193 PolarHBondContact N-O 2.87Å; L168-A194 HydrophobicContact CB-CB 3.98Å; L168-A194 CarbonylContact O-C 3.56Å; L168-A194 VanDerWaalsContact O-CA 3.28Å; L168-A194 WeakPolarHBondContact O-CA 3.25Å; L168-V195 PolarHBondContact O-N 2.99Å
169	V	94.2	Very high	89.6	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	101.2	176.8	-177.5	0	0	0	0	108.4	L139 E140 I141 L142 N171 V195 F197 L227	L139-V169 HydrophobicContact CB-CG2 4.09Å; L139-V169 HydrophobicContact CD1-CG2 4.41Å; L139-V169 HydrophobicContact CD2-CG2 4.29Å; L139-V169 HydrophobicContact CG-CG2 4.48Å; E140-V169 PolarHBondContact O-N 3Å; I141-V169 HydrophobicContact CD1-CB 3.73Å; I141-V169 HydrophobicContact CD1-CG1 4.1Å; I141-V169 HydrophobicContact CD1-CG2 4.1Å; L142-V169 PolarHBondContact N-O 3.36Å; V169-N171 PolarHBondContact O-N 2.83Å; V169-N171 VanDerWaalsContact O-N 3.1Å; V169-V195 HydrophobicContact CB-CG2 4.42Å; V169-V195 HydrophobicContact CG1-CG2 4.32Å; V169-V195 HydrophobicContact CG2-CG2 4.04Å; V169-F197 HydrophobicContact CG1-CB 3.52Å; V169-F197 HydrophobicContact CG1-CD2 4.22Å; V169-F197 HydrophobicContact CG1-CG 3.87Å; V169-L227 HydrophobicContact CG2-CD1 4.34Å; V169-L227 HydrophobicContact CG2-CD2 4.4Å
170	M	93.4	Very high	89.7	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	96.3	177.4	-175.1	170.1	57.4	0	0	109.6	A144 P147 I173 I181 W184 L185 L188 V195 F197	A144-M170 HydrophobicContact CB-CG 3.63Å; A144-M170 HydrophobicContact CB-SD 4.14Å; P147-M170 HydrophobicContact CG-SD 3.96Å; M170-I173 HydrophobicContact CE-CG2 4.4Å; M170-I173 HydrophobicContact CG-CG2 4.41Å; M170-I173 VanDerWaalsContact O-CG2 3.24Å; M170-I173 WeakPolarHBondContact O-CG2 3.35Å; M170-I181 HydrophobicContact CE-CB 4.41Å; M170-I181 HydrophobicContact CE-CG2 3.72Å; M170-W184 HydrophobicContact CE-CB 4.06Å; M170-W184 HydrophobicContact SD-CB 3.7Å; M170-W184 HydrophobicContact SD-CG 4.26Å; M170-L185 HydrophobicContact CE-CD2 3.91Å; M170-L185 HydrophobicContact CE-CG 3.82Å; M170-L188 HydrophobicContact SD-CD1 4.47Å; M170-V195 PolarHBondContact N-O 3.41Å; M170-F197 PolarHBondContact O-N 2.76Å
171	N	90.8	Very high	89.8	Confident	15 Å²	15	32.8 Å²	32.8	8%	0.08	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	158.6	-175.6	-170	23.4	0	0	0	112.1	I141 L142 A144 V169 F197 A199 L252	I141-N171 HydrophobicContact CG2-CB 3.85Å; L142-N171 WeakPolarHBondContact O-CB 3.23Å; L142-N171 PolarHBondContact O-N 2.81Å; A144-N171 VanDerWaalsContact CB-O 3.25Å; A144-N171 WeakPolarHBondContact CB-O 3.41Å; A144-N171 PolarHBondContact N-O 3.1Å; V169-N171 PolarHBondContact O-N 2.83Å; V169-N171 VanDerWaalsContact O-N 3.1Å; N171-F197 CarbonylContact C-O 3.53Å; N171-F197 VanDerWaalsContact CA-O 3.23Å; N171-F197 WeakPolarHBondContact CA-O 3.48Å; N171-F197 PolarHBondContact OD1-O 3.05Å; N171-A199 PolarHBondContact OD1-N 3.01Å; N171-L252 HydrophobicContact CB-CD2 4.48Å; N171-L252 WeakPolarHBondContact ND2-CD2 3.33Å
172	K	84.6	Confident	90	Very high	33 Å²	33	29.6 Å²	29.6	14%	0.143	16%	0.16	C	C	.	.			trans	67.4	36.1	-179.4	-47.2	-176.7	-176.9	177.9	0	113.6	D174 L175 F197 P374	K172-D174 WeakPolarHBondContact CA-OD1 3.38Å; K172-D174 PolarHBondContact O-N 2.94Å; K172-L175 HydrophobicContact CB-CD1 3.85Å; K172-L175 HydrophobicContact CB-CG 4.17Å; K172-L175 HydrophobicContact CD-CD1 4.1Å; K172-L175 WeakPolarHBondContact O-CB 3.26Å; K172-L175 PolarHBondContact O-N 2.87Å; K172-F197 PolarHBondContact N-O 3.23Å; K172-P374 HydrophobicContact CD-CB 3.86Å; K172-P374 PolarHBondContact NZ-O 2.85Å
173	I	87.8	Confident	90.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-58.1	-19.9	176.4	63.9	179.5	0	0	0	113.4	A144 M170 L175 I176 I181 A196 F197 K198 I222 L418 L421	A144-I173 HydrophobicContact CB-CG2 4.19Å; M170-I173 HydrophobicContact CE-CG2 4.4Å; M170-I173 HydrophobicContact CG-CG2 4.41Å; M170-I173 VanDerWaalsContact O-CG2 3.24Å; M170-I173 WeakPolarHBondContact O-CG2 3.35Å; I173-L175 PolarHBondContact O-N 2.84Å; I173-L175 VanDerWaalsContact O-N 3.16Å; I173-I176 PolarHBondContact O-N 3.5Å; I173-I181 HydrophobicContact CB-CD1 3.74Å; I173-I181 HydrophobicContact CB-CG1 4.18Å; I173-I181 HydrophobicContact CG2-CD1 4.47Å; I173-I181 HydrophobicContact CG2-CG1 4.47Å; I173-A196 HydrophobicContact CD1-CB 4.01Å; I173-A196 HydrophobicContact CG2-CB 3.94Å; I173-F197 PolarHBondContact N-O 3.02Å; I173-K198 HydrophobicContact CD1-CB 4.48Å; I173-K198 HydrophobicContact CG1-CB 4.1Å; I173-I222 HydrophobicContact CD1-CG2 4.42Å; I173-L418 HydrophobicContact CD1-CD2 4.34Å; I173-L421 HydrophobicContact CD1-CD1 4.03Å; I173-L421 HydrophobicContact CG1-CD1 4.16Å
174	D	83.4	Confident	90.4	Very high	44 Å²	44	29.4 Å²	29.4	24%	0.235	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-68.9	-6.2	175.3	61.2	-57.8	0	0	0	114.5	K172 K198	K172-D174 WeakPolarHBondContact CA-OD1 3.38Å; K172-D174 PolarHBondContact O-N 2.94Å; D174-K198 HydrophobicContact CB-CD 4.12Å; D174-K198 HydrophobicContact CB-CG 4.43Å; D174-K198 IonicContact OD1-NZ 3.42Å; D174-K198 IonicContact OD2-NZ 2.72Å; D174-K198 PolarHBondContact OD2-NZ 3.27Å
175	L	80.8	Confident	90.5	Very high	56 Å²	56	27.5 Å²	27.5	29%	0.293	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-94.9	-8.5	178.4	-57.2	-177.5	0	0	0	113.7	R145 K172 I173 P374	R145-L175 HydrophobicContact CG-CB 3.93Å; R145-L175 HydrophobicContact CG-CD1 4.35Å; K172-L175 HydrophobicContact CB-CD1 3.85Å; K172-L175 HydrophobicContact CB-CG 4.17Å; K172-L175 HydrophobicContact CD-CD1 4.1Å; K172-L175 WeakPolarHBondContact O-CB 3.26Å; K172-L175 PolarHBondContact O-N 2.87Å; I173-L175 PolarHBondContact O-N 2.84Å; I173-L175 VanDerWaalsContact O-N 3.16Å; L175-P374 HydrophobicContact CD1-CB 4.35Å
176	I	83	Confident	90.5	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.015	15%	0.145	C	C	.	.	S	Bend	trans	-132.5	157	-172.5	65.8	153.3	0	0	0	112.5	A144 R145 I173 N180 I181 Y382 I426	A144-I176 HydrophobicContact CB-CD1 3.89Å; A144-I176 HydrophobicContact CB-CG1 4Å; A144-I176 WeakPolarHBondContact O-CD1 3.33Å; R145-I176 HydrophobicContact CB-CG2 4.28Å; R145-I176 HydrophobicContact CG-CG2 3.64Å; I173-I176 PolarHBondContact O-N 3.5Å; I176-N180 HydrophobicContact CD1-CB 4.39Å; I176-I181 HydrophobicContact CD1-CB 4.32Å; I176-I181 HydrophobicContact CD1-CG1 3.45Å; I176-I181 VanDerWaalsContact CD1-CG1 3.45Å; I176-I181 HydrophobicContact CG1-CD1 4.25Å; I176-I181 HydrophobicContact CG1-CG1 3.56Å; I176-Y382 HydrophobicContact CB-CG 4.49Å; I176-Y382 VanDerWaalsContact CG2-CB 3.48Å; I176-Y382 HydrophobicContact CG2-CG 4.25Å; I176-I426 WeakPolarHBondContact O-CD1 3.3Å
177	P	87.2	Confident	90.5	Very high	17 Å²	17	31.3 Å²	31.3	11%	0.11	15%	0.15	C	C	.	.			trans	-61.1	150.7	-179.5	-21.3	30.8	0	0	0	113.5	E179 N180 I181 Y382 I426	P177-E179 PolarHBondContact O-N 3.3Å; P177-N180 HydrophobicContact CB-CB 4.17Å; P177-N180 HydrophobicContact CG-CB 4.29Å; P177-N180 PolarHBondContact O-N 3.25Å; P177-N180 VanDerWaalsContact O-N 3.11Å; P177-I181 WeakPolarHBondContact O-CG1 2.82Å; P177-I181 PolarHBondContact O-N 3.01Å; P177-Y382 HydrophobicContact CG-CD1 4.37Å; P177-Y382 HydrophobicContact CG-CE1 3.71Å; P177-Y382 HydrophobicContact CG-CE2 4.17Å; P177-I426 VanDerWaalsContact CA-CD1 3.49Å; P177-I426 HydrophobicContact CB-CD1 4.33Å; P177-I426 HydrophobicContact CG-CD1 4.36Å; P177-I426 HydrophobicContact CG-CG2 3.67Å
178	K	89.4	Confident	90.5	Very high	34 Å²	34	31.3 Å²	31.3	15%	0.148	15%	0.15	C	C	.	.	H	α-helix	trans	-58.5	-39.7	177.7	-67.3	177.1	-176.7	175.9	0	111.8	N180 I181 K182 L418 Q419 L421 S423	K178-N180 VanDerWaalsContact C-N 3.35Å; K178-I181 WeakPolarHBondContact O-CB 2.94Å; K178-I181 PolarHBondContact O-N 3.47Å; K178-K182 WeakPolarHBondContact O-CG 3.36Å; K178-K182 PolarHBondContact O-N 2.98Å; K178-K182 VanDerWaalsContact O-N 3.14Å; K178-L418 VanDerWaalsContact CD-O 3.31Å; K178-L418 WeakPolarHBondContact CD-O 3.33Å; K178-L418 WeakPolarHBondContact CE-O 3.34Å; K178-Q419 PolarHBondContact NZ-O 3.44Å; K178-L421 WeakPolarHBondContact CE-O 3.26Å; K178-L421 HydrophobicContact CG-CB 4.41Å; K178-L421 PolarHBondContact NZ-O 3.34Å; K178-S423 PolarHBondContact NZ-OG 3.19Å
179	E	90.3	Very high	90.4	Very high	128 Å²	128	33.3 Å²	33.3	60%	0.598	16%	0.158	S	C	*	.	H	α-helix	trans	-64.3	-44.1	179	-61.4	66.9	-144.9	0	0	109.5	P177 K182 K183	P177-E179 PolarHBondContact O-N 3.3Å; E179-K182 PolarHBondContact O-N 2.81Å; E179-K183 WeakPolarHBondContact O-CG 3.42Å; E179-K183 PolarHBondContact O-N 2.91Å
180	N	90.9	Very high	90.1	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.011	18%	0.176	C	C	.	.	H	α-helix	trans	-67.8	-37.1	177.4	-162.4	46.9	0	0	0	112.3	I176 P177 K178 K182 K183 W184 Y382 C383	I176-N180 HydrophobicContact CD1-CB 4.39Å; P177-N180 HydrophobicContact CB-CB 4.17Å; P177-N180 HydrophobicContact CG-CB 4.29Å; P177-N180 PolarHBondContact O-N 3.25Å; P177-N180 VanDerWaalsContact O-N 3.11Å; K178-N180 VanDerWaalsContact C-N 3.35Å; N180-K182 VanDerWaalsContact C-N 3.3Å; N180-K182 PolarHBondContact O-N 3.15Å; N180-K183 PolarHBondContact O-N 3.28Å; N180-W184 PolarHBondContact ND2-NE1 3.29Å; N180-W184 VanDerWaalsContact O-CD1 3.27Å; N180-W184 PolarHBondContact O-N 3.19Å; N180-Y382 HydrophobicContact CB-CD2 4.34Å; N180-Y382 HydrophobicContact CB-CE2 4.24Å; N180-Y382 WeakPolarHBondContact ND2-CD2 3.47Å; N180-C383 PolarHBondContact ND2-O 3.03Å
181	I	93.1	Very high	89.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-56.3	-47.8	172.4	-64.6	163.4	0	0	0	110.2	M170 I173 I176 P177 K178 W184 L185 A196 L418 L421	M170-I181 HydrophobicContact CE-CB 4.41Å; M170-I181 HydrophobicContact CE-CG2 3.72Å; I173-I181 HydrophobicContact CB-CD1 3.74Å; I173-I181 HydrophobicContact CB-CG1 4.18Å; I173-I181 HydrophobicContact CG2-CD1 4.47Å; I173-I181 HydrophobicContact CG2-CG1 4.47Å; I176-I181 HydrophobicContact CD1-CB 4.32Å; I176-I181 HydrophobicContact CD1-CG1 3.45Å; I176-I181 VanDerWaalsContact CD1-CG1 3.45Å; I176-I181 HydrophobicContact CG1-CD1 4.25Å; I176-I181 HydrophobicContact CG1-CG1 3.56Å; P177-I181 WeakPolarHBondContact O-CG1 2.82Å; P177-I181 PolarHBondContact O-N 3.01Å; K178-I181 WeakPolarHBondContact O-CB 2.94Å; K178-I181 PolarHBondContact O-N 3.47Å; I181-W184 PolarHBondContact O-N 2.78Å; I181-L185 HydrophobicContact CG2-CD1 3.94Å; I181-L185 HydrophobicContact CG2-CG 4.34Å; I181-L185 WeakPolarHBondContact O-CG 3.5Å; I181-L185 PolarHBondContact O-N 2.72Å; I181-A196 HydrophobicContact CG2-CB 4.01Å; I181-L418 HydrophobicContact CB-CD2 4.35Å; I181-L418 HydrophobicContact CD1-CD2 3.98Å; I181-L418 HydrophobicContact CG2-CD1 4.03Å; I181-L418 HydrophobicContact CG2-CD2 3.58Å; I181-L418 HydrophobicContact CG2-CG 4.48Å; I181-L421 HydrophobicContact CD1-CD1 3.6Å
182	K	93.4	Very high	90	Very high	97 Å²	97	40.3 Å²	40.3	42%	0.422	18%	0.184	S	C	.	.	H	α-helix	trans	-64	-44.7	179.1	-69.1	178.9	178.8	-174.3	0	112.2	K178 E179 N180 W184 L185 N186 L418	K178-K182 WeakPolarHBondContact O-CG 3.36Å; K178-K182 PolarHBondContact O-N 2.98Å; K178-K182 VanDerWaalsContact O-N 3.14Å; E179-K182 PolarHBondContact O-N 2.81Å; N180-K182 VanDerWaalsContact C-N 3.3Å; N180-K182 PolarHBondContact O-N 3.15Å; K182-W184 VanDerWaalsContact C-N 3.32Å; K182-W184 PolarHBondContact O-N 3.16Å; K182-L185 PolarHBondContact O-N 3.39Å; K182-N186 WeakPolarHBondContact O-CB 3.24Å; K182-N186 VanDerWaalsContact O-CG 3.26Å; K182-N186 PolarHBondContact O-N 2.99Å; K182-L418 HydrophobicContact CG-CD1 4.02Å
183	K	94	Very high	90.5	Very high	90 Å²	90	39 Å²	39	39%	0.391	18%	0.179	S	C	.	.	H	α-helix	trans	-55.4	-48.2	175.2	-70.8	-178.6	177.1	-177.3	0	110.7	E179 N180 N186 Y187 E384 P385	E179-K183 WeakPolarHBondContact O-CG 3.42Å; E179-K183 PolarHBondContact O-N 2.91Å; N180-K183 PolarHBondContact O-N 3.28Å; K183-N186 PolarHBondContact O-N 2.73Å; K183-Y187 PolarHBondContact O-N 3.06Å; K183-E384 IonicContact NZ-OE1 3.25Å; K183-E384 PolarHBondContact NZ-OE1 3.48Å; K183-E384 IonicContact NZ-OE2 3.79Å; K183-E384 PolarHBondContact NZ-OE2 3.43Å; K183-P385 HydrophobicContact CB-CG 3.68Å
184	W	95.3	Very high	90.9	Very high	2 Å²	2	39 Å²	39	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-65.1	-43.7	178.4	-84.4	116	0	0	0	113.7	P147 L148 M170 N180 I181 K182 N186 Y187 L188 C383 E384 P385	P147-W184 HydrophobicContact CB-CD2 4.3Å; P147-W184 HydrophobicContact CB-CE3 4.02Å; P147-W184 HydrophobicContact CB-CZ3 4.2Å; P147-W184 HydrophobicContact CG-CD2 3.62Å; P147-W184 HydrophobicContact CG-CE3 3.87Å; P147-W184 HydrophobicContact CG-CG 3.98Å; P147-W184 HydrophobicContact CG-CH2 4.49Å; P147-W184 HydrophobicContact CG-CZ2 4.26Å; P147-W184 HydrophobicContact CG-CZ3 4.31Å; L148-W184 HydrophobicContact CD1-CH2 3.91Å; L148-W184 HydrophobicContact CD1-CZ3 4.12Å; L148-W184 HydrophobicContact CD2-CZ3 4.42Å; L148-W184 HydrophobicContact CG-CH2 3.78Å; L148-W184 HydrophobicContact CG-CZ3 3.76Å; M170-W184 HydrophobicContact CE-CB 4.06Å; M170-W184 HydrophobicContact SD-CB 3.7Å; M170-W184 HydrophobicContact SD-CG 4.26Å; N180-W184 PolarHBondContact ND2-NE1 3.29Å; N180-W184 VanDerWaalsContact O-CD1 3.27Å; N180-W184 PolarHBondContact O-N 3.19Å; I181-W184 PolarHBondContact O-N 2.78Å; K182-W184 VanDerWaalsContact C-N 3.32Å; K182-W184 PolarHBondContact O-N 3.16Å; W184-N186 VanDerWaalsContact C-N 3.31Å; W184-N186 PolarHBondContact O-N 2.83Å; W184-Y187 HydrophobicContact CE3-CD1 4.29Å; W184-Y187 HydrophobicContact CZ3-CD1 4.09Å; W184-Y187 HydrophobicContact CZ3-CE1 4.47Å; W184-Y187 PolarHBondContact O-N 2.98Å; W184-L188 HydrophobicContact CE3-CG 4.43Å; W184-L188 WeakPolarHBondContact O-CB 3.18Å; W184-L188 VanDerWaalsContact O-CG 3.24Å; W184-L188 WeakPolarHBondContact O-CG 3.44Å; W184-L188 PolarHBondContact O-N 2.65Å; W184-C383 HydrophobicContact CZ2-CB 4.06Å; W184-C383 PolarHBondContact NE1-O 3.46Å; W184-E384 WeakPolarHBondContact CZ2-O 3.23Å; W184-P385 HydrophobicContact CD2-CB 4Å; W184-P385 HydrophobicContact CD2-CG 4.29Å; W184-P385 HydrophobicContact CE3-CB 3.78Å; W184-P385 VanDerWaalsContact CH2-CA 3.5Å; W184-P385 HydrophobicContact CH2-CB 4.02Å; W184-P385 HydrophobicContact CZ2-CB 4.24Å; W184-P385 VanDerWaalsContact CZ2-N 3.35Å; W184-P385 HydrophobicContact CZ3-CB 3.78Å
185	L	94.6	Very high	91.4	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-59.8	-44	176.5	-73	171.9	0	0	0	111.3	M170 I181 K182 Y187 L188 R189 A194 A196 E414 L418	M170-L185 HydrophobicContact CE-CD2 3.91Å; M170-L185 HydrophobicContact CE-CG 3.82Å; I181-L185 HydrophobicContact CG2-CD1 3.94Å; I181-L185 HydrophobicContact CG2-CG 4.34Å; I181-L185 WeakPolarHBondContact O-CG 3.5Å; I181-L185 PolarHBondContact O-N 2.72Å; K182-L185 PolarHBondContact O-N 3.39Å; L185-Y187 VanDerWaalsContact C-N 3.32Å; L185-Y187 PolarHBondContact O-N 2.82Å; L185-L188 PolarHBondContact O-N 3.24Å; L185-R189 VanDerWaalsContact O-CB 3.23Å; L185-R189 WeakPolarHBondContact O-CB 3.28Å; L185-R189 WeakPolarHBondContact O-CD 3.18Å; L185-R189 WeakPolarHBondContact O-CG 3.38Å; L185-R189 PolarHBondContact O-N 3.49Å; L185-A194 HydrophobicContact CD2-CB 4.28Å; L185-A196 HydrophobicContact CD1-CB 4.06Å; L185-A196 HydrophobicContact CD2-CB 4.37Å; L185-E414 HydrophobicContact CD1-CG 4.41Å; L185-E414 WeakPolarHBondContact CD1-OE1 3.39Å; L185-L418 HydrophobicContact CD1-CD1 4.36Å
186	N	92.4	Very high	92.1	Very high	104 Å²	104	34.3 Å²	34.3	56%	0.556	16%	0.155	S	C	*	.	H	α-helix	trans	-63.2	-38.9	177.1	-70.5	-10.1	0	0	0	112.2	K182 K183 W184	K182-N186 WeakPolarHBondContact O-CB 3.24Å; K182-N186 VanDerWaalsContact O-CG 3.26Å; K182-N186 PolarHBondContact O-N 2.99Å; K183-N186 PolarHBondContact O-N 2.73Å; W184-N186 VanDerWaalsContact C-N 3.31Å; W184-N186 PolarHBondContact O-N 2.83Å
187	Y	93.1	Very high	92.5	Very high	26 Å²	26	35.9 Å²	35.9	10%	0.102	16%	0.162	C	C	.	.	H	α-helix	trans	-66.9	-52.2	176.5	-177.4	-84.4	0	0	0	111.5	L148 K183 W184 L185 R189 R190 P385 P386 I392	L148-Y187 HydrophobicContact CD2-CE1 4.05Å; K183-Y187 PolarHBondContact O-N 3.06Å; W184-Y187 HydrophobicContact CE3-CD1 4.29Å; W184-Y187 HydrophobicContact CZ3-CD1 4.09Å; W184-Y187 HydrophobicContact CZ3-CE1 4.47Å; W184-Y187 PolarHBondContact O-N 2.98Å; L185-Y187 VanDerWaalsContact C-N 3.32Å; L185-Y187 PolarHBondContact O-N 2.82Å; Y187-R189 VanDerWaalsContact C-N 3.34Å; Y187-R189 PolarHBondContact O-N 3.08Å; Y187-R190 WeakPolarHBondContact O-CB 3.27Å; Y187-R190 WeakPolarHBondContact O-CG 3.49Å; Y187-R190 PolarHBondContact O-N 2.83Å; Y187-P385 HydrophobicContact CD2-CB 3.87Å; Y187-P385 HydrophobicContact CG-CB 3.82Å; Y187-P386 HydrophobicContact CE2-CB 4.35Å; Y187-P386 HydrophobicContact CE2-CG 4.19Å; Y187-I392 HydrophobicContact CE1-CD1 4.42Å; Y187-I392 HydrophobicContact CE2-CD1 3.92Å
188	L	93.4	Very high	92.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-34.9	-176.2	-66.6	172.4	0	0	0	112.8	L142 P147 L168 M170 W184 L185 R190 E191 Y192 A194	L142-L188 HydrophobicContact CD1-CD1 4.04Å; L142-L188 HydrophobicContact CD1-CD2 4.36Å; P147-L188 HydrophobicContact CB-CD1 4.23Å; L168-L188 HydrophobicContact CD1-CB 4.09Å; L168-L188 HydrophobicContact CD1-CD2 4.03Å; L168-L188 HydrophobicContact CD1-CG 4.46Å; M170-L188 HydrophobicContact SD-CD1 4.47Å; W184-L188 HydrophobicContact CE3-CG 4.43Å; W184-L188 WeakPolarHBondContact O-CB 3.18Å; W184-L188 VanDerWaalsContact O-CG 3.24Å; W184-L188 WeakPolarHBondContact O-CG 3.44Å; W184-L188 PolarHBondContact O-N 2.65Å; L185-L188 PolarHBondContact O-N 3.24Å; L188-R190 PolarHBondContact O-N 3Å; L188-R190 VanDerWaalsContact O-N 3.15Å; L188-E191 PolarHBondContact O-N 3.22Å; L188-Y192 PolarHBondContact O-N 3.3Å; L188-Y192 VanDerWaalsContact O-O 3.1Å; L188-A194 HydrophobicContact CB-CB 3.82Å; L188-A194 HydrophobicContact CD1-CB 4.48Å
189	R	92.6	Very high	92	Very high	43 Å²	43	35.6 Å²	35.6	16%	0.162	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-8.4	178.2	-75.8	171.5	179.9	161.3	4.2	114.6	L185 Y187 E191 Y192 A194 M402 L407 E414	L185-R189 VanDerWaalsContact O-CB 3.23Å; L185-R189 WeakPolarHBondContact O-CB 3.28Å; L185-R189 WeakPolarHBondContact O-CD 3.18Å; L185-R189 WeakPolarHBondContact O-CG 3.38Å; L185-R189 PolarHBondContact O-N 3.49Å; Y187-R189 VanDerWaalsContact C-N 3.34Å; Y187-R189 PolarHBondContact O-N 3.08Å; R189-E191 VanDerWaalsContact C-N 3.3Å; R189-Y192 WeakPolarHBondContact CA-O 3.4Å; R189-A194 HydrophobicContact CG-CB 4.02Å; R189-A194 PolarHBondContact NE-O 3.07Å; R189-A194 PolarHBondContact NH2-O 2.9Å; R189-M402 HydrophobicContact CB-CE 4.47Å; R189-M402 WeakPolarHBondContact O-CE 3.34Å; R189-L407 HydrophobicContact CG-CD1 4.12Å; R189-E414 IonicContact CZ-OE1 2.78Å; R189-E414 IonicContact CZ-OE2 3.01Å; R189-E414 VanDerWaalsContact CZ-OE2 3.25Å; R189-E414 IonicContact NH1-OE2 3.59Å; R189-E414 PolarHBondContact NH1-OE2 3.34Å; R189-E414 IonicContact NH2-OE1 2.82Å; R189-E414 PolarHBondContact NH2-OE1 3.49Å; R189-E414 IonicContact NH2-OE2 2.9Å; R189-E414 PolarHBondContact NH2-OE2 2.9Å
190	R	88.8	Confident	91	Very high	106 Å²	106	31.9 Å²	31.9	40%	0.4	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-28.7	170.2	-62.1	172.1	-178	178.9	-2.6	112	Y187 L188 D388 C394	Y187-R190 WeakPolarHBondContact O-CB 3.27Å; Y187-R190 WeakPolarHBondContact O-CG 3.49Å; Y187-R190 PolarHBondContact O-N 2.83Å; L188-R190 PolarHBondContact O-N 3Å; L188-R190 VanDerWaalsContact O-N 3.15Å; R190-D388 IonicContact NH1-OD2 2.77Å; R190-D388 PolarHBondContact NH1-OD2 3Å; R190-C394 PolarHBondContact O-SG 2.94Å
191	E	89.3	Confident	89.7	Confident	42 Å²	42	34 Å²	34	20%	0.196	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-41.4	-176.7	-64.4	179.3	-112.4	0	0	112.3	R151 L188 R189 I392 V398	R151-E191 IonicContact CZ-OE1 3.75Å; R151-E191 IonicContact CZ-OE2 3.55Å; R151-E191 VanDerWaalsContact NH1-CD 3.31Å; R151-E191 IonicContact NH1-OE1 3.57Å; R151-E191 PolarHBondContact NH1-OE1 3.08Å; R151-E191 IonicContact NH1-OE2 3.69Å; R151-E191 PolarHBondContact NH1-OE2 3.38Å; R151-E191 IonicContact NH2-OE1 2.8Å; R151-E191 IonicContact NH2-OE2 2.75Å; R151-E191 PolarHBondContact NH2-OE2 3.19Å; L188-E191 PolarHBondContact O-N 3.22Å; R189-E191 VanDerWaalsContact C-N 3.3Å; E191-I392 HydrophobicContact CG-CG2 4.3Å; E191-V398 WeakPolarHBondContact O-CG1 3.45Å
192	Y	93.1	Very high	87.6	Confident	18 Å²	18	41.2 Å²	41.2	7%	0.071	20%	0.201	C	C	.	.	S	Bend	trans	-150.2	154.1	-176	-59.3	-71.5	0	0	0	112	E156 L160 L166 L168 L188 R189 A194 M402	E156-Y192 WeakPolarHBondContact OE2-CE2 3.48Å; L160-Y192 HydrophobicContact CD1-CE1 4.28Å; L160-Y192 WeakPolarHBondContact CD1-OH 3.15Å; L160-Y192 HydrophobicContact CD2-CE1 4.26Å; L166-Y192 HydrophobicContact CB-CD1 4.09Å; L166-Y192 HydrophobicContact CB-CE1 4.36Å; L166-Y192 HydrophobicContact CD2-CD1 3.92Å; L166-Y192 HydrophobicContact CD2-CD2 4.03Å; L166-Y192 HydrophobicContact CD2-CE1 3.87Å; L166-Y192 HydrophobicContact CD2-CE2 3.97Å; L166-Y192 HydrophobicContact CD2-CG 4Å; L166-Y192 HydrophobicContact CG-CD1 4.29Å; L166-Y192 HydrophobicContact CG-CG 4.41Å; L168-Y192 HydrophobicContact CD1-CD2 4.07Å; L168-Y192 HydrophobicContact CD1-CG 4.48Å; L168-Y192 HydrophobicContact CD2-CD2 4.47Å; L168-Y192 HydrophobicContact CG-CD2 4.38Å; L168-Y192 HydrophobicContact CG-CG 4.47Å; L188-Y192 PolarHBondContact O-N 3.3Å; L188-Y192 VanDerWaalsContact O-O 3.1Å; R189-Y192 WeakPolarHBondContact CA-O 3.4Å; Y192-A194 PolarHBondContact O-N 3.18Å; Y192-M402 VanDerWaalsContact C-SD 3.55Å
193	P	94.9	Very high	85.4	Confident	4 Å²	4	41.9 Å²	41.9	3%	0.026	21%	0.205	C	C	.	.			trans	-57	126.4	172.6	-16.7	27.3	0	0	0	109.5	L166 V167 L168 L230 M402 F405 L407	L166-P193 WeakPolarHBondContact O-CD 3.46Å; V167-P193 CarbonylContact C-O 3.51Å; V167-P193 WeakPolarHBondContact CA-O 3.48Å; V167-P193 HydrophobicContact CG1-CB 4.47Å; V167-P193 WeakPolarHBondContact CG1-O 3.33Å; V167-P193 HydrophobicContact CG2-CB 4.33Å; L168-P193 PolarHBondContact N-O 2.87Å; P193-L230 HydrophobicContact CB-CD2 4.37Å; P193-M402 HydrophobicContact CB-SD 4.31Å; P193-M402 WeakPolarHBondContact CD-SD 3.48Å; P193-M402 HydrophobicContact CG-SD 3.62Å; P193-F405 HydrophobicContact CB-CB 4.17Å; P193-F405 HydrophobicContact CB-CD2 4.23Å; P193-F405 HydrophobicContact CB-CG 4.07Å; P193-F405 HydrophobicContact CG-CB 4.03Å; P193-F405 HydrophobicContact CG-CD1 4.43Å; P193-F405 HydrophobicContact CG-CD2 3.35Å; P193-F405 HydrophobicContact CG-CE2 3.83Å; P193-F405 HydrophobicContact CG-CG 3.68Å; P193-L407 HydrophobicContact CB-CD2 4.46Å
194	A	95.4	Very high	83	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	140.2	-176.3	0	0	0	0	0	111.8	L168 L185 L188 R189 Y192	L168-A194 HydrophobicContact CB-CB 3.98Å; L168-A194 CarbonylContact O-C 3.56Å; L168-A194 VanDerWaalsContact O-CA 3.28Å; L168-A194 WeakPolarHBondContact O-CA 3.25Å; L185-A194 HydrophobicContact CD2-CB 4.28Å; L188-A194 HydrophobicContact CB-CB 3.82Å; L188-A194 HydrophobicContact CD1-CB 4.48Å; R189-A194 HydrophobicContact CG-CB 4.02Å; R189-A194 PolarHBondContact NE-O 3.07Å; R189-A194 PolarHBondContact NH2-O 2.9Å; Y192-A194 PolarHBondContact O-N 3.18Å
195	V	95.1	Very high	80.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.2	177	-63	0	0	0	0	112.2	L168 V169 M170 I226 L227 L230 I410	L168-V195 PolarHBondContact O-N 2.99Å; V169-V195 HydrophobicContact CB-CG2 4.42Å; V169-V195 HydrophobicContact CG1-CG2 4.32Å; V169-V195 HydrophobicContact CG2-CG2 4.04Å; M170-V195 PolarHBondContact N-O 3.41Å; V195-I226 HydrophobicContact CB-CG2 4.49Å; V195-I226 HydrophobicContact CG1-CG2 4.11Å; V195-L227 HydrophobicContact CG2-CB 4.35Å; V195-L227 HydrophobicContact CG2-CD1 4Å; V195-L230 HydrophobicContact CG1-CD2 3.48Å; V195-L230 VanDerWaalsContact CG1-CD2 3.48Å; V195-I410 HydrophobicContact CG1-CD1 4.06Å
196	A	94	Very high	77.8	Confident	3 Å²	3	59.8 Å²	59.8	3%	0.025	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	132.5	171.9	0	0	0	0	0	111.3	I173 I181 L185 L418	I173-A196 HydrophobicContact CD1-CB 4.01Å; I173-A196 HydrophobicContact CG2-CB 3.94Å; I181-A196 HydrophobicContact CG2-CB 4.01Å; L185-A196 HydrophobicContact CD1-CB 4.06Å; L185-A196 HydrophobicContact CD2-CB 4.37Å; A196-L418 HydrophobicContact CB-CD2 4.15Å
197	F	91.8	Very high	75.4	Confident	36 Å²	36	64.1 Å²	64.1	16%	0.158	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.4	-174.8	-160.2	-89	0	0	0	113.4	V169 M170 N171 K172 I173 A199 I222 A224 L227	V169-F197 HydrophobicContact CG1-CB 3.52Å; V169-F197 HydrophobicContact CG1-CD2 4.22Å; V169-F197 HydrophobicContact CG1-CG 3.87Å; M170-F197 PolarHBondContact O-N 2.76Å; N171-F197 CarbonylContact C-O 3.53Å; N171-F197 VanDerWaalsContact CA-O 3.23Å; N171-F197 WeakPolarHBondContact CA-O 3.48Å; N171-F197 PolarHBondContact OD1-O 3.05Å; K172-F197 PolarHBondContact N-O 3.23Å; I173-F197 PolarHBondContact N-O 3.02Å; F197-A199 HydrophobicContact CE1-CB 4.05Å; F197-I222 WeakPolarHBondContact CA-O 3.35Å; F197-A224 HydrophobicContact CE2-CB 4.02Å; F197-A224 HydrophobicContact CZ-CB 4.37Å; F197-L227 HydrophobicContact CD2-CD2 4.49Å; F197-L227 HydrophobicContact CE2-CD2 4.26Å
198	K	85.8	Confident	73	Confident	6 Å²	6	66.7 Å²	66.7	3%	0.026	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-131.9	115.4	166.5	-178.5	-163.6	169.5	87.9	0	108.3	I173 D174 I217 T218 A221 I222	I173-K198 HydrophobicContact CD1-CB 4.48Å; I173-K198 HydrophobicContact CG1-CB 4.1Å; D174-K198 HydrophobicContact CB-CD 4.12Å; D174-K198 HydrophobicContact CB-CG 4.43Å; D174-K198 IonicContact OD1-NZ 3.42Å; D174-K198 IonicContact OD2-NZ 2.72Å; D174-K198 PolarHBondContact OD2-NZ 3.27Å; K198-I217 VanDerWaalsContact NZ-CG2 3.29Å; K198-T218 WeakPolarHBondContact CE-O 3.44Å; K198-A221 CarbonylContact O-C 3.37Å; K198-A221 WeakPolarHBondContact O-CA 3.36Å; K198-I222 HydrophobicContact CB-CB 3.87Å; K198-I222 HydrophobicContact CB-CD1 4.45Å; K198-I222 HydrophobicContact CB-CG1 4.28Å; K198-I222 HydrophobicContact CD-CB 4.5Å; K198-I222 HydrophobicContact CD-CD1 3.64Å; K198-I222 HydrophobicContact CD-CG1 3.99Å; K198-I222 PolarHBondContact N-O 3.31Å; K198-I222 PolarHBondContact O-N 2.67Å
199	A	80.8	Confident	70.4	Confident	39 Å²	39	69.8 Å²	69.8	32%	0.322	34%	0.34	S	S	.	.			trans	-68.3	146.8	174	0	0	0	0	0	112.2	N171 F197	N171-A199 PolarHBondContact OD1-N 3.01Å; F197-A199 HydrophobicContact CE1-CB 4.05Å
200	S	68.8	Low	67.9	Low	50 Å²	50	78.8 Å²	78.8	35%	0.35	37%	0.374	S	S	.	.			trans	-66.2	132.6	176.5	-178.7	0	0	0	0	111.6	Q202 S219	S200-Q202 WeakPolarHBondContact OG-CG 3.42Å; S200-Q202 PolarHBondContact OG-NE2 2.8Å; S200-S219 WeakPolarHBondContact CA-O 3.47Å; S200-S219 WeakPolarHBondContact CB-O 3.42Å; S200-S219 PolarHBondContact OG-O 3.46Å
201	T	63.2	Low	65.4	Low	47 Å²	47	79.3 Å²	79.3	29%	0.288	38%	0.383	S	S	.	.			trans	-103.9	52.1	179.3	54.8	0	0	0	0	111.6	E203 Q204 S219	T201-E203 PolarHBondContact O-N 3.37Å; T201-Q204 PolarHBondContact O-N 3.47Å; T201-S219 PolarHBondContact N-O 2.87Å
202	Q	50.1	Low	63.1	Low	150 Å²	150	82.6 Å²	82.6	70%	0.701	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-31.5	-176.3	-73.9	-64.8	-26.5	0	0	114.4	S200	S200-Q202 WeakPolarHBondContact OG-CG 3.42Å; S200-Q202 PolarHBondContact OG-NE2 2.8Å
203	E	46.2	Very low	60.3	Low	111 Å²	111	84.1 Å²	84.1	52%	0.519	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-9.9	-168.3	-145	140.2	-148	0	0	115.3	T201 R205 K206 K255	T201-E203 PolarHBondContact O-N 3.37Å; E203-R205 VanDerWaalsContact C-N 3.26Å; E203-R205 PolarHBondContact O-N 3.43Å; E203-K206 PolarHBondContact O-N 3.35Å; E203-K255 IonicContact OE2-NZ 3.41Å; E203-K255 PolarHBondContact OE2-NZ 2.95Å
204	Q	44.9	Very low	57.5	Low	71 Å²	71	88 Å²	88	33%	0.332	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-67.7	-24.7	-178.5	-84.6	-173.8	-37.5	0	0	112.7	T201 K206 K207 L208 S375	T201-Q204 PolarHBondContact O-N 3.47Å; Q204-K206 PolarHBondContact O-N 2.78Å; Q204-K206 VanDerWaalsContact O-N 3.17Å; Q204-K207 PolarHBondContact O-N 3.16Å; Q204-L208 HydrophobicContact CB-CD1 4.18Å; Q204-L208 HydrophobicContact CG-CD1 4.38Å; Q204-L208 WeakPolarHBondContact O-CB 3.49Å; Q204-L208 PolarHBondContact O-N 2.89Å; Q204-S375 PolarHBondContact NE2-O 2.93Å
205	R	40.3	Very low	54.8	Low	221 Å²	221	90.4 Å²	90.4	83%	0.834	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-59.1	-27.3	174.5	-84.4	-170.3	163	-163.2	-3.8	114.5	E203 K207	E203-R205 VanDerWaalsContact C-N 3.26Å; E203-R205 PolarHBondContact O-N 3.43Å; R205-K207 VanDerWaalsContact C-N 3.27Å; R205-K207 PolarHBondContact O-N 3.17Å
206	K	39.8	Very low	52.1	Low	179 Å²	179	95.9 Å²	95.9	78%	0.778	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-74.5	-15.6	177.9	-71.2	-177.4	-177.4	169.7	0	113.2	E203 Q204	E203-K206 PolarHBondContact O-N 3.35Å; Q204-K206 PolarHBondContact O-N 2.78Å; Q204-K206 VanDerWaalsContact O-N 3.17Å
207	K	42.8	Very low	50	Low	194 Å²	194	99.2 Å²	99.2	84%	0.843	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	-18.9	-178.2	-68.7	-173.1	-179.3	177.2	0	115.1	Q204 R205 G209	Q204-K207 PolarHBondContact O-N 3.16Å; R205-K207 VanDerWaalsContact C-N 3.27Å; R205-K207 PolarHBondContact O-N 3.17Å; K207-G209 VanDerWaalsContact C-N 3.29Å; K207-G209 PolarHBondContact O-N 2.96Å
208	L	42.3	Very low	48.3	Very low	80 Å²	80	100.2 Å²	100.2	42%	0.419	54%	0.536	S	S	.	.			trans	-78	83.7	168.1	-103.6	67.8	0	0	0	108.1	Q204 I211	Q204-L208 HydrophobicContact CB-CD1 4.18Å; Q204-L208 HydrophobicContact CG-CD1 4.38Å; Q204-L208 WeakPolarHBondContact O-CB 3.49Å; Q204-L208 PolarHBondContact O-N 2.89Å; L208-I211 HydrophobicContact CD2-CD1 4.06Å; L208-I211 HydrophobicContact CD2-CG1 4.45Å
209	G	38	Very low	47	Very low	66 Å²	66	102.2 Å²	102.2	68%	0.68	55%	0.551	S	S	*	*			trans	-60.8	141.4	150.3	0	0	0	0	0	108.9	K207	K207-G209 VanDerWaalsContact C-N 3.29Å; K207-G209 PolarHBondContact O-N 2.96Å
210	W	40.2	Very low	46.4	Very low	232 Å²	232	108 Å²	108	88%	0.879	57%	0.569	S	S	*	*			trans	107.7	-23.9	146.8	-158.5	-82	0	0	0	121.9	S212	W210-S212 PolarHBondContact O-N 2.91Å; W210-S212 PolarHBondContact O-OG 3.05Å
211	I	37.4	Very low	47	Very low	117 Å²	117	107.7 Å²	107.7	60%	0.6	57%	0.57	S	S	*	*			trans	-73.2	95.2	177.5	35.9	170.7	0	0	0	111.4	L208 I217	L208-I211 HydrophobicContact CD2-CD1 4.06Å; L208-I211 HydrophobicContact CD2-CG1 4.45Å; I211-I217 HydrophobicContact CD1-CD1 3.63Å
212	S	39.7	Very low	48	Very low	110 Å²	110	106.3 Å²	106.3	77%	0.769	56%	0.56	S	S	*	*			trans	-104.5	12.5	179.7	52.6	0	0	0	0	113	W210	W210-S212 PolarHBondContact O-N 2.91Å; W210-S212 PolarHBondContact O-OG 3.05Å
213	G	34.9	Very low	49.8	Very low	51 Å²	51	99.4 Å²	99.4	53%	0.526	53%	0.529	S	S	.	.	S	Bend	trans	-79.6	151.1	168.1	0	0	0	0	0	111	N215	G213-N215 PolarHBondContact O-N 3.27Å
214	A	36	Very low	51.8	Low	86 Å²	86	95.7 Å²	95.7	71%	0.711	52%	0.518	S	S	*	.	S	Bend	trans	-58.3	11.6	-177.9	0	0	0	0	0	116.5	V216	A214-V216 PolarHBondContact O-N 3.36Å
215	N	39.1	Very low	53.9	Low	49 Å²	49	97.7 Å²	97.7	26%	0.262	53%	0.531	S	S	.	.			trans	-74.2	88.7	170.4	-63.6	-22.9	0	0	0	108.4	G213 I217 S424	G213-N215 PolarHBondContact O-N 3.27Å; N215-I217 HydrophobicContact CB-CG1 4.46Å; N215-I217 PolarHBondContact O-N 2.99Å; N215-S424 PolarHBondContact OD1-OG 3.36Å
216	V	38.1	Very low	56.3	Low	116 Å²	116	87.3 Å²	87.3	70%	0.703	49%	0.492	S	S	*	.			trans	-64.4	82.2	164.7	-178.4	0	0	0	0	107.1	A214 T218	A214-V216 PolarHBondContact O-N 3.36Å; V216-T218 VanDerWaalsContact C-N 3.3Å; V216-T218 HydrophobicContact CG1-CG2 4.4Å; V216-T218 PolarHBondContact O-N 3.31Å
217	I	50.3	Low	58.9	Low	73 Å²	73	79.7 Å²	79.7	37%	0.374	46%	0.46	S	S	.	.			trans	-65.4	100.2	165.4	-56.5	-178.9	0	0	0	104.6	K198 I211 N215 S219	K198-I217 VanDerWaalsContact NZ-CG2 3.29Å; I211-I217 HydrophobicContact CD1-CD1 3.63Å; N215-I217 HydrophobicContact CB-CG1 4.46Å; N215-I217 PolarHBondContact O-N 2.99Å; I217-S219 PolarHBondContact O-N 2.98Å
218	T	54.7	Low	61.1	Low	56 Å²	56	73.5 Å²	73.5	34%	0.344	44%	0.435	S	S	.	.			trans	-56.5	127	175.4	53.3	0	0	0	0	108	K198 V216 K220	K198-T218 WeakPolarHBondContact CE-O 3.44Å; V216-T218 VanDerWaalsContact C-N 3.3Å; V216-T218 HydrophobicContact CG1-CG2 4.4Å; V216-T218 PolarHBondContact O-N 3.31Å; T218-K220 PolarHBondContact O-N 3.25Å
219	S	59.9	Low	63.4	Low	49 Å²	49	76.4 Å²	76.4	34%	0.343	44%	0.441	S	S	.	.			trans	-74.4	-7.6	174.3	56.2	0	0	0	0	112	S200 T201 I217	S200-S219 WeakPolarHBondContact CA-O 3.47Å; S200-S219 WeakPolarHBondContact CB-O 3.42Å; S200-S219 PolarHBondContact OG-O 3.46Å; T201-S219 PolarHBondContact N-O 2.87Å; I217-S219 PolarHBondContact O-N 2.98Å
220	K	68.7	Low	66.1	Low	159 Å²	159	73.2 Å²	73.2	69%	0.691	41%	0.408	S	S	*	.	S	Bend	trans	-69.2	145	178.4	-66.7	-173.1	176.8	-175.5	0	110.1	T218	T218-K220 PolarHBondContact O-N 3.25Å
221	A	80.1	Confident	68.5	Low	45 Å²	45	62.3 Å²	62.3	37%	0.372	37%	0.367	S	S	.	.			trans	-65.4	146.9	164.7	0	0	0	0	0	108.8	K198	K198-A221 CarbonylContact O-C 3.37Å; K198-A221 WeakPolarHBondContact O-CA 3.36Å
222	I	84.7	Confident	71	Confident	17 Å²	17	57.8 Å²	57.8	9%	0.087	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-127	137.1	176.8	-57.6	179	0	0	0	107.3	I173 F197 K198 V417 L421	I173-I222 HydrophobicContact CD1-CG2 4.42Å; F197-I222 WeakPolarHBondContact CA-O 3.35Å; K198-I222 HydrophobicContact CB-CB 3.87Å; K198-I222 HydrophobicContact CB-CD1 4.45Å; K198-I222 HydrophobicContact CB-CG1 4.28Å; K198-I222 HydrophobicContact CD-CB 4.5Å; K198-I222 HydrophobicContact CD-CD1 3.64Å; K198-I222 HydrophobicContact CD-CG1 3.99Å; K198-I222 PolarHBondContact N-O 3.31Å; K198-I222 PolarHBondContact O-N 2.67Å; I222-V417 HydrophobicContact CG2-CB 4.41Å; I222-V417 HydrophobicContact CG2-CG1 3.04Å; I222-L421 HydrophobicContact CD1-CD2 3.64Å
223	G	87.9	Confident	73.4	Confident	5 Å²	5	53.1 Å²	53.1	5%	0.052	32%	0.317	C	S	.	.	S	Bend	trans	87.3	0.2	178.6	0	0	0	0	0	115.5	L227	G223-L227 WeakPolarHBondContact O-CB 3.24Å; G223-L227 PolarHBondContact O-N 3.32Å
224	A	87.7	Confident	76	Confident	33 Å²	33	50.9 Å²	50.9	27%	0.273	29%	0.292	S	S	.	.	H	α-helix	trans	-65.6	-44.3	176.3	0	0	0	0	0	112.6	F197 L227 L228	F197-A224 HydrophobicContact CE2-CB 4.02Å; F197-A224 HydrophobicContact CZ-CB 4.37Å; A224-L227 PolarHBondContact O-N 2.98Å; A224-L228 WeakPolarHBondContact O-CG 3.42Å; A224-L228 PolarHBondContact O-N 2.92Å
225	D	88.7	Confident	78.5	Confident	114 Å²	114	47.2 Å²	47.2	61%	0.61	26%	0.261	S	S	*	.	H	α-helix	trans	-65.5	-41.8	178.2	-54.9	-50.2	0	0	0	111.1	L227 L228 R229	D225-L227 PolarHBondContact O-N 3.11Å; D225-L228 PolarHBondContact O-N 2.94Å; D225-R229 WeakPolarHBondContact O-CB 3.42Å; D225-R229 PolarHBondContact O-N 2.86Å
226	I	92.2	Very high	80.8	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-58.1	-49.3	174.1	-66.9	168.1	0	0	0	111.2	V195 R229 L230 I410 E413 E414 V417	V195-I226 HydrophobicContact CB-CG2 4.49Å; V195-I226 HydrophobicContact CG1-CG2 4.11Å; I226-R229 PolarHBondContact O-N 3.24Å; I226-L230 WeakPolarHBondContact O-CB 3.49Å; I226-L230 PolarHBondContact O-N 3.28Å; I226-I410 HydrophobicContact CG2-CB 4.06Å; I226-I410 HydrophobicContact CG2-CD1 3.75Å; I226-I410 HydrophobicContact CG2-CG1 4.46Å; I226-I410 HydrophobicContact CG2-CG2 4.36Å; I226-E413 HydrophobicContact CD1-CG 4.36Å; I226-E413 HydrophobicContact CG1-CB 4.42Å; I226-E413 HydrophobicContact CG1-CG 3.94Å; I226-E414 HydrophobicContact CD1-CB 4.01Å; I226-E414 HydrophobicContact CD1-CG 4.5Å; I226-V417 HydrophobicContact CD1-CB 4.06Å; I226-V417 HydrophobicContact CD1-CG1 4.27Å; I226-V417 HydrophobicContact CD1-CG2 3.92Å
227	L	92.6	Very high	83.2	Confident	19 Å²	19	51.5 Å²	51.5	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-45.5	178.1	175	60.1	0	0	0	111.3	L139 V167 V169 V195 F197 G223 A224 D225 R229 L230 L231	L139-L227 HydrophobicContact CD1-CD1 4.42Å; L139-L227 HydrophobicContact CD1-CD2 3.98Å; L139-L227 HydrophobicContact CD2-CD1 4.1Å; V167-L227 HydrophobicContact CG1-CD1 4.44Å; V169-L227 HydrophobicContact CG2-CD1 4.34Å; V169-L227 HydrophobicContact CG2-CD2 4.4Å; V195-L227 HydrophobicContact CG2-CB 4.35Å; V195-L227 HydrophobicContact CG2-CD1 4Å; F197-L227 HydrophobicContact CD2-CD2 4.49Å; F197-L227 HydrophobicContact CE2-CD2 4.26Å; G223-L227 WeakPolarHBondContact O-CB 3.24Å; G223-L227 PolarHBondContact O-N 3.32Å; A224-L227 PolarHBondContact O-N 2.98Å; D225-L227 PolarHBondContact O-N 3.11Å; L227-R229 VanDerWaalsContact C-N 3.33Å; L227-R229 PolarHBondContact O-N 3.23Å; L227-L230 PolarHBondContact O-N 2.73Å; L227-L231 HydrophobicContact CD1-CD1 3.87Å; L227-L231 HydrophobicContact CD1-CG 4.12Å; L227-L231 HydrophobicContact CG-CD1 3.86Å; L227-L231 WeakPolarHBondContact O-CB 3.4Å; L227-L231 WeakPolarHBondContact O-CD1 3.46Å; L227-L231 WeakPolarHBondContact O-CG 3.37Å; L227-L231 PolarHBondContact O-N 2.73Å
228	L	90.9	Very high	84.6	Confident	63 Å²	63	53.2 Å²	53.2	33%	0.33	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-38.1	177.7	-72.3	173.7	0	0	0	112.2	A224 D225 L231 G232 I279	A224-L228 WeakPolarHBondContact O-CG 3.42Å; A224-L228 PolarHBondContact O-N 2.92Å; D225-L228 PolarHBondContact O-N 2.94Å; L228-L231 PolarHBondContact O-N 2.99Å; L228-G232 PolarHBondContact O-N 3.01Å; L228-I279 HydrophobicContact CD2-CD1 4.13Å
229	R	90.6	Very high	85.3	Confident	141 Å²	141	58.9 Å²	58.9	53%	0.532	30%	0.3	S	S	.	.	H	α-helix	trans	-64.9	-44.5	176.2	-173.2	172.7	-130.1	149.5	-1.5	111.8	D225 I226 L227 G232 S233 I410 E413	D225-R229 WeakPolarHBondContact O-CB 3.42Å; D225-R229 PolarHBondContact O-N 2.86Å; I226-R229 PolarHBondContact O-N 3.24Å; L227-R229 VanDerWaalsContact C-N 3.33Å; L227-R229 PolarHBondContact O-N 3.23Å; R229-G232 CarbonylContact O-C 3.58Å; R229-G232 WeakPolarHBondContact O-CA 3.35Å; R229-G232 PolarHBondContact O-N 3.07Å; R229-G232 VanDerWaalsContact O-N 3.14Å; R229-S233 PolarHBondContact O-N 3.15Å; R229-I410 HydrophobicContact CB-CG2 4.1Å; R229-I410 HydrophobicContact CG-CG2 3.95Å; R229-E413 IonicContact CZ-OE2 3.89Å; R229-E413 IonicContact NH1-OE2 2.73Å; R229-E413 PolarHBondContact NH1-OE2 3.45Å
230	L	92.8	Very high	85.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.7	-42.8	175.5	-172.9	65.9	0	0	0	111.9	V167 P193 V195 I226 L227 G232 S233 Y234 F405 L407 I410	V167-L230 HydrophobicContact CG1-CD2 4.13Å; P193-L230 HydrophobicContact CB-CD2 4.37Å; V195-L230 HydrophobicContact CG1-CD2 3.48Å; V195-L230 VanDerWaalsContact CG1-CD2 3.48Å; I226-L230 WeakPolarHBondContact O-CB 3.49Å; I226-L230 PolarHBondContact O-N 3.28Å; L227-L230 PolarHBondContact O-N 2.73Å; L230-G232 VanDerWaalsContact C-N 3.3Å; L230-G232 PolarHBondContact O-N 3.26Å; L230-S233 PolarHBondContact O-N 3.18Å; L230-S233 PolarHBondContact O-OG 2.87Å; L230-Y234 PolarHBondContact O-N 3.48Å; L230-F405 HydrophobicContact CD1-CB 3.81Å; L230-F405 HydrophobicContact CD1-CD1 4.27Å; L230-F405 HydrophobicContact CG-CB 4.44Å; L230-F405 HydrophobicContact CG-CD1 4.01Å; L230-L407 HydrophobicContact CD1-CD2 3.81Å; L230-L407 HydrophobicContact CD1-CG 4.48Å; L230-L407 HydrophobicContact CD2-CD2 4.29Å; L230-I410 HydrophobicContact CB-CD1 4.4Å; L230-I410 HydrophobicContact CD1-CD1 4.04Å; L230-I410 HydrophobicContact CD2-CD1 4.35Å
231	L	91.7	Very high	85.2	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-35.1	174.4	-65.9	163.9	0	0	0	111.5	I137 L139 L227 L228 Y234 V235 I246 I279	I137-L231 HydrophobicContact CD1-CD2 3.71Å; I137-L231 HydrophobicContact CG2-CD2 4.23Å; L139-L231 HydrophobicContact CD2-CD2 4.38Å; L227-L231 HydrophobicContact CD1-CD1 3.87Å; L227-L231 HydrophobicContact CD1-CG 4.12Å; L227-L231 HydrophobicContact CG-CD1 3.86Å; L227-L231 WeakPolarHBondContact O-CB 3.4Å; L227-L231 WeakPolarHBondContact O-CD1 3.46Å; L227-L231 WeakPolarHBondContact O-CG 3.37Å; L227-L231 PolarHBondContact O-N 2.73Å; L228-L231 PolarHBondContact O-N 2.99Å; L231-Y234 PolarHBondContact O-N 2.95Å; L231-V235 WeakPolarHBondContact O-CG2 3.46Å; L231-V235 PolarHBondContact O-N 3.35Å; L231-I246 HydrophobicContact CB-CD1 4.44Å; L231-I246 HydrophobicContact CD1-CD1 3.34Å; L231-I246 HydrophobicContact CD2-CD1 3.71Å; L231-I246 HydrophobicContact CG-CD1 4.01Å; L231-I279 HydrophobicContact CB-CD1 4.04Å
232	G	89.4	Confident	85.1	Confident	22 Å²	22	55.7 Å²	55.7	23%	0.227	31%	0.31	C	S	.	.	H	α-helix	trans	-65.1	-35.7	174.6	0	0	0	0	0	113.5	L228 R229 L230 V235 K236	L228-G232 PolarHBondContact O-N 3.01Å; R229-G232 CarbonylContact O-C 3.58Å; R229-G232 WeakPolarHBondContact O-CA 3.35Å; R229-G232 PolarHBondContact O-N 3.07Å; R229-G232 VanDerWaalsContact O-N 3.14Å; L230-G232 VanDerWaalsContact C-N 3.3Å; L230-G232 PolarHBondContact O-N 3.26Å; G232-V235 PolarHBondContact O-N 3.45Å; G232-K236 WeakPolarHBondContact O-CG 3.48Å; G232-K236 PolarHBondContact O-N 3.42Å; G232-K236 VanDerWaalsContact O-N 3.15Å
233	S	89.9	Confident	85	Confident	13 Å²	13	57.3 Å²	57.3	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-65.3	-41.7	174.7	74.2	0	0	0	0	111.1	R229 L230 V235 K236 N237 D406	R229-S233 PolarHBondContact O-N 3.15Å; L230-S233 PolarHBondContact O-N 3.18Å; L230-S233 PolarHBondContact O-OG 2.87Å; S233-V235 VanDerWaalsContact C-N 3.35Å; S233-V235 PolarHBondContact O-N 3.02Å; S233-K236 PolarHBondContact O-N 2.84Å; S233-K236 VanDerWaalsContact O-N 3.17Å; S233-N237 WeakPolarHBondContact O-CB 3.45Å; S233-N237 VanDerWaalsContact O-CG 3.25Å; S233-N237 PolarHBondContact O-N 3.05Å; S233-D406 PolarHBondContact OG-N 2.94Å
234	Y	90.6	Very high	85	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.012	32%	0.319	C	S	.	.	H	α-helix	trans	-58.7	-44.8	174.7	170	-90.4	0	0	0	112.3	I137 R165 L230 L231 K236 N237 K238 I244 E404 F405	I137-Y234 HydrophobicContact CD1-CD1 3.36Å; I137-Y234 HydrophobicContact CD1-CD2 4.45Å; I137-Y234 HydrophobicContact CD1-CE1 3.53Å; I137-Y234 HydrophobicContact CD1-CG 3.84Å; I137-Y234 HydrophobicContact CG1-CD1 4.15Å; I137-Y234 HydrophobicContact CG1-CE1 3.8Å; R165-Y234 HydrophobicContact CG-CE2 3.7Å; L230-Y234 PolarHBondContact O-N 3.48Å; L231-Y234 PolarHBondContact O-N 2.95Å; Y234-K236 VanDerWaalsContact C-N 3.28Å; Y234-K236 PolarHBondContact O-N 3.08Å; Y234-N237 PolarHBondContact O-N 3.31Å; Y234-K238 HydrophobicContact CE1-CD 4.19Å; Y234-K238 HydrophobicContact CE2-CD 4.01Å; Y234-K238 WeakPolarHBondContact O-CB 3.42Å; Y234-K238 PolarHBondContact O-N 3.39Å; Y234-K238 VanDerWaalsContact OH-CD 3.27Å; Y234-K238 WeakPolarHBondContact OH-CD 3.4Å; Y234-K238 PolarHBondContact OH-NZ 3.38Å; Y234-I244 HydrophobicContact CD1-CD1 4.48Å; Y234-I244 HydrophobicContact CE1-CG2 4.22Å; Y234-E404 VanDerWaalsContact CA-O 3.28Å; Y234-E404 WeakPolarHBondContact CA-O 3.39Å; Y234-E404 HydrophobicContact CD2-CB 3.92Å; Y234-E404 HydrophobicContact CE2-CB 4.42Å; Y234-E404 VanDerWaalsContact CE2-OE2 3.27Å; Y234-E404 WeakPolarHBondContact CE2-OE2 3.25Å; Y234-F405 HydrophobicContact CD2-CE1 4.07Å; Y234-F405 HydrophobicContact CD2-CE2 4.18Å; Y234-F405 AromaticContact CD2-CZ 3.78Å; Y234-F405 HydrophobicContact CD2-CZ 3.78Å; Y234-F405 HydrophobicContact CE2-CZ 4.43Å; Y234-F405 HydrophobicContact CG-CE1 4.08Å; Y234-F405 HydrophobicContact CG-CZ 4.22Å
235	V	88.2	Confident	85.1	Confident	10 Å²	10	59.5 Å²	59.5	6%	0.061	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-39.3	177.6	174.8	0	0	0	0	111.6	L231 G232 S233 A240 I244 K278	L231-V235 WeakPolarHBondContact O-CG2 3.46Å; L231-V235 PolarHBondContact O-N 3.35Å; G232-V235 PolarHBondContact O-N 3.45Å; S233-V235 VanDerWaalsContact C-N 3.35Å; S233-V235 PolarHBondContact O-N 3.02Å; V235-A240 PolarHBondContact O-N 3.05Å; V235-I244 HydrophobicContact CG2-CB 4.38Å; V235-I244 HydrophobicContact CG2-CD1 3.46Å; V235-I244 VanDerWaalsContact CG2-CD1 3.46Å; V235-I244 HydrophobicContact CG2-CG1 3.68Å; V235-I244 HydrophobicContact CG2-CG2 3.8Å; V235-K278 HydrophobicContact CG1-CB 4.4Å; V235-K278 HydrophobicContact CG1-CD 3.78Å
236	K	87.9	Confident	85.1	Confident	163 Å²	163	54.1 Å²	54.1	71%	0.709	29%	0.292	S	S	*	.	H	α-helix	trans	-69	-48.3	177.6	-69.6	172.7	-177	-179.5	0	111.5	G232 S233 Y234 K238 E239	G232-K236 WeakPolarHBondContact O-CG 3.48Å; G232-K236 PolarHBondContact O-N 3.42Å; G232-K236 VanDerWaalsContact O-N 3.15Å; S233-K236 PolarHBondContact O-N 2.84Å; S233-K236 VanDerWaalsContact O-N 3.17Å; Y234-K236 VanDerWaalsContact C-N 3.28Å; Y234-K236 PolarHBondContact O-N 3.08Å; K236-K238 PolarHBondContact O-N 3.01Å; K236-E239 PolarHBondContact O-N 3.07Å
237	N	87	Confident	84.9	Confident	91 Å²	91	54 Å²	54	49%	0.487	29%	0.291	S	S	.	.	H	α-helix	trans	-68.5	-32.9	-174.5	-69.8	-8.7	0	0	0	113	S233 Y234 E239 E404	S233-N237 WeakPolarHBondContact O-CB 3.45Å; S233-N237 VanDerWaalsContact O-CG 3.25Å; S233-N237 PolarHBondContact O-N 3.05Å; Y234-N237 PolarHBondContact O-N 3.31Å; N237-E239 VanDerWaalsContact C-N 3.29Å; N237-E404 PolarHBondContact ND2-O 3.03Å; N237-E404 VanDerWaalsContact ND2-O 3.13Å
238	K	81.1	Confident	84.6	Confident	110 Å²	110	53.2 Å²	53.2	48%	0.478	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-2.3	178.7	-156.8	177	-177.5	176.6	0	113.7	Y234 K236 A240	Y234-K238 HydrophobicContact CE1-CD 4.19Å; Y234-K238 HydrophobicContact CE2-CD 4.01Å; Y234-K238 WeakPolarHBondContact O-CB 3.42Å; Y234-K238 PolarHBondContact O-N 3.39Å; Y234-K238 VanDerWaalsContact OH-CD 3.27Å; Y234-K238 WeakPolarHBondContact OH-CD 3.4Å; Y234-K238 PolarHBondContact OH-NZ 3.38Å; K236-K238 PolarHBondContact O-N 3.01Å; K238-A240 PolarHBondContact O-N 3.12Å
239	E	68.3	Low	84.1	Confident	174 Å²	174	50.3 Å²	50.3	81%	0.813	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	37.9	-168.8	-61.8	-172.4	159.3	0	0	112.2	K236 N237 A241	K236-E239 PolarHBondContact O-N 3.07Å; N237-E239 VanDerWaalsContact C-N 3.29Å; E239-A241 PolarHBondContact O-N 2.97Å
240	A	65.2	Low	83	Confident	28 Å²	28	44 Å²	44	23%	0.231	25%	0.251	C	S	.	.			trans	-64.1	106.7	-176	0	0	0	0	0	108.6	V235 K238 G242 I244	V235-A240 PolarHBondContact O-N 3.05Å; K238-A240 PolarHBondContact O-N 3.12Å; A240-G242 PolarHBondContact O-N 3.49Å; A240-I244 HydrophobicContact CB-CG2 4.34Å
241	A	62.3	Low	81.3	Confident	115 Å²	115	46.5 Å²	46.5	95%	0.95	26%	0.264	S	S	*	.			trans	-64.2	-9.2	-178.2	0	0	0	0	0	113.4	E239	E239-A241 PolarHBondContact O-N 2.97Å
242	G	77.2	Confident	79.1	Confident	43 Å²	43	48.1 Å²	48.1	44%	0.443	27%	0.273	S	S	.	.	S	Bend	trans	-127.5	-179.2	-172.8	0	0	0	0	0	114.9	A240 I244	A240-G242 PolarHBondContact O-N 3.49Å; G242-I244 PolarHBondContact O-N 2.88Å
243	V	84.1	Confident	76.8	Confident	51 Å²	51	51 Å²	51	31%	0.309	28%	0.279	S	S	.	.			trans	-72.7	121.6	175.1	-178.4	0	0	0	0	109.6	K278 R280	V243-K278 CarbonylContact C-O 3.56Å; V243-K278 WeakPolarHBondContact CA-O 3.34Å; V243-R280 HydrophobicContact CG1-CB 4.09Å; V243-R280 HydrophobicContact CG1-CG 3.64Å; V243-R280 VanDerWaalsContact CG1-NE 3.28Å
244	I	87.9	Confident	74.3	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	141.6	173.8	60.1	157.5	0	0	0	110.7	D136 I137 Y234 V235 A240 G242 I246 K278 I279 R280	D136-I244 WeakPolarHBondContact OD2-CA 3.47Å; I137-I244 HydrophobicContact CD1-CD1 3.85Å; Y234-I244 HydrophobicContact CD1-CD1 4.48Å; Y234-I244 HydrophobicContact CE1-CG2 4.22Å; V235-I244 HydrophobicContact CG2-CB 4.38Å; V235-I244 HydrophobicContact CG2-CD1 3.46Å; V235-I244 VanDerWaalsContact CG2-CD1 3.46Å; V235-I244 HydrophobicContact CG2-CG1 3.68Å; V235-I244 HydrophobicContact CG2-CG2 3.8Å; A240-I244 HydrophobicContact CB-CG2 4.34Å; G242-I244 PolarHBondContact O-N 2.88Å; I244-I246 HydrophobicContact CD1-CD1 4.18Å; I244-I246 HydrophobicContact CD1-CG1 4.21Å; I244-K278 VanDerWaalsContact CG1-O 3.26Å; I244-K278 WeakPolarHBondContact CG1-O 3.11Å; I244-K278 PolarHBondContact N-O 3.44Å; I244-I279 HydrophobicContact CD1-CG1 4.12Å; I244-I279 HydrophobicContact CG1-CB 4.48Å; I244-I279 HydrophobicContact CG1-CG1 4.03Å; I244-R280 PolarHBondContact O-N 3.33Å
245	R	89.3	Confident	71.4	Confident	80 Å²	80	57.9 Å²	57.9	30%	0.302	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128	174.7	-65.3	-176.2	-172.8	83.6	-8	110.1	L134 D136 I137 E272 R280 I282	L134-R245 WeakPolarHBondContact O-CB 3.45Å; L134-R245 VanDerWaalsContact O-CD 3.23Å; L134-R245 WeakPolarHBondContact O-CD 3.33Å; D136-R245 PolarHBondContact N-O 3.02Å; D136-R245 PolarHBondContact OD2-N 2.9Å; I137-R245 PolarHBondContact N-O 3.38Å; R245-E272 IonicContact NE-OE1 2.75Å; R245-R280 CarbonylContact C-O 3.58Å; R245-R280 WeakPolarHBondContact CA-O 3.39Å; R245-R280 HydrophobicContact CG-CB 4.47Å; R245-I282 HydrophobicContact CB-CD1 3.77Å; R245-I282 HydrophobicContact CB-CG1 4.3Å; R245-I282 HydrophobicContact CG-CD1 4.42Å
246	I	89.3	Confident	69.2	Low	1 Å²	1	61.6 Å²	61.6	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114.5	-176.4	-58.4	-176.4	0	0	0	108.5	I137 L139 L231 I244 I279 R280 L281 I282	I137-I246 CarbonylContact O-C 3.6Å; I137-I246 VanDerWaalsContact O-CA 3.27Å; I137-I246 WeakPolarHBondContact O-CA 3.42Å; L139-I246 HydrophobicContact CD1-CG2 3.66Å; L139-I246 HydrophobicContact CD2-CG2 4.14Å; L139-I246 HydrophobicContact CG-CG2 3.49Å; L139-I246 VanDerWaalsContact CG-CG2 3.49Å; L231-I246 HydrophobicContact CB-CD1 4.44Å; L231-I246 HydrophobicContact CD1-CD1 3.34Å; L231-I246 HydrophobicContact CD2-CD1 3.71Å; L231-I246 HydrophobicContact CG-CD1 4.01Å; I244-I246 HydrophobicContact CD1-CD1 4.18Å; I244-I246 HydrophobicContact CD1-CG1 4.21Å; I246-I279 HydrophobicContact CD1-CG2 3.31Å; I246-I279 HydrophobicContact CG1-CG2 4.05Å; I246-R280 PolarHBondContact N-O 3.27Å; I246-L281 HydrophobicContact CB-CD1 4.07Å; I246-L281 HydrophobicContact CG2-CD1 3.92Å; I246-L281 CarbonylContact O-C 3.58Å; I246-L281 WeakPolarHBondContact O-CA 3.35Å; I246-I282 PolarHBondContact O-N 3.37Å
247	G	88.1	Confident	66.7	Low	0 Å²	0	59 Å²	59	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	145.3	170.6	0	0	0	0	0	110.5	S135 I137 L138 L139	S135-G247 WeakPolarHBondContact OG-CA 3.33Å; S135-G247 PolarHBondContact OG-N 3Å; S135-G247 VanDerWaalsContact OG-N 3.15Å; I137-G247 PolarHBondContact O-N 3.32Å; L138-G247 CarbonylContact C-O 3.52Å; L138-G247 VanDerWaalsContact CA-O 3.3Å; L138-G247 WeakPolarHBondContact CA-O 3.29Å; L139-G247 PolarHBondContact N-O 3.3Å
248	I	85.3	Confident	64.3	Low	3 Å²	3	55.3 Å²	55.3	2%	0.015	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133	168.1	-61.6	168.3	0	0	0	108.8	L139 I141 R254 I256 L281 I282 S284	L139-I248 HydrophobicContact CB-CG1 4.43Å; L139-I248 HydrophobicContact CD1-CG1 4.47Å; I141-I248 HydrophobicContact CD1-CG2 4.01Å; I141-I248 HydrophobicContact CG1-CG2 3.58Å; I248-R254 PolarHBondContact O-NH2 2.94Å; I248-I256 HydrophobicContact CD1-CD1 3.73Å; I248-L281 HydrophobicContact CD1-CD1 3.69Å; I248-L281 HydrophobicContact CD1-CD2 3.84Å; I248-L281 HydrophobicContact CD1-CG 4.05Å; I248-L281 HydrophobicContact CG1-CD1 3.77Å; I248-L281 HydrophobicContact CG1-CG 4.5Å; I248-I282 PolarHBondContact N-O 2.88Å; I248-S284 PolarHBondContact O-OG 3.17Å
249	V	80.8	Confident	62	Low	2 Å²	2	57 Å²	57	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	164.2	169.9	-64.1	0	0	0	0	109.6	L128 L138 L139 E140 I141 V155 I159	L128-V249 HydrophobicContact CD1-CG1 3.68Å; L138-V249 HydrophobicContact CB-CG2 4.43Å; L138-V249 HydrophobicContact CD1-CG1 4.08Å; L139-V249 PolarHBondContact O-N 2.87Å; E140-V249 WeakPolarHBondContact CA-O 3.47Å; E140-V249 HydrophobicContact CB-CG2 3.87Å; E140-V249 HydrophobicContact CG-CG2 4.27Å; I141-V249 PolarHBondContact N-O 3.13Å; V155-V249 HydrophobicContact CG1-CB 4.29Å; V155-V249 HydrophobicContact CG1-CG1 4.49Å; V155-V249 HydrophobicContact CG1-CG2 4.15Å; I159-V249 HydrophobicContact CD1-CG2 4.2Å
250	G	67.4	Low	60.8	Low	9 Å²	9	50.6 Å²	50.6	9%	0.093	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120.9	167.6	178.2	0	0	0	0	0	114.6	L252	G250-L252 VanDerWaalsContact C-N 3.31Å; G250-L252 PolarHBondContact O-N 2.92Å
251	N	56.6	Low	59.5	Low	51 Å²	51	50.8 Å²	50.8	27%	0.273	29%	0.291	S	S	.	.	S	Bend	trans	-84.3	1.6	-164	-76.2	-40.2	0	0	0	114.6	S150 V287 F305	S150-N251 PolarHBondContact O-ND2 2.83Å; N251-V287 PolarHBondContact OD1-O 3.49Å; N251-F305 HydrophobicContact CB-CE1 3.87Å; N251-F305 VanDerWaalsContact CG-CE1 3.43Å; N251-F305 WeakPolarHBondContact OD1-CE1 3.38Å
252	L	46.1	Very low	58.7	Low	36 Å²	36	49 Å²	49	19%	0.188	28%	0.276	C	S	.	.			trans	-84.3	128.7	-174.9	-141.9	72.4	0	0	0	111.9	I141 N171 G250 R254	I141-L252 HydrophobicContact CG2-CB 4.07Å; I141-L252 HydrophobicContact CG2-CD2 3.88Å; N171-L252 HydrophobicContact CB-CD2 4.48Å; N171-L252 WeakPolarHBondContact ND2-CD2 3.33Å; G250-L252 VanDerWaalsContact C-N 3.31Å; G250-L252 PolarHBondContact O-N 2.92Å; L252-R254 PolarHBondContact O-N 3.02Å
253	K	41.1	Very low	57.4	Low	84 Å²	84	50.9 Å²	50.9	37%	0.365	28%	0.276	S	S	.	.			trans	-60.9	104.3	165.5	-66.9	177.5	-179.4	162.3	0	108	A262	K253-A262 WeakPolarHBondContact CD-O 3.39Å; K253-A262 VanDerWaalsContact CE-O 3.28Å; K253-A262 WeakPolarHBondContact CE-O 3.5Å; K253-A262 PolarHBondContact NZ-O 3.46Å
254	R	36.5	Very low	55.7	Low	25 Å²	25	50.6 Å²	50.6	9%	0.094	28%	0.275	C	S	.	.			trans	-69.3	154	-175.7	-74.3	175.3	-113.5	175.9	-4.5	111.1	I248 L252 V260 D283 S284 P285	I248-R254 PolarHBondContact O-NH2 2.94Å; L252-R254 PolarHBondContact O-N 3.02Å; R254-V260 WeakPolarHBondContact O-CB 3.42Å; R254-V260 WeakPolarHBondContact O-CG1 3.45Å; R254-V260 WeakPolarHBondContact O-CG2 3.44Å; R254-D283 IonicContact CZ-OD1 3.27Å; R254-D283 IonicContact NE-OD1 3.36Å; R254-D283 IonicContact NH1-OD1 3.53Å; R254-D283 PolarHBondContact NH1-OD1 3.29Å; R254-S284 VanDerWaalsContact NH1-N 3.14Å; R254-S284 PolarHBondContact NH1-O 3.13Å; R254-S284 PolarHBondContact NH1-OG 3.31Å; R254-S284 PolarHBondContact NH2-O 3.23Å; R254-S284 VanDerWaalsContact NH2-O 3.07Å; R254-S284 PolarHBondContact NH2-OG 2.93Å; R254-P285 PolarHBondContact NH2-O 2.85Å; R254-P285 VanDerWaalsContact NH2-O 3.08Å
255	K	30.7	Very low	54	Low	135 Å²	135	51.8 Å²	51.8	59%	0.587	29%	0.289	S	S	*	.			trans	-139.1	98.4	145.4	-168.1	162.4	-178.6	-177.7	0	103.7	E203 V260	E203-K255 IonicContact OE2-NZ 3.41Å; E203-K255 PolarHBondContact OE2-NZ 2.95Å; K255-V260 HydrophobicContact CB-CB 4.5Å; K255-V260 HydrophobicContact CB-CG2 3.42Å; K255-V260 VanDerWaalsContact CB-CG2 3.42Å; K255-V260 HydrophobicContact CD-CG2 3.68Å; K255-V260 HydrophobicContact CG-CG2 3.34Å
256	I	41.7	Very low	52.1	Low	87 Å²	87	50.7 Å²	50.7	45%	0.446	29%	0.291	S	S	.	.	S	Bend	trans	-114.7	-58.9	171.2	-61.9	179.4	0	0	0	107.8	I248 L281	I248-I256 HydrophobicContact CD1-CD1 3.73Å; I256-L281 HydrophobicContact CG2-CD2 4.31Å
257	I	36	Very low	50.1	Low	108 Å²	108	51.5 Å²	51.5	55%	0.554	30%	0.296	S	S	*	.	S	Bend	trans	-140.1	-27.2	174.6	-67.9	167.2	0	0	0	112.3	V273	I257-V273 HydrophobicContact CD1-CB 4.26Å; I257-V273 HydrophobicContact CD1-CG1 3.36Å; I257-V273 HydrophobicContact CD1-CG2 4.18Å; I257-V273 HydrophobicContact CG2-CG2 4.48Å
258	C	34.7	Very low	48.4	Very low	14 Å²	14	61.9 Å²	61.9	10%	0.095	34%	0.335	C	S	.	.	S	Bend	trans	-80.9	157.3	-178.6	-58.8	0	0	0	0	113.2	V260 Q271 D283	C258-V260 VanDerWaalsContact O-CG1 3.26Å; C258-V260 WeakPolarHBondContact O-CG1 3.43Å; C258-V260 PolarHBondContact O-N 3.34Å; C258-Q271 PolarHBondContact SG-OE1 3.49Å; C258-Q271 VanDerWaalsContact SG-OE1 3.35Å; C258-D283 VanDerWaalsContact CB-OD2 3.32Å; C258-D283 WeakPolarHBondContact CB-OD2 3.49Å; C258-D283 PolarHBondContact SG-OD2 2.85Å
259	D	34.2	Very low	47	Very low	147 Å²	147	66 Å²	66	79%	0.786	36%	0.36	S	S	*	.			trans	-57.2	128	174	-166.5	17.4	0	0	0	109.6	V266	D259-V266 VanDerWaalsContact O-CG1 3.24Å; D259-V266 WeakPolarHBondContact O-CG1 3.48Å
260	V	42.1	Very low	46.2	Very low	39 Å²	39	67.6 Å²	67.6	24%	0.236	37%	0.37	C	S	.	.			trans	-140.5	142.8	-169.8	-71.7	0	0	0	0	111.8	R254 K255 C258	R254-V260 WeakPolarHBondContact O-CB 3.42Å; R254-V260 WeakPolarHBondContact O-CG1 3.45Å; R254-V260 WeakPolarHBondContact O-CG2 3.44Å; K255-V260 HydrophobicContact CB-CB 4.5Å; K255-V260 HydrophobicContact CB-CG2 3.42Å; K255-V260 VanDerWaalsContact CB-CG2 3.42Å; K255-V260 HydrophobicContact CD-CG2 3.68Å; K255-V260 HydrophobicContact CG-CG2 3.34Å; C258-V260 VanDerWaalsContact O-CG1 3.26Å; C258-V260 WeakPolarHBondContact O-CG1 3.43Å; C258-V260 PolarHBondContact O-N 3.34Å
261	G	37.4	Very low	46.2	Very low	32 Å²	32	71.4 Å²	71.4	33%	0.33	39%	0.386	S	S	.	.			trans	-131.5	159.8	-178.2	0	0	0	0	0	111.2	N263	G261-N263 PolarHBondContact O-N 3.1Å
262	A	45.9	Very low	47	Very low	78 Å²	78	73.3 Å²	73.3	65%	0.645	39%	0.393	S	S	*	.	S	Bend	trans	-67.2	16.1	175.2	0	0	0	0	0	113.6	K253	K253-A262 WeakPolarHBondContact CD-O 3.39Å; K253-A262 VanDerWaalsContact CE-O 3.28Å; K253-A262 WeakPolarHBondContact CE-O 3.5Å; K253-A262 PolarHBondContact NZ-O 3.46Å
263	N	49.9	Very low	48.5	Very low	81 Å²	81	73 Å²	73	43%	0.433	39%	0.392	S	S	.	.	S	Bend	trans	-121.6	141.6	-175.8	-65.7	29.2	0	0	0	108.8	G261 V266	G261-N263 PolarHBondContact O-N 3.1Å; N263-V266 WeakPolarHBondContact O-CG2 3.18Å
264	P	49.5	Very low	50.1	Low	45 Å²	45	75.4 Å²	75.4	29%	0.292	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	151.5	168.7	26.1	-33	0	0	0	111	I288	P264-I288 HydrophobicContact CB-CD1 4.25Å
265	G	52.4	Low	51.9	Low	31 Å²	31	78 Å²	78	32%	0.32	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	22.1	176.4	0	0	0	0	0	116.5
266	V	47.9	Very low	54	Low	56 Å²	56	75.6 Å²	75.6	34%	0.339	41%	0.414	S	S	.	.			trans	-76.5	-50.2	179.7	-178.5	0	0	0	0	111.9	D259 N263 R268	D259-V266 VanDerWaalsContact O-CG1 3.24Å; D259-V266 WeakPolarHBondContact O-CG1 3.48Å; N263-V266 WeakPolarHBondContact O-CG2 3.18Å; V266-R268 PolarHBondContact O-N 3.04Å
267	T	48.9	Very low	55.9	Low	19 Å²	19	79.1 Å²	79.1	12%	0.117	43%	0.428	C	S	.	.			trans	-78	106.5	171.5	-50.5	0	0	0	0	108.9	T269 P285	T267-T269 WeakPolarHBondContact CG2-O 3.11Å; T267-P285 WeakPolarHBondContact O-CA 3.34Å; T267-P285 WeakPolarHBondContact O-CB 3.46Å; T267-P285 WeakPolarHBondContact O-CG 3.44Å
268	R	52	Low	58.1	Low	218 Å²	218	79.6 Å²	79.6	82%	0.823	43%	0.426	S	S	*	.			trans	-100	-22.4	-180	-66.6	-177	179	-176.1	-4.2	113.7	V266	V266-R268 PolarHBondContact O-N 3.04Å
269	T	56.1	Low	60.4	Low	88 Å²	88	79 Å²	79	54%	0.54	42%	0.423	S	S	.	.	S	Bend	trans	-116.3	137.6	-178.9	53.4	0	0	0	0	109.9	T267	T267-T269 WeakPolarHBondContact CG2-O 3.11Å
270	V	64.3	Low	62.9	Low	37 Å²	37	75.3 Å²	75.3	22%	0.224	40%	0.397	C	S	.	.			trans	-70.4	127.4	173.6	179.4	0	0	0	0	108.4	V131 L134 I282 D283	V131-V270 HydrophobicContact CG2-CG2 4.29Å; L134-V270 HydrophobicContact CD1-CG1 4.49Å; V270-I282 HydrophobicContact CG1-CG2 3.34Å; V270-D283 WeakPolarHBondContact CA-O 3.49Å
271	Q	66.9	Low	64.9	Low	89 Å²	89	73.8 Å²	73.8	42%	0.416	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.9	177.9	-62.4	-173.5	7.6	0	0	110.4	C258 I282 D283	C258-Q271 PolarHBondContact SG-OE1 3.49Å; C258-Q271 VanDerWaalsContact SG-OE1 3.35Å; Q271-I282 CarbonylContact O-C 3.56Å; Q271-I282 WeakPolarHBondContact O-CA 3.37Å; Q271-D283 PolarHBondContact N-O 3.08Å; Q271-D283 VanDerWaalsContact N-O 3.08Å; Q271-D283 PolarHBondContact O-N 2.8Å
272	E	73.5	Confident	66.8	Low	91 Å²	91	72.3 Å²	72.3	43%	0.425	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132	171.6	-70.2	-168.5	-175.1	0	0	110.2	R245 R280 L281 I282	R245-E272 IonicContact NE-OE1 2.75Å; E272-R280 IonicContact OE2-CZ 2.96Å; E272-R280 IonicContact OE2-NE 3.23Å; E272-R280 IonicContact OE2-NH1 3.86Å; E272-R280 PolarHBondContact OE2-NH1 3.5Å; E272-L281 CarbonylContact C-O 3.59Å; E272-L281 WeakPolarHBondContact CA-O 3.39Å; E272-I282 HydrophobicContact CG-CG1 4.17Å
273	V	76.3	Confident	67.9	Low	28 Å²	28	68.8 Å²	68.8	17%	0.17	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.6	174.3	-177.2	0	0	0	0	108.5	I257 L275 R280 L281	I257-V273 HydrophobicContact CD1-CB 4.26Å; I257-V273 HydrophobicContact CD1-CG1 3.36Å; I257-V273 HydrophobicContact CD1-CG2 4.18Å; I257-V273 HydrophobicContact CG2-CG2 4.48Å; V273-L275 HydrophobicContact CG1-CD2 4.43Å; V273-L275 PolarHBondContact O-N 2.98Å; V273-R280 CarbonylContact O-C 3.55Å; V273-R280 WeakPolarHBondContact O-CA 3.45Å; V273-L281 HydrophobicContact CB-CB 4.44Å; V273-L281 PolarHBondContact N-O 2.93Å; V273-L281 PolarHBondContact O-N 3.24Å
274	Q	74.3	Confident	68.5	Low	136 Å²	136	65 Å²	65	64%	0.636	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	122.6	171.2	-171.2	172.6	-4.4	0	0	110.4	D276 R280	Q274-D276 WeakPolarHBondContact CG-O 3.21Å; Q274-D276 PolarHBondContact NE2-O 3.06Å; Q274-R280 HydrophobicContact CB-CG 4.49Å
275	L	74.3	Confident	68.7	Low	79 Å²	79	63.3 Å²	63.3	41%	0.414	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-39.1	176.1	-63.4	-177.3	0	0	0	111.8	V273 I279 L281	V273-L275 HydrophobicContact CG1-CD2 4.43Å; V273-L275 PolarHBondContact O-N 2.98Å; L275-I279 HydrophobicContact CB-CG2 4.29Å; L275-I279 HydrophobicContact CD1-CG2 4.32Å; L275-I279 PolarHBondContact N-O 3.48Å; L275-L281 HydrophobicContact CD1-CB 3.82Å; L275-L281 HydrophobicContact CD1-CD1 4.24Å; L275-L281 HydrophobicContact CD1-CD2 4.28Å; L275-L281 HydrophobicContact CD1-CG 4.36Å; L275-L281 HydrophobicContact CD2-CB 4.37Å; L275-L281 HydrophobicContact CD2-CD2 4.42Å; L275-L281 HydrophobicContact CG-CB 3.89Å
276	D	75.6	Confident	68.7	Low	85 Å²	85	63.3 Å²	63.3	46%	0.455	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	172.3	179.5	-165.3	2.2	0	0	0	109.4	Q274 K278 I279	Q274-D276 WeakPolarHBondContact CG-O 3.21Å; Q274-D276 PolarHBondContact NE2-O 3.06Å; D276-K278 PolarHBondContact O-N 2.9Å; D276-I279 HydrophobicContact CB-CB 3.98Å; D276-I279 HydrophobicContact CB-CD1 4.4Å; D276-I279 HydrophobicContact CB-CG1 4.21Å; D276-I279 PolarHBondContact N-O 3.3Å; D276-I279 VanDerWaalsContact N-O 3.13Å; D276-I279 PolarHBondContact O-N 2.85Å; D276-I279 VanDerWaalsContact O-O 3.13Å
277	Q	81.4	Confident	68.9	Low	160 Å²	160	61 Å²	61	75%	0.748	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-37	178.2	-64.4	-176.3	-1.8	0	0	112.4
278	K	82.3	Confident	69	Low	118 Å²	118	61.2 Å²	61.2	51%	0.513	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	0.3	-179.5	-61.1	-169.6	-179.6	-173.3	0	113.9	V235 V243 I244 D276	V235-K278 HydrophobicContact CG1-CB 4.4Å; V235-K278 HydrophobicContact CG1-CD 3.78Å; V243-K278 CarbonylContact C-O 3.56Å; V243-K278 WeakPolarHBondContact CA-O 3.34Å; I244-K278 VanDerWaalsContact CG1-O 3.26Å; I244-K278 WeakPolarHBondContact CG1-O 3.11Å; I244-K278 PolarHBondContact N-O 3.44Å; D276-K278 PolarHBondContact O-N 2.9Å
279	I	84	Confident	68.8	Low	3 Å²	3	52.2 Å²	52.2	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.1	-172.5	-54.6	-179.7	0	0	0	111.3	L228 L231 I244 I246 L275 D276	L228-I279 HydrophobicContact CD2-CD1 4.13Å; L231-I279 HydrophobicContact CB-CD1 4.04Å; I244-I279 HydrophobicContact CD1-CG1 4.12Å; I244-I279 HydrophobicContact CG1-CB 4.48Å; I244-I279 HydrophobicContact CG1-CG1 4.03Å; I246-I279 HydrophobicContact CD1-CG2 3.31Å; I246-I279 HydrophobicContact CG1-CG2 4.05Å; L275-I279 HydrophobicContact CB-CG2 4.29Å; L275-I279 HydrophobicContact CD1-CG2 4.32Å; L275-I279 PolarHBondContact N-O 3.48Å; D276-I279 HydrophobicContact CB-CB 3.98Å; D276-I279 HydrophobicContact CB-CD1 4.4Å; D276-I279 HydrophobicContact CB-CG1 4.21Å; D276-I279 PolarHBondContact N-O 3.3Å; D276-I279 VanDerWaalsContact N-O 3.13Å; D276-I279 PolarHBondContact O-N 2.85Å; D276-I279 VanDerWaalsContact O-O 3.13Å
280	R	85.8	Confident	68.3	Low	68 Å²	68	49 Å²	49	26%	0.257	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.8	169.4	-79.1	-175	-70.5	-179.9	-16.8	110.9	V243 I244 R245 I246 E272 V273 Q274	V243-R280 HydrophobicContact CG1-CB 4.09Å; V243-R280 HydrophobicContact CG1-CG 3.64Å; V243-R280 VanDerWaalsContact CG1-NE 3.28Å; I244-R280 PolarHBondContact O-N 3.33Å; R245-R280 CarbonylContact C-O 3.58Å; R245-R280 WeakPolarHBondContact CA-O 3.39Å; R245-R280 HydrophobicContact CG-CB 4.47Å; I246-R280 PolarHBondContact N-O 3.27Å; E272-R280 IonicContact OE2-CZ 2.96Å; E272-R280 IonicContact OE2-NE 3.23Å; E272-R280 IonicContact OE2-NH1 3.86Å; E272-R280 PolarHBondContact OE2-NH1 3.5Å; V273-R280 CarbonylContact O-C 3.55Å; V273-R280 WeakPolarHBondContact O-CA 3.45Å; Q274-R280 HydrophobicContact CB-CG 4.49Å
281	L	84	Confident	67.2	Low	8 Å²	8	54.3 Å²	54.3	4%	0.042	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.4	175.6	-169.6	70.8	0	0	0	110.2	I246 I248 I256 E272 V273 L275	I246-L281 HydrophobicContact CB-CD1 4.07Å; I246-L281 HydrophobicContact CG2-CD1 3.92Å; I246-L281 CarbonylContact O-C 3.58Å; I246-L281 WeakPolarHBondContact O-CA 3.35Å; I248-L281 HydrophobicContact CD1-CD1 3.69Å; I248-L281 HydrophobicContact CD1-CD2 3.84Å; I248-L281 HydrophobicContact CD1-CG 4.05Å; I248-L281 HydrophobicContact CG1-CD1 3.77Å; I248-L281 HydrophobicContact CG1-CG 4.5Å; I256-L281 HydrophobicContact CG2-CD2 4.31Å; E272-L281 CarbonylContact C-O 3.59Å; E272-L281 WeakPolarHBondContact CA-O 3.39Å; V273-L281 HydrophobicContact CB-CB 4.44Å; V273-L281 PolarHBondContact N-O 2.93Å; V273-L281 PolarHBondContact O-N 3.24Å; L275-L281 HydrophobicContact CD1-CB 3.82Å; L275-L281 HydrophobicContact CD1-CD1 4.24Å; L275-L281 HydrophobicContact CD1-CD2 4.28Å; L275-L281 HydrophobicContact CD1-CG 4.36Å; L275-L281 HydrophobicContact CD2-CB 4.37Å; L275-L281 HydrophobicContact CD2-CD2 4.42Å; L275-L281 HydrophobicContact CG-CB 3.89Å
282	I	78.2	Confident	66	Low	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	105.6	169.5	-61	171.7	0	0	0	107.3	V131 L134 S135 R245 I246 I248 V270 Q271 E272 S284	V131-I282 HydrophobicContact CG1-CG2 4.45Å; L134-I282 HydrophobicContact CB-CD1 3.58Å; L134-I282 WeakPolarHBondContact O-CD1 3.48Å; S135-I282 WeakPolarHBondContact OG-CD1 3.46Å; R245-I282 HydrophobicContact CB-CD1 3.77Å; R245-I282 HydrophobicContact CB-CG1 4.3Å; R245-I282 HydrophobicContact CG-CD1 4.42Å; I246-I282 PolarHBondContact O-N 3.37Å; I248-I282 PolarHBondContact N-O 2.88Å; V270-I282 HydrophobicContact CG1-CG2 3.34Å; Q271-I282 CarbonylContact O-C 3.56Å; Q271-I282 WeakPolarHBondContact O-CA 3.37Å; E272-I282 HydrophobicContact CG-CG1 4.17Å; I282-S284 PolarHBondContact O-N 3.05Å
283	D	67.6	Low	64.7	Low	4 Å²	4	57.5 Å²	57.5	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	114.3	170.7	-164.4	30	0	0	0	110	R254 C258 V270 Q271	R254-D283 IonicContact CZ-OD1 3.27Å; R254-D283 IonicContact NE-OD1 3.36Å; R254-D283 IonicContact NH1-OD1 3.53Å; R254-D283 PolarHBondContact NH1-OD1 3.29Å; C258-D283 VanDerWaalsContact CB-OD2 3.32Å; C258-D283 WeakPolarHBondContact CB-OD2 3.49Å; C258-D283 PolarHBondContact SG-OD2 2.85Å; V270-D283 WeakPolarHBondContact CA-O 3.49Å; Q271-D283 PolarHBondContact N-O 3.08Å; Q271-D283 VanDerWaalsContact N-O 3.08Å; Q271-D283 PolarHBondContact O-N 2.8Å
284	S	62.8	Low	63.4	Low	1 Å²	1	59.5 Å²	59.5	1%	0.007	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-100.5	164.7	178.8	63.4	0	0	0	0	113.2	I248 R254 I282	I248-S284 PolarHBondContact O-OG 3.17Å; R254-S284 VanDerWaalsContact NH1-N 3.14Å; R254-S284 PolarHBondContact NH1-O 3.13Å; R254-S284 PolarHBondContact NH1-OG 3.31Å; R254-S284 PolarHBondContact NH2-O 3.23Å; R254-S284 VanDerWaalsContact NH2-O 3.07Å; R254-S284 PolarHBondContact NH2-OG 2.93Å; I282-S284 PolarHBondContact O-N 3.05Å
285	P	53.5	Low	62.2	Low	10 Å²	10	55.6 Å²	55.6	7%	0.065	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-57	147.2	159.4	-16.6	29.2	0	0	0	110.9	F124 A127 R254 T267 V287	F124-P285 HydrophobicContact CD1-CB 4.3Å; F124-P285 HydrophobicContact CE1-CB 4.24Å; A127-P285 HydrophobicContact CB-CG 3.89Å; R254-P285 PolarHBondContact NH2-O 2.85Å; R254-P285 VanDerWaalsContact NH2-O 3.08Å; T267-P285 WeakPolarHBondContact O-CA 3.34Å; T267-P285 WeakPolarHBondContact O-CB 3.46Å; T267-P285 WeakPolarHBondContact O-CG 3.44Å; P285-V287 PolarHBondContact O-N 3.45Å
286	G	53.5	Low	61.2	Low	31 Å²	31	55.6 Å²	55.6	32%	0.32	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-60	136.7	166.1	0	0	0	0	0	110.1	F124	F124-G286 WeakPolarHBondContact CD1-O 3.47Å; F124-G286 WeakPolarHBondContact CE1-O 3.43Å
287	V	51.7	Low	60.1	Low	6 Å²	6	53.1 Å²	53.1	4%	0.036	30%	0.3	C	S	.	.			trans	-105.3	125.9	-177.4	-176.1	0	0	0	0	107.8	L128 N251 P285 M289	L128-V287 HydrophobicContact CB-CG1 3.98Å; L128-V287 HydrophobicContact CB-CG2 3.86Å; L128-V287 HydrophobicContact CD1-CB 4.46Å; L128-V287 HydrophobicContact CD1-CG1 4.31Å; L128-V287 HydrophobicContact CD1-CG2 3.88Å; L128-V287 HydrophobicContact CD2-CG1 4.07Å; L128-V287 HydrophobicContact CG-CG1 4.31Å; L128-V287 HydrophobicContact CG-CG2 4.39Å; N251-V287 PolarHBondContact OD1-O 3.49Å; P285-V287 PolarHBondContact O-N 3.45Å; V287-M289 HydrophobicContact CG1-CG 3.89Å; V287-M289 HydrophobicContact CG1-SD 3.73Å
288	I	50.2	Low	58.5	Low	24 Å²	24	46.3 Å²	46.3	12%	0.123	27%	0.269	C	S	.	.			trans	-109.9	107.4	170.5	-60.5	160.2	0	0	0	105.7	P264 F305	P264-I288 HydrophobicContact CB-CD1 4.25Å; I288-F305 HydrophobicContact CB-CD1 4.47Å; I288-F305 HydrophobicContact CD1-CB 3.84Å; I288-F305 HydrophobicContact CD1-CD1 4.27Å; I288-F305 HydrophobicContact CD1-CG 4.44Å; I288-F305 WeakPolarHBondContact CD1-O 3.42Å; I288-F305 HydrophobicContact CG1-CB 4.21Å; I288-F305 HydrophobicContact CG1-CD1 3.84Å; I288-F305 HydrophobicContact CG1-CG 4.29Å; I288-F305 HydrophobicContact CG2-CB 3.73Å; I288-F305 HydrophobicContact CG2-CD1 3.92Å; I288-F305 HydrophobicContact CG2-CD2 4.19Å; I288-F305 HydrophobicContact CG2-CG 3.7Å
289	M	48	Very low	57	Low	29 Å²	29	44.6 Å²	44.6	14%	0.143	26%	0.263	C	S	.	.			trans	-95.8	91.8	165.2	-54.9	-59.5	-97.4	0	0	106.1	T125 L128 Q154 V155 M158 V287	T125-M289 HydrophobicContact CG2-CE 4.4Å; L128-M289 HydrophobicContact CD2-CE 4.01Å; L128-M289 HydrophobicContact CD2-SD 4.25Å; Q154-M289 HydrophobicContact CG-CE 4.28Å; V155-M289 HydrophobicContact CG2-CG 3.62Å; M158-M289 HydrophobicContact CE-CE 4.37Å; V287-M289 HydrophobicContact CG1-CG 3.89Å; V287-M289 HydrophobicContact CG1-SD 3.73Å
290	A	45.2	Very low	55.6	Low	22 Å²	22	44.9 Å²	44.9	18%	0.182	27%	0.265	C	S	.	.			trans	-72.5	125.4	160.3	0	0	0	0	0	105.6	D292 L300	A290-D292 PolarHBondContact O-N 2.96Å; A290-D292 VanDerWaalsContact O-N 3.15Å; A290-L300 HydrophobicContact CB-CD2 3.72Å
291	K	41.8	Very low	54	Low	148 Å²	148	41.9 Å²	41.9	64%	0.643	25%	0.254	S	S	*	.			trans	-55.7	123.9	163.5	-99.5	-177.7	178.4	-179.5	0	106.3	G293 S294	K291-G293 PolarHBondContact O-N 3.08Å; K291-S294 WeakPolarHBondContact CB-OG 3.46Å; K291-S294 PolarHBondContact O-N 3.4Å
292	D	42.9	Very low	52.4	Low	163 Å²	163	43.3 Å²	43.3	87%	0.872	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	107.7	177.5	-56	-33.2	0	0	0	108.9	A290 S294	A290-D292 PolarHBondContact O-N 2.96Å; A290-D292 VanDerWaalsContact O-N 3.15Å; D292-S294 PolarHBondContact O-N 3.06Å
293	G	45.7	Very low	51.1	Low	83 Å²	83	47.4 Å²	47.4	86%	0.856	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	-3.6	177.2	0	0	0	0	0	118.5	K291	K291-G293 PolarHBondContact O-N 3.08Å
294	S	47.9	Very low	50.3	Low	70 Å²	70	48.5 Å²	48.5	49%	0.49	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-22.6	-176.7	93	0	0	0	0	115.3	K291 D292	K291-S294 WeakPolarHBondContact CB-OG 3.46Å; K291-S294 PolarHBondContact O-N 3.4Å; D292-S294 PolarHBondContact O-N 3.06Å
295	M	50.2	Low	49.6	Very low	55 Å²	55	49.6 Å²	49.6	27%	0.271	29%	0.29	S	S	.	.	S	Bend	trans	-112.2	127.6	176.6	-66.8	-166.9	-177.9	0	0	109.1	E299 L300 K303 F305	M295-E299 WeakPolarHBondContact CA-OE2 3.45Å; M295-E299 HydrophobicContact CB-CB 4.18Å; M295-E299 WeakPolarHBondContact CB-OE2 3.4Å; M295-E299 VanDerWaalsContact CG-OE2 3.23Å; M295-E299 WeakPolarHBondContact CG-OE2 3.27Å; M295-L300 HydrophobicContact CB-CD2 3.89Å; M295-L300 HydrophobicContact CB-CG 4Å; M295-L300 HydrophobicContact SD-CD2 4.17Å; M295-K303 HydrophobicContact CE-CD 4.43Å; M295-K303 HydrophobicContact SD-CD 4.23Å; M295-F305 HydrophobicContact SD-CE2 4.05Å
296	D	53.4	Low	49.3	Very low	79 Å²	79	50.1 Å²	50.1	42%	0.422	29%	0.292	S	S	.	.			trans	-68.8	164.6	173.9	87.1	-18.1	0	0	0	110.9	T298 E299 L300	D296-T298 PolarHBondContact O-N 3.44Å; D296-T298 WeakPolarHBondContact OD1-CA 3.32Å; D296-T298 WeakPolarHBondContact OD1-CB 3.45Å; D296-T298 PolarHBondContact OD1-N 3.18Å; D296-T298 WeakPolarHBondContact OD2-CB 3.41Å; D296-T298 PolarHBondContact OD2-OG1 2.91Å; D296-E299 PolarHBondContact O-N 2.9Å; D296-E299 WeakPolarHBondContact OD1-CB 3.35Å; D296-E299 WeakPolarHBondContact OD1-CG 3.49Å; D296-E299 PolarHBondContact OD1-N 2.78Å; D296-L300 WeakPolarHBondContact O-CG 3.46Å; D296-L300 PolarHBondContact O-N 2.82Å; D296-L300 VanDerWaalsContact O-N 3.11Å
297	A	51.2	Low	48.9	Very low	32 Å²	32	55.4 Å²	55.4	26%	0.264	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-22.2	178.6	0	0	0	0	0	112.8	I113 A301	I113-A297 HydrophobicContact CG2-CB 4.31Å; A297-A301 VanDerWaalsContact O-CB 3.3Å; A297-A301 WeakPolarHBondContact O-CB 3.47Å; A297-A301 PolarHBondContact O-N 3.5Å
298	T	49.5	Very low	48.9	Very low	17 Å²	17	57.4 Å²	57.4	10%	0.104	32%	0.315	C	S	.	.	H	α-helix	trans	-73.1	-51.9	179.6	-45.3	0	0	0	0	111.3	D296 L300 A301 L302 T315 A316	D296-T298 PolarHBondContact O-N 3.44Å; D296-T298 WeakPolarHBondContact OD1-CA 3.32Å; D296-T298 WeakPolarHBondContact OD1-CB 3.45Å; D296-T298 PolarHBondContact OD1-N 3.18Å; D296-T298 WeakPolarHBondContact OD2-CB 3.41Å; D296-T298 PolarHBondContact OD2-OG1 2.91Å; T298-L300 VanDerWaalsContact C-N 3.31Å; T298-L300 PolarHBondContact O-N 2.94Å; T298-A301 CarbonylContact O-C 3.54Å; T298-A301 WeakPolarHBondContact O-CA 3.28Å; T298-A301 WeakPolarHBondContact O-CB 3.14Å; T298-A301 PolarHBondContact O-N 3.48Å; T298-A301 VanDerWaalsContact O-N 3.08Å; T298-L302 HydrophobicContact CG2-CD1 4.43Å; T298-L302 WeakPolarHBondContact O-CB 3.46Å; T298-L302 WeakPolarHBondContact O-CG 3.34Å; T298-L302 PolarHBondContact O-N 2.96Å; T298-T315 VanDerWaalsContact CG2-OG1 3.27Å; T298-T315 WeakPolarHBondContact CG2-OG1 3.38Å; T298-T315 PolarHBondContact OG1-OG1 3.48Å; T298-T315 VanDerWaalsContact OG1-OG1 3.05Å; T298-A316 HydrophobicContact CG2-CB 3.66Å
299	E	50.5	Low	49	Very low	82 Å²	82	59.3 Å²	59.3	38%	0.383	33%	0.325	S	S	.	.	H	α-helix	trans	-58.8	-45	174.9	-75.7	-178.8	-174	0	0	110.4	M295 D296 A301 L302 K303	M295-E299 WeakPolarHBondContact CA-OE2 3.45Å; M295-E299 HydrophobicContact CB-CB 4.18Å; M295-E299 WeakPolarHBondContact CB-OE2 3.4Å; M295-E299 VanDerWaalsContact CG-OE2 3.23Å; M295-E299 WeakPolarHBondContact CG-OE2 3.27Å; D296-E299 PolarHBondContact O-N 2.9Å; D296-E299 WeakPolarHBondContact OD1-CB 3.35Å; D296-E299 WeakPolarHBondContact OD1-CG 3.49Å; D296-E299 PolarHBondContact OD1-N 2.78Å; E299-A301 VanDerWaalsContact C-N 3.27Å; E299-A301 PolarHBondContact O-N 2.96Å; E299-L302 PolarHBondContact O-N 3.46Å; E299-K303 WeakPolarHBondContact O-CB 3.46Å; E299-K303 WeakPolarHBondContact O-CG 3.49Å; E299-K303 PolarHBondContact O-N 2.82Å
300	L	54.1	Low	49.1	Very low	10 Å²	10	63.6 Å²	63.6	5%	0.052	34%	0.343	C	S	.	.	H	α-helix	trans	-60.4	-39.7	175.1	-64.3	173.6	0	0	0	111.2	L117 A290 M295 D296 T298 N304 F305 I306	L117-L300 HydrophobicContact CD1-CD1 4.24Å; A290-L300 HydrophobicContact CB-CD2 3.72Å; M295-L300 HydrophobicContact CB-CD2 3.89Å; M295-L300 HydrophobicContact CB-CG 4Å; M295-L300 HydrophobicContact SD-CD2 4.17Å; D296-L300 WeakPolarHBondContact O-CG 3.46Å; D296-L300 PolarHBondContact O-N 2.82Å; D296-L300 VanDerWaalsContact O-N 3.11Å; T298-L300 VanDerWaalsContact C-N 3.31Å; T298-L300 PolarHBondContact O-N 2.94Å; L300-N304 PolarHBondContact O-N 3.36Å; L300-F305 HydrophobicContact CB-CB 4.23Å; L300-F305 HydrophobicContact CB-CD2 4.36Å; L300-F305 HydrophobicContact CD2-CB 4.27Å; L300-F305 HydrophobicContact CD2-CD2 3.55Å; L300-F305 HydrophobicContact CD2-CE2 4.36Å; L300-F305 HydrophobicContact CD2-CG 4.35Å; L300-F305 WeakPolarHBondContact O-CA 3.46Å; L300-F305 VanDerWaalsContact O-CB 3.26Å; L300-F305 WeakPolarHBondContact O-CB 3.23Å; L300-F305 PolarHBondContact O-N 2.99Å; L300-I306 HydrophobicContact CB-CD1 3.45Å; L300-I306 VanDerWaalsContact CB-CD1 3.45Å; L300-I306 HydrophobicContact CB-CG1 3.89Å; L300-I306 HydrophobicContact CD1-CD1 3.77Å; L300-I306 HydrophobicContact CG-CD1 4.26Å; L300-I306 PolarHBondContact O-N 3.07Å
301	A	51.6	Low	49.4	Very low	4 Å²	4	63 Å²	63	3%	0.033	34%	0.338	C	S	.	.	H	α-helix	trans	-67.2	-48.7	173.7	0	0	0	0	0	111.2	A297 T298 E299 K303 N304 A311 K368	A297-A301 VanDerWaalsContact O-CB 3.3Å; A297-A301 WeakPolarHBondContact O-CB 3.47Å; A297-A301 PolarHBondContact O-N 3.5Å; T298-A301 CarbonylContact O-C 3.54Å; T298-A301 WeakPolarHBondContact O-CA 3.28Å; T298-A301 WeakPolarHBondContact O-CB 3.14Å; T298-A301 PolarHBondContact O-N 3.48Å; T298-A301 VanDerWaalsContact O-N 3.08Å; E299-A301 VanDerWaalsContact C-N 3.27Å; E299-A301 PolarHBondContact O-N 2.96Å; A301-K303 PolarHBondContact O-N 2.73Å; A301-N304 VanDerWaalsContact O-CA 3.25Å; A301-N304 WeakPolarHBondContact O-CA 3.45Å; A301-N304 PolarHBondContact O-N 3.45Å; A301-A311 HydrophobicContact CB-CB 3.43Å; A301-A311 VanDerWaalsContact CB-CB 3.43Å; A301-K368 VanDerWaalsContact C-NZ 3.26Å; A301-K368 WeakPolarHBondContact O-CE 3.38Å; A301-K368 PolarHBondContact O-NZ 3.35Å
302	L	50.2	Low	50	Low	39 Å²	39	60.7 Å²	60.7	20%	0.204	33%	0.333	C	S	.	.	H	α-helix	trans	-56.4	-47.1	-178.6	-80.2	177.4	0	0	0	112.5	T298 E299 N304 A316 A319 I320	T298-L302 HydrophobicContact CG2-CD1 4.43Å; T298-L302 WeakPolarHBondContact O-CB 3.46Å; T298-L302 WeakPolarHBondContact O-CG 3.34Å; T298-L302 PolarHBondContact O-N 2.96Å; E299-L302 PolarHBondContact O-N 3.46Å; L302-N304 PolarHBondContact O-N 3.46Å; L302-N304 VanDerWaalsContact O-N 3.13Å; L302-A316 HydrophobicContact CD1-CB 4.2Å; L302-A316 WeakPolarHBondContact CD1-O 3.3Å; L302-A316 HydrophobicContact CD2-CB 3.58Å; L302-A316 WeakPolarHBondContact CD2-O 3.45Å; L302-A316 HydrophobicContact CG-CB 3.76Å; L302-A319 HydrophobicContact CD1-CB 3.88Å; L302-I320 HydrophobicContact CD1-CG1 4.45Å; L302-I320 HydrophobicContact CD2-CD1 3.46Å; L302-I320 VanDerWaalsContact CD2-CD1 3.46Å; L302-I320 HydrophobicContact CD2-CG1 4.06Å
303	K	51.2	Low	50.6	Low	87 Å²	87	53.6 Å²	53.6	38%	0.378	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	0.7	173.6	-64.5	-175	175.2	-170.8	0	113.4	M295 E299 A301 F305	M295-K303 HydrophobicContact CE-CD 4.43Å; M295-K303 HydrophobicContact SD-CD 4.23Å; E299-K303 WeakPolarHBondContact O-CB 3.46Å; E299-K303 WeakPolarHBondContact O-CG 3.49Å; E299-K303 PolarHBondContact O-N 2.82Å; A301-K303 PolarHBondContact O-N 2.73Å; K303-F305 VanDerWaalsContact C-N 3.3Å; K303-F305 HydrophobicContact CB-CD1 4.33Å; K303-F305 HydrophobicContact CB-CD2 3.68Å; K303-F305 HydrophobicContact CB-CE1 4.05Å; K303-F305 HydrophobicContact CB-CE2 3.39Å; K303-F305 HydrophobicContact CB-CG 4.16Å; K303-F305 HydrophobicContact CB-CZ 3.59Å; K303-F305 HydrophobicContact CD-CD2 4.42Å; K303-F305 HydrophobicContact CD-CE2 3.48Å; K303-F305 VanDerWaalsContact CD-CE2 3.48Å; K303-F305 HydrophobicContact CD-CZ 3.82Å; K303-F305 HydrophobicContact CG-CE2 4.03Å; K303-F305 HydrophobicContact CG-CZ 4.31Å; K303-F305 PolarHBondContact O-N 2.94Å
304	N	50.3	Low	51	Low	27 Å²	27	52.8 Å²	52.8	14%	0.144	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	22.8	-179.9	-72	-68.9	0	0	0	115.6	L300 A301 L302 I306 K368	L300-N304 PolarHBondContact O-N 3.36Å; A301-N304 VanDerWaalsContact O-CA 3.25Å; A301-N304 WeakPolarHBondContact O-CA 3.45Å; A301-N304 PolarHBondContact O-N 3.45Å; L302-N304 PolarHBondContact O-N 3.46Å; L302-N304 VanDerWaalsContact O-N 3.13Å; N304-I306 VanDerWaalsContact C-N 3.33Å; N304-K368 WeakPolarHBondContact OD1-CE 3.15Å
305	F	49	Very low	51.3	Low	23 Å²	23	52 Å²	52	10%	0.101	26%	0.262	C	S	.	.			trans	-67.8	-31.1	175.1	-59.2	-34.7	0	0	0	112.6	N251 I288 M295 L300 K303	N251-F305 HydrophobicContact CB-CE1 3.87Å; N251-F305 VanDerWaalsContact CG-CE1 3.43Å; N251-F305 WeakPolarHBondContact OD1-CE1 3.38Å; I288-F305 HydrophobicContact CB-CD1 4.47Å; I288-F305 HydrophobicContact CD1-CB 3.84Å; I288-F305 HydrophobicContact CD1-CD1 4.27Å; I288-F305 HydrophobicContact CD1-CG 4.44Å; I288-F305 WeakPolarHBondContact CD1-O 3.42Å; I288-F305 HydrophobicContact CG1-CB 4.21Å; I288-F305 HydrophobicContact CG1-CD1 3.84Å; I288-F305 HydrophobicContact CG1-CG 4.29Å; I288-F305 HydrophobicContact CG2-CB 3.73Å; I288-F305 HydrophobicContact CG2-CD1 3.92Å; I288-F305 HydrophobicContact CG2-CD2 4.19Å; I288-F305 HydrophobicContact CG2-CG 3.7Å; M295-F305 HydrophobicContact SD-CE2 4.05Å; L300-F305 HydrophobicContact CB-CB 4.23Å; L300-F305 HydrophobicContact CB-CD2 4.36Å; L300-F305 HydrophobicContact CD2-CB 4.27Å; L300-F305 HydrophobicContact CD2-CD2 3.55Å; L300-F305 HydrophobicContact CD2-CE2 4.36Å; L300-F305 HydrophobicContact CD2-CG 4.35Å; L300-F305 WeakPolarHBondContact O-CA 3.46Å; L300-F305 VanDerWaalsContact O-CB 3.26Å; L300-F305 WeakPolarHBondContact O-CB 3.23Å; L300-F305 PolarHBondContact O-N 2.99Å; K303-F305 VanDerWaalsContact C-N 3.3Å; K303-F305 HydrophobicContact CB-CD1 4.33Å; K303-F305 HydrophobicContact CB-CD2 3.68Å; K303-F305 HydrophobicContact CB-CE1 4.05Å; K303-F305 HydrophobicContact CB-CE2 3.39Å; K303-F305 HydrophobicContact CB-CG 4.16Å; K303-F305 HydrophobicContact CB-CZ 3.59Å; K303-F305 HydrophobicContact CD-CD2 4.42Å; K303-F305 HydrophobicContact CD-CE2 3.48Å; K303-F305 VanDerWaalsContact CD-CE2 3.48Å; K303-F305 HydrophobicContact CD-CZ 3.82Å; K303-F305 HydrophobicContact CG-CE2 4.03Å; K303-F305 HydrophobicContact CG-CZ 4.31Å; K303-F305 PolarHBondContact O-N 2.94Å
306	I	48.2	Very low	51.3	Low	22 Å²	22	50 Å²	50	11%	0.113	26%	0.255	C	S	.	.	S	Bend	trans	-112.2	146.9	-178.9	-53.7	169.1	0	0	0	111.8	L117 L300 N304 T308	L117-I306 HydrophobicContact CD1-CD1 4.29Å; L117-I306 HydrophobicContact CD2-CD1 3.58Å; L117-I306 HydrophobicContact CD2-CG1 3.66Å; L117-I306 HydrophobicContact CG-CD1 4.5Å; L300-I306 HydrophobicContact CB-CD1 3.45Å; L300-I306 VanDerWaalsContact CB-CD1 3.45Å; L300-I306 HydrophobicContact CB-CG1 3.89Å; L300-I306 HydrophobicContact CD1-CD1 3.77Å; L300-I306 HydrophobicContact CG-CD1 4.26Å; L300-I306 PolarHBondContact O-N 3.07Å; N304-I306 VanDerWaalsContact C-N 3.33Å; I306-T308 PolarHBondContact O-N 3.44Å
307	R	44.7	Very low	51.4	Low	142 Å²	142	46.5 Å²	46.5	54%	0.536	24%	0.236	S	C	.	.			trans	-59.4	124	170	-156	177.9	83.4	154.9	-1.5	109.8	D309 K310	R307-D309 VanDerWaalsContact CB-OD1 3.31Å; R307-D309 WeakPolarHBondContact CB-OD1 3.5Å; R307-D309 WeakPolarHBondContact CD-OD1 3.48Å; R307-D309 WeakPolarHBondContact CG-OD1 3.37Å; R307-D309 IonicContact CZ-OD1 3.74Å; R307-D309 IonicContact CZ-OD2 2.64Å; R307-D309 VanDerWaalsContact CZ-OD2 3.31Å; R307-D309 VanDerWaalsContact NE-CG 3.26Å; R307-D309 IonicContact NE-OD1 2.63Å; R307-D309 PolarHBondContact NE-OD1 3.08Å; R307-D309 IonicContact NE-OD2 3.63Å; R307-D309 PolarHBondContact NE-OD2 2.92Å; R307-D309 IonicContact NH2-OD1 2.76Å; R307-D309 IonicContact NH2-OD2 3.23Å; R307-D309 PolarHBondContact NH2-OD2 2.95Å; R307-D309 PolarHBondContact O-N 3.25Å; R307-K310 PolarHBondContact O-N 2.89Å
308	T	50.5	Low	51.4	Low	48 Å²	48	51.2 Å²	51.2	29%	0.294	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-7	-163.6	66.7	0	0	0	0	115	I306 K310 K368	I306-T308 PolarHBondContact O-N 3.44Å; T308-K310 PolarHBondContact O-N 2.83Å; T308-K368 HydrophobicContact CG2-CD 3.96Å
309	D	53.5	Low	51.4	Low	63 Å²	63	53.8 Å²	53.8	34%	0.337	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-20.4	176.5	59.6	-50	0	0	0	112.5	R307	R307-D309 VanDerWaalsContact CB-OD1 3.31Å; R307-D309 WeakPolarHBondContact CB-OD1 3.5Å; R307-D309 WeakPolarHBondContact CD-OD1 3.48Å; R307-D309 WeakPolarHBondContact CG-OD1 3.37Å; R307-D309 IonicContact CZ-OD1 3.74Å; R307-D309 IonicContact CZ-OD2 2.64Å; R307-D309 VanDerWaalsContact CZ-OD2 3.31Å; R307-D309 VanDerWaalsContact NE-CG 3.26Å; R307-D309 IonicContact NE-OD1 2.63Å; R307-D309 PolarHBondContact NE-OD1 3.08Å; R307-D309 IonicContact NE-OD2 3.63Å; R307-D309 PolarHBondContact NE-OD2 2.92Å; R307-D309 IonicContact NH2-OD1 2.76Å; R307-D309 IonicContact NH2-OD2 3.23Å; R307-D309 PolarHBondContact NH2-OD2 2.95Å; R307-D309 PolarHBondContact O-N 3.25Å
310	K	48.6	Very low	51.5	Low	119 Å²	119	50.8 Å²	50.8	52%	0.517	26%	0.262	S	S	.	.	S	Bend	trans	-99.1	-23.8	-173.3	-65.1	-171.9	174.1	-172.3	0	116.5	S116 R307 T308	S116-K310 PolarHBondContact OG-NZ 2.6Å; R307-K310 PolarHBondContact O-N 2.89Å; T308-K310 PolarHBondContact O-N 2.83Å
311	A	53.3	Low	51.5	Low	11 Å²	11	51.6 Å²	51.6	9%	0.091	27%	0.268	C	S	.	.	S	Bend	trans	-89.7	147.1	-175.1	0	0	0	0	0	112.8	A301 C313	A301-A311 HydrophobicContact CB-CB 3.43Å; A301-A311 VanDerWaalsContact CB-CB 3.43Å; A311-C313 PolarHBondContact O-N 2.81Å
312	D	54.6	Low	52	Low	98 Å²	98	54.3 Å²	54.3	52%	0.524	29%	0.287	S	S	.	.			trans	-66.1	128.9	166.1	-165.2	-3.5	0	0	0	109	Q314	D312-Q314 PolarHBondContact OD1-N 2.81Å
313	C	54.8	Low	52.8	Low	15 Å²	15	56.2 Å²	56.2	10%	0.101	30%	0.296	C	S	.	.	S	Bend	trans	-91.1	-9.5	-174.4	-56.4	0	0	0	0	111.6	A311 A364	A311-C313 PolarHBondContact O-N 2.81Å; C313-A364 HydrophobicContact CB-CB 3.43Å; C313-A364 VanDerWaalsContact CB-CB 3.43Å; C313-A364 WeakPolarHBondContact O-CB 3.24Å
314	Q	54.6	Low	53.4	Low	66 Å²	66	59.3 Å²	59.3	31%	0.308	31%	0.31	S	S	.	.	S	Bend	trans	-81	-47	-172.4	-168.9	160.7	-19.3	0	0	112.5	D312 A316 V317 D339 L342	D312-Q314 PolarHBondContact OD1-N 2.81Å; Q314-A316 PolarHBondContact O-N 3.36Å; Q314-V317 PolarHBondContact O-N 3.18Å; Q314-D339 PolarHBondContact NE2-OD1 3.36Å; Q314-D339 PolarHBondContact NE2-OD2 2.99Å; Q314-L342 HydrophobicContact CG-CD1 4.17Å
315	T	52.5	Low	54.1	Low	54 Å²	54	60.4 Å²	60.4	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-58.8	-32.6	172.4	40.3	0	0	0	0	112.6	T298 V317 Q318	T298-T315 VanDerWaalsContact CG2-OG1 3.27Å; T298-T315 WeakPolarHBondContact CG2-OG1 3.38Å; T298-T315 PolarHBondContact OG1-OG1 3.48Å; T298-T315 VanDerWaalsContact OG1-OG1 3.05Å; T315-V317 PolarHBondContact O-N 2.77Å; T315-V317 VanDerWaalsContact O-N 3.13Å; T315-Q318 PolarHBondContact O-N 2.99Å; T315-Q318 VanDerWaalsContact O-N 3.12Å
316	A	51.8	Low	55.1	Low	13 Å²	13	59.6 Å²	59.6	11%	0.107	31%	0.31	C	S	.	.	H	α-helix	trans	-60.2	-26.8	-179.3	0	0	0	0	0	113.4	T298 L302 Q314 I320	T298-A316 HydrophobicContact CG2-CB 3.66Å; L302-A316 HydrophobicContact CD1-CB 4.2Å; L302-A316 WeakPolarHBondContact CD1-O 3.3Å; L302-A316 HydrophobicContact CD2-CB 3.58Å; L302-A316 WeakPolarHBondContact CD2-O 3.45Å; L302-A316 HydrophobicContact CG-CB 3.76Å; Q314-A316 PolarHBondContact O-N 3.36Å; A316-I320 WeakPolarHBondContact O-CD1 3.03Å; A316-I320 WeakPolarHBondContact O-CG1 3.26Å
317	V	54.5	Low	56.3	Low	4 Å²	4	59.7 Å²	59.7	2%	0.024	31%	0.311	C	S	.	.	H	α-helix	trans	-76.6	-34.9	179.7	-174.3	0	0	0	0	111.6	Q314 T315 A319 I320 L326 V338 F341 L342 L367	Q314-V317 PolarHBondContact O-N 3.18Å; T315-V317 PolarHBondContact O-N 2.77Å; T315-V317 VanDerWaalsContact O-N 3.13Å; V317-A319 PolarHBondContact O-N 3.1Å; V317-I320 PolarHBondContact O-N 2.8Å; V317-L326 HydrophobicContact CG1-CD1 4.41Å; V317-V338 HydrophobicContact CB-CG1 3.68Å; V317-V338 HydrophobicContact CG1-CG1 3.85Å; V317-V338 HydrophobicContact CG1-CG2 4.44Å; V317-V338 HydrophobicContact CG2-CG1 4.28Å; V317-F341 HydrophobicContact CG1-CD1 3.6Å; V317-F341 HydrophobicContact CG1-CE1 3.55Å; V317-L342 HydrophobicContact CG2-CD1 4.35Å; V317-L342 HydrophobicContact CG2-CD2 4Å; V317-L342 HydrophobicContact CG2-CG 4.38Å; V317-L367 HydrophobicContact CB-CD2 4.24Å; V317-L367 HydrophobicContact CG1-CD2 3.94Å; V317-L367 HydrophobicContact CG2-CD2 3.64Å
318	Q	52.1	Low	57.4	Low	131 Å²	131	59.1 Å²	59.1	61%	0.612	32%	0.317	S	S	*	.	H	α-helix	trans	-61.7	-28.5	-177.8	-70.6	174.4	-29.9	0	0	112.5	T315 V338	T315-Q318 PolarHBondContact O-N 2.99Å; T315-Q318 VanDerWaalsContact O-N 3.12Å; Q318-V338 HydrophobicContact CG-CB 4.38Å; Q318-V338 HydrophobicContact CG-CG2 3.58Å
319	A	48.9	Very low	58	Low	71 Å²	71	59.1 Å²	59.1	59%	0.587	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-11.9	178.7	0	0	0	0	0	114.2	L302 V317	L302-A319 HydrophobicContact CD1-CB 3.88Å; V317-A319 PolarHBondContact O-N 3.1Å
320	I	53.3	Low	58.8	Low	20 Å²	20	57.2 Å²	57.2	10%	0.103	30%	0.304	C	S	.	.	S	Bend	trans	-104	105.4	-173	-59	165.6	0	0	0	109.5	L302 A316 V317 P372 I379	L302-I320 HydrophobicContact CD1-CG1 4.45Å; L302-I320 HydrophobicContact CD2-CD1 3.46Å; L302-I320 VanDerWaalsContact CD2-CD1 3.46Å; L302-I320 HydrophobicContact CD2-CG1 4.06Å; A316-I320 WeakPolarHBondContact O-CD1 3.03Å; A316-I320 WeakPolarHBondContact O-CG1 3.26Å; V317-I320 PolarHBondContact O-N 2.8Å; I320-P372 HydrophobicContact CD1-CG 3.94Å; I320-P372 HydrophobicContact CG1-CG 4.11Å; I320-P372 HydrophobicContact CG2-CG 3.91Å; I320-I379 HydrophobicContact CG2-CD1 4.38Å
321	S	54.1	Low	60.1	Low	27 Å²	27	58.4 Å²	58.4	19%	0.189	32%	0.316	C	S	.	.	S	Bend	trans	67.1	157.2	166.8	-101.1	0	0	0	0	116.3	Q325	S321-Q325 PolarHBondContact OG-OE1 3.42Å
322	S	62.1	Low	61.5	Low	60 Å²	60	58.6 Å²	58.6	42%	0.42	32%	0.315	S	S	.	.			trans	-64.8	148.1	168.3	63.3	0	0	0	0	110.5	F324 Q325 L326	S322-F324 PolarHBondContact O-N 3.28Å; S322-Q325 WeakPolarHBondContact O-CB 3.47Å; S322-Q325 PolarHBondContact O-N 3.21Å; S322-Q325 WeakPolarHBondContact OG-CG 3.33Å; S322-Q325 PolarHBondContact OG-NE2 3.49Å; S322-Q325 PolarHBondContact OG-OE1 3.26Å; S322-L326 PolarHBondContact O-N 2.89Å
323	M	67.3	Low	62.9	Low	80 Å²	80	57.9 Å²	57.9	39%	0.394	32%	0.316	S	S	.	.	H	α-helix	trans	-56.9	-38	-177.1	-65	168	70.1	0	0	112.3	Q325 L326 M327 F335 N336	M323-Q325 VanDerWaalsContact C-N 3.32Å; M323-Q325 PolarHBondContact O-N 2.85Å; M323-L326 PolarHBondContact O-N 2.92Å; M323-M327 WeakPolarHBondContact O-CG 3.32Å; M323-M327 PolarHBondContact O-N 3.18Å; M323-M327 VanDerWaalsContact O-N 3.15Å; M323-F335 HydrophobicContact CB-CE2 3.86Å; M323-F335 HydrophobicContact CB-CZ 4.28Å; M323-F335 HydrophobicContact CE-CD2 3.81Å; M323-F335 HydrophobicContact CE-CE2 3.9Å; M323-F335 VanDerWaalsContact CE-O 3.24Å; M323-F335 WeakPolarHBondContact CE-O 3.27Å; M323-F335 HydrophobicContact CG-CE2 4.08Å; M323-F335 WeakPolarHBondContact O-CZ 3.28Å; M323-N336 VanDerWaalsContact CE-CA 3.46Å; M323-N336 WeakPolarHBondContact CE-O 3.08Å
324	F	63.6	Low	64.3	Low	152 Å²	152	63.6 Å²	63.6	67%	0.667	35%	0.346	S	S	*	.	H	α-helix	trans	-57.8	-40.8	174.8	-177.4	-104.4	0	0	0	112.9	S322 L326 M327 L328	S322-F324 PolarHBondContact O-N 3.28Å; F324-L326 VanDerWaalsContact C-N 3.35Å; F324-L326 PolarHBondContact O-N 2.8Å; F324-M327 WeakPolarHBondContact O-CB 3.31Å; F324-M327 PolarHBondContact O-N 3.17Å; F324-L328 PolarHBondContact O-N 3.46Å
325	Q	63.9	Low	65.7	Low	49 Å²	49	60.6 Å²	60.6	23%	0.229	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-38.7	179.3	-70.6	165.1	-6.8	0	0	111.7	S321 S322 M323 M327 L329 V430	S321-Q325 PolarHBondContact OG-OE1 3.42Å; S322-Q325 WeakPolarHBondContact O-CB 3.47Å; S322-Q325 PolarHBondContact O-N 3.21Å; S322-Q325 WeakPolarHBondContact OG-CG 3.33Å; S322-Q325 PolarHBondContact OG-NE2 3.49Å; S322-Q325 PolarHBondContact OG-OE1 3.26Å; M323-Q325 VanDerWaalsContact C-N 3.32Å; M323-Q325 PolarHBondContact O-N 2.85Å; Q325-M327 VanDerWaalsContact C-N 3.32Å; Q325-M327 PolarHBondContact O-N 3.06Å; Q325-L329 WeakPolarHBondContact O-CB 2.81Å; Q325-L329 PolarHBondContact O-N 2.87Å; Q325-V430 HydrophobicContact CB-CG2 4.49Å; Q325-V430 VanDerWaalsContact CD-CG1 3.49Å; Q325-V430 HydrophobicContact CG-CG1 4.47Å; Q325-V430 HydrophobicContact CG-CG2 4.03Å
326	L	70.6	Confident	67.1	Low	6 Å²	6	64.9 Å²	64.9	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-65.7	-34.6	176.3	-70.2	177.8	0	0	0	111.9	V317 S322 M323 F324 Y330 F335 F341 I379	V317-L326 HydrophobicContact CG1-CD1 4.41Å; S322-L326 PolarHBondContact O-N 2.89Å; M323-L326 PolarHBondContact O-N 2.92Å; F324-L326 VanDerWaalsContact C-N 3.35Å; F324-L326 PolarHBondContact O-N 2.8Å; L326-Y330 HydrophobicContact CD2-CD2 4.37Å; L326-Y330 HydrophobicContact CD2-CE2 3.97Å; L326-Y330 WeakPolarHBondContact O-CB 3.49Å; L326-Y330 WeakPolarHBondContact O-CD2 3.38Å; L326-Y330 PolarHBondContact O-N 3.44Å; L326-F335 HydrophobicContact CB-CE1 4.41Å; L326-F335 HydrophobicContact CB-CZ 3.82Å; L326-F335 HydrophobicContact CD1-CZ 4.43Å; L326-F341 HydrophobicContact CB-CD2 4.27Å; L326-F341 HydrophobicContact CB-CE2 3.78Å; L326-F341 HydrophobicContact CB-CZ 4.25Å; L326-F341 HydrophobicContact CD1-CD1 4.47Å; L326-F341 HydrophobicContact CD1-CD2 4.44Å; L326-F341 HydrophobicContact CD1-CE1 4.16Å; L326-F341 HydrophobicContact CD1-CE2 4.15Å; L326-F341 HydrophobicContact CD1-CZ 3.98Å; L326-F341 HydrophobicContact CD2-CE2 4.38Å; L326-F341 HydrophobicContact CD2-CZ 4Å; L326-F341 HydrophobicContact CG-CE2 4.33Å; L326-F341 HydrophobicContact CG-CZ 4.31Å; L326-I379 HydrophobicContact CD2-CD1 4.36Å
327	M	73.7	Confident	68.5	Low	25 Å²	25	68 Å²	68	12%	0.123	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-54	174.7	-65	169.4	-172	0	0	111.4	M323 F324 Q325 L329 Y330 N331 L332 D334 F335	M323-M327 WeakPolarHBondContact O-CG 3.32Å; M323-M327 PolarHBondContact O-N 3.18Å; M323-M327 VanDerWaalsContact O-N 3.15Å; F324-M327 WeakPolarHBondContact O-CB 3.31Å; F324-M327 PolarHBondContact O-N 3.17Å; Q325-M327 VanDerWaalsContact C-N 3.32Å; Q325-M327 PolarHBondContact O-N 3.06Å; M327-L329 VanDerWaalsContact C-N 3.33Å; M327-L329 PolarHBondContact O-N 2.66Å; M327-Y330 PolarHBondContact O-N 3.19Å; M327-N331 WeakPolarHBondContact O-CA 3.31Å; M327-N331 PolarHBondContact O-N 2.9Å; M327-L332 PolarHBondContact O-N 3.22Å; M327-D334 HydrophobicContact CE-CB 4.38Å; M327-D334 HydrophobicContact SD-CB 4.46Å; M327-F335 HydrophobicContact CB-CE1 4.28Å; M327-F335 HydrophobicContact CE-CB 4.48Å; M327-F335 HydrophobicContact CE-CD1 3.74Å; M327-F335 HydrophobicContact CE-CD2 4.12Å; M327-F335 HydrophobicContact CE-CE1 3.87Å; M327-F335 HydrophobicContact CE-CE2 4.23Å; M327-F335 HydrophobicContact CE-CG 3.86Å; M327-F335 HydrophobicContact CE-CZ 4.11Å; M327-F335 WeakPolarHBondContact CE-O 3.46Å; M327-F335 HydrophobicContact CG-CD1 3.68Å; M327-F335 HydrophobicContact CG-CE1 3.22Å; M327-F335 HydrophobicContact CG-CZ 3.92Å; M327-F335 HydrophobicContact SD-CE1 4.44Å
328	L	66.9	Low	69.7	Low	129 Å²	129	68.8 Å²	68.8	68%	0.675	37%	0.372	S	S	*	.	H	α-helix	trans	-61.4	-42.9	-177.9	-171.2	68.7	0	0	0	111.8	F324 Y330 N331	F324-L328 PolarHBondContact O-N 3.46Å; L328-Y330 PolarHBondContact O-N 3.27Å; L328-N331 PolarHBondContact O-OD1 2.97Å
329	L	64.3	Low	71.2	Confident	49 Å²	49	64.8 Å²	64.8	26%	0.257	36%	0.355	S	S	.	.	H	α-helix	trans	-70.5	-32.8	-174.8	179.1	68.4	0	0	0	114.2	Q325 M327 K378 I379	Q325-L329 WeakPolarHBondContact O-CB 2.81Å; Q325-L329 PolarHBondContact O-N 2.87Å; M327-L329 VanDerWaalsContact C-N 3.33Å; M327-L329 PolarHBondContact O-N 2.66Å; L329-K378 HydrophobicContact CD1-CB 4.31Å; L329-K378 WeakPolarHBondContact CD1-O 3.39Å; L329-I379 HydrophobicContact CD1-CB 4.47Å; L329-I379 HydrophobicContact CD1-CG1 4.41Å; L329-I379 HydrophobicContact CD2-CB 3.74Å; L329-I379 HydrophobicContact CD2-CD1 3.17Å; L329-I379 HydrophobicContact CD2-CG1 3.12Å; L329-I379 HydrophobicContact CD2-CG2 3.83Å; L329-I379 HydrophobicContact CG-CG1 4.22Å
330	Y	70.3	Confident	73	Confident	22 Å²	22	65.4 Å²	65.4	9%	0.086	35%	0.345	C	S	.	.	H	α-helix	trans	-103.8	3.1	-179.2	-69.6	-66.7	0	0	0	113.2	L326 M327 L328 L332 F341 L345 L367 M370 G371 I379	L326-Y330 HydrophobicContact CD2-CD2 4.37Å; L326-Y330 HydrophobicContact CD2-CE2 3.97Å; L326-Y330 WeakPolarHBondContact O-CB 3.49Å; L326-Y330 WeakPolarHBondContact O-CD2 3.38Å; L326-Y330 PolarHBondContact O-N 3.44Å; M327-Y330 PolarHBondContact O-N 3.19Å; L328-Y330 PolarHBondContact O-N 3.27Å; Y330-L332 PolarHBondContact O-N 2.67Å; Y330-F341 AromaticContact CD2-CE2 3.89Å; Y330-F341 HydrophobicContact CD2-CE2 3.89Å; Y330-F341 AromaticContact CD2-CZ 3.98Å; Y330-F341 HydrophobicContact CD2-CZ 3.98Å; Y330-F341 HydrophobicContact CE2-CE2 4.41Å; Y330-F341 HydrophobicContact CE2-CZ 4.05Å; Y330-L345 HydrophobicContact CD1-CD1 3.62Å; Y330-L345 HydrophobicContact CD2-CD1 4.42Å; Y330-L345 HydrophobicContact CE1-CD1 4.08Å; Y330-L345 HydrophobicContact CG-CD1 3.85Å; Y330-L367 HydrophobicContact CD2-CD1 4.43Å; Y330-L367 HydrophobicContact CE1-CD1 4.42Å; Y330-L367 HydrophobicContact CE2-CD1 3.42Å; Y330-L367 VanDerWaalsContact CE2-CD1 3.42Å; Y330-L367 VanDerWaalsContact CZ-CD1 3.44Å; Y330-L367 VanDerWaalsContact OH-CD1 3.24Å; Y330-L367 WeakPolarHBondContact OH-CD1 3.48Å; Y330-M370 HydrophobicContact CE1-CB 4.01Å; Y330-M370 PolarHBondContact OH-O 3.22Å; Y330-M370 VanDerWaalsContact OH-O 3.08Å; Y330-G371 WeakPolarHBondContact OH-CA 3.3Å; Y330-G371 PolarHBondContact OH-N 2.87Å; Y330-I379 HydrophobicContact CE2-CD1 4.32Å
331	N	74.6	Confident	74.6	Confident	144 Å²	144	64.5 Å²	64.5	77%	0.77	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	50	-171.3	-65.1	-21.6	0	0	0	110.9	M327 L328	M327-N331 WeakPolarHBondContact O-CA 3.31Å; M327-N331 PolarHBondContact O-N 2.9Å; L328-N331 PolarHBondContact O-OD1 2.97Å
332	L	82.6	Confident	76.1	Confident	15 Å²	15	63.2 Å²	63.2	8%	0.079	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-96.9	148.5	178.9	-59.6	177.5	0	0	0	109.8	M327 Y330 F335 F341 L344 L345	M327-L332 PolarHBondContact O-N 3.22Å; Y330-L332 PolarHBondContact O-N 2.67Å; L332-F335 HydrophobicContact CD1-CE1 4.43Å; L332-F341 HydrophobicContact CD1-CD2 3.53Å; L332-F341 HydrophobicContact CD1-CE2 3.49Å; L332-F341 VanDerWaalsContact CD1-CE2 3.49Å; L332-L344 HydrophobicContact CD1-CB 4.27Å; L332-L344 HydrophobicContact CD2-CB 4.11Å; L332-L345 HydrophobicContact CD1-CB 4.35Å
333	P	84.6	Confident	77.4	Confident	83 Å²	83	62.2 Å²	62.2	54%	0.539	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-57	164.7	164	-19.6	31.1	0	0	0	111.6	F335 L344	P333-F335 WeakPolarHBondContact O-CD1 3.43Å; P333-F335 PolarHBondContact O-N 3.31Å; P333-L344 HydrophobicContact CG-CD2 4.33Å
334	D	84.9	Confident	78.4	Confident	136 Å²	136	60 Å²	60	73%	0.727	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-54.2	139.1	171.8	-59.8	-16.8	0	0	0	110.8	M327	M327-D334 HydrophobicContact CE-CB 4.38Å; M327-D334 HydrophobicContact SD-CB 4.46Å
335	F	83.4	Confident	79.5	Confident	3 Å²	3	52.9 Å²	52.9	1%	0.013	28%	0.282	C	S	.	.			trans	-144.1	147.9	177.6	61.8	-98.9	0	0	0	109.3	M323 L326 M327 L332 P333 E340 F341 L344	M323-F335 HydrophobicContact CB-CE2 3.86Å; M323-F335 HydrophobicContact CB-CZ 4.28Å; M323-F335 HydrophobicContact CE-CD2 3.81Å; M323-F335 HydrophobicContact CE-CE2 3.9Å; M323-F335 VanDerWaalsContact CE-O 3.24Å; M323-F335 WeakPolarHBondContact CE-O 3.27Å; M323-F335 HydrophobicContact CG-CE2 4.08Å; M323-F335 WeakPolarHBondContact O-CZ 3.28Å; L326-F335 HydrophobicContact CB-CE1 4.41Å; L326-F335 HydrophobicContact CB-CZ 3.82Å; L326-F335 HydrophobicContact CD1-CZ 4.43Å; M327-F335 HydrophobicContact CB-CE1 4.28Å; M327-F335 HydrophobicContact CE-CB 4.48Å; M327-F335 HydrophobicContact CE-CD1 3.74Å; M327-F335 HydrophobicContact CE-CD2 4.12Å; M327-F335 HydrophobicContact CE-CE1 3.87Å; M327-F335 HydrophobicContact CE-CE2 4.23Å; M327-F335 HydrophobicContact CE-CG 3.86Å; M327-F335 HydrophobicContact CE-CZ 4.11Å; M327-F335 WeakPolarHBondContact CE-O 3.46Å; M327-F335 HydrophobicContact CG-CD1 3.68Å; M327-F335 HydrophobicContact CG-CE1 3.22Å; M327-F335 HydrophobicContact CG-CZ 3.92Å; M327-F335 HydrophobicContact SD-CE1 4.44Å; L332-F335 HydrophobicContact CD1-CE1 4.43Å; P333-F335 WeakPolarHBondContact O-CD1 3.43Å; P333-F335 PolarHBondContact O-N 3.31Å; F335-E340 VanDerWaalsContact CA-OE2 3.25Å; F335-E340 WeakPolarHBondContact CA-OE2 3.5Å; F335-E340 HydrophobicContact CB-CB 4.05Å; F335-E340 HydrophobicContact CB-CG 3.68Å; F335-F341 HydrophobicContact CD1-CB 4.24Å; F335-F341 HydrophobicContact CD1-CD2 4.15Å; F335-F341 HydrophobicContact CD2-CB 3.65Å; F335-F341 HydrophobicContact CE1-CB 4.19Å; F335-F341 AromaticContact CE1-CD2 3.48Å; F335-F341 HydrophobicContact CE1-CD2 3.48Å; F335-F341 VanDerWaalsContact CE1-CD2 3.48Å; F335-F341 HydrophobicContact CE1-CE2 4.32Å; F335-F341 HydrophobicContact CE1-CG 4.25Å; F335-F341 HydrophobicContact CE2-CB 3.6Å; F335-F341 HydrophobicContact CE2-CD2 4.09Å; F335-F341 HydrophobicContact CE2-CG 4.1Å; F335-F341 HydrophobicContact CG-CB 3.99Å; F335-F341 HydrophobicContact CZ-CB 3.88Å; F335-F341 AromaticContact CZ-CD2 3.45Å; F335-F341 HydrophobicContact CZ-CD2 3.45Å; F335-F341 VanDerWaalsContact CZ-CD2 3.45Å; F335-F341 HydrophobicContact CZ-CE2 4.28Å; F335-F341 AromaticContact CZ-CG 3.92Å; F335-F341 HydrophobicContact CZ-CG 3.92Å; F335-L344 HydrophobicContact CB-CD1 3.88Å; F335-L344 HydrophobicContact CD1-CD1 4.21Å; F335-L344 HydrophobicContact CG-CD1 4.47Å
336	N	81.4	Confident	80.6	Confident	144 Å²	144	50.5 Å²	50.5	77%	0.77	27%	0.271	S	S	*	.	S	Bend	trans	-109.1	-7.8	-174.9	-64.8	-53.4	0	0	0	113.6	M323 E340	M323-N336 VanDerWaalsContact CE-CA 3.46Å; M323-N336 WeakPolarHBondContact CE-O 3.08Å; N336-E340 PolarHBondContact N-OE2 2.96Å
337	D	81.4	Confident	81.5	Confident	77 Å²	77	56.2 Å²	56.2	41%	0.412	30%	0.295	S	S	.	.	S	Bend	trans	-147	159.1	-179.6	-176.4	36.9	0	0	0	112.6	D339 E340 F341	D337-D339 VanDerWaalsContact C-N 3.27Å; D337-D339 PolarHBondContact O-N 3.28Å; D337-D339 PolarHBondContact OD2-N 2.91Å; D337-E340 PolarHBondContact O-N 2.9Å; D337-F341 PolarHBondContact O-N 3.29Å
338	V	79.5	Confident	82	Confident	21 Å²	21	58.5 Å²	58.5	13%	0.127	31%	0.313	C	S	.	.	H	α-helix	trans	-60.4	-35.4	178.1	172.7	0	0	0	0	112	V317 Q318 F341 L342	V317-V338 HydrophobicContact CB-CG1 3.68Å; V317-V338 HydrophobicContact CG1-CG1 3.85Å; V317-V338 HydrophobicContact CG1-CG2 4.44Å; V317-V338 HydrophobicContact CG2-CG1 4.28Å; Q318-V338 HydrophobicContact CG-CB 4.38Å; Q318-V338 HydrophobicContact CG-CG2 3.58Å; V338-F341 PolarHBondContact O-N 3.44Å; V338-L342 HydrophobicContact CG1-CD1 4.17Å; V338-L342 HydrophobicContact CG1-CG 4.41Å; V338-L342 WeakPolarHBondContact O-CB 3.34Å; V338-L342 WeakPolarHBondContact O-CG 3.38Å; V338-L342 PolarHBondContact O-N 3.28Å
339	D	83.8	Confident	82.7	Confident	47 Å²	47	54.5 Å²	54.5	25%	0.251	30%	0.295	S	S	.	.	H	α-helix	trans	-65.9	-39.5	176.2	-94.2	-54.7	0	0	0	112.4	Q314 D337 T343 R360	Q314-D339 PolarHBondContact NE2-OD1 3.36Å; Q314-D339 PolarHBondContact NE2-OD2 2.99Å; D337-D339 VanDerWaalsContact C-N 3.27Å; D337-D339 PolarHBondContact O-N 3.28Å; D337-D339 PolarHBondContact OD2-N 2.91Å; D339-T343 WeakPolarHBondContact O-CB 3.35Å; D339-T343 PolarHBondContact O-N 2.89Å; D339-T343 PolarHBondContact O-OG1 3.38Å; D339-R360 WeakPolarHBondContact OD1-CD 3.33Å; D339-R360 IonicContact OD1-CZ 3.41Å; D339-R360 IonicContact OD1-NE 3.99Å; D339-R360 PolarHBondContact OD1-NE 3.3Å; D339-R360 IonicContact OD1-NH1 3.2Å; D339-R360 PolarHBondContact OD1-NH1 3.38Å; D339-R360 IonicContact OD2-NH1 3.66Å
340	E	87.6	Confident	83.7	Confident	84 Å²	84	54.8 Å²	54.8	39%	0.393	31%	0.31	S	S	.	.	H	α-helix	trans	-67.9	-46.2	176.7	-174.2	173.3	-149.9	0	0	110.6	F335 N336 D337 L342 T343 L344	F335-E340 VanDerWaalsContact CA-OE2 3.25Å; F335-E340 WeakPolarHBondContact CA-OE2 3.5Å; F335-E340 HydrophobicContact CB-CB 4.05Å; F335-E340 HydrophobicContact CB-CG 3.68Å; N336-E340 PolarHBondContact N-OE2 2.96Å; D337-E340 PolarHBondContact O-N 2.9Å; E340-L342 PolarHBondContact O-N 3.46Å; E340-T343 WeakPolarHBondContact O-CB 3.5Å; E340-T343 PolarHBondContact O-N 3.23Å; E340-T343 VanDerWaalsContact O-N 3.09Å; E340-L344 HydrophobicContact CG-CD1 4.23Å; E340-L344 WeakPolarHBondContact O-CG 3.44Å; E340-L344 PolarHBondContact O-N 2.91Å
341	F	85.2	Confident	84.4	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-52.3	-52	172.1	168.9	-109.5	0	0	0	112.5	V317 L326 Y330 L332 F335 D337 V338 T343 L344 L345 L367	V317-F341 HydrophobicContact CG1-CD1 3.6Å; V317-F341 HydrophobicContact CG1-CE1 3.55Å; L326-F341 HydrophobicContact CB-CD2 4.27Å; L326-F341 HydrophobicContact CB-CE2 3.78Å; L326-F341 HydrophobicContact CB-CZ 4.25Å; L326-F341 HydrophobicContact CD1-CD1 4.47Å; L326-F341 HydrophobicContact CD1-CD2 4.44Å; L326-F341 HydrophobicContact CD1-CE1 4.16Å; L326-F341 HydrophobicContact CD1-CE2 4.15Å; L326-F341 HydrophobicContact CD1-CZ 3.98Å; L326-F341 HydrophobicContact CD2-CE2 4.38Å; L326-F341 HydrophobicContact CD2-CZ 4Å; L326-F341 HydrophobicContact CG-CE2 4.33Å; L326-F341 HydrophobicContact CG-CZ 4.31Å; Y330-F341 AromaticContact CD2-CE2 3.89Å; Y330-F341 HydrophobicContact CD2-CE2 3.89Å; Y330-F341 AromaticContact CD2-CZ 3.98Å; Y330-F341 HydrophobicContact CD2-CZ 3.98Å; Y330-F341 HydrophobicContact CE2-CE2 4.41Å; Y330-F341 HydrophobicContact CE2-CZ 4.05Å; L332-F341 HydrophobicContact CD1-CD2 3.53Å; L332-F341 HydrophobicContact CD1-CE2 3.49Å; L332-F341 VanDerWaalsContact CD1-CE2 3.49Å; F335-F341 HydrophobicContact CD1-CB 4.24Å; F335-F341 HydrophobicContact CD1-CD2 4.15Å; F335-F341 HydrophobicContact CD2-CB 3.65Å; F335-F341 HydrophobicContact CE1-CB 4.19Å; F335-F341 AromaticContact CE1-CD2 3.48Å; F335-F341 HydrophobicContact CE1-CD2 3.48Å; F335-F341 VanDerWaalsContact CE1-CD2 3.48Å; F335-F341 HydrophobicContact CE1-CE2 4.32Å; F335-F341 HydrophobicContact CE1-CG 4.25Å; F335-F341 HydrophobicContact CE2-CB 3.6Å; F335-F341 HydrophobicContact CE2-CD2 4.09Å; F335-F341 HydrophobicContact CE2-CG 4.1Å; F335-F341 HydrophobicContact CG-CB 3.99Å; F335-F341 HydrophobicContact CZ-CB 3.88Å; F335-F341 AromaticContact CZ-CD2 3.45Å; F335-F341 HydrophobicContact CZ-CD2 3.45Å; F335-F341 VanDerWaalsContact CZ-CD2 3.45Å; F335-F341 HydrophobicContact CZ-CE2 4.28Å; F335-F341 AromaticContact CZ-CG 3.92Å; F335-F341 HydrophobicContact CZ-CG 3.92Å; D337-F341 PolarHBondContact O-N 3.29Å; V338-F341 PolarHBondContact O-N 3.44Å; F341-T343 PolarHBondContact O-N 3.45Å; F341-L344 PolarHBondContact O-N 2.91Å; F341-L345 HydrophobicContact CE1-CD2 4.19Å; F341-L345 HydrophobicContact CZ-CD2 4.02Å; F341-L345 VanDerWaalsContact O-CB 3.28Å; F341-L345 WeakPolarHBondContact O-CB 3.28Å; F341-L345 PolarHBondContact O-N 2.95Å; F341-L367 HydrophobicContact CE1-CD1 3.94Å; F341-L367 HydrophobicContact CE1-CD2 3.88Å; F341-L367 HydrophobicContact CZ-CD1 3.62Å; F341-L367 HydrophobicContact CZ-CD2 4.36Å
342	L	85.9	Confident	85.2	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-32.2	-179.8	-75.9	178.4	0	0	0	112.2	Q314 V317 V338 E340 A346 R360 A363 A364	Q314-L342 HydrophobicContact CG-CD1 4.17Å; V317-L342 HydrophobicContact CG2-CD1 4.35Å; V317-L342 HydrophobicContact CG2-CD2 4Å; V317-L342 HydrophobicContact CG2-CG 4.38Å; V338-L342 HydrophobicContact CG1-CD1 4.17Å; V338-L342 HydrophobicContact CG1-CG 4.41Å; V338-L342 WeakPolarHBondContact O-CB 3.34Å; V338-L342 WeakPolarHBondContact O-CG 3.38Å; V338-L342 PolarHBondContact O-N 3.28Å; E340-L342 PolarHBondContact O-N 3.46Å; L342-A346 WeakPolarHBondContact O-CB 3.5Å; L342-A346 PolarHBondContact O-N 3.46Å; L342-R360 HydrophobicContact CB-CB 4.12Å; L342-R360 HydrophobicContact CB-CG 4.21Å; L342-R360 HydrophobicContact CD1-CB 4.48Å; L342-A363 HydrophobicContact CD2-CB 4.35Å; L342-A363 WeakPolarHBondContact O-CB 3.47Å; L342-A364 HydrophobicContact CD1-CB 4.14Å; L342-A364 HydrophobicContact CD2-CB 3.67Å
343	T	89.6	Confident	85.6	Confident	39 Å²	39	61.7 Å²	61.7	24%	0.239	33%	0.329	C	S	.	.	H	α-helix	trans	-70.1	-45.7	175.9	-60.2	0	0	0	0	111.4	D339 E340 F341 A346 K347 P358	D339-T343 WeakPolarHBondContact O-CB 3.35Å; D339-T343 PolarHBondContact O-N 2.89Å; D339-T343 PolarHBondContact O-OG1 3.38Å; E340-T343 WeakPolarHBondContact O-CB 3.5Å; E340-T343 PolarHBondContact O-N 3.23Å; E340-T343 VanDerWaalsContact O-N 3.09Å; F341-T343 PolarHBondContact O-N 3.45Å; T343-A346 PolarHBondContact O-N 2.85Å; T343-K347 WeakPolarHBondContact O-CG 3.37Å; T343-K347 PolarHBondContact O-N 3.4Å; T343-P358 HydrophobicContact CG2-CB 4Å; T343-P358 HydrophobicContact CG2-CG 3.95Å
344	L	89.5	Confident	85.8	Confident	32 Å²	32	67.5 Å²	67.5	17%	0.168	35%	0.346	C	S	.	.	H	α-helix	trans	-64.6	-43.8	175.9	-70.1	173.1	0	0	0	111.4	L332 P333 F335 E340 F341 A346 K347 S348	L332-L344 HydrophobicContact CD1-CB 4.27Å; L332-L344 HydrophobicContact CD2-CB 4.11Å; P333-L344 HydrophobicContact CG-CD2 4.33Å; F335-L344 HydrophobicContact CB-CD1 3.88Å; F335-L344 HydrophobicContact CD1-CD1 4.21Å; F335-L344 HydrophobicContact CG-CD1 4.47Å; E340-L344 HydrophobicContact CG-CD1 4.23Å; E340-L344 WeakPolarHBondContact O-CG 3.44Å; E340-L344 PolarHBondContact O-N 2.91Å; F341-L344 PolarHBondContact O-N 2.91Å; L344-A346 VanDerWaalsContact C-N 3.35Å; L344-A346 PolarHBondContact O-N 3.19Å; L344-K347 PolarHBondContact O-N 2.98Å; L344-S348 PolarHBondContact O-N 3.06Å; L344-S348 PolarHBondContact O-OG 3.22Å
345	L	84.9	Confident	86.1	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.016	35%	0.352	C	S	.	.	H	α-helix	trans	-62.7	-40.5	175.6	-174.9	66.5	0	0	0	111.9	Y330 L332 F341 K347 S348 T349 A363 L367	Y330-L345 HydrophobicContact CD1-CD1 3.62Å; Y330-L345 HydrophobicContact CD2-CD1 4.42Å; Y330-L345 HydrophobicContact CE1-CD1 4.08Å; Y330-L345 HydrophobicContact CG-CD1 3.85Å; L332-L345 HydrophobicContact CD1-CB 4.35Å; F341-L345 HydrophobicContact CE1-CD2 4.19Å; F341-L345 HydrophobicContact CZ-CD2 4.02Å; F341-L345 VanDerWaalsContact O-CB 3.28Å; F341-L345 WeakPolarHBondContact O-CB 3.28Å; F341-L345 PolarHBondContact O-N 2.95Å; L345-K347 VanDerWaalsContact C-N 3.34Å; L345-S348 PolarHBondContact O-OG 3.47Å; L345-T349 HydrophobicContact CD1-CG2 3.94Å; L345-T349 HydrophobicContact CG-CG2 4.42Å; L345-T349 WeakPolarHBondContact O-CB 3.39Å; L345-T349 WeakPolarHBondContact O-CG2 3.12Å; L345-T349 PolarHBondContact O-N 3.28Å; L345-T349 PolarHBondContact O-OG1 3.47Å; L345-A363 HydrophobicContact CB-CB 4.47Å; L345-A363 HydrophobicContact CD2-CB 4.36Å; L345-A363 HydrophobicContact CG-CB 4.41Å; L345-L367 HydrophobicContact CD2-CB 3.96Å; L345-L367 HydrophobicContact CD2-CD1 3.71Å; L345-L367 HydrophobicContact CD2-CG 4.43Å
346	A	88.6	Confident	86.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-61	-42.5	174.7	0	0	0	0	0	111.8	L342 T343 L344 G350 R351 P358 A363	L342-A346 WeakPolarHBondContact O-CB 3.5Å; L342-A346 PolarHBondContact O-N 3.46Å; T343-A346 PolarHBondContact O-N 2.85Å; L344-A346 VanDerWaalsContact C-N 3.35Å; L344-A346 PolarHBondContact O-N 3.19Å; A346-G350 PolarHBondContact O-N 3Å; A346-G350 VanDerWaalsContact O-N 3.12Å; A346-R351 HydrophobicContact CB-CB 4.46Å; A346-R351 PolarHBondContact O-N 3.37Å; A346-P358 HydrophobicContact CB-CB 3.71Å; A346-A363 HydrophobicContact CB-CB 3.75Å
347	K	89.6	Confident	86.9	Confident	126 Å²	126	65 Å²	65	55%	0.548	36%	0.362	S	S	.	.	H	α-helix	trans	-65.4	-51.4	176.2	-72	175.8	180	177.6	0	111.5	T343 L344 L345 T349 G350 P358	T343-K347 WeakPolarHBondContact O-CG 3.37Å; T343-K347 PolarHBondContact O-N 3.4Å; L344-K347 PolarHBondContact O-N 2.98Å; L345-K347 VanDerWaalsContact C-N 3.34Å; K347-T349 VanDerWaalsContact C-N 3.29Å; K347-T349 PolarHBondContact O-N 3.4Å; K347-G350 PolarHBondContact O-N 3.32Å; K347-G350 VanDerWaalsContact O-N 3.16Å; K347-P358 HydrophobicContact CD-CG 4.42Å; K347-P358 HydrophobicContact CG-CB 4.43Å; K347-P358 HydrophobicContact CG-CG 3.87Å
348	S	83.9	Confident	87.4	Confident	72 Å²	72	62.8 Å²	62.8	50%	0.503	35%	0.352	S	S	.	.	H	α-helix	trans	-63.9	-33.2	-177.4	71.9	0	0	0	0	112.8	L344 L345	L344-S348 PolarHBondContact O-N 3.06Å; L344-S348 PolarHBondContact O-OG 3.22Å; L345-S348 PolarHBondContact O-OG 3.47Å
349	T	81.8	Confident	87.8	Confident	46 Å²	46	63 Å²	63	28%	0.282	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	3.1	178.9	63.5	0	0	0	0	114.3	L345 K347 R351	L345-T349 HydrophobicContact CD1-CG2 3.94Å; L345-T349 HydrophobicContact CG-CG2 4.42Å; L345-T349 WeakPolarHBondContact O-CB 3.39Å; L345-T349 WeakPolarHBondContact O-CG2 3.12Å; L345-T349 PolarHBondContact O-N 3.28Å; L345-T349 PolarHBondContact O-OG1 3.47Å; K347-T349 VanDerWaalsContact C-N 3.29Å; K347-T349 PolarHBondContact O-N 3.4Å; T349-R351 VanDerWaalsContact C-N 3.32Å; T349-R351 PolarHBondContact O-N 3.34Å; T349-R351 WeakPolarHBondContact OG1-CG 3.49Å
350	G	84.8	Confident	87.8	Confident	55 Å²	55	66 Å²	66	57%	0.567	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	27.4	178.6	0	0	0	0	0	114.5	A346 K347 L352	A346-G350 PolarHBondContact O-N 3Å; A346-G350 VanDerWaalsContact O-N 3.12Å; K347-G350 PolarHBondContact O-N 3.32Å; K347-G350 VanDerWaalsContact O-N 3.16Å; G350-L352 PolarHBondContact O-N 3.49Å
351	R	85.8	Confident	87.5	Confident	74 Å²	74	68.8 Å²	68.8	28%	0.279	37%	0.367	S	S	.	.			trans	-90.3	82.5	178.4	-57.3	-52	-177.5	103.7	-15.1	109.7	A346 T349 D359 M362	A346-R351 HydrophobicContact CB-CB 4.46Å; A346-R351 PolarHBondContact O-N 3.37Å; T349-R351 VanDerWaalsContact C-N 3.32Å; T349-R351 PolarHBondContact O-N 3.34Å; T349-R351 WeakPolarHBondContact OG1-CG 3.49Å; R351-D359 WeakPolarHBondContact O-CB 3.37Å; R351-D359 PolarHBondContact O-N 3.42Å; R351-M362 HydrophobicContact CB-CB 4.26Å; R351-M362 HydrophobicContact CB-CE 4.24Å; R351-M362 HydrophobicContact CG-CE 4.35Å
352	L	90.9	Very high	87.1	Confident	85 Å²	85	72.2 Å²	72.2	45%	0.445	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-114.5	143.7	-178.4	-51.8	179.1	0	0	0	111.1	G350 I357 P358	G350-L352 PolarHBondContact O-N 3.49Å; L352-I357 CarbonylContact C-O 3.51Å; L352-I357 WeakPolarHBondContact CA-O 3.46Å; L352-P358 HydrophobicContact CD2-CB 4.35Å; L352-P358 HydrophobicContact CD2-CG 4.29Å
353	R	89.7	Confident	86.9	Confident	167 Å²	167	72.2 Å²	72.2	63%	0.63	38%	0.383	S	S	*	.			trans	-81.4	178.5	168.5	-57.4	-177.3	71.9	-176.8	-0	110.1	G355 G356 I357 D359	R353-G355 PolarHBondContact O-N 2.87Å; R353-G356 PolarHBondContact O-N 3.37Å; R353-G356 VanDerWaalsContact O-N 3.16Å; R353-I357 HydrophobicContact CB-CB 4.49Å; R353-I357 PolarHBondContact N-O 3.3Å; R353-D359 HydrophobicContact CG-CB 3.7Å; R353-D359 WeakPolarHBondContact CG-OD2 3.49Å
354	K	89.4	Confident	86.1	Confident	204 Å²	204	70.6 Å²	70.6	89%	0.887	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-54.6	137.3	170.1	-67.4	-175.6	179.7	179.7	0	109.6
355	G	91.6	Very high	85.1	Confident	82 Å²	82	73.3 Å²	73.3	85%	0.845	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	83.5	7.7	-176.5	0	0	0	0	0	114.9	R353 I357	R353-G355 PolarHBondContact O-N 2.87Å; G355-I357 VanDerWaalsContact C-N 3.26Å; G355-I357 PolarHBondContact O-N 2.99Å
356	G	90.1	Very high	84.2	Confident	44 Å²	44	75.7 Å²	75.7	45%	0.454	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	78.1	8.9	177.7	0	0	0	0	0	114.4	R353 P358	R353-G356 PolarHBondContact O-N 3.37Å; R353-G356 VanDerWaalsContact O-N 3.16Å; G356-P358 WeakPolarHBondContact O-CD 3.37Å
357	I	92	Very high	82.9	Confident	105 Å²	105	75.9 Å²	75.9	54%	0.538	39%	0.393	S	S	.	.			trans	-70.1	125.7	179.5	-58.3	170.2	0	0	0	109.4	L352 R353 G355 D359	L352-I357 CarbonylContact C-O 3.51Å; L352-I357 WeakPolarHBondContact CA-O 3.46Å; R353-I357 HydrophobicContact CB-CB 4.49Å; R353-I357 PolarHBondContact N-O 3.3Å; G355-I357 VanDerWaalsContact C-N 3.26Å; G355-I357 PolarHBondContact O-N 2.99Å; I357-D359 PolarHBondContact O-N 2.92Å
358	P	91.1	Very high	81.1	Confident	31 Å²	31	71.4 Å²	71.4	20%	0.201	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-56.3	127.9	176.1	-25.9	35.9	0	0	0	112.9	T343 A346 K347 L352 G356 R360	T343-P358 HydrophobicContact CG2-CB 4Å; T343-P358 HydrophobicContact CG2-CG 3.95Å; A346-P358 HydrophobicContact CB-CB 3.71Å; K347-P358 HydrophobicContact CD-CG 4.42Å; K347-P358 HydrophobicContact CG-CB 4.43Å; K347-P358 HydrophobicContact CG-CG 3.87Å; L352-P358 HydrophobicContact CD2-CB 4.35Å; L352-P358 HydrophobicContact CD2-CG 4.29Å; G356-P358 WeakPolarHBondContact O-CD 3.37Å; P358-R360 PolarHBondContact O-N 3.13Å
359	D	88.3	Confident	79.3	Confident	25 Å²	25	72.5 Å²	72.5	13%	0.134	37%	0.371	C	S	.	.			trans	-90.1	87.8	178.9	-165.5	-31.3	0	0	0	110.7	R351 R353 I357 R361 M362 A363	R351-D359 WeakPolarHBondContact O-CB 3.37Å; R351-D359 PolarHBondContact O-N 3.42Å; R353-D359 HydrophobicContact CG-CB 3.7Å; R353-D359 WeakPolarHBondContact CG-OD2 3.49Å; I357-D359 PolarHBondContact O-N 2.92Å; D359-R361 PolarHBondContact O-N 2.88Å; D359-R361 PolarHBondContact OD1-N 3.01Å; D359-R361 VanDerWaalsContact OD1-N 3.15Å; D359-M362 HydrophobicContact CB-CB 3.94Å; D359-M362 HydrophobicContact CB-CG 4.38Å; D359-M362 PolarHBondContact O-N 3.32Å; D359-M362 PolarHBondContact OD1-N 3.36Å; D359-M362 WeakPolarHBondContact OD2-CG 3.27Å; D359-A363 WeakPolarHBondContact O-CB 3.29Å; D359-A363 PolarHBondContact O-N 3.05Å
360	R	83.8	Confident	77.4	Confident	111 Å²	111	72.2 Å²	72.2	42%	0.419	37%	0.367	S	S	.	.	H	α-helix	trans	-54.7	-37.9	177.6	-61	-172	-62.1	-157.4	-1.4	112.7	D339 L342 P358 A363 A364	D339-R360 WeakPolarHBondContact OD1-CD 3.33Å; D339-R360 IonicContact OD1-CZ 3.41Å; D339-R360 IonicContact OD1-NE 3.99Å; D339-R360 PolarHBondContact OD1-NE 3.3Å; D339-R360 IonicContact OD1-NH1 3.2Å; D339-R360 PolarHBondContact OD1-NH1 3.38Å; D339-R360 IonicContact OD2-NH1 3.66Å; L342-R360 HydrophobicContact CB-CB 4.12Å; L342-R360 HydrophobicContact CB-CG 4.21Å; L342-R360 HydrophobicContact CD1-CB 4.48Å; P358-R360 PolarHBondContact O-N 3.13Å; R360-A363 PolarHBondContact O-N 2.97Å; R360-A364 WeakPolarHBondContact O-CB 3.46Å; R360-A364 PolarHBondContact O-N 3.09Å
361	R	80.4	Confident	75.3	Confident	142 Å²	142	69.6 Å²	69.6	54%	0.536	34%	0.34	S	S	.	.	H	α-helix	trans	-70.4	-41.7	-178.5	-168.2	173.7	-173.3	163.5	2.6	111.4	D359 R365	D359-R361 PolarHBondContact O-N 2.88Å; D359-R361 PolarHBondContact OD1-N 3.01Å; D359-R361 VanDerWaalsContact OD1-N 3.15Å; R361-R365 WeakPolarHBondContact O-CB 3Å; R361-R365 VanDerWaalsContact O-CG 3.27Å; R361-R365 WeakPolarHBondContact O-CG 3.26Å; R361-R365 PolarHBondContact O-N 2.85Å
362	M	77.8	Confident	73.1	Confident	73 Å²	73	67.7 Å²	67.7	36%	0.36	34%	0.337	S	S	.	.	H	α-helix	trans	-70.2	-33.3	173.2	-78	-171.5	30.3	0	0	112.6	R351 D359 K366	R351-M362 HydrophobicContact CB-CB 4.26Å; R351-M362 HydrophobicContact CB-CE 4.24Å; R351-M362 HydrophobicContact CG-CE 4.35Å; D359-M362 HydrophobicContact CB-CB 3.94Å; D359-M362 HydrophobicContact CB-CG 4.38Å; D359-M362 PolarHBondContact O-N 3.32Å; D359-M362 PolarHBondContact OD1-N 3.36Å; D359-M362 WeakPolarHBondContact OD2-CG 3.27Å; M362-K366 WeakPolarHBondContact O-CB 3.5Å; M362-K366 PolarHBondContact O-N 2.64Å
363	A	80.1	Confident	70.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.2	-47.2	172.9	0	0	0	0	0	111.3	L342 L345 A346 D359 R360 R365 K366 L367	L342-A363 HydrophobicContact CD2-CB 4.35Å; L342-A363 WeakPolarHBondContact O-CB 3.47Å; L345-A363 HydrophobicContact CB-CB 4.47Å; L345-A363 HydrophobicContact CD2-CB 4.36Å; L345-A363 HydrophobicContact CG-CB 4.41Å; A346-A363 HydrophobicContact CB-CB 3.75Å; D359-A363 WeakPolarHBondContact O-CB 3.29Å; D359-A363 PolarHBondContact O-N 3.05Å; R360-A363 PolarHBondContact O-N 2.97Å; A363-R365 PolarHBondContact O-N 3.24Å; A363-K366 CarbonylContact O-C 3.52Å; A363-K366 WeakPolarHBondContact O-CA 3.42Å; A363-K366 WeakPolarHBondContact O-CB 3.21Å; A363-K366 PolarHBondContact O-N 3.08Å; A363-L367 WeakPolarHBondContact O-CB 3.34Å; A363-L367 PolarHBondContact O-N 2.54Å
364	A	74	Confident	68.6	Low	6 Å²	6	58.1 Å²	58.1	5%	0.05	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-42.1	175.4	0	0	0	0	0	112.2	C313 L342 R360 K366 L367 K368	C313-A364 HydrophobicContact CB-CB 3.43Å; C313-A364 VanDerWaalsContact CB-CB 3.43Å; C313-A364 WeakPolarHBondContact O-CB 3.24Å; L342-A364 HydrophobicContact CD1-CB 4.14Å; L342-A364 HydrophobicContact CD2-CB 3.67Å; R360-A364 WeakPolarHBondContact O-CB 3.46Å; R360-A364 PolarHBondContact O-N 3.09Å; A364-K366 VanDerWaalsContact C-N 3.3Å; A364-K366 PolarHBondContact O-N 3.28Å; A364-L367 WeakPolarHBondContact O-CB 3.45Å; A364-L367 PolarHBondContact O-N 3.09Å; A364-K368 PolarHBondContact O-N 2.84Å
365	R	68.6	Low	66.3	Low	88 Å²	88	51.7 Å²	51.7	33%	0.332	28%	0.282	S	S	.	.	H	α-helix	trans	-62.6	-36.5	171.3	-74.4	175	174.5	-179.9	-2	112.6	R361 A363 K368 H369	R361-R365 WeakPolarHBondContact O-CB 3Å; R361-R365 VanDerWaalsContact O-CG 3.27Å; R361-R365 WeakPolarHBondContact O-CG 3.26Å; R361-R365 PolarHBondContact O-N 2.85Å; A363-R365 PolarHBondContact O-N 3.24Å; R365-K368 WeakPolarHBondContact O-CB 3.41Å; R365-K368 PolarHBondContact O-N 3.07Å; R365-H369 PolarHBondContact O-CD2 3.44Å; R365-H369 PolarHBondContact O-N 2.88Å
366	K	65.1	Low	64.1	Low	53 Å²	53	51 Å²	51	23%	0.23	26%	0.263	C	S	.	.	H	α-helix	trans	-75	-35.5	177.8	-174.6	55.7	171.4	170.1	0	111.2	M362 A363 A364 K368 H369 M370	M362-K366 WeakPolarHBondContact O-CB 3.5Å; M362-K366 PolarHBondContact O-N 2.64Å; A363-K366 CarbonylContact O-C 3.52Å; A363-K366 WeakPolarHBondContact O-CA 3.42Å; A363-K366 WeakPolarHBondContact O-CB 3.21Å; A363-K366 PolarHBondContact O-N 3.08Å; A364-K366 VanDerWaalsContact C-N 3.3Å; A364-K366 PolarHBondContact O-N 3.28Å; K366-K368 PolarHBondContact O-N 3.13Å; K366-H369 HydrophobicContact CD-CB 4.31Å; K366-H369 CarbonylContact O-C 3.46Å; K366-H369 WeakPolarHBondContact O-CA 2.97Å; K366-H369 PolarHBondContact O-N 3.43Å; K366-M370 HydrophobicContact CD-CG 4.15Å; K366-M370 HydrophobicContact CG-CG 4.13Å; K366-M370 VanDerWaalsContact O-CB 3.29Å; K366-M370 WeakPolarHBondContact O-CB 3.25Å; K366-M370 PolarHBondContact O-N 2.77Å
367	L	62.6	Low	62.1	Low	4 Å²	4	50.3 Å²	50.3	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-55.2	-40.9	165.6	-169	79.9	0	0	0	108.6	V317 Y330 F341 L345 A363 A364 H369 M370 G371	V317-L367 HydrophobicContact CB-CD2 4.24Å; V317-L367 HydrophobicContact CG1-CD2 3.94Å; V317-L367 HydrophobicContact CG2-CD2 3.64Å; Y330-L367 HydrophobicContact CD2-CD1 4.43Å; Y330-L367 HydrophobicContact CE1-CD1 4.42Å; Y330-L367 HydrophobicContact CE2-CD1 3.42Å; Y330-L367 VanDerWaalsContact CE2-CD1 3.42Å; Y330-L367 VanDerWaalsContact CZ-CD1 3.44Å; Y330-L367 VanDerWaalsContact OH-CD1 3.24Å; Y330-L367 WeakPolarHBondContact OH-CD1 3.48Å; F341-L367 HydrophobicContact CE1-CD1 3.94Å; F341-L367 HydrophobicContact CE1-CD2 3.88Å; F341-L367 HydrophobicContact CZ-CD1 3.62Å; F341-L367 HydrophobicContact CZ-CD2 4.36Å; L345-L367 HydrophobicContact CD2-CB 3.96Å; L345-L367 HydrophobicContact CD2-CD1 3.71Å; L345-L367 HydrophobicContact CD2-CG 4.43Å; A363-L367 WeakPolarHBondContact O-CB 3.34Å; A363-L367 PolarHBondContact O-N 2.54Å; A364-L367 WeakPolarHBondContact O-CB 3.45Å; A364-L367 PolarHBondContact O-N 3.09Å; L367-H369 PolarHBondContact O-N 2.8Å; L367-M370 CarbonylContact O-C 3.52Å; L367-M370 PolarHBondContact O-N 3.15Å; L367-M370 VanDerWaalsContact O-N 3.09Å; L367-G371 WeakPolarHBondContact O-CA 3.04Å; L367-G371 PolarHBondContact O-N 2.85Å
368	K	51.7	Low	60	Low	32 Å²	32	51.3 Å²	51.3	14%	0.139	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-17.8	172.3	-160.8	173.2	178.7	174	0	115.2	A301 N304 T308 A364 R365 K366 N373	A301-K368 VanDerWaalsContact C-NZ 3.26Å; A301-K368 WeakPolarHBondContact O-CE 3.38Å; A301-K368 PolarHBondContact O-NZ 3.35Å; N304-K368 WeakPolarHBondContact OD1-CE 3.15Å; T308-K368 HydrophobicContact CG2-CD 3.96Å; A364-K368 PolarHBondContact O-N 2.84Å; R365-K368 WeakPolarHBondContact O-CB 3.41Å; R365-K368 PolarHBondContact O-N 3.07Å; K366-K368 PolarHBondContact O-N 3.13Å; K368-N373 WeakPolarHBondContact O-CB 3.15Å; K368-N373 PolarHBondContact O-ND2 2.84Å
369	H	45.4	Very low	58.3	Low	95 Å²	95	50.2 Å²	50.2	44%	0.44	25%	0.249	S	C	.	.	H	α-helix	trans	-100.8	-11.6	173.4	-66.2	-60.8	0	0	0	113.8	R365 K366 L367 S376	R365-H369 PolarHBondContact O-CD2 3.44Å; R365-H369 PolarHBondContact O-N 2.88Å; K366-H369 HydrophobicContact CD-CB 4.31Å; K366-H369 CarbonylContact O-C 3.46Å; K366-H369 WeakPolarHBondContact O-CA 2.97Å; K366-H369 PolarHBondContact O-N 3.43Å; L367-H369 PolarHBondContact O-N 2.8Å; H369-S376 PolarHBondContact O-OG 2.96Å
370	M	43.2	Very low	57	Low	40 Å²	40	53.5 Å²	53.5	20%	0.197	26%	0.26	C	S	.	.	H	α-helix	trans	-116.1	-21.8	-177.8	-81	-82.8	-171.3	0	0	113.3	Y330 K366 L367 K378	Y330-M370 HydrophobicContact CE1-CB 4.01Å; Y330-M370 PolarHBondContact OH-O 3.22Å; Y330-M370 VanDerWaalsContact OH-O 3.08Å; K366-M370 HydrophobicContact CD-CG 4.15Å; K366-M370 HydrophobicContact CG-CG 4.13Å; K366-M370 VanDerWaalsContact O-CB 3.29Å; K366-M370 WeakPolarHBondContact O-CB 3.25Å; K366-M370 PolarHBondContact O-N 2.77Å; L367-M370 CarbonylContact O-C 3.52Å; L367-M370 PolarHBondContact O-N 3.15Å; L367-M370 VanDerWaalsContact O-N 3.09Å; M370-K378 PolarHBondContact O-N 3.29Å; M370-K378 HydrophobicContact SD-CD 3.83Å; M370-K378 HydrophobicContact SD-CG 4.01Å
371	G	39.8	Very low	56.4	Low	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-77.5	-158.8	178.7	0	0	0	0	0	110	Y330 L367 N373 G377	Y330-G371 WeakPolarHBondContact OH-CA 3.3Å; Y330-G371 PolarHBondContact OH-N 2.87Å; L367-G371 WeakPolarHBondContact O-CA 3.04Å; L367-G371 PolarHBondContact O-N 2.85Å; G371-N373 PolarHBondContact O-N 3.43Å; G371-G377 VanDerWaalsContact O-CA 3.26Å; G371-G377 WeakPolarHBondContact O-CA 3.29Å
372	P	39.6	Very low	56.4	Low	34 Å²	34	44.5 Å²	44.5	22%	0.221	23%	0.226	C	C	.	.	S	Bend	trans	-73.2	45	-173.6	32.7	-35.3	0	0	0	112.6	I320 P374 Y381	I320-P372 HydrophobicContact CD1-CG 3.94Å; I320-P372 HydrophobicContact CG1-CG 4.11Å; I320-P372 HydrophobicContact CG2-CG 3.91Å; P372-P374 VanDerWaalsContact O-CD 3.27Å; P372-P374 WeakPolarHBondContact O-CD 3.25Å; P372-Y381 HydrophobicContact CB-CD1 3.97Å; P372-Y381 HydrophobicContact CB-CE1 3.15Å
373	N	38.8	Very low	56.7	Low	22 Å²	22	42 Å²	42	12%	0.118	22%	0.216	C	C	.	.			trans	-96.1	107.5	173.5	-164.5	-16.8	0	0	0	110.1	K368 G371 S375 S376 G377	K368-N373 WeakPolarHBondContact O-CB 3.15Å; K368-N373 PolarHBondContact O-ND2 2.84Å; G371-N373 PolarHBondContact O-N 3.43Å; N373-S375 PolarHBondContact O-N 3.4Å; N373-S376 PolarHBondContact O-N 3.27Å; N373-G377 PolarHBondContact O-N 2.6Å
374	P	46.5	Very low	57.1	Low	30 Å²	30	45.4 Å²	45.4	20%	0.195	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	34.5	-166.5	27.4	-34.8	0	0	0	116.3	D143 R145 K172 L175 P372	D143-P374 WeakPolarHBondContact OD2-CB 3.31Å; D143-P374 VanDerWaalsContact OD2-CG 3.3Å; D143-P374 WeakPolarHBondContact OD2-CG 3.15Å; R145-P374 VanDerWaalsContact CZ-CB 3.42Å; K172-P374 HydrophobicContact CD-CB 3.86Å; K172-P374 PolarHBondContact NZ-O 2.85Å; L175-P374 HydrophobicContact CD1-CB 4.35Å; P372-P374 VanDerWaalsContact O-CD 3.27Å; P372-P374 WeakPolarHBondContact O-CD 3.25Å
375	S	42.5	Very low	57.9	Low	69 Å²	69	46 Å²	46	48%	0.483	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-12.4	164.4	58.9	0	0	0	0	113.1	Q204 N373	Q204-S375 PolarHBondContact NE2-O 2.93Å; N373-S375 PolarHBondContact O-N 3.4Å
376	S	44.3	Very low	58.8	Low	66 Å²	66	44 Å²	44	46%	0.462	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-157.5	4.6	-178.6	61.7	0	0	0	0	115.7	H369 N373	H369-S376 PolarHBondContact O-OG 2.96Å; N373-S376 PolarHBondContact O-N 3.27Å
377	G	48.7	Very low	59.4	Low	30 Å²	30	48.8 Å²	48.8	31%	0.309	26%	0.262	S	S	.	.			trans	-68.6	138.3	-172.5	0	0	0	0	0	113.2	G371 N373 I379	G371-G377 VanDerWaalsContact O-CA 3.26Å; G371-G377 WeakPolarHBondContact O-CA 3.29Å; N373-G377 PolarHBondContact O-N 2.6Å; G377-I379 VanDerWaalsContact C-N 3.33Å
378	K	47.5	Very low	59.5	Low	126 Å²	126	51.1 Å²	51.1	55%	0.548	27%	0.274	S	S	.	.	S	Bend	trans	-76.2	-24.5	170.5	-71	-175.1	174.4	-171.1	0	111.7	L329 M370 R380	L329-K378 HydrophobicContact CD1-CB 4.31Å; L329-K378 WeakPolarHBondContact CD1-O 3.39Å; M370-K378 PolarHBondContact O-N 3.29Å; M370-K378 HydrophobicContact SD-CD 3.83Å; M370-K378 HydrophobicContact SD-CG 4.01Å; K378-R380 PolarHBondContact O-N 3.05Å; K378-R380 VanDerWaalsContact O-N 3.1Å
379	I	54.9	Low	59.4	Low	8 Å²	8	61.5 Å²	61.5	4%	0.041	31%	0.312	C	S	.	.			trans	-72.9	103.3	-179.6	-35.7	-152	0	0	0	108.7	I320 L326 L329 Y330 G377 Y381	I320-I379 HydrophobicContact CG2-CD1 4.38Å; L326-I379 HydrophobicContact CD2-CD1 4.36Å; L329-I379 HydrophobicContact CD1-CB 4.47Å; L329-I379 HydrophobicContact CD1-CG1 4.41Å; L329-I379 HydrophobicContact CD2-CB 3.74Å; L329-I379 HydrophobicContact CD2-CD1 3.17Å; L329-I379 HydrophobicContact CD2-CG1 3.12Å; L329-I379 HydrophobicContact CD2-CG2 3.83Å; L329-I379 HydrophobicContact CG-CG1 4.22Å; Y330-I379 HydrophobicContact CE2-CD1 4.32Å; G377-I379 VanDerWaalsContact C-N 3.33Å; I379-Y381 HydrophobicContact CG2-CD1 4.14Å
380	R	62.9	Low	59.7	Low	94 Å²	94	61.1 Å²	61.1	36%	0.355	32%	0.32	S	S	.	.			trans	-84.5	114.7	166	-65.4	-177	-177.5	140.8	-0.3	106.8	K378 A425 E428 A429 V430	K378-R380 PolarHBondContact O-N 3.05Å; K378-R380 VanDerWaalsContact O-N 3.1Å; R380-A425 PolarHBondContact NE-O 2.71Å; R380-A425 PolarHBondContact NH1-O 3.3Å; R380-E428 IonicContact NH1-OE2 2.64Å; R380-A429 HydrophobicContact CB-CB 3.78Å; R380-A429 CarbonylContact O-C 3.36Å; R380-A429 VanDerWaalsContact O-CA 3.28Å; R380-A429 WeakPolarHBondContact O-CA 3.35Å; R380-V430 PolarHBondContact O-N 3.11Å
381	Y	70.7	Confident	60.1	Low	39 Å²	39	62.4 Å²	62.4	15%	0.153	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	157	170.4	72.9	-80.7	0	0	0	108.4	R145 P372 I379 V430 M432	R145-Y381 HydrophobicContact CB-CE2 4.25Å; R145-Y381 WeakPolarHBondContact CB-O 3.45Å; R145-Y381 WeakPolarHBondContact CD-O 3.41Å; R145-Y381 VanDerWaalsContact CG-O 3.27Å; R145-Y381 WeakPolarHBondContact CG-O 3.4Å; R145-Y381 PolarHBondContact NH1-OH 3.01Å; R145-Y381 PolarHBondContact NH2-OH 3.22Å; P372-Y381 HydrophobicContact CB-CD1 3.97Å; P372-Y381 HydrophobicContact CB-CE1 3.15Å; I379-Y381 HydrophobicContact CG2-CD1 4.14Å; Y381-V430 CarbonylContact C-O 3.5Å; Y381-V430 WeakPolarHBondContact CA-O 3.27Å; Y381-V430 WeakPolarHBondContact CB-O 3.43Å; Y381-M432 HydrophobicContact CD2-CG 3.89Å; Y381-M432 HydrophobicContact CG-CG 4.39Å
382	Y	80.8	Confident	61	Low	26 Å²	26	64.9 Å²	64.9	10%	0.102	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	153.4	169.7	63.1	-89.7	0	0	0	110	R145 I176 P177 N180 E384 I426 A429 V430 I431 M432	R145-Y382 CarbonylContact O-C 3.55Å; R145-Y382 WeakPolarHBondContact O-CA 3.46Å; I176-Y382 HydrophobicContact CB-CG 4.49Å; I176-Y382 VanDerWaalsContact CG2-CB 3.48Å; I176-Y382 HydrophobicContact CG2-CG 4.25Å; P177-Y382 HydrophobicContact CG-CD1 4.37Å; P177-Y382 HydrophobicContact CG-CE1 3.71Å; P177-Y382 HydrophobicContact CG-CE2 4.17Å; N180-Y382 HydrophobicContact CB-CD2 4.34Å; N180-Y382 HydrophobicContact CB-CE2 4.24Å; N180-Y382 WeakPolarHBondContact ND2-CD2 3.47Å; Y382-E384 HydrophobicContact CE2-CG 4.24Å; Y382-I426 HydrophobicContact CE1-CG2 4.32Å; Y382-A429 HydrophobicContact CD1-CB 3.78Å; Y382-A429 HydrophobicContact CE1-CB 3.66Å; Y382-V430 PolarHBondContact N-O 3.31Å; Y382-I431 HydrophobicContact CE1-CG1 4.32Å; Y382-I431 HydrophobicContact CE2-CD1 4.46Å; Y382-I431 HydrophobicContact CE2-CG1 3.92Å; Y382-I431 WeakPolarHBondContact O-CA 3.24Å; Y382-M432 PolarHBondContact O-N 3.04Å
383	C	83.2	Confident	61.7	Low	21 Å²	21	69.8 Å²	69.8	14%	0.142	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	150	168.9	-53.9	0	0	0	0	108.9	R145 N180 W184	R145-C383 PolarHBondContact O-N 2.95Å; N180-C383 PolarHBondContact ND2-O 3.03Å; W184-C383 HydrophobicContact CZ2-CB 4.06Å; W184-C383 PolarHBondContact NE1-O 3.46Å
384	E	87.9	Confident	62.5	Low	71 Å²	71	71.3 Å²	71.3	33%	0.332	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-89.7	153.1	161.8	-63.1	-147.3	137.7	0	0	109.1	K183 W184 Y382 I431	K183-E384 IonicContact NZ-OE1 3.25Å; K183-E384 PolarHBondContact NZ-OE1 3.48Å; K183-E384 IonicContact NZ-OE2 3.79Å; K183-E384 PolarHBondContact NZ-OE2 3.43Å; W184-E384 WeakPolarHBondContact CZ2-O 3.23Å; Y382-E384 HydrophobicContact CE2-CG 4.24Å; E384-I431 HydrophobicContact CG-CG2 4.19Å
385	P	90.6	Very high	63.5	Low	17 Å²	17	72.7 Å²	72.7	11%	0.11	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-63.4	152	170	26.4	-31.8	0	0	0	110.6	K183 W184 Y187	K183-P385 HydrophobicContact CB-CG 3.68Å; W184-P385 HydrophobicContact CD2-CB 4Å; W184-P385 HydrophobicContact CD2-CG 4.29Å; W184-P385 HydrophobicContact CE3-CB 3.78Å; W184-P385 VanDerWaalsContact CH2-CA 3.5Å; W184-P385 HydrophobicContact CH2-CB 4.02Å; W184-P385 HydrophobicContact CZ2-CB 4.24Å; W184-P385 VanDerWaalsContact CZ2-N 3.35Å; W184-P385 HydrophobicContact CZ3-CB 3.78Å; Y187-P385 HydrophobicContact CD2-CB 3.87Å; Y187-P385 HydrophobicContact CG-CB 3.82Å
386	P	87.7	Confident	65.1	Low	46 Å²	46	76.8 Å²	76.8	30%	0.299	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-53.8	141.3	175.4	-25.9	33.8	0	0	0	113.1	L148 Y187 D388	L148-P386 HydrophobicContact CD1-CG 4.05Å; Y187-P386 HydrophobicContact CE2-CB 4.35Å; Y187-P386 HydrophobicContact CE2-CG 4.19Å; P386-D388 VanDerWaalsContact C-N 3.32Å; P386-D388 PolarHBondContact O-N 3.03Å
387	D	78.1	Confident	66.5	Low	155 Å²	155	77.8 Å²	77.8	83%	0.829	42%	0.423	S	S	*	.			trans	-72.8	84.6	171	-75.5	-31.3	0	0	0	109.7	R389	D387-R389 PolarHBondContact O-N 2.78Å
388	D	64.6	Low	67.7	Low	52 Å²	52	77.4 Å²	77.4	28%	0.278	41%	0.414	S	S	.	.			trans	-68.8	102	-177	-99.7	-17.9	0	0	0	112.5	R190 P386 I392	R190-D388 IonicContact NH1-OD2 2.77Å; R190-D388 PolarHBondContact NH1-OD2 3Å; P386-D388 VanDerWaalsContact C-N 3.32Å; P386-D388 PolarHBondContact O-N 3.03Å; D388-I392 VanDerWaalsContact OD2-CD1 3.32Å; D388-I392 WeakPolarHBondContact OD2-CD1 3.28Å; D388-I392 WeakPolarHBondContact OD2-CG1 3.41Å
389	R	49.9	Very low	69.4	Low	250 Å²	250	75 Å²	75	94%	0.943	41%	0.407	S	S	*	.	S	Bend	trans	-88.7	-19.6	152.2	-62.7	-176.5	-160.3	-178.3	6.1	112.1	D387	D387-R389 PolarHBondContact O-N 2.78Å
390	S	51	Low	70.8	Confident	87 Å²	87	80.7 Å²	80.7	61%	0.608	43%	0.434	S	S	*	.	S	Bend	trans	-95.6	102.4	175.8	45.8	0	0	0	0	108.8	I392	S390-I392 PolarHBondContact O-N 2.64Å
391	G	52.9	Low	71.8	Confident	68 Å²	68	77 Å²	77	70%	0.701	42%	0.421	S	S	*	.			trans	-53.6	113.4	177	0	0	0	0	0	110.7	V393	G391-V393 PolarHBondContact O-N 3.23Å; G391-V393 VanDerWaalsContact O-N 3.07Å
392	I	57.6	Low	72.6	Confident	52 Å²	52	76.7 Å²	76.7	27%	0.267	42%	0.421	S	S	.	.			trans	-51.4	118.9	162.7	-64.6	169.3	0	0	0	106.1	Y187 E191 D388 S390 C394	Y187-I392 HydrophobicContact CE1-CD1 4.42Å; Y187-I392 HydrophobicContact CE2-CD1 3.92Å; E191-I392 HydrophobicContact CG-CG2 4.3Å; D388-I392 VanDerWaalsContact OD2-CD1 3.32Å; D388-I392 WeakPolarHBondContact OD2-CD1 3.28Å; D388-I392 WeakPolarHBondContact OD2-CG1 3.41Å; S390-I392 PolarHBondContact O-N 2.64Å; I392-C394 VanDerWaalsContact C-N 3.31Å; I392-C394 PolarHBondContact O-N 2.76Å
393	V	54.9	Low	73	Confident	136 Å²	136	83.1 Å²	83.1	82%	0.824	45%	0.449	S	S	*	.			trans	-67.3	96.7	176.3	-177.7	0	0	0	0	106.3	G391 S395	G391-V393 PolarHBondContact O-N 3.23Å; G391-V393 VanDerWaalsContact O-N 3.07Å; V393-S395 PolarHBondContact O-N 3.25Å
394	C	55.6	Low	73.4	Confident	55 Å²	55	84 Å²	84	37%	0.372	45%	0.451	S	S	.	.			trans	-61.4	122	168.4	-63.9	0	0	0	0	106.6	R190 I392	R190-C394 PolarHBondContact O-SG 2.94Å; I392-C394 VanDerWaalsContact C-N 3.31Å; I392-C394 PolarHBondContact O-N 2.76Å
395	S	66.8	Low	73.6	Confident	58 Å²	58	81 Å²	81	41%	0.406	44%	0.437	S	S	.	.			trans	-74.9	138.8	174.1	175	0	0	0	0	108.7	V393 V397 V398 D399	V393-S395 PolarHBondContact O-N 3.25Å; S395-V397 PolarHBondContact O-N 3.43Å; S395-V397 PolarHBondContact OG-N 2.89Å; S395-V398 WeakPolarHBondContact O-CA 3.49Å; S395-V398 WeakPolarHBondContact O-CB 3.35Å; S395-V398 PolarHBondContact O-N 2.9Å; S395-D399 PolarHBondContact O-N 3.33Å
396	E	76.9	Confident	73.6	Confident	156 Å²	156	83.5 Å²	83.5	73%	0.729	45%	0.45	S	S	*	.	H	α-helix	trans	-51.9	-29.6	172.8	-67.1	177.5	171.8	0	0	112.2	D399 Q400	E396-D399 PolarHBondContact O-N 3.5Å; E396-Q400 WeakPolarHBondContact O-CG 3.08Å; E396-Q400 PolarHBondContact O-N 2.87Å; E396-Q400 VanDerWaalsContact O-N 3.07Å
397	V	73.6	Confident	73.8	Confident	87 Å²	87	82.7 Å²	82.7	53%	0.527	44%	0.443	S	S	.	.	H	α-helix	trans	-63.6	-42.1	175.1	-179.4	0	0	0	0	111.3	S395 Q400 M401	S395-V397 PolarHBondContact O-N 3.43Å; S395-V397 PolarHBondContact OG-N 2.89Å; V397-Q400 PolarHBondContact O-N 3.33Å; V397-M401 HydrophobicContact CG1-SD 4.1Å; V397-M401 VanDerWaalsContact O-CG 3.26Å; V397-M401 WeakPolarHBondContact O-CG 3.5Å; V397-M401 PolarHBondContact O-N 3Å
398	V	73.5	Confident	74.4	Confident	21 Å²	21	82 Å²	82	13%	0.127	44%	0.439	C	S	.	.	H	α-helix	trans	-65.3	-46.7	177.6	168.3	0	0	0	0	109.8	E191 S395 Q400 M401 M402	E191-V398 WeakPolarHBondContact O-CG1 3.45Å; S395-V398 WeakPolarHBondContact O-CA 3.49Å; S395-V398 WeakPolarHBondContact O-CB 3.35Å; S395-V398 PolarHBondContact O-N 2.9Å; V398-Q400 VanDerWaalsContact C-N 3.28Å; V398-Q400 PolarHBondContact O-N 3.47Å; V398-M401 CarbonylContact O-C 3.58Å; V398-M401 WeakPolarHBondContact O-CA 3.4Å; V398-M401 WeakPolarHBondContact O-CB 3.35Å; V398-M401 PolarHBondContact O-N 3.09Å; V398-M402 HydrophobicContact CG1-CG 4.06Å; V398-M402 WeakPolarHBondContact O-CG 3.36Å; V398-M402 PolarHBondContact O-N 3.38Å
399	D	82.6	Confident	75.6	Confident	77 Å²	77	82 Å²	82	41%	0.412	45%	0.446	S	S	.	.	H	α-helix	trans	-60.1	-38.5	179.4	-69	-22.8	0	0	0	112.4	S395 E396 M402 K403	S395-D399 PolarHBondContact O-N 3.33Å; E396-D399 PolarHBondContact O-N 3.5Å; D399-M402 PolarHBondContact O-N 3.32Å; D399-K403 WeakPolarHBondContact O-CG 3.39Å; D399-K403 PolarHBondContact O-N 3.17Å
400	Q	85	Confident	77.5	Confident	127 Å²	127	70.1 Å²	70.1	59%	0.593	40%	0.401	S	S	*	.	H	α-helix	trans	-65.1	-42.1	173.8	-72.5	177	23	0	0	112	E396 V397 V398 M402 K403	E396-Q400 WeakPolarHBondContact O-CG 3.08Å; E396-Q400 PolarHBondContact O-N 2.87Å; E396-Q400 VanDerWaalsContact O-N 3.07Å; V397-Q400 PolarHBondContact O-N 3.33Å; V398-Q400 VanDerWaalsContact C-N 3.28Å; V398-Q400 PolarHBondContact O-N 3.47Å; Q400-M402 VanDerWaalsContact C-N 3.33Å; Q400-K403 PolarHBondContact O-N 3.26Å
401	M	84.6	Confident	79.3	Confident	16 Å²	16	68.4 Å²	68.4	8%	0.079	39%	0.39	C	S	.	.	H	α-helix	trans	-66.3	-35.8	176.7	-70.7	173.1	71.3	0	0	112	L160 V397 V398 K403 E404 F405	L160-M401 HydrophobicContact CD2-CE 3.52Å; L160-M401 HydrophobicContact CD2-SD 3.93Å; V397-M401 HydrophobicContact CG1-SD 4.1Å; V397-M401 VanDerWaalsContact O-CG 3.26Å; V397-M401 WeakPolarHBondContact O-CG 3.5Å; V397-M401 PolarHBondContact O-N 3Å; V398-M401 CarbonylContact O-C 3.58Å; V398-M401 WeakPolarHBondContact O-CA 3.4Å; V398-M401 WeakPolarHBondContact O-CB 3.35Å; V398-M401 PolarHBondContact O-N 3.09Å; M401-K403 VanDerWaalsContact C-N 3.31Å; M401-K403 PolarHBondContact O-N 3.15Å; M401-E404 WeakPolarHBondContact O-CB 3.49Å; M401-E404 PolarHBondContact O-N 3.22Å; M401-F405 WeakPolarHBondContact O-CD2 3.5Å
402	M	87.2	Confident	81.1	Confident	32 Å²	32	72.9 Å²	72.9	16%	0.158	39%	0.392	C	S	.	.	H	α-helix	trans	-63.3	-36.2	178.3	-71.6	-68.8	-72	0	0	112	R189 Y192 P193 V398 D399 Q400 E404 F405 L407	R189-M402 HydrophobicContact CB-CE 4.47Å; R189-M402 WeakPolarHBondContact O-CE 3.34Å; Y192-M402 VanDerWaalsContact C-SD 3.55Å; P193-M402 HydrophobicContact CB-SD 4.31Å; P193-M402 WeakPolarHBondContact CD-SD 3.48Å; P193-M402 HydrophobicContact CG-SD 3.62Å; V398-M402 HydrophobicContact CG1-CG 4.06Å; V398-M402 WeakPolarHBondContact O-CG 3.36Å; V398-M402 PolarHBondContact O-N 3.38Å; D399-M402 PolarHBondContact O-N 3.32Å; Q400-M402 VanDerWaalsContact C-N 3.33Å; M402-E404 PolarHBondContact O-N 3.26Å; M402-E404 VanDerWaalsContact O-N 3.17Å; M402-F405 CarbonylContact O-C 3.58Å; M402-F405 PolarHBondContact O-N 3.1Å; M402-L407 HydrophobicContact CE-CD1 3.4Å; M402-L407 VanDerWaalsContact CE-CD1 3.4Å
403	K	89.1	Confident	82.5	Confident	161 Å²	161	72.8 Å²	72.8	70%	0.7	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.3	176.8	-69.6	171.9	-175	177	0	113.7	D399 Q400 M401 F405	D399-K403 WeakPolarHBondContact O-CG 3.39Å; D399-K403 PolarHBondContact O-N 3.17Å; Q400-K403 PolarHBondContact O-N 3.26Å; M401-K403 VanDerWaalsContact C-N 3.31Å; M401-K403 PolarHBondContact O-N 3.15Å; K403-F405 PolarHBondContact O-N 3.07Å
404	E	90.7	Very high	84.2	Confident	40 Å²	40	66.8 Å²	66.8	19%	0.187	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-19.6	174.9	-55.5	177.7	173.7	0	0	111.6	R165 Y234 N237 M401 M402	R165-E404 WeakPolarHBondContact CD-OE2 3.41Å; R165-E404 IonicContact CZ-OE1 3.26Å; R165-E404 IonicContact CZ-OE2 3.8Å; R165-E404 IonicContact NE-OE1 3.74Å; R165-E404 PolarHBondContact NE-OE1 2.9Å; R165-E404 IonicContact NE-OE2 3.84Å; R165-E404 PolarHBondContact NE-OE2 3.16Å; R165-E404 IonicContact NH2-OE1 2.73Å; R165-E404 PolarHBondContact NH2-OE1 3.22Å; R165-E404 IonicContact NH2-OE2 2.82Å; Y234-E404 VanDerWaalsContact CA-O 3.28Å; Y234-E404 WeakPolarHBondContact CA-O 3.39Å; Y234-E404 HydrophobicContact CD2-CB 3.92Å; Y234-E404 HydrophobicContact CE2-CB 4.42Å; Y234-E404 VanDerWaalsContact CE2-OE2 3.27Å; Y234-E404 WeakPolarHBondContact CE2-OE2 3.25Å; N237-E404 PolarHBondContact ND2-O 3.03Å; N237-E404 VanDerWaalsContact ND2-O 3.13Å; M401-E404 WeakPolarHBondContact O-CB 3.49Å; M401-E404 PolarHBondContact O-N 3.22Å; M402-E404 PolarHBondContact O-N 3.26Å; M402-E404 VanDerWaalsContact O-N 3.17Å
405	F	92.4	Very high	85.8	Confident	8 Å²	8	66.1 Å²	66.1	4%	0.035	35%	0.35	C	S	.	.	S	Bend	trans	-113.7	117	-177.7	-63.5	-83.4	0	0	0	110.8	I137 R165 V167 P193 L230 Y234 M401 M402 K403 L407	I137-F405 HydrophobicContact CD1-CE1 4.43Å; R165-F405 HydrophobicContact CB-CE2 4.22Å; R165-F405 HydrophobicContact CB-CZ 3.99Å; R165-F405 HydrophobicContact CG-CE2 4.43Å; R165-F405 HydrophobicContact CG-CZ 4.45Å; V167-F405 HydrophobicContact CG2-CD1 4.25Å; V167-F405 HydrophobicContact CG2-CE1 3.55Å; V167-F405 HydrophobicContact CG2-CE2 4.48Å; V167-F405 HydrophobicContact CG2-CZ 3.69Å; P193-F405 HydrophobicContact CB-CB 4.17Å; P193-F405 HydrophobicContact CB-CD2 4.23Å; P193-F405 HydrophobicContact CB-CG 4.07Å; P193-F405 HydrophobicContact CG-CB 4.03Å; P193-F405 HydrophobicContact CG-CD1 4.43Å; P193-F405 HydrophobicContact CG-CD2 3.35Å; P193-F405 HydrophobicContact CG-CE2 3.83Å; P193-F405 HydrophobicContact CG-CG 3.68Å; L230-F405 HydrophobicContact CD1-CB 3.81Å; L230-F405 HydrophobicContact CD1-CD1 4.27Å; L230-F405 HydrophobicContact CG-CB 4.44Å; L230-F405 HydrophobicContact CG-CD1 4.01Å; Y234-F405 HydrophobicContact CD2-CE1 4.07Å; Y234-F405 HydrophobicContact CD2-CE2 4.18Å; Y234-F405 AromaticContact CD2-CZ 3.78Å; Y234-F405 HydrophobicContact CD2-CZ 3.78Å; Y234-F405 HydrophobicContact CE2-CZ 4.43Å; Y234-F405 HydrophobicContact CG-CE1 4.08Å; Y234-F405 HydrophobicContact CG-CZ 4.22Å; M401-F405 WeakPolarHBondContact O-CD2 3.5Å; M402-F405 CarbonylContact O-C 3.58Å; M402-F405 PolarHBondContact O-N 3.1Å; K403-F405 PolarHBondContact O-N 3.07Å; F405-L407 PolarHBondContact O-N 3.38Å
406	D	91.2	Very high	86.8	Confident	69 Å²	69	68.7 Å²	68.7	37%	0.369	36%	0.358	S	S	.	.			trans	-82.8	85.9	-178.8	-170.7	-10.6	0	0	0	110.1	S233 D408 A409	S233-D406 PolarHBondContact OG-N 2.94Å; D406-D408 VanDerWaalsContact C-N 3.32Å; D406-D408 PolarHBondContact OD1-N 3.2Å; D406-A409 HydrophobicContact CB-CB 4.13Å; D406-A409 WeakPolarHBondContact OD1-CB 3.23Å; D406-A409 PolarHBondContact OD1-N 3.4Å; D406-A409 VanDerWaalsContact OD2-CB 3.27Å; D406-A409 WeakPolarHBondContact OD2-CB 3.43Å
407	L	91	Very high	87.2	Confident	30 Å²	30	62.8 Å²	62.8	16%	0.157	33%	0.333	C	S	.	.	S	Bend	trans	-70.4	-28.9	178.3	-69.3	175.7	0	0	0	112.4	R189 P193 L230 M402 F405 I410 S411	R189-L407 HydrophobicContact CG-CD1 4.12Å; P193-L407 HydrophobicContact CB-CD2 4.46Å; L230-L407 HydrophobicContact CD1-CD2 3.81Å; L230-L407 HydrophobicContact CD1-CG 4.48Å; L230-L407 HydrophobicContact CD2-CD2 4.29Å; M402-L407 HydrophobicContact CE-CD1 3.4Å; M402-L407 VanDerWaalsContact CE-CD1 3.4Å; F405-L407 PolarHBondContact O-N 3.38Å; L407-I410 HydrophobicContact CD2-CD1 4Å; L407-I410 WeakPolarHBondContact O-CG1 3.34Å; L407-I410 PolarHBondContact O-N 3.09Å; L407-S411 PolarHBondContact O-N 3.21Å
408	D	90.8	Very high	87.8	Confident	140 Å²	140	58.9 Å²	58.9	75%	0.749	31%	0.309	S	S	*	.	H	α-helix	trans	-68.7	-39.8	179.9	-66.8	-35.4	0	0	0	110.6	D406 I410 S411	D406-D408 VanDerWaalsContact C-N 3.32Å; D406-D408 PolarHBondContact OD1-N 3.2Å; D408-I410 PolarHBondContact O-N 3.4Å; D408-I410 VanDerWaalsContact O-N 3.13Å; D408-S411 WeakPolarHBondContact O-CB 3.49Å; D408-S411 PolarHBondContact O-N 3.19Å; D408-S411 VanDerWaalsContact O-N 3.15Å
409	A	89.3	Confident	88.3	Confident	51 Å²	51	63.9 Å²	63.9	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-15.7	176.3	0	0	0	0	0	115	D406	D406-A409 HydrophobicContact CB-CB 4.13Å; D406-A409 WeakPolarHBondContact OD1-CB 3.23Å; D406-A409 PolarHBondContact OD1-N 3.4Å; D406-A409 VanDerWaalsContact OD2-CB 3.27Å; D406-A409 WeakPolarHBondContact OD2-CB 3.43Å
410	I	90.8	Very high	88.3	Confident	1 Å²	1	64 Å²	64	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-105.5	-7.9	176.4	62.7	163.4	0	0	0	113.6	V195 I226 R229 L230 L407 D408 E412 E413 E414	V195-I410 HydrophobicContact CG1-CD1 4.06Å; I226-I410 HydrophobicContact CG2-CB 4.06Å; I226-I410 HydrophobicContact CG2-CD1 3.75Å; I226-I410 HydrophobicContact CG2-CG1 4.46Å; I226-I410 HydrophobicContact CG2-CG2 4.36Å; R229-I410 HydrophobicContact CB-CG2 4.1Å; R229-I410 HydrophobicContact CG-CG2 3.95Å; L230-I410 HydrophobicContact CB-CD1 4.4Å; L230-I410 HydrophobicContact CD1-CD1 4.04Å; L230-I410 HydrophobicContact CD2-CD1 4.35Å; L407-I410 HydrophobicContact CD2-CD1 4Å; L407-I410 WeakPolarHBondContact O-CG1 3.34Å; L407-I410 PolarHBondContact O-N 3.09Å; D408-I410 PolarHBondContact O-N 3.4Å; D408-I410 VanDerWaalsContact O-N 3.13Å; I410-E412 PolarHBondContact O-N 3.46Å; I410-E413 PolarHBondContact O-N 3.47Å; I410-E414 VanDerWaalsContact O-CB 3.31Å; I410-E414 WeakPolarHBondContact O-CB 3.17Å; I410-E414 PolarHBondContact O-N 2.93Å
411	S	89.6	Confident	88	Confident	52 Å²	52	58.5 Å²	58.5	36%	0.364	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-42.6	-169.5	-175.3	0	0	0	0	113.8	L407 D408 S415	L407-S411 PolarHBondContact O-N 3.21Å; D408-S411 WeakPolarHBondContact O-CB 3.49Å; D408-S411 PolarHBondContact O-N 3.19Å; D408-S411 VanDerWaalsContact O-N 3.15Å; S411-S415 WeakPolarHBondContact O-CB 3.33Å; S411-S415 PolarHBondContact O-N 3.3Å; S411-S415 PolarHBondContact O-OG 2.93Å
412	E	89.3	Confident	87.3	Confident	161 Å²	161	59.7 Å²	59.7	75%	0.752	32%	0.321	S	S	*	.	H	α-helix	trans	-66.2	-45.9	177.9	-65.6	-174.6	171.1	0	0	111.7	I410 S415 L416	I410-E412 PolarHBondContact O-N 3.46Å; E412-S415 WeakPolarHBondContact O-CB 3.47Å; E412-S415 PolarHBondContact O-N 3.06Å; E412-L416 WeakPolarHBondContact O-CG 3.38Å; E412-L416 PolarHBondContact O-N 3.4Å
413	E	87.7	Confident	86.1	Confident	51 Å²	51	63 Å²	63	24%	0.238	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-42	179.2	-171.4	173.9	-177.6	0	0	111.1	I226 R229 I410 S415 L416 V417	I226-E413 HydrophobicContact CD1-CG 4.36Å; I226-E413 HydrophobicContact CG1-CB 4.42Å; I226-E413 HydrophobicContact CG1-CG 3.94Å; R229-E413 IonicContact CZ-OE2 3.89Å; R229-E413 IonicContact NH1-OE2 2.73Å; R229-E413 PolarHBondContact NH1-OE2 3.45Å; I410-E413 PolarHBondContact O-N 3.47Å; E413-S415 VanDerWaalsContact C-N 3.35Å; E413-S415 PolarHBondContact O-N 3.27Å; E413-L416 PolarHBondContact O-N 3.05Å; E413-V417 VanDerWaalsContact O-CB 3.28Å; E413-V417 WeakPolarHBondContact O-CB 3.49Å; E413-V417 VanDerWaalsContact O-CG2 3.27Å; E413-V417 WeakPolarHBondContact O-CG2 3.42Å; E413-V417 PolarHBondContact O-N 3.46Å
414	E	89.9	Confident	84.4	Confident	9 Å²	9	59.7 Å²	59.7	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-59.6	-45.3	172.9	-175.7	172.4	-112.7	0	0	111.4	L185 R189 I226 I410 L416 V417 L418	L185-E414 HydrophobicContact CD1-CG 4.41Å; L185-E414 WeakPolarHBondContact CD1-OE1 3.39Å; R189-E414 IonicContact CZ-OE1 2.78Å; R189-E414 IonicContact CZ-OE2 3.01Å; R189-E414 VanDerWaalsContact CZ-OE2 3.25Å; R189-E414 IonicContact NH1-OE2 3.59Å; R189-E414 PolarHBondContact NH1-OE2 3.34Å; R189-E414 IonicContact NH2-OE1 2.82Å; R189-E414 PolarHBondContact NH2-OE1 3.49Å; R189-E414 IonicContact NH2-OE2 2.9Å; R189-E414 PolarHBondContact NH2-OE2 2.9Å; I226-E414 HydrophobicContact CD1-CB 4.01Å; I226-E414 HydrophobicContact CD1-CG 4.5Å; I410-E414 VanDerWaalsContact O-CB 3.31Å; I410-E414 WeakPolarHBondContact O-CB 3.17Å; I410-E414 PolarHBondContact O-N 2.93Å; E414-L416 PolarHBondContact O-N 3.47Å; E414-V417 PolarHBondContact O-N 3.22Å; E414-L418 HydrophobicContact CG-CD1 4.11Å; E414-L418 HydrophobicContact CG-CG 4.32Å; E414-L418 WeakPolarHBondContact O-CB 3.45Å; E414-L418 VanDerWaalsContact O-CG 3.25Å; E414-L418 WeakPolarHBondContact O-CG 3.32Å; E414-L418 PolarHBondContact O-N 3.34Å
415	S	89.6	Confident	82.4	Confident	42 Å²	42	58.5 Å²	58.5	29%	0.294	34%	0.342	S	S	.	.	H	α-helix	trans	-60.9	-44.1	177.5	-67.9	0	0	0	0	112.5	S411 E412 E413 L418 Q419	S411-S415 WeakPolarHBondContact O-CB 3.33Å; S411-S415 PolarHBondContact O-N 3.3Å; S411-S415 PolarHBondContact O-OG 2.93Å; E412-S415 WeakPolarHBondContact O-CB 3.47Å; E412-S415 PolarHBondContact O-N 3.06Å; E413-S415 VanDerWaalsContact C-N 3.35Å; E413-S415 PolarHBondContact O-N 3.27Å; S415-L418 PolarHBondContact O-N 3.49Å; S415-Q419 VanDerWaalsContact O-CG 3.28Å; S415-Q419 WeakPolarHBondContact O-CG 3.38Å; S415-Q419 PolarHBondContact O-N 2.96Å
416	L	87.7	Confident	80.5	Confident	112 Å²	112	59.5 Å²	59.5	59%	0.586	35%	0.347	S	S	*	.	H	α-helix	trans	-63.5	-42.9	175.9	-70.7	170.6	0	0	0	111.8	E412 E413 E414 Q419 S420	E412-L416 WeakPolarHBondContact O-CG 3.38Å; E412-L416 PolarHBondContact O-N 3.4Å; E413-L416 PolarHBondContact O-N 3.05Å; E414-L416 PolarHBondContact O-N 3.47Å; L416-Q419 PolarHBondContact O-N 3.2Å; L416-S420 PolarHBondContact O-N 3.21Å
417	V	86.2	Confident	78.4	Confident	32 Å²	32	61.3 Å²	61.3	19%	0.194	37%	0.372	C	S	.	.	H	α-helix	trans	-62.5	-45.3	177.3	159.8	0	0	0	0	111.3	I222 I226 E413 E414 Q419 S420	I222-V417 HydrophobicContact CG2-CB 4.41Å; I222-V417 HydrophobicContact CG2-CG1 3.04Å; I226-V417 HydrophobicContact CD1-CB 4.06Å; I226-V417 HydrophobicContact CD1-CG1 4.27Å; I226-V417 HydrophobicContact CD1-CG2 3.92Å; E413-V417 VanDerWaalsContact O-CB 3.28Å; E413-V417 WeakPolarHBondContact O-CB 3.49Å; E413-V417 VanDerWaalsContact O-CG2 3.27Å; E413-V417 WeakPolarHBondContact O-CG2 3.42Å; E413-V417 PolarHBondContact O-N 3.46Å; E414-V417 PolarHBondContact O-N 3.22Å; V417-Q419 VanDerWaalsContact C-N 3.32Å; V417-Q419 PolarHBondContact O-N 3.39Å; V417-S420 WeakPolarHBondContact O-CB 3.34Å; V417-S420 PolarHBondContact O-N 2.99Å; V417-S420 VanDerWaalsContact O-N 3.14Å; V417-S420 PolarHBondContact O-OG 3.43Å
418	L	86	Confident	76.3	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.021	40%	0.4	C	S	.	.	H	α-helix	trans	-65.6	-35.9	177.3	-68.1	179.7	0	0	0	111.9	I173 K178 I181 K182 L185 A196 E414 S415 S420 L421	I173-L418 HydrophobicContact CD1-CD2 4.34Å; K178-L418 VanDerWaalsContact CD-O 3.31Å; K178-L418 WeakPolarHBondContact CD-O 3.33Å; K178-L418 WeakPolarHBondContact CE-O 3.34Å; I181-L418 HydrophobicContact CB-CD2 4.35Å; I181-L418 HydrophobicContact CD1-CD2 3.98Å; I181-L418 HydrophobicContact CG2-CD1 4.03Å; I181-L418 HydrophobicContact CG2-CD2 3.58Å; I181-L418 HydrophobicContact CG2-CG 4.48Å; K182-L418 HydrophobicContact CG-CD1 4.02Å; L185-L418 HydrophobicContact CD1-CD1 4.36Å; A196-L418 HydrophobicContact CB-CD2 4.15Å; E414-L418 HydrophobicContact CG-CD1 4.11Å; E414-L418 HydrophobicContact CG-CG 4.32Å; E414-L418 WeakPolarHBondContact O-CB 3.45Å; E414-L418 VanDerWaalsContact O-CG 3.25Å; E414-L418 WeakPolarHBondContact O-CG 3.32Å; E414-L418 PolarHBondContact O-N 3.34Å; S415-L418 PolarHBondContact O-N 3.49Å; L418-S420 PolarHBondContact O-N 3.07Å; L418-L421 HydrophobicContact CD2-CD1 3.93Å; L418-L421 WeakPolarHBondContact O-CB 3.48Å; L418-L421 PolarHBondContact O-N 2.61Å
419	Q	84.4	Confident	74.7	Confident	126 Å²	126	61.7 Å²	61.7	59%	0.589	37%	0.372	S	S	*	.	H	α-helix	trans	-61.9	-31.4	174	-75.4	174.8	11	0	0	112.4	K178 S415 L416 V417 L421	K178-Q419 PolarHBondContact NZ-O 3.44Å; S415-Q419 VanDerWaalsContact O-CG 3.28Å; S415-Q419 WeakPolarHBondContact O-CG 3.38Å; S415-Q419 PolarHBondContact O-N 2.96Å; L416-Q419 PolarHBondContact O-N 3.2Å; V417-Q419 VanDerWaalsContact C-N 3.32Å; V417-Q419 PolarHBondContact O-N 3.39Å; Q419-L421 VanDerWaalsContact C-N 3.27Å; Q419-L421 PolarHBondContact O-N 3.22Å
420	S	81.6	Confident	73.2	Confident	81 Å²	81	60.7 Å²	60.7	57%	0.566	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-14.2	178.7	81.9	0	0	0	0	115.1	L416 V417 L418	L416-S420 PolarHBondContact O-N 3.21Å; V417-S420 WeakPolarHBondContact O-CB 3.34Å; V417-S420 PolarHBondContact O-N 2.99Å; V417-S420 VanDerWaalsContact O-N 3.14Å; V417-S420 PolarHBondContact O-OG 3.43Å; L418-S420 PolarHBondContact O-N 3.07Å
421	L	78.4	Confident	71.7	Confident	11 Å²	11	65 Å²	65	6%	0.058	38%	0.383	C	S	.	.	S	Bend	trans	-67.1	149.4	177.5	-65.3	172.6	0	0	0	111.1	I173 K178 I181 I222 L418 Q419 S423	I173-L421 HydrophobicContact CD1-CD1 4.03Å; I173-L421 HydrophobicContact CG1-CD1 4.16Å; K178-L421 WeakPolarHBondContact CE-O 3.26Å; K178-L421 HydrophobicContact CG-CB 4.41Å; K178-L421 PolarHBondContact NZ-O 3.34Å; I181-L421 HydrophobicContact CD1-CD1 3.6Å; I222-L421 HydrophobicContact CD1-CD2 3.64Å; L418-L421 HydrophobicContact CD2-CD1 3.93Å; L418-L421 WeakPolarHBondContact O-CB 3.48Å; L418-L421 PolarHBondContact O-N 2.61Å; Q419-L421 VanDerWaalsContact C-N 3.27Å; Q419-L421 PolarHBondContact O-N 3.22Å; L421-S423 PolarHBondContact O-N 3.19Å
422	P	69.6	Low	70	Confident	41 Å²	41	65 Å²	65	27%	0.266	38%	0.377	S	S	.	.			trans	-67.4	126.6	179.3	26.1	-33.1	0	0	0	111.7
423	S	63.7	Low	68	Low	102 Å²	102	59.7 Å²	59.7	71%	0.713	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-27.7	-178.3	-54.5	0	0	0	0	114.2	K178 L421	K178-S423 PolarHBondContact NZ-OG 3.19Å; L421-S423 PolarHBondContact O-N 3.19Å
424	S	52.6	Low	65.9	Low	91 Å²	91	64.5 Å²	64.5	64%	0.636	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	7.3	-167	81.4	0	0	0	0	115.7	N215 I426	N215-S424 PolarHBondContact OD1-OG 3.36Å; S424-I426 PolarHBondContact O-N 2.76Å
425	A	48.5	Very low	63.2	Low	14 Å²	14	71 Å²	71	12%	0.116	43%	0.428	C	S	.	.	S	Bend	trans	-80	0.8	-172.8	0	0	0	0	0	114.5	R380	R380-A425 PolarHBondContact NE-O 2.71Å; R380-A425 PolarHBondContact NH1-O 3.3Å
426	I	52.2	Low	60.6	Low	29 Å²	29	72.5 Å²	72.5	15%	0.149	44%	0.443	C	S	.	.			trans	-131.1	0.2	-152.1	-41.6	171.2	0	0	0	114.1	I176 P177 Y382 S424 E428 A429	I176-I426 WeakPolarHBondContact O-CD1 3.3Å; P177-I426 VanDerWaalsContact CA-CD1 3.49Å; P177-I426 HydrophobicContact CB-CD1 4.33Å; P177-I426 HydrophobicContact CG-CD1 4.36Å; P177-I426 HydrophobicContact CG-CG2 3.67Å; Y382-I426 HydrophobicContact CE1-CG2 4.32Å; S424-I426 PolarHBondContact O-N 2.76Å; I426-E428 PolarHBondContact O-N 3.08Å; I426-A429 HydrophobicContact CG2-CB 3.67Å; I426-A429 PolarHBondContact O-N 3.46Å; I426-A429 VanDerWaalsContact O-N 3.08Å
427	A	47.1	Very low	57.7	Low	108 Å²	108	75.5 Å²	75.5	89%	0.893	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-14.1	-179.1	0	0	0	0	0	115
428	E	47.8	Very low	54.7	Low	158 Å²	158	77.2 Å²	77.2	74%	0.738	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	13.1	-178.1	-63	172.4	164.6	0	0	113.3	R380 I426	R380-E428 IonicContact NH1-OE2 2.64Å; I426-E428 PolarHBondContact O-N 3.08Å
429	A	56.6	Low	51.8	Low	20 Å²	20	82.5 Å²	82.5	17%	0.165	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-83.6	131.4	-177.4	0	0	0	0	0	112.4	R380 Y382 I426	R380-A429 HydrophobicContact CB-CB 3.78Å; R380-A429 CarbonylContact O-C 3.36Å; R380-A429 VanDerWaalsContact O-CA 3.28Å; R380-A429 WeakPolarHBondContact O-CA 3.35Å; Y382-A429 HydrophobicContact CD1-CB 3.78Å; Y382-A429 HydrophobicContact CE1-CB 3.66Å; I426-A429 HydrophobicContact CG2-CB 3.67Å; I426-A429 PolarHBondContact O-N 3.46Å; I426-A429 VanDerWaalsContact O-N 3.08Å
430	V	58.5	Low	49.1	Very low	30 Å²	30	83.1 Å²	83.1	18%	0.182	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	126.1	177.3	172.5	0	0	0	0	110.5	Q325 R380 Y381 Y382 M432	Q325-V430 HydrophobicContact CB-CG2 4.49Å; Q325-V430 VanDerWaalsContact CD-CG1 3.49Å; Q325-V430 HydrophobicContact CG-CG1 4.47Å; Q325-V430 HydrophobicContact CG-CG2 4.03Å; R380-V430 PolarHBondContact O-N 3.11Å; Y381-V430 CarbonylContact C-O 3.5Å; Y381-V430 WeakPolarHBondContact CA-O 3.27Å; Y381-V430 WeakPolarHBondContact CB-O 3.43Å; Y382-V430 PolarHBondContact N-O 3.31Å; V430-M432 HydrophobicContact CG1-SD 4.14Å
431	I	58.8	Low	46.4	Very low	92 Å²	92	82.4 Å²	82.4	47%	0.472	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	119.3	167.2	-56.9	176.6	0	0	0	107.8	Y382 E384	Y382-I431 HydrophobicContact CE1-CG1 4.32Å; Y382-I431 HydrophobicContact CE2-CD1 4.46Å; Y382-I431 HydrophobicContact CE2-CG1 3.92Å; Y382-I431 WeakPolarHBondContact O-CA 3.24Å; E384-I431 HydrophobicContact CG-CG2 4.19Å
432	M	54.7	Low	43.9	Very low	52 Å²	52	90.1 Å²	90.1	26%	0.256	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.8	117.6	170.6	-65.6	-70.1	-68	0	0	108	Y381 Y382 V430	Y381-M432 HydrophobicContact CD2-CG 3.89Å; Y381-M432 HydrophobicContact CG-CG 4.39Å; Y382-M432 PolarHBondContact O-N 3.04Å; V430-M432 HydrophobicContact CG1-SD 4.14Å
433	G	47.5	Very low	41.8	Very low	49 Å²	49	93 Å²	93	51%	0.505	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-94.6	160.8	167.9	0	0	0	0	0	111.4	D435	G433-D435 PolarHBondContact O-N 3.02Å
434	D	42.4	Very low	39.9	Very low	151 Å²	151	93.6 Å²	93.6	81%	0.807	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-63.9	-18.8	179.7	-75.7	-25	0	0	0	113.4	A436	D434-A436 PolarHBondContact O-N 3.06Å; D434-A436 VanDerWaalsContact O-N 3.17Å
435	D	33.9	Very low	38.6	Very low	145 Å²	145	96 Å²	96	78%	0.775	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-76.9	5	-177.6	-75.9	-28.2	0	0	0	115.2	G433 L437 A438	G433-D435 PolarHBondContact O-N 3.02Å; D435-L437 PolarHBondContact O-N 2.88Å; D435-A438 PolarHBondContact O-N 3.49Å
436	A	34.9	Very low	37.6	Very low	75 Å²	75	104.3 Å²	104.3	62%	0.62	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-66.3	-2.7	179.5	0	0	0	0	0	114.8	D434	D434-A436 PolarHBondContact O-N 3.06Å; D434-A436 VanDerWaalsContact O-N 3.17Å
437	L	27	Very low	36.4	Very low	175 Å²	175	111.3 Å²	111.3	92%	0.916	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-95.8	-0.3	171	-101.3	89.5	0	0	0	114.8	D435	D435-L437 PolarHBondContact O-N 2.88Å
438	A	22.8	Very low	35.3	Very low	67 Å²	67	111.9 Å²	111.9	55%	0.554	67%	0.674	S	S	*	*	S	Bend	trans	-87.9	136.1	173.1	0	0	0	0	0	111.2	D435	D435-A438 PolarHBondContact O-N 3.49Å
439	P	24.5	Very low	34	Very low	116 Å²	116	114.3 Å²	114.3	75%	0.753	68%	0.682	S	S	*	*			trans	-63.1	155.3	179.4	25.3	-31.5	0	0	0	111.5	G441	P439-G441 PolarHBondContact O-N 3.16Å
440	P	28.4	Very low	32.5	Very low	138 Å²	138	118.9 Å²	118.9	90%	0.896	71%	0.708	S	S	*	*			trans	-66.1	103.6	-165.2	26.1	-33.3	0	0	0	111.8
441	G	24.6	Very low	30.8	Very low	66 Å²	66	124.8 Å²	124.8	68%	0.68	74%	0.738	S	S	*	*			trans	-102.7	127.1	162.2	0	0	0	0	0	109.2	P439 A443	P439-G441 PolarHBondContact O-N 3.16Å; G441-A443 PolarHBondContact O-N 3.32Å; G441-A443 VanDerWaalsContact O-N 3.12Å
442	N	25.1	Very low	29.3	Very low	174 Å²	174	127.8 Å²	127.8	93%	0.93	76%	0.755	S	S	*	*			trans	-46.6	111.5	-179.3	-75.4	-20	0	0	0	113.3
443	A	26.4	Very low	27.8	Very low	100 Å²	100	130.8 Å²	130.8	83%	0.826	78%	0.78	S	S	*	*			trans	-140.6	71.2	159.8	0	0	0	0	0	109	G441	G441-A443 PolarHBondContact O-N 3.32Å; G441-A443 VanDerWaalsContact O-N 3.12Å
444	C	24.6	Very low	27	Very low	115 Å²	115	133.3 Å²	133.3	78%	0.777	79%	0.79	S	S	*	*			trans	-86	106.7	156.5	178.2	0	0	0	0	105.9
445	D	25.2	Very low	26.1	Very low	141 Å²	141	135 Å²	135	75%	0.754	79%	0.793	S	S	*	*			trans	171.2	116.7	142.6	-89.2	-17.8	0	0	0	110.2
446	Q	25.6	Very low	25.9	Very low	189 Å²	189	133.7 Å²	133.7	88%	0.883	80%	0.795	S	S	*	*			trans	156.2	77.5	142.8	-84.1	173.1	63.2	0	0	109.9
447	L	28.1	Very low	25.3	Very low	177 Å²	177	139.3 Å²	139.3	93%	0.927	81%	0.806	S	S	*	*			trans	-90.3	101.2	160.9	-80.3	160.7	0	0	0	107.9	K449	L447-K449 PolarHBondContact O-N 3.12Å
448	T	23.2	Very low	25.3	Very low	120 Å²	120	135 Å²	135	74%	0.736	80%	0.804	S	S	*	*			trans	-70.9	115.5	170.2	46	0	0	0	0	109.8	V450	T448-V450 PolarHBondContact O-N 2.63Å
449	K	21	Very low	25.5	Very low	208 Å²	208	143.1 Å²	143.1	90%	0.904	82%	0.82	S	S	*	*			trans	-61	122.8	172.2	-70.2	178.7	176.7	-180	0	109.7	L447	L447-K449 PolarHBondContact O-N 3.12Å
450	V	25.7	Very low	25.4	Very low	117 Å²	117	147.7 Å²	147.7	71%	0.709	83%	0.828	S	S	*	*			trans	-104.2	113.5	167.6	-176.4	0	0	0	0	107.6	T448 L452	T448-V450 PolarHBondContact O-N 2.63Å; V450-L452 PolarHBondContact O-N 2.98Å
451	D	21.5	Very low	25.6	Very low	154 Å²	154	151.3 Å²	151.3	82%	0.824	82%	0.824	S	S	*	*			trans	-67.7	124.2	176.5	-93.8	-37.1	0	0	0	111.2
452	L	28.9	Very low	25.8	Very low	155 Å²	155	153.7 Å²	153.7	81%	0.812	83%	0.827	S	S	*	*			trans	-119.3	70.9	173.8	-85.3	136.2	0	0	0	109.3	V450	V450-L452 PolarHBondContact O-N 2.98Å
453	S	22.7	Very low	26.1	Very low	114 Å²	114	151 Å²	151	80%	0.797	81%	0.813	S	S	*	*			trans	-95.7	87.3	167.3	56.8	0	0	0	0	109.9
454	S	29.4	Very low	26.8	Very low	102 Å²	102	153.2 Å²	153.2	71%	0.713	81%	0.811	S	S	*	*			trans	-140.1	93.7	161.2	66.3	0	0	0	0	110.4	S456	S454-S456 PolarHBondContact O-N 3.33Å
455	Q	24.1	Very low	27.7	Very low	187 Å²	187	154.9 Å²	154.9	87%	0.874	80%	0.802	S	S	*	*			trans	-64	108.8	171.1	-68.4	178.3	-6.9	0	0	109.7
456	S	29.4	Very low	28.5	Very low	117 Å²	117	154.2 Å²	154.2	82%	0.818	80%	0.798	S	S	*	*			trans	-102.1	110.5	166.5	64.5	0	0	0	0	109.8	S454	S454-S456 PolarHBondContact O-N 3.33Å
457	K	23.3	Very low	29.2	Very low	193 Å²	193	151.7 Å²	151.7	84%	0.839	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.6	134.6	179.2	-70.9	179.7	177.5	173.6	0	110.5	R459	K457-R459 PolarHBondContact O-N 2.69Å
458	G	26.6	Very low	30	Very low	84 Å²	84	146.9 Å²	146.9	87%	0.866	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-55.5	116.5	-172.4	0	0	0	0	0	114.7
459	R	26.9	Very low	30.9	Very low	238 Å²	238	148.5 Å²	148.5	90%	0.898	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-91.5	119.5	157.5	-88.3	-179.3	165.1	176.5	-3.9	108.8	K457 R461	K457-R459 PolarHBondContact O-N 2.69Å; R459-R461 PolarHBondContact O-N 3.4Å; R459-R461 VanDerWaalsContact O-N 3.12Å
460	K	23.7	Very low	31.9	Very low	213 Å²	213	143 Å²	143	93%	0.926	75%	0.754	S	S	*	*			trans	-55.5	113.7	169.8	-85.9	177	175.5	170	0	109
461	R	31.1	Very low	33	Very low	214 Å²	214	142.2 Å²	142.2	81%	0.808	75%	0.753	S	S	*	*			trans	-70.1	137.4	176.2	-73.1	-178.7	162.9	-166.5	-4.9	110.3	R459	R459-R461 PolarHBondContact O-N 3.4Å; R459-R461 VanDerWaalsContact O-N 3.12Å
462	P	29.5	Very low	34.2	Very low	116 Å²	116	137.6 Å²	137.6	75%	0.753	73%	0.728	S	S	*	*			trans	-61	142.1	172.8	-20.4	32.4	0	0	0	111.6	D464	P462-D464 PolarHBondContact O-N 3.03Å
463	N	32.2	Very low	34.6	Very low	118 Å²	118	138.3 Å²	138.3	63%	0.631	73%	0.727	S	S	*	*			trans	-78.6	101.4	-179.6	-96.4	-36.8	0	0	0	110.7	Y465	N463-Y465 PolarHBondContact O-N 2.86Å
464	D	40.1	Very low	35.7	Very low	146 Å²	146	137.3 Å²	137.3	78%	0.781	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	22	174.7	-83.9	-16.8	0	0	0	115.2	P462	P462-D464 PolarHBondContact O-N 3.03Å
465	Y	44.6	Very low	36.7	Very low	150 Å²	150	140.9 Å²	140.9	59%	0.588	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-0.8	-175.9	-74.7	-69.5	0	0	0	115.1	N463 D467 V468	N463-Y465 PolarHBondContact O-N 2.86Å; Y465-D467 VanDerWaalsContact C-N 3.28Å; Y465-V468 HydrophobicContact CD1-CG2 4.35Å
466	D	40	Very low	37.7	Very low	127 Å²	127	135.3 Å²	135.3	68%	0.679	72%	0.715	S	S	*	*	S	Bend	trans	-72	-25.3	172.9	-72.7	-33.2	0	0	0	111.8	V468 K469	D466-V468 VanDerWaalsContact C-N 3.34Å; D466-V468 PolarHBondContact O-N 3.44Å; D466-K469 WeakPolarHBondContact O-CB 3.24Å; D466-K469 PolarHBondContact O-N 3Å
467	D	41.6	Very low	38.6	Very low	135 Å²	135	134.2 Å²	134.2	72%	0.722	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-66.7	-27.7	179.5	-100.6	-9.5	0	0	0	114.8	Y465 K469 S470	Y465-D467 VanDerWaalsContact C-N 3.28Å; D467-K469 PolarHBondContact O-N 2.82Å; D467-S470 PolarHBondContact O-N 3Å
468	V	45.1	Very low	39.8	Very low	77 Å²	77	133.9 Å²	133.9	47%	0.467	69%	0.693	S	S	.	*	G	3₁₀ helix	trans	-71.5	-17.5	-178.4	-166.7	0	0	0	0	111.7	Y465 D466 L472	Y465-V468 HydrophobicContact CD1-CG2 4.35Å; D466-V468 VanDerWaalsContact C-N 3.34Å; D466-V468 PolarHBondContact O-N 3.44Å; V468-L472 HydrophobicContact CG1-CD1 4.39Å
469	K	41.4	Very low	41.3	Very low	153 Å²	153	138 Å²	138	67%	0.665	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-73.7	-29.9	-178.6	-144.7	179.6	179.4	-168.5	0	111.9	D466 D467	D466-K469 WeakPolarHBondContact O-CB 3.24Å; D466-K469 PolarHBondContact O-N 3Å; D467-K469 PolarHBondContact O-N 2.82Å
470	S	42.5	Very low	42.7	Very low	94 Å²	94	131 Å²	131	66%	0.657	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-72.8	-38.5	-178.8	171.9	0	0	0	0	113	D467 L472	D467-S470 PolarHBondContact O-N 3Å; S470-L472 VanDerWaalsContact C-N 3.3Å; S470-L472 PolarHBondContact O-N 3.42Å
471	S	48.1	Very low	44.4	Very low	99 Å²	99	122.3 Å²	122.3	69%	0.692	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-78.5	-4.2	-173.8	-58.8	0	0	0	0	115.8
472	L	46.3	Very low	46.1	Very low	57 Å²	57	121.2 Å²	121.2	30%	0.298	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-100.4	5.9	-174.5	-71.8	168.7	0	0	0	114	V468 S470 T474 N481	V468-L472 HydrophobicContact CG1-CD1 4.39Å; S470-L472 VanDerWaalsContact C-N 3.3Å; S470-L472 PolarHBondContact O-N 3.42Å; L472-T474 PolarHBondContact O-N 3.28Å; L472-N481 PolarHBondContact O-ND2 2.86Å
473	E	37.7	Very low	47.9	Very low	170 Å²	170	122.1 Å²	122.1	79%	0.794	62%	0.622	S	S	*	*			trans	-98.7	65.7	177.5	-62.5	-172.4	172.2	0	0	110.8
474	T	45.9	Very low	49.5	Very low	94 Å²	94	120.8 Å²	120.8	58%	0.577	61%	0.614	S	S	*	*			trans	-108.5	123.1	163.1	44.4	0	0	0	0	109.2	L472 G476 N481	L472-T474 PolarHBondContact O-N 3.28Å; T474-G476 PolarHBondContact O-N 2.88Å; T474-G476 VanDerWaalsContact O-N 3.09Å; T474-N481 PolarHBondContact O-ND2 3.22Å
475	E	50.3	Low	51.1	Low	177 Å²	177	120.7 Å²	120.7	83%	0.827	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-18.6	-164.3	-123.9	170.6	171.1	0	0	114.6
476	G	45.8	Very low	52.4	Low	70 Å²	70	120.1 Å²	120.1	72%	0.722	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-12.7	-170.7	0	0	0	0	0	117.4	T474	T474-G476 PolarHBondContact O-N 2.88Å; T474-G476 VanDerWaalsContact O-N 3.09Å
477	N	47.6	Very low	54	Low	94 Å²	94	118.7 Å²	118.7	50%	0.503	60%	0.6	S	S	.	*			trans	-133.3	54.7	-169.5	-99.3	-4.9	0	0	0	114.2	Q479 D480 N481	N477-Q479 VanDerWaalsContact C-N 3.29Å; N477-Q479 PolarHBondContact O-N 3.44Å; N477-Q479 VanDerWaalsContact O-N 3.15Å; N477-D480 HydrophobicContact CB-CB 4.35Å; N477-D480 PolarHBondContact O-N 2.83Å; N477-N481 WeakPolarHBondContact O-CB 3.33Å; N477-N481 VanDerWaalsContact O-CG 3.3Å; N477-N481 PolarHBondContact O-N 3.31Å
478	R	49.4	Very low	55.4	Low	186 Å²	186	114.7 Å²	114.7	70%	0.702	59%	0.586	S	S	*	*	H	α-helix	trans	-54.7	-34.6	-175.7	-72	-176.6	170.2	-175.9	-2.6	115	R482	R478-R482 VanDerWaalsContact O-CG 3.3Å; R478-R482 WeakPolarHBondContact O-CG 3.38Å; R478-R482 PolarHBondContact O-N 3.1Å
479	Q	58.6	Low	57	Low	171 Å²	171	116.8 Å²	116.8	80%	0.799	59%	0.589	S	S	*	*	H	α-helix	trans	-76.6	-46.7	179.5	-73.8	-173.6	-2.4	0	0	112.5	N477 N481 R482 F483	N477-Q479 VanDerWaalsContact C-N 3.29Å; N477-Q479 PolarHBondContact O-N 3.44Å; N477-Q479 VanDerWaalsContact O-N 3.15Å; Q479-N481 VanDerWaalsContact C-N 3.34Å; Q479-N481 PolarHBondContact O-N 3.4Å; Q479-R482 PolarHBondContact O-N 3.11Å; Q479-F483 PolarHBondContact O-N 2.88Å
480	D	55	Low	58.8	Low	90 Å²	90	116.9 Å²	116.9	48%	0.481	59%	0.585	S	S	.	*	H	α-helix	trans	-63.7	-41.6	177.5	-71.4	-16.7	0	0	0	110.9	N477 R482 F483 L484	N477-D480 HydrophobicContact CB-CB 4.35Å; N477-D480 PolarHBondContact O-N 2.83Å; D480-R482 VanDerWaalsContact C-N 3.34Å; D480-R482 PolarHBondContact O-N 3.37Å; D480-F483 PolarHBondContact O-N 3.38Å; D480-L484 WeakPolarHBondContact O-CB 3.28Å; D480-L484 WeakPolarHBondContact O-CD1 3.36Å; D480-L484 WeakPolarHBondContact O-CG 3.5Å; D480-L484 PolarHBondContact O-N 3.44Å
481	N	58.9	Low	60.1	Low	31 Å²	31	121.1 Å²	121.1	17%	0.166	59%	0.586	C	S	.	*	H	α-helix	trans	-63.5	-37.4	177.1	-70.8	-11.4	0	0	0	112	L472 T474 N477 Q479 K485	L472-N481 PolarHBondContact O-ND2 2.86Å; T474-N481 PolarHBondContact O-ND2 3.22Å; N477-N481 WeakPolarHBondContact O-CB 3.33Å; N477-N481 VanDerWaalsContact O-CG 3.3Å; N477-N481 PolarHBondContact O-N 3.31Å; Q479-N481 VanDerWaalsContact C-N 3.34Å; Q479-N481 PolarHBondContact O-N 3.4Å; N481-K485 WeakPolarHBondContact O-CB 3.46Å; N481-K485 PolarHBondContact O-N 3.19Å
482	R	68.3	Low	61.5	Low	190 Å²	190	121 Å²	121	72%	0.717	57%	0.573	S	S	*	*	H	α-helix	trans	-65.4	-44.5	173.2	-79.8	179.5	-171.7	-170.7	3.5	111.9	R478 Q479 D480 K485 H486	R478-R482 VanDerWaalsContact O-CG 3.3Å; R478-R482 WeakPolarHBondContact O-CG 3.38Å; R478-R482 PolarHBondContact O-N 3.1Å; Q479-R482 PolarHBondContact O-N 3.11Å; D480-R482 VanDerWaalsContact C-N 3.34Å; D480-R482 PolarHBondContact O-N 3.37Å; R482-K485 PolarHBondContact O-N 3.02Å; R482-H486 WeakPolarHBondContact O-CB 3.47Å; R482-H486 PolarHBondContact O-N 2.98Å
483	F	65.9	Low	63	Low	135 Å²	135	125.9 Å²	125.9	59%	0.592	59%	0.588	S	S	*	*	H	α-helix	trans	-63.8	-46.4	178.3	-179	-100.5	0	0	0	111.6	Q479 D480 K485 H486 M487	Q479-F483 PolarHBondContact O-N 2.88Å; D480-F483 PolarHBondContact O-N 3.38Å; F483-K485 PolarHBondContact O-N 3.47Å; F483-H486 PolarHBondContact O-N 2.83Å; F483-M487 HydrophobicContact CD1-CG 4.17Å; F483-M487 HydrophobicContact CE1-CG 3.76Å; F483-M487 HydrophobicContact CE2-CG 4.24Å; F483-M487 HydrophobicContact CZ-CE 4.47Å; F483-M487 HydrophobicContact CZ-CG 3.8Å; F483-M487 HydrophobicContact CZ-SD 4.12Å; F483-M487 WeakPolarHBondContact O-CB 3.5Å; F483-M487 WeakPolarHBondContact O-CG 3.36Å; F483-M487 PolarHBondContact O-N 2.87Å
484	L	66.8	Low	64.8	Low	90 Å²	90	122.8 Å²	122.8	47%	0.471	57%	0.573	S	S	.	*	H	α-helix	trans	-57.3	-46.1	174.1	-82.3	153.6	0	0	0	111.6	D480 H486 M487 A488	D480-L484 WeakPolarHBondContact O-CB 3.28Å; D480-L484 WeakPolarHBondContact O-CD1 3.36Å; D480-L484 WeakPolarHBondContact O-CG 3.5Å; D480-L484 PolarHBondContact O-N 3.44Å; L484-H486 VanDerWaalsContact C-N 3.34Å; L484-H486 PolarHBondContact O-N 2.86Å; L484-M487 PolarHBondContact O-N 2.63Å; L484-A488 WeakPolarHBondContact O-CB 3.44Å; L484-A488 PolarHBondContact O-N 3.39Å
485	K	72.7	Confident	65.9	Low	145 Å²	145	123.1 Å²	123.1	63%	0.63	57%	0.57	S	S	*	*	H	α-helix	trans	-62.1	-39.7	176.5	-170.2	172.3	-175	171.5	0	112.1	N481 R482 F483 K489	N481-K485 WeakPolarHBondContact O-CB 3.46Å; N481-K485 PolarHBondContact O-N 3.19Å; R482-K485 PolarHBondContact O-N 3.02Å; F483-K485 PolarHBondContact O-N 3.47Å; K485-K489 WeakPolarHBondContact O-CB 3.48Å; K485-K489 PolarHBondContact O-N 3.49Å
486	H	72.7	Confident	67.1	Low	137 Å²	137	121.3 Å²	121.3	63%	0.634	56%	0.555	S	S	*	*	H	α-helix	trans	-69.6	-40.7	177.9	-146.1	-79.5	0	0	0	112	R482 F483 L484 K489 R490	R482-H486 WeakPolarHBondContact O-CB 3.47Å; R482-H486 PolarHBondContact O-N 2.98Å; F483-H486 PolarHBondContact O-N 2.83Å; L484-H486 VanDerWaalsContact C-N 3.34Å; L484-H486 PolarHBondContact O-N 2.86Å; H486-K489 PolarHBondContact O-N 3.37Å; H486-R490 WeakPolarHBondContact O-CB 3.46Å; H486-R490 PolarHBondContact O-N 2.98Å
487	M	73.5	Confident	68.5	Low	98 Å²	98	125.6 Å²	125.6	48%	0.483	55%	0.554	S	S	.	*	H	α-helix	trans	-64.2	-43.1	174.1	-73.6	-68.9	-84.6	0	0	111.5	F483 L484 R490 R491	F483-M487 HydrophobicContact CD1-CG 4.17Å; F483-M487 HydrophobicContact CE1-CG 3.76Å; F483-M487 HydrophobicContact CE2-CG 4.24Å; F483-M487 HydrophobicContact CZ-CE 4.47Å; F483-M487 HydrophobicContact CZ-CG 3.8Å; F483-M487 HydrophobicContact CZ-SD 4.12Å; F483-M487 WeakPolarHBondContact O-CB 3.5Å; F483-M487 WeakPolarHBondContact O-CG 3.36Å; F483-M487 PolarHBondContact O-N 2.87Å; L484-M487 PolarHBondContact O-N 2.63Å; M487-R490 PolarHBondContact O-N 3.29Å; M487-R491 VanDerWaalsContact O-CB 3.28Å; M487-R491 WeakPolarHBondContact O-CB 3.44Å; M487-R491 PolarHBondContact O-N 3.09Å
488	A	71.4	Confident	69.7	Low	51 Å²	51	124.6 Å²	124.6	42%	0.421	55%	0.551	S	S	.	*	H	α-helix	trans	-62	-43.7	174.6	0	0	0	0	0	111.9	L484 R491 K492	L484-A488 WeakPolarHBondContact O-CB 3.44Å; L484-A488 PolarHBondContact O-N 3.39Å; A488-R491 PolarHBondContact O-N 2.91Å; A488-K492 WeakPolarHBondContact O-CB 3.46Å; A488-K492 PolarHBondContact O-N 3.44Å
489	K	79	Confident	71.1	Confident	121 Å²	121	122 Å²	122	53%	0.526	55%	0.547	S	S	.	.	H	α-helix	trans	-64.9	-42	176.3	-168.9	176.5	-177.2	177.7	0	112.3	K485 H486 R491 K492 R493	K485-K489 WeakPolarHBondContact O-CB 3.48Å; K485-K489 PolarHBondContact O-N 3.49Å; H486-K489 PolarHBondContact O-N 3.37Å; K489-R491 VanDerWaalsContact C-N 3.34Å; K489-K492 PolarHBondContact O-N 3.47Å; K489-R493 WeakPolarHBondContact O-CG 3.2Å; K489-R493 PolarHBondContact O-N 3.29Å
490	R	79	Confident	71.9	Confident	155 Å²	155	118.5 Å²	118.5	59%	0.585	53%	0.534	S	S	*	.	H	α-helix	trans	-61.8	-42.9	174.2	-177.7	177.6	174.9	174.9	0.6	111	H486 M487 R493 Q494	H486-R490 WeakPolarHBondContact O-CB 3.46Å; H486-R490 PolarHBondContact O-N 2.98Å; M487-R490 PolarHBondContact O-N 3.29Å; R490-R493 PolarHBondContact O-N 3.05Å; R490-Q494 PolarHBondContact O-N 2.87Å
491	R	69.7	Low	72.7	Confident	183 Å²	183	119.5 Å²	119.5	69%	0.691	53%	0.531	S	S	*	.	H	α-helix	trans	-64.5	-43.5	177.1	-165.2	174.9	179.7	-173	-1.5	111.8	M487 A488 K489 R493 Q494 M495	M487-R491 VanDerWaalsContact O-CB 3.28Å; M487-R491 WeakPolarHBondContact O-CB 3.44Å; M487-R491 PolarHBondContact O-N 3.09Å; A488-R491 PolarHBondContact O-N 2.91Å; K489-R491 VanDerWaalsContact C-N 3.34Å; R491-R493 VanDerWaalsContact C-N 3.31Å; R491-R493 PolarHBondContact O-N 3.03Å; R491-Q494 PolarHBondContact O-N 3.35Å; R491-M495 WeakPolarHBondContact O-CG 3.28Å; R491-M495 PolarHBondContact O-N 2.94Å
492	K	76.9	Confident	73.3	Confident	96 Å²	96	122.1 Å²	122.1	42%	0.417	55%	0.55	S	S	.	*	H	α-helix	trans	-59.1	-39.7	173.7	-172.2	170.8	-175.6	167.4	0	112.2	A488 K489 R496	A488-K492 WeakPolarHBondContact O-CB 3.46Å; A488-K492 PolarHBondContact O-N 3.44Å; K489-K492 PolarHBondContact O-N 3.47Å; K492-R496 WeakPolarHBondContact O-CG 3.27Å; K492-R496 PolarHBondContact O-N 2.91Å
493	R	78.6	Confident	73.7	Confident	160 Å²	160	116 Å²	116	60%	0.604	54%	0.537	S	S	*	.	H	α-helix	trans	-66.6	-41.9	174.7	-73.7	177.8	174.9	179.7	-3.5	112.4	K489 R490 R491 K497	K489-R493 WeakPolarHBondContact O-CG 3.2Å; K489-R493 PolarHBondContact O-N 3.29Å; R490-R493 PolarHBondContact O-N 3.05Å; R491-R493 VanDerWaalsContact C-N 3.31Å; R491-R493 PolarHBondContact O-N 3.03Å; R493-K497 WeakPolarHBondContact O-CG 3.13Å; R493-K497 PolarHBondContact O-N 3.09Å; R493-K497 VanDerWaalsContact O-N 3.15Å
494	Q	74	Confident	74.1	Confident	105 Å²	105	116.5 Å²	116.5	49%	0.491	54%	0.535	S	S	.	.	H	α-helix	trans	-65.3	-43.4	176.3	-76.4	179.5	-34.7	0	0	111.6	R490 R491 R496 K497 T498	R490-Q494 PolarHBondContact O-N 2.87Å; R491-Q494 PolarHBondContact O-N 3.35Å; Q494-R496 PolarHBondContact O-N 3.39Å; Q494-K497 WeakPolarHBondContact O-CB 3.13Å; Q494-K497 PolarHBondContact O-N 3.15Å; Q494-K497 VanDerWaalsContact O-N 3.16Å; Q494-T498 PolarHBondContact O-N 2.99Å; Q494-T498 PolarHBondContact O-OG1 3.17Å
495	M	69.4	Low	74.5	Confident	101 Å²	101	115.5 Å²	115.5	50%	0.498	53%	0.53	S	S	.	.	H	α-helix	trans	-61.3	-43.8	177	-71.2	-61.9	-60.5	0	0	112.3	R491 K497 T498 E499	R491-M495 WeakPolarHBondContact O-CG 3.28Å; R491-M495 PolarHBondContact O-N 2.94Å; M495-K497 VanDerWaalsContact C-N 3.29Å; M495-K497 PolarHBondContact O-N 3.32Å; M495-T498 WeakPolarHBondContact CA-OG1 3.38Å; M495-T498 PolarHBondContact O-N 3.36Å; M495-T498 PolarHBondContact O-OG1 3.38Å; M495-E499 VanDerWaalsContact O-CB 3.26Å; M495-E499 WeakPolarHBondContact O-CB 3.41Å; M495-E499 PolarHBondContact O-N 3.06Å
496	R	76.7	Confident	74.6	Confident	139 Å²	139	111 Å²	111	53%	0.525	52%	0.52	S	S	.	.	H	α-helix	trans	-61.7	-37.3	174.7	-75.9	179.8	176.6	-171.3	-4.5	112.5	K492 Q494 N500	K492-R496 WeakPolarHBondContact O-CG 3.27Å; K492-R496 PolarHBondContact O-N 2.91Å; Q494-R496 PolarHBondContact O-N 3.39Å; R496-N500 VanDerWaalsContact O-CB 3.29Å; R496-N500 WeakPolarHBondContact O-CB 3.44Å; R496-N500 PolarHBondContact O-N 3.38Å; R496-N500 PolarHBondContact O-OD1 2.99Å
497	K	75.3	Confident	74.7	Confident	160 Å²	160	108.6 Å²	108.6	70%	0.696	51%	0.512	S	S	*	.	H	α-helix	trans	-65.8	-44.7	174.9	-73.7	-174.8	174.9	-156.9	0	111.6	R493 Q494 M495 R501	R493-K497 WeakPolarHBondContact O-CG 3.13Å; R493-K497 PolarHBondContact O-N 3.09Å; R493-K497 VanDerWaalsContact O-N 3.15Å; Q494-K497 WeakPolarHBondContact O-CB 3.13Å; Q494-K497 PolarHBondContact O-N 3.15Å; Q494-K497 VanDerWaalsContact O-N 3.16Å; M495-K497 VanDerWaalsContact C-N 3.29Å; M495-K497 PolarHBondContact O-N 3.32Å; K497-R501 WeakPolarHBondContact O-CB 3.19Å; K497-R501 PolarHBondContact O-N 3.26Å
498	T	72.5	Confident	74.7	Confident	73 Å²	73	104.6 Å²	104.6	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-67.5	-40.5	178.7	52.4	0	0	0	0	112.1	Q494 M495 R501 C502	Q494-T498 PolarHBondContact O-N 2.99Å; Q494-T498 PolarHBondContact O-OG1 3.17Å; M495-T498 WeakPolarHBondContact CA-OG1 3.38Å; M495-T498 PolarHBondContact O-N 3.36Å; M495-T498 PolarHBondContact O-OG1 3.38Å; T498-R501 PolarHBondContact O-N 3.22Å; T498-C502 PolarHBondContact O-N 3.21Å; T498-C502 PolarHBondContact O-SG 2.93Å; T498-C502 VanDerWaalsContact O-SG 3.32Å
499	E	78	Confident	74.9	Confident	131 Å²	131	107.2 Å²	107.2	61%	0.612	50%	0.499	S	S	*	.	H	α-helix	trans	-64.5	-45.3	177.3	-173	175.5	-166.2	0	0	111.3	M495 R501 C502 S503	M495-E499 VanDerWaalsContact O-CB 3.26Å; M495-E499 WeakPolarHBondContact O-CB 3.41Å; M495-E499 PolarHBondContact O-N 3.06Å; E499-R501 VanDerWaalsContact C-N 3.29Å; E499-R501 PolarHBondContact O-N 3.15Å; E499-C502 PolarHBondContact O-N 3.12Å; E499-S503 WeakPolarHBondContact O-CB 3.5Å; E499-S503 PolarHBondContact O-N 3.3Å
500	N	75.1	Confident	74.7	Confident	98 Å²	98	106.1 Å²	106.1	52%	0.524	50%	0.496	S	S	.	.	H	α-helix	trans	-60.5	-39.3	173.7	-71.7	0.5	0	0	0	112	R496 S503 R504	R496-N500 VanDerWaalsContact O-CB 3.29Å; R496-N500 WeakPolarHBondContact O-CB 3.44Å; R496-N500 PolarHBondContact O-N 3.38Å; R496-N500 PolarHBondContact O-OD1 2.99Å; N500-S503 PolarHBondContact O-N 3.25Å; N500-R504 WeakPolarHBondContact O-CB 3.39Å; N500-R504 WeakPolarHBondContact O-CG 3.43Å; N500-R504 PolarHBondContact O-N 3.27Å
501	R	72.6	Confident	74.5	Confident	111 Å²	111	101.7 Å²	101.7	42%	0.419	49%	0.486	S	S	.	.	H	α-helix	trans	-66.6	-43.9	177.1	178.6	157	176.5	-176.3	-3.9	111.9	K497 T498 E499 R504 L505 A534 E535	K497-R501 WeakPolarHBondContact O-CB 3.19Å; K497-R501 PolarHBondContact O-N 3.26Å; T498-R501 PolarHBondContact O-N 3.22Å; E499-R501 VanDerWaalsContact C-N 3.29Å; E499-R501 PolarHBondContact O-N 3.15Å; R501-R504 PolarHBondContact O-N 3.05Å; R501-L505 WeakPolarHBondContact O-CB 3.2Å; R501-L505 PolarHBondContact O-N 2.75Å; R501-A534 WeakPolarHBondContact CD-O 3.44Å; R501-A534 VanDerWaalsContact CG-O 3.23Å; R501-A534 WeakPolarHBondContact CG-O 3.48Å; R501-E535 IonicContact CZ-OE1 2.72Å; R501-E535 VanDerWaalsContact NH2-CD 3.34Å; R501-E535 IonicContact NH2-OE1 3.31Å; R501-E535 PolarHBondContact NH2-OE1 2.87Å
502	C	71.6	Confident	74.6	Confident	85 Å²	85	93.4 Å²	93.4	57%	0.574	46%	0.457	S	S	*	.	H	α-helix	trans	-64.1	-40.7	174.5	-69.7	0	0	0	0	112.4	T498 E499 L505 A506	T498-C502 PolarHBondContact O-N 3.21Å; T498-C502 PolarHBondContact O-SG 2.93Å; T498-C502 VanDerWaalsContact O-SG 3.32Å; E499-C502 PolarHBondContact O-N 3.12Å; C502-L505 PolarHBondContact O-N 2.82Å; C502-A506 WeakPolarHBondContact O-CB 3.34Å; C502-A506 PolarHBondContact O-N 3.4Å
503	S	76	Confident	74.5	Confident	63 Å²	63	95.7 Å²	95.7	44%	0.441	47%	0.47	S	S	.	.	H	α-helix	trans	-61.9	-47.2	176	-169.2	0	0	0	0	111.2	E499 N500 L505 A506 D507	E499-S503 WeakPolarHBondContact O-CB 3.5Å; E499-S503 PolarHBondContact O-N 3.3Å; N500-S503 PolarHBondContact O-N 3.25Å; S503-L505 VanDerWaalsContact C-N 3.32Å; S503-L505 PolarHBondContact O-N 3.13Å; S503-A506 WeakPolarHBondContact O-CB 3.24Å; S503-A506 PolarHBondContact O-N 3.23Å; S503-D507 PolarHBondContact O-N 3.2Å
504	R	74.2	Confident	74.4	Confident	144 Å²	144	94.6 Å²	94.6	54%	0.543	47%	0.47	S	S	.	.	H	α-helix	trans	-61.7	-39.9	177.1	-75.7	176.1	171.9	176.3	-6.7	112.8	N500 R501 A506 D507 A508 A534	N500-R504 WeakPolarHBondContact O-CB 3.39Å; N500-R504 WeakPolarHBondContact O-CG 3.43Å; N500-R504 PolarHBondContact O-N 3.27Å; R501-R504 PolarHBondContact O-N 3.05Å; R504-A506 VanDerWaalsContact C-N 3.35Å; R504-D507 PolarHBondContact O-N 3.06Å; R504-A508 WeakPolarHBondContact O-CB 3.37Å; R504-A508 PolarHBondContact O-N 3.46Å; R504-A534 HydrophobicContact CB-CB 3.97Å
505	L	74.6	Confident	74.5	Confident	69 Å²	69	91.3 Å²	91.3	36%	0.361	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-43.4	175.5	-161.4	90.9	0	0	0	110.9	R501 C502 S503 A508 M509 L531	R501-L505 WeakPolarHBondContact O-CB 3.2Å; R501-L505 PolarHBondContact O-N 2.75Å; C502-L505 PolarHBondContact O-N 2.82Å; S503-L505 VanDerWaalsContact C-N 3.32Å; S503-L505 PolarHBondContact O-N 3.13Å; L505-A508 PolarHBondContact O-N 3.39Å; L505-M509 HydrophobicContact CD2-SD 4.39Å; L505-M509 WeakPolarHBondContact O-CB 3.42Å; L505-M509 VanDerWaalsContact O-CG 3.28Å; L505-M509 WeakPolarHBondContact O-CG 3.47Å; L505-M509 PolarHBondContact O-N 3.35Å; L505-L531 HydrophobicContact CD1-CD1 3.65Å
506	A	75	Confident	74.5	Confident	52 Å²	52	89.2 Å²	89.2	43%	0.43	45%	0.454	S	S	.	.	H	α-helix	trans	-63.3	-44.3	176.8	0	0	0	0	0	111.8	C502 S503 R504 A508 M509 E510	C502-A506 WeakPolarHBondContact O-CB 3.34Å; C502-A506 PolarHBondContact O-N 3.4Å; S503-A506 WeakPolarHBondContact O-CB 3.24Å; S503-A506 PolarHBondContact O-N 3.23Å; R504-A506 VanDerWaalsContact C-N 3.35Å; A506-A508 VanDerWaalsContact C-N 3.33Å; A506-A508 PolarHBondContact O-N 2.94Å; A506-M509 PolarHBondContact O-N 2.88Å; A506-E510 WeakPolarHBondContact O-CB 3.43Å; A506-E510 PolarHBondContact O-N 3.21Å
507	D	75.5	Confident	74.3	Confident	85 Å²	85	89.9 Å²	89.9	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-62.1	-40.5	176.5	-63.2	-27.1	0	0	0	111.3	S503 R504 E510 T511	S503-D507 PolarHBondContact O-N 3.2Å; R504-D507 PolarHBondContact O-N 3.06Å; D507-E510 PolarHBondContact O-N 2.79Å; D507-T511 WeakPolarHBondContact O-CB 3.49Å; D507-T511 PolarHBondContact O-N 2.82Å; D507-T511 PolarHBondContact O-OG1 3.21Å
508	A	74.1	Confident	74.1	Confident	14 Å²	14	83.8 Å²	83.8	12%	0.116	45%	0.446	C	S	.	.	H	α-helix	trans	-65.5	-41.1	176	0	0	0	0	0	112	R504 L505 A506 T511 A512 Y525 A530	R504-A508 WeakPolarHBondContact O-CB 3.37Å; R504-A508 PolarHBondContact O-N 3.46Å; L505-A508 PolarHBondContact O-N 3.39Å; A506-A508 VanDerWaalsContact C-N 3.33Å; A506-A508 PolarHBondContact O-N 2.94Å; A508-T511 PolarHBondContact O-N 3.31Å; A508-A512 WeakPolarHBondContact O-CB 3.45Å; A508-A512 PolarHBondContact O-N 3.15Å; A508-Y525 PolarHBondContact O-OH 2.86Å; A508-A530 HydrophobicContact CB-CB 4.28Å
509	M	74	Confident	73.9	Confident	106 Å²	106	85 Å²	85	52%	0.522	46%	0.455	S	S	.	.	H	α-helix	trans	-67.3	-42	175.4	-71.1	-179.2	82.7	0	0	111.8	L505 A506 T511 A512 M513	L505-M509 HydrophobicContact CD2-SD 4.39Å; L505-M509 WeakPolarHBondContact O-CB 3.42Å; L505-M509 VanDerWaalsContact O-CG 3.28Å; L505-M509 WeakPolarHBondContact O-CG 3.47Å; L505-M509 PolarHBondContact O-N 3.35Å; A506-M509 PolarHBondContact O-N 2.88Å; M509-T511 VanDerWaalsContact C-N 3.31Å; M509-T511 PolarHBondContact O-N 3.15Å; M509-A512 PolarHBondContact O-N 2.95Å; M509-M513 WeakPolarHBondContact O-CB 3.35Å; M509-M513 WeakPolarHBondContact O-CG 3.46Å; M509-M513 PolarHBondContact O-N 3.46Å
510	E	75.8	Confident	73.8	Confident	99 Å²	99	85.5 Å²	85.5	46%	0.463	46%	0.462	S	S	.	.	H	α-helix	trans	-63.8	-39.6	177	-168.9	-176.5	156.5	0	0	111.2	A506 D507 M513 K514	A506-E510 WeakPolarHBondContact O-CB 3.43Å; A506-E510 PolarHBondContact O-N 3.21Å; D507-E510 PolarHBondContact O-N 2.79Å; E510-M513 PolarHBondContact O-N 2.77Å; E510-K514 WeakPolarHBondContact O-CG 3.45Å; E510-K514 PolarHBondContact O-N 3.43Å; E510-K514 WeakPolarHBondContact OE1-CE 3.34Å; E510-K514 IonicContact OE1-NZ 3.18Å; E510-K514 PolarHBondContact OE1-NZ 3.45Å
511	T	75.6	Confident	73.6	Confident	62 Å²	62	85.1 Å²	85.1	38%	0.38	46%	0.46	S	S	.	.	H	α-helix	trans	-64.1	-45.6	175.3	-53.7	0	0	0	0	110.9	D507 A508 M509 M513 K514 L515 Y525	D507-T511 WeakPolarHBondContact O-CB 3.49Å; D507-T511 PolarHBondContact O-N 2.82Å; D507-T511 PolarHBondContact O-OG1 3.21Å; A508-T511 PolarHBondContact O-N 3.31Å; M509-T511 VanDerWaalsContact C-N 3.31Å; M509-T511 PolarHBondContact O-N 3.15Å; T511-M513 PolarHBondContact O-N 3.25Å; T511-K514 PolarHBondContact O-N 3.36Å; T511-L515 HydrophobicContact CG2-CD1 4.02Å; T511-L515 VanDerWaalsContact O-CG 3.27Å; T511-L515 WeakPolarHBondContact O-CG 3.44Å; T511-L515 PolarHBondContact O-N 3.37Å; T511-Y525 HydrophobicContact CG2-CD2 4.47Å; T511-Y525 HydrophobicContact CG2-CE2 3.74Å
512	A	72	Confident	73.5	Confident	9 Å²	9	83.2 Å²	83.2	7%	0.074	46%	0.458	C	S	.	.	H	α-helix	trans	-61.3	-42.2	175.6	0	0	0	0	0	113	A508 M509 K514 L515 A516 Y525 F527	A508-A512 WeakPolarHBondContact O-CB 3.45Å; A508-A512 PolarHBondContact O-N 3.15Å; M509-A512 PolarHBondContact O-N 2.95Å; A512-K514 VanDerWaalsContact C-N 3.35Å; A512-K514 PolarHBondContact O-N 3.09Å; A512-L515 PolarHBondContact O-N 3.11Å; A512-A516 PolarHBondContact O-N 3.25Å; A512-A516 VanDerWaalsContact O-N 3.09Å; A512-Y525 HydrophobicContact CB-CE1 4.22Å; A512-F527 HydrophobicContact CB-CD2 4.33Å; A512-F527 HydrophobicContact CB-CE2 3.32Å; A512-F527 HydrophobicContact CB-CZ 3.75Å
513	M	74.7	Confident	73.5	Confident	143 Å²	143	83.7 Å²	83.7	70%	0.704	47%	0.468	S	S	*	.	H	α-helix	trans	-64.4	-38.6	177	-73.6	-176.1	76.9	0	0	111.9	M509 E510 T511 L515 A516	M509-M513 WeakPolarHBondContact O-CB 3.35Å; M509-M513 WeakPolarHBondContact O-CG 3.46Å; M509-M513 PolarHBondContact O-N 3.46Å; E510-M513 PolarHBondContact O-N 2.77Å; T511-M513 PolarHBondContact O-N 3.25Å; M513-L515 VanDerWaalsContact C-N 3.3Å; M513-L515 PolarHBondContact O-N 3.25Å; M513-A516 WeakPolarHBondContact O-CB 3.16Å; M513-A516 PolarHBondContact O-N 3.16Å
514	K	75.1	Confident	73.5	Confident	137 Å²	137	84.7 Å²	84.7	60%	0.596	48%	0.48	S	S	*	.	H	α-helix	trans	-66.5	-30.6	174.4	-77	170.8	176.8	159.6	0	113.2	E510 T511 A512	E510-K514 WeakPolarHBondContact O-CG 3.45Å; E510-K514 PolarHBondContact O-N 3.43Å; E510-K514 WeakPolarHBondContact OE1-CE 3.34Å; E510-K514 IonicContact OE1-NZ 3.18Å; E510-K514 PolarHBondContact OE1-NZ 3.45Å; T511-K514 PolarHBondContact O-N 3.36Å; A512-K514 VanDerWaalsContact C-N 3.35Å; A512-K514 PolarHBondContact O-N 3.09Å
515	L	77.2	Confident	73.5	Confident	37 Å²	37	80.6 Å²	80.6	19%	0.194	47%	0.465	C	S	.	.	H	α-helix	trans	-81.2	-17	178.3	-67.7	167.5	0	0	0	112.8	T511 A512 M513 D517 S518 N521 L522 Y525	T511-L515 HydrophobicContact CG2-CD1 4.02Å; T511-L515 VanDerWaalsContact O-CG 3.27Å; T511-L515 WeakPolarHBondContact O-CG 3.44Å; T511-L515 PolarHBondContact O-N 3.37Å; A512-L515 PolarHBondContact O-N 3.11Å; M513-L515 VanDerWaalsContact C-N 3.3Å; M513-L515 PolarHBondContact O-N 3.25Å; L515-D517 PolarHBondContact O-N 2.92Å; L515-S518 CarbonylContact O-C 3.5Å; L515-S518 PolarHBondContact O-N 3.01Å; L515-S518 PolarHBondContact O-OG 3.2Å; L515-N521 HydrophobicContact CD2-CB 3.62Å; L515-L522 HydrophobicContact CB-CD1 4.19Å; L515-Y525 HydrophobicContact CD1-CD2 3.48Å; L515-Y525 VanDerWaalsContact CD1-CD2 3.48Å; L515-Y525 HydrophobicContact CD1-CE2 4.15Å; L515-Y525 HydrophobicContact CD1-CG 3.7Å
516	A	69	Low	73.6	Confident	56 Å²	56	82.3 Å²	82.3	46%	0.463	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.8	-178.9	0	0	0	0	0	113.5	A512 M513 S518	A512-A516 PolarHBondContact O-N 3.25Å; A512-A516 VanDerWaalsContact O-N 3.09Å; M513-A516 WeakPolarHBondContact O-CB 3.16Å; M513-A516 PolarHBondContact O-N 3.16Å; A516-S518 PolarHBondContact O-N 2.95Å
517	D	72.6	Confident	73.6	Confident	153 Å²	153	84.5 Å²	84.5	82%	0.818	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-10	175.2	-65.3	-27.5	0	0	0	113.1	L515	L515-D517 PolarHBondContact O-N 2.92Å
518	S	70	Confident	73.4	Confident	33 Å²	33	86.2 Å²	86.2	23%	0.231	48%	0.484	C	S	.	.			trans	-127.9	96.7	175.5	64.1	0	0	0	0	110.9	L515 A516 D520 N521 L522	L515-S518 CarbonylContact O-C 3.5Å; L515-S518 PolarHBondContact O-N 3.01Å; L515-S518 PolarHBondContact O-OG 3.2Å; A516-S518 PolarHBondContact O-N 2.95Å; S518-D520 PolarHBondContact O-N 3.33Å; S518-D520 VanDerWaalsContact O-N 3.16Å; S518-N521 WeakPolarHBondContact CB-ND2 3.48Å; S518-N521 PolarHBondContact O-N 2.91Å; S518-N521 VanDerWaalsContact O-N 3.07Å; S518-N521 WeakPolarHBondContact OG-CB 3.07Å; S518-N521 PolarHBondContact OG-ND2 2.92Å; S518-L522 PolarHBondContact O-N 3.32Å; S518-L522 VanDerWaalsContact O-N 3.1Å
519	P	69.4	Low	73.3	Confident	98 Å²	98	86.4 Å²	86.4	64%	0.636	49%	0.487	S	S	*	.	H	α-helix	trans	-57.8	-34.4	-172.9	18.2	-29.2	0	0	0	113.5	L522 A523	P519-L522 PolarHBondContact O-N 3.12Å; P519-A523 PolarHBondContact O-N 3.49Å; P519-A523 VanDerWaalsContact O-N 3.09Å
520	D	75.7	Confident	73.1	Confident	141 Å²	141	82.2 Å²	82.2	75%	0.754	47%	0.469	S	S	*	.	H	α-helix	trans	-64.1	-41.2	177.6	-65.6	-22.9	0	0	0	112.6	S518 A524	S518-D520 PolarHBondContact O-N 3.33Å; S518-D520 VanDerWaalsContact O-N 3.16Å; D520-A524 PolarHBondContact O-N 2.95Å
521	N	71.9	Confident	72.7	Confident	91 Å²	91	81.2 Å²	81.2	49%	0.487	47%	0.467	S	S	.	.	H	α-helix	trans	-78.4	-28.1	179.3	-57.3	-48.3	0	0	0	112.3	L515 S518 A524 Y525	L515-N521 HydrophobicContact CD2-CB 3.62Å; S518-N521 WeakPolarHBondContact CB-ND2 3.48Å; S518-N521 PolarHBondContact O-N 2.91Å; S518-N521 VanDerWaalsContact O-N 3.07Å; S518-N521 WeakPolarHBondContact OG-CB 3.07Å; S518-N521 PolarHBondContact OG-ND2 2.92Å; N521-A524 PolarHBondContact O-N 2.92Å; N521-Y525 PolarHBondContact O-N 3.2Å
522	L	70.5	Confident	72.4	Confident	70 Å²	70	85.3 Å²	85.3	37%	0.366	48%	0.481	S	S	.	.	H	α-helix	trans	-66.1	-42	174.2	-172.1	70.2	0	0	0	111	L515 S518 P519 A524 Y525	L515-L522 HydrophobicContact CB-CD1 4.19Å; S518-L522 PolarHBondContact O-N 3.32Å; S518-L522 VanDerWaalsContact O-N 3.1Å; P519-L522 PolarHBondContact O-N 3.12Å; L522-A524 VanDerWaalsContact C-N 3.27Å; L522-A524 PolarHBondContact O-N 3.5Å; L522-Y525 PolarHBondContact O-N 2.95Å; L522-Y525 VanDerWaalsContact O-N 3.15Å
523	A	70.3	Confident	72.3	Confident	95 Å²	95	92 Å²	92	79%	0.785	51%	0.513	S	S	*	.	H	α-helix	trans	-64	-31.5	176.4	0	0	0	0	0	112.8	P519	P519-A523 PolarHBondContact O-N 3.49Å; P519-A523 VanDerWaalsContact O-N 3.09Å
524	A	75.8	Confident	71.5	Confident	84 Å²	84	85.4 Å²	85.4	69%	0.694	48%	0.481	S	S	*	.	H	α-helix	trans	-79.1	-15	175.6	0	0	0	0	0	113.9	D520 N521 L522 N526	D520-A524 PolarHBondContact O-N 2.95Å; N521-A524 PolarHBondContact O-N 2.92Å; L522-A524 VanDerWaalsContact C-N 3.27Å; L522-A524 PolarHBondContact O-N 3.5Å; A524-N526 PolarHBondContact O-N 3.17Å
525	Y	75.5	Confident	70.6	Confident	58 Å²	58	86.4 Å²	86.4	23%	0.227	49%	0.488	C	S	.	.	S	Bend	trans	-79.6	109.9	-177.2	-173.1	-102.9	0	0	0	111.3	A508 T511 A512 L515 N521 L522 F527 A530	A508-Y525 PolarHBondContact O-OH 2.86Å; T511-Y525 HydrophobicContact CG2-CD2 4.47Å; T511-Y525 HydrophobicContact CG2-CE2 3.74Å; A512-Y525 HydrophobicContact CB-CE1 4.22Å; L515-Y525 HydrophobicContact CD1-CD2 3.48Å; L515-Y525 VanDerWaalsContact CD1-CD2 3.48Å; L515-Y525 HydrophobicContact CD1-CE2 4.15Å; L515-Y525 HydrophobicContact CD1-CG 3.7Å; N521-Y525 PolarHBondContact O-N 3.2Å; L522-Y525 PolarHBondContact O-N 2.95Å; L522-Y525 VanDerWaalsContact O-N 3.15Å; Y525-F527 AromaticContact CD1-CD2 3.85Å; Y525-F527 HydrophobicContact CD1-CD2 3.85Å; Y525-F527 HydrophobicContact CD1-CE2 4.4Å; Y525-F527 HydrophobicContact CD1-CG 4.49Å; Y525-F527 AromaticContact CE1-CD2 3.97Å; Y525-F527 HydrophobicContact CE1-CD2 3.97Å; Y525-F527 HydrophobicContact CE1-CE2 4.29Å; Y525-F527 HydrophobicContact CE1-CG 4.42Å; Y525-F527 PolarHBondContact O-N 3.09Å; Y525-A530 HydrophobicContact CE1-CB 4.38Å
526	N	76.5	Confident	70.3	Confident	106 Å²	106	88.9 Å²	88.9	57%	0.567	50%	0.503	S	S	*	.			trans	-73	90	178.4	-175.4	0.3	0	0	0	111.4	A524 D528 G529 A530	A524-N526 PolarHBondContact O-N 3.17Å; N526-D528 PolarHBondContact O-N 3.36Å; N526-D528 PolarHBondContact OD1-N 2.73Å; N526-G529 PolarHBondContact O-N 3.04Å; N526-G529 PolarHBondContact OD1-N 2.96Å; N526-A530 PolarHBondContact O-N 2.78Å
527	F	73.8	Confident	70.4	Confident	97 Å²	97	90.6 Å²	90.6	43%	0.425	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-42.1	179.2	-132.4	-78.2	0	0	0	112.5	A512 Y525 A530 L531	A512-F527 HydrophobicContact CB-CD2 4.33Å; A512-F527 HydrophobicContact CB-CE2 3.32Å; A512-F527 HydrophobicContact CB-CZ 3.75Å; Y525-F527 AromaticContact CD1-CD2 3.85Å; Y525-F527 HydrophobicContact CD1-CD2 3.85Å; Y525-F527 HydrophobicContact CD1-CE2 4.4Å; Y525-F527 HydrophobicContact CD1-CG 4.49Å; Y525-F527 AromaticContact CE1-CD2 3.97Å; Y525-F527 HydrophobicContact CE1-CD2 3.97Å; Y525-F527 HydrophobicContact CE1-CE2 4.29Å; Y525-F527 HydrophobicContact CE1-CG 4.42Å; Y525-F527 PolarHBondContact O-N 3.09Å; F527-A530 PolarHBondContact O-N 3.41Å; F527-L531 WeakPolarHBondContact O-CB 3.24Å; F527-L531 PolarHBondContact O-N 3.39Å
528	D	71.7	Confident	70.3	Confident	122 Å²	122	87.1 Å²	87.1	65%	0.652	49%	0.487	S	S	*	.	H	α-helix	trans	-65.1	-42.9	-178.9	-69	-29.3	0	0	0	110.9	N526 A530 L531 E532	N526-D528 PolarHBondContact O-N 3.36Å; N526-D528 PolarHBondContact OD1-N 2.73Å; D528-A530 PolarHBondContact O-N 3.03Å; D528-L531 PolarHBondContact O-N 3.36Å; D528-E532 WeakPolarHBondContact O-CB 3.43Å; D528-E532 WeakPolarHBondContact O-CG 3.38Å; D528-E532 PolarHBondContact O-N 3.4Å
529	G	72.3	Confident	70.3	Confident	18 Å²	18	90.3 Å²	90.3	19%	0.186	50%	0.502	C	S	.	.	H	α-helix	trans	-64.4	-37.6	174.9	0	0	0	0	0	113.1	N526 M533	N526-G529 PolarHBondContact O-N 3.04Å; N526-G529 PolarHBondContact OD1-N 2.96Å; G529-M533 WeakPolarHBondContact O-CB 3.32Å; G529-M533 WeakPolarHBondContact O-CG 3.42Å; G529-M533 PolarHBondContact O-N 3.07Å
530	A	70.6	Confident	70.3	Confident	18 Å²	18	89.8 Å²	89.8	15%	0.149	49%	0.494	C	S	.	.	H	α-helix	trans	-67	-38.4	174.3	0	0	0	0	0	111.9	A508 Y525 N526 F527 D528 A534	A508-A530 HydrophobicContact CB-CB 4.28Å; Y525-A530 HydrophobicContact CE1-CB 4.38Å; N526-A530 PolarHBondContact O-N 2.78Å; F527-A530 PolarHBondContact O-N 3.41Å; D528-A530 PolarHBondContact O-N 3.03Å; A530-A534 WeakPolarHBondContact O-CB 3.25Å; A530-A534 PolarHBondContact O-N 3.1Å; A530-A534 VanDerWaalsContact O-N 3.13Å
531	L	66.9	Low	70	Confident	78 Å²	78	86.4 Å²	86.4	41%	0.408	48%	0.477	S	S	.	.	H	α-helix	trans	-67.3	-44.3	176.1	-148.8	83.4	0	0	0	111.2	L505 F527 D528 A534 E535	L505-L531 HydrophobicContact CD1-CD1 3.65Å; F527-L531 WeakPolarHBondContact O-CB 3.24Å; F527-L531 PolarHBondContact O-N 3.39Å; D528-L531 PolarHBondContact O-N 3.36Å; L531-A534 WeakPolarHBondContact O-CA 3.32Å; L531-A534 WeakPolarHBondContact O-CB 3.37Å; L531-A534 PolarHBondContact O-N 3.1Å; L531-A534 VanDerWaalsContact O-N 3.09Å; L531-E535 WeakPolarHBondContact O-CG 3.15Å; L531-E535 PolarHBondContact O-N 3.06Å
532	E	69.6	Low	69.8	Low	148 Å²	148	86.1 Å²	86.1	69%	0.692	48%	0.476	S	S	*	.	H	α-helix	trans	-61.8	-40.8	174.9	-79.7	-170.3	164.3	0	0	112.3	D528 A534 E535	D528-E532 WeakPolarHBondContact O-CB 3.43Å; D528-E532 WeakPolarHBondContact O-CG 3.38Å; D528-E532 PolarHBondContact O-N 3.4Å; E532-A534 PolarHBondContact O-N 3.48Å; E532-E535 PolarHBondContact O-N 3.17Å
533	M	68.7	Low	69.8	Low	148 Å²	148	87.3 Å²	87.3	73%	0.729	48%	0.484	S	S	*	.	H	α-helix	trans	-67.3	-23.4	173.9	-75.1	-144.1	-64.4	0	0	113.4	G529	G529-M533 WeakPolarHBondContact O-CB 3.32Å; G529-M533 WeakPolarHBondContact O-CG 3.42Å; G529-M533 PolarHBondContact O-N 3.07Å
534	A	59	Low	69.7	Low	6 Å²	6	86.7 Å²	86.7	5%	0.05	46%	0.459	C	S	.	.	H	α-helix	trans	-80.5	-30.1	175.6	0	0	0	0	0	112.7	R501 R504 A530 L531 E532	R501-A534 WeakPolarHBondContact CD-O 3.44Å; R501-A534 VanDerWaalsContact CG-O 3.23Å; R501-A534 WeakPolarHBondContact CG-O 3.48Å; R504-A534 HydrophobicContact CB-CB 3.97Å; A530-A534 WeakPolarHBondContact O-CB 3.25Å; A530-A534 PolarHBondContact O-N 3.1Å; A530-A534 VanDerWaalsContact O-N 3.13Å; L531-A534 WeakPolarHBondContact O-CA 3.32Å; L531-A534 WeakPolarHBondContact O-CB 3.37Å; L531-A534 PolarHBondContact O-N 3.1Å; L531-A534 VanDerWaalsContact O-N 3.09Å; E532-A534 PolarHBondContact O-N 3.48Å
535	E	56.5	Low	69.2	Low	157 Å²	157	86.9 Å²	86.9	73%	0.734	44%	0.438	S	S	*	.			trans	-65.7	0	176.9	-59.5	-143.6	124.6	0	0	114.2	R501 L531 E532	R501-E535 IonicContact CZ-OE1 2.72Å; R501-E535 VanDerWaalsContact NH2-CD 3.34Å; R501-E535 IonicContact NH2-OE1 3.31Å; R501-E535 PolarHBondContact NH2-OE1 2.87Å; L531-E535 WeakPolarHBondContact O-CG 3.15Å; L531-E535 PolarHBondContact O-N 3.06Å; E532-E535 PolarHBondContact O-N 3.17Å

Retrieved 535 of 535 residues in 255.6 ms (Link to these results)

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