A0A077YZQ5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077YZQ5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 561 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	45.2	Very low	39.7	Very low	186 Å²	186	110.6 Å²	110.6	92%	0.916	61%	0.609	S	S	*	*				0	-69.2	0	-70.9	-150.3	92.8	0	0	113.7	L3 D4 C5	M1-L3 PolarHBondContact O-N 3.37Å; M1-D4 WeakPolarHBondContact CA-OD2 3.13Å; M1-D4 PolarHBondContact N-OD2 3.37Å; M1-D4 PolarHBondContact O-N 3.34Å; M1-C5 PolarHBondContact O-N 2.77Å; M1-C5 VanDerWaalsContact O-N 3.11Å
2	V	36.3	Very low	39.6	Very low	130 Å²	130	108.8 Å²	108.8	79%	0.788	60%	0.596	S	S	*	*	H	α-helix	trans	-64.7	-38	-179.7	-178.8	0	0	0	0	112.5	C5 A6	V2-C5 PolarHBondContact O-N 2.86Å; V2-A6 PolarHBondContact O-N 3.37Å; V2-A6 VanDerWaalsContact O-N 3.15Å
3	L	35.5	Very low	39.6	Very low	135 Å²	135	112 Å²	112	71%	0.707	60%	0.601	S	S	*	*	H	α-helix	trans	-67	-35.5	177	-151.2	78.8	0	0	0	112.5	M1 A6 L7	M1-L3 PolarHBondContact O-N 3.37Å; L3-A6 PolarHBondContact O-N 3.12Å; L3-L7 WeakPolarHBondContact O-CG 3.49Å; L3-L7 PolarHBondContact O-N 2.92Å; L3-L7 VanDerWaalsContact O-N 3.12Å
4	D	40.8	Very low	39.6	Very low	102 Å²	102	108.1 Å²	108.1	55%	0.545	59%	0.592	S	S	.	*	H	α-helix	trans	-71.3	-37.8	178.4	-53.5	-55.2	0	0	0	111.4	M1 L7 F8	M1-D4 WeakPolarHBondContact CA-OD2 3.13Å; M1-D4 PolarHBondContact N-OD2 3.37Å; M1-D4 PolarHBondContact O-N 3.34Å; D4-L7 PolarHBondContact O-N 3.41Å; D4-F8 WeakPolarHBondContact O-CB 3.35Å; D4-F8 PolarHBondContact O-N 2.88Å
5	C	33.7	Very low	39.5	Very low	81 Å²	81	104.5 Å²	104.5	55%	0.547	58%	0.577	S	S	.	*	H	α-helix	trans	-64.5	-39.1	172.5	-73.4	0	0	0	0	112.4	M1 V2 F8 V9	M1-C5 PolarHBondContact O-N 2.77Å; M1-C5 VanDerWaalsContact O-N 3.11Å; V2-C5 PolarHBondContact O-N 2.86Å; C5-F8 PolarHBondContact O-N 3.3Å; C5-V9 VanDerWaalsContact O-CG2 3.32Å; C5-V9 WeakPolarHBondContact O-CG2 3.2Å; C5-V9 PolarHBondContact O-N 3.4Å
6	A	38.4	Very low	39.2	Very low	55 Å²	55	101.3 Å²	101.3	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-68	-38.4	178.7	0	0	0	0	0	112.6	V2 L3 S10	V2-A6 PolarHBondContact O-N 3.37Å; V2-A6 VanDerWaalsContact O-N 3.15Å; L3-A6 PolarHBondContact O-N 3.12Å; A6-S10 WeakPolarHBondContact O-CB 3.44Å; A6-S10 PolarHBondContact O-N 2.87Å; A6-S10 PolarHBondContact O-OG 3.49Å
7	L	43.4	Very low	39.3	Very low	113 Å²	113	107.8 Å²	107.8	59%	0.592	58%	0.582	S	S	*	*	H	α-helix	trans	-68.4	-38.6	174.2	-72.8	169.9	0	0	0	111.8	L3 D4 S10 F11	L3-L7 WeakPolarHBondContact O-CG 3.49Å; L3-L7 PolarHBondContact O-N 2.92Å; L3-L7 VanDerWaalsContact O-N 3.12Å; D4-L7 PolarHBondContact O-N 3.41Å; L7-S10 PolarHBondContact O-N 2.93Å; L7-F11 WeakPolarHBondContact O-CB 3.25Å; L7-F11 PolarHBondContact O-N 3.36Å
8	F	38.2	Very low	39.2	Very low	121 Å²	121	113.1 Å²	113.1	53%	0.531	59%	0.592	S	S	.	*	H	α-helix	trans	-66.3	-43.1	176.8	-165.4	-105.9	0	0	0	112.4	D4 C5 S10 F11 I12	D4-F8 WeakPolarHBondContact O-CB 3.35Å; D4-F8 PolarHBondContact O-N 2.88Å; C5-F8 PolarHBondContact O-N 3.3Å; F8-S10 PolarHBondContact O-N 3.29Å; F8-F11 PolarHBondContact O-N 3.4Å; F8-I12 HydrophobicContact CD1-CD1 3.75Å; F8-I12 HydrophobicContact CD1-CG1 4.44Å; F8-I12 HydrophobicContact CE1-CD1 3.44Å; F8-I12 VanDerWaalsContact CE1-CD1 3.44Å; F8-I12 HydrophobicContact CE1-CG1 4.3Å; F8-I12 HydrophobicContact CZ-CD1 4.12Å; F8-I12 WeakPolarHBondContact O-CG1 3.44Å; F8-I12 PolarHBondContact O-N 3.12Å
9	V	41.8	Very low	39.1	Very low	79 Å²	79	111.6 Å²	111.6	48%	0.479	59%	0.588	S	S	.	*	H	α-helix	trans	-64.9	-39.4	175.4	173.9	0	0	0	0	111.3	C5 F11 I12 F13	C5-V9 VanDerWaalsContact O-CG2 3.32Å; C5-V9 WeakPolarHBondContact O-CG2 3.2Å; C5-V9 PolarHBondContact O-N 3.4Å; V9-F11 VanDerWaalsContact C-N 3.34Å; V9-F11 PolarHBondContact O-N 3.28Å; V9-I12 PolarHBondContact O-N 3.42Å; V9-F13 HydrophobicContact CG1-CD2 4.14Å; V9-F13 HydrophobicContact CG1-CE2 4.43Å; V9-F13 PolarHBondContact O-N 3.11Å
10	S	42.3	Very low	39.1	Very low	77 Å²	77	112.2 Å²	112.2	54%	0.538	59%	0.591	S	S	.	*	H	α-helix	trans	-65.7	-36.8	175.9	-59.1	0	0	0	0	112.2	A6 L7 F8 A14	A6-S10 WeakPolarHBondContact O-CB 3.44Å; A6-S10 PolarHBondContact O-N 2.87Å; A6-S10 PolarHBondContact O-OG 3.49Å; L7-S10 PolarHBondContact O-N 2.93Å; F8-S10 PolarHBondContact O-N 3.29Å; S10-A14 WeakPolarHBondContact O-CB 3.47Å; S10-A14 PolarHBondContact O-N 2.98Å
11	F	40.8	Very low	39.1	Very low	138 Å²	138	110.7 Å²	110.7	61%	0.605	59%	0.59	S	S	*	*	H	α-helix	trans	-68.1	-42.7	175.6	-172.3	-98.7	0	0	0	112.2	L7 F8 V9 F13 A14 C15	L7-F11 WeakPolarHBondContact O-CB 3.25Å; L7-F11 PolarHBondContact O-N 3.36Å; F8-F11 PolarHBondContact O-N 3.4Å; V9-F11 VanDerWaalsContact C-N 3.34Å; V9-F11 PolarHBondContact O-N 3.28Å; F11-F13 PolarHBondContact O-N 3.49Å; F11-A14 PolarHBondContact O-N 3.42Å; F11-C15 WeakPolarHBondContact O-CB 3.28Å; F11-C15 PolarHBondContact O-N 2.92Å
12	I	38.4	Very low	38.8	Very low	88 Å²	88	106.4 Å²	106.4	45%	0.451	57%	0.574	S	S	.	*	H	α-helix	trans	-60.8	-44.4	174.8	-70.8	178.5	0	0	0	110.9	F8 V9 A14 C15 A16	F8-I12 HydrophobicContact CD1-CD1 3.75Å; F8-I12 HydrophobicContact CD1-CG1 4.44Å; F8-I12 HydrophobicContact CE1-CD1 3.44Å; F8-I12 VanDerWaalsContact CE1-CD1 3.44Å; F8-I12 HydrophobicContact CE1-CG1 4.3Å; F8-I12 HydrophobicContact CZ-CD1 4.12Å; F8-I12 WeakPolarHBondContact O-CG1 3.44Å; F8-I12 PolarHBondContact O-N 3.12Å; V9-I12 PolarHBondContact O-N 3.42Å; I12-A14 PolarHBondContact O-N 3.48Å; I12-C15 PolarHBondContact O-N 3.4Å; I12-A16 WeakPolarHBondContact O-CB 3.32Å; I12-A16 PolarHBondContact O-N 3.06Å
13	F	40.6	Very low	38.7	Very low	151 Å²	151	103.9 Å²	103.9	66%	0.662	56%	0.559	S	S	*	*	H	α-helix	trans	-64.6	-38.1	177.2	-99.3	-83.2	0	0	0	112.8	V9 F11 R17	V9-F13 HydrophobicContact CG1-CD2 4.14Å; V9-F13 HydrophobicContact CG1-CE2 4.43Å; V9-F13 PolarHBondContact O-N 3.11Å; F11-F13 PolarHBondContact O-N 3.49Å; F13-R17 WeakPolarHBondContact O-CB 3.47Å; F13-R17 PolarHBondContact O-N 2.82Å; F13-R17 VanDerWaalsContact O-N 3.08Å
14	A	39.5	Very low	38.7	Very low	57 Å²	57	100.7 Å²	100.7	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-40.2	176.1	0	0	0	0	0	112.3	S10 F11 I12 R18	S10-A14 WeakPolarHBondContact O-CB 3.47Å; S10-A14 PolarHBondContact O-N 2.98Å; F11-A14 PolarHBondContact O-N 3.42Å; I12-A14 PolarHBondContact O-N 3.48Å; A14-R18 PolarHBondContact O-N 3.07Å; A14-R18 VanDerWaalsContact O-N 3.16Å
15	C	37.8	Very low	38.6	Very low	54 Å²	54	98.6 Å²	98.6	37%	0.365	54%	0.54	S	S	.	.	H	α-helix	trans	-67.6	-45.3	175.5	-78.1	0	0	0	0	112	F11 I12 R17 R18 V19	F11-C15 WeakPolarHBondContact O-CB 3.28Å; F11-C15 PolarHBondContact O-N 2.92Å; I12-C15 PolarHBondContact O-N 3.4Å; C15-R17 VanDerWaalsContact C-N 3.28Å; C15-R17 PolarHBondContact O-N 3Å; C15-R18 PolarHBondContact O-N 3.03Å; C15-R18 VanDerWaalsContact O-N 3.17Å; C15-V19 WeakPolarHBondContact O-CG2 3.49Å; C15-V19 PolarHBondContact O-N 3.47Å
16	A	34.7	Very low	38.6	Very low	54 Å²	54	101.4 Å²	101.4	45%	0.446	54%	0.544	S	S	.	.	H	α-helix	trans	-58.8	-40	176.1	0	0	0	0	0	111.9	I12 V19 L20	I12-A16 WeakPolarHBondContact O-CB 3.32Å; I12-A16 PolarHBondContact O-N 3.06Å; A16-V19 PolarHBondContact O-N 3.33Å; A16-L20 WeakPolarHBondContact O-CB 3.24Å; A16-L20 PolarHBondContact O-N 2.87Å
17	R	40.5	Very low	38.3	Very low	211 Å²	211	104.6 Å²	104.6	80%	0.796	55%	0.551	S	S	*	*	H	α-helix	trans	-68.4	-35.2	178	-161.3	173.5	178.9	164	-0.5	112.9	F13 C15 S21	F13-R17 WeakPolarHBondContact O-CB 3.47Å; F13-R17 PolarHBondContact O-N 2.82Å; F13-R17 VanDerWaalsContact O-N 3.08Å; C15-R17 VanDerWaalsContact C-N 3.28Å; C15-R17 PolarHBondContact O-N 3Å; R17-S21 PolarHBondContact O-N 3.49Å
18	R	38.7	Very low	38	Very low	203 Å²	203	109.4 Å²	109.4	77%	0.766	56%	0.561	S	S	*	*	H	α-helix	trans	-70.4	-43	173.5	-93.1	-177.2	174.1	171.6	-0.5	112.2	A14 C15 S21 T22	A14-R18 PolarHBondContact O-N 3.07Å; A14-R18 VanDerWaalsContact O-N 3.16Å; C15-R18 PolarHBondContact O-N 3.03Å; C15-R18 VanDerWaalsContact O-N 3.17Å; R18-S21 WeakPolarHBondContact O-CB 3.47Å; R18-S21 PolarHBondContact O-N 2.93Å; R18-T22 PolarHBondContact O-N 3.36Å; R18-T22 PolarHBondContact O-OG1 3.27Å
19	V	36.5	Very low	37.9	Very low	85 Å²	85	113 Å²	113	52%	0.515	57%	0.571	S	S	.	*	H	α-helix	trans	-64.1	-43.6	177.6	174.9	0	0	0	0	110.9	C15 A16 S21 T22 V23	C15-V19 WeakPolarHBondContact O-CG2 3.49Å; C15-V19 PolarHBondContact O-N 3.47Å; A16-V19 PolarHBondContact O-N 3.33Å; V19-S21 VanDerWaalsContact C-N 3.31Å; V19-S21 PolarHBondContact O-N 3.08Å; V19-T22 PolarHBondContact O-N 3.21Å; V19-V23 HydrophobicContact CG1-CG2 4.2Å; V19-V23 WeakPolarHBondContact O-CG2 3.35Å; V19-V23 PolarHBondContact O-N 3.16Å
20	L	39.4	Very low	37.4	Very low	124 Å²	124	112.8 Å²	112.8	65%	0.649	57%	0.572	S	S	*	*	H	α-helix	trans	-62.4	-38	177.3	-145.7	81	0	0	0	112	A16 C24	A16-L20 WeakPolarHBondContact O-CB 3.24Å; A16-L20 PolarHBondContact O-N 2.87Å; L20-C24 VanDerWaalsContact O-CB 3.32Å; L20-C24 WeakPolarHBondContact O-CB 3.45Å; L20-C24 PolarHBondContact O-N 3.06Å; L20-C24 PolarHBondContact O-SG 3.01Å
21	S	39.6	Very low	36.8	Very low	80 Å²	80	116.6 Å²	116.6	56%	0.559	59%	0.587	S	S	*	*	H	α-helix	trans	-63.4	-42.8	174.4	-179	0	0	0	0	112.3	R17 R18 V19 S25	R17-S21 PolarHBondContact O-N 3.49Å; R18-S21 WeakPolarHBondContact O-CB 3.47Å; R18-S21 PolarHBondContact O-N 2.93Å; V19-S21 VanDerWaalsContact C-N 3.31Å; V19-S21 PolarHBondContact O-N 3.08Å; S21-S25 WeakPolarHBondContact O-CB 3.41Å; S21-S25 PolarHBondContact O-N 3.17Å
22	T	37.3	Very low	36.3	Very low	97 Å²	97	113.2 Å²	113.2	60%	0.595	58%	0.584	S	S	*	*	H	α-helix	trans	-71.2	-39.7	-180	-48.9	0	0	0	0	111.5	R18 V19 S25 F26	R18-T22 PolarHBondContact O-N 3.36Å; R18-T22 PolarHBondContact O-OG1 3.27Å; V19-T22 PolarHBondContact O-N 3.21Å; T22-S25 PolarHBondContact O-N 3.02Å; T22-F26 WeakPolarHBondContact O-CB 3.48Å; T22-F26 PolarHBondContact O-N 2.89Å
23	V	34.7	Very low	35.7	Very low	76 Å²	76	116.1 Å²	116.1	46%	0.461	61%	0.605	S	S	.	*	H	α-helix	trans	-66.4	-42.1	175.1	174	0	0	0	0	111.2	V19 S25 F26 M27	V19-V23 HydrophobicContact CG1-CG2 4.2Å; V19-V23 WeakPolarHBondContact O-CG2 3.35Å; V19-V23 PolarHBondContact O-N 3.16Å; V23-S25 VanDerWaalsContact C-N 3.31Å; V23-S25 PolarHBondContact O-N 2.96Å; V23-F26 PolarHBondContact O-N 2.78Å; V23-M27 HydrophobicContact CG1-CG 4.18Å; V23-M27 WeakPolarHBondContact O-CB 3.37Å; V23-M27 WeakPolarHBondContact O-CG 3.46Å; V23-M27 PolarHBondContact O-N 3.15Å
24	C	34.9	Very low	35	Very low	68 Å²	68	114.3 Å²	114.3	46%	0.459	61%	0.612	S	S	.	*	H	α-helix	trans	-64.2	-34.6	173.9	-74.8	0	0	0	0	112.4	L20 R28	L20-C24 VanDerWaalsContact O-CB 3.32Å; L20-C24 WeakPolarHBondContact O-CB 3.45Å; L20-C24 PolarHBondContact O-N 3.06Å; L20-C24 PolarHBondContact O-SG 3.01Å; C24-R28 WeakPolarHBondContact O-CB 3.47Å; C24-R28 WeakPolarHBondContact O-CG 3.41Å; C24-R28 PolarHBondContact O-N 3.3Å; C24-R28 VanDerWaalsContact O-N 3.1Å
25	S	40.2	Very low	34.2	Very low	58 Å²	58	116.5 Å²	116.5	41%	0.406	63%	0.63	S	S	.	*	H	α-helix	trans	-73.5	-31.4	174.9	-165.8	0	0	0	0	113	S21 T22 V23 R29	S21-S25 WeakPolarHBondContact O-CB 3.41Å; S21-S25 PolarHBondContact O-N 3.17Å; T22-S25 PolarHBondContact O-N 3.02Å; V23-S25 VanDerWaalsContact C-N 3.31Å; V23-S25 PolarHBondContact O-N 2.96Å; S25-R29 PolarHBondContact O-N 2.91Å
26	F	33.6	Very low	33.5	Very low	140 Å²	140	123.5 Å²	123.5	61%	0.614	65%	0.654	S	S	*	*	H	α-helix	trans	-73.2	-45.2	174.6	-170.9	-98.3	0	0	0	111.3	T22 V23 R28 R29 C30	T22-F26 WeakPolarHBondContact O-CB 3.48Å; T22-F26 PolarHBondContact O-N 2.89Å; V23-F26 PolarHBondContact O-N 2.78Å; F26-R28 VanDerWaalsContact C-N 3.29Å; F26-R28 PolarHBondContact O-N 2.82Å; F26-R29 WeakPolarHBondContact O-CA 3.45Å; F26-R29 PolarHBondContact O-N 2.86Å; F26-C30 VanDerWaalsContact CE1-SG 3.52Å; F26-C30 PolarHBondContact O-N 3.46Å; F26-C30 PolarHBondContact O-SG 3.11Å
27	M	32.2	Very low	33	Very low	123 Å²	123	125.4 Å²	125.4	61%	0.606	66%	0.662	S	S	*	*	H	α-helix	trans	-62	-33.8	175.2	-69.6	-78.8	-79.6	0	0	112.4	V23 R29 N31	V23-M27 HydrophobicContact CG1-CG 4.18Å; V23-M27 WeakPolarHBondContact O-CB 3.37Å; V23-M27 WeakPolarHBondContact O-CG 3.46Å; V23-M27 PolarHBondContact O-N 3.15Å; M27-R29 VanDerWaalsContact C-N 3.34Å; M27-N31 PolarHBondContact O-N 2.97Å
28	R	36.6	Very low	32.1	Very low	213 Å²	213	124.5 Å²	124.5	80%	0.804	66%	0.664	S	S	*	*	H	α-helix	trans	-69.5	-26.4	171.5	-78.9	-178.1	-169.5	167.1	4	113.7	C24 F26	C24-R28 WeakPolarHBondContact O-CB 3.47Å; C24-R28 WeakPolarHBondContact O-CG 3.41Å; C24-R28 PolarHBondContact O-N 3.3Å; C24-R28 VanDerWaalsContact O-N 3.1Å; F26-R28 VanDerWaalsContact C-N 3.29Å; F26-R28 PolarHBondContact O-N 2.82Å
29	R	35.1	Very low	31.2	Very low	198 Å²	198	120.3 Å²	120.3	75%	0.747	67%	0.665	S	S	*	*	H	α-helix	trans	-84.5	-27.3	176.1	-75.8	-179.3	-178.5	179.2	0.8	113	S25 F26 M27	S25-R29 PolarHBondContact O-N 2.91Å; F26-R29 WeakPolarHBondContact O-CA 3.45Å; F26-R29 PolarHBondContact O-N 2.86Å; M27-R29 VanDerWaalsContact C-N 3.34Å
30	C	31.8	Very low	30.4	Very low	74 Å²	74	123.3 Å²	123.3	50%	0.5	68%	0.683	S	S	.	*	H	α-helix	trans	-85.6	-8.9	-179.4	-65.7	0	0	0	0	115	F26 A32	F26-C30 VanDerWaalsContact CE1-SG 3.52Å; F26-C30 PolarHBondContact O-N 3.46Å; F26-C30 PolarHBondContact O-SG 3.11Å; C30-A32 VanDerWaalsContact C-N 3.26Å; C30-A32 PolarHBondContact O-N 3.49Å
31	N	30	Very low	29.4	Very low	157 Å²	157	125.6 Å²	125.6	84%	0.84	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	8.3	173	-89.3	-10.5	0	0	0	114.1	M27	M27-N31 PolarHBondContact O-N 2.97Å
32	A	29.3	Very low	28.5	Very low	67 Å²	67	128.3 Å²	128.3	55%	0.554	70%	0.703	S	S	*	*	S	Bend	trans	-107.7	128.3	171.2	0	0	0	0	0	109.3	C30	C30-A32 VanDerWaalsContact C-N 3.26Å; C30-A32 PolarHBondContact O-N 3.49Å
33	V	27.6	Very low	27.7	Very low	148 Å²	148	129.9 Å²	129.9	90%	0.897	71%	0.708	S	S	*	*			trans	90.2	75.7	171.1	-159.8	0	0	0	0	115.8
34	S	24.7	Very low	27.1	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	73%	0.726	S	S	*	*			trans	-78.2	143.5	151.4	60	0	0	0	0	110.8
35	A	23.9	Very low	26.4	Very low	103 Å²	103	139.7 Å²	139.7	85%	0.851	74%	0.738	S	S	*	*			trans	161.2	117.7	141.8	0	0	0	0	0	111.8
36	K	22	Very low	25.6	Very low	200 Å²	200	146 Å²	146	87%	0.87	76%	0.759	S	S	*	*			trans	-82.8	-166.1	166.3	-61.6	175.7	168.3	177	0	110.2
37	P	25	Very low	25.1	Very low	95 Å²	95	145.9 Å²	145.9	62%	0.617	76%	0.764	S	S	*	*			cis	-137	-179.3	-35.2	18.5	8.3	0	0	0	115.9
38	F	21.2	Very low	24.7	Very low	191 Å²	191	146.3 Å²	146.3	84%	0.838	77%	0.773	S	S	*	*			trans	121.3	130.9	144	-66.9	-71.2	0	0	0	124.1
39	C	19.3	Very low	24.2	Very low	116 Å²	116	141 Å²	141	78%	0.784	77%	0.766	S	S	*	*			trans	17.6	151.1	151.8	-86.3	0	0	0	0	128.4
40	V	19.4	Very low	23.7	Very low	147 Å²	147	140.7 Å²	140.7	89%	0.891	77%	0.773	S	S	*	*				-178.7	147.5	121.3	156.9	0	0	0	0	113.9
41	H	19.9	Very low	23.3	Very low	173 Å²	173	144.6 Å²	144.6	80%	0.801	79%	0.787	S	S	*	*			trans	-77	161.5	-176.7	-92.1	-93.7	0	0	0	117.9
42	V	20	Very low	22.9	Very low	137 Å²	137	142.1 Å²	142.1	83%	0.83	79%	0.789	S	S	*	*			trans	-155.9	146.3	137	-170.7	0	0	0	0	112.3
43	N	20	Very low	22.6	Very low	130 Å²	130	143 Å²	143	70%	0.695	80%	0.796	S	S	*	*			trans	-111	154.2	-173	-150.2	20.3	0	0	0	111.9
44	Y	22.3	Very low	22.4	Very low	218 Å²	218	140.4 Å²	140.4	86%	0.855	79%	0.785	S	S	*	*			trans	-146.9	116.1	162.1	-87.8	-80.9	0	0	0	111.9
45	D	21.2	Very low	22.5	Very low	132 Å²	132	145.2 Å²	145.2	71%	0.706	79%	0.787	S	S	*	*			trans	-82.8	148.4	164.4	-72.9	-52.4	0	0	0	110.5
46	F	23.6	Very low	22.4	Very low	190 Å²	190	145 Å²	145	83%	0.833	78%	0.779	S	S	*	*			trans	-171.2	114.6	140.8	-103.1	-76.3	0	0	0	112.4
47	L	22.2	Very low	22.5	Very low	138 Å²	138	142.2 Å²	142.2	72%	0.723	77%	0.774	S	S	*	*			trans	35.3	127	142	-81.9	131.4	0	0	0	122.4
48	V	24.4	Very low	22.4	Very low	132 Å²	132	150.2 Å²	150.2	80%	0.8	79%	0.792	S	S	*	*				-171.1	132.5	95.4	169.9	0	0	0	0	110
49	P	25.2	Very low	22.5	Very low	102 Å²	102	149 Å²	149	66%	0.662	79%	0.794	S	S	*	*			trans	-104.6	129.3	171.7	34.4	-23.1	0	0	0	112.2
50	E	24.1	Very low	22.6	Very low	190 Å²	190	153 Å²	153	89%	0.888	80%	0.798	S	S	*	*			trans	-171.6	151.9	155.7	-114.4	164.4	-163.6	0	0	112.7
51	I	24.3	Very low	22.8	Very low	157 Å²	157	153.6 Å²	153.6	81%	0.805	80%	0.796	S	S	*	*			trans	89.3	56.6	178.3	-43.1	162.3	0	0	0	115
52	A	22	Very low	22.9	Very low	105 Å²	105	154.8 Å²	154.8	87%	0.868	79%	0.794	S	S	*	*			trans	-92.5	99.9	134.8	0	0	0	0	0	107.5
53	A	22.5	Very low	23.1	Very low	86 Å²	86	159.7 Å²	159.7	71%	0.711	80%	0.798	S	S	*	*			trans	160.5	83.2	157.7	0	0	0	0	0	110
54	S	23.9	Very low	23.2	Very low	93 Å²	93	163.4 Å²	163.4	65%	0.65	80%	0.802	S	S	*	*			trans	-166.2	122.2	152.3	-115.1	0	0	0	0	111.9
55	Y	25.4	Very low	23.2	Very low	214 Å²	214	159.1 Å²	159.1	84%	0.839	80%	0.802	S	S	*	*			trans	84.8	64.5	165.1	-54.5	-71.8	0	0	0	118.4
56	S	23.1	Very low	23.3	Very low	100 Å²	100	157.6 Å²	157.6	70%	0.699	80%	0.802	S	S	*	*			trans	-43.4	139.5	133.4	51.5	0	0	0	0	113.3
57	N	22.9	Very low	23.4	Very low	140 Å²	140	153.1 Å²	153.1	75%	0.749	80%	0.795	S	S	*	*			trans	124.5	64.4	155.6	-71.9	-18.9	0	0	0	115.8
58	W	23.1	Very low	23.5	Very low	263 Å²	263	151.6 Å²	151.6	100%	0.996	80%	0.795	S	S	*	*			trans	-129.2	113.2	151.1	-82.1	69.3	0	0	0	110.2
59	N	23.8	Very low	23.6	Very low	166 Å²	166	151.2 Å²	151.2	89%	0.888	80%	0.799	S	S	*	*			trans	-67.5	122.8	-168.5	-89.4	-41.2	0	0	0	113.3
60	F	21.6	Very low	23.6	Very low	200 Å²	200	149.7 Å²	149.7	88%	0.877	80%	0.801	S	S	*	*			trans	-77.8	111.3	159.4	-107.5	-93.3	0	0	0	109.9	R62	F60-R62 PolarHBondContact O-N 3.08Å
61	N	23.7	Very low	23.6	Very low	159 Å²	159	148.1 Å²	148.1	85%	0.85	80%	0.799	S	S	*	*			trans	-76.5	90.1	164.8	-107.6	-24.1	0	0	0	109.9	R63	N61-R63 PolarHBondContact O-N 2.98Å
62	R	21.8	Very low	23.6	Very low	199 Å²	199	146 Å²	146	75%	0.751	80%	0.796	S	S	*	*			trans	-64.4	111.8	157.6	-94.7	179.5	170.8	176.3	0.9	108.8	F60	F60-R62 PolarHBondContact O-N 3.08Å
63	R	23.1	Very low	23.6	Very low	240 Å²	240	147.3 Å²	147.3	91%	0.906	79%	0.789	S	S	*	*			trans	-99.2	105	149.6	-78.3	-167.9	-173.3	-175.6	3.8	109.2	N61	N61-R63 PolarHBondContact O-N 2.98Å
64	R	22	Very low	23.7	Very low	207 Å²	207	155 Å²	155	78%	0.781	80%	0.8	S	S	*	*			trans	-71.1	126.9	156.9	-74.4	178.8	176.3	176.8	-1.2	107.4
65	C	23.5	Very low	23.7	Very low	128 Å²	128	158 Å²	158	87%	0.865	81%	0.807	S	S	*	*			trans	-122.4	109.8	150.1	-78.7	0	0	0	0	107.4
66	S	22.9	Very low	23.6	Very low	101 Å²	101	152 Å²	152	71%	0.706	80%	0.796	S	S	*	*			trans	-71.9	171.8	169.9	43.8	0	0	0	0	111.7
67	S	26	Very low	23.5	Very low	96 Å²	96	154 Å²	154	67%	0.671	80%	0.799	S	S	*	*			trans	66.6	101.3	157.6	52	0	0	0	0	115.5
68	S	24.9	Very low	23.6	Very low	105 Å²	105	155.2 Å²	155.2	73%	0.734	80%	0.8	S	S	*	*				88.7	126.8	86.5	69.7	0	0	0	0	111.2	G70	S68-G70 PolarHBondContact O-N 3.4Å
69	S	26.4	Very low	23.6	Very low	125 Å²	125	149.7 Å²	149.7	87%	0.874	79%	0.785	S	S	*	*			trans	-25.2	126.6	164	51.5	0	0	0	0	114.2
70	G	24.6	Very low	23.6	Very low	69 Å²	69	148.5 Å²	148.5	71%	0.711	79%	0.788	S	S	*	*			trans	171.4	114.2	170.2	0	0	0	0	0	107.4	S68	S68-G70 PolarHBondContact O-N 3.4Å
71	D	24.3	Very low	23.7	Very low	157 Å²	157	143.8 Å²	143.8	84%	0.84	77%	0.772	S	S	*	*			trans	-36.3	144.9	178.7	-66	-60.7	0	0	0	114.4
72	C	23.2	Very low	23.8	Very low	112 Å²	112	143.4 Å²	143.4	76%	0.757	77%	0.77	S	S	*	*				171.5	123.4	122.9	-82.2	0	0	0	0	111
73	D	23.7	Very low	23.9	Very low	134 Å²	134	141.4 Å²	141.4	72%	0.717	77%	0.774	S	S	*	*			trans	69.6	105.4	134.9	-62.2	-32.4	0	0	0	122.4	I75	D73-I75 PolarHBondContact O-N 3.27Å
74	R	23.5	Very low	24	Very low	246 Å²	246	140.6 Å²	140.6	93%	0.928	77%	0.771	S	S	*	*				26.5	87.4	122.9	-75	-179.7	167.2	170	-2.3	115.8
75	I	23.4	Very low	24.2	Very low	156 Å²	156	138 Å²	138	80%	0.8	77%	0.77	S	S	*	*			trans	-135.9	124.2	150.3	-56.8	-179.9	0	0	0	109.2	D73	D73-I75 PolarHBondContact O-N 3.27Å
76	S	23.1	Very low	24.3	Very low	89 Å²	89	138.5 Å²	138.5	62%	0.622	76%	0.763	S	S	*	*			trans	-50.3	150.3	170.9	49.5	0	0	0	0	114.5
77	N	22.5	Very low	24.4	Very low	143 Å²	143	140.5 Å²	140.5	77%	0.765	77%	0.766	S	S	*	*			trans	64.8	135.9	168.4	-62.2	-22.6	0	0	0	115.5
78	H	24.4	Very low	24.4	Very low	165 Å²	165	139.5 Å²	139.5	76%	0.764	77%	0.771	S	S	*	*			trans	136.5	105.7	149	-71.5	-67.6	0	0	0	113
79	E	24.2	Very low	24.5	Very low	146 Å²	146	140.4 Å²	140.4	68%	0.682	77%	0.772	S	S	*	*			trans	41.2	105.2	134.7	-64.9	174.4	-177.9	0	0	117.9	N81	E79-N81 PolarHBondContact O-N 3.48Å; E79-N81 PolarHBondContact OE2-ND2 2.94Å
80	C	23.8	Very low	24.4	Very low	141 Å²	141	144.1 Å²	144.1	95%	0.953	77%	0.772	S	S	*	*			trans	-67.6	71.9	157.9	-83	0	0	0	0	111
81	N	23.4	Very low	24.5	Very low	101 Å²	101	146.1 Å²	146.1	54%	0.54	78%	0.776	S	S	.	*			trans	-98.8	80.1	164.6	-81.9	-27	0	0	0	108.6	E79	E79-N81 PolarHBondContact O-N 3.48Å; E79-N81 PolarHBondContact OE2-ND2 2.94Å
82	N	24.5	Very low	24.6	Very low	151 Å²	151	143.9 Å²	143.9	81%	0.807	77%	0.772	S	S	*	*			trans	-150.2	76.5	168.2	-87.3	-44	0	0	0	111.1	R84	N82-R84 PolarHBondContact O-N 3.4Å
83	L	25.3	Very low	24.7	Very low	158 Å²	158	146 Å²	146	83%	0.827	77%	0.771	S	S	*	*			trans	-77	107.1	159.6	-96.8	153.2	0	0	0	108.4
84	R	24.3	Very low	24.7	Very low	223 Å²	223	149.3 Å²	149.3	84%	0.842	78%	0.782	S	S	*	*			trans	-88.4	113.8	169	-75.5	-177.8	176.9	173.3	0.3	109.2	N82 I86	N82-R84 PolarHBondContact O-N 3.4Å; R84-I86 PolarHBondContact O-N 3.04Å
85	I	26.5	Very low	24.7	Very low	151 Å²	151	147.6 Å²	147.6	77%	0.774	78%	0.776	S	S	*	*			trans	-79.2	111.4	165.9	-60.2	174.3	0	0	0	107.4	N87	I85-N87 PolarHBondContact O-N 2.87Å
86	I	25.2	Very low	24.7	Very low	140 Å²	140	149.6 Å²	149.6	72%	0.718	78%	0.782	S	S	*	*			trans	-79.4	102.5	174.1	-57	172.9	0	0	0	107.2	R84 G88	R84-I86 PolarHBondContact O-N 3.04Å; I86-G88 PolarHBondContact O-N 3.41Å
87	N	25.4	Very low	24.7	Very low	143 Å²	143	151.8 Å²	151.8	77%	0.765	80%	0.796	S	S	*	*			trans	-70.9	100.4	165.3	-86.8	-11.6	0	0	0	108.3	I85 T89	I85-N87 PolarHBondContact O-N 2.87Å; N87-T89 PolarHBondContact O-N 3.47Å
88	G	26.4	Very low	24.8	Very low	74 Å²	74	149.2 Å²	149.2	76%	0.763	79%	0.789	S	S	*	*			trans	-53.3	120.4	169.1	0	0	0	0	0	110.2	I86	I86-G88 PolarHBondContact O-N 3.41Å
89	T	25.9	Very low	25	Very low	124 Å²	124	147.1 Å²	147.1	76%	0.761	79%	0.79	S	S	*	*			trans	-64.9	139.1	-168.3	41	0	0	0	0	115.7	N87	N87-T89 PolarHBondContact O-N 3.47Å
90	K	24.9	Very low	25	Very low	203 Å²	203	145.1 Å²	145.1	88%	0.883	78%	0.78	S	S	*	*			trans	34.5	101.6	136.3	-62.8	-177.4	-180	-178.7	0	117.8
91	S	26.4	Very low	25.1	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	76%	0.762	S	S	*	*			trans	-160.2	125.4	132.7	55.6	0	0	0	0	109.1	E93	S91-E93 PolarHBondContact O-N 3.33Å
92	S	26.6	Very low	25.3	Very low	109 Å²	109	146.1 Å²	146.1	76%	0.762	77%	0.771	S	S	*	*			trans	-40.9	127.6	163.9	47.4	0	0	0	0	111.9
93	E	25.4	Very low	25.4	Very low	157 Å²	157	142.8 Å²	142.8	73%	0.734	75%	0.752	S	S	*	*			trans	166.9	131	145.6	-94.7	165.8	-161	0	0	108.5	S91 R95	S91-E93 PolarHBondContact O-N 3.33Å; E93-R95 PolarHBondContact O-N 2.95Å; E93-R95 VanDerWaalsContact O-N 3.09Å
94	E	22.9	Very low	25.5	Very low	204 Å²	204	139.3 Å²	139.3	95%	0.953	74%	0.741	S	S	*	*			trans	-49.3	111.1	173	-65.4	170.1	148.8	0	0	110.1
95	R	23.7	Very low	25.6	Very low	209 Å²	209	132.4 Å²	132.4	79%	0.789	72%	0.717	S	S	*	*			trans	-128.6	119.5	169.1	-71.9	-168.5	-175.5	-178.3	3.8	110.3	E93 C97	E93-R95 PolarHBondContact O-N 2.95Å; E93-R95 VanDerWaalsContact O-N 3.09Å; R95-C97 PolarHBondContact O-N 3.45Å
96	Q	23.8	Very low	25.6	Very low	199 Å²	199	131.7 Å²	131.7	93%	0.93	71%	0.71	S	S	*	*			trans	-41.5	121.9	169.1	-71.4	167.8	-21.9	0	0	110.4	S98	Q96-S98 PolarHBondContact O-N 2.93Å
97	C	24	Very low	25.7	Very low	135 Å²	135	132.4 Å²	132.4	91%	0.912	71%	0.709	S	S	*	*			trans	-69.4	112.8	179.4	-77.4	0	0	0	0	110.2	R95	R95-C97 PolarHBondContact O-N 3.45Å
98	S	24.8	Very low	25.7	Very low	89 Å²	89	130.3 Å²	130.3	62%	0.622	71%	0.711	S	S	*	*			trans	-73.2	151.4	164.5	57	0	0	0	0	110.1	Q96 E100	Q96-S98 PolarHBondContact O-N 2.93Å; S98-E100 PolarHBondContact O-N 3.19Å
99	P	27.2	Very low	25.7	Very low	121 Å²	121	136.3 Å²	136.3	79%	0.786	72%	0.716	S	S	*	*	S	Bend	trans	-79.1	28.2	-168	29.6	-28.6	0	0	0	114.3
100	E	24.7	Very low	25.8	Very low	103 Å²	103	137.4 Å²	137.4	48%	0.481	72%	0.717	S	S	.	*			trans	-130.9	99.7	-172.8	-65.3	-174.3	162.9	0	0	111.3	S98	S98-E100 PolarHBondContact O-N 3.19Å
101	A	26.3	Very low	25.9	Very low	68 Å²	68	132.9 Å²	132.9	56%	0.562	71%	0.712	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.9	114.3	164.9	0	0	0	0	0	108.8
102	R	27.7	Very low	25.9	Very low	196 Å²	196	132.5 Å²	132.5	74%	0.74	70%	0.704	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.2	123	172.4	-76.9	180	169.5	179	-3.8	109.5
103	I	26.7	Very low	26	Very low	81 Å²	81	132.7 Å²	132.7	42%	0.415	70%	0.701	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109	119.2	170.2	-56.7	173.9	0	0	0	107.1	F105 V137	I103-F105 HydrophobicContact CB-CE2 4.4Å; I103-F105 HydrophobicContact CG2-CD2 4.47Å; I103-F105 HydrophobicContact CG2-CE1 4.15Å; I103-F105 HydrophobicContact CG2-CE2 3.84Å; I103-F105 HydrophobicContact CG2-CZ 3.65Å; I103-V137 HydrophobicContact CD1-CG2 4.48Å
104	S	26.5	Very low	26.1	Very low	84 Å²	84	131.3 Å²	131.3	59%	0.587	70%	0.704	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99	125	177	-57.7	0	0	0	0	109.5
105	F	27.7	Very low	26.3	Very low	79 Å²	79	131.3 Å²	131.3	35%	0.346	70%	0.703	S	S	.	*			trans	-98.7	138.8	172.6	-61.2	-83.5	0	0	0	110.2	I103 F107 C135	I103-F105 HydrophobicContact CB-CE2 4.4Å; I103-F105 HydrophobicContact CG2-CD2 4.47Å; I103-F105 HydrophobicContact CG2-CE1 4.15Å; I103-F105 HydrophobicContact CG2-CE2 3.84Å; I103-F105 HydrophobicContact CG2-CZ 3.65Å; F105-F107 HydrophobicContact CB-CE2 3.86Å; F105-F107 HydrophobicContact CB-CZ 4.24Å; F105-C135 HydrophobicContact CE2-CB 4.34Å
106	H	25.7	Very low	26.6	Very low	135 Å²	135	126.4 Å²	126.4	63%	0.625	70%	0.701	S	S	*	*			trans	-116.3	117	170.6	-78.1	-35	0	0	0	109
107	F	27.1	Very low	26.7	Very low	155 Å²	155	120.6 Å²	120.6	68%	0.68	70%	0.695	S	S	*	*			trans	-101.5	118.6	171.7	-62.6	-78.3	0	0	0	109	F105	F105-F107 HydrophobicContact CB-CE2 3.86Å; F105-F107 HydrophobicContact CB-CZ 4.24Å
108	A	25.3	Very low	26.8	Very low	99 Å²	99	121.8 Å²	121.8	82%	0.818	69%	0.692	S	S	*	*			trans	-76.6	127.1	163.7	0	0	0	0	0	107.9
109	K	27	Very low	26.9	Very low	200 Å²	200	125.4 Å²	125.4	87%	0.87	70%	0.699	S	S	*	*			trans	-103.5	106.2	176.8	-168.3	-178.4	-176.3	-176.7	0	108.4	S111	K109-S111 PolarHBondContact O-N 2.88Å
110	D	26.7	Very low	26.8	Very low	147 Å²	147	126.7 Å²	126.7	79%	0.786	70%	0.699	S	S	*	*			trans	-67.9	118.5	168.1	-72.8	-24.9	0	0	0	109	V112	D110-V112 PolarHBondContact O-N 3.37Å
111	S	27	Very low	27	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	72%	0.719	S	S	*	*			trans	-77	99	172.1	48.2	0	0	0	0	108.7	K109 T113	K109-S111 PolarHBondContact O-N 2.88Å; S111-T113 PolarHBondContact O-N 3.32Å
112	V	27.8	Very low	27	Very low	104 Å²	104	132.1 Å²	132.1	63%	0.63	73%	0.728	S	S	*	*			trans	-81.8	101.7	166.8	-178	0	0	0	0	107.4	D110 T114	D110-V112 PolarHBondContact O-N 3.37Å; V112-T114 PolarHBondContact O-N 2.91Å
113	T	28.2	Very low	26.9	Very low	113 Å²	113	132.2 Å²	132.2	69%	0.693	73%	0.734	S	S	*	*			trans	-57.8	123.1	166.8	34.9	0	0	0	0	109.3	S111	S111-T113 PolarHBondContact O-N 3.32Å
114	T	28.5	Very low	26.9	Very low	128 Å²	128	137 Å²	137	79%	0.785	76%	0.755	S	S	*	*			trans	-69.4	128.7	168.9	37.1	0	0	0	0	109.3	V112 S116	V112-T114 PolarHBondContact O-N 2.91Å; T114-S116 PolarHBondContact O-N 2.84Å; T114-S116 VanDerWaalsContact O-N 3.16Å
115	E	27.1	Very low	26.9	Very low	203 Å²	203	139.2 Å²	139.2	95%	0.949	77%	0.767	S	S	*	*			trans	-39.5	111.4	173.3	-64.5	169.2	161.3	0	0	112.4
116	S	28.3	Very low	26.7	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	78%	0.784	S	S	*	*			trans	-132.9	118.5	152.4	61.4	0	0	0	0	106.5	T114 N118	T114-S116 PolarHBondContact O-N 2.84Å; T114-S116 VanDerWaalsContact O-N 3.16Å; S116-N118 PolarHBondContact O-N 3.26Å
117	G	26.5	Very low	26.7	Very low	77 Å²	77	138.6 Å²	138.6	79%	0.794	79%	0.793	S	S	*	*			trans	-53.5	120.5	179.2	0	0	0	0	0	111.1
118	N	26.7	Very low	26.5	Very low	159 Å²	159	137.4 Å²	137.4	85%	0.85	80%	0.802	S	S	*	*				-167.9	140.9	129.2	-105.1	-13	0	0	0	109.7	S116	S116-N118 PolarHBondContact O-N 3.26Å
119	E	25.5	Very low	26.5	Very low	165 Å²	165	138.3 Å²	138.3	77%	0.771	80%	0.797	S	S	*	*			trans	-40.1	139.6	176.3	-61.1	170.7	166.4	0	0	114
120	N	26.8	Very low	26.4	Very low	148 Å²	148	133.4 Å²	133.4	79%	0.791	78%	0.784	S	S	*	*			trans	51.3	97	154.7	-61	-30.8	0	0	0	117.4
121	L	27.6	Very low	26.4	Very low	170 Å²	170	132 Å²	132	89%	0.89	78%	0.776	S	S	*	*			trans	-159.9	144.9	146.3	-93.3	134.1	0	0	0	111.1
122	P	27.6	Very low	26.3	Very low	116 Å²	116	131 Å²	131	75%	0.753	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-80.7	145.8	-172.7	33.8	-30	0	0	0	111.5	E124	P122-E124 PolarHBondContact O-N 2.87Å
123	F	23.8	Very low	26.2	Very low	197 Å²	197	132.2 Å²	132.2	86%	0.864	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-58.2	121.5	179.5	-79	-98.2	0	0	0	112.6
124	E	27	Very low	26.1	Very low	182 Å²	182	131 Å²	131	85%	0.85	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-87.6	145.5	160.3	-88.8	-165.7	156.7	0	0	111.2	P122 G126	P122-E124 PolarHBondContact O-N 2.87Å; E124-G126 PolarHBondContact O-N 3.35Å
125	P	26.3	Very low	26	Very low	131 Å²	131	128.4 Å²	128.4	85%	0.851	74%	0.742	S	S	*	*			trans	-79.6	103.3	-173.6	30.1	-28.4	0	0	0	111.7
126	G	24.5	Very low	25.9	Very low	68 Å²	68	122.9 Å²	122.9	70%	0.701	72%	0.722	S	S	*	*			trans	-86.2	111.6	179.4	0	0	0	0	0	114.5	E124	E124-G126 PolarHBondContact O-N 3.35Å
127	T	24.7	Very low	25.8	Very low	133 Å²	133	121.7 Å²	121.7	82%	0.816	71%	0.71	S	S	*	*			trans	10.5	114.4	157.4	50.7	0	0	0	0	120.3	V129	T127-V129 PolarHBondContact O-N 3.42Å
128	C	23.6	Very low	25.8	Very low	129 Å²	129	125.6 Å²	125.6	87%	0.872	70%	0.701	S	S	*	*			trans	-70.9	118.4	164.1	-88.6	0	0	0	0	111.3
129	V	24.9	Very low	25.8	Very low	118 Å²	118	127.2 Å²	127.2	72%	0.715	70%	0.695	S	S	*	*			trans	-92.5	108.6	165.7	-179.9	0	0	0	0	108.4	T127 I131	T127-V129 PolarHBondContact O-N 3.42Å; V129-I131 HydrophobicContact CG1-CG1 4.36Å; V129-I131 PolarHBondContact O-N 3.28Å
130	T	26.1	Very low	26	Very low	97 Å²	97	126 Å²	126	60%	0.595	69%	0.689	S	S	*	*			trans	-77.5	107.5	176.1	-33.7	0	0	0	0	109.6	V132	T130-V132 HydrophobicContact CG2-CG2 4.19Å
131	I	25.3	Very low	26.1	Very low	119 Å²	119	128.2 Å²	128.2	61%	0.61	70%	0.695	S	S	*	*			trans	-94	110.3	168.4	-56.2	176.5	0	0	0	107.1	V129 E133	V129-I131 HydrophobicContact CG1-CG1 4.36Å; V129-I131 PolarHBondContact O-N 3.28Å; I131-E133 HydrophobicContact CG2-CG 4.36Å
132	V	25.4	Very low	26	Very low	86 Å²	86	125.1 Å²	125.1	52%	0.521	69%	0.694	S	S	.	*			trans	-93.3	97.8	174.4	-178.7	0	0	0	0	108	T130	T130-V132 HydrophobicContact CG2-CG2 4.19Å
133	E	26.4	Very low	26	Very low	131 Å²	131	125.3 Å²	125.3	61%	0.612	69%	0.688	S	S	*	*			trans	-85.8	120.1	164.5	-79.8	-173.8	160.9	0	0	109.1	I131	I131-E133 HydrophobicContact CG2-CG 4.36Å
134	T	26.3	Very low	26.1	Very low	88 Å²	88	118.8 Å²	118.8	54%	0.54	67%	0.667	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.3	108.3	-179.5	-26.7	0	0	0	0	108.6
135	C	25.9	Very low	26.1	Very low	73 Å²	73	113.5 Å²	113.5	49%	0.493	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.4	119.9	173.6	-133.3	0	0	0	0	109.3	F105	F105-C135 HydrophobicContact CE2-CB 4.34Å
136	V	25	Very low	26.1	Very low	86 Å²	86	114.5 Å²	114.5	52%	0.521	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.8	104	178.6	179.9	0	0	0	0	108.7	R138	V136-R138 HydrophobicContact CG1-CG 4.26Å
137	V	26	Very low	26.3	Very low	83 Å²	83	115 Å²	115	50%	0.503	63%	0.634	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.1	111	172.7	-175	0	0	0	0	108.4	I103	I103-V137 HydrophobicContact CD1-CG2 4.48Å
138	R	26.2	Very low	26.4	Very low	159 Å²	159	111 Å²	111	60%	0.6	61%	0.61	S	S	*	*			trans	-94.3	113.9	171.1	-74.2	-165.3	-179.8	170.9	-5.6	109.5	V136	V136-R138 HydrophobicContact CG1-CG 4.26Å
139	R	27.1	Very low	26.6	Very low	193 Å²	193	110.2 Å²	110.2	73%	0.728	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-72	134.5	172.1	-82.1	-176.8	168.2	178.5	-5.3	111.3
140	Q	29.4	Very low	26.8	Very low	139 Å²	139	111.1 Å²	111.1	65%	0.65	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-86.7	155.2	152	-86	-179.4	-22.6	0	0	109.5
141	Q	28.3	Very low	27	Very low	195 Å²	195	112.1 Å²	112.1	91%	0.911	59%	0.591	S	S	*	*	S	Bend	trans	-61.1	144.2	-167	-72.5	167.3	-33.6	0	0	114.1
142	A	26.6	Very low	27.2	Very low	105 Å²	105	109.5 Å²	109.5	87%	0.868	59%	0.587	S	S	*	*			trans	64	66.6	162.1	0	0	0	0	0	118.6
143	L	26.8	Very low	27.4	Very low	119 Å²	119	109.5 Å²	109.5	62%	0.623	59%	0.587	S	S	*	*			trans	-122.2	129.7	155.2	-79.2	157.3	0	0	0	108.5	L147	L143-L147 HydrophobicContact CD2-CD1 3.95Å
144	S	26.6	Very low	27.6	Very low	61 Å²	61	111.4 Å²	111.4	43%	0.427	59%	0.593	S	S	.	*			trans	-57.9	146.2	-178.8	62.9	0	0	0	0	110.7	E146 L147	S144-E146 PolarHBondContact O-N 3.1Å; S144-L147 PolarHBondContact O-N 3.43Å; S144-L147 VanDerWaalsContact O-N 3.12Å
145	A	26.7	Very low	27.8	Very low	70 Å²	70	114.1 Å²	114.1	58%	0.579	59%	0.594	S	S	*	*	H	α-helix	trans	-57.1	-19.9	-178.4	0	0	0	0	0	113.6
146	E	26.8	Very low	28.1	Very low	153 Å²	153	114 Å²	114	72%	0.715	60%	0.595	S	S	*	*	H	α-helix	trans	-73.6	-36.4	179.4	-69.4	167.8	159.8	0	0	112.7	S144 I149 E150	S144-E146 PolarHBondContact O-N 3.1Å; E146-I149 PolarHBondContact O-N 3.49Å; E146-E150 PolarHBondContact O-N 2.98Å
147	L	28.6	Very low	28.3	Very low	79 Å²	79	113.8 Å²	113.8	41%	0.414	60%	0.597	S	S	.	*	H	α-helix	trans	-71.6	-30.4	177.5	-83.1	156.4	0	0	0	112.6	L143 S144 I149 E150 E151	L143-L147 HydrophobicContact CD2-CD1 3.95Å; S144-L147 PolarHBondContact O-N 3.43Å; S144-L147 VanDerWaalsContact O-N 3.12Å; L147-I149 VanDerWaalsContact C-N 3.25Å; L147-I149 PolarHBondContact O-N 3.05Å; L147-E150 PolarHBondContact O-N 2.97Å; L147-E151 PolarHBondContact O-N 3.06Å
148	C	27.3	Very low	28.4	Very low	47 Å²	47	117 Å²	117	32%	0.318	61%	0.612	S	S	.	*	H	α-helix	trans	-66.4	-26.1	173.7	-77.3	0	0	0	0	113.1	A152	C148-A152 VanDerWaalsContact O-CB 3.26Å; C148-A152 WeakPolarHBondContact O-CB 3.49Å; C148-A152 PolarHBondContact O-N 3.34Å
149	I	27.7	Very low	28.5	Very low	113 Å²	113	115.9 Å²	115.9	58%	0.579	61%	0.613	S	S	*	*	H	α-helix	trans	-81.1	-39	178.8	-61.9	169.6	0	0	0	109.6	E146 L147 A152 V153	E146-I149 PolarHBondContact O-N 3.49Å; L147-I149 VanDerWaalsContact C-N 3.25Å; L147-I149 PolarHBondContact O-N 3.05Å; I149-A152 PolarHBondContact O-N 3.02Å; I149-V153 HydrophobicContact CG2-CG2 4.44Å; I149-V153 WeakPolarHBondContact O-CB 3.5Å; I149-V153 WeakPolarHBondContact O-CG2 3.38Å; I149-V153 PolarHBondContact O-N 3.44Å
150	E	28.9	Very low	28.4	Very low	138 Å²	138	112.1 Å²	112.1	65%	0.645	61%	0.611	S	S	*	*	H	α-helix	trans	-67.3	-39.7	175	-78.2	-170.7	149.9	0	0	113.2	E146 L147 V153 K154	E146-E150 PolarHBondContact O-N 2.98Å; L147-E150 PolarHBondContact O-N 2.97Å; E150-V153 PolarHBondContact O-N 2.85Å; E150-K154 PolarHBondContact O-N 3.5Å
151	E	29.2	Very low	28.2	Very low	117 Å²	117	110.5 Å²	110.5	55%	0.547	61%	0.611	S	S	.	*	H	α-helix	trans	-66.3	-44.2	173.8	-82.6	-168	145.8	0	0	111.7	L147 V153 K154 Y155	L147-E151 PolarHBondContact O-N 3.06Å; E151-V153 VanDerWaalsContact C-N 3.28Å; E151-V153 PolarHBondContact O-N 2.89Å; E151-K154 WeakPolarHBondContact O-CB 3.35Å; E151-K154 PolarHBondContact O-N 3.49Å; E151-K154 VanDerWaalsContact O-N 3.16Å; E151-Y155 WeakPolarHBondContact O-CD2 3.41Å; E151-Y155 PolarHBondContact O-N 3.19Å
152	A	29.3	Very low	28.1	Very low	64 Å²	64	111.3 Å²	111.3	53%	0.529	61%	0.611	S	S	.	*	H	α-helix	trans	-64.5	-29.8	178.1	0	0	0	0	0	113.3	C148 I149 S156	C148-A152 VanDerWaalsContact O-CB 3.26Å; C148-A152 WeakPolarHBondContact O-CB 3.49Å; C148-A152 PolarHBondContact O-N 3.34Å; I149-A152 PolarHBondContact O-N 3.02Å; A152-S156 PolarHBondContact O-N 3.15Å
153	V	29.5	Very low	28	Very low	87 Å²	87	113.8 Å²	113.8	53%	0.527	61%	0.609	S	S	.	*	H	α-helix	trans	-80.1	-27.6	175.1	173.2	0	0	0	0	112.2	I149 E150 E151 S156	I149-V153 HydrophobicContact CG2-CG2 4.44Å; I149-V153 WeakPolarHBondContact O-CB 3.5Å; I149-V153 WeakPolarHBondContact O-CG2 3.38Å; I149-V153 PolarHBondContact O-N 3.44Å; E150-V153 PolarHBondContact O-N 2.85Å; E151-V153 VanDerWaalsContact C-N 3.28Å; E151-V153 PolarHBondContact O-N 2.89Å; V153-S156 WeakPolarHBondContact CA-OG 3.31Å; V153-S156 PolarHBondContact O-N 3.43Å; V153-S156 PolarHBondContact O-OG 3.36Å
154	K	31	Very low	27.8	Very low	170 Å²	170	117.9 Å²	117.9	74%	0.739	62%	0.622	S	S	*	*	H	α-helix	trans	-66.1	-37	170.6	-104.4	177.4	176.5	172.8	0	112.7	E150 E151 S156	E150-K154 PolarHBondContact O-N 3.5Å; E151-K154 WeakPolarHBondContact O-CB 3.35Å; E151-K154 PolarHBondContact O-N 3.49Å; E151-K154 VanDerWaalsContact O-N 3.16Å; K154-S156 VanDerWaalsContact C-N 3.34Å
155	Y	30.8	Very low	27.6	Very low	145 Å²	145	124.2 Å²	124.2	57%	0.569	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-11.5	177.8	-75.8	-75	0	0	0	114	E151	E151-Y155 WeakPolarHBondContact O-CD2 3.41Å; E151-Y155 PolarHBondContact O-N 3.19Å
156	S	31.7	Very low	27.6	Very low	72 Å²	72	131 Å²	131	50%	0.503	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.7	-6.3	-174.8	67.7	0	0	0	0	115.4	A152 V153 K154	A152-S156 PolarHBondContact O-N 3.15Å; V153-S156 WeakPolarHBondContact CA-OG 3.31Å; V153-S156 PolarHBondContact O-N 3.43Å; V153-S156 PolarHBondContact O-OG 3.36Å; K154-S156 VanDerWaalsContact C-N 3.34Å
157	S	29.8	Very low	27.4	Very low	81 Å²	81	130.8 Å²	130.8	57%	0.566	66%	0.656	S	S	*	*	S	Bend	trans	-118.3	-14.3	-172.3	50.5	0	0	0	0	116.1
158	N	28.6	Very low	27.2	Very low	151 Å²	151	132.6 Å²	132.6	81%	0.807	68%	0.675	S	S	*	*	S	Bend	trans	-128.6	-1	-176.2	-81.2	-28.8	0	0	0	116.2
159	E	28.7	Very low	27	Very low	135 Å²	135	135.7 Å²	135.7	63%	0.631	69%	0.692	S	S	*	*			trans	-128.1	50	-179.6	-69	-170.6	151.5	0	0	112.6	V161	E159-V161 VanDerWaalsContact C-N 3.28Å; E159-V161 PolarHBondContact O-N 2.81Å
160	V	24.4	Very low	26.9	Very low	113 Å²	113	139.7 Å²	139.7	69%	0.685	71%	0.708	S	S	*	*			trans	-79	83.3	165.5	-176.4	0	0	0	0	109.3	K162	V160-K162 PolarHBondContact O-N 3.28Å
161	V	26	Very low	26.6	Very low	106 Å²	106	143 Å²	143	64%	0.642	72%	0.716	S	S	*	*			trans	27.4	90.7	140.7	-172.7	0	0	0	0	116.4	E159 L163	E159-V161 VanDerWaalsContact C-N 3.28Å; E159-V161 PolarHBondContact O-N 2.81Å; V161-L163 VanDerWaalsContact C-N 3.29Å; V161-L163 HydrophobicContact CG1-CB 3.76Å; V161-L163 HydrophobicContact CG1-CD1 3.6Å; V161-L163 HydrophobicContact CG1-CG 3.76Å; V161-L163 PolarHBondContact O-N 2.74Å
162	K	25.4	Very low	26.4	Very low	212 Å²	212	143.1 Å²	143.1	92%	0.922	73%	0.726	S	S	*	*			trans	-82.6	69.7	154.9	-90.8	179.1	178.8	169.2	0	110.2	V160 K164	V160-K162 PolarHBondContact O-N 3.28Å; K162-K164 PolarHBondContact O-N 3.15Å
163	L	23.5	Very low	26.1	Very low	157 Å²	157	145 Å²	145	82%	0.822	74%	0.735	S	S	*	*			trans	-85.9	84.1	163.6	-88.9	164.3	0	0	0	109.5	V161	V161-L163 VanDerWaalsContact C-N 3.29Å; V161-L163 HydrophobicContact CG1-CB 3.76Å; V161-L163 HydrophobicContact CG1-CD1 3.6Å; V161-L163 HydrophobicContact CG1-CG 3.76Å; V161-L163 PolarHBondContact O-N 2.74Å
164	K	24.2	Very low	25.9	Very low	204 Å²	204	147.5 Å²	147.5	89%	0.887	75%	0.75	S	S	*	*			trans	-91.8	106.9	164.7	-94.1	-172.9	175.3	-178.6	0	110.1	K162	K162-K164 PolarHBondContact O-N 3.15Å
165	R	22.7	Very low	25.5	Very low	195 Å²	195	142.2 Å²	142.2	74%	0.736	74%	0.744	S	S	*	*			trans	6.4	124.8	157.8	-68.2	177	175.6	173.4	-3	118.3
166	K	25.4	Very low	25.2	Very low	211 Å²	211	140.5 Å²	140.5	92%	0.917	75%	0.753	S	S	*	*				-145.1	108.5	128.4	-109.2	-179.6	-177.9	177.4	0	109.7
167	L	22.9	Very low	24.9	Very low	149 Å²	149	143.6 Å²	143.6	78%	0.78	77%	0.769	S	S	*	*			trans	-63.1	131.2	169.7	-84.8	123	0	0	0	110	V169	L167-V169 HydrophobicContact CD2-CG2 4.3Å
168	S	25.4	Very low	24.6	Very low	118 Å²	118	144.2 Å²	144.2	83%	0.825	78%	0.779	S	S	*	*			trans	-142.4	100.9	145.6	51.6	0	0	0	0	108.1
169	V	22.5	Very low	24.4	Very low	112 Å²	112	141.4 Å²	141.4	68%	0.679	78%	0.777	S	S	*	*			trans	-58.7	125.7	164.6	172.1	0	0	0	0	108.3	L167	L167-V169 HydrophobicContact CD2-CG2 4.3Å
170	E	24.5	Very low	24.2	Very low	196 Å²	196	142.4 Å²	142.4	92%	0.916	79%	0.787	S	S	*	*			trans	-151	102.4	145.5	-111.5	172.2	-157.6	0	0	107.5
171	Y	22.5	Very low	24.4	Very low	207 Å²	207	143.8 Å²	143.8	81%	0.812	80%	0.795	S	S	*	*			trans	-83.5	164	171.4	-113.1	-94.5	0	0	0	109.9
172	T	25.2	Very low	24.3	Very low	121 Å²	121	145.3 Å²	145.3	74%	0.742	80%	0.8	S	S	*	*			trans	89.1	95.9	172.6	70.1	0	0	0	0	114.1
173	S	22.8	Very low	24.3	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	79%	0.794	S	S	*	*				39.7	114.6	73.4	80.3	0	0	0	0	111.2
174	V	25.5	Very low	24.3	Very low	138 Å²	138	141 Å²	141	84%	0.836	79%	0.79	S	S	*	*				-168.9	126.3	78.7	169.6	0	0	0	0	104.5
175	G	24.1	Very low	24.4	Very low	60 Å²	60	136.5 Å²	136.5	62%	0.619	78%	0.783	S	S	*	*				90.6	107	85.7	0	0	0	0	0	112.1
176	S	23	Very low	24.7	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	79%	0.789	S	S	*	*			trans	44.4	125.5	142.7	56.4	0	0	0	0	121.7
177	T	26.6	Very low	24.6	Very low	136 Å²	136	129.2 Å²	129.2	83%	0.834	79%	0.79	S	S	*	*			trans	140.2	108.5	137.5	47.9	0	0	0	0	109
178	A	23.3	Very low	24.9	Very low	94 Å²	94	126.2 Å²	126.2	78%	0.777	79%	0.787	S	S	*	*				60.1	121.7	71.4	0	0	0	0	0	113.8
179	A	24.2	Very low	24.9	Very low	93 Å²	93	126.5 Å²	126.5	77%	0.769	79%	0.789	S	S	*	*			trans	82.2	122.7	162	0	0	0	0	0	118.8
180	N	24	Very low	25.3	Very low	155 Å²	155	125 Å²	125	83%	0.829	78%	0.784	S	S	*	*			trans	42.7	126.2	140.7	-62.9	-7.6	0	0	0	118.6
181	V	28.4	Very low	25.4	Very low	143 Å²	143	120.7 Å²	120.7	87%	0.867	78%	0.781	S	S	*	*				-175.8	134.3	110.1	153.7	0	0	0	0	108
182	D	23.5	Very low	25.9	Very low	138 Å²	138	118.5 Å²	118.5	74%	0.738	78%	0.784	S	S	*	*			trans	-57.8	160.6	178.3	-80.8	-50.1	0	0	0	115.3
183	E	25.7	Very low	26.3	Very low	171 Å²	171	123.2 Å²	123.2	80%	0.799	79%	0.788	S	S	*	*			trans	63.2	127.7	141.8	-75.2	179.3	173.1	0	0	121.9
184	C	24.3	Very low	26.9	Very low	108 Å²	108	121.6 Å²	121.6	73%	0.73	79%	0.787	S	S	*	*			trans	71	124.3	139.6	-75.8	0	0	0	0	120.3
185	S	26.1	Very low	27.5	Very low	108 Å²	108	121.4 Å²	121.4	76%	0.755	78%	0.781	S	S	*	*			trans	63.6	98.7	143.5	46.3	0	0	0	0	117.1
186	T	28.2	Very low	28.3	Very low	140 Å²	140	121.2 Å²	121.2	86%	0.859	77%	0.769	S	S	*	*				-160.7	103.1	127.7	19.3	0	0	0	0	108.4	A188	T186-A188 PolarHBondContact O-N 2.7Å; T186-A188 VanDerWaalsContact O-N 3.13Å
187	A	24.6	Very low	29.4	Very low	114 Å²	114	120.5 Å²	120.5	94%	0.942	76%	0.761	S	S	*	*			trans	-61.1	108.9	156.7	0	0	0	0	0	107.2
188	A	27.9	Very low	30.5	Very low	85 Å²	85	123.6 Å²	123.6	70%	0.702	76%	0.758	S	S	*	*			trans	-119.4	119.4	169.5	0	0	0	0	0	108.8	T186	T186-A188 PolarHBondContact O-N 2.7Å; T186-A188 VanDerWaalsContact O-N 3.13Å
189	S	25.5	Very low	32.1	Very low	124 Å²	124	121.2 Å²	121.2	87%	0.867	73%	0.734	S	S	*	*			trans	-48.4	127.7	178.2	56.6	0	0	0	0	113.6
190	S	31.6	Very low	33.5	Very low	82 Å²	82	121.8 Å²	121.8	57%	0.573	72%	0.72	S	S	*	*			trans	-153.9	64.8	152.7	48.4	0	0	0	0	110.2	D192	S190-D192 PolarHBondContact O-N 3.19Å
191	A	27.3	Very low	35.2	Very low	104 Å²	104	119.2 Å²	119.2	86%	0.86	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	85.7	156.8	0	0	0	0	0	108.2
192	D	31.4	Very low	36.8	Very low	162 Å²	162	117.5 Å²	117.5	87%	0.866	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.4	16.2	149.8	-121.6	-10.4	0	0	0	114.6	S190 G194	S190-D192 PolarHBondContact O-N 3.19Å; D192-G194 PolarHBondContact O-N 3.46Å
193	R	33.9	Very low	38.5	Very low	220 Å²	220	115.4 Å²	115.4	83%	0.83	66%	0.658	S	S	*	*			trans	-90.2	102.2	178.1	-67	-170.8	-176.8	-176.2	3.1	109.5
194	G	35.9	Very low	40.3	Very low	69 Å²	69	113.6 Å²	113.6	71%	0.711	65%	0.647	S	S	*	*			trans	-40.1	144.9	174.7	0	0	0	0	0	113	D192 P196	D192-G194 PolarHBondContact O-N 3.46Å; G194-P196 VanDerWaalsContact O-N 3.17Å
195	L	38.8	Very low	42.1	Very low	135 Å²	135	113.2 Å²	113.2	71%	0.707	64%	0.636	S	S	*	*			trans	-36.9	119.7	176.1	-74.2	-179.4	0	0	0	110.7	R201	L195-R201 VanDerWaalsContact CG-NH2 3.3Å
196	P	40.2	Very low	43.8	Very low	56 Å²	56	108.1 Å²	108.1	36%	0.364	60%	0.6	S	S	.	*			trans	-52	143.3	-178.9	14.2	-30.8	0	0	0	110.6	G194 R198 F200 R201	G194-P196 VanDerWaalsContact O-N 3.17Å; P196-R198 PolarHBondContact O-N 3.11Å; P196-F200 HydrophobicContact CB-CB 4.3Å; P196-F200 HydrophobicContact CB-CD1 3.83Å; P196-F200 HydrophobicContact CB-CG 4.37Å; P196-F200 HydrophobicContact CG-CD1 4.35Å; P196-R201 VanDerWaalsContact CD-NH2 3.34Å; P196-R201 HydrophobicContact CG-CG 4.1Å; P196-R201 WeakPolarHBondContact O-CD 3.42Å; P196-R201 WeakPolarHBondContact O-CG 3.32Å; P196-R201 PolarHBondContact O-NE 3.34Å
197	P	45	Very low	45.4	Very low	93 Å²	93	103.6 Å²	103.6	60%	0.604	58%	0.575	S	S	*	*			trans	-52	141.9	-174.2	18.5	-30.6	0	0	0	110.8	P199 F200 R201	P197-P199 WeakPolarHBondContact O-CD 3.3Å; P197-F200 WeakPolarHBondContact O-CB 3.36Å; P197-F200 PolarHBondContact O-N 3.37Å; P197-R201 PolarHBondContact O-N 3.47Å
198	R	51	Low	47.2	Very low	202 Å²	202	102.7 Å²	102.7	76%	0.762	55%	0.553	S	S	*	*	H	α-helix	trans	-43.7	-39.6	-173.4	-73.5	-175.9	177.9	-176.1	-0.2	114.7	P196 F200 R201 R202	P196-R198 PolarHBondContact O-N 3.11Å; R198-F200 VanDerWaalsContact C-N 3.33Å; R198-F200 PolarHBondContact O-N 3.47Å; R198-R201 PolarHBondContact O-N 2.84Å; R198-R202 WeakPolarHBondContact O-CG 2.95Å; R198-R202 PolarHBondContact O-N 2.8Å; R198-R202 VanDerWaalsContact O-N 3.09Å
199	P	55.7	Low	48.8	Very low	43 Å²	43	100.2 Å²	100.2	28%	0.279	53%	0.528	S	S	.	.	H	α-helix	trans	-60.1	-36.9	175.7	-25.9	35.9	0	0	0	114.3	P197 R203 E237	P197-P199 WeakPolarHBondContact O-CD 3.3Å; P199-R203 WeakPolarHBondContact O-CB 3.35Å; P199-R203 VanDerWaalsContact O-CG 3.32Å; P199-R203 WeakPolarHBondContact O-CG 3.38Å; P199-R203 PolarHBondContact O-N 2.87Å; P199-R203 PolarHBondContact O-NE 3.06Å; P199-E237 WeakPolarHBondContact CB-OE1 3.25Å
200	F	54.4	Low	50.4	Low	106 Å²	106	94.8 Å²	94.8	47%	0.465	49%	0.49	S	S	.	.	H	α-helix	trans	-71.6	-39.4	-179.6	-169.6	-91.2	0	0	0	111.5	P196 P197 R198 R203 K204	P196-F200 HydrophobicContact CB-CB 4.3Å; P196-F200 HydrophobicContact CB-CD1 3.83Å; P196-F200 HydrophobicContact CB-CG 4.37Å; P196-F200 HydrophobicContact CG-CD1 4.35Å; P197-F200 WeakPolarHBondContact O-CB 3.36Å; P197-F200 PolarHBondContact O-N 3.37Å; R198-F200 VanDerWaalsContact C-N 3.33Å; R198-F200 PolarHBondContact O-N 3.47Å; F200-R203 PolarHBondContact O-N 2.86Å; F200-K204 HydrophobicContact CE1-CD 4.38Å; F200-K204 WeakPolarHBondContact O-CB 3.38Å; F200-K204 PolarHBondContact O-N 2.65Å
201	R	59.6	Low	51.8	Low	101 Å²	101	94.9 Å²	94.9	38%	0.381	48%	0.484	S	S	.	.	H	α-helix	trans	-62	-46.4	174.1	-64.4	173.6	-176.9	-114.9	-50.2	111.7	L195 P196 P197 R198 K204 M205	L195-R201 VanDerWaalsContact CG-NH2 3.3Å; P196-R201 VanDerWaalsContact CD-NH2 3.34Å; P196-R201 HydrophobicContact CG-CG 4.1Å; P196-R201 WeakPolarHBondContact O-CD 3.42Å; P196-R201 WeakPolarHBondContact O-CG 3.32Å; P196-R201 PolarHBondContact O-NE 3.34Å; P197-R201 PolarHBondContact O-N 3.47Å; R198-R201 PolarHBondContact O-N 2.84Å; R201-K204 PolarHBondContact O-N 3.04Å; R201-M205 VanDerWaalsContact O-CB 3.3Å; R201-M205 WeakPolarHBondContact O-CB 3.33Å; R201-M205 PolarHBondContact O-N 3Å
202	R	61.1	Low	53.2	Low	106 Å²	106	94 Å²	94	40%	0.4	46%	0.464	S	S	.	.	H	α-helix	trans	-58.5	-50	176.6	-74.2	-176.6	178.7	-175.3	2.7	110.7	R198 K204 M205 I206 D235	R198-R202 WeakPolarHBondContact O-CG 2.95Å; R198-R202 PolarHBondContact O-N 2.8Å; R198-R202 VanDerWaalsContact O-N 3.09Å; R202-K204 PolarHBondContact O-N 3.41Å; R202-M205 PolarHBondContact O-N 3.39Å; R202-I206 VanDerWaalsContact O-CG1 3.24Å; R202-I206 WeakPolarHBondContact O-CG1 3.32Å; R202-I206 PolarHBondContact O-N 3.29Å; R202-D235 IonicContact CZ-OD2 2.8Å; R202-D235 IonicContact NH1-OD1 2.61Å; R202-D235 IonicContact NH1-OD2 3.91Å; R202-D235 PolarHBondContact NH1-OD2 3.27Å
203	R	60.5	Low	54.3	Low	94 Å²	94	87.1 Å²	87.1	36%	0.355	43%	0.428	S	S	.	.	H	α-helix	trans	-57.9	-44.2	176.8	-76.4	-176.7	-80	176.2	-5.7	113.1	P199 F200 S207 V240 Q243	P199-R203 WeakPolarHBondContact O-CB 3.35Å; P199-R203 VanDerWaalsContact O-CG 3.32Å; P199-R203 WeakPolarHBondContact O-CG 3.38Å; P199-R203 PolarHBondContact O-N 2.87Å; P199-R203 PolarHBondContact O-NE 3.06Å; F200-R203 PolarHBondContact O-N 2.86Å; R203-S207 VanDerWaalsContact O-CB 3.31Å; R203-S207 WeakPolarHBondContact O-CB 3.41Å; R203-S207 PolarHBondContact O-N 2.9Å; R203-V240 HydrophobicContact CG-CG2 4.44Å; R203-Q243 PolarHBondContact O-OE1 3.36Å
204	K	62.3	Low	55.2	Low	133 Å²	133	82.8 Å²	82.8	58%	0.578	42%	0.415	S	S	*	.	H	α-helix	trans	-67.6	-39.3	178.3	-161.5	172	-175.4	178.5	0	111.8	F200 R201 R202 S207 L208	F200-K204 HydrophobicContact CE1-CD 4.38Å; F200-K204 WeakPolarHBondContact O-CB 3.38Å; F200-K204 PolarHBondContact O-N 2.65Å; R201-K204 PolarHBondContact O-N 3.04Å; R202-K204 PolarHBondContact O-N 3.41Å; K204-S207 PolarHBondContact O-N 3.4Å; K204-L208 WeakPolarHBondContact O-CB 3.36Å; K204-L208 VanDerWaalsContact O-CG 3.26Å; K204-L208 WeakPolarHBondContact O-CG 3.21Å; K204-L208 PolarHBondContact O-N 3.45Å
205	M	62.5	Low	56.1	Low	101 Å²	101	83.8 Å²	83.8	50%	0.498	41%	0.411	S	S	.	.	H	α-helix	trans	-64.7	-44.3	176.1	-170.6	177.4	77.3	0	0	111.8	R201 R202 L208 I209	R201-M205 VanDerWaalsContact O-CB 3.3Å; R201-M205 WeakPolarHBondContact O-CB 3.33Å; R201-M205 PolarHBondContact O-N 3Å; R202-M205 PolarHBondContact O-N 3.39Å; M205-L208 WeakPolarHBondContact O-CB 3.47Å; M205-L208 PolarHBondContact O-N 3.35Å; M205-I209 HydrophobicContact CG-CD1 4.44Å; M205-I209 WeakPolarHBondContact O-CG1 3.35Å; M205-I209 PolarHBondContact O-N 3.15Å
206	I	61.9	Low	56.5	Low	0 Å²	0	82.8 Å²	82.8	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-71	-37	178.5	-57.5	164.4	0	0	0	110.8	R202 L208 I209 S210 L229 L232 V240 Q243	R202-I206 VanDerWaalsContact O-CG1 3.24Å; R202-I206 WeakPolarHBondContact O-CG1 3.32Å; R202-I206 PolarHBondContact O-N 3.29Å; I206-L208 VanDerWaalsContact C-N 3.29Å; I206-L208 PolarHBondContact O-N 3.42Å; I206-I209 PolarHBondContact O-N 3.49Å; I206-S210 PolarHBondContact O-N 2.99Å; I206-L229 HydrophobicContact CG2-CD2 4.44Å; I206-L232 HydrophobicContact CD1-CD1 4.15Å; I206-L232 HydrophobicContact CG1-CD1 4.2Å; I206-V240 HydrophobicContact CD1-CB 4.23Å; I206-V240 HydrophobicContact CD1-CG1 3.54Å; I206-V240 HydrophobicContact CD1-CG2 4.36Å; I206-Q243 HydrophobicContact CB-CB 4.24Å; I206-Q243 HydrophobicContact CG2-CB 3.44Å; I206-Q243 VanDerWaalsContact CG2-CB 3.44Å
207	S	61.9	Low	57	Low	46 Å²	46	87.1 Å²	87.1	32%	0.322	42%	0.418	S	S	.	.	H	α-helix	trans	-61.8	-37.5	170.9	-175.6	0	0	0	0	112.2	R203 K204 S210 N211	R203-S207 VanDerWaalsContact O-CB 3.31Å; R203-S207 WeakPolarHBondContact O-CB 3.41Å; R203-S207 PolarHBondContact O-N 2.9Å; K204-S207 PolarHBondContact O-N 3.4Å; S207-S210 PolarHBondContact O-N 2.95Å; S207-N211 WeakPolarHBondContact O-CB 3.5Å; S207-N211 PolarHBondContact O-N 3.29Å; S207-N211 PolarHBondContact O-ND2 3.41Å
208	L	62.6	Low	57.2	Low	95 Å²	95	84 Å²	84	50%	0.497	40%	0.398	S	S	.	.	H	α-helix	trans	-65.3	-45.5	173.3	-77.7	165.2	0	0	0	110.9	K204 M205 I206 S210 N211 I212	K204-L208 WeakPolarHBondContact O-CB 3.36Å; K204-L208 VanDerWaalsContact O-CG 3.26Å; K204-L208 WeakPolarHBondContact O-CG 3.21Å; K204-L208 PolarHBondContact O-N 3.45Å; M205-L208 WeakPolarHBondContact O-CB 3.47Å; M205-L208 PolarHBondContact O-N 3.35Å; I206-L208 VanDerWaalsContact C-N 3.29Å; I206-L208 PolarHBondContact O-N 3.42Å; L208-S210 PolarHBondContact O-N 2.05Å; L208-N211 PolarHBondContact O-N 2.76Å; L208-I212 WeakPolarHBondContact O-CB 3.39Å; L208-I212 WeakPolarHBondContact O-CD1 3.17Å; L208-I212 WeakPolarHBondContact O-CG1 3.39Å; L208-I212 PolarHBondContact O-N 3.31Å
209	I	61.1	Low	57.1	Low	33 Å²	33	79.1 Å²	79.1	17%	0.169	39%	0.388	C	S	.	.	H	α-helix	trans	-57.7	-50.3	174	-65.4	164.3	0	0	0	109.5	M205 I206 N211 I212 V213 T225 L229	M205-I209 HydrophobicContact CG-CD1 4.44Å; M205-I209 WeakPolarHBondContact O-CG1 3.35Å; M205-I209 PolarHBondContact O-N 3.15Å; I206-I209 PolarHBondContact O-N 3.49Å; I209-N211 VanDerWaalsContact C-N 3.28Å; I209-N211 PolarHBondContact O-N 3.24Å; I209-I212 PolarHBondContact O-N 2.79Å; I209-I212 VanDerWaalsContact O-N 3.14Å; I209-V213 HydrophobicContact CG2-CG2 4.11Å; I209-V213 WeakPolarHBondContact O-CB 3.1Å; I209-V213 WeakPolarHBondContact O-CG2 3.47Å; I209-V213 PolarHBondContact O-N 3.16Å; I209-T225 HydrophobicContact CG2-CG2 4.3Å; I209-L229 HydrophobicContact CD1-CD2 4.48Å; I209-L229 HydrophobicContact CG2-CD1 4.14Å; I209-L229 HydrophobicContact CG2-CD2 4.22Å
210	S	59.9	Low	56.8	Low	9 Å²	9	86.6 Å²	86.6	6%	0.063	41%	0.41	C	S	.	.	H	α-helix	trans	-58	-39.2	177.5	-174.6	0	0	0	0	112.7	I206 S207 L208 K214	I206-S210 PolarHBondContact O-N 2.99Å; S207-S210 PolarHBondContact O-N 2.95Å; L208-S210 PolarHBondContact O-N 2.05Å; S210-K214 WeakPolarHBondContact O-CB 3.41Å; S210-K214 VanDerWaalsContact O-CG 3.25Å; S210-K214 WeakPolarHBondContact O-CG 3.25Å; S210-K214 PolarHBondContact O-N 2.92Å
211	N	60.8	Low	56.9	Low	84 Å²	84	83.2 Å²	83.2	45%	0.449	40%	0.397	S	S	.	.	H	α-helix	trans	-71.8	-36.4	177.4	-72.5	-12.8	0	0	0	112.7	S207 L208 I209 K214 S215	S207-N211 WeakPolarHBondContact O-CB 3.5Å; S207-N211 PolarHBondContact O-N 3.29Å; S207-N211 PolarHBondContact O-ND2 3.41Å; L208-N211 PolarHBondContact O-N 2.76Å; I209-N211 VanDerWaalsContact C-N 3.28Å; I209-N211 PolarHBondContact O-N 3.24Å; N211-K214 PolarHBondContact O-N 3.44Å; N211-S215 VanDerWaalsContact O-CB 3.23Å; N211-S215 WeakPolarHBondContact O-CB 3.32Å; N211-S215 PolarHBondContact O-N 3.49Å; N211-S215 PolarHBondContact O-OG 3.03Å
212	I	55.9	Low	56.8	Low	87 Å²	87	83.4 Å²	83.4	45%	0.446	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-44.9	173.7	-69.8	162.1	0	0	0	109.8	L208 I209 K214 S215 Q216	L208-I212 WeakPolarHBondContact O-CB 3.39Å; L208-I212 WeakPolarHBondContact O-CD1 3.17Å; L208-I212 WeakPolarHBondContact O-CG1 3.39Å; L208-I212 PolarHBondContact O-N 3.31Å; I209-I212 PolarHBondContact O-N 2.79Å; I209-I212 VanDerWaalsContact O-N 3.14Å; I212-K214 PolarHBondContact O-N 3.48Å; I212-S215 PolarHBondContact O-N 3.21Å; I212-S215 VanDerWaalsContact O-N 3.16Å; I212-S215 PolarHBondContact O-OG 2.92Å; I212-Q216 PolarHBondContact O-N 2.89Å
213	V	54.3	Low	56.3	Low	17 Å²	17	83.6 Å²	83.6	10%	0.103	41%	0.411	C	S	.	.	H	α-helix	trans	-66	-28	178.3	179.8	0	0	0	0	111.8	I209 L221 T250 V251	I209-V213 HydrophobicContact CG2-CG2 4.11Å; I209-V213 WeakPolarHBondContact O-CB 3.1Å; I209-V213 WeakPolarHBondContact O-CG2 3.47Å; I209-V213 PolarHBondContact O-N 3.16Å; V213-L221 HydrophobicContact CB-CD1 4.07Å; V213-L221 HydrophobicContact CG1-CD1 3.55Å; V213-L221 HydrophobicContact CG2-CD1 3.29Å; V213-L221 HydrophobicContact CG2-CD2 4.36Å; V213-L221 HydrophobicContact CG2-CG 3.95Å; V213-T250 HydrophobicContact CB-CG2 4.48Å; V213-T250 HydrophobicContact CG1-CG2 3.69Å; V213-V251 HydrophobicContact CG1-CG2 4.07Å
214	K	54.7	Low	56.2	Low	128 Å²	128	89 Å²	89	56%	0.557	43%	0.431	S	S	*	.	H	α-helix	trans	-82.5	-24.5	173.3	-74.3	175.3	-175.8	178.3	0	114.2	S210 N211 I212 T250	S210-K214 WeakPolarHBondContact O-CB 3.41Å; S210-K214 VanDerWaalsContact O-CG 3.25Å; S210-K214 WeakPolarHBondContact O-CG 3.25Å; S210-K214 PolarHBondContact O-N 2.92Å; N211-K214 PolarHBondContact O-N 3.44Å; I212-K214 PolarHBondContact O-N 3.48Å; K214-T250 HydrophobicContact CG-CG2 3.73Å
215	S	53.4	Low	56.1	Low	90 Å²	90	84.8 Å²	84.8	63%	0.629	42%	0.417	S	S	*	.	H	α-helix	trans	-104.4	-11.6	-170.1	68.9	0	0	0	0	114.6	N211 I212	N211-S215 VanDerWaalsContact O-CB 3.23Å; N211-S215 WeakPolarHBondContact O-CB 3.32Å; N211-S215 PolarHBondContact O-N 3.49Å; N211-S215 PolarHBondContact O-OG 3.03Å; I212-S215 PolarHBondContact O-N 3.21Å; I212-S215 VanDerWaalsContact O-N 3.16Å; I212-S215 PolarHBondContact O-OG 2.92Å
216	Q	48.3	Very low	55.8	Low	114 Å²	114	81 Å²	81	53%	0.533	40%	0.401	S	S	.	.	S	Bend	trans	-121.9	147.2	178.5	-63.7	-168.5	-12.9	0	0	110.1	I212 S218	I212-Q216 PolarHBondContact O-N 2.89Å; Q216-S218 PolarHBondContact O-N 2.83Å; Q216-S218 VanDerWaalsContact O-N 3.08Å
217	Q	50.9	Low	55.5	Low	148 Å²	148	83.1 Å²	83.1	69%	0.692	41%	0.413	S	S	*	.			trans	-36.3	121	166.3	-73.2	170.4	-27.4	0	0	108.3	D219	Q217-D219 PolarHBondContact O-N 3.23Å
218	S	48.6	Very low	55.6	Low	26 Å²	26	84 Å²	84	18%	0.182	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-47.3	-12.9	-178.4	37.7	0	0	0	0	116.8	Q216 R220 S254	Q216-S218 PolarHBondContact O-N 2.83Å; Q216-S218 VanDerWaalsContact O-N 3.08Å; S218-R220 PolarHBondContact O-N 2.94Å; S218-S254 WeakPolarHBondContact CB-OG 3.34Å; S218-S254 VanDerWaalsContact OG-CB 3.3Å; S218-S254 WeakPolarHBondContact OG-CB 3.27Å; S218-S254 PolarHBondContact OG-OG 2.92Å
219	D	49.3	Very low	55.6	Low	101 Å²	101	79.5 Å²	79.5	54%	0.54	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-78.6	12.1	-167.7	-48.6	-25.4	0	0	0	112.7	Q217	Q217-D219 PolarHBondContact O-N 3.23Å
220	R	49.7	Very low	55.5	Low	199 Å²	199	78 Å²	78	75%	0.751	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-135.6	28.6	-174.8	-68.9	-167.2	173	-168.8	-1.1	116	S218 D222	S218-R220 PolarHBondContact O-N 2.94Å; R220-D222 PolarHBondContact O-N 3.35Å
221	L	55.2	Low	55.5	Low	36 Å²	36	83.6 Å²	83.6	19%	0.188	41%	0.411	C	S	.	.			trans	-79.7	99.9	155.8	-98.6	120.9	0	0	0	109.8	V213 T225 L229 V251	V213-L221 HydrophobicContact CB-CD1 4.07Å; V213-L221 HydrophobicContact CG1-CD1 3.55Å; V213-L221 HydrophobicContact CG2-CD1 3.29Å; V213-L221 HydrophobicContact CG2-CD2 4.36Å; V213-L221 HydrophobicContact CG2-CG 3.95Å; L221-T225 HydrophobicContact CD2-CG2 3.75Å; L221-L229 HydrophobicContact CD2-CD1 3.83Å; L221-V251 HydrophobicContact CD1-CB 4.16Å; L221-V251 HydrophobicContact CD1-CG1 4.03Å; L221-V251 HydrophobicContact CD1-CG2 3.21Å; L221-V251 HydrophobicContact CD2-CG2 4.17Å; L221-V251 HydrophobicContact CG-CG2 4.23Å
222	D	57.2	Low	55.6	Low	105 Å²	105	81.1 Å²	81.1	56%	0.561	40%	0.397	S	S	*	.			trans	-54.4	141.2	171.2	-47.9	-13.2	0	0	0	109.9	R220 R224 T225 A226	R220-D222 PolarHBondContact O-N 3.35Å; D222-R224 PolarHBondContact O-N 3.42Å; D222-T225 WeakPolarHBondContact O-CA 3.26Å; D222-T225 WeakPolarHBondContact O-CB 3.35Å; D222-T225 PolarHBondContact O-N 3.08Å; D222-A226 PolarHBondContact O-N 3.17Å; D222-A226 VanDerWaalsContact O-N 3.16Å
223	E	51.9	Low	55.8	Low	109 Å²	109	77.2 Å²	77.2	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-48.4	-36.8	179.1	-175	177.6	162.3	0	0	112.3	T225 A226 L227 K275	E223-T225 PolarHBondContact O-N 2.91Å; E223-A226 PolarHBondContact O-N 3.23Å; E223-L227 HydrophobicContact CG-CD1 4.03Å; E223-L227 VanDerWaalsContact O-CB 3.3Å; E223-L227 WeakPolarHBondContact O-CB 3.46Å; E223-L227 WeakPolarHBondContact O-CD1 3.23Å; E223-L227 WeakPolarHBondContact O-CG 3.39Å; E223-L227 PolarHBondContact O-N 3.36Å; E223-K275 IonicContact OE2-NZ 3.91Å
224	R	58.5	Low	55.8	Low	207 Å²	207	80.3 Å²	80.3	78%	0.781	39%	0.393	S	S	*	.	H	α-helix	trans	-63.9	-36.5	175.9	-69.1	-176.7	178.9	176.8	0.4	113.4	D222 S228	D222-R224 PolarHBondContact O-N 3.42Å; R224-S228 VanDerWaalsContact O-CB 3.31Å; R224-S228 WeakPolarHBondContact O-CB 3.14Å; R224-S228 PolarHBondContact O-N 3.1Å; R224-S228 PolarHBondContact O-OG 3.4Å
225	T	59.9	Low	56.1	Low	46 Å²	46	75.5 Å²	75.5	28%	0.282	37%	0.374	S	S	.	.	H	α-helix	trans	-72.8	-42.3	178.9	-54.1	0	0	0	0	109.9	I209 L221 D222 E223 S228 L229	I209-T225 HydrophobicContact CG2-CG2 4.3Å; L221-T225 HydrophobicContact CD2-CG2 3.75Å; D222-T225 WeakPolarHBondContact O-CA 3.26Å; D222-T225 WeakPolarHBondContact O-CB 3.35Å; D222-T225 PolarHBondContact O-N 3.08Å; E223-T225 PolarHBondContact O-N 2.91Å; T225-S228 PolarHBondContact O-N 3.37Å; T225-L229 WeakPolarHBondContact O-CG 3.32Å; T225-L229 PolarHBondContact O-N 3.26Å
226	A	55.5	Low	56.2	Low	21 Å²	21	79 Å²	79	17%	0.174	38%	0.38	C	S	.	.	H	α-helix	trans	-61.5	-48.4	172.6	0	0	0	0	0	111.7	D222 E223 S228 L229 V230	D222-A226 PolarHBondContact O-N 3.17Å; D222-A226 VanDerWaalsContact O-N 3.16Å; E223-A226 PolarHBondContact O-N 3.23Å; A226-S228 VanDerWaalsContact C-N 3.26Å; A226-S228 PolarHBondContact O-N 3.37Å; A226-L229 PolarHBondContact O-N 3.28Å; A226-L229 VanDerWaalsContact O-N 3.15Å; A226-V230 WeakPolarHBondContact O-CG2 3.46Å; A226-V230 PolarHBondContact O-N 3.29Å
227	L	56.6	Low	57	Low	45 Å²	45	76.8 Å²	76.8	24%	0.236	37%	0.369	C	S	.	.	H	α-helix	trans	-54.3	-41	172.1	-90.9	156.4	0	0	0	112.6	E223 V230 K231 L279	E223-L227 HydrophobicContact CG-CD1 4.03Å; E223-L227 VanDerWaalsContact O-CB 3.3Å; E223-L227 WeakPolarHBondContact O-CB 3.46Å; E223-L227 WeakPolarHBondContact O-CD1 3.23Å; E223-L227 WeakPolarHBondContact O-CG 3.39Å; E223-L227 PolarHBondContact O-N 3.36Å; L227-V230 PolarHBondContact O-N 2.89Å; L227-K231 WeakPolarHBondContact O-CB 3.38Å; L227-K231 VanDerWaalsContact O-CG 3.27Å; L227-K231 WeakPolarHBondContact O-CG 3.33Å; L227-K231 PolarHBondContact O-N 3.08Å; L227-L279 HydrophobicContact CD2-CD2 3.21Å; L227-L279 HydrophobicContact CG-CD2 3.68Å
228	S	63.1	Low	57.5	Low	63 Å²	63	73 Å²	73	44%	0.441	35%	0.351	S	S	.	.	H	α-helix	trans	-70.2	-39	179	-61.4	0	0	0	0	111.7	R224 T225 A226 K231 L232	R224-S228 VanDerWaalsContact O-CB 3.31Å; R224-S228 WeakPolarHBondContact O-CB 3.14Å; R224-S228 PolarHBondContact O-N 3.1Å; R224-S228 PolarHBondContact O-OG 3.4Å; T225-S228 PolarHBondContact O-N 3.37Å; A226-S228 VanDerWaalsContact C-N 3.26Å; A226-S228 PolarHBondContact O-N 3.37Å; S228-K231 PolarHBondContact O-N 3.13Å; S228-L232 WeakPolarHBondContact O-CB 3.5Å; S228-L232 WeakPolarHBondContact O-CD1 3.24Å; S228-L232 WeakPolarHBondContact O-CG 3.16Å; S228-L232 PolarHBondContact O-N 3.43Å
229	L	62.9	Low	58.1	Low	1 Å²	1	76 Å²	76	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-64.2	-42.5	173.6	-71.5	171.7	0	0	0	111.4	I206 I209 L221 T225 A226 L232 L233 C244 A247	I206-L229 HydrophobicContact CG2-CD2 4.44Å; I209-L229 HydrophobicContact CD1-CD2 4.48Å; I209-L229 HydrophobicContact CG2-CD1 4.14Å; I209-L229 HydrophobicContact CG2-CD2 4.22Å; L221-L229 HydrophobicContact CD2-CD1 3.83Å; T225-L229 WeakPolarHBondContact O-CG 3.32Å; T225-L229 PolarHBondContact O-N 3.26Å; A226-L229 PolarHBondContact O-N 3.28Å; A226-L229 VanDerWaalsContact O-N 3.15Å; L229-L232 WeakPolarHBondContact O-CB 2.89Å; L229-L232 PolarHBondContact O-N 3.38Å; L229-L232 VanDerWaalsContact O-N 3.17Å; L229-L233 PolarHBondContact O-N 3.19Å; L229-L233 VanDerWaalsContact O-N 3.15Å; L229-C244 HydrophobicContact CD2-CB 4.4Å; L229-A247 HydrophobicContact CD1-CB 3.89Å; L229-A247 HydrophobicContact CD2-CB 4.24Å
230	V	58.9	Low	58.7	Low	2 Å²	2	71.2 Å²	71.2	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-65.4	-41	176.1	178.2	0	0	0	0	110.9	A226 L227 L232 L233 L248 F283 V285	A226-V230 WeakPolarHBondContact O-CG2 3.46Å; A226-V230 PolarHBondContact O-N 3.29Å; L227-V230 PolarHBondContact O-N 2.89Å; V230-L232 PolarHBondContact O-N 3.11Å; V230-L233 VanDerWaalsContact O-CB 3.28Å; V230-L233 WeakPolarHBondContact O-CB 3.42Å; V230-L233 PolarHBondContact O-N 3.44Å; V230-L248 HydrophobicContact CG2-CD2 4.44Å; V230-F283 HydrophobicContact CB-CD2 4.41Å; V230-F283 HydrophobicContact CG1-CB 3.64Å; V230-F283 HydrophobicContact CG1-CD1 4.04Å; V230-F283 HydrophobicContact CG1-CD2 3.31Å; V230-F283 HydrophobicContact CG1-CE2 3.96Å; V230-F283 HydrophobicContact CG1-CG 3.38Å; V230-V285 HydrophobicContact CG1-CG2 4.33Å
231	K	60.4	Low	59.3	Low	127 Å²	127	61.8 Å²	61.8	55%	0.552	30%	0.304	S	S	*	.	H	α-helix	trans	-59.5	-35.1	172	-77.7	174.2	-178.2	-176.7	0	112.8	L227 S228 L233 N234 F283	L227-K231 WeakPolarHBondContact O-CB 3.38Å; L227-K231 VanDerWaalsContact O-CG 3.27Å; L227-K231 WeakPolarHBondContact O-CG 3.33Å; L227-K231 PolarHBondContact O-N 3.08Å; S228-K231 PolarHBondContact O-N 3.13Å; K231-L233 VanDerWaalsContact C-N 3.3Å; K231-N234 PolarHBondContact O-N 3.38Å; K231-F283 HydrophobicContact CB-CE1 4.33Å; K231-F283 HydrophobicContact CB-CZ 4.45Å; K231-F283 HydrophobicContact CD-CZ 4.43Å; K231-F283 HydrophobicContact CG-CE1 3.66Å; K231-F283 HydrophobicContact CG-CE2 4.43Å; K231-F283 HydrophobicContact CG-CZ 3.39Å
232	L	62.7	Low	59.6	Low	32 Å²	32	60.8 Å²	60.8	17%	0.168	30%	0.299	C	S	.	.	H	α-helix	trans	-75.2	-15.3	176.9	-70.8	166.7	0	0	0	113.2	I206 S228 L229 V230 N234 D235 V240 C244	I206-L232 HydrophobicContact CD1-CD1 4.15Å; I206-L232 HydrophobicContact CG1-CD1 4.2Å; S228-L232 WeakPolarHBondContact O-CB 3.5Å; S228-L232 WeakPolarHBondContact O-CD1 3.24Å; S228-L232 WeakPolarHBondContact O-CG 3.16Å; S228-L232 PolarHBondContact O-N 3.43Å; L229-L232 WeakPolarHBondContact O-CB 2.89Å; L229-L232 PolarHBondContact O-N 3.38Å; L229-L232 VanDerWaalsContact O-N 3.17Å; V230-L232 PolarHBondContact O-N 3.11Å; L232-N234 PolarHBondContact O-N 2.93Å; L232-D235 VanDerWaalsContact O-CB 3.23Å; L232-D235 WeakPolarHBondContact O-CB 3.49Å; L232-D235 PolarHBondContact O-N 3.48Å; L232-D235 VanDerWaalsContact O-N 3.13Å; L232-V240 HydrophobicContact CB-CG1 4.36Å; L232-V240 HydrophobicContact CD2-CG1 4.48Å; L232-C244 WeakPolarHBondContact CB-SG 3.32Å
233	L	60	Low	59.9	Low	4 Å²	4	58.4 Å²	58.4	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-23.3	170.1	-63.5	175.7	0	0	0	112.5	L229 V230 K231 D235 I241 C244 L245 L248 V285	L229-L233 PolarHBondContact O-N 3.19Å; L229-L233 VanDerWaalsContact O-N 3.15Å; V230-L233 VanDerWaalsContact O-CB 3.28Å; V230-L233 WeakPolarHBondContact O-CB 3.42Å; V230-L233 PolarHBondContact O-N 3.44Å; K231-L233 VanDerWaalsContact C-N 3.3Å; L233-D235 VanDerWaalsContact C-N 3.25Å; L233-D235 PolarHBondContact O-N 2.96Å; L233-I241 HydrophobicContact CD2-CG2 3.85Å; L233-C244 HydrophobicContact CD2-CB 3.61Å; L233-C244 HydrophobicContact CG-CB 4.32Å; L233-L245 HydrophobicContact CD2-CD2 3.81Å; L233-L245 HydrophobicContact CD2-CG 3.76Å; L233-L248 HydrophobicContact CD1-CD1 3.71Å; L233-L248 HydrophobicContact CD2-CD1 4.34Å; L233-L248 HydrophobicContact CG-CD1 4.33Å; L233-V285 HydrophobicContact CD1-CG1 4.09Å; L233-V285 HydrophobicContact CD1-CG2 4.29Å
234	N	53.9	Low	60.5	Low	83 Å²	83	53.2 Å²	53.2	44%	0.444	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	2.3	173.1	-74.6	-0.9	0	0	0	113.3	K231 L232 F283	K231-N234 PolarHBondContact O-N 3.38Å; L232-N234 PolarHBondContact O-N 2.93Å; N234-F283 WeakPolarHBondContact ND2-CD1 3.42Å
235	D	61.5	Low	60.8	Low	27 Å²	27	43.5 Å²	43.5	14%	0.144	22%	0.224	C	C	.	.	S	Bend	trans	-69.5	160.4	173.6	-150.6	-25.3	0	0	0	110.5	R202 L232 L233 V240 I241 R288	R202-D235 IonicContact CZ-OD2 2.8Å; R202-D235 IonicContact NH1-OD1 2.61Å; R202-D235 IonicContact NH1-OD2 3.91Å; R202-D235 PolarHBondContact NH1-OD2 3.27Å; L232-D235 VanDerWaalsContact O-CB 3.23Å; L232-D235 WeakPolarHBondContact O-CB 3.49Å; L232-D235 PolarHBondContact O-N 3.48Å; L232-D235 VanDerWaalsContact O-N 3.13Å; L233-D235 VanDerWaalsContact C-N 3.25Å; L233-D235 PolarHBondContact O-N 2.96Å; D235-V240 HydrophobicContact CB-CG1 3.99Å; D235-I241 WeakPolarHBondContact O-CD1 3.42Å; D235-R288 PolarHBondContact O-NH2 3.45Å
236	H	56	Low	60.9	Low	163 Å²	163	42.7 Å²	42.7	76%	0.755	22%	0.219	S	C	*	.	S	Bend	trans	-88	-14.4	-178.5	-64.5	-61	0	0	0	113	H238	H236-H238 PolarHBondContact O-N 3.12Å
237	E	64.4	Low	61.3	Low	68 Å²	68	41.7 Å²	41.7	32%	0.318	21%	0.21	S	C	.	.			trans	-84.7	111.5	-178.4	-68.1	-172.2	-176.8	0	0	111.6	P199 N239 V240 I241	P199-E237 WeakPolarHBondContact CB-OE1 3.25Å; E237-N239 PolarHBondContact O-N 2.76Å; E237-N239 VanDerWaalsContact O-N 3.1Å; E237-V240 HydrophobicContact CB-CB 4.05Å; E237-V240 HydrophobicContact CB-CG2 3.73Å; E237-V240 WeakPolarHBondContact O-CB 3.33Å; E237-V240 PolarHBondContact O-N 2.95Å; E237-V240 WeakPolarHBondContact OE2-CG2 3.49Å; E237-I241 PolarHBondContact O-N 3.31Å; E237-I241 VanDerWaalsContact O-N 3.14Å
238	H	62.1	Low	61.5	Low	67 Å²	67	40.9 Å²	40.9	31%	0.31	21%	0.206	S	C	.	.	H	α-helix	trans	-50.5	-39.1	178.2	-65.1	164.6	0	0	0	113.4	H236 V240 I241 L242 L298	H236-H238 PolarHBondContact O-N 3.12Å; H238-V240 PolarHBondContact O-N 3.17Å; H238-I241 PolarHBondContact O-N 3.42Å; H238-L242 WeakPolarHBondContact O-CB 3.16Å; H238-L242 WeakPolarHBondContact O-CD1 3.37Å; H238-L242 WeakPolarHBondContact O-CG 3.49Å; H238-L242 PolarHBondContact O-N 3.01Å; H238-L298 HydrophobicContact CB-CD2 3.66Å
239	N	61	Low	61.5	Low	90 Å²	90	40.6 Å²	40.6	48%	0.481	20%	0.197	S	C	.	.	H	α-helix	trans	-64.8	-37.1	178.6	-70.4	-35.6	0	0	0	113.1	E237 Q243	E237-N239 PolarHBondContact O-N 2.76Å; E237-N239 VanDerWaalsContact O-N 3.1Å; N239-Q243 VanDerWaalsContact O-CG 3.27Å; N239-Q243 WeakPolarHBondContact O-CG 3.44Å; N239-Q243 PolarHBondContact O-N 2.91Å; N239-Q243 VanDerWaalsContact O-N 3.12Å
240	V	61	Low	61.5	Low	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-46.3	176	169.7	0	0	0	0	109.1	R203 I206 L232 D235 E237 H238 L242 Q243 C244	R203-V240 HydrophobicContact CG-CG2 4.44Å; I206-V240 HydrophobicContact CD1-CB 4.23Å; I206-V240 HydrophobicContact CD1-CG1 3.54Å; I206-V240 HydrophobicContact CD1-CG2 4.36Å; L232-V240 HydrophobicContact CB-CG1 4.36Å; L232-V240 HydrophobicContact CD2-CG1 4.48Å; D235-V240 HydrophobicContact CB-CG1 3.99Å; E237-V240 HydrophobicContact CB-CB 4.05Å; E237-V240 HydrophobicContact CB-CG2 3.73Å; E237-V240 WeakPolarHBondContact O-CB 3.33Å; E237-V240 PolarHBondContact O-N 2.95Å; E237-V240 WeakPolarHBondContact OE2-CG2 3.49Å; H238-V240 PolarHBondContact O-N 3.17Å; V240-L242 PolarHBondContact O-N 2.92Å; V240-Q243 PolarHBondContact O-N 3.3Å; V240-C244 PolarHBondContact O-N 3.07Å; V240-C244 PolarHBondContact O-SG 3.36Å
241	I	61.7	Low	61.4	Low	1 Å²	1	42 Å²	42	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-47.3	178.6	-58.8	166.8	0	0	0	110.9	L233 D235 E237 H238 Q243 C244 L245 L292	L233-I241 HydrophobicContact CD2-CG2 3.85Å; D235-I241 WeakPolarHBondContact O-CD1 3.42Å; E237-I241 PolarHBondContact O-N 3.31Å; E237-I241 VanDerWaalsContact O-N 3.14Å; H238-I241 PolarHBondContact O-N 3.42Å; I241-Q243 VanDerWaalsContact C-N 3.33Å; I241-Q243 PolarHBondContact O-N 2.97Å; I241-C244 CarbonylContact O-C 3.6Å; I241-C244 WeakPolarHBondContact O-CB 3.5Å; I241-C244 PolarHBondContact O-N 3.04Å; I241-C244 VanDerWaalsContact O-N 3.13Å; I241-L245 HydrophobicContact CG2-CD1 3.8Å; I241-L245 HydrophobicContact CG2-CG 4.13Å; I241-L245 WeakPolarHBondContact O-CB 3.2Å; I241-L245 VanDerWaalsContact O-CG 3.29Å; I241-L245 WeakPolarHBondContact O-CG 3.49Å; I241-L245 PolarHBondContact O-N 2.79Å; I241-L292 HydrophobicContact CB-CD1 4.5Å; I241-L292 HydrophobicContact CD1-CD1 4.37Å; I241-L292 HydrophobicContact CD1-CD2 3.91Å; I241-L292 HydrophobicContact CG2-CD1 3.44Å; I241-L292 VanDerWaalsContact CG2-CD1 3.44Å
242	L	62.5	Low	61.1	Low	16 Å²	16	37.1 Å²	37.1	8%	0.084	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-39.3	179.8	-70.9	161.9	0	0	0	113.1	H238 V240 L245 T246 L298 A302	H238-L242 WeakPolarHBondContact O-CB 3.16Å; H238-L242 WeakPolarHBondContact O-CD1 3.37Å; H238-L242 WeakPolarHBondContact O-CG 3.49Å; H238-L242 PolarHBondContact O-N 3.01Å; V240-L242 PolarHBondContact O-N 2.92Å; L242-L245 PolarHBondContact O-N 3.22Å; L242-T246 WeakPolarHBondContact O-CB 3.21Å; L242-T246 PolarHBondContact O-N 3.48Å; L242-T246 PolarHBondContact O-OG1 3.1Å; L242-L298 HydrophobicContact CD1-CD2 4.32Å; L242-A302 HydrophobicContact CD1-CB 3.19Å; L242-A302 HydrophobicContact CD2-CB 3.55Å; L242-A302 VanDerWaalsContact CD2-O 3.23Å; L242-A302 WeakPolarHBondContact CD2-O 3.15Å; L242-A302 HydrophobicContact CG-CB 3.96Å
243	Q	63.8	Low	60.7	Low	54 Å²	54	37.9 Å²	37.9	25%	0.252	19%	0.194	S	C	.	.	H	α-helix	trans	-69.6	-37.2	175.9	-70.6	179.2	-19.1	0	0	111.4	R203 I206 N239 V240 I241 T246 A247	R203-Q243 PolarHBondContact O-OE1 3.36Å; I206-Q243 HydrophobicContact CB-CB 4.24Å; I206-Q243 HydrophobicContact CG2-CB 3.44Å; I206-Q243 VanDerWaalsContact CG2-CB 3.44Å; N239-Q243 VanDerWaalsContact O-CG 3.27Å; N239-Q243 WeakPolarHBondContact O-CG 3.44Å; N239-Q243 PolarHBondContact O-N 2.91Å; N239-Q243 VanDerWaalsContact O-N 3.12Å; V240-Q243 PolarHBondContact O-N 3.3Å; I241-Q243 VanDerWaalsContact C-N 3.33Å; I241-Q243 PolarHBondContact O-N 2.97Å; Q243-T246 PolarHBondContact O-N 2.69Å; Q243-A247 WeakPolarHBondContact O-CB 3.44Å; Q243-A247 PolarHBondContact O-N 2.86Å
244	C	64.4	Low	60.2	Low	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-44.2	173	-66.3	0	0	0	0	111.4	L229 L232 L233 V240 I241 T246 A247 L248	L229-C244 HydrophobicContact CD2-CB 4.4Å; L232-C244 WeakPolarHBondContact CB-SG 3.32Å; L233-C244 HydrophobicContact CD2-CB 3.61Å; L233-C244 HydrophobicContact CG-CB 4.32Å; V240-C244 PolarHBondContact O-N 3.07Å; V240-C244 PolarHBondContact O-SG 3.36Å; I241-C244 CarbonylContact O-C 3.6Å; I241-C244 WeakPolarHBondContact O-CB 3.5Å; I241-C244 PolarHBondContact O-N 3.04Å; I241-C244 VanDerWaalsContact O-N 3.13Å; C244-T246 VanDerWaalsContact C-N 3.34Å; C244-T246 PolarHBondContact O-N 3.46Å; C244-A247 WeakPolarHBondContact O-CB 3.5Å; C244-A247 PolarHBondContact O-N 3.06Å; C244-L248 WeakPolarHBondContact O-CB 3.34Å; C244-L248 VanDerWaalsContact O-CG 3.3Å; C244-L248 WeakPolarHBondContact O-CG 3.49Å; C244-L248 PolarHBondContact O-N 3.15Å
245	L	63.8	Low	59.9	Low	4 Å²	4	38.8 Å²	38.8	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-41.7	174.1	-72.2	172.9	0	0	0	111.6	L233 I241 L242 A247 L248 K249 L292 L306 C309	L233-L245 HydrophobicContact CD2-CD2 3.81Å; L233-L245 HydrophobicContact CD2-CG 3.76Å; I241-L245 HydrophobicContact CG2-CD1 3.8Å; I241-L245 HydrophobicContact CG2-CG 4.13Å; I241-L245 WeakPolarHBondContact O-CB 3.2Å; I241-L245 VanDerWaalsContact O-CG 3.29Å; I241-L245 WeakPolarHBondContact O-CG 3.49Å; I241-L245 PolarHBondContact O-N 2.79Å; L242-L245 PolarHBondContact O-N 3.22Å; L245-A247 PolarHBondContact O-N 3.14Å; L245-L248 PolarHBondContact O-N 3.09Å; L245-K249 WeakPolarHBondContact O-CB 3.21Å; L245-K249 PolarHBondContact O-N 3.44Å; L245-L292 HydrophobicContact CD1-CD1 4.37Å; L245-L306 HydrophobicContact CD1-CD1 3.45Å; L245-L306 VanDerWaalsContact CD1-CD1 3.45Å; L245-C309 PolarHBondContact O-SG 3.09Å
246	T	63.1	Low	58.9	Low	28 Å²	28	43.3 Å²	43.3	17%	0.172	22%	0.224	C	C	.	.	H	α-helix	trans	-62.9	-42.2	175.2	-54.9	0	0	0	0	111.7	L242 Q243 C244 K249 T250 I305	L242-T246 WeakPolarHBondContact O-CB 3.21Å; L242-T246 PolarHBondContact O-N 3.48Å; L242-T246 PolarHBondContact O-OG1 3.1Å; Q243-T246 PolarHBondContact O-N 2.69Å; C244-T246 VanDerWaalsContact C-N 3.34Å; C244-T246 PolarHBondContact O-N 3.46Å; T246-K249 PolarHBondContact O-N 3.36Å; T246-T250 PolarHBondContact O-N 2.98Å; T246-T250 PolarHBondContact O-OG1 3.21Å; T246-I305 VanDerWaalsContact OG1-CG2 3.28Å; T246-I305 WeakPolarHBondContact OG1-CG2 3.44Å
247	A	62.6	Low	58.1	Low	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.7	-49.9	175.1	0	0	0	0	0	110.1	L229 Q243 C244 L245 K249 T250 V251	L229-A247 HydrophobicContact CD1-CB 3.89Å; L229-A247 HydrophobicContact CD2-CB 4.24Å; Q243-A247 WeakPolarHBondContact O-CB 3.44Å; Q243-A247 PolarHBondContact O-N 2.86Å; C244-A247 WeakPolarHBondContact O-CB 3.5Å; C244-A247 PolarHBondContact O-N 3.06Å; L245-A247 PolarHBondContact O-N 3.14Å; A247-K249 PolarHBondContact O-N 3.01Å; A247-T250 WeakPolarHBondContact O-CB 3.31Å; A247-T250 PolarHBondContact O-N 3.41Å; A247-V251 WeakPolarHBondContact O-CG2 3.42Å; A247-V251 PolarHBondContact O-N 3.04Å
248	L	62.7	Low	56.8	Low	28 Å²	28	45.1 Å²	45.1	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-57.1	-42.9	176.4	-72.2	169.8	0	0	0	112.9	V230 L233 C244 L245 T250 V251 S252	V230-L248 HydrophobicContact CG2-CD2 4.44Å; L233-L248 HydrophobicContact CD1-CD1 3.71Å; L233-L248 HydrophobicContact CD2-CD1 4.34Å; L233-L248 HydrophobicContact CG-CD1 4.33Å; C244-L248 WeakPolarHBondContact O-CB 3.34Å; C244-L248 VanDerWaalsContact O-CG 3.3Å; C244-L248 WeakPolarHBondContact O-CG 3.49Å; C244-L248 PolarHBondContact O-N 3.15Å; L245-L248 PolarHBondContact O-N 3.09Å; L248-T250 VanDerWaalsContact C-N 3.32Å; L248-T250 PolarHBondContact O-N 3.46Å; L248-V251 WeakPolarHBondContact O-CB 3.42Å; L248-V251 PolarHBondContact O-N 3.06Å; L248-S252 PolarHBondContact O-N 2.9Å; L248-S252 PolarHBondContact O-OG 2.97Å; L248-S252 VanDerWaalsContact O-OG 3.11Å
249	K	62.8	Low	55.3	Low	57 Å²	57	48.1 Å²	48.1	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-57.7	-45.5	173	-179.4	-175.4	176	-172	0	111.6	L245 T246 A247 V251 S252 T253 D308	L245-K249 WeakPolarHBondContact O-CB 3.21Å; L245-K249 PolarHBondContact O-N 3.44Å; T246-K249 PolarHBondContact O-N 3.36Å; A247-K249 PolarHBondContact O-N 3.01Å; K249-V251 VanDerWaalsContact C-N 3.26Å; K249-V251 PolarHBondContact O-N 3.35Å; K249-S252 WeakPolarHBondContact CA-OG 3.44Å; K249-S252 PolarHBondContact O-N 2.95Å; K249-S252 PolarHBondContact O-OG 3.26Å; K249-T253 HydrophobicContact CG-CG2 4.23Å; K249-T253 WeakPolarHBondContact O-CG2 3.42Å; K249-T253 PolarHBondContact O-N 3.44Å; K249-T253 PolarHBondContact O-OG1 3.03Å; K249-T253 VanDerWaalsContact O-OG1 3.07Å; K249-D308 HydrophobicContact CD-CB 4Å; K249-D308 IonicContact NZ-OD2 2.88Å; K249-D308 PolarHBondContact NZ-OD2 3.28Å
250	T	61.6	Low	53.7	Low	24 Å²	24	50 Å²	50	15%	0.147	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-37.4	-178.2	-47.1	0	0	0	0	110.6	V213 K214 T246 A247 L248 T253	V213-T250 HydrophobicContact CB-CG2 4.48Å; V213-T250 HydrophobicContact CG1-CG2 3.69Å; K214-T250 HydrophobicContact CG-CG2 3.73Å; T246-T250 PolarHBondContact O-N 2.98Å; T246-T250 PolarHBondContact O-OG1 3.21Å; A247-T250 WeakPolarHBondContact O-CB 3.31Å; A247-T250 PolarHBondContact O-N 3.41Å; L248-T250 VanDerWaalsContact C-N 3.32Å; L248-T250 PolarHBondContact O-N 3.46Å; T250-T253 PolarHBondContact O-OG1 3.38Å
251	V	57.9	Low	52.7	Low	10 Å²	10	54.3 Å²	54.3	6%	0.061	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-49.4	172.7	-165.7	0	0	0	0	110.8	V213 L221 A247 L248 K249 S254 Y272	V213-V251 HydrophobicContact CG1-CG2 4.07Å; L221-V251 HydrophobicContact CD1-CB 4.16Å; L221-V251 HydrophobicContact CD1-CG1 4.03Å; L221-V251 HydrophobicContact CD1-CG2 3.21Å; L221-V251 HydrophobicContact CD2-CG2 4.17Å; L221-V251 HydrophobicContact CG-CG2 4.23Å; A247-V251 WeakPolarHBondContact O-CG2 3.42Å; A247-V251 PolarHBondContact O-N 3.04Å; L248-V251 WeakPolarHBondContact O-CB 3.42Å; L248-V251 PolarHBondContact O-N 3.06Å; K249-V251 VanDerWaalsContact C-N 3.26Å; K249-V251 PolarHBondContact O-N 3.35Å; V251-S254 PolarHBondContact O-N 2.95Å; V251-S254 PolarHBondContact O-OG 3.44Å; V251-Y272 WeakPolarHBondContact CG1-OH 3.44Å
252	S	54.7	Low	51.3	Low	23 Å²	23	61.7 Å²	61.7	16%	0.161	33%	0.331	C	S	.	.	H	α-helix	trans	-74.2	-25.7	-174.7	51.9	0	0	0	0	114.6	L248 K249 S254 T255 T312	L248-S252 PolarHBondContact O-N 2.9Å; L248-S252 PolarHBondContact O-OG 2.97Å; L248-S252 VanDerWaalsContact O-OG 3.11Å; K249-S252 WeakPolarHBondContact CA-OG 3.44Å; K249-S252 PolarHBondContact O-N 2.95Å; K249-S252 PolarHBondContact O-OG 3.26Å; S252-S254 VanDerWaalsContact C-N 3.34Å; S252-T255 PolarHBondContact O-OG1 3.38Å; S252-T255 VanDerWaalsContact O-OG1 3.11Å; S252-T312 WeakPolarHBondContact OG-CG2 3.41Å
253	T	53.6	Low	49.9	Very low	48 Å²	48	67 Å²	67	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-77.9	-18.5	177.1	49.7	0	0	0	0	114.3	K249 T250 T255 T312	K249-T253 HydrophobicContact CG-CG2 4.23Å; K249-T253 WeakPolarHBondContact O-CG2 3.42Å; K249-T253 PolarHBondContact O-N 3.44Å; K249-T253 PolarHBondContact O-OG1 3.03Å; K249-T253 VanDerWaalsContact O-OG1 3.07Å; T250-T253 PolarHBondContact O-OG1 3.38Å; T253-T255 VanDerWaalsContact C-N 3.28Å; T253-T255 PolarHBondContact O-N 3.24Å; T253-T312 HydrophobicContact CG2-CG2 3.97Å
254	S	50.2	Low	48.4	Very low	28 Å²	28	68 Å²	68	20%	0.196	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-73.2	-20.4	-174.1	66.6	0	0	0	0	114.6	S218 V251 S252	S218-S254 WeakPolarHBondContact CB-OG 3.34Å; S218-S254 VanDerWaalsContact OG-CB 3.3Å; S218-S254 WeakPolarHBondContact OG-CB 3.27Å; S218-S254 PolarHBondContact OG-OG 2.92Å; V251-S254 PolarHBondContact O-N 2.95Å; V251-S254 PolarHBondContact O-OG 3.44Å; S252-S254 VanDerWaalsContact C-N 3.34Å
255	T	47.2	Very low	47	Very low	79 Å²	79	72.2 Å²	72.2	49%	0.485	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-80.3	-15.1	179.9	52.9	0	0	0	0	113.6	S252 T253	S252-T255 PolarHBondContact O-OG1 3.38Å; S252-T255 VanDerWaalsContact O-OG1 3.11Å; T253-T255 VanDerWaalsContact C-N 3.28Å; T253-T255 PolarHBondContact O-N 3.24Å
256	E	40.8	Very low	45.6	Very low	121 Å²	121	78.3 Å²	78.3	57%	0.565	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-83.1	-12.5	-177.9	-75	-178.1	164.1	0	0	113.7
257	N	38.4	Very low	44.1	Very low	141 Å²	141	82.5 Å²	82.5	75%	0.754	44%	0.438	S	S	*	.	S	Bend	trans	-113.5	5.9	-167	-74.6	-29	0	0	0	116.1
258	Q	36.5	Very low	42.7	Very low	128 Å²	128	87.3 Å²	87.3	60%	0.598	46%	0.459	S	S	*	.	S	Bend	trans	-116.4	118.7	176	-72.5	-168	1	0	0	112.5	D260	Q258-D260 PolarHBondContact O-N 2.91Å
259	V	30.5	Very low	41.7	Very low	131 Å²	131	89.6 Å²	89.6	79%	0.794	47%	0.469	S	S	*	.	S	Bend	trans	-69.6	97.8	-178.4	176.8	0	0	0	0	109.5
260	D	28.8	Very low	40.6	Very low	128 Å²	128	90.1 Å²	90.1	68%	0.684	48%	0.48	S	S	*	.			trans	-174.4	70.5	144.7	-98.2	-24.9	0	0	0	106.8	Q258 E262 V264	Q258-D260 PolarHBondContact O-N 2.91Å; D260-E262 PolarHBondContact O-N 2.87Å; D260-V264 WeakPolarHBondContact O-CB 3.5Å; D260-V264 WeakPolarHBondContact O-CG2 3.24Å
261	V	38.7	Very low	39.6	Very low	91 Å²	91	93.9 Å²	93.9	55%	0.552	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-4.8	-145.4	178.2	0	0	0	0	114.8	M265	V261-M265 HydrophobicContact CG1-CG 4.12Å; V261-M265 HydrophobicContact CG1-SD 3.66Å; V261-M265 WeakPolarHBondContact O-CB 3.38Å; V261-M265 WeakPolarHBondContact O-CG 3.27Å
262	E	33.2	Very low	39.1	Very low	157 Å²	157	97.2 Å²	97.2	73%	0.734	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-46.4	-174.4	-133.3	169.2	-177.4	0	0	113.7	D260 Q266	D260-E262 PolarHBondContact O-N 2.87Å; E262-Q266 WeakPolarHBondContact O-CB 3.39Å; E262-Q266 VanDerWaalsContact O-CG 3.27Å; E262-Q266 WeakPolarHBondContact O-CG 3.46Å; E262-Q266 PolarHBondContact O-N 2.97Å
263	L	33.6	Very low	38.7	Very low	127 Å²	127	98.4 Å²	98.4	67%	0.665	51%	0.51	S	S	*	.	H	α-helix	trans	-81.6	-37	-179.6	-153.5	84.7	0	0	0	112.2	Q266 L267	L263-Q266 PolarHBondContact O-N 2.66Å; L263-L267 PolarHBondContact O-N 2.94Å; L263-L267 VanDerWaalsContact O-N 3.09Å
264	V	32.5	Very low	38.5	Very low	75 Å²	75	100.2 Å²	100.2	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-71.6	-39.8	175.4	-178	0	0	0	0	109.7	D260 F268	D260-V264 WeakPolarHBondContact O-CB 3.5Å; D260-V264 WeakPolarHBondContact O-CG2 3.24Å; V264-F268 HydrophobicContact CG1-CD2 3.45Å; V264-F268 VanDerWaalsContact CG1-CD2 3.45Å; V264-F268 HydrophobicContact CG1-CE2 3.78Å; V264-F268 HydrophobicContact CG1-CG 4.33Å; V264-F268 WeakPolarHBondContact O-CB 3.09Å; V264-F268 WeakPolarHBondContact O-CD2 3.25Å; V264-F268 PolarHBondContact O-N 2.8Å
265	M	34.6	Very low	38.4	Very low	89 Å²	89	102.7 Å²	102.7	44%	0.438	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-43.6	171	-74.3	-158.6	70.1	0	0	111.5	V261 L267 F268 Q269	V261-M265 HydrophobicContact CG1-CG 4.12Å; V261-M265 HydrophobicContact CG1-SD 3.66Å; V261-M265 WeakPolarHBondContact O-CB 3.38Å; V261-M265 WeakPolarHBondContact O-CG 3.27Å; M265-L267 PolarHBondContact O-N 2.91Å; M265-F268 PolarHBondContact O-N 2.88Å; M265-Q269 WeakPolarHBondContact O-CA 3.22Å; M265-Q269 WeakPolarHBondContact O-CB 3.49Å; M265-Q269 PolarHBondContact O-N 3.49Å
266	Q	34.2	Very low	38.6	Very low	131 Å²	131	100.5 Å²	100.5	61%	0.612	51%	0.513	S	S	*	.	H	α-helix	trans	-62.6	-40.1	179.1	-76.7	176.4	3.9	0	0	113.7	E262 L263 S270	E262-Q266 WeakPolarHBondContact O-CB 3.39Å; E262-Q266 VanDerWaalsContact O-CG 3.27Å; E262-Q266 WeakPolarHBondContact O-CG 3.46Å; E262-Q266 PolarHBondContact O-N 2.97Å; L263-Q266 PolarHBondContact O-N 2.66Å; Q266-S270 PolarHBondContact O-N 3.42Å
267	L	31.1	Very low	39.2	Very low	116 Å²	116	95.5 Å²	95.5	61%	0.607	49%	0.489	S	S	*	.	H	α-helix	trans	-77.7	-36.4	178.4	-81	160	0	0	0	113.4	L263 M265 S270 F271	L263-L267 PolarHBondContact O-N 2.94Å; L263-L267 VanDerWaalsContact O-N 3.09Å; M265-L267 PolarHBondContact O-N 2.91Å; L267-S270 PolarHBondContact O-OG 3.28Å; L267-F271 WeakPolarHBondContact O-CB 3.03Å; L267-F271 PolarHBondContact O-N 3.42Å
268	F	33.8	Very low	39.8	Very low	101 Å²	101	93.5 Å²	93.5	44%	0.443	48%	0.482	S	S	.	.	H	α-helix	trans	-78.6	-33.8	175.8	-87.9	-100.1	0	0	0	112.5	V264 M265 F271 Y272	V264-F268 HydrophobicContact CG1-CD2 3.45Å; V264-F268 VanDerWaalsContact CG1-CD2 3.45Å; V264-F268 HydrophobicContact CG1-CE2 3.78Å; V264-F268 HydrophobicContact CG1-CG 4.33Å; V264-F268 WeakPolarHBondContact O-CB 3.09Å; V264-F268 WeakPolarHBondContact O-CD2 3.25Å; V264-F268 PolarHBondContact O-N 2.8Å; M265-F268 PolarHBondContact O-N 2.88Å; F268-F271 PolarHBondContact O-N 3.44Å; F268-Y272 HydrophobicContact CD1-CD2 4.25Å; F268-Y272 HydrophobicContact CD1-CE2 4.31Å; F268-Y272 VanDerWaalsContact O-CB 3.29Å; F268-Y272 WeakPolarHBondContact O-CB 3.36Å; F268-Y272 PolarHBondContact O-N 2.94Å
269	Q	42.2	Very low	40.3	Very low	76 Å²	76	88.4 Å²	88.4	36%	0.355	46%	0.459	S	S	.	.	H	α-helix	trans	-69.6	-38.8	178.1	-165.7	162.2	6.6	0	0	110	M265 F271 E273	M265-Q269 WeakPolarHBondContact O-CA 3.22Å; M265-Q269 WeakPolarHBondContact O-CB 3.49Å; M265-Q269 PolarHBondContact O-N 3.49Å; Q269-F271 VanDerWaalsContact C-N 3.33Å; Q269-F271 PolarHBondContact O-N 3.11Å; Q269-E273 HydrophobicContact CG-CG 3.82Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.31Å; Q269-E273 PolarHBondContact NE2-OE1 3.44Å; Q269-E273 VanDerWaalsContact NE2-OE1 3.1Å; Q269-E273 WeakPolarHBondContact O-CA 3.33Å; Q269-E273 WeakPolarHBondContact O-CB 3.31Å; Q269-E273 VanDerWaalsContact O-CG 3.23Å; Q269-E273 WeakPolarHBondContact O-CG 3.44Å; Q269-E273 PolarHBondContact O-N 3.18Å
270	S	39.3	Very low	41.5	Very low	68 Å²	68	82.9 Å²	82.9	48%	0.476	43%	0.425	S	S	.	.	H	α-helix	trans	-64.7	-37.1	171.3	86.6	0	0	0	0	112.4	Q266 L267 T274	Q266-S270 PolarHBondContact O-N 3.42Å; L267-S270 PolarHBondContact O-OG 3.28Å; S270-T274 WeakPolarHBondContact O-CB 3.29Å; S270-T274 PolarHBondContact O-N 3.33Å; S270-T274 PolarHBondContact O-OG1 3.38Å
271	F	39.5	Very low	42.7	Very low	104 Å²	104	80.4 Å²	80.4	46%	0.456	41%	0.412	S	S	.	.	H	α-helix	trans	-75.2	-43.3	179.9	-164.9	-92.1	0	0	0	113	L267 F268 Q269 K275	L267-F271 WeakPolarHBondContact O-CB 3.03Å; L267-F271 PolarHBondContact O-N 3.42Å; F268-F271 PolarHBondContact O-N 3.44Å; Q269-F271 VanDerWaalsContact C-N 3.33Å; Q269-F271 PolarHBondContact O-N 3.11Å; F271-K275 HydrophobicContact CD1-CD 4.28Å; F271-K275 HydrophobicContact CD2-CD 4.24Å; F271-K275 HydrophobicContact CE1-CD 3.95Å; F271-K275 HydrophobicContact CE2-CD 3.92Å; F271-K275 HydrophobicContact CG-CD 4.42Å; F271-K275 HydrophobicContact CZ-CD 3.77Å; F271-K275 VanDerWaalsContact O-CB 3.25Å; F271-K275 WeakPolarHBondContact O-CB 3.46Å; F271-K275 WeakPolarHBondContact O-CG 3.41Å; F271-K275 PolarHBondContact O-N 3.26Å
272	Y	46.8	Very low	43.2	Very low	79 Å²	79	79.8 Å²	79.8	31%	0.31	41%	0.411	S	S	.	.	H	α-helix	trans	-74.8	-46.6	177.4	-102.1	-96.3	0	0	0	112.1	V251 F268 T274 L276	V251-Y272 WeakPolarHBondContact CG1-OH 3.44Å; F268-Y272 HydrophobicContact CD1-CD2 4.25Å; F268-Y272 HydrophobicContact CD1-CE2 4.31Å; F268-Y272 VanDerWaalsContact O-CB 3.29Å; F268-Y272 WeakPolarHBondContact O-CB 3.36Å; F268-Y272 PolarHBondContact O-N 2.94Å; Y272-T274 VanDerWaalsContact C-N 3.32Å; Y272-T274 PolarHBondContact O-N 3.3Å; Y272-L276 HydrophobicContact CD1-CB 4.28Å; Y272-L276 HydrophobicContact CD1-CD2 4.23Å; Y272-L276 WeakPolarHBondContact O-CA 3.45Å; Y272-L276 WeakPolarHBondContact O-CB 3.31Å; Y272-L276 PolarHBondContact O-N 2.79Å
273	E	48.3	Very low	44	Very low	49 Å²	49	74 Å²	74	23%	0.229	38%	0.384	C	S	.	.	H	α-helix	trans	-68.5	-29.8	-176.8	-69.2	-174.5	162.3	0	0	112.4	Q269 Q277	Q269-E273 HydrophobicContact CG-CG 3.82Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.31Å; Q269-E273 PolarHBondContact NE2-OE1 3.44Å; Q269-E273 VanDerWaalsContact NE2-OE1 3.1Å; Q269-E273 WeakPolarHBondContact O-CA 3.33Å; Q269-E273 WeakPolarHBondContact O-CB 3.31Å; Q269-E273 VanDerWaalsContact O-CG 3.23Å; Q269-E273 WeakPolarHBondContact O-CG 3.44Å; Q269-E273 PolarHBondContact O-N 3.18Å; E273-Q277 WeakPolarHBondContact O-CB 3.06Å
274	T	48.2	Very low	45.4	Very low	85 Å²	85	72.8 Å²	72.8	52%	0.521	38%	0.378	S	S	.	.	H	α-helix	trans	-84.9	-45.5	175.2	56.1	0	0	0	0	112.1	S270 Y272 V278	S270-T274 WeakPolarHBondContact O-CB 3.29Å; S270-T274 PolarHBondContact O-N 3.33Å; S270-T274 PolarHBondContact O-OG1 3.38Å; Y272-T274 VanDerWaalsContact C-N 3.32Å; Y272-T274 PolarHBondContact O-N 3.3Å; T274-V278 WeakPolarHBondContact O-CB 3.32Å; T274-V278 WeakPolarHBondContact O-CG2 2.8Å; T274-V278 PolarHBondContact O-N 3.4Å
275	K	49.2	Very low	46.7	Very low	80 Å²	80	69.6 Å²	69.6	35%	0.348	36%	0.359	S	S	.	.	H	α-helix	trans	-82	-42.6	-173.7	-65.4	-174.8	172.8	-169.9	0	113.4	E223 F271 Q277 V278 L279	E223-K275 IonicContact OE2-NZ 3.91Å; F271-K275 HydrophobicContact CD1-CD 4.28Å; F271-K275 HydrophobicContact CD2-CD 4.24Å; F271-K275 HydrophobicContact CE1-CD 3.95Å; F271-K275 HydrophobicContact CE2-CD 3.92Å; F271-K275 HydrophobicContact CG-CD 4.42Å; F271-K275 HydrophobicContact CZ-CD 3.77Å; F271-K275 VanDerWaalsContact O-CB 3.25Å; F271-K275 WeakPolarHBondContact O-CB 3.46Å; F271-K275 WeakPolarHBondContact O-CG 3.41Å; F271-K275 PolarHBondContact O-N 3.26Å; K275-Q277 VanDerWaalsContact C-N 3.25Å; K275-Q277 PolarHBondContact O-N 2.79Å; K275-V278 PolarHBondContact O-N 2.98Å; K275-L279 WeakPolarHBondContact O-CB 3.4Å; K275-L279 WeakPolarHBondContact O-CD1 3.49Å; K275-L279 WeakPolarHBondContact O-CG 3.48Å; K275-L279 PolarHBondContact O-N 3.36Å
276	L	50.5	Low	48.2	Very low	33 Å²	33	66.9 Å²	66.9	17%	0.173	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-36.2	174.4	-163	81.2	0	0	0	110	Y272 L279 L280 L313 L319	Y272-L276 HydrophobicContact CD1-CB 4.28Å; Y272-L276 HydrophobicContact CD1-CD2 4.23Å; Y272-L276 WeakPolarHBondContact O-CA 3.45Å; Y272-L276 WeakPolarHBondContact O-CB 3.31Å; Y272-L276 PolarHBondContact O-N 2.79Å; L276-L279 CarbonylContact O-C 3.59Å; L276-L279 WeakPolarHBondContact O-CB 3.09Å; L276-L279 PolarHBondContact O-N 3.24Å; L276-L280 HydrophobicContact CD2-CD1 3.85Å; L276-L280 HydrophobicContact CG-CD1 3.79Å; L276-L280 HydrophobicContact CG-CG 4.23Å; L276-L280 VanDerWaalsContact O-CB 3.32Å; L276-L280 WeakPolarHBondContact O-CB 3.2Å; L276-L280 WeakPolarHBondContact O-CG 3.26Å; L276-L280 PolarHBondContact O-N 3.23Å; L276-L313 HydrophobicContact CD2-CD2 4.4Å; L276-L319 HydrophobicContact CD2-CD1 4.26Å
277	Q	53	Low	49.7	Very low	16 Å²	16	62.2 Å²	62.2	8%	0.075	33%	0.329	C	S	.	.	H	α-helix	trans	-64.1	-48.2	174.3	-175.6	63.3	37.5	0	0	112.3	E273 K275 L279 L280 D281 I318	E273-Q277 WeakPolarHBondContact O-CB 3.06Å; K275-Q277 VanDerWaalsContact C-N 3.25Å; K275-Q277 PolarHBondContact O-N 2.79Å; Q277-L279 PolarHBondContact O-N 2.71Å; Q277-L280 PolarHBondContact O-N 3.14Å; Q277-D281 PolarHBondContact NE2-OD1 2.88Å; Q277-D281 PolarHBondContact NE2-OD2 2.73Å; Q277-D281 WeakPolarHBondContact O-CB 3.18Å; Q277-D281 PolarHBondContact O-N 2.96Å; Q277-I318 HydrophobicContact CG-CG2 4.06Å; Q277-I318 VanDerWaalsContact OE1-CG2 3.28Å
278	V	50.4	Low	51.3	Low	99 Å²	99	58.8 Å²	58.8	60%	0.6	31%	0.308	S	S	*	.	H	α-helix	trans	-58.9	-38.7	174.7	168	0	0	0	0	110.6	T274 K275 S282	T274-V278 WeakPolarHBondContact O-CB 3.32Å; T274-V278 WeakPolarHBondContact O-CG2 2.8Å; T274-V278 PolarHBondContact O-N 3.4Å; K275-V278 PolarHBondContact O-N 2.98Å; V278-S282 WeakPolarHBondContact O-CB 3.14Å; V278-S282 PolarHBondContact O-N 3.36Å; V278-S282 PolarHBondContact O-OG 3.32Å
279	L	48.7	Very low	52.9	Low	22 Å²	22	54.2 Å²	54.2	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-66.5	-49.2	175	-69.7	169.8	0	0	0	111.9	L227 K275 L276 Q277 D281 S282 F283	L227-L279 HydrophobicContact CD2-CD2 3.21Å; L227-L279 HydrophobicContact CG-CD2 3.68Å; K275-L279 WeakPolarHBondContact O-CB 3.4Å; K275-L279 WeakPolarHBondContact O-CD1 3.49Å; K275-L279 WeakPolarHBondContact O-CG 3.48Å; K275-L279 PolarHBondContact O-N 3.36Å; L276-L279 CarbonylContact O-C 3.59Å; L276-L279 WeakPolarHBondContact O-CB 3.09Å; L276-L279 PolarHBondContact O-N 3.24Å; Q277-L279 PolarHBondContact O-N 2.71Å; L279-D281 VanDerWaalsContact C-N 3.3Å; L279-D281 PolarHBondContact O-N 2.8Å; L279-S282 WeakPolarHBondContact CA-OG 3.33Å; L279-S282 PolarHBondContact O-N 3.45Å; L279-S282 PolarHBondContact O-OG 3.05Å; L279-F283 VanDerWaalsContact O-CD2 3.29Å; L279-F283 WeakPolarHBondContact O-CD2 3.47Å; L279-F283 PolarHBondContact O-N 3.1Å
280	L	54.5	Low	54.2	Low	15 Å²	15	54.9 Å²	54.9	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-67.2	-32.5	-179.1	-68.7	170.4	0	0	0	112.1	L276 Q277 N284 V285 L313 L319	L276-L280 HydrophobicContact CD2-CD1 3.85Å; L276-L280 HydrophobicContact CG-CD1 3.79Å; L276-L280 HydrophobicContact CG-CG 4.23Å; L276-L280 VanDerWaalsContact O-CB 3.32Å; L276-L280 WeakPolarHBondContact O-CB 3.2Å; L276-L280 WeakPolarHBondContact O-CG 3.26Å; L276-L280 PolarHBondContact O-N 3.23Å; Q277-L280 PolarHBondContact O-N 3.14Å; L280-N284 PolarHBondContact O-N 3.05Å; L280-V285 HydrophobicContact CD2-CB 3.72Å; L280-V285 HydrophobicContact CD2-CG1 3.74Å; L280-V285 HydrophobicContact CD2-CG2 3.69Å; L280-V285 PolarHBondContact O-N 3.11Å; L280-L313 HydrophobicContact CD1-CD2 4.43Å; L280-L319 HydrophobicContact CB-CD2 4.31Å; L280-L319 HydrophobicContact CD1-CD1 3.61Å; L280-L319 HydrophobicContact CD1-CD2 3.43Å; L280-L319 VanDerWaalsContact CD1-CD2 3.43Å; L280-L319 HydrophobicContact CD1-CG 4.18Å
281	D	54.4	Low	55.7	Low	76 Å²	76	56 Å²	56	41%	0.406	29%	0.285	S	S	.	.	H	α-helix	trans	-73	-39.4	175.1	-72.6	-10.3	0	0	0	112.2	Q277 L279 F283 K322	Q277-D281 PolarHBondContact NE2-OD1 2.88Å; Q277-D281 PolarHBondContact NE2-OD2 2.73Å; Q277-D281 WeakPolarHBondContact O-CB 3.18Å; Q277-D281 PolarHBondContact O-N 2.96Å; L279-D281 VanDerWaalsContact C-N 3.3Å; L279-D281 PolarHBondContact O-N 2.8Å; D281-F283 PolarHBondContact O-N 2.62Å; D281-K322 IonicContact OD1-NZ 2.64Å; D281-K322 PolarHBondContact OD1-NZ 2.84Å; D281-K322 IonicContact OD2-NZ 3.6Å; D281-K322 PolarHBondContact OD2-NZ 3.2Å
282	S	49	Very low	57.1	Low	77 Å²	77	51.2 Å²	51.2	54%	0.538	26%	0.264	S	S	.	.	H	α-helix	trans	-67.6	-21.4	175.9	66.1	0	0	0	0	113.5	V278 L279	V278-S282 WeakPolarHBondContact O-CB 3.14Å; V278-S282 PolarHBondContact O-N 3.36Å; V278-S282 PolarHBondContact O-OG 3.32Å; L279-S282 WeakPolarHBondContact CA-OG 3.33Å; L279-S282 PolarHBondContact O-N 3.45Å; L279-S282 PolarHBondContact O-OG 3.05Å
283	F	51.5	Low	58.2	Low	37 Å²	37	48 Å²	48	16%	0.162	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	7	-173.8	-80.7	-84.3	0	0	0	115.2	V230 K231 N234 L279 D281 V285	V230-F283 HydrophobicContact CB-CD2 4.41Å; V230-F283 HydrophobicContact CG1-CB 3.64Å; V230-F283 HydrophobicContact CG1-CD1 4.04Å; V230-F283 HydrophobicContact CG1-CD2 3.31Å; V230-F283 HydrophobicContact CG1-CE2 3.96Å; V230-F283 HydrophobicContact CG1-CG 3.38Å; K231-F283 HydrophobicContact CB-CE1 4.33Å; K231-F283 HydrophobicContact CB-CZ 4.45Å; K231-F283 HydrophobicContact CD-CZ 4.43Å; K231-F283 HydrophobicContact CG-CE1 3.66Å; K231-F283 HydrophobicContact CG-CE2 4.43Å; K231-F283 HydrophobicContact CG-CZ 3.39Å; N234-F283 WeakPolarHBondContact ND2-CD1 3.42Å; L279-F283 VanDerWaalsContact O-CD2 3.29Å; L279-F283 WeakPolarHBondContact O-CD2 3.47Å; L279-F283 PolarHBondContact O-N 3.1Å; D281-F283 PolarHBondContact O-N 2.62Å; F283-V285 HydrophobicContact CB-CG2 3.59Å; F283-V285 PolarHBondContact O-N 3.37Å; F283-V285 VanDerWaalsContact O-N 3.08Å
284	N	61.8	Low	59.2	Low	101 Å²	101	50.2 Å²	50.2	54%	0.54	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	37.8	-179.1	-153.1	6.9	0	0	0	112.6	L280 T286 S287 R288	L280-N284 PolarHBondContact O-N 3.05Å; N284-T286 PolarHBondContact O-N 3.4Å; N284-S287 PolarHBondContact ND2-OG 2.94Å; N284-S287 PolarHBondContact O-N 3.48Å; N284-S287 PolarHBondContact O-OG 3.22Å; N284-S287 WeakPolarHBondContact OD1-CB 3.3Å; N284-S287 PolarHBondContact OD1-OG 2.78Å; N284-R288 PolarHBondContact O-N 3.03Å; N284-R288 VanDerWaalsContact O-N 3.14Å
285	V	60.7	Low	60.1	Low	8 Å²	8	47.4 Å²	47.4	5%	0.048	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-30.3	-168.2	177	0	0	0	0	111.6	V230 L233 L280 F283 R288 I289	V230-V285 HydrophobicContact CG1-CG2 4.33Å; L233-V285 HydrophobicContact CD1-CG1 4.09Å; L233-V285 HydrophobicContact CD1-CG2 4.29Å; L280-V285 HydrophobicContact CD2-CB 3.72Å; L280-V285 HydrophobicContact CD2-CG1 3.74Å; L280-V285 HydrophobicContact CD2-CG2 3.69Å; L280-V285 PolarHBondContact O-N 3.11Å; F283-V285 HydrophobicContact CB-CG2 3.59Å; F283-V285 PolarHBondContact O-N 3.37Å; F283-V285 VanDerWaalsContact O-N 3.08Å; V285-R288 PolarHBondContact O-N 2.86Å; V285-I289 HydrophobicContact CG1-CD1 3.82Å; V285-I289 HydrophobicContact CG1-CG1 4.17Å; V285-I289 WeakPolarHBondContact O-CB 2.9Å; V285-I289 WeakPolarHBondContact O-CG1 3.01Å; V285-I289 PolarHBondContact O-N 3.08Å
286	T	64.4	Low	60.6	Low	32 Å²	32	53 Å²	53	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-40.1	173.5	33.2	0	0	0	0	113.2	N284 R288 R290 K322 L323	N284-T286 PolarHBondContact O-N 3.4Å; T286-R288 VanDerWaalsContact C-N 3.34Å; T286-R290 PolarHBondContact O-N 2.68Å; T286-K322 HydrophobicContact CG2-CB 3.85Å; T286-L323 HydrophobicContact CG2-CD2 3.8Å; T286-L323 HydrophobicContact CG2-CG 4.2Å
287	S	66.6	Low	60.9	Low	32 Å²	32	54.5 Å²	54.5	22%	0.224	30%	0.298	C	S	.	.	H	α-helix	trans	-67.1	-40.1	173.8	80	0	0	0	0	110.6	N284 R290 E291	N284-S287 PolarHBondContact ND2-OG 2.94Å; N284-S287 PolarHBondContact O-N 3.48Å; N284-S287 PolarHBondContact O-OG 3.22Å; N284-S287 WeakPolarHBondContact OD1-CB 3.3Å; N284-S287 PolarHBondContact OD1-OG 2.78Å; S287-R290 WeakPolarHBondContact O-CB 3.4Å; S287-R290 PolarHBondContact O-N 3.49Å; S287-E291 WeakPolarHBondContact O-CG 3.47Å; S287-E291 PolarHBondContact O-N 2.93Å
288	R	64.4	Low	61.5	Low	45 Å²	45	54.8 Å²	54.8	17%	0.17	30%	0.3	C	S	.	.	H	α-helix	trans	-67.5	-39	179.1	-167.9	58.1	172.4	156	2.7	112.5	D235 N284 V285 T286 R290 E291 L292	D235-R288 PolarHBondContact O-NH2 3.45Å; N284-R288 PolarHBondContact O-N 3.03Å; N284-R288 VanDerWaalsContact O-N 3.14Å; V285-R288 PolarHBondContact O-N 2.86Å; T286-R288 VanDerWaalsContact C-N 3.34Å; R288-R290 VanDerWaalsContact C-N 3.29Å; R288-R290 PolarHBondContact O-N 2.85Å; R288-E291 VanDerWaalsContact CD-OE2 3.29Å; R288-E291 WeakPolarHBondContact CD-OE2 3.43Å; R288-E291 IonicContact CZ-OE2 2.72Å; R288-E291 IonicContact NE-OE2 2.81Å; R288-E291 IonicContact NH1-OE2 3.72Å; R288-E291 PolarHBondContact NH1-OE2 3.31Å; R288-E291 PolarHBondContact O-N 3.33Å; R288-L292 HydrophobicContact CG-CD1 4.43Å; R288-L292 WeakPolarHBondContact O-CB 3.29Å; R288-L292 WeakPolarHBondContact O-CD1 3.32Å; R288-L292 WeakPolarHBondContact O-CG 3.37Å; R288-L292 PolarHBondContact O-N 3.46Å
289	I	68.3	Low	62.3	Low	4 Å²	4	53.4 Å²	53.4	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-42.9	171.8	-74.2	168.2	0	0	0	109.9	V285 L292 L293 L306 I310 L313 L323	V285-I289 HydrophobicContact CG1-CD1 3.82Å; V285-I289 HydrophobicContact CG1-CG1 4.17Å; V285-I289 WeakPolarHBondContact O-CB 2.9Å; V285-I289 WeakPolarHBondContact O-CG1 3.01Å; V285-I289 PolarHBondContact O-N 3.08Å; I289-L292 PolarHBondContact O-N 2.94Å; I289-L293 HydrophobicContact CG2-CD1 4.15Å; I289-L293 WeakPolarHBondContact O-CG 3.22Å; I289-L293 PolarHBondContact O-N 3.47Å; I289-L306 HydrophobicContact CG1-CD1 4.3Å; I289-L306 HydrophobicContact CG2-CD1 4.23Å; I289-I310 HydrophobicContact CG2-CD1 3.73Å; I289-I310 HydrophobicContact CG2-CG1 3.89Å; I289-L313 HydrophobicContact CD1-CD1 4.34Å; I289-L323 HydrophobicContact CD1-CD2 4Å
290	R	69.2	Low	63.3	Low	90 Å²	90	56.2 Å²	56.2	34%	0.34	31%	0.307	S	S	.	.	H	α-helix	trans	-63.1	-48.5	176.5	-170.6	-172.3	-61.5	167.1	7.1	112.1	T286 S287 R288 L292 L293 E294 S325 Q329	T286-R290 PolarHBondContact O-N 2.68Å; S287-R290 WeakPolarHBondContact O-CB 3.4Å; S287-R290 PolarHBondContact O-N 3.49Å; R288-R290 VanDerWaalsContact C-N 3.29Å; R288-R290 PolarHBondContact O-N 2.85Å; R290-L292 PolarHBondContact O-N 3.34Å; R290-L293 WeakPolarHBondContact O-CB 3.26Å; R290-L293 PolarHBondContact O-N 3.02Å; R290-E294 VanDerWaalsContact CG-OE1 3.32Å; R290-E294 WeakPolarHBondContact CG-OE1 3.35Å; R290-E294 WeakPolarHBondContact O-CG 3.33Å; R290-E294 PolarHBondContact O-N 3.04Å; R290-S325 PolarHBondContact NH2-OG 3.21Å; R290-Q329 HydrophobicContact CG-CG 4.31Å
291	E	70.2	Confident	64	Low	92 Å²	92	60.7 Å²	60.7	43%	0.43	33%	0.331	S	S	.	.	H	α-helix	trans	-56.5	-38	175.3	-73.5	170.2	-162.1	0	0	111.9	S287 R288 E294 A295	S287-E291 WeakPolarHBondContact O-CG 3.47Å; S287-E291 PolarHBondContact O-N 2.93Å; R288-E291 VanDerWaalsContact CD-OE2 3.29Å; R288-E291 WeakPolarHBondContact CD-OE2 3.43Å; R288-E291 IonicContact CZ-OE2 2.72Å; R288-E291 IonicContact NE-OE2 2.81Å; R288-E291 IonicContact NH1-OE2 3.72Å; R288-E291 PolarHBondContact NH1-OE2 3.31Å; R288-E291 PolarHBondContact O-N 3.33Å; E291-E294 PolarHBondContact O-N 3.06Å; E291-A295 WeakPolarHBondContact O-CB 3.42Å; E291-A295 PolarHBondContact O-N 3.19Å
292	L	68.6	Low	64.5	Low	4 Å²	4	57.2 Å²	57.2	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-70.1	-40.9	175.8	-71.4	165.9	0	0	0	112.1	I241 L245 R288 I289 R290 E294 A295 L298 L306	I241-L292 HydrophobicContact CB-CD1 4.5Å; I241-L292 HydrophobicContact CD1-CD1 4.37Å; I241-L292 HydrophobicContact CD1-CD2 3.91Å; I241-L292 HydrophobicContact CG2-CD1 3.44Å; I241-L292 VanDerWaalsContact CG2-CD1 3.44Å; L245-L292 HydrophobicContact CD1-CD1 4.37Å; R288-L292 HydrophobicContact CG-CD1 4.43Å; R288-L292 WeakPolarHBondContact O-CB 3.29Å; R288-L292 WeakPolarHBondContact O-CD1 3.32Å; R288-L292 WeakPolarHBondContact O-CG 3.37Å; R288-L292 PolarHBondContact O-N 3.46Å; I289-L292 PolarHBondContact O-N 2.94Å; R290-L292 PolarHBondContact O-N 3.34Å; L292-E294 PolarHBondContact O-N 3.07Å; L292-A295 WeakPolarHBondContact O-CB 3.46Å; L292-A295 PolarHBondContact O-N 2.87Å; L292-L298 HydrophobicContact CB-CD1 4.23Å; L292-L298 HydrophobicContact CD2-CD1 4.48Å; L292-L298 WeakPolarHBondContact O-CD1 3.49Å; L292-L306 HydrophobicContact CB-CD2 3.74Å; L292-L306 HydrophobicContact CD1-CD1 4.38Å
293	L	70.8	Confident	65.6	Low	11 Å²	11	54 Å²	54	6%	0.058	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-32.4	174.4	-71.2	169.6	0	0	0	111.9	I289 R290 L306 I307 I310 C326 Q329 L330 L333	I289-L293 HydrophobicContact CG2-CD1 4.15Å; I289-L293 WeakPolarHBondContact O-CG 3.22Å; I289-L293 PolarHBondContact O-N 3.47Å; R290-L293 WeakPolarHBondContact O-CB 3.26Å; R290-L293 PolarHBondContact O-N 3.02Å; L293-L306 HydrophobicContact CD2-CD2 3.6Å; L293-L306 HydrophobicContact CD2-CG 4.16Å; L293-L306 HydrophobicContact CG-CD2 3.8Å; L293-I307 HydrophobicContact CD2-CG1 4.45Å; L293-I310 HydrophobicContact CD1-CD1 3.84Å; L293-I310 HydrophobicContact CD2-CD1 4.23Å; L293-I310 HydrophobicContact CG-CD1 4.42Å; L293-C326 HydrophobicContact CD1-CB 3.96Å; L293-Q329 HydrophobicContact CB-CB 4.17Å; L293-Q329 HydrophobicContact CD1-CB 4.16Å; L293-L330 HydrophobicContact CD2-CD2 4.34Å; L293-L333 HydrophobicContact CB-CD1 4.35Å; L293-L333 HydrophobicContact CD2-CD1 3.6Å
294	E	70.1	Confident	66.7	Low	95 Å²	95	53.3 Å²	53.3	44%	0.444	29%	0.288	S	S	.	.	H	α-helix	trans	-83.9	-12.9	177.9	-68.9	169.3	-172.2	0	0	112.9	R290 E291 L292 H296 Q329	R290-E294 VanDerWaalsContact CG-OE1 3.32Å; R290-E294 WeakPolarHBondContact CG-OE1 3.35Å; R290-E294 WeakPolarHBondContact O-CG 3.33Å; R290-E294 PolarHBondContact O-N 3.04Å; E291-E294 PolarHBondContact O-N 3.06Å; L292-E294 PolarHBondContact O-N 3.07Å; E294-H296 PolarHBondContact O-N 3.34Å; E294-H296 VanDerWaalsContact O-N 3.1Å; E294-Q329 HydrophobicContact CG-CG 4.06Å; E294-Q329 PolarHBondContact OE1-NE2 3.4Å
295	A	65.8	Low	67.1	Low	26 Å²	26	51 Å²	51	22%	0.215	28%	0.275	C	S	.	.			trans	-72.7	105.8	-178	0	0	0	0	0	112	E291 L292 G297 L298	E291-A295 WeakPolarHBondContact O-CB 3.42Å; E291-A295 PolarHBondContact O-N 3.19Å; L292-A295 WeakPolarHBondContact O-CB 3.46Å; L292-A295 PolarHBondContact O-N 2.87Å; A295-G297 PolarHBondContact O-N 2.9Å; A295-L298 HydrophobicContact CB-CG 4.34Å; A295-L298 PolarHBondContact O-N 3.4Å
296	H	59.4	Low	67.8	Low	198 Å²	198	50.7 Å²	50.7	92%	0.917	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	8.5	179.3	-61.6	-61.8	0	0	0	116.5	E294	E294-H296 PolarHBondContact O-N 3.34Å; E294-H296 VanDerWaalsContact O-N 3.1Å
297	G	58	Low	68.5	Low	64 Å²	64	49.1 Å²	49.1	66%	0.66	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	5.1	-178.2	0	0	0	0	0	115.2	A295	A295-G297 PolarHBondContact O-N 2.9Å
298	L	65.5	Low	68.9	Low	22 Å²	22	49.6 Å²	49.6	12%	0.115	26%	0.263	C	S	.	.			trans	-79.4	135.9	178.4	-69.6	-178.4	0	0	0	111.5	H238 L242 L292 A295 A302 L303 L306	H238-L298 HydrophobicContact CB-CD2 3.66Å; L242-L298 HydrophobicContact CD1-CD2 4.32Å; L292-L298 HydrophobicContact CB-CD1 4.23Å; L292-L298 HydrophobicContact CD2-CD1 4.48Å; L292-L298 WeakPolarHBondContact O-CD1 3.49Å; A295-L298 HydrophobicContact CB-CG 4.34Å; A295-L298 PolarHBondContact O-N 3.4Å; L298-A302 HydrophobicContact CB-CB 4.17Å; L298-A302 HydrophobicContact CD2-CB 4.23Å; L298-L303 HydrophobicContact CB-CD2 4.03Å; L298-L303 HydrophobicContact CB-CG 3.98Å; L298-L303 HydrophobicContact CD1-CD2 3.81Å; L298-L306 HydrophobicContact CD1-CD2 4.42Å
299	S	67.1	Low	69.3	Low	70 Å²	70	47.7 Å²	47.7	49%	0.49	26%	0.257	S	S	.	.			trans	-63.8	154	171.1	73	0	0	0	0	111	N301 A302 L303	S299-N301 PolarHBondContact O-N 3.36Å; S299-N301 VanDerWaalsContact O-N 3.16Å; S299-A302 WeakPolarHBondContact O-CA 3.23Å; S299-A302 WeakPolarHBondContact O-CB 3.35Å; S299-A302 PolarHBondContact O-N 2.96Å; S299-A302 WeakPolarHBondContact OG-CB 3.2Å; S299-A302 PolarHBondContact OG-N 2.94Å; S299-L303 PolarHBondContact O-N 2.85Å
300	Q	70.1	Confident	69.7	Low	81 Å²	81	47.5 Å²	47.5	38%	0.379	26%	0.256	S	S	.	.	H	α-helix	trans	-58.2	-33.6	178	-159.3	-161.1	-73.2	0	0	112.8	L303 I304 S340 F343	Q300-L303 PolarHBondContact O-N 2.97Å; Q300-I304 VanDerWaalsContact O-CG1 3.26Å; Q300-I304 WeakPolarHBondContact O-CG1 3.48Å; Q300-I304 PolarHBondContact O-N 3.27Å; Q300-S340 PolarHBondContact NE2-OG 3.32Å; Q300-F343 HydrophobicContact CG-CD2 4.08Å
301	N	69	Low	70.2	Confident	110 Å²	110	43.6 Å²	43.6	59%	0.588	24%	0.242	S	C	*	.	H	α-helix	trans	-68	-37.7	174.7	-72.3	-19.6	0	0	0	112	S299 L303 I304 I305	S299-N301 PolarHBondContact O-N 3.36Å; S299-N301 VanDerWaalsContact O-N 3.16Å; N301-L303 VanDerWaalsContact C-N 3.35Å; N301-I304 PolarHBondContact O-N 3.45Å; N301-I305 VanDerWaalsContact O-CG1 3.31Å; N301-I305 WeakPolarHBondContact O-CG1 3.29Å; N301-I305 PolarHBondContact O-N 2.8Å
302	A	64.6	Low	70.3	Confident	3 Å²	3	40 Å²	40	3%	0.025	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-46	174.7	0	0	0	0	0	111.4	L242 L298 S299 I305 L306	L242-A302 HydrophobicContact CD1-CB 3.19Å; L242-A302 HydrophobicContact CD2-CB 3.55Å; L242-A302 VanDerWaalsContact CD2-O 3.23Å; L242-A302 WeakPolarHBondContact CD2-O 3.15Å; L242-A302 HydrophobicContact CG-CB 3.96Å; L298-A302 HydrophobicContact CB-CB 4.17Å; L298-A302 HydrophobicContact CD2-CB 4.23Å; S299-A302 WeakPolarHBondContact O-CA 3.23Å; S299-A302 WeakPolarHBondContact O-CB 3.35Å; S299-A302 PolarHBondContact O-N 2.96Å; S299-A302 WeakPolarHBondContact OG-CB 3.2Å; S299-A302 PolarHBondContact OG-N 2.94Å; A302-I305 PolarHBondContact O-N 3.09Å; A302-L306 WeakPolarHBondContact O-CB 3.23Å; A302-L306 PolarHBondContact O-N 2.98Å
303	L	72.6	Confident	70.5	Confident	9 Å²	9	41.1 Å²	41.1	5%	0.047	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-41.5	176.5	-67.2	169.3	0	0	0	111.9	L298 S299 Q300 N301 I305 L306 I307 L333 F343	L298-L303 HydrophobicContact CB-CD2 4.03Å; L298-L303 HydrophobicContact CB-CG 3.98Å; L298-L303 HydrophobicContact CD1-CD2 3.81Å; S299-L303 PolarHBondContact O-N 2.85Å; Q300-L303 PolarHBondContact O-N 2.97Å; N301-L303 VanDerWaalsContact C-N 3.35Å; L303-I305 VanDerWaalsContact C-N 3.32Å; L303-I305 PolarHBondContact O-N 3.06Å; L303-L306 WeakPolarHBondContact O-CB 3.08Å; L303-L306 PolarHBondContact O-N 3.21Å; L303-I307 WeakPolarHBondContact O-CB 3.3Å; L303-I307 WeakPolarHBondContact O-CD1 3.48Å; L303-I307 WeakPolarHBondContact O-CG1 3.38Å; L303-I307 PolarHBondContact O-N 3.42Å; L303-L333 HydrophobicContact CD1-CD2 4.45Å; L303-F343 HydrophobicContact CB-CD2 4.37Å; L303-F343 HydrophobicContact CB-CE2 3.62Å; L303-F343 HydrophobicContact CD1-CE2 4.01Å; L303-F343 HydrophobicContact CG-CE2 4.45Å
304	I	74.3	Confident	70.8	Confident	22 Å²	22	40.6 Å²	40.6	11%	0.113	23%	0.23	C	C	.	.	H	α-helix	trans	-58.3	-45.9	175.1	-69.8	165	0	0	0	110.9	Q300 N301 L306 I307 D308 R342 F343 A346	Q300-I304 VanDerWaalsContact O-CG1 3.26Å; Q300-I304 WeakPolarHBondContact O-CG1 3.48Å; Q300-I304 PolarHBondContact O-N 3.27Å; N301-I304 PolarHBondContact O-N 3.45Å; I304-L306 VanDerWaalsContact C-N 3.34Å; I304-L306 PolarHBondContact O-N 3.28Å; I304-I307 PolarHBondContact O-N 2.61Å; I304-D308 WeakPolarHBondContact O-CB 3.05Å; I304-D308 PolarHBondContact O-N 3.39Å; I304-R342 HydrophobicContact CD1-CB 4.02Å; I304-F343 HydrophobicContact CD1-CB 4.33Å; I304-F343 HydrophobicContact CG1-CB 4.17Å; I304-F343 HydrophobicContact CG1-CD2 3.89Å; I304-F343 HydrophobicContact CG1-CG 4.48Å; I304-A346 HydrophobicContact CG2-CB 4.33Å
305	I	69.7	Low	70.9	Confident	53 Å²	53	38.5 Å²	38.5	27%	0.272	23%	0.225	S	C	.	.	H	α-helix	trans	-60.8	-45.4	177.6	-69.9	166.3	0	0	0	110.5	T246 N301 A302 L303 D308 C309	T246-I305 VanDerWaalsContact OG1-CG2 3.28Å; T246-I305 WeakPolarHBondContact OG1-CG2 3.44Å; N301-I305 VanDerWaalsContact O-CG1 3.31Å; N301-I305 WeakPolarHBondContact O-CG1 3.29Å; N301-I305 PolarHBondContact O-N 2.8Å; A302-I305 PolarHBondContact O-N 3.09Å; L303-I305 VanDerWaalsContact C-N 3.32Å; L303-I305 PolarHBondContact O-N 3.06Å; I305-D308 PolarHBondContact O-N 3.43Å; I305-C309 PolarHBondContact O-N 2.74Å; I305-C309 PolarHBondContact O-SG 3.08Å
306	L	75	Confident	71	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-47.2	178.5	-178.5	64.6	0	0	0	111.5	L245 I289 L292 L293 L298 A302 L303 I304 C309 I310	L245-L306 HydrophobicContact CD1-CD1 3.45Å; L245-L306 VanDerWaalsContact CD1-CD1 3.45Å; I289-L306 HydrophobicContact CG1-CD1 4.3Å; I289-L306 HydrophobicContact CG2-CD1 4.23Å; L292-L306 HydrophobicContact CB-CD2 3.74Å; L292-L306 HydrophobicContact CD1-CD1 4.38Å; L293-L306 HydrophobicContact CD2-CD2 3.6Å; L293-L306 HydrophobicContact CD2-CG 4.16Å; L293-L306 HydrophobicContact CG-CD2 3.8Å; L298-L306 HydrophobicContact CD1-CD2 4.42Å; A302-L306 WeakPolarHBondContact O-CB 3.23Å; A302-L306 PolarHBondContact O-N 2.98Å; L303-L306 WeakPolarHBondContact O-CB 3.08Å; L303-L306 PolarHBondContact O-N 3.21Å; I304-L306 VanDerWaalsContact C-N 3.34Å; I304-L306 PolarHBondContact O-N 3.28Å; L306-C309 WeakPolarHBondContact O-CB 3.04Å; L306-C309 PolarHBondContact O-N 2.8Å; L306-C309 VanDerWaalsContact O-N 3.15Å; L306-I310 WeakPolarHBondContact O-CG1 3.44Å; L306-I310 PolarHBondContact O-N 2.82Å
307	I	78.4	Confident	71.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-42.2	178.4	-68	167.9	0	0	0	111.2	L293 L303 I304 C309 I310 S311 L330 F343 A346 C347 A350	L293-I307 HydrophobicContact CD2-CG1 4.45Å; L303-I307 WeakPolarHBondContact O-CB 3.3Å; L303-I307 WeakPolarHBondContact O-CD1 3.48Å; L303-I307 WeakPolarHBondContact O-CG1 3.38Å; L303-I307 PolarHBondContact O-N 3.42Å; I304-I307 PolarHBondContact O-N 2.61Å; I307-C309 VanDerWaalsContact C-N 3.28Å; I307-C309 PolarHBondContact O-N 3.1Å; I307-I310 WeakPolarHBondContact O-CB 3.32Å; I307-I310 PolarHBondContact O-N 3.31Å; I307-S311 PolarHBondContact O-N 3.1Å; I307-L330 HydrophobicContact CD1-CD2 4.39Å; I307-L330 HydrophobicContact CG1-CD2 3.88Å; I307-L330 HydrophobicContact CG2-CD2 4.48Å; I307-F343 HydrophobicContact CD1-CD2 4.26Å; I307-F343 HydrophobicContact CD1-CE1 4.22Å; I307-F343 HydrophobicContact CD1-CE2 3.63Å; I307-F343 HydrophobicContact CD1-CZ 3.59Å; I307-A346 HydrophobicContact CB-CB 4.42Å; I307-A346 HydrophobicContact CG2-CB 3.83Å; I307-A346 WeakPolarHBondContact CG2-O 3.38Å; I307-C347 HydrophobicContact CD1-CB 4.41Å; I307-C347 HydrophobicContact CG2-CB 4.47Å; I307-A350 HydrophobicContact CG2-CB 3.72Å
308	D	76	Confident	71.7	Confident	42 Å²	42	32.6 Å²	32.6	23%	0.225	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-36.8	174.2	-81	-5.4	0	0	0	111.9	K249 I304 I305 S311 T312 A346	K249-D308 HydrophobicContact CD-CB 4Å; K249-D308 IonicContact NZ-OD2 2.88Å; K249-D308 PolarHBondContact NZ-OD2 3.28Å; I304-D308 WeakPolarHBondContact O-CB 3.05Å; I304-D308 PolarHBondContact O-N 3.39Å; I305-D308 PolarHBondContact O-N 3.43Å; D308-S311 WeakPolarHBondContact O-CB 3.28Å; D308-S311 PolarHBondContact O-N 3.09Å; D308-T312 PolarHBondContact O-N 2.64Å; D308-T312 PolarHBondContact O-OG1 3.11Å; D308-A346 WeakPolarHBondContact OD1-CB 3.44Å
309	C	72.7	Confident	71.9	Confident	4 Å²	4	32.1 Å²	32.1	3%	0.027	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-45.3	174.1	-65.6	0	0	0	0	110.6	L245 I305 L306 I307 S311 T312 L313	L245-C309 PolarHBondContact O-SG 3.09Å; I305-C309 PolarHBondContact O-N 2.74Å; I305-C309 PolarHBondContact O-SG 3.08Å; L306-C309 WeakPolarHBondContact O-CB 3.04Å; L306-C309 PolarHBondContact O-N 2.8Å; L306-C309 VanDerWaalsContact O-N 3.15Å; I307-C309 VanDerWaalsContact C-N 3.28Å; I307-C309 PolarHBondContact O-N 3.1Å; C309-S311 VanDerWaalsContact C-N 3.31Å; C309-S311 PolarHBondContact O-N 2.88Å; C309-T312 PolarHBondContact O-N 2.88Å; C309-L313 WeakPolarHBondContact O-CB 3.49Å; C309-L313 VanDerWaalsContact O-CG 3.23Å; C309-L313 WeakPolarHBondContact O-CG 3.39Å; C309-L313 PolarHBondContact O-N 3.23Å
310	I	76.8	Confident	72.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-56.7	-48.3	174.5	-64.6	167.6	0	0	0	109.9	I289 L293 L306 I307 T312 L313 S314 L323 L330 A350 L354	I289-I310 HydrophobicContact CG2-CD1 3.73Å; I289-I310 HydrophobicContact CG2-CG1 3.89Å; L293-I310 HydrophobicContact CD1-CD1 3.84Å; L293-I310 HydrophobicContact CD2-CD1 4.23Å; L293-I310 HydrophobicContact CG-CD1 4.42Å; L306-I310 WeakPolarHBondContact O-CG1 3.44Å; L306-I310 PolarHBondContact O-N 2.82Å; I307-I310 WeakPolarHBondContact O-CB 3.32Å; I307-I310 PolarHBondContact O-N 3.31Å; I310-T312 VanDerWaalsContact C-N 3.3Å; I310-T312 PolarHBondContact O-N 2.86Å; I310-L313 PolarHBondContact O-N 3.44Å; I310-S314 VanDerWaalsContact O-CB 3.3Å; I310-S314 WeakPolarHBondContact O-CB 3.09Å; I310-S314 PolarHBondContact O-N 3.04Å; I310-S314 PolarHBondContact O-OG 3.28Å; I310-L323 HydrophobicContact CG2-CD1 4.47Å; I310-L330 HydrophobicContact CD1-CD2 4.4Å; I310-A350 HydrophobicContact CG2-CB 4.47Å; I310-L354 HydrophobicContact CG2-CD1 3.91Å; I310-L354 HydrophobicContact CG2-CD2 4.48Å; I310-L354 HydrophobicContact CG2-CG 4.42Å
311	S	79.2	Confident	72.2	Confident	8 Å²	8	30.4 Å²	30.4	6%	0.056	18%	0.179	C	C	.	.	H	α-helix	trans	-56.8	-44.2	177.5	-170.9	0	0	0	0	111.7	I307 D308 C309 S314 K353	I307-S311 PolarHBondContact O-N 3.1Å; D308-S311 WeakPolarHBondContact O-CB 3.28Å; D308-S311 PolarHBondContact O-N 3.09Å; C309-S311 VanDerWaalsContact C-N 3.31Å; C309-S311 PolarHBondContact O-N 2.88Å; S311-S314 PolarHBondContact O-N 2.91Å; S311-K353 WeakPolarHBondContact O-CD 3.46Å
312	T	73.5	Confident	72.2	Confident	17 Å²	17	28.8 Å²	28.8	10%	0.104	17%	0.166	C	C	.	.	H	α-helix	trans	-70.1	-44	-178.8	-45.1	0	0	0	0	111.7	S252 T253 D308 C309 I310 S314 S315	S252-T312 WeakPolarHBondContact OG-CG2 3.41Å; T253-T312 HydrophobicContact CG2-CG2 3.97Å; D308-T312 PolarHBondContact O-N 2.64Å; D308-T312 PolarHBondContact O-OG1 3.11Å; C309-T312 PolarHBondContact O-N 2.88Å; I310-T312 VanDerWaalsContact C-N 3.3Å; I310-T312 PolarHBondContact O-N 2.86Å; T312-S314 VanDerWaalsContact C-N 3.3Å; T312-S314 PolarHBondContact O-N 3.17Å; T312-S315 WeakPolarHBondContact O-CB 3.39Å; T312-S315 PolarHBondContact O-N 3.26Å; T312-S315 PolarHBondContact O-OG 3.27Å
313	L	72.6	Confident	72.7	Confident	28 Å²	28	28.8 Å²	28.8	15%	0.147	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-31.4	177.7	-67.8	171.2	0	0	0	112.6	L276 L280 I289 C309 I310 S315 S316 L319 L323	L276-L313 HydrophobicContact CD2-CD2 4.4Å; L280-L313 HydrophobicContact CD1-CD2 4.43Å; I289-L313 HydrophobicContact CD1-CD1 4.34Å; C309-L313 WeakPolarHBondContact O-CB 3.49Å; C309-L313 VanDerWaalsContact O-CG 3.23Å; C309-L313 WeakPolarHBondContact O-CG 3.39Å; C309-L313 PolarHBondContact O-N 3.23Å; I310-L313 PolarHBondContact O-N 3.44Å; L313-S315 PolarHBondContact O-N 3.22Å; L313-S315 VanDerWaalsContact O-N 3.09Å; L313-S316 PolarHBondContact O-N 3.05Å; L313-L319 HydrophobicContact CB-CD1 4.45Å; L313-L319 HydrophobicContact CD2-CD1 4.18Å; L313-L319 WeakPolarHBondContact O-CB 3.13Å; L313-L323 HydrophobicContact CB-CD1 3.63Å
314	S	76.8	Confident	72.8	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-2.9	177.6	-56.9	0	0	0	0	113.6	I310 S311 T312 S316 R320 L354	I310-S314 VanDerWaalsContact O-CB 3.3Å; I310-S314 WeakPolarHBondContact O-CB 3.09Å; I310-S314 PolarHBondContact O-N 3.04Å; I310-S314 PolarHBondContact O-OG 3.28Å; S311-S314 PolarHBondContact O-N 2.91Å; T312-S314 VanDerWaalsContact C-N 3.3Å; T312-S314 PolarHBondContact O-N 3.17Å; S314-S316 VanDerWaalsContact C-N 3.28Å; S314-R320 PolarHBondContact O-NE 3.34Å; S314-R320 PolarHBondContact O-NH2 3.16Å; S314-L354 WeakPolarHBondContact OG-CD2 2.99Å
315	S	71.3	Confident	72.9	Confident	50 Å²	50	30 Å²	30	35%	0.35	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-26.8	173.4	-44.1	0	0	0	0	111.5	T312 L313 R320 K353	T312-S315 WeakPolarHBondContact O-CB 3.39Å; T312-S315 PolarHBondContact O-N 3.26Å; T312-S315 PolarHBondContact O-OG 3.27Å; L313-S315 PolarHBondContact O-N 3.22Å; L313-S315 VanDerWaalsContact O-N 3.09Å; S315-R320 PolarHBondContact O-NH2 3.06Å; S315-R320 VanDerWaalsContact O-NH2 3.1Å; S315-K353 PolarHBondContact OG-NZ 2.93Å
316	S	68.2	Low	73.2	Confident	21 Å²	21	27.5 Å²	27.5	15%	0.147	17%	0.165	C	C	.	.	S	Bend	trans	-85.3	130.1	170.7	174.7	0	0	0	0	110.9	L313 S314 I318 L319 R320	L313-S316 PolarHBondContact O-N 3.05Å; S314-S316 VanDerWaalsContact C-N 3.28Å; S316-I318 VanDerWaalsContact C-N 3.31Å; S316-I318 PolarHBondContact O-N 3.11Å; S316-L319 PolarHBondContact O-N 3.02Å; S316-R320 VanDerWaalsContact O-CB 3.32Å; S316-R320 WeakPolarHBondContact O-CB 3.33Å; S316-R320 PolarHBondContact O-N 3.19Å
317	P	67.7	Low	73.3	Confident	69 Å²	69	27.7 Å²	27.7	45%	0.448	17%	0.166	S	C	.	.	H	α-helix	trans	-62.5	-35.8	-177.4	24.2	-33.1	0	0	0	113	R320 A321	P317-R320 WeakPolarHBondContact O-CB 3.3Å; P317-R320 PolarHBondContact O-N 3.26Å; P317-A321 PolarHBondContact O-N 3.46Å; P317-A321 VanDerWaalsContact O-N 3.09Å
318	I	65.6	Low	73.2	Confident	74 Å²	74	29.4 Å²	29.4	38%	0.379	18%	0.177	S	C	.	.	H	α-helix	trans	-66.3	-44.9	179.4	-53.9	173.5	0	0	0	110.5	Q277 S316 K322	Q277-I318 HydrophobicContact CG-CG2 4.06Å; Q277-I318 VanDerWaalsContact OE1-CG2 3.28Å; S316-I318 VanDerWaalsContact C-N 3.31Å; S316-I318 PolarHBondContact O-N 3.11Å; I318-K322 PolarHBondContact O-N 3.02Å
319	L	68.4	Low	73.2	Confident	13 Å²	13	28.5 Å²	28.5	7%	0.068	17%	0.172	C	C	.	.	H	α-helix	trans	-71.1	-36.4	177.4	-68.6	177.3	0	0	0	112.1	L276 L280 L313 S316 A321 K322 L323	L276-L319 HydrophobicContact CD2-CD1 4.26Å; L280-L319 HydrophobicContact CB-CD2 4.31Å; L280-L319 HydrophobicContact CD1-CD1 3.61Å; L280-L319 HydrophobicContact CD1-CD2 3.43Å; L280-L319 VanDerWaalsContact CD1-CD2 3.43Å; L280-L319 HydrophobicContact CD1-CG 4.18Å; L313-L319 HydrophobicContact CB-CD1 4.45Å; L313-L319 HydrophobicContact CD2-CD1 4.18Å; L313-L319 WeakPolarHBondContact O-CB 3.13Å; S316-L319 PolarHBondContact O-N 3.02Å; L319-A321 VanDerWaalsContact C-N 3.33Å; L319-A321 PolarHBondContact O-N 3.23Å; L319-K322 PolarHBondContact O-N 2.79Å; L319-K322 VanDerWaalsContact O-N 3.16Å; L319-L323 HydrophobicContact CB-CD1 4.45Å; L319-L323 WeakPolarHBondContact O-CB 3.48Å; L319-L323 VanDerWaalsContact O-CG 3.31Å; L319-L323 WeakPolarHBondContact O-CG 3.31Å; L319-L323 PolarHBondContact O-N 3.24Å
320	R	74.2	Confident	73.6	Confident	43 Å²	43	28.3 Å²	28.3	16%	0.162	17%	0.171	C	C	.	.	H	α-helix	trans	-55.1	-47.9	173.9	-170.8	-175.4	-57.1	133.8	12.9	111.1	S314 S315 S316 P317 K322 L323 A324 K353 L354 D356	S314-R320 PolarHBondContact O-NE 3.34Å; S314-R320 PolarHBondContact O-NH2 3.16Å; S315-R320 PolarHBondContact O-NH2 3.06Å; S315-R320 VanDerWaalsContact O-NH2 3.1Å; S316-R320 VanDerWaalsContact O-CB 3.32Å; S316-R320 WeakPolarHBondContact O-CB 3.33Å; S316-R320 PolarHBondContact O-N 3.19Å; P317-R320 WeakPolarHBondContact O-CB 3.3Å; P317-R320 PolarHBondContact O-N 3.26Å; R320-K322 VanDerWaalsContact C-N 3.29Å; R320-K322 PolarHBondContact O-N 3.41Å; R320-L323 CarbonylContact O-C 3.59Å; R320-L323 PolarHBondContact O-N 3.49Å; R320-A324 PolarHBondContact O-N 2.88Å; R320-K353 VanDerWaalsContact CD-O 3.28Å; R320-K353 WeakPolarHBondContact CD-O 3.24Å; R320-K353 PolarHBondContact NE-O 2.86Å; R320-K353 VanDerWaalsContact NE-O 3.11Å; R320-L354 HydrophobicContact CG-CD2 4.42Å; R320-D356 IonicContact CZ-OD2 3.14Å; R320-D356 IonicContact NH1-OD2 3.15Å; R320-D356 PolarHBondContact NH1-OD2 2.91Å
321	A	69.6	Low	73.6	Confident	71 Å²	71	28.4 Å²	28.4	59%	0.587	17%	0.171	S	C	*	.	H	α-helix	trans	-59.3	-37.7	178	0	0	0	0	0	113	P317 L319 A324	P317-A321 PolarHBondContact O-N 3.46Å; P317-A321 VanDerWaalsContact O-N 3.09Å; L319-A321 VanDerWaalsContact C-N 3.33Å; L319-A321 PolarHBondContact O-N 3.23Å; A321-A324 WeakPolarHBondContact O-CB 3.44Å
322	K	69.3	Low	73.4	Confident	76 Å²	76	33.1 Å²	33.1	33%	0.33	19%	0.192	S	C	.	.	H	α-helix	trans	-77	-38.4	178.1	-59.5	-171.2	-177.8	-161	0	112.6	D281 T286 I318 L319 R320 A324 S325	D281-K322 IonicContact OD1-NZ 2.64Å; D281-K322 PolarHBondContact OD1-NZ 2.84Å; D281-K322 IonicContact OD2-NZ 3.6Å; D281-K322 PolarHBondContact OD2-NZ 3.2Å; T286-K322 HydrophobicContact CG2-CB 3.85Å; I318-K322 PolarHBondContact O-N 3.02Å; L319-K322 PolarHBondContact O-N 2.79Å; L319-K322 VanDerWaalsContact O-N 3.16Å; R320-K322 VanDerWaalsContact C-N 3.29Å; R320-K322 PolarHBondContact O-N 3.41Å; K322-A324 VanDerWaalsContact C-N 3.29Å; K322-A324 PolarHBondContact O-N 3.16Å; K322-S325 PolarHBondContact O-OG 3.38Å
323	L	76.1	Confident	73.5	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-75.3	-15.1	177.3	-69.2	169.1	0	0	0	113.1	T286 I289 I310 L313 L319 R320 S325 C326 L354	T286-L323 HydrophobicContact CG2-CD2 3.8Å; T286-L323 HydrophobicContact CG2-CG 4.2Å; I289-L323 HydrophobicContact CD1-CD2 4Å; I310-L323 HydrophobicContact CG2-CD1 4.47Å; L313-L323 HydrophobicContact CB-CD1 3.63Å; L319-L323 HydrophobicContact CB-CD1 4.45Å; L319-L323 WeakPolarHBondContact O-CB 3.48Å; L319-L323 VanDerWaalsContact O-CG 3.31Å; L319-L323 WeakPolarHBondContact O-CG 3.31Å; L319-L323 PolarHBondContact O-N 3.24Å; R320-L323 CarbonylContact O-C 3.59Å; R320-L323 PolarHBondContact O-N 3.49Å; L323-S325 PolarHBondContact O-N 2.97Å; L323-S325 VanDerWaalsContact O-N 3.08Å; L323-C326 VanDerWaalsContact O-CB 3.26Å; L323-C326 WeakPolarHBondContact O-CB 3.23Å; L323-C326 PolarHBondContact O-N 3.46Å; L323-L354 HydrophobicContact CB-CD2 3.64Å
324	A	74.1	Confident	73.7	Confident	14 Å²	14	31.9 Å²	31.9	12%	0.116	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-55.3	-26.9	171.7	0	0	0	0	0	112.1	R320 A321 K322 C326 I327 L359	R320-A324 PolarHBondContact O-N 2.88Å; A321-A324 WeakPolarHBondContact O-CB 3.44Å; K322-A324 VanDerWaalsContact C-N 3.29Å; K322-A324 PolarHBondContact O-N 3.16Å; A324-C326 PolarHBondContact O-N 3.01Å; A324-I327 HydrophobicContact CB-CD1 4.14Å; A324-I327 WeakPolarHBondContact O-CB 3.27Å; A324-I327 WeakPolarHBondContact O-CD1 3.47Å; A324-I327 WeakPolarHBondContact O-CG1 3.5Å; A324-I327 PolarHBondContact O-N 3.24Å; A324-I327 VanDerWaalsContact O-N 3.12Å; A324-L359 HydrophobicContact CB-CD2 3.73Å
325	S	75.5	Confident	73.5	Confident	44 Å²	44	35 Å²	35	31%	0.308	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-67	-10.2	173.7	73.7	0	0	0	0	115.1	R290 K322 L323 Q329	R290-S325 PolarHBondContact NH2-OG 3.21Å; K322-S325 PolarHBondContact O-OG 3.38Å; L323-S325 PolarHBondContact O-N 2.97Å; L323-S325 VanDerWaalsContact O-N 3.08Å; S325-Q329 PolarHBondContact O-OE1 2.89Å
326	C	76.2	Confident	73.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-90.5	-7.5	173.5	-59.8	0	0	0	0	113.2	L293 L323 A324 Q329 L330	L293-C326 HydrophobicContact CD1-CB 3.96Å; L323-C326 VanDerWaalsContact O-CB 3.26Å; L323-C326 WeakPolarHBondContact O-CB 3.23Å; L323-C326 PolarHBondContact O-N 3.46Å; A324-C326 PolarHBondContact O-N 3.01Å; C326-Q329 PolarHBondContact O-N 3.39Å; C326-Q329 PolarHBondContact O-OE1 3.3Å; C326-L330 WeakPolarHBondContact O-CG 3.46Å; C326-L330 PolarHBondContact O-N 3.05Å
327	I	78.1	Confident	73.1	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-53.9	-47.1	-179.3	-68.9	168.5	0	0	0	111.9	A324 Q329 L330 I331 L351 L354	A324-I327 HydrophobicContact CB-CD1 4.14Å; A324-I327 WeakPolarHBondContact O-CB 3.27Å; A324-I327 WeakPolarHBondContact O-CD1 3.47Å; A324-I327 WeakPolarHBondContact O-CG1 3.5Å; A324-I327 PolarHBondContact O-N 3.24Å; A324-I327 VanDerWaalsContact O-N 3.12Å; I327-Q329 PolarHBondContact O-N 3.16Å; I327-L330 PolarHBondContact O-N 2.78Å; I327-I331 HydrophobicContact CG2-CD1 3.64Å; I327-I331 HydrophobicContact CG2-CG1 4.27Å; I327-I331 VanDerWaalsContact O-CG1 3.28Å; I327-I331 WeakPolarHBondContact O-CG1 3.38Å; I327-I331 PolarHBondContact O-N 3.36Å; I327-L351 HydrophobicContact CG2-CD2 4.21Å; I327-L354 HydrophobicContact CD1-CB 4.4Å; I327-L354 HydrophobicContact CG1-CB 4.28Å; I327-L354 HydrophobicContact CG1-CD1 4.16Å
328	P	74.6	Confident	72.7	Confident	36 Å²	36	42.6 Å²	42.6	23%	0.234	22%	0.219	C	C	.	.	H	α-helix	trans	-59.4	-43.5	179.9	-23.2	34.3	0	0	0	113	I331 Q332	P328-I331 PolarHBondContact O-N 3.41Å; P328-Q332 WeakPolarHBondContact O-CG 3.46Å; P328-Q332 PolarHBondContact O-N 2.89Å
329	Q	77.4	Confident	72.5	Confident	24 Å²	24	48 Å²	48	11%	0.112	23%	0.234	C	C	.	.	H	α-helix	trans	-65.4	-39.5	178.2	-68.8	78.4	3.1	0	0	111.5	R290 L293 E294 S325 C326 I327 Q332 L333	R290-Q329 HydrophobicContact CG-CG 4.31Å; L293-Q329 HydrophobicContact CB-CB 4.17Å; L293-Q329 HydrophobicContact CD1-CB 4.16Å; E294-Q329 HydrophobicContact CG-CG 4.06Å; E294-Q329 PolarHBondContact OE1-NE2 3.4Å; S325-Q329 PolarHBondContact O-OE1 2.89Å; C326-Q329 PolarHBondContact O-N 3.39Å; C326-Q329 PolarHBondContact O-OE1 3.3Å; I327-Q329 PolarHBondContact O-N 3.16Å; Q329-Q332 PolarHBondContact O-N 3.34Å; Q329-L333 WeakPolarHBondContact O-CB 3.46Å; Q329-L333 VanDerWaalsContact O-CG 3.27Å; Q329-L333 WeakPolarHBondContact O-CG 3.11Å; Q329-L333 PolarHBondContact O-N 3.39Å
330	L	80.8	Confident	72.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-39.8	175.4	-70.5	174.8	0	0	0	112	L293 I307 I310 C326 I327 L333 L334 C347 A350 L351 L354	L293-L330 HydrophobicContact CD2-CD2 4.34Å; I307-L330 HydrophobicContact CD1-CD2 4.39Å; I307-L330 HydrophobicContact CG1-CD2 3.88Å; I307-L330 HydrophobicContact CG2-CD2 4.48Å; I310-L330 HydrophobicContact CD1-CD2 4.4Å; C326-L330 WeakPolarHBondContact O-CG 3.46Å; C326-L330 PolarHBondContact O-N 3.05Å; I327-L330 PolarHBondContact O-N 2.78Å; L330-L333 PolarHBondContact O-N 3.05Å; L330-L334 WeakPolarHBondContact O-CB 3.45Å; L330-L334 PolarHBondContact O-N 3.05Å; L330-C347 PolarHBondContact O-SG 3.44Å; L330-A350 HydrophobicContact CD1-CB 4.27Å; L330-L351 HydrophobicContact CB-CD2 3.91Å; L330-L351 HydrophobicContact CB-CG 4.26Å; L330-L351 HydrophobicContact CD1-CD2 4.14Å; L330-L351 HydrophobicContact CD1-CG 4.42Å; L330-L354 HydrophobicContact CD1-CD1 3.49Å; L330-L354 VanDerWaalsContact CD1-CD1 3.49Å
331	I	76.4	Confident	72.7	Confident	2 Å²	2	53 Å²	53	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-46	176.4	-63.3	163.4	0	0	0	110.6	I327 P328 L333 L334 D335 L351 H366 L369 L370	I327-I331 HydrophobicContact CG2-CD1 3.64Å; I327-I331 HydrophobicContact CG2-CG1 4.27Å; I327-I331 VanDerWaalsContact O-CG1 3.28Å; I327-I331 WeakPolarHBondContact O-CG1 3.38Å; I327-I331 PolarHBondContact O-N 3.36Å; P328-I331 PolarHBondContact O-N 3.41Å; I331-L333 PolarHBondContact O-N 2.74Å; I331-L334 WeakPolarHBondContact O-CB 3.44Å; I331-L334 PolarHBondContact O-N 2.93Å; I331-D335 PolarHBondContact O-N 3.17Å; I331-L351 HydrophobicContact CG1-CD2 4.44Å; I331-H366 HydrophobicContact CD1-CB 3.82Å; I331-L369 HydrophobicContact CG2-CB 4.39Å; I331-L369 HydrophobicContact CG2-CD2 3.67Å; I331-L369 HydrophobicContact CG2-CG 4.09Å; I331-L370 HydrophobicContact CD1-CB 3.9Å; I331-L370 HydrophobicContact CD1-CD2 4.32Å; I331-L370 HydrophobicContact CD1-CG 4.49Å; I331-L370 HydrophobicContact CG1-CB 4.13Å; I331-L370 HydrophobicContact CG1-CD1 4.06Å; I331-L370 HydrophobicContact CG1-CG 4.47Å; I331-L370 HydrophobicContact CG2-CB 4.33Å
332	Q	74.8	Confident	73	Confident	107 Å²	107	59 Å²	59	50%	0.5	26%	0.262	S	S	.	.	H	α-helix	trans	-59.7	-46.9	176	-73.4	176.9	-8.1	0	0	111.2	P328 Q329 L334 D335 Y336	P328-Q332 WeakPolarHBondContact O-CG 3.46Å; P328-Q332 PolarHBondContact O-N 2.89Å; Q329-Q332 PolarHBondContact O-N 3.34Å; Q332-L334 VanDerWaalsContact C-N 3.29Å; Q332-L334 PolarHBondContact O-N 3.43Å; Q332-D335 WeakPolarHBondContact O-CB 3.5Å; Q332-D335 PolarHBondContact O-N 2.9Å; Q332-D335 VanDerWaalsContact O-N 3.11Å; Q332-Y336 HydrophobicContact CB-CD2 4.49Å; Q332-Y336 HydrophobicContact CB-CE2 4.43Å; Q332-Y336 WeakPolarHBondContact O-CD2 3.07Å; Q332-Y336 PolarHBondContact O-N 3.27Å
333	L	76.6	Confident	73.5	Confident	17 Å²	17	55.4 Å²	55.4	9%	0.089	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-35.7	177.7	-78.7	175.1	0	0	0	113	L293 L303 Q329 L330 I331 D335 Y336 H337 F343	L293-L333 HydrophobicContact CB-CD1 4.35Å; L293-L333 HydrophobicContact CD2-CD1 3.6Å; L303-L333 HydrophobicContact CD1-CD2 4.45Å; Q329-L333 WeakPolarHBondContact O-CB 3.46Å; Q329-L333 VanDerWaalsContact O-CG 3.27Å; Q329-L333 WeakPolarHBondContact O-CG 3.11Å; Q329-L333 PolarHBondContact O-N 3.39Å; L330-L333 PolarHBondContact O-N 3.05Å; I331-L333 PolarHBondContact O-N 2.74Å; L333-D335 VanDerWaalsContact C-N 3.27Å; L333-D335 PolarHBondContact O-N 3.43Å; L333-Y336 PolarHBondContact O-N 2.88Å; L333-H337 WeakPolarHBondContact O-CB 3.22Å; L333-H337 PolarHBondContact O-N 2.85Å; L333-F343 HydrophobicContact CB-CE1 4.2Å; L333-F343 HydrophobicContact CB-CZ 3.92Å; L333-F343 HydrophobicContact CD2-CZ 4.45Å; L333-F343 WeakPolarHBondContact O-CE1 3.2Å
334	L	77	Confident	73.6	Confident	1 Å²	1	58 Å²	58	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-38.1	174.8	-172.4	65.6	0	0	0	111.3	L330 I331 Q332 I338 R344 C347 L348 L351 N373	L330-L334 WeakPolarHBondContact O-CB 3.45Å; L330-L334 PolarHBondContact O-N 3.05Å; I331-L334 WeakPolarHBondContact O-CB 3.44Å; I331-L334 PolarHBondContact O-N 2.93Å; Q332-L334 VanDerWaalsContact C-N 3.29Å; Q332-L334 PolarHBondContact O-N 3.43Å; L334-I338 WeakPolarHBondContact O-CG1 3.45Å; L334-R344 HydrophobicContact CD1-CB 4.49Å; L334-R344 HydrophobicContact CD1-CG 4.23Å; L334-C347 HydrophobicContact CD1-CB 4.15Å; L334-L348 HydrophobicContact CD1-CG 4.5Å; L334-L348 HydrophobicContact CD2-CD2 4.07Å; L334-L351 HydrophobicContact CD2-CD1 4.37Å; L334-N373 HydrophobicContact CD2-CB 4.26Å
335	D	71.5	Confident	74	Confident	66 Å²	66	58.5 Å²	58.5	35%	0.353	26%	0.257	S	S	.	.	H	α-helix	trans	-71.7	-43.7	176.9	-165.4	24.8	0	0	0	112.3	I331 Q332 L333 H337 I338	I331-D335 PolarHBondContact O-N 3.17Å; Q332-D335 WeakPolarHBondContact O-CB 3.5Å; Q332-D335 PolarHBondContact O-N 2.9Å; Q332-D335 VanDerWaalsContact O-N 3.11Å; L333-D335 VanDerWaalsContact C-N 3.27Å; L333-D335 PolarHBondContact O-N 3.43Å; D335-H337 PolarHBondContact O-N 3.46Å; D335-I338 WeakPolarHBondContact O-CD1 3.44Å; D335-I338 VanDerWaalsContact O-CG1 3.25Å; D335-I338 WeakPolarHBondContact O-CG1 3.44Å
336	Y	67.5	Low	74.3	Confident	170 Å²	170	56.7 Å²	56.7	67%	0.667	25%	0.245	S	C	*	.	H	α-helix	trans	-68.3	-37.1	178.6	-77.7	-68.9	0	0	0	113.7	Q332 L333	Q332-Y336 HydrophobicContact CB-CD2 4.49Å; Q332-Y336 HydrophobicContact CB-CE2 4.43Å; Q332-Y336 WeakPolarHBondContact O-CD2 3.07Å; Q332-Y336 PolarHBondContact O-N 3.27Å; L333-Y336 PolarHBondContact O-N 2.88Å
337	H	63.3	Low	74.7	Confident	66 Å²	66	56.7 Å²	56.7	31%	0.306	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110	31.4	-169.6	-69.9	-61	0	0	0	114.7	L333 D335 R339 S340 F343	L333-H337 WeakPolarHBondContact O-CB 3.22Å; L333-H337 PolarHBondContact O-N 2.85Å; D335-H337 PolarHBondContact O-N 3.46Å; H337-R339 PolarHBondContact O-N 2.86Å; H337-S340 PolarHBondContact O-N 2.69Å; H337-F343 HydrophobicContact CB-CD1 3.62Å; H337-F343 HydrophobicContact CB-CD2 4.49Å; H337-F343 HydrophobicContact CB-CE1 3.57Å; H337-F343 HydrophobicContact CB-CE2 4.41Å; H337-F343 HydrophobicContact CB-CG 4.11Å; H337-F343 HydrophobicContact CB-CZ 3.99Å; H337-F343 AromaticContact CD2-CZ 3.76Å
338	I	59.4	Low	75	Confident	64 Å²	64	56.5 Å²	56.5	33%	0.328	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-24.9	-176.7	-65.9	165.5	0	0	0	113.8	L334 D335 R344	L334-I338 WeakPolarHBondContact O-CG1 3.45Å; D335-I338 WeakPolarHBondContact O-CD1 3.44Å; D335-I338 VanDerWaalsContact O-CG1 3.25Å; D335-I338 WeakPolarHBondContact O-CG1 3.44Å; I338-R344 WeakPolarHBondContact O-CD 3.25Å; I338-R344 VanDerWaalsContact O-CZ 3.3Å; I338-R344 PolarHBondContact O-NE 3.03Å; I338-R344 PolarHBondContact O-NH1 3.26Å
339	R	62.2	Low	75.6	Confident	186 Å²	186	56.9 Å²	56.9	70%	0.702	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-26.4	-173	-62.4	-171.8	-172	172.3	9.3	115.2	H337 R341	H337-R339 PolarHBondContact O-N 2.86Å; R339-R341 PolarHBondContact O-N 3.25Å
340	S	71.7	Confident	75.9	Confident	19 Å²	19	55.8 Å²	55.8	13%	0.133	24%	0.237	C	C	.	.			trans	-87.5	112.8	-174.8	173.5	0	0	0	0	111.7	Q300 H337 R342 F343 R344	Q300-S340 PolarHBondContact NE2-OG 3.32Å; H337-S340 PolarHBondContact O-N 2.69Å; S340-R342 VanDerWaalsContact C-N 3.34Å; S340-R342 PolarHBondContact O-N 2.94Å; S340-F343 PolarHBondContact O-N 3.07Å; S340-F343 WeakPolarHBondContact OG-CB 3.33Å; S340-F343 PolarHBondContact OG-N 3.5Å; S340-R344 WeakPolarHBondContact O-CG 3.38Å; S340-R344 PolarHBondContact O-N 2.81Å
341	R	74.3	Confident	76.1	Confident	143 Å²	143	55.8 Å²	55.8	54%	0.54	24%	0.237	S	C	.	.	H	α-helix	trans	-56.5	-46.9	178.2	-176	177.4	176.3	175.4	0.4	112.1	R339 F343 R344 D345	R339-R341 PolarHBondContact O-N 3.25Å; R341-F343 VanDerWaalsContact C-N 3.33Å; R341-F343 PolarHBondContact O-N 3.14Å; R341-R344 PolarHBondContact O-N 3.31Å; R341-D345 WeakPolarHBondContact O-CB 3.47Å; R341-D345 PolarHBondContact O-N 3.19Å
342	R	76.8	Confident	76.5	Confident	197 Å²	197	57 Å²	57	74%	0.743	24%	0.244	S	C	*	.	H	α-helix	trans	-63.8	-38.8	179.6	-70.9	-173.9	176.2	179.5	-1	112.3	I304 S340 A346	I304-R342 HydrophobicContact CD1-CB 4.02Å; S340-R342 VanDerWaalsContact C-N 3.34Å; S340-R342 PolarHBondContact O-N 2.94Å; R342-A346 WeakPolarHBondContact O-CB 3.2Å; R342-A346 PolarHBondContact O-N 3.46Å
343	F	79.2	Confident	76.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-47.6	177	-172.6	-84.6	0	0	0	111.7	Q300 L303 I304 I307 L333 H337 S340 R341 D345 A346 C347	Q300-F343 HydrophobicContact CG-CD2 4.08Å; L303-F343 HydrophobicContact CB-CD2 4.37Å; L303-F343 HydrophobicContact CB-CE2 3.62Å; L303-F343 HydrophobicContact CD1-CE2 4.01Å; L303-F343 HydrophobicContact CG-CE2 4.45Å; I304-F343 HydrophobicContact CD1-CB 4.33Å; I304-F343 HydrophobicContact CG1-CB 4.17Å; I304-F343 HydrophobicContact CG1-CD2 3.89Å; I304-F343 HydrophobicContact CG1-CG 4.48Å; I307-F343 HydrophobicContact CD1-CD2 4.26Å; I307-F343 HydrophobicContact CD1-CE1 4.22Å; I307-F343 HydrophobicContact CD1-CE2 3.63Å; I307-F343 HydrophobicContact CD1-CZ 3.59Å; L333-F343 HydrophobicContact CB-CE1 4.2Å; L333-F343 HydrophobicContact CB-CZ 3.92Å; L333-F343 HydrophobicContact CD2-CZ 4.45Å; L333-F343 WeakPolarHBondContact O-CE1 3.2Å; H337-F343 HydrophobicContact CB-CD1 3.62Å; H337-F343 HydrophobicContact CB-CD2 4.49Å; H337-F343 HydrophobicContact CB-CE1 3.57Å; H337-F343 HydrophobicContact CB-CE2 4.41Å; H337-F343 HydrophobicContact CB-CG 4.11Å; H337-F343 HydrophobicContact CB-CZ 3.99Å; H337-F343 AromaticContact CD2-CZ 3.76Å; S340-F343 PolarHBondContact O-N 3.07Å; S340-F343 WeakPolarHBondContact OG-CB 3.33Å; S340-F343 PolarHBondContact OG-N 3.5Å; R341-F343 VanDerWaalsContact C-N 3.33Å; R341-F343 PolarHBondContact O-N 3.14Å; F343-D345 PolarHBondContact O-N 2.92Å; F343-A346 PolarHBondContact O-N 2.87Å; F343-C347 HydrophobicContact CE1-CB 4.43Å; F343-C347 WeakPolarHBondContact O-CB 3.25Å; F343-C347 PolarHBondContact O-N 3.32Å
344	R	78.3	Confident	77	Confident	59 Å²	59	53.9 Å²	53.9	22%	0.223	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-47.7	176.2	-71.6	-170.8	-58.2	-146.9	10.2	111.5	L334 I338 S340 R341 A346 C347 L348	L334-R344 HydrophobicContact CD1-CB 4.49Å; L334-R344 HydrophobicContact CD1-CG 4.23Å; I338-R344 WeakPolarHBondContact O-CD 3.25Å; I338-R344 VanDerWaalsContact O-CZ 3.3Å; I338-R344 PolarHBondContact O-NE 3.03Å; I338-R344 PolarHBondContact O-NH1 3.26Å; S340-R344 WeakPolarHBondContact O-CG 3.38Å; S340-R344 PolarHBondContact O-N 2.81Å; R341-R344 PolarHBondContact O-N 3.31Å; R344-A346 VanDerWaalsContact C-N 3.34Å; R344-A346 PolarHBondContact O-N 3.31Å; R344-C347 PolarHBondContact O-N 3.02Å; R344-L348 WeakPolarHBondContact O-CB 3.36Å; R344-L348 VanDerWaalsContact O-CG 3.25Å; R344-L348 WeakPolarHBondContact O-CG 3.16Å; R344-L348 PolarHBondContact O-N 2.88Å
345	D	82.4	Confident	76.9	Confident	23 Å²	23	54.2 Å²	54.2	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-46.7	178.7	-69.2	-14.4	0	0	0	110.8	R341 F343 Q349 A386	R341-D345 WeakPolarHBondContact O-CB 3.47Å; R341-D345 PolarHBondContact O-N 3.19Å; F343-D345 PolarHBondContact O-N 2.92Å; D345-Q349 WeakPolarHBondContact O-CB 3.38Å; D345-Q349 PolarHBondContact O-N 2.72Å; D345-A386 WeakPolarHBondContact OD1-CA 3.46Å; D345-A386 VanDerWaalsContact OD1-CB 3.3Å; D345-A386 WeakPolarHBondContact OD1-CB 3.37Å; D345-A386 PolarHBondContact OD1-N 3.34Å; D345-A386 VanDerWaalsContact OD1-N 3.09Å
346	A	81.3	Confident	76.7	Confident	6 Å²	6	53.3 Å²	53.3	5%	0.05	23%	0.225	C	C	.	.	H	α-helix	trans	-63.1	-45.6	177.9	0	0	0	0	0	112.1	I304 I307 D308 R342 F343 R344 Q349 A350	I304-A346 HydrophobicContact CG2-CB 4.33Å; I307-A346 HydrophobicContact CB-CB 4.42Å; I307-A346 HydrophobicContact CG2-CB 3.83Å; I307-A346 WeakPolarHBondContact CG2-O 3.38Å; D308-A346 WeakPolarHBondContact OD1-CB 3.44Å; R342-A346 WeakPolarHBondContact O-CB 3.2Å; R342-A346 PolarHBondContact O-N 3.46Å; F343-A346 PolarHBondContact O-N 2.87Å; R344-A346 VanDerWaalsContact C-N 3.34Å; R344-A346 PolarHBondContact O-N 3.31Å; A346-Q349 PolarHBondContact O-N 2.82Å; A346-A350 WeakPolarHBondContact O-CB 3.37Å; A346-A350 PolarHBondContact O-N 3.22Å
347	C	84.8	Confident	76.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.7	-46	-179	-169.9	0	0	0	0	111.4	I307 L330 L334 F343 R344 Q349 A350 L351	I307-C347 HydrophobicContact CD1-CB 4.41Å; I307-C347 HydrophobicContact CG2-CB 4.47Å; L330-C347 PolarHBondContact O-SG 3.44Å; L334-C347 HydrophobicContact CD1-CB 4.15Å; F343-C347 HydrophobicContact CE1-CB 4.43Å; F343-C347 WeakPolarHBondContact O-CB 3.25Å; F343-C347 PolarHBondContact O-N 3.32Å; R344-C347 PolarHBondContact O-N 3.02Å; C347-Q349 VanDerWaalsContact C-N 3.34Å; C347-Q349 PolarHBondContact O-N 3.38Å; C347-A350 PolarHBondContact O-N 2.77Å; C347-L351 WeakPolarHBondContact O-CB 3.24Å; C347-L351 WeakPolarHBondContact O-CG 3.44Å; C347-L351 PolarHBondContact O-N 2.86Å
348	L	85	Confident	75.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-38.7	175.9	-68.5	173.3	0	0	0	112.1	L334 R344 L351 L352 L374 V377 A386 L389 A390 L393	L334-L348 HydrophobicContact CD1-CG 4.5Å; L334-L348 HydrophobicContact CD2-CD2 4.07Å; R344-L348 WeakPolarHBondContact O-CB 3.36Å; R344-L348 VanDerWaalsContact O-CG 3.25Å; R344-L348 WeakPolarHBondContact O-CG 3.16Å; R344-L348 PolarHBondContact O-N 2.88Å; L348-L351 PolarHBondContact O-N 3.43Å; L348-L352 VanDerWaalsContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CB 3.26Å; L348-L352 PolarHBondContact O-N 3.26Å; L348-L374 HydrophobicContact CD2-CD2 3.35Å; L348-V377 HydrophobicContact CD1-CG1 4.12Å; L348-A386 HydrophobicContact CD1-CB 4.09Å; L348-A386 WeakPolarHBondContact CD1-O 3.49Å; L348-L389 HydrophobicContact CB-CB 3.83Å; L348-L389 HydrophobicContact CB-CD1 4.06Å; L348-L389 HydrophobicContact CD1-CB 4.17Å; L348-A390 HydrophobicContact CD1-CB 4.37Å; L348-L393 HydrophobicContact CD2-CD2 4.43Å
349	Q	86.3	Confident	75.3	Confident	45 Å²	45	53.1 Å²	53.1	21%	0.21	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-39.8	175.5	-171.9	74.5	58.5	0	0	112	D345 A346 C347 K353 L389	D345-Q349 WeakPolarHBondContact O-CB 3.38Å; D345-Q349 PolarHBondContact O-N 2.72Å; A346-Q349 PolarHBondContact O-N 2.82Å; C347-Q349 VanDerWaalsContact C-N 3.34Å; C347-Q349 PolarHBondContact O-N 3.38Å; Q349-K353 PolarHBondContact O-N 3Å; Q349-K353 VanDerWaalsContact O-N 3.16Å; Q349-L389 HydrophobicContact CB-CD1 4.33Å
350	A	83.9	Confident	74.7	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-66.2	-47.6	175.2	0	0	0	0	0	111	I307 I310 L330 A346 C347 L352 K353 L354	I307-A350 HydrophobicContact CG2-CB 3.72Å; I310-A350 HydrophobicContact CG2-CB 4.47Å; L330-A350 HydrophobicContact CD1-CB 4.27Å; A346-A350 WeakPolarHBondContact O-CB 3.37Å; A346-A350 PolarHBondContact O-N 3.22Å; C347-A350 PolarHBondContact O-N 2.77Å; A350-L352 VanDerWaalsContact C-N 3.34Å; A350-L352 PolarHBondContact O-N 3.5Å; A350-K353 PolarHBondContact O-N 3.08Å; A350-L354 WeakPolarHBondContact O-CB 3.49Å; A350-L354 VanDerWaalsContact O-CG 3.28Å; A350-L354 WeakPolarHBondContact O-CG 3.25Å; A350-L354 PolarHBondContact O-N 3.37Å
351	L	85.5	Confident	73.7	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-44.3	175.5	-73.9	169.8	0	0	0	111.6	I327 L330 I331 L334 C347 L348 K353 L354 V355 L370 L393	I327-L351 HydrophobicContact CG2-CD2 4.21Å; L330-L351 HydrophobicContact CB-CD2 3.91Å; L330-L351 HydrophobicContact CB-CG 4.26Å; L330-L351 HydrophobicContact CD1-CD2 4.14Å; L330-L351 HydrophobicContact CD1-CG 4.42Å; I331-L351 HydrophobicContact CG1-CD2 4.44Å; L334-L351 HydrophobicContact CD2-CD1 4.37Å; C347-L351 WeakPolarHBondContact O-CB 3.24Å; C347-L351 WeakPolarHBondContact O-CG 3.44Å; C347-L351 PolarHBondContact O-N 2.86Å; L348-L351 PolarHBondContact O-N 3.43Å; L351-K353 VanDerWaalsContact C-N 3.33Å; L351-K353 PolarHBondContact O-N 3.49Å; L351-L354 PolarHBondContact O-N 2.94Å; L351-L354 VanDerWaalsContact O-N 3.16Å; L351-V355 WeakPolarHBondContact O-CB 3.42Å; L351-V355 VanDerWaalsContact O-CG2 3.31Å; L351-V355 WeakPolarHBondContact O-CG2 3.19Å; L351-V355 PolarHBondContact O-N 3.45Å; L351-L370 HydrophobicContact CD1-CD1 3.98Å; L351-L393 HydrophobicContact CB-CD2 3.82Å; L351-L393 HydrophobicContact CD1-CD2 4.41Å
352	L	84.6	Confident	72.4	Confident	28 Å²	28	50.3 Å²	50.3	15%	0.147	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-36.3	178.2	-175.9	66.2	0	0	0	113.3	L348 A350 L389 T392 L393 K396	L348-L352 VanDerWaalsContact O-CB 3.26Å; L348-L352 WeakPolarHBondContact O-CB 3.26Å; L348-L352 PolarHBondContact O-N 3.26Å; A350-L352 VanDerWaalsContact C-N 3.34Å; A350-L352 PolarHBondContact O-N 3.5Å; L352-L389 HydrophobicContact CD2-CD2 3.88Å; L352-T392 HydrophobicContact CD1-CG2 3.82Å; L352-T392 HydrophobicContact CD2-CG2 3.96Å; L352-L393 HydrophobicContact CD1-CB 4.33Å; L352-L393 HydrophobicContact CD1-CD1 4.3Å; L352-K396 HydrophobicContact CD1-CD 4.44Å
353	K	82.6	Confident	71.3	Confident	59 Å²	59	42.9 Å²	42.9	26%	0.257	25%	0.245	S	C	.	.	H	α-helix	trans	-78.2	-25.3	175.2	-77.3	-165.9	173.2	-167	0	113.2	S311 S315 R320 Q349 A350 L351	S311-K353 WeakPolarHBondContact O-CD 3.46Å; S315-K353 PolarHBondContact OG-NZ 2.93Å; R320-K353 VanDerWaalsContact CD-O 3.28Å; R320-K353 WeakPolarHBondContact CD-O 3.24Å; R320-K353 PolarHBondContact NE-O 2.86Å; R320-K353 VanDerWaalsContact NE-O 3.11Å; Q349-K353 PolarHBondContact O-N 3Å; Q349-K353 VanDerWaalsContact O-N 3.16Å; A350-K353 PolarHBondContact O-N 3.08Å; L351-K353 VanDerWaalsContact C-N 3.33Å; L351-K353 PolarHBondContact O-N 3.49Å
354	L	79.7	Confident	70.2	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-79.2	-40.3	176.7	-76.2	170	0	0	0	111.6	I310 S314 R320 L323 I327 L330 A350 L351 D356 L359	I310-L354 HydrophobicContact CG2-CD1 3.91Å; I310-L354 HydrophobicContact CG2-CD2 4.48Å; I310-L354 HydrophobicContact CG2-CG 4.42Å; S314-L354 WeakPolarHBondContact OG-CD2 2.99Å; R320-L354 HydrophobicContact CG-CD2 4.42Å; L323-L354 HydrophobicContact CB-CD2 3.64Å; I327-L354 HydrophobicContact CD1-CB 4.4Å; I327-L354 HydrophobicContact CG1-CB 4.28Å; I327-L354 HydrophobicContact CG1-CD1 4.16Å; L330-L354 HydrophobicContact CD1-CD1 3.49Å; L330-L354 VanDerWaalsContact CD1-CD1 3.49Å; A350-L354 WeakPolarHBondContact O-CB 3.49Å; A350-L354 VanDerWaalsContact O-CG 3.28Å; A350-L354 WeakPolarHBondContact O-CG 3.25Å; A350-L354 PolarHBondContact O-N 3.37Å; L351-L354 PolarHBondContact O-N 2.94Å; L351-L354 VanDerWaalsContact O-N 3.16Å; L354-D356 PolarHBondContact O-N 3.28Å; L354-L359 WeakPolarHBondContact O-CD1 2.82Å
355	V	75.3	Confident	68.7	Low	7 Å²	7	51 Å²	51	4%	0.042	28%	0.282	C	S	.	.			trans	-72.5	110.2	175.7	176.6	0	0	0	0	108	L351 F364 L393 K396 L397	L351-V355 WeakPolarHBondContact O-CB 3.42Å; L351-V355 VanDerWaalsContact O-CG2 3.31Å; L351-V355 WeakPolarHBondContact O-CG2 3.19Å; L351-V355 PolarHBondContact O-N 3.45Å; V355-F364 HydrophobicContact CB-CZ 4.47Å; V355-F364 HydrophobicContact CG1-CZ 4.09Å; V355-F364 HydrophobicContact CG2-CE1 3.84Å; V355-F364 HydrophobicContact CG2-CZ 3.9Å; V355-L393 HydrophobicContact CB-CD1 3.99Å; V355-L393 HydrophobicContact CG1-CD1 4.31Å; V355-L393 HydrophobicContact CG2-CD1 3.83Å; V355-K396 HydrophobicContact CG1-CD 4.17Å; V355-K396 HydrophobicContact CG1-CG 4.16Å; V355-K396 WeakPolarHBondContact O-CD 3.43Å; V355-K396 WeakPolarHBondContact O-CE 3.28Å; V355-K396 PolarHBondContact O-NZ 2.84Å; V355-L397 HydrophobicContact CG1-CD2 4.06Å
356	D	67.3	Low	67.3	Low	47 Å²	47	54 Å²	54	25%	0.251	30%	0.296	S	S	.	.			trans	-129.1	156.7	173.8	-148.9	14.1	0	0	0	111.7	R320 L354 D358 L359 K396	R320-D356 IonicContact CZ-OD2 3.14Å; R320-D356 IonicContact NH1-OD2 3.15Å; R320-D356 PolarHBondContact NH1-OD2 2.91Å; L354-D356 PolarHBondContact O-N 3.28Å; D356-D358 PolarHBondContact O-N 3.22Å; D356-D358 VanDerWaalsContact O-N 3.08Å; D356-L359 PolarHBondContact O-N 2.91Å; D356-L359 VanDerWaalsContact O-N 3.1Å; D356-K396 IonicContact OD1-NZ 3.98Å; D356-K396 PolarHBondContact OD1-NZ 3.46Å
357	D	56.2	Low	66.3	Low	117 Å²	117	54 Å²	54	63%	0.626	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17	-169.9	-61.4	-15.8	0	0	0	112.4	K396	D357-K396 WeakPolarHBondContact OD1-CE 3.42Å
358	D	50.3	Low	65.4	Low	149 Å²	149	59.8 Å²	59.8	80%	0.797	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	4.1	179.2	-68.2	-31.8	0	0	0	114.6	D356	D356-D358 PolarHBondContact O-N 3.22Å; D356-D358 VanDerWaalsContact O-N 3.08Å
359	L	54.3	Low	64.5	Low	31 Å²	31	63.6 Å²	63.6	16%	0.162	34%	0.342	C	S	.	.	S	Bend	trans	-73.2	127.9	177.3	-95.4	137	0	0	0	111	A324 L354 D356 D361 F364	A324-L359 HydrophobicContact CB-CD2 3.73Å; L354-L359 WeakPolarHBondContact O-CD1 2.82Å; D356-L359 PolarHBondContact O-N 2.91Å; D356-L359 VanDerWaalsContact O-N 3.1Å; L359-D361 PolarHBondContact O-N 3.19Å; L359-F364 HydrophobicContact CB-CE2 4.13Å
360	P	48.8	Very low	63.8	Low	100 Å²	100	61.5 Å²	61.5	65%	0.649	33%	0.332	S	S	*	.			trans	-58.8	125.5	176.1	23	-31.9	0	0	0	109.5	G362 S363	P360-G362 PolarHBondContact O-N 3.31Å; P360-S363 PolarHBondContact O-N 2.89Å; P360-S363 VanDerWaalsContact O-N 3.12Å; P360-S363 PolarHBondContact O-OG 2.65Å
361	D	50.2	Low	63.2	Low	123 Å²	123	61.5 Å²	61.5	66%	0.658	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-43.6	-22	-176.3	-78.1	-52.1	0	0	0	114.6	L359 S363 F364 S400	L359-D361 PolarHBondContact O-N 3.19Å; D361-S363 VanDerWaalsContact C-N 3.34Å; D361-S363 PolarHBondContact O-N 3.39Å; D361-F364 PolarHBondContact O-N 3.44Å; D361-S400 PolarHBondContact OD1-OG 3.49Å
362	G	48.1	Very low	62.3	Low	65 Å²	65	63.2 Å²	63.2	67%	0.67	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-66.6	-17.5	178.8	0	0	0	0	0	116.8	P360 F364	P360-G362 PolarHBondContact O-N 3.31Å; G362-F364 PolarHBondContact O-N 2.72Å
363	S	53.3	Low	61.6	Low	41 Å²	41	62.3 Å²	62.3	29%	0.287	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-76.3	-12.1	178.8	57.2	0	0	0	0	113.9	P360 D361	P360-S363 PolarHBondContact O-N 2.89Å; P360-S363 VanDerWaalsContact O-N 3.12Å; P360-S363 PolarHBondContact O-OG 2.65Å; D361-S363 VanDerWaalsContact C-N 3.34Å; D361-S363 PolarHBondContact O-N 3.39Å
364	F	55	Low	61.1	Low	34 Å²	34	59.5 Å²	59.5	15%	0.149	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-101.9	26.6	-170.3	-68.6	-75.7	0	0	0	114	V355 L359 D361 G362 H366 S367 L397	V355-F364 HydrophobicContact CB-CZ 4.47Å; V355-F364 HydrophobicContact CG1-CZ 4.09Å; V355-F364 HydrophobicContact CG2-CE1 3.84Å; V355-F364 HydrophobicContact CG2-CZ 3.9Å; L359-F364 HydrophobicContact CB-CE2 4.13Å; D361-F364 PolarHBondContact O-N 3.44Å; G362-F364 PolarHBondContact O-N 2.72Å; F364-H366 PolarHBondContact O-N 3.44Å; F364-S367 WeakPolarHBondContact O-CB 3.48Å; F364-S367 PolarHBondContact O-N 3.29Å; F364-S367 PolarHBondContact O-OG 3.4Å; F364-L397 HydrophobicContact CD1-CD2 4.1Å; F364-L397 HydrophobicContact CE1-CD2 3.79Å; F364-L397 HydrophobicContact CZ-CD2 4.34Å
365	K	46.9	Very low	60.6	Low	196 Å²	196	60.3 Å²	60.3	85%	0.852	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-16.9	165.5	-81.2	-174.7	175.8	-179.8	0	113.2
366	H	52.8	Low	60.2	Low	87 Å²	87	64.4 Å²	64.4	40%	0.403	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	6.1	173.7	-56	-64.6	0	0	0	113.9	I331 F364 E368 L369 L370	I331-H366 HydrophobicContact CD1-CB 3.82Å; F364-H366 PolarHBondContact O-N 3.44Å; H366-E368 VanDerWaalsContact C-N 3.27Å; H366-E368 PolarHBondContact O-N 3.44Å; H366-L369 PolarHBondContact O-N 3.48Å; H366-L370 PolarHBondContact O-N 2.88Å
367	S	62.2	Low	60	Low	5 Å²	5	63 Å²	63	4%	0.035	34%	0.342	C	S	.	.	H	α-helix	trans	-59.5	-36.4	-177.7	56.7	0	0	0	0	112.1	F364 L370 I371 L406	F364-S367 WeakPolarHBondContact O-CB 3.48Å; F364-S367 PolarHBondContact O-N 3.29Å; F364-S367 PolarHBondContact O-OG 3.4Å; S367-L370 CarbonylContact O-C 3.24Å; S367-L370 PolarHBondContact O-N 3.19Å; S367-I371 WeakPolarHBondContact O-CB 3.33Å; S367-I371 WeakPolarHBondContact O-CD1 3.47Å; S367-I371 WeakPolarHBondContact O-CG1 2.96Å; S367-I371 PolarHBondContact O-N 3.18Å; S367-L406 WeakPolarHBondContact OG-CD1 3.42Å
368	E	65.3	Low	60.3	Low	121 Å²	121	57.9 Å²	57.9	57%	0.565	32%	0.315	S	S	*	.	H	α-helix	trans	-63	-47.9	179.9	-169.6	175.4	-170.8	0	0	111.7	H366 L370 I371 C372	H366-E368 VanDerWaalsContact C-N 3.27Å; H366-E368 PolarHBondContact O-N 3.44Å; E368-L370 VanDerWaalsContact C-N 3.35Å; E368-L370 PolarHBondContact O-N 3.09Å; E368-I371 PolarHBondContact O-N 3.01Å; E368-C372 WeakPolarHBondContact O-CB 3.35Å; E368-C372 PolarHBondContact O-N 3.16Å; E368-C372 PolarHBondContact O-SG 3.35Å
369	L	66.5	Low	60.9	Low	81 Å²	81	57.5 Å²	57.5	42%	0.424	31%	0.306	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175.4	-169.1	79.1	0	0	0	111.2	I331 H366 N373	I331-L369 HydrophobicContact CG2-CB 4.39Å; I331-L369 HydrophobicContact CG2-CD2 3.67Å; I331-L369 HydrophobicContact CG2-CG 4.09Å; H366-L369 PolarHBondContact O-N 3.48Å; L369-N373 VanDerWaalsContact O-CB 3.31Å; L369-N373 WeakPolarHBondContact O-CB 3.3Å; L369-N373 PolarHBondContact O-N 3.44Å; L369-N373 PolarHBondContact O-ND2 3.27Å
370	L	71.6	Confident	60.8	Low	1 Å²	1	57.1 Å²	57.1	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-46.4	175.7	174.6	61.2	0	0	0	111.5	I331 L351 H366 S367 E368 N373 L374 L393 L397	I331-L370 HydrophobicContact CD1-CB 3.9Å; I331-L370 HydrophobicContact CD1-CD2 4.32Å; I331-L370 HydrophobicContact CD1-CG 4.49Å; I331-L370 HydrophobicContact CG1-CB 4.13Å; I331-L370 HydrophobicContact CG1-CD1 4.06Å; I331-L370 HydrophobicContact CG1-CG 4.47Å; I331-L370 HydrophobicContact CG2-CB 4.33Å; L351-L370 HydrophobicContact CD1-CD1 3.98Å; H366-L370 PolarHBondContact O-N 2.88Å; S367-L370 CarbonylContact O-C 3.24Å; S367-L370 PolarHBondContact O-N 3.19Å; E368-L370 VanDerWaalsContact C-N 3.35Å; E368-L370 PolarHBondContact O-N 3.09Å; L370-N373 PolarHBondContact O-N 3.42Å; L370-L374 HydrophobicContact CD1-CD1 3.82Å; L370-L374 HydrophobicContact CD1-CD2 4.36Å; L370-L374 HydrophobicContact CD1-CG 3.88Å; L370-L374 HydrophobicContact CD2-CD1 4.5Å; L370-L374 HydrophobicContact CG-CD1 3.78Å; L370-L374 HydrophobicContact CG-CG 4.26Å; L370-L374 WeakPolarHBondContact O-CB 3.23Å; L370-L374 WeakPolarHBondContact O-CG 3.13Å; L370-L374 PolarHBondContact O-N 3.32Å; L370-L393 HydrophobicContact CD1-CD2 4.31Å; L370-L397 HydrophobicContact CD2-CD1 3.86Å; L370-L397 HydrophobicContact CG-CD1 4.35Å
371	I	70	Confident	60.9	Low	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-47.2	179.1	-71.1	161.1	0	0	0	109.2	S367 E368 N373 L374 L375 L394 L406 I407 C410	S367-I371 WeakPolarHBondContact O-CB 3.33Å; S367-I371 WeakPolarHBondContact O-CD1 3.47Å; S367-I371 WeakPolarHBondContact O-CG1 2.96Å; S367-I371 PolarHBondContact O-N 3.18Å; E368-I371 PolarHBondContact O-N 3.01Å; I371-N373 VanDerWaalsContact C-N 3.35Å; I371-N373 PolarHBondContact O-N 2.77Å; I371-L374 PolarHBondContact O-N 2.84Å; I371-L375 HydrophobicContact CG2-CD1 3.8Å; I371-L375 HydrophobicContact CG2-CG 4.27Å; I371-L375 WeakPolarHBondContact O-CB 3.28Å; I371-L375 VanDerWaalsContact O-CG 3.24Å; I371-L375 WeakPolarHBondContact O-CG 3.31Å; I371-L375 PolarHBondContact O-N 2.73Å; I371-L394 HydrophobicContact CG1-CD2 4.5Å; I371-L394 HydrophobicContact CG2-CD2 4.41Å; I371-L406 HydrophobicContact CD1-CB 3.77Å; I371-L406 HydrophobicContact CD1-CD1 4.43Å; I371-I407 HydrophobicContact CD1-CG1 3.86Å; I371-I407 HydrophobicContact CG1-CG1 4.03Å; I371-I407 HydrophobicContact CG2-CG1 3.9Å; I371-C410 HydrophobicContact CG2-CB 4.4Å; I371-C410 VanDerWaalsContact CG2-SG 3.56Å
372	C	67.3	Low	61.4	Low	35 Å²	35	53.4 Å²	53.4	24%	0.236	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-45.3	174.5	-72.3	0	0	0	0	111.9	E368 L374 L375 H376	E368-C372 WeakPolarHBondContact O-CB 3.35Å; E368-C372 PolarHBondContact O-N 3.16Å; E368-C372 PolarHBondContact O-SG 3.35Å; C372-L374 PolarHBondContact O-N 2.84Å; C372-L375 PolarHBondContact O-N 3.5Å; C372-H376 WeakPolarHBondContact O-CB 3.41Å; C372-H376 PolarHBondContact O-CD2 2.63Å; C372-H376 PolarHBondContact O-N 3.35Å
373	N	69.3	Low	62.2	Low	10 Å²	10	54.9 Å²	54.9	5%	0.053	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-39.8	176.8	-75.1	-16.1	0	0	0	112.2	L334 L369 L370 I371 H376 V377	L334-N373 HydrophobicContact CD2-CB 4.26Å; L369-N373 VanDerWaalsContact O-CB 3.31Å; L369-N373 WeakPolarHBondContact O-CB 3.3Å; L369-N373 PolarHBondContact O-N 3.44Å; L369-N373 PolarHBondContact O-ND2 3.27Å; L370-N373 PolarHBondContact O-N 3.42Å; I371-N373 VanDerWaalsContact C-N 3.35Å; I371-N373 PolarHBondContact O-N 2.77Å; N373-H376 PolarHBondContact O-N 3.35Å; N373-V377 VanDerWaalsContact O-CG2 3.26Å; N373-V377 WeakPolarHBondContact O-CG2 3.38Å; N373-V377 PolarHBondContact O-N 2.85Å
374	L	72.8	Confident	63.2	Low	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.1	-43.2	176.3	-70.3	170.8	0	0	0	111.3	L348 L370 I371 C372 H376 V377 F378 A390 L393 L394 L397	L348-L374 HydrophobicContact CD2-CD2 3.35Å; L370-L374 HydrophobicContact CD1-CD1 3.82Å; L370-L374 HydrophobicContact CD1-CD2 4.36Å; L370-L374 HydrophobicContact CD1-CG 3.88Å; L370-L374 HydrophobicContact CD2-CD1 4.5Å; L370-L374 HydrophobicContact CG-CD1 3.78Å; L370-L374 HydrophobicContact CG-CG 4.26Å; L370-L374 WeakPolarHBondContact O-CB 3.23Å; L370-L374 WeakPolarHBondContact O-CG 3.13Å; L370-L374 PolarHBondContact O-N 3.32Å; I371-L374 PolarHBondContact O-N 2.84Å; C372-L374 PolarHBondContact O-N 2.84Å; L374-H376 VanDerWaalsContact C-N 3.3Å; L374-H376 PolarHBondContact O-N 3.16Å; L374-V377 PolarHBondContact O-N 3.46Å; L374-F378 WeakPolarHBondContact O-CB 3.39Å; L374-F378 PolarHBondContact O-N 3.12Å; L374-A390 HydrophobicContact CD2-CB 3.95Å; L374-L393 HydrophobicContact CD1-CB 4.28Å; L374-L393 HydrophobicContact CD1-CD2 3.79Å; L374-L393 HydrophobicContact CD1-CG 3.83Å; L374-L393 HydrophobicContact CD2-CB 4.45Å; L374-L393 HydrophobicContact CD2-CD2 3.8Å; L374-L393 HydrophobicContact CD2-CG 4.44Å; L374-L393 HydrophobicContact CG-CD2 4.39Å; L374-L394 HydrophobicContact CB-CD1 4.26Å; L374-L394 HydrophobicContact CB-CD2 3.95Å; L374-L394 HydrophobicContact CB-CG 4.01Å; L374-L394 HydrophobicContact CD1-CD2 3.89Å; L374-L394 HydrophobicContact CD1-CG 4.06Å; L374-L397 HydrophobicContact CD1-CD1 3.94Å
375	L	68.7	Low	64.4	Low	16 Å²	16	58.7 Å²	58.7	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-35.3	174.3	-69.8	172.5	0	0	0	111.7	I371 C372 F378 L394 C410	I371-L375 HydrophobicContact CG2-CD1 3.8Å; I371-L375 HydrophobicContact CG2-CG 4.27Å; I371-L375 WeakPolarHBondContact O-CB 3.28Å; I371-L375 VanDerWaalsContact O-CG 3.24Å; I371-L375 WeakPolarHBondContact O-CG 3.31Å; I371-L375 PolarHBondContact O-N 2.73Å; C372-L375 PolarHBondContact O-N 3.5Å; L375-F378 PolarHBondContact O-N 2.85Å; L375-F378 VanDerWaalsContact O-O 3.13Å; L375-L394 HydrophobicContact CD2-CD1 4.25Å; L375-C410 HydrophobicContact CD1-CB 3.67Å
376	H	66.7	Low	65.8	Low	94 Å²	94	49.4 Å²	49.4	44%	0.435	25%	0.245	S	C	.	.	H	α-helix	trans	-70.3	-37.9	173.5	-83.2	-51.6	0	0	0	114	C372 N373 L374 F378	C372-H376 WeakPolarHBondContact O-CB 3.41Å; C372-H376 PolarHBondContact O-CD2 2.63Å; C372-H376 PolarHBondContact O-N 3.35Å; N373-H376 PolarHBondContact O-N 3.35Å; L374-H376 VanDerWaalsContact C-N 3.3Å; L374-H376 PolarHBondContact O-N 3.16Å; H376-F378 VanDerWaalsContact C-N 3.28Å
377	V	64.4	Low	66.9	Low	16 Å²	16	45.2 Å²	45.2	10%	0.097	23%	0.225	C	C	.	.	H	α-helix	trans	-71.9	-30.1	174.7	174.7	0	0	0	0	110.6	L348 N373 L374 K379 A386 A390	L348-V377 HydrophobicContact CD1-CG1 4.12Å; N373-V377 VanDerWaalsContact O-CG2 3.26Å; N373-V377 WeakPolarHBondContact O-CG2 3.38Å; N373-V377 PolarHBondContact O-N 2.85Å; L374-V377 PolarHBondContact O-N 3.46Å; V377-K379 PolarHBondContact O-N 3.03Å; V377-A386 HydrophobicContact CG1-CB 4.11Å; V377-A390 HydrophobicContact CG1-CB 4.4Å
378	F	62	Low	67.8	Low	10 Å²	10	47.7 Å²	47.7	4%	0.044	24%	0.237	C	C	.	.			trans	-73	95.2	178.2	-174	-132.3	0	0	0	111.2	L374 L375 H376 V391 P415 F420 F432	L374-F378 WeakPolarHBondContact O-CB 3.39Å; L374-F378 PolarHBondContact O-N 3.12Å; L375-F378 PolarHBondContact O-N 2.85Å; L375-F378 VanDerWaalsContact O-O 3.13Å; H376-F378 VanDerWaalsContact C-N 3.28Å; F378-V391 HydrophobicContact CD2-CG2 3.46Å; F378-V391 VanDerWaalsContact CD2-CG2 3.46Å; F378-V391 HydrophobicContact CE2-CB 4.42Å; F378-V391 HydrophobicContact CE2-CG2 2.92Å; F378-V391 HydrophobicContact CG-CG2 4.47Å; F378-V391 HydrophobicContact CZ-CG2 3.54Å; F378-P415 HydrophobicContact CD1-CB 4.3Å; F378-P415 HydrophobicContact CD1-CG 3.69Å; F378-P415 HydrophobicContact CE1-CB 4.15Å; F378-P415 HydrophobicContact CE1-CG 3.31Å; F378-P415 HydrophobicContact CZ-CG 4.39Å; F378-F420 HydrophobicContact CD1-CZ 4Å; F378-F420 HydrophobicContact CD2-CE1 4.03Å; F378-F420 HydrophobicContact CD2-CZ 4.24Å; F378-F420 AromaticContact CE1-CE1 3.73Å; F378-F420 HydrophobicContact CE1-CE1 3.73Å; F378-F420 AromaticContact CE1-CE2 3.9Å; F378-F420 HydrophobicContact CE1-CE2 3.9Å; F378-F420 AromaticContact CE1-CZ 3.23Å; F378-F420 HydrophobicContact CE1-CZ 3.23Å; F378-F420 AromaticContact CE2-CD1 3.91Å; F378-F420 HydrophobicContact CE2-CD1 3.91Å; F378-F420 AromaticContact CE2-CE1 3.02Å; F378-F420 HydrophobicContact CE2-CE1 3.02Å; F378-F420 AromaticContact CE2-CZ 3.45Å; F378-F420 HydrophobicContact CE2-CZ 3.45Å; F378-F420 VanDerWaalsContact CE2-CZ 3.45Å; F378-F420 HydrophobicContact CG-CZ 4.48Å; F378-F420 AromaticContact CZ-CD1 3.66Å; F378-F420 HydrophobicContact CZ-CD1 3.66Å; F378-F420 HydrophobicContact CZ-CD2 4.45Å; F378-F420 AromaticContact CZ-CE1 2.89Å; F378-F420 HydrophobicContact CZ-CE1 2.89Å; F378-F420 AromaticContact CZ-CE2 3.79Å; F378-F420 HydrophobicContact CZ-CE2 3.79Å; F378-F420 HydrophobicContact CZ-CG 4.38Å; F378-F420 AromaticContact CZ-CZ 2.93Å; F378-F420 HydrophobicContact CZ-CZ 2.93Å; F378-F432 HydrophobicContact CE1-CE2 4.17Å; F378-F432 AromaticContact CZ-CD2 3.84Å; F378-F432 HydrophobicContact CZ-CD2 3.84Å; F378-F432 AromaticContact CZ-CE2 3.86Å; F378-F432 HydrophobicContact CZ-CE2 3.86Å
379	K	62.2	Low	68.7	Low	141 Å²	141	42.4 Å²	42.4	61%	0.613	21%	0.212	S	C	*	.			trans	-106.4	120.1	169.7	-67.4	-169	177.4	-169.2	0	110	V377 D381 S382	V377-K379 PolarHBondContact O-N 3.03Å; K379-D381 PolarHBondContact O-N 3.4Å; K379-D381 VanDerWaalsContact O-N 3.14Å; K379-S382 WeakPolarHBondContact O-CB 3.19Å; K379-S382 PolarHBondContact O-N 3.47Å; K379-S382 PolarHBondContact O-OG 2.87Å
380	P	52.2	Low	69.3	Low	24 Å²	24	38.6 Å²	38.6	16%	0.156	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-36.1	179.9	2.6	-12.8	0	0	0	113.7	S382 P415 R419 F420	P380-S382 PolarHBondContact O-N 2.81Å; P380-P415 HydrophobicContact CG-CB 4.07Å; P380-R419 HydrophobicContact CB-CB 3.86Å; P380-F420 VanDerWaalsContact CA-CE1 3.44Å; P380-F420 HydrophobicContact CB-CD1 4.5Å; P380-F420 HydrophobicContact CB-CD2 4.29Å; P380-F420 HydrophobicContact CB-CE1 3.8Å; P380-F420 HydrophobicContact CB-CE2 3.63Å; P380-F420 HydrophobicContact CB-CZ 3.34Å; P380-F420 HydrophobicContact CG-CE2 4.08Å; P380-F420 HydrophobicContact CG-CZ 3.83Å
381	D	51.6	Low	69.7	Low	115 Å²	115	38.5 Å²	38.5	62%	0.615	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-0.3	-176.2	-51.3	-26.5	0	0	0	113	K379 R419	K379-D381 PolarHBondContact O-N 3.4Å; K379-D381 VanDerWaalsContact O-N 3.14Å; D381-R419 WeakPolarHBondContact OD1-CD 3.33Å; D381-R419 IonicContact OD1-CZ 2.73Å; D381-R419 IonicContact OD1-NH1 3.94Å; D381-R419 PolarHBondContact OD1-NH1 3.31Å; D381-R419 IonicContact OD2-NH1 3.06Å; D381-R419 PolarHBondContact OD2-NH1 2.88Å; D381-R419 VanDerWaalsContact OD2-NH1 3.14Å
382	S	61.4	Low	70.3	Confident	29 Å²	29	40 Å²	40	20%	0.203	20%	0.201	C	C	.	.			trans	-102.9	103.1	-176	74.3	0	0	0	0	111.8	K379 P380 S384 A387	K379-S382 WeakPolarHBondContact O-CB 3.19Å; K379-S382 PolarHBondContact O-N 3.47Å; K379-S382 PolarHBondContact O-OG 2.87Å; P380-S382 PolarHBondContact O-N 2.81Å; S382-S384 PolarHBondContact O-N 3.48Å; S382-S384 PolarHBondContact OG-OG 3.24Å; S382-A387 WeakPolarHBondContact O-CB 3.46Å; S382-A387 WeakPolarHBondContact OG-CB 3.33Å
383	N	65.1	Low	71.1	Confident	97 Å²	97	38.3 Å²	38.3	52%	0.519	19%	0.189	S	C	.	.			trans	-71.8	45.8	164.6	-69.6	-27.3	0	0	0	111.1	S423	N383-S423 PolarHBondContact OD1-OG 3.4Å
384	S	73.9	Confident	71.6	Confident	19 Å²	19	37.9 Å²	37.9	13%	0.133	19%	0.187	C	C	.	.			trans	-99	145.5	-174.4	74.8	0	0	0	0	110.9	S382 A386 A387 E388	S382-S384 PolarHBondContact O-N 3.48Å; S382-S384 PolarHBondContact OG-OG 3.24Å; S384-A386 PolarHBondContact O-N 3.24Å; S384-A387 WeakPolarHBondContact O-CB 3.16Å; S384-A387 PolarHBondContact O-N 2.93Å; S384-A387 PolarHBondContact OG-N 3.48Å; S384-E388 PolarHBondContact O-N 2.95Å; S384-E388 VanDerWaalsContact O-N 3.11Å
385	R	79.5	Confident	71.8	Confident	135 Å²	135	38.3 Å²	38.3	51%	0.509	19%	0.19	S	C	.	.	H	α-helix	trans	-53.5	-38.4	171.8	-175.7	177.3	176	176.4	-1.7	111.9	A387 E388 L389	R385-A387 VanDerWaalsContact C-N 3.33Å; R385-A387 PolarHBondContact O-N 3.07Å; R385-E388 PolarHBondContact O-N 3.19Å; R385-L389 HydrophobicContact CG-CD1 3.98Å; R385-L389 HydrophobicContact CG-CG 4.26Å; R385-L389 WeakPolarHBondContact O-CB 3.14Å; R385-L389 VanDerWaalsContact O-CG 3.31Å; R385-L389 WeakPolarHBondContact O-CG 3.34Å; R385-L389 PolarHBondContact O-N 3.3Å
386	A	77.4	Confident	72.4	Confident	1 Å²	1	40 Å²	40	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-57.7	-43.3	173.7	0	0	0	0	0	112.7	D345 L348 V377 S384 L389 A390	D345-A386 WeakPolarHBondContact OD1-CA 3.46Å; D345-A386 VanDerWaalsContact OD1-CB 3.3Å; D345-A386 WeakPolarHBondContact OD1-CB 3.37Å; D345-A386 PolarHBondContact OD1-N 3.34Å; D345-A386 VanDerWaalsContact OD1-N 3.09Å; L348-A386 HydrophobicContact CD1-CB 4.09Å; L348-A386 WeakPolarHBondContact CD1-O 3.49Å; V377-A386 HydrophobicContact CG1-CB 4.11Å; S384-A386 PolarHBondContact O-N 3.24Å; A386-L389 PolarHBondContact O-N 3.04Å; A386-A390 WeakPolarHBondContact O-CB 3.49Å; A386-A390 PolarHBondContact O-N 2.97Å
387	A	75.3	Confident	73	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.8	-43.6	178.4	0	0	0	0	0	111.3	S382 S384 R385 A390 V391 L428	S382-A387 WeakPolarHBondContact O-CB 3.46Å; S382-A387 WeakPolarHBondContact OG-CB 3.33Å; S384-A387 WeakPolarHBondContact O-CB 3.16Å; S384-A387 PolarHBondContact O-N 2.93Å; S384-A387 PolarHBondContact OG-N 3.48Å; R385-A387 VanDerWaalsContact C-N 3.33Å; R385-A387 PolarHBondContact O-N 3.07Å; A387-A390 PolarHBondContact O-N 3.4Å; A387-V391 VanDerWaalsContact O-CG2 3.31Å; A387-V391 WeakPolarHBondContact O-CG2 3.34Å; A387-V391 PolarHBondContact O-N 3.15Å; A387-L428 HydrophobicContact CB-CD1 4.01Å
388	E	80.6	Confident	73.5	Confident	57 Å²	57	35.2 Å²	35.2	27%	0.266	18%	0.175	S	C	.	.	H	α-helix	trans	-58.5	-49.3	174.2	-176.1	-173.7	153.7	0	0	111.8	S384 R385 A390 V391 T392 N425 P427	S384-E388 PolarHBondContact O-N 2.95Å; S384-E388 VanDerWaalsContact O-N 3.11Å; R385-E388 PolarHBondContact O-N 3.19Å; E388-A390 VanDerWaalsContact C-N 3.33Å; E388-A390 PolarHBondContact O-N 3.34Å; E388-V391 PolarHBondContact O-N 3.32Å; E388-T392 WeakPolarHBondContact O-CB 3.42Å; E388-T392 PolarHBondContact O-N 3.25Å; E388-T392 PolarHBondContact O-OG1 3.45Å; E388-N425 PolarHBondContact OE2-ND2 3.15Å; E388-P427 HydrophobicContact CG-CB 4.18Å; E388-P427 WeakPolarHBondContact OE1-CB 3.19Å
389	L	83.5	Confident	74.2	Confident	10 Å²	10	37.7 Å²	37.7	5%	0.052	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-38.8	177.4	-70.5	172.7	0	0	0	112.1	L348 Q349 L352 R385 A386 T392 L393	L348-L389 HydrophobicContact CB-CB 3.83Å; L348-L389 HydrophobicContact CB-CD1 4.06Å; L348-L389 HydrophobicContact CD1-CB 4.17Å; Q349-L389 HydrophobicContact CB-CD1 4.33Å; L352-L389 HydrophobicContact CD2-CD2 3.88Å; R385-L389 HydrophobicContact CG-CD1 3.98Å; R385-L389 HydrophobicContact CG-CG 4.26Å; R385-L389 WeakPolarHBondContact O-CB 3.14Å; R385-L389 VanDerWaalsContact O-CG 3.31Å; R385-L389 WeakPolarHBondContact O-CG 3.34Å; R385-L389 PolarHBondContact O-N 3.3Å; A386-L389 PolarHBondContact O-N 3.04Å; L389-T392 PolarHBondContact O-N 2.9Å; L389-L393 WeakPolarHBondContact O-CB 3.28Å; L389-L393 PolarHBondContact O-N 2.8Å
390	A	80.7	Confident	74.8	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.2	-45	177.9	0	0	0	0	0	111.7	L348 L374 V377 A386 A387 E388 L393 L394	L348-A390 HydrophobicContact CD1-CB 4.37Å; L374-A390 HydrophobicContact CD2-CB 3.95Å; V377-A390 HydrophobicContact CG1-CB 4.4Å; A386-A390 WeakPolarHBondContact O-CB 3.49Å; A386-A390 PolarHBondContact O-N 2.97Å; A387-A390 PolarHBondContact O-N 3.4Å; E388-A390 VanDerWaalsContact C-N 3.33Å; E388-A390 PolarHBondContact O-N 3.34Å; A390-L393 PolarHBondContact O-N 2.72Å; A390-L394 WeakPolarHBondContact O-CB 3.4Å; A390-L394 WeakPolarHBondContact O-CG 3.43Å; A390-L394 PolarHBondContact O-N 3.37Å
391	V	79.4	Confident	75.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-41.6	175.3	-179.6	0	0	0	0	111.3	F378 A387 E388 L393 L394 A395 N431 F432	F378-V391 HydrophobicContact CD2-CG2 3.46Å; F378-V391 VanDerWaalsContact CD2-CG2 3.46Å; F378-V391 HydrophobicContact CE2-CB 4.42Å; F378-V391 HydrophobicContact CE2-CG2 2.92Å; F378-V391 HydrophobicContact CG-CG2 4.47Å; F378-V391 HydrophobicContact CZ-CG2 3.54Å; A387-V391 VanDerWaalsContact O-CG2 3.31Å; A387-V391 WeakPolarHBondContact O-CG2 3.34Å; A387-V391 PolarHBondContact O-N 3.15Å; E388-V391 PolarHBondContact O-N 3.32Å; V391-L393 VanDerWaalsContact C-N 3.28Å; V391-L393 PolarHBondContact O-N 2.9Å; V391-L394 PolarHBondContact O-N 3.25Å; V391-A395 VanDerWaalsContact O-CB 3.31Å; V391-A395 WeakPolarHBondContact O-CB 3.46Å; V391-A395 PolarHBondContact O-N 3.48Å; V391-N431 HydrophobicContact CB-CB 4.32Å; V391-N431 VanDerWaalsContact CG1-C 3.42Å; V391-N431 HydrophobicContact CG1-CB 3.7Å; V391-F432 HydrophobicContact CG1-CB 4.01Å; V391-F432 HydrophobicContact CG1-CD2 4.39Å; V391-F432 VanDerWaalsContact CG1-N 3.34Å
392	T	83.1	Confident	76.4	Confident	31 Å²	31	34.2 Å²	34.2	19%	0.19	18%	0.181	C	C	.	.	H	α-helix	trans	-60.1	-43.7	177.3	-48.4	0	0	0	0	110.5	L352 E388 L389 A395 K396 N431	L352-T392 HydrophobicContact CD1-CG2 3.82Å; L352-T392 HydrophobicContact CD2-CG2 3.96Å; E388-T392 WeakPolarHBondContact O-CB 3.42Å; E388-T392 PolarHBondContact O-N 3.25Å; E388-T392 PolarHBondContact O-OG1 3.45Å; L389-T392 PolarHBondContact O-N 2.9Å; T392-A395 PolarHBondContact O-N 3.44Å; T392-K396 WeakPolarHBondContact O-CB 3.42Å; T392-K396 PolarHBondContact O-N 2.86Å; T392-N431 PolarHBondContact OG1-ND2 3.48Å
393	L	83.4	Confident	76.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-66.9	-42.2	177.4	-174.8	55.9	0	0	0	111.8	L348 L351 L352 V355 L370 L374 L389 A390 V391 K396 L397	L348-L393 HydrophobicContact CD2-CD2 4.43Å; L351-L393 HydrophobicContact CB-CD2 3.82Å; L351-L393 HydrophobicContact CD1-CD2 4.41Å; L352-L393 HydrophobicContact CD1-CB 4.33Å; L352-L393 HydrophobicContact CD1-CD1 4.3Å; V355-L393 HydrophobicContact CB-CD1 3.99Å; V355-L393 HydrophobicContact CG1-CD1 4.31Å; V355-L393 HydrophobicContact CG2-CD1 3.83Å; L370-L393 HydrophobicContact CD1-CD2 4.31Å; L374-L393 HydrophobicContact CD1-CB 4.28Å; L374-L393 HydrophobicContact CD1-CD2 3.79Å; L374-L393 HydrophobicContact CD1-CG 3.83Å; L374-L393 HydrophobicContact CD2-CB 4.45Å; L374-L393 HydrophobicContact CD2-CD2 3.8Å; L374-L393 HydrophobicContact CD2-CG 4.44Å; L374-L393 HydrophobicContact CG-CD2 4.39Å; L389-L393 WeakPolarHBondContact O-CB 3.28Å; L389-L393 PolarHBondContact O-N 2.8Å; A390-L393 PolarHBondContact O-N 2.72Å; V391-L393 VanDerWaalsContact C-N 3.28Å; V391-L393 PolarHBondContact O-N 2.9Å; L393-K396 PolarHBondContact O-N 3.39Å; L393-L397 HydrophobicContact CD1-CD1 4.48Å; L393-L397 HydrophobicContact CD1-CG 4.37Å; L393-L397 HydrophobicContact CG-CD1 4.19Å; L393-L397 WeakPolarHBondContact O-CB 3.49Å; L393-L397 VanDerWaalsContact O-CG 3.24Å; L393-L397 WeakPolarHBondContact O-CG 3.5Å; L393-L397 PolarHBondContact O-N 3.21Å
394	L	79.5	Confident	77.1	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-60.6	-44.2	173.5	-74.8	170.5	0	0	0	111.8	I371 L374 L375 A390 V391 K396 L397 A398 I407 L435	I371-L394 HydrophobicContact CG1-CD2 4.5Å; I371-L394 HydrophobicContact CG2-CD2 4.41Å; L374-L394 HydrophobicContact CB-CD1 4.26Å; L374-L394 HydrophobicContact CB-CD2 3.95Å; L374-L394 HydrophobicContact CB-CG 4.01Å; L374-L394 HydrophobicContact CD1-CD2 3.89Å; L374-L394 HydrophobicContact CD1-CG 4.06Å; L375-L394 HydrophobicContact CD2-CD1 4.25Å; A390-L394 WeakPolarHBondContact O-CB 3.4Å; A390-L394 WeakPolarHBondContact O-CG 3.43Å; A390-L394 PolarHBondContact O-N 3.37Å; V391-L394 PolarHBondContact O-N 3.25Å; L394-K396 VanDerWaalsContact C-N 3.32Å; L394-K396 PolarHBondContact O-N 2.87Å; L394-L397 PolarHBondContact O-N 2.96Å; L394-A398 VanDerWaalsContact O-CB 3.29Å; L394-A398 WeakPolarHBondContact O-CB 3.17Å; L394-A398 PolarHBondContact O-N 3.42Å; L394-I407 HydrophobicContact CD2-CD1 4.17Å; L394-I407 HydrophobicContact CD2-CG1 4.31Å; L394-L435 HydrophobicContact CB-CD1 4.18Å; L394-L435 HydrophobicContact CB-CD2 3.99Å; L394-L435 HydrophobicContact CD1-CD2 4.43Å
395	A	77.8	Confident	76.8	Confident	8 Å²	8	29 Å²	29	7%	0.066	15%	0.152	C	C	.	.	H	α-helix	trans	-62.5	-40	177.5	0	0	0	0	0	111.6	V391 T392 A398 I434 L435	V391-A395 VanDerWaalsContact O-CB 3.31Å; V391-A395 WeakPolarHBondContact O-CB 3.46Å; V391-A395 PolarHBondContact O-N 3.48Å; T392-A395 PolarHBondContact O-N 3.44Å; A395-A398 PolarHBondContact O-N 3.3Å; A395-I434 HydrophobicContact CB-CB 4.49Å; A395-I434 HydrophobicContact CB-CG2 4.13Å; A395-L435 HydrophobicContact CB-CB 4.02Å
396	K	81.2	Confident	76.3	Confident	51 Å²	51	23.9 Å²	23.9	22%	0.222	14%	0.135	C	C	.	.	H	α-helix	trans	-68.1	-43.4	175.7	-165.7	167	-170.2	177.4	0	111.7	L352 V355 D356 D357 T392 L393 L394 A398 S399	L352-K396 HydrophobicContact CD1-CD 4.44Å; V355-K396 HydrophobicContact CG1-CD 4.17Å; V355-K396 HydrophobicContact CG1-CG 4.16Å; V355-K396 WeakPolarHBondContact O-CD 3.43Å; V355-K396 WeakPolarHBondContact O-CE 3.28Å; V355-K396 PolarHBondContact O-NZ 2.84Å; D356-K396 IonicContact OD1-NZ 3.98Å; D356-K396 PolarHBondContact OD1-NZ 3.46Å; D357-K396 WeakPolarHBondContact OD1-CE 3.42Å; T392-K396 WeakPolarHBondContact O-CB 3.42Å; T392-K396 PolarHBondContact O-N 2.86Å; L393-K396 PolarHBondContact O-N 3.39Å; L394-K396 VanDerWaalsContact C-N 3.32Å; L394-K396 PolarHBondContact O-N 2.87Å; K396-A398 VanDerWaalsContact C-N 3.33Å; K396-A398 PolarHBondContact O-N 3.37Å; K396-S399 VanDerWaalsContact O-CB 3.26Å; K396-S399 WeakPolarHBondContact O-CB 3.38Å; K396-S399 PolarHBondContact O-N 3.02Å; K396-S399 PolarHBondContact O-OG 3.43Å
397	L	78.6	Confident	76	Confident	9 Å²	9	24.5 Å²	24.5	5%	0.047	14%	0.138	C	C	.	.	H	α-helix	trans	-63.1	-39.1	175.2	-70.5	170.6	0	0	0	111.8	V355 F364 L370 L374 L393 L394 S399 S400 A403	V355-L397 HydrophobicContact CG1-CD2 4.06Å; F364-L397 HydrophobicContact CD1-CD2 4.1Å; F364-L397 HydrophobicContact CE1-CD2 3.79Å; F364-L397 HydrophobicContact CZ-CD2 4.34Å; L370-L397 HydrophobicContact CD2-CD1 3.86Å; L370-L397 HydrophobicContact CG-CD1 4.35Å; L374-L397 HydrophobicContact CD1-CD1 3.94Å; L393-L397 HydrophobicContact CD1-CD1 4.48Å; L393-L397 HydrophobicContact CD1-CG 4.37Å; L393-L397 HydrophobicContact CG-CD1 4.19Å; L393-L397 WeakPolarHBondContact O-CB 3.49Å; L393-L397 VanDerWaalsContact O-CG 3.24Å; L393-L397 WeakPolarHBondContact O-CG 3.5Å; L393-L397 PolarHBondContact O-N 3.21Å; L394-L397 PolarHBondContact O-N 2.96Å; L397-S399 PolarHBondContact O-N 3.31Å; L397-S400 PolarHBondContact O-N 2.91Å; L397-A403 HydrophobicContact CB-CB 4.4Å; L397-A403 VanDerWaalsContact O-CB 3.23Å; L397-A403 WeakPolarHBondContact O-CB 3.37Å
398	A	75.9	Confident	75.6	Confident	2 Å²	2	26 Å²	26	2%	0.017	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-4	178.2	0	0	0	0	0	114.2	L394 A395 K396 A404 I407 L435 R438 L439	L394-A398 VanDerWaalsContact O-CB 3.29Å; L394-A398 WeakPolarHBondContact O-CB 3.17Å; L394-A398 PolarHBondContact O-N 3.42Å; A395-A398 PolarHBondContact O-N 3.3Å; K396-A398 VanDerWaalsContact C-N 3.33Å; K396-A398 PolarHBondContact O-N 3.37Å; A398-A404 HydrophobicContact CB-CB 4.33Å; A398-I407 HydrophobicContact CB-CD1 3.98Å; A398-L435 HydrophobicContact CB-CD1 3.67Å; A398-R438 HydrophobicContact CB-CB 3.83Å; A398-L439 HydrophobicContact CB-CD2 4.49Å
399	S	76.7	Confident	74.8	Confident	62 Å²	62	26.1 Å²	26.1	43%	0.434	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-31.2	166.4	66.3	0	0	0	0	112.2	K396 L397	K396-S399 VanDerWaalsContact O-CB 3.26Å; K396-S399 WeakPolarHBondContact O-CB 3.38Å; K396-S399 PolarHBondContact O-N 3.02Å; K396-S399 PolarHBondContact O-OG 3.43Å; L397-S399 PolarHBondContact O-N 3.31Å
400	S	73.3	Confident	73.8	Confident	22 Å²	22	26.2 Å²	26.2	15%	0.154	15%	0.15	C	C	.	.	S	Bend	trans	-82.4	126	172.6	173.7	0	0	0	0	109.8	D361 L397 H402 A403 A404	D361-S400 PolarHBondContact OD1-OG 3.49Å; L397-S400 PolarHBondContact O-N 2.91Å; S400-H402 PolarHBondContact O-N 2.9Å; S400-A403 PolarHBondContact O-N 3.41Å; S400-A404 WeakPolarHBondContact O-CB 3.34Å; S400-A404 PolarHBondContact O-N 3.2Å
401	P	67.9	Low	72.3	Confident	62 Å²	62	34.8 Å²	34.8	40%	0.403	19%	0.187	S	C	.	.	H	α-helix	trans	-64.7	-26.4	-178.1	27.4	-35.2	0	0	0	112.2	S405 P447	P401-S405 WeakPolarHBondContact O-CB 3.42Å; P401-S405 PolarHBondContact O-N 3.25Å; P401-P447 HydrophobicContact CB-CB 4.04Å; P401-P447 HydrophobicContact CB-CG 3.92Å; P401-P447 HydrophobicContact CG-CB 4.34Å
402	H	71.3	Confident	70.8	Confident	122 Å²	122	36.4 Å²	36.4	57%	0.565	20%	0.201	S	C	*	.	H	α-helix	trans	-69.2	-47.8	174.1	-177.2	58.3	0	0	0	111.7	S400 S405 L406	S400-H402 PolarHBondContact O-N 2.9Å; H402-S405 WeakPolarHBondContact O-CB 3.42Å; H402-S405 PolarHBondContact O-N 3.01Å; H402-L406 WeakPolarHBondContact O-CG 3.31Å; H402-L406 PolarHBondContact O-N 3.5Å
403	A	70.5	Confident	68.8	Low	9 Å²	9	38.1 Å²	38.1	7%	0.074	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-38.3	177.4	0	0	0	0	0	112	L397 S400 S405 L406 I407	L397-A403 HydrophobicContact CB-CB 4.4Å; L397-A403 VanDerWaalsContact O-CB 3.23Å; L397-A403 WeakPolarHBondContact O-CB 3.37Å; S400-A403 PolarHBondContact O-N 3.41Å; A403-S405 VanDerWaalsContact C-N 3.33Å; A403-S405 PolarHBondContact O-N 2.95Å; A403-L406 WeakPolarHBondContact O-CB 3.26Å; A403-L406 PolarHBondContact O-N 3.36Å; A403-I407 VanDerWaalsContact O-CG1 3.27Å; A403-I407 WeakPolarHBondContact O-CG1 3.31Å; A403-I407 PolarHBondContact O-N 3.46Å
404	A	70.6	Confident	67.2	Low	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.4	-41.5	172.1	0	0	0	0	0	112	A398 S400 I407 L408 L439 T442	A398-A404 HydrophobicContact CB-CB 4.33Å; S400-A404 WeakPolarHBondContact O-CB 3.34Å; S400-A404 PolarHBondContact O-N 3.2Å; A404-I407 PolarHBondContact O-N 3.27Å; A404-L408 WeakPolarHBondContact O-CG 3.31Å; A404-L408 PolarHBondContact O-N 3.36Å; A404-L439 HydrophobicContact CB-CD2 4.12Å; A404-T442 HydrophobicContact CB-CG2 3.81Å; A404-T442 WeakPolarHBondContact CB-OG1 3.48Å
405	S	67.2	Low	65.9	Low	26 Å²	26	46.4 Å²	46.4	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-40	173.3	-178.8	0	0	0	0	112.5	P401 H402 A403 L408 N409	P401-S405 WeakPolarHBondContact O-CB 3.42Å; P401-S405 PolarHBondContact O-N 3.25Å; H402-S405 WeakPolarHBondContact O-CB 3.42Å; H402-S405 PolarHBondContact O-N 3.01Å; A403-S405 VanDerWaalsContact C-N 3.33Å; A403-S405 PolarHBondContact O-N 2.95Å; S405-L408 PolarHBondContact O-N 3.18Å; S405-N409 WeakPolarHBondContact O-CB 3.26Å; S405-N409 VanDerWaalsContact O-CG 3.26Å; S405-N409 PolarHBondContact O-N 3.46Å; S405-N409 PolarHBondContact O-ND2 2.99Å
406	L	69.2	Low	64.6	Low	29 Å²	29	49.1 Å²	49.1	15%	0.152	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-43.8	174.3	-70.6	172.5	0	0	0	111.9	S367 I371 H402 A403 L408 N409 C410	S367-L406 WeakPolarHBondContact OG-CD1 3.42Å; I371-L406 HydrophobicContact CD1-CB 3.77Å; I371-L406 HydrophobicContact CD1-CD1 4.43Å; H402-L406 WeakPolarHBondContact O-CG 3.31Å; H402-L406 PolarHBondContact O-N 3.5Å; A403-L406 WeakPolarHBondContact O-CB 3.26Å; A403-L406 PolarHBondContact O-N 3.36Å; L406-L408 VanDerWaalsContact C-N 3.28Å; L406-L408 PolarHBondContact O-N 2.87Å; L406-N409 PolarHBondContact O-N 3.45Å; L406-C410 PolarHBondContact O-N 3.47Å; L406-C410 PolarHBondContact O-SG 3.11Å
407	I	69.9	Low	63.1	Low	14 Å²	14	50.6 Å²	50.6	7%	0.072	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-40.3	175.4	-66.1	164	0	0	0	110.9	I371 L394 A398 A403 A404 N409 L435 L439	I371-I407 HydrophobicContact CD1-CG1 3.86Å; I371-I407 HydrophobicContact CG1-CG1 4.03Å; I371-I407 HydrophobicContact CG2-CG1 3.9Å; L394-I407 HydrophobicContact CD2-CD1 4.17Å; L394-I407 HydrophobicContact CD2-CG1 4.31Å; A398-I407 HydrophobicContact CB-CD1 3.98Å; A403-I407 VanDerWaalsContact O-CG1 3.27Å; A403-I407 WeakPolarHBondContact O-CG1 3.31Å; A403-I407 PolarHBondContact O-N 3.46Å; A404-I407 PolarHBondContact O-N 3.27Å; I407-N409 VanDerWaalsContact C-N 3.34Å; I407-L435 HydrophobicContact CD1-CD1 4.36Å; I407-L439 HydrophobicContact CB-CD2 3.99Å; I407-L439 HydrophobicContact CG2-CD1 4.15Å; I407-L439 HydrophobicContact CG2-CD2 3.81Å
408	L	66.8	Low	61.6	Low	32 Å²	32	52.2 Å²	52.2	17%	0.168	29%	0.287	C	S	.	.	H	α-helix	trans	-67.2	-32.5	175.5	-70.4	170.1	0	0	0	113.1	A404 S405 L406 L439 I443 L454	A404-L408 WeakPolarHBondContact O-CG 3.31Å; A404-L408 PolarHBondContact O-N 3.36Å; S405-L408 PolarHBondContact O-N 3.18Å; L406-L408 VanDerWaalsContact C-N 3.28Å; L406-L408 PolarHBondContact O-N 2.87Å; L408-L439 HydrophobicContact CD2-CB 4.36Å; L408-L439 HydrophobicContact CD2-CD2 4.34Å; L408-L439 HydrophobicContact CG-CD2 4.14Å; L408-I443 HydrophobicContact CD1-CD1 4.29Å; L408-I443 HydrophobicContact CD1-CG1 3.73Å; L408-I443 HydrophobicContact CD2-CD1 4.12Å; L408-I443 HydrophobicContact CD2-CG1 4.46Å; L408-L454 HydrophobicContact CB-CD2 4.25Å; L408-L454 HydrophobicContact CD1-CD2 4.42Å
409	N	63.9	Low	60.6	Low	58 Å²	58	57.3 Å²	57.3	31%	0.31	31%	0.306	S	S	.	.	H	α-helix	trans	-86.1	-16.3	-178.2	-71.4	-27.4	0	0	0	113.7	S405 L406 I407 K411	S405-N409 WeakPolarHBondContact O-CB 3.26Å; S405-N409 VanDerWaalsContact O-CG 3.26Å; S405-N409 PolarHBondContact O-N 3.46Å; S405-N409 PolarHBondContact O-ND2 2.99Å; L406-N409 PolarHBondContact O-N 3.45Å; I407-N409 VanDerWaalsContact C-N 3.34Å; N409-K411 PolarHBondContact O-N 2.91Å
410	C	62.3	Low	59.7	Low	13 Å²	13	54.4 Å²	54.4	9%	0.088	29%	0.286	C	S	.	.			trans	-66.3	102.1	177.3	-78.4	0	0	0	0	110.8	I371 L375 L406 A412	I371-C410 HydrophobicContact CG2-CB 4.4Å; I371-C410 VanDerWaalsContact CG2-SG 3.56Å; L375-C410 HydrophobicContact CD1-CB 3.67Å; L406-C410 PolarHBondContact O-N 3.47Å; L406-C410 PolarHBondContact O-SG 3.11Å; C410-A412 PolarHBondContact O-N 3.13Å; C410-A412 VanDerWaalsContact O-N 3.08Å
411	K	49.4	Very low	59	Low	180 Å²	180	55.1 Å²	55.1	78%	0.783	29%	0.288	S	S	*	.			trans	-61.2	-13.6	175.5	-68.2	-175.9	177	-179.4	0	114.1	N409 S413	N409-K411 PolarHBondContact O-N 2.91Å; K411-S413 PolarHBondContact O-N 3.32Å
412	A	47.6	Very low	58.6	Low	34 Å²	34	59 Å²	59	28%	0.281	30%	0.301	S	S	.	.	S	Bend	trans	-74.6	91.2	-178.4	0	0	0	0	0	110.5	C410	C410-A412 PolarHBondContact O-N 3.13Å; C410-A412 VanDerWaalsContact O-N 3.08Å
413	S	42.7	Very low	58.3	Low	67 Å²	67	54.1 Å²	54.1	47%	0.469	28%	0.28	S	S	.	.			trans	56.5	90.3	168.1	56.5	0	0	0	0	115.2	K411 P415	K411-S413 PolarHBondContact O-N 3.32Å; S413-P415 WeakPolarHBondContact O-CD 3.43Å
414	H	49.4	Very low	58.1	Low	152 Å²	152	62.1 Å²	62.1	70%	0.704	31%	0.313	S	S	*	.			trans	-59.1	105.5	150.3	-70.3	-62.4	0	0	0	106.8
415	P	51.7	Low	58.1	Low	23 Å²	23	63.6 Å²	63.6	15%	0.149	32%	0.321	C	S	.	.			trans	-76.5	140.8	-172.3	32.6	-26.7	0	0	0	107.1	F378 P380 S413 L417 F420	F378-P415 HydrophobicContact CD1-CB 4.3Å; F378-P415 HydrophobicContact CD1-CG 3.69Å; F378-P415 HydrophobicContact CE1-CB 4.15Å; F378-P415 HydrophobicContact CE1-CG 3.31Å; F378-P415 HydrophobicContact CZ-CG 4.39Å; P380-P415 HydrophobicContact CG-CB 4.07Å; S413-P415 WeakPolarHBondContact O-CD 3.43Å; P415-L417 PolarHBondContact O-N 3.32Å; P415-F420 HydrophobicContact CB-CE2 3.51Å; P415-F420 HydrophobicContact CB-CZ 3.77Å; P415-F420 HydrophobicContact CG-CE2 3.58Å; P415-F420 HydrophobicContact CG-CZ 3.88Å
416	D	50.3	Low	58.2	Low	65 Å²	65	64.4 Å²	64.4	35%	0.348	33%	0.334	S	S	.	.			trans	-52.1	104.2	-173.1	-169.6	-3.5	0	0	0	110.6	T418 R419 F420	D416-T418 VanDerWaalsContact CG-OG1 3.22Å; D416-T418 PolarHBondContact O-N 2.79Å; D416-T418 VanDerWaalsContact O-N 3.1Å; D416-T418 PolarHBondContact OD1-OG1 2.81Å; D416-T418 PolarHBondContact OD2-OG1 2.61Å; D416-R419 HydrophobicContact CB-CG 4.05Å; D416-R419 PolarHBondContact O-N 2.82Å; D416-R419 VanDerWaalsContact O-N 3.09Å; D416-R419 IonicContact OD2-CZ 3.65Å; D416-R419 IonicContact OD2-NE 3.97Å; D416-R419 PolarHBondContact OD2-NE 2.87Å; D416-R419 VanDerWaalsContact OD2-NE 3.15Å; D416-R419 IonicContact OD2-NH2 3.96Å; D416-F420 WeakPolarHBondContact O-CD2 3.46Å
417	L	50.6	Low	58.5	Low	82 Å²	82	65.7 Å²	65.7	43%	0.429	34%	0.343	S	S	.	.	H	α-helix	trans	-56.7	-31.3	-170.6	-64.1	178.1	0	0	0	111.6	P415 R419 F420 F432 L436	P415-L417 PolarHBondContact O-N 3.32Å; L417-R419 VanDerWaalsContact C-N 3.34Å; L417-R419 PolarHBondContact O-N 3.37Å; L417-F420 PolarHBondContact O-N 2.99Å; L417-F432 HydrophobicContact CD2-CE1 4.07Å; L417-F432 HydrophobicContact CD2-CZ 3.51Å; L417-L436 HydrophobicContact CD2-CD2 4.39Å
418	T	46	Very low	58.7	Low	42 Å²	42	65.1 Å²	65.1	26%	0.258	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-41.6	-179	59.4	0	0	0	0	111.6	D416 F420 L421 E422 Y470	D416-T418 VanDerWaalsContact CG-OG1 3.22Å; D416-T418 PolarHBondContact O-N 2.79Å; D416-T418 VanDerWaalsContact O-N 3.1Å; D416-T418 PolarHBondContact OD1-OG1 2.81Å; D416-T418 PolarHBondContact OD2-OG1 2.61Å; T418-F420 VanDerWaalsContact C-N 3.27Å; T418-F420 PolarHBondContact O-N 3.23Å; T418-L421 PolarHBondContact O-N 2.75Å; T418-E422 WeakPolarHBondContact O-CG 3.2Å; T418-E422 PolarHBondContact O-N 2.87Å; T418-Y470 HydrophobicContact CG2-CD1 3.87Å; T418-Y470 HydrophobicContact CG2-CE1 4.26Å
419	R	54.3	Low	58.9	Low	109 Å²	109	64.9 Å²	64.9	41%	0.411	34%	0.34	S	S	.	.	H	α-helix	trans	-69	-25	-177.1	-57.6	-170.3	-169.5	-167.5	-2.1	113.3	P380 D381 D416 L417 S423	P380-R419 HydrophobicContact CB-CB 3.86Å; D381-R419 WeakPolarHBondContact OD1-CD 3.33Å; D381-R419 IonicContact OD1-CZ 2.73Å; D381-R419 IonicContact OD1-NH1 3.94Å; D381-R419 PolarHBondContact OD1-NH1 3.31Å; D381-R419 IonicContact OD2-NH1 3.06Å; D381-R419 PolarHBondContact OD2-NH1 2.88Å; D381-R419 VanDerWaalsContact OD2-NH1 3.14Å; D416-R419 HydrophobicContact CB-CG 4.05Å; D416-R419 PolarHBondContact O-N 2.82Å; D416-R419 VanDerWaalsContact O-N 3.09Å; D416-R419 IonicContact OD2-CZ 3.65Å; D416-R419 IonicContact OD2-NE 3.97Å; D416-R419 PolarHBondContact OD2-NE 2.87Å; D416-R419 VanDerWaalsContact OD2-NE 3.15Å; D416-R419 IonicContact OD2-NH2 3.96Å; L417-R419 VanDerWaalsContact C-N 3.34Å; L417-R419 PolarHBondContact O-N 3.37Å; R419-S423 PolarHBondContact O-N 3.5Å
420	F	58.4	Low	59.5	Low	1 Å²	1	62.9 Å²	62.9	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-72.9	-42.9	176	-71	-71.3	0	0	0	112.5	F378 P380 P415 D416 L417 T418 E422 S423 L428 V429 F432	F378-F420 HydrophobicContact CD1-CZ 4Å; F378-F420 HydrophobicContact CD2-CE1 4.03Å; F378-F420 HydrophobicContact CD2-CZ 4.24Å; F378-F420 AromaticContact CE1-CE1 3.73Å; F378-F420 HydrophobicContact CE1-CE1 3.73Å; F378-F420 AromaticContact CE1-CE2 3.9Å; F378-F420 HydrophobicContact CE1-CE2 3.9Å; F378-F420 AromaticContact CE1-CZ 3.23Å; F378-F420 HydrophobicContact CE1-CZ 3.23Å; F378-F420 AromaticContact CE2-CD1 3.91Å; F378-F420 HydrophobicContact CE2-CD1 3.91Å; F378-F420 AromaticContact CE2-CE1 3.02Å; F378-F420 HydrophobicContact CE2-CE1 3.02Å; F378-F420 AromaticContact CE2-CZ 3.45Å; F378-F420 HydrophobicContact CE2-CZ 3.45Å; F378-F420 VanDerWaalsContact CE2-CZ 3.45Å; F378-F420 HydrophobicContact CG-CZ 4.48Å; F378-F420 AromaticContact CZ-CD1 3.66Å; F378-F420 HydrophobicContact CZ-CD1 3.66Å; F378-F420 HydrophobicContact CZ-CD2 4.45Å; F378-F420 AromaticContact CZ-CE1 2.89Å; F378-F420 HydrophobicContact CZ-CE1 2.89Å; F378-F420 AromaticContact CZ-CE2 3.79Å; F378-F420 HydrophobicContact CZ-CE2 3.79Å; F378-F420 HydrophobicContact CZ-CG 4.38Å; F378-F420 AromaticContact CZ-CZ 2.93Å; F378-F420 HydrophobicContact CZ-CZ 2.93Å; P380-F420 VanDerWaalsContact CA-CE1 3.44Å; P380-F420 HydrophobicContact CB-CD1 4.5Å; P380-F420 HydrophobicContact CB-CD2 4.29Å; P380-F420 HydrophobicContact CB-CE1 3.8Å; P380-F420 HydrophobicContact CB-CE2 3.63Å; P380-F420 HydrophobicContact CB-CZ 3.34Å; P380-F420 HydrophobicContact CG-CE2 4.08Å; P380-F420 HydrophobicContact CG-CZ 3.83Å; P415-F420 HydrophobicContact CB-CE2 3.51Å; P415-F420 HydrophobicContact CB-CZ 3.77Å; P415-F420 HydrophobicContact CG-CE2 3.58Å; P415-F420 HydrophobicContact CG-CZ 3.88Å; D416-F420 WeakPolarHBondContact O-CD2 3.46Å; L417-F420 PolarHBondContact O-N 2.99Å; T418-F420 VanDerWaalsContact C-N 3.27Å; T418-F420 PolarHBondContact O-N 3.23Å; F420-E422 PolarHBondContact O-N 3.42Å; F420-S423 WeakPolarHBondContact O-CB 3.41Å; F420-S423 PolarHBondContact O-N 3.47Å; F420-S423 VanDerWaalsContact O-N 3.08Å; F420-L428 HydrophobicContact CD1-CD2 3.95Å; F420-V429 WeakPolarHBondContact O-CG2 3.17Å; F420-F432 HydrophobicContact CB-CD1 3.77Å; F420-F432 HydrophobicContact CB-CE1 3.72Å; F420-F432 HydrophobicContact CB-CG 4.23Å; F420-F432 HydrophobicContact CB-CZ 4.17Å; F420-F432 HydrophobicContact CD1-CD2 4.37Å; F420-F432 HydrophobicContact CD1-CE2 4.48Å; F420-F432 HydrophobicContact CD2-CE1 4.1Å; F420-F432 AromaticContact CD2-CE2 3.99Å; F420-F432 HydrophobicContact CD2-CE2 3.99Å; F420-F432 AromaticContact CD2-CZ 3.69Å; F420-F432 HydrophobicContact CD2-CZ 3.69Å; F420-F432 HydrophobicContact CE2-CE2 4.29Å; F420-F432 HydrophobicContact CE2-CZ 4.31Å; F420-F432 HydrophobicContact CG-CD1 4.2Å; F420-F432 HydrophobicContact CG-CD2 4.26Å; F420-F432 AromaticContact CG-CE1 3.99Å; F420-F432 HydrophobicContact CG-CE1 3.99Å; F420-F432 HydrophobicContact CG-CE2 4.07Å; F420-F432 HydrophobicContact CG-CG 4.31Å; F420-F432 AromaticContact CG-CZ 3.92Å; F420-F432 HydrophobicContact CG-CZ 3.92Å
421	L	58.5	Low	60.1	Low	37 Å²	37	63.6 Å²	63.6	19%	0.194	33%	0.332	C	S	.	.	H	α-helix	trans	-71.3	-21	-179.7	-60.7	175.2	0	0	0	111.8	T418 V429 L433 I472	T418-L421 PolarHBondContact O-N 2.75Å; L421-V429 HydrophobicContact CD2-CG1 4.46Å; L421-L433 HydrophobicContact CD2-CD2 4.21Å; L421-I472 HydrophobicContact CB-CG2 4.47Å; L421-I472 HydrophobicContact CD1-CD1 3.62Å; L421-I472 HydrophobicContact CD1-CG1 4.02Å; L421-I472 HydrophobicContact CD1-CG2 3.66Å
422	E	60.7	Low	61.3	Low	145 Å²	145	55.3 Å²	55.3	68%	0.678	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-4.7	171.6	-66.8	179	177.2	0	0	113.8	T418 F420	T418-E422 WeakPolarHBondContact O-CG 3.2Å; T418-E422 PolarHBondContact O-N 2.87Å; F420-E422 PolarHBondContact O-N 3.42Å
423	S	64.8	Low	62.4	Low	18 Å²	18	54.2 Å²	54.2	13%	0.126	29%	0.286	C	S	.	.			trans	-65.1	136.3	178.1	-179.7	0	0	0	0	111.4	N383 R419 F420 N425	N383-S423 PolarHBondContact OD1-OG 3.4Å; R419-S423 PolarHBondContact O-N 3.5Å; F420-S423 WeakPolarHBondContact O-CB 3.41Å; F420-S423 PolarHBondContact O-N 3.47Å; F420-S423 VanDerWaalsContact O-N 3.08Å; S423-N425 PolarHBondContact O-N 2.71Å; S423-N425 PolarHBondContact OG-N 2.92Å; S423-N425 VanDerWaalsContact OG-N 3.13Å
424	K	66.4	Low	64	Low	178 Å²	178	53.3 Å²	53.3	77%	0.774	28%	0.275	S	S	*	.	S	Bend	trans	-76.3	-5.2	172.3	-60.7	-173.1	-179.9	-176.8	0	113.2	G426	K424-G426 PolarHBondContact O-N 2.89Å
425	N	69.7	Low	65.2	Low	31 Å²	31	46.4 Å²	46.4	17%	0.166	24%	0.244	C	C	.	.			trans	-90.5	94.3	-178.7	-173.7	-5.7	0	0	0	110.4	E388 S423 P427 L428 V429	E388-N425 PolarHBondContact OE2-ND2 3.15Å; S423-N425 PolarHBondContact O-N 2.71Å; S423-N425 PolarHBondContact OG-N 2.92Å; S423-N425 VanDerWaalsContact OG-N 3.13Å; N425-P427 WeakPolarHBondContact OD1-CD 3.4Å; N425-L428 HydrophobicContact CB-CB 3.87Å; N425-L428 WeakPolarHBondContact O-CB 3.5Å; N425-L428 PolarHBondContact O-N 2.87Å; N425-V429 PolarHBondContact O-N 2.86Å
426	G	70.5	Confident	66.1	Low	43 Å²	43	47.3 Å²	47.3	44%	0.443	25%	0.247	S	C	.	.	H	α-helix	trans	-50.8	-49.8	-179	0	0	0	0	0	114.8	K424 L428 V429 L430	K424-G426 PolarHBondContact O-N 2.89Å; G426-L428 VanDerWaalsContact C-N 3.31Å; G426-L428 PolarHBondContact O-N 3.3Å; G426-V429 PolarHBondContact O-N 3.23Å; G426-L430 WeakPolarHBondContact O-CB 3.25Å; G426-L430 PolarHBondContact O-N 2.89Å
427	P	75.1	Confident	67.1	Low	55 Å²	55	45 Å²	45	36%	0.357	23%	0.234	S	C	.	.	H	α-helix	trans	-53.1	-42.5	172.5	-30.8	33.2	0	0	0	114.6	E388 N425 L430 N431	E388-P427 HydrophobicContact CG-CB 4.18Å; E388-P427 WeakPolarHBondContact OE1-CB 3.19Å; N425-P427 WeakPolarHBondContact OD1-CD 3.4Å; P427-L430 PolarHBondContact O-N 3.08Å; P427-N431 WeakPolarHBondContact O-CB 3.13Å; P427-N431 VanDerWaalsContact O-CG 3.31Å; P427-N431 PolarHBondContact O-N 3.12Å; P427-N431 PolarHBondContact O-ND2 3.5Å
428	L	73.5	Confident	68.1	Low	2 Å²	2	45.8 Å²	45.8	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-44.5	178.3	-179.6	154.1	0	0	0	111.3	A387 F420 N425 G426 F432	A387-L428 HydrophobicContact CB-CD1 4.01Å; F420-L428 HydrophobicContact CD1-CD2 3.95Å; N425-L428 HydrophobicContact CB-CB 3.87Å; N425-L428 WeakPolarHBondContact O-CB 3.5Å; N425-L428 PolarHBondContact O-N 2.87Å; G426-L428 VanDerWaalsContact C-N 3.31Å; G426-L428 PolarHBondContact O-N 3.3Å; L428-F432 VanDerWaalsContact O-CB 3.24Å; L428-F432 WeakPolarHBondContact O-CB 3.14Å; L428-F432 PolarHBondContact O-N 3.48Å
429	V	70.6	Confident	69.3	Low	27 Å²	27	44.8 Å²	44.8	16%	0.164	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-46	175.9	178.8	0	0	0	0	110.8	F420 L421 N425 G426 F432 L433	F420-V429 WeakPolarHBondContact O-CG2 3.17Å; L421-V429 HydrophobicContact CD2-CG1 4.46Å; N425-V429 PolarHBondContact O-N 2.86Å; G426-V429 PolarHBondContact O-N 3.23Å; V429-F432 WeakPolarHBondContact O-CB 3.38Å; V429-F432 PolarHBondContact O-N 2.79Å; V429-L433 HydrophobicContact CG1-CD1 4.14Å; V429-L433 HydrophobicContact CG1-CG 4.48Å; V429-L433 VanDerWaalsContact O-CG 3.32Å; V429-L433 WeakPolarHBondContact O-CG 3.5Å; V429-L433 PolarHBondContact O-N 3.15Å
430	L	76.1	Confident	69.9	Low	17 Å²	17	40.3 Å²	40.3	9%	0.089	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-51	179	179.5	66	0	0	0	111.8	G426 P427 F432 L433 I434 Q496 I500	G426-L430 WeakPolarHBondContact O-CB 3.25Å; G426-L430 PolarHBondContact O-N 2.89Å; P427-L430 PolarHBondContact O-N 3.08Å; L430-F432 PolarHBondContact O-N 3.18Å; L430-L433 PolarHBondContact O-N 3.19Å; L430-L433 VanDerWaalsContact O-N 3.17Å; L430-I434 HydrophobicContact CD1-CD1 4.46Å; L430-I434 HydrophobicContact CG-CD1 4.14Å; L430-I434 WeakPolarHBondContact O-CG1 3.46Å; L430-I434 PolarHBondContact O-N 3Å; L430-Q496 HydrophobicContact CD2-CG 3.84Å; L430-I500 HydrophobicContact CD1-CD1 4.31Å; L430-I500 HydrophobicContact CD1-CG1 3.67Å
431	N	76.1	Confident	70.3	Confident	27 Å²	27	43.4 Å²	43.4	14%	0.144	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-33.5	179.4	-71.6	-40.7	0	0	0	111.7	V391 T392 P427 I434 L435	V391-N431 HydrophobicContact CB-CB 4.32Å; V391-N431 VanDerWaalsContact CG1-C 3.42Å; V391-N431 HydrophobicContact CG1-CB 3.7Å; T392-N431 PolarHBondContact OG1-ND2 3.48Å; P427-N431 WeakPolarHBondContact O-CB 3.13Å; P427-N431 VanDerWaalsContact O-CG 3.31Å; P427-N431 PolarHBondContact O-N 3.12Å; P427-N431 PolarHBondContact O-ND2 3.5Å; N431-I434 PolarHBondContact O-N 3.38Å; N431-L435 PolarHBondContact O-N 3.02Å
432	F	74.4	Confident	70.6	Confident	6 Å²	6	42.2 Å²	42.2	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-68.4	-41.9	175.3	-172.7	-108.5	0	0	0	112.2	F378 V391 L417 F420 L428 V429 L430 I434 L435 L436	F378-F432 HydrophobicContact CE1-CE2 4.17Å; F378-F432 AromaticContact CZ-CD2 3.84Å; F378-F432 HydrophobicContact CZ-CD2 3.84Å; F378-F432 AromaticContact CZ-CE2 3.86Å; F378-F432 HydrophobicContact CZ-CE2 3.86Å; V391-F432 HydrophobicContact CG1-CB 4.01Å; V391-F432 HydrophobicContact CG1-CD2 4.39Å; V391-F432 VanDerWaalsContact CG1-N 3.34Å; L417-F432 HydrophobicContact CD2-CE1 4.07Å; L417-F432 HydrophobicContact CD2-CZ 3.51Å; F420-F432 HydrophobicContact CB-CD1 3.77Å; F420-F432 HydrophobicContact CB-CE1 3.72Å; F420-F432 HydrophobicContact CB-CG 4.23Å; F420-F432 HydrophobicContact CB-CZ 4.17Å; F420-F432 HydrophobicContact CD1-CD2 4.37Å; F420-F432 HydrophobicContact CD1-CE2 4.48Å; F420-F432 HydrophobicContact CD2-CE1 4.1Å; F420-F432 AromaticContact CD2-CE2 3.99Å; F420-F432 HydrophobicContact CD2-CE2 3.99Å; F420-F432 AromaticContact CD2-CZ 3.69Å; F420-F432 HydrophobicContact CD2-CZ 3.69Å; F420-F432 HydrophobicContact CE2-CE2 4.29Å; F420-F432 HydrophobicContact CE2-CZ 4.31Å; F420-F432 HydrophobicContact CG-CD1 4.2Å; F420-F432 HydrophobicContact CG-CD2 4.26Å; F420-F432 AromaticContact CG-CE1 3.99Å; F420-F432 HydrophobicContact CG-CE1 3.99Å; F420-F432 HydrophobicContact CG-CE2 4.07Å; F420-F432 HydrophobicContact CG-CG 4.31Å; F420-F432 AromaticContact CG-CZ 3.92Å; F420-F432 HydrophobicContact CG-CZ 3.92Å; L428-F432 VanDerWaalsContact O-CB 3.24Å; L428-F432 WeakPolarHBondContact O-CB 3.14Å; L428-F432 PolarHBondContact O-N 3.48Å; V429-F432 WeakPolarHBondContact O-CB 3.38Å; V429-F432 PolarHBondContact O-N 2.79Å; L430-F432 PolarHBondContact O-N 3.18Å; F432-I434 VanDerWaalsContact C-N 3.32Å; F432-I434 PolarHBondContact O-N 3.26Å; F432-L435 WeakPolarHBondContact O-CB 3.46Å; F432-L435 PolarHBondContact O-N 3.3Å; F432-L436 HydrophobicContact CD1-CD1 3.9Å; F432-L436 HydrophobicContact CD1-CG 4.34Å; F432-L436 HydrophobicContact CE1-CD1 3.57Å; F432-L436 HydrophobicContact CE1-CD2 4.49Å; F432-L436 HydrophobicContact CE1-CG 4.06Å; F432-L436 HydrophobicContact CZ-CD1 4.23Å; F432-L436 HydrophobicContact CZ-CD2 4.35Å; F432-L436 HydrophobicContact CZ-CG 4.31Å; F432-L436 WeakPolarHBondContact O-CG 3.49Å; F432-L436 PolarHBondContact O-N 3.14Å
433	L	70.8	Confident	70.7	Confident	12 Å²	12	39.1 Å²	39.1	6%	0.063	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-38.7	173.9	-70.7	171.8	0	0	0	112	L421 V429 L430 L436 D437 I500	L421-L433 HydrophobicContact CD2-CD2 4.21Å; V429-L433 HydrophobicContact CG1-CD1 4.14Å; V429-L433 HydrophobicContact CG1-CG 4.48Å; V429-L433 VanDerWaalsContact O-CG 3.32Å; V429-L433 WeakPolarHBondContact O-CG 3.5Å; V429-L433 PolarHBondContact O-N 3.15Å; L430-L433 PolarHBondContact O-N 3.19Å; L430-L433 VanDerWaalsContact O-N 3.17Å; L433-L436 PolarHBondContact O-N 3.17Å; L433-D437 WeakPolarHBondContact O-CB 3.3Å; L433-D437 PolarHBondContact O-N 3.22Å; L433-I500 HydrophobicContact CD1-CG1 4.17Å; L433-I500 HydrophobicContact CD1-CG2 4.02Å
434	I	75.5	Confident	70.6	Confident	47 Å²	47	42.8 Å²	42.8	24%	0.241	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-46.5	173.7	-65.7	166.5	0	0	0	110.2	A395 L430 N431 F432 L436 D437 R438	A395-I434 HydrophobicContact CB-CB 4.49Å; A395-I434 HydrophobicContact CB-CG2 4.13Å; L430-I434 HydrophobicContact CD1-CD1 4.46Å; L430-I434 HydrophobicContact CG-CD1 4.14Å; L430-I434 WeakPolarHBondContact O-CG1 3.46Å; L430-I434 PolarHBondContact O-N 3Å; N431-I434 PolarHBondContact O-N 3.38Å; F432-I434 VanDerWaalsContact C-N 3.32Å; F432-I434 PolarHBondContact O-N 3.26Å; I434-L436 VanDerWaalsContact C-N 3.35Å; I434-L436 PolarHBondContact O-N 2.98Å; I434-D437 PolarHBondContact O-N 2.91Å; I434-R438 WeakPolarHBondContact O-CG 3.32Å; I434-R438 PolarHBondContact O-N 3.48Å
435	L	74.9	Confident	70.3	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.042	21%	0.214	C	C	.	.	H	α-helix	trans	-56.3	-48.6	175	174.8	61.5	0	0	0	111.2	L394 A395 A398 I407 N431 F432 D437 R438 L439	L394-L435 HydrophobicContact CB-CD1 4.18Å; L394-L435 HydrophobicContact CB-CD2 3.99Å; L394-L435 HydrophobicContact CD1-CD2 4.43Å; A395-L435 HydrophobicContact CB-CB 4.02Å; A398-L435 HydrophobicContact CB-CD1 3.67Å; I407-L435 HydrophobicContact CD1-CD1 4.36Å; N431-L435 PolarHBondContact O-N 3.02Å; F432-L435 WeakPolarHBondContact O-CB 3.46Å; F432-L435 PolarHBondContact O-N 3.3Å; L435-D437 PolarHBondContact O-N 3.48Å; L435-R438 PolarHBondContact O-N 3.37Å; L435-L439 HydrophobicContact CD1-CD1 4.05Å; L435-L439 HydrophobicContact CD1-CD2 4.42Å; L435-L439 HydrophobicContact CD1-CG 4.05Å; L435-L439 HydrophobicContact CG-CD1 4.02Å; L435-L439 HydrophobicContact CG-CG 4.41Å; L435-L439 VanDerWaalsContact O-CG 3.29Å; L435-L439 WeakPolarHBondContact O-CG 3.16Å; L435-L439 PolarHBondContact O-N 3.12Å
436	L	71.2	Confident	69.7	Low	42 Å²	42	40.8 Å²	40.8	22%	0.22	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-43.8	177.7	-72	177.5	0	0	0	112.3	L417 F432 L433 I434 R438 L439 V440 I507	L417-L436 HydrophobicContact CD2-CD2 4.39Å; F432-L436 HydrophobicContact CD1-CD1 3.9Å; F432-L436 HydrophobicContact CD1-CG 4.34Å; F432-L436 HydrophobicContact CE1-CD1 3.57Å; F432-L436 HydrophobicContact CE1-CD2 4.49Å; F432-L436 HydrophobicContact CE1-CG 4.06Å; F432-L436 HydrophobicContact CZ-CD1 4.23Å; F432-L436 HydrophobicContact CZ-CD2 4.35Å; F432-L436 HydrophobicContact CZ-CG 4.31Å; F432-L436 WeakPolarHBondContact O-CG 3.49Å; F432-L436 PolarHBondContact O-N 3.14Å; L433-L436 PolarHBondContact O-N 3.17Å; I434-L436 VanDerWaalsContact C-N 3.35Å; I434-L436 PolarHBondContact O-N 2.98Å; L436-R438 VanDerWaalsContact C-N 3.33Å; L436-R438 PolarHBondContact O-N 3.34Å; L436-L439 PolarHBondContact O-N 3.48Å; L436-V440 VanDerWaalsContact O-CB 3.31Å; L436-V440 WeakPolarHBondContact O-CB 3.31Å; L436-V440 WeakPolarHBondContact O-CG2 3.35Å; L436-V440 PolarHBondContact O-N 2.89Å; L436-I507 HydrophobicContact CB-CD1 4.1Å
437	D	71.4	Confident	68.6	Low	15 Å²	15	41.5 Å²	41.5	8%	0.08	22%	0.216	C	C	.	.	H	α-helix	trans	-58.4	-44.8	176.4	-177.9	46	0	0	0	111.4	L433 I434 L435 V440 Q441 C503 I507	L433-D437 WeakPolarHBondContact O-CB 3.3Å; L433-D437 PolarHBondContact O-N 3.22Å; I434-D437 PolarHBondContact O-N 2.91Å; L435-D437 PolarHBondContact O-N 3.48Å; D437-V440 PolarHBondContact O-N 3.13Å; D437-Q441 WeakPolarHBondContact O-CB 3.35Å; D437-Q441 VanDerWaalsContact O-CG 3.25Å; D437-Q441 WeakPolarHBondContact O-CG 3.26Å; D437-Q441 PolarHBondContact O-N 2.91Å; D437-Q441 PolarHBondContact OD1-NE2 3.43Å; D437-Q441 VanDerWaalsContact OD1-NE2 3.11Å; D437-Q441 PolarHBondContact OD2-NE2 2.95Å; D437-C503 HydrophobicContact CB-CB 4.3Å; D437-I507 HydrophobicContact CB-CD1 3.99Å; D437-I507 HydrophobicContact CB-CG1 4.19Å
438	R	71.9	Confident	67	Low	100 Å²	100	46.7 Å²	46.7	38%	0.377	24%	0.241	S	C	.	.	H	α-helix	trans	-65.8	-43.1	178	-65.6	-60.5	-175.9	-178.5	5.8	113.3	A398 I434 L435 L436 V440 Q441 T442	A398-R438 HydrophobicContact CB-CB 3.83Å; I434-R438 WeakPolarHBondContact O-CG 3.32Å; I434-R438 PolarHBondContact O-N 3.48Å; L435-R438 PolarHBondContact O-N 3.37Å; L436-R438 VanDerWaalsContact C-N 3.33Å; L436-R438 PolarHBondContact O-N 3.34Å; R438-V440 VanDerWaalsContact C-N 3.33Å; R438-Q441 PolarHBondContact O-N 2.92Å; R438-T442 PolarHBondContact O-N 2.87Å; R438-T442 PolarHBondContact O-OG1 3.28Å
439	L	70.1	Confident	65.1	Low	21 Å²	21	50.8 Å²	50.8	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-63.2	-42.5	175.9	-65.9	176.3	0	0	0	110.9	A398 A404 I407 L408 L435 L436 T442 I443	A398-L439 HydrophobicContact CB-CD2 4.49Å; A404-L439 HydrophobicContact CB-CD2 4.12Å; I407-L439 HydrophobicContact CB-CD2 3.99Å; I407-L439 HydrophobicContact CG2-CD1 4.15Å; I407-L439 HydrophobicContact CG2-CD2 3.81Å; L408-L439 HydrophobicContact CD2-CB 4.36Å; L408-L439 HydrophobicContact CD2-CD2 4.34Å; L408-L439 HydrophobicContact CG-CD2 4.14Å; L435-L439 HydrophobicContact CD1-CD1 4.05Å; L435-L439 HydrophobicContact CD1-CD2 4.42Å; L435-L439 HydrophobicContact CD1-CG 4.05Å; L435-L439 HydrophobicContact CG-CD1 4.02Å; L435-L439 HydrophobicContact CG-CG 4.41Å; L435-L439 VanDerWaalsContact O-CG 3.29Å; L435-L439 WeakPolarHBondContact O-CG 3.16Å; L435-L439 PolarHBondContact O-N 3.12Å; L436-L439 PolarHBondContact O-N 3.48Å; L439-T442 WeakPolarHBondContact O-CB 3.48Å; L439-T442 PolarHBondContact O-N 3.34Å; L439-I443 WeakPolarHBondContact O-CG1 3.29Å; L439-I443 PolarHBondContact O-N 3.03Å
440	V	66.4	Low	63.1	Low	15 Å²	15	50.5 Å²	50.5	9%	0.091	29%	0.286	C	S	.	.	H	α-helix	trans	-62.9	-42.5	176	165.4	0	0	0	0	112.2	L436 D437 R438 T442 I443 K444 I507 A510	L436-V440 VanDerWaalsContact O-CB 3.31Å; L436-V440 WeakPolarHBondContact O-CB 3.31Å; L436-V440 WeakPolarHBondContact O-CG2 3.35Å; L436-V440 PolarHBondContact O-N 2.89Å; D437-V440 PolarHBondContact O-N 3.13Å; R438-V440 VanDerWaalsContact C-N 3.33Å; V440-T442 VanDerWaalsContact C-N 3.26Å; V440-T442 PolarHBondContact O-N 2.93Å; V440-I443 PolarHBondContact O-N 3.16Å; V440-K444 HydrophobicContact CG1-CD 4.39Å; V440-K444 PolarHBondContact O-N 2.97Å; V440-I507 HydrophobicContact CG2-CG1 4.34Å; V440-I507 HydrophobicContact CG2-CG2 4.45Å; V440-A510 HydrophobicContact CB-CB 4.48Å; V440-A510 HydrophobicContact CG1-CB 3.08Å
441	Q	68.7	Low	61.1	Low	66 Å²	66	54.7 Å²	54.7	31%	0.308	31%	0.308	S	S	.	.	H	α-helix	trans	-60.5	-38.3	174.8	-74.4	169.2	18	0	0	111.6	D437 R438 K444 N445	D437-Q441 WeakPolarHBondContact O-CB 3.35Å; D437-Q441 VanDerWaalsContact O-CG 3.25Å; D437-Q441 WeakPolarHBondContact O-CG 3.26Å; D437-Q441 PolarHBondContact O-N 2.91Å; D437-Q441 PolarHBondContact OD1-NE2 3.43Å; D437-Q441 VanDerWaalsContact OD1-NE2 3.11Å; D437-Q441 PolarHBondContact OD2-NE2 2.95Å; R438-Q441 PolarHBondContact O-N 2.92Å; Q441-K444 PolarHBondContact O-N 2.91Å; Q441-N445 PolarHBondContact O-N 3.19Å
442	T	64.2	Low	59	Low	11 Å²	11	59.8 Å²	59.8	7%	0.067	34%	0.335	C	S	.	.	H	α-helix	trans	-69.3	-37.6	177.2	-54.3	0	0	0	0	112.2	A404 R438 L439 V440 K444 N445 P446	A404-T442 HydrophobicContact CB-CG2 3.81Å; A404-T442 WeakPolarHBondContact CB-OG1 3.48Å; R438-T442 PolarHBondContact O-N 2.87Å; R438-T442 PolarHBondContact O-OG1 3.28Å; L439-T442 WeakPolarHBondContact O-CB 3.48Å; L439-T442 PolarHBondContact O-N 3.34Å; V440-T442 VanDerWaalsContact C-N 3.26Å; V440-T442 PolarHBondContact O-N 2.93Å; T442-K444 VanDerWaalsContact C-N 3.34Å; T442-N445 CarbonylContact O-C 3.58Å; T442-N445 VanDerWaalsContact O-C 3.24Å; T442-N445 PolarHBondContact O-N 3.29Å; T442-P446 WeakPolarHBondContact O-CA 3.45Å
443	I	61.5	Low	56.9	Low	81 Å²	81	64.3 Å²	64.3	42%	0.415	36%	0.363	S	S	.	.	H	α-helix	trans	-64	-40.8	173.5	-66.4	165.4	0	0	0	110.8	L408 L439 V440	L408-I443 HydrophobicContact CD1-CD1 4.29Å; L408-I443 HydrophobicContact CD1-CG1 3.73Å; L408-I443 HydrophobicContact CD2-CD1 4.12Å; L408-I443 HydrophobicContact CD2-CG1 4.46Å; L439-I443 WeakPolarHBondContact O-CG1 3.29Å; L439-I443 PolarHBondContact O-N 3.03Å; V440-I443 PolarHBondContact O-N 3.16Å
444	K	62.9	Low	55	Low	94 Å²	94	65.5 Å²	65.5	41%	0.409	37%	0.369	S	S	.	.	H	α-helix	trans	-66.3	-39.1	177.4	-80.8	174.7	153.9	165.6	0	112.9	V440 Q441 T442 P506 A510	V440-K444 HydrophobicContact CG1-CD 4.39Å; V440-K444 PolarHBondContact O-N 2.97Å; Q441-K444 PolarHBondContact O-N 2.91Å; T442-K444 VanDerWaalsContact C-N 3.34Å; K444-P506 PolarHBondContact NZ-O 3.12Å; K444-A510 HydrophobicContact CD-CB 3.86Å; K444-A510 HydrophobicContact CG-CB 4.2Å; K444-A510 VanDerWaalsContact NZ-CB 3.31Å
445	N	61	Low	52.8	Low	126 Å²	126	66 Å²	66	67%	0.674	37%	0.37	S	S	*	.	S	Bend	trans	-127	73.3	-174.7	-63.5	-33.6	0	0	0	109.8	Q441 T442	Q441-N445 PolarHBondContact O-N 3.19Å; T442-N445 CarbonylContact O-C 3.58Å; T442-N445 VanDerWaalsContact O-C 3.24Å; T442-N445 PolarHBondContact O-N 3.29Å
446	P	56	Low	50.5	Low	42 Å²	42	68.1 Å²	68.1	27%	0.273	39%	0.389	S	S	.	.			trans	-62	131.9	-178.3	24.2	-32.6	0	0	0	110.2	T442 N448 I451	T442-P446 WeakPolarHBondContact O-CA 3.45Å; P446-N448 PolarHBondContact O-N 3.09Å; P446-I451 HydrophobicContact CG-CG1 4.46Å
447	P	48.3	Very low	48.5	Very low	58 Å²	58	71.5 Å²	71.5	38%	0.377	41%	0.407	S	S	.	.	S	Bend	trans	-62.1	124.5	175.5	26.4	-33.8	0	0	0	109.4	P401	P401-P447 HydrophobicContact CB-CB 4.04Å; P401-P447 HydrophobicContact CB-CG 3.92Å; P401-P447 HydrophobicContact CG-CB 4.34Å
448	N	41.5	Very low	46.5	Very low	163 Å²	163	75.3 Å²	75.3	87%	0.872	43%	0.431	S	S	*	.	S	Bend	trans	56.7	76.5	174.7	-62.2	-21.6	0	0	0	116.1	P446 G450	P446-N448 PolarHBondContact O-N 3.09Å; N448-G450 PolarHBondContact O-N 2.9Å
449	G	33	Very low	44.4	Very low	89 Å²	89	75.3 Å²	75.3	92%	0.918	44%	0.437	S	S	*	.	S	Bend	trans	60.9	10.4	148.5	0	0	0	0	0	118.7
450	G	30.3	Very low	42.3	Very low	21 Å²	21	83.3 Å²	83.3	22%	0.216	47%	0.468	C	S	.	.			trans	-120.7	63.7	-166.2	0	0	0	0	0	114.4	N448 N452 V453	N448-G450 PolarHBondContact O-N 2.9Å; G450-N452 PolarHBondContact O-N 3.03Å; G450-V453 PolarHBondContact O-N 2.79Å
451	I	34	Very low	40.3	Very low	105 Å²	105	86.3 Å²	86.3	54%	0.538	50%	0.501	S	S	.	.	H	α-helix	trans	-53.4	-24	162.7	-64.7	173.2	0	0	0	110.1	P446 V453 H455	P446-I451 HydrophobicContact CG-CG1 4.46Å; I451-V453 PolarHBondContact O-N 3.2Å; I451-H455 WeakPolarHBondContact O-CB 3.43Å; I451-H455 PolarHBondContact O-CD2 3.39Å; I451-H455 PolarHBondContact O-N 3.31Å
452	N	30.7	Very low	38.2	Very low	133 Å²	133	87 Å²	87	71%	0.711	52%	0.519	S	S	*	.	H	α-helix	trans	-75.4	-16.5	-177.3	-66.6	-16.1	0	0	0	116	G450	G450-N452 PolarHBondContact O-N 3.03Å
453	V	29.8	Very low	36.3	Very low	101 Å²	101	95 Å²	95	61%	0.612	56%	0.555	S	S	*	*	H	α-helix	trans	-90.2	-31	-177.9	-176.6	0	0	0	0	112.4	G450 I451	G450-V453 PolarHBondContact O-N 2.79Å; I451-V453 PolarHBondContact O-N 3.2Å
454	L	32.1	Very low	34.6	Very low	38 Å²	38	100 Å²	100	20%	0.199	58%	0.577	C	S	.	*	H	α-helix	trans	-75.7	-30.5	169.6	-81.9	155.1	0	0	0	111.8	L408 V458	L408-L454 HydrophobicContact CB-CD2 4.25Å; L408-L454 HydrophobicContact CD1-CD2 4.42Å; L454-V458 WeakPolarHBondContact O-CB 3.3Å; L454-V458 WeakPolarHBondContact O-CG2 3.24Å; L454-V458 PolarHBondContact O-N 3.35Å
455	H	29.5	Very low	32.8	Very low	57 Å²	57	105 Å²	105	26%	0.264	60%	0.599	S	S	.	*	H	α-helix	trans	-72.2	-29.3	-178.8	-93.2	-96.5	0	0	0	115	I451 L459 Y515	I451-H455 WeakPolarHBondContact O-CB 3.43Å; I451-H455 PolarHBondContact O-CD2 3.39Å; I451-H455 PolarHBondContact O-N 3.31Å; H455-L459 VanDerWaalsContact ND1-CD1 3.32Å; H455-L459 WeakPolarHBondContact ND1-CD1 3.44Å; H455-Y515 AromaticContact CE1-CE1 3.9Å; H455-Y515 AromaticContact CE1-CZ 3.39Å; H455-Y515 PolarHBondContact CE1-OH 3.45Å; H455-Y515 AromaticContact NE2-CE2 3.94Å; H455-Y515 AromaticContact NE2-CZ 3.51Å; H455-Y515 PolarHBondContact NE2-OH 3.1Å
456	A	27.1	Very low	31.1	Very low	52 Å²	52	104.8 Å²	104.8	43%	0.43	60%	0.604	S	S	.	*	H	α-helix	trans	-78	-25.2	-173.5	0	0	0	0	0	113.9
457	N	27.4	Very low	29.6	Very low	114 Å²	114	106.5 Å²	106.5	61%	0.61	63%	0.629	S	S	*	*	H	α-helix	trans	-113.4	-15.6	-173.8	-75.1	-25	0	0	0	115
458	V	30.3	Very low	28.5	Very low	94 Å²	94	108.3 Å²	108.3	57%	0.57	64%	0.639	S	S	*	*	H	α-helix	trans	-94.9	-20.9	178.1	-179.4	0	0	0	0	112.3	L454	L454-V458 WeakPolarHBondContact O-CB 3.3Å; L454-V458 WeakPolarHBondContact O-CG2 3.24Å; L454-V458 PolarHBondContact O-N 3.35Å
459	L	27	Very low	27.7	Very low	100 Å²	100	106.5 Å²	106.5	52%	0.524	63%	0.634	S	S	.	*	S	Bend	trans	-110.3	-8.3	-174.2	-80.8	157	0	0	0	116.1	H455	H455-L459 VanDerWaalsContact ND1-CD1 3.32Å; H455-L459 WeakPolarHBondContact ND1-CD1 3.44Å
460	Y	26.3	Very low	27.4	Very low	189 Å²	189	107.1 Å²	107.1	74%	0.741	61%	0.609	S	S	*	*	S	Bend	trans	-100.5	6.8	-177.9	-84.8	-82	0	0	0	115.4
461	G	24.6	Very low	27.1	Very low	78 Å²	78	113.2 Å²	113.2	80%	0.804	63%	0.632	S	S	*	*	S	Bend	trans	-107.7	-2.3	176.5	0	0	0	0	0	115.8
462	A	25.4	Very low	26.8	Very low	82 Å²	82	110.4 Å²	110.4	68%	0.678	62%	0.618	S	S	*	*			trans	-119.1	64.9	-173.7	0	0	0	0	0	111.5	E464	A462-E464 VanDerWaalsContact C-N 3.26Å; A462-E464 PolarHBondContact O-N 3.31Å
463	H	23.4	Very low	26.5	Very low	177 Å²	177	111.2 Å²	111.2	82%	0.819	62%	0.615	S	S	*	*			trans	-79	81.6	155.6	-82.7	-72.7	0	0	0	108.2
464	E	26.6	Very low	26.4	Very low	187 Å²	187	109.1 Å²	109.1	87%	0.874	60%	0.604	S	S	*	*			trans	175.5	122.7	150.9	-98.1	166.9	-165.1	0	0	110.4	A462	A462-E464 VanDerWaalsContact C-N 3.26Å; A462-E464 PolarHBondContact O-N 3.31Å
465	K	24.2	Very low	26.1	Very low	200 Å²	200	113.3 Å²	113.3	87%	0.87	63%	0.631	S	S	*	*			trans	-80.6	165.4	172.2	-76	176.4	174	176.3	0	110
466	P	26.8	Very low	26.1	Very low	121 Å²	121	114.3 Å²	114.3	79%	0.786	64%	0.644	S	S	*	*			cis	-137.8	-178.4	21.4	36.4	-13.5	0	0	0	116
467	G	23.6	Very low	26	Very low	78 Å²	78	115.4 Å²	115.4	80%	0.804	65%	0.648	S	S	*	*			trans	-52	140.5	-167.5	0	0	0	0	0	118.1
468	V	24.9	Very low	26.1	Very low	96 Å²	96	111.8 Å²	111.8	58%	0.582	63%	0.634	S	S	*	*			trans	-106.3	113.5	170.2	-178.9	0	0	0	0	108.1	Y470	V468-Y470 HydrophobicContact CB-CE2 4.12Å; V468-Y470 HydrophobicContact CG1-CD1 4.39Å; V468-Y470 HydrophobicContact CG1-CD2 4.14Å; V468-Y470 HydrophobicContact CG1-CE1 4.02Å; V468-Y470 HydrophobicContact CG1-CE2 3.73Å; V468-Y470 HydrophobicContact CG1-CG 4.46Å
469	T	25.3	Very low	26	Very low	125 Å²	125	110.4 Å²	110.4	77%	0.767	63%	0.629	S	S	*	*			trans	-82.2	121.7	168.1	-34.6	0	0	0	0	108
470	Y	26.1	Very low	26.1	Very low	102 Å²	102	114.8 Å²	114.8	40%	0.4	64%	0.64	S	S	.	*			trans	-96	106.7	175	-69.4	-84.8	0	0	0	109.9	T418 V468 I472	T418-Y470 HydrophobicContact CG2-CD1 3.87Å; T418-Y470 HydrophobicContact CG2-CE1 4.26Å; V468-Y470 HydrophobicContact CB-CE2 4.12Å; V468-Y470 HydrophobicContact CG1-CD1 4.39Å; V468-Y470 HydrophobicContact CG1-CD2 4.14Å; V468-Y470 HydrophobicContact CG1-CE1 4.02Å; V468-Y470 HydrophobicContact CG1-CE2 3.73Å; V468-Y470 HydrophobicContact CG1-CG 4.46Å; Y470-I472 PolarHBondContact O-N 3.37Å
471	E	23.8	Very low	26.5	Very low	149 Å²	149	108.8 Å²	108.8	70%	0.696	62%	0.62	S	S	*	*			trans	-86.1	104.3	167.6	-164.8	-170.7	169	0	0	108.7	K473	E471-K473 PolarHBondContact O-N 2.99Å; E471-K473 WeakPolarHBondContact OE1-CE 3.23Å
472	I	28.5	Very low	26.7	Very low	46 Å²	46	111.3 Å²	111.3	24%	0.236	61%	0.606	C	S	.	*			trans	-86.1	95.4	174.9	-62.6	166.5	0	0	0	108.3	L421 Y470 C474 V521	L421-I472 HydrophobicContact CB-CG2 4.47Å; L421-I472 HydrophobicContact CD1-CD1 3.62Å; L421-I472 HydrophobicContact CD1-CG1 4.02Å; L421-I472 HydrophobicContact CD1-CG2 3.66Å; Y470-I472 PolarHBondContact O-N 3.37Å; I472-C474 PolarHBondContact O-N 3.4Å; I472-C474 VanDerWaalsContact O-N 3.15Å; I472-V521 HydrophobicContact CD1-CG1 4.16Å
473	K	24.7	Very low	26.8	Very low	149 Å²	149	115.7 Å²	115.7	65%	0.648	61%	0.613	S	S	*	*			trans	-77.9	91.1	165.7	-92.6	178.9	179.4	162.9	0	110.1	E471 T475	E471-K473 PolarHBondContact O-N 2.99Å; E471-K473 WeakPolarHBondContact OE1-CE 3.23Å; K473-T475 PolarHBondContact O-N 2.9Å
474	C	27.6	Very low	27.2	Very low	57 Å²	57	111.7 Å²	111.7	39%	0.385	60%	0.601	S	S	.	*			trans	-70.1	97.1	164.3	-143.3	0	0	0	0	107.7	I472 C476	I472-C474 PolarHBondContact O-N 3.4Å; I472-C474 VanDerWaalsContact O-N 3.15Å; C474-C476 VanDerWaalsContact CA-SG 3.54Å; C474-C476 HydrophobicContact CB-CB 4.12Å; C474-C476 WeakPolarHBondContact CB-SG 3.48Å; C474-C476 PolarHBondContact O-N 3.04Å; C474-C476 WeakPolarHBondContact SG-CB 3.47Å; C474-C476 CovalentContact SG-SG 2.05Å; C474-C476 PolarHBondContact SG-SG 3.31Å
475	T	25.7	Very low	27.3	Very low	126 Å²	126	106.2 Å²	106.2	77%	0.773	59%	0.594	S	S	*	*			trans	-80.3	20.3	165.5	53.9	0	0	0	0	111.9	K473 S477	K473-T475 PolarHBondContact O-N 2.9Å; T475-S477 PolarHBondContact O-N 3.08Å
476	C	28.9	Very low	27.6	Very low	79 Å²	79	102 Å²	102	53%	0.534	58%	0.581	S	S	.	*			trans	-61.6	76.8	174.3	-40.2	0	0	0	0	108.8	C474 A478	C474-C476 VanDerWaalsContact CA-SG 3.54Å; C474-C476 HydrophobicContact CB-CB 4.12Å; C474-C476 WeakPolarHBondContact CB-SG 3.48Å; C474-C476 PolarHBondContact O-N 3.04Å; C474-C476 WeakPolarHBondContact SG-CB 3.47Å; C474-C476 CovalentContact SG-SG 2.05Å; C474-C476 PolarHBondContact SG-SG 3.31Å; C476-A478 PolarHBondContact O-N 3.31Å; C476-A478 VanDerWaalsContact O-N 3.15Å
477	S	25.2	Very low	27.9	Very low	74 Å²	74	100.1 Å²	100.1	52%	0.517	58%	0.576	S	S	.	*			trans	-57.3	121.6	170.1	48.9	0	0	0	0	106.7	T475 S479 Y480	T475-S477 PolarHBondContact O-N 3.08Å; S477-S479 WeakPolarHBondContact CB-OG 3.27Å; S477-S479 PolarHBondContact O-N 3.14Å; S477-S479 PolarHBondContact O-OG 3.03Å; S477-S479 PolarHBondContact OG-OG 3.07Å; S477-Y480 PolarHBondContact O-N 3.19Å
478	A	29.4	Very low	28.4	Very low	38 Å²	38	101.2 Å²	101.2	31%	0.314	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-59.4	11.6	172.8	0	0	0	0	0	113.7	C476 Y480 I481 I531	C476-A478 PolarHBondContact O-N 3.31Å; C476-A478 VanDerWaalsContact O-N 3.15Å; A478-Y480 VanDerWaalsContact C-N 3.26Å; A478-I481 HydrophobicContact CB-CD1 4.17Å; A478-I481 PolarHBondContact O-N 2.8Å; A478-I531 HydrophobicContact CB-CD1 3.34Å
479	S	27.9	Very low	29.1	Very low	65 Å²	65	97.9 Å²	97.9	46%	0.455	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-68.9	-15.6	167.6	41.3	0	0	0	0	113.8	S477 I481 Y482	S477-S479 WeakPolarHBondContact CB-OG 3.27Å; S477-S479 PolarHBondContact O-N 3.14Å; S477-S479 PolarHBondContact O-OG 3.03Å; S477-S479 PolarHBondContact OG-OG 3.07Å; S479-I481 PolarHBondContact O-N 2.94Å; S479-Y482 PolarHBondContact O-N 3.4Å
480	Y	29.5	Very low	29.4	Very low	192 Å²	192	95.5 Å²	95.5	75%	0.753	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-72.1	-3.3	172.9	-121.9	-87	0	0	0	114.1	S477 A478	S477-Y480 PolarHBondContact O-N 3.19Å; A478-Y480 VanDerWaalsContact C-N 3.26Å
481	I	33.3	Very low	29.6	Very low	63 Å²	63	94.2 Å²	94.2	32%	0.323	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-89.1	-1.4	-179.3	-55.8	174.8	0	0	0	111.9	A478 S479	A478-I481 HydrophobicContact CB-CD1 4.17Å; A478-I481 PolarHBondContact O-N 2.8Å; S479-I481 PolarHBondContact O-N 2.94Å
482	Y	29.1	Very low	30.2	Very low	132 Å²	132	90 Å²	90	52%	0.518	53%	0.525	S	S	.	.	S	Bend	trans	-137	6.3	-166.5	-79.6	-80.9	0	0	0	117.9	S479 R534	S479-Y482 PolarHBondContact O-N 3.4Å; Y482-R534 PolarHBondContact OH-NH1 3.01Å; Y482-R534 VanDerWaalsContact OH-NH1 3.08Å
483	E	29.2	Very low	30.4	Very low	174 Å²	174	89.6 Å²	89.6	81%	0.813	52%	0.522	S	S	*	.	S	Bend	trans	-102.6	-2.3	-176.9	-76.8	-170.2	163.5	0	0	116.3
484	T	31.1	Very low	31	Very low	93 Å²	93	87.1 Å²	87.1	57%	0.571	52%	0.515	S	S	*	.	S	Bend	trans	-115.6	96.2	171.5	45.6	0	0	0	0	110.6	D486 Q493	T484-D486 PolarHBondContact O-N 3.35Å; T484-Q493 PolarHBondContact OG1-NE2 2.95Å
485	G	27.7	Very low	31.3	Very low	71 Å²	71	88.7 Å²	88.7	73%	0.732	52%	0.519	S	S	*	.			trans	-72.6	38.2	-170.1	0	0	0	0	0	117.2
486	D	32.1	Very low	31.9	Very low	111 Å²	111	86.5 Å²	86.5	59%	0.594	50%	0.5	S	S	*	.			trans	-101.9	111	170.9	-83.7	-29.8	0	0	0	110.2	T484 S488 S489	T484-D486 PolarHBondContact O-N 3.35Å; D486-S488 PolarHBondContact O-N 3.48Å; D486-S489 WeakPolarHBondContact O-CB 3.32Å; D486-S489 PolarHBondContact O-N 3.49Å; D486-S489 PolarHBondContact O-OG 3.13Å
487	A	31.5	Very low	32.2	Very low	83 Å²	83	85 Å²	85	69%	0.686	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.7	-176	0	0	0	0	0	114.2	S489	A487-S489 VanDerWaalsContact C-N 3.33Å
488	S	34.2	Very low	32.8	Very low	100 Å²	100	85.5 Å²	85.5	70%	0.699	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-18.3	171.6	53.7	0	0	0	0	113.5	D486 S491	D486-S488 PolarHBondContact O-N 3.48Å; S488-S491 PolarHBondContact O-OG 2.91Å
489	S	39.3	Very low	33.2	Very low	26 Å²	26	87.7 Å²	87.7	18%	0.182	49%	0.492	C	S	.	.	H	α-helix	trans	-84.8	-11.7	176.6	74.5	0	0	0	0	113.5	D486 A487 S492 Q493	D486-S489 WeakPolarHBondContact O-CB 3.32Å; D486-S489 PolarHBondContact O-N 3.49Å; D486-S489 PolarHBondContact O-OG 3.13Å; A487-S489 VanDerWaalsContact C-N 3.33Å; S489-S492 PolarHBondContact O-N 2.95Å; S489-Q493 VanDerWaalsContact O-CG 3.32Å; S489-Q493 WeakPolarHBondContact O-CG 3.43Å; S489-Q493 PolarHBondContact O-N 3.18Å
490	H	32.9	Very low	33.8	Very low	75 Å²	75	87.3 Å²	87.3	35%	0.347	49%	0.485	S	S	.	.	H	α-helix	trans	-65.9	-39.4	-178.5	-83.3	-49.8	0	0	0	113.5	I494	H490-I494 WeakPolarHBondContact O-CB 3.2Å; H490-I494 WeakPolarHBondContact O-CD1 3.12Å; H490-I494 WeakPolarHBondContact O-CG1 3.44Å; H490-I494 PolarHBondContact O-N 3.31Å
491	S	30.6	Very low	34.3	Very low	76 Å²	76	83.7 Å²	83.7	53%	0.531	47%	0.474	S	S	.	.	H	α-helix	trans	-66.4	-42.7	176.4	50.2	0	0	0	0	111.1	S488 L495	S488-S491 PolarHBondContact O-OG 2.91Å; S491-L495 VanDerWaalsContact O-CB 3.25Å; S491-L495 WeakPolarHBondContact O-CB 3.27Å; S491-L495 WeakPolarHBondContact O-CD1 3.37Å; S491-L495 PolarHBondContact O-N 2.9Å
492	S	34.6	Very low	34.6	Very low	60 Å²	60	89.9 Å²	89.9	42%	0.42	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-41.9	177	142.5	0	0	0	0	112.7	S489 L495 Q496	S489-S492 PolarHBondContact O-N 2.95Å; S492-L495 WeakPolarHBondContact O-CB 3.38Å; S492-L495 PolarHBondContact O-N 3.22Å; S492-Q496 WeakPolarHBondContact O-CG 3.29Å; S492-Q496 PolarHBondContact O-N 3.14Å
493	Q	34.5	Very low	34.9	Very low	38 Å²	38	84.3 Å²	84.3	18%	0.178	47%	0.474	C	S	.	.	H	α-helix	trans	-75.1	-37.2	-179.5	-70.1	174.1	11.8	0	0	112.5	T484 S489 L495 Q496 A497	T484-Q493 PolarHBondContact OG1-NE2 2.95Å; S489-Q493 VanDerWaalsContact O-CG 3.32Å; S489-Q493 WeakPolarHBondContact O-CG 3.43Å; S489-Q493 PolarHBondContact O-N 3.18Å; Q493-L495 VanDerWaalsContact C-N 3.34Å; Q493-Q496 PolarHBondContact O-N 3.41Å; Q493-A497 PolarHBondContact O-N 2.86Å
494	I	35.9	Very low	35.3	Very low	96 Å²	96	78 Å²	78	49%	0.492	45%	0.445	S	S	.	.	H	α-helix	trans	-66	-40	171.6	-66.6	167.2	0	0	0	110	H490 A497 M498	H490-I494 WeakPolarHBondContact O-CB 3.2Å; H490-I494 WeakPolarHBondContact O-CD1 3.12Å; H490-I494 WeakPolarHBondContact O-CG1 3.44Å; H490-I494 PolarHBondContact O-N 3.31Å; I494-A497 PolarHBondContact O-N 3.07Å; I494-M498 HydrophobicContact CG2-CE 3.86Å; I494-M498 HydrophobicContact CG2-CG 4.41Å; I494-M498 WeakPolarHBondContact O-CB 3.42Å; I494-M498 VanDerWaalsContact O-CG 3.32Å; I494-M498 WeakPolarHBondContact O-CG 3.49Å; I494-M498 PolarHBondContact O-N 3.26Å
495	L	35.5	Very low	35.8	Very low	90 Å²	90	78.2 Å²	78.2	47%	0.471	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-42.3	171.3	-98.4	142.6	0	0	0	111.8	S491 S492 Q493 M498 Q499	S491-L495 VanDerWaalsContact O-CB 3.25Å; S491-L495 WeakPolarHBondContact O-CB 3.27Å; S491-L495 WeakPolarHBondContact O-CD1 3.37Å; S491-L495 PolarHBondContact O-N 2.9Å; S492-L495 WeakPolarHBondContact O-CB 3.38Å; S492-L495 PolarHBondContact O-N 3.22Å; Q493-L495 VanDerWaalsContact C-N 3.34Å; L495-M498 PolarHBondContact O-N 3.4Å; L495-Q499 VanDerWaalsContact O-CB 3.24Å; L495-Q499 WeakPolarHBondContact O-CB 3.2Å; L495-Q499 WeakPolarHBondContact O-CG 3.28Å; L495-Q499 PolarHBondContact O-N 3.36Å
496	Q	37.8	Very low	36.2	Very low	80 Å²	80	77 Å²	77	37%	0.374	42%	0.417	S	S	.	.	H	α-helix	trans	-64	-43.9	174.4	-82	-176.8	-11.8	0	0	112.4	L430 S492 Q493 Q499 I500	L430-Q496 HydrophobicContact CD2-CG 3.84Å; S492-Q496 WeakPolarHBondContact O-CG 3.29Å; S492-Q496 PolarHBondContact O-N 3.14Å; Q493-Q496 PolarHBondContact O-N 3.41Å; Q496-Q499 WeakPolarHBondContact O-CB 3.39Å; Q496-Q499 PolarHBondContact O-N 3.01Å; Q496-I500 VanDerWaalsContact O-CG1 3.25Å; Q496-I500 WeakPolarHBondContact O-CG1 3.23Å; Q496-I500 PolarHBondContact O-N 3.31Å
497	A	35.7	Very low	36.4	Very low	47 Å²	47	72.4 Å²	72.4	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-64.2	-41.8	176.4	0	0	0	0	0	111.8	Q493 I494 I500 Q501	Q493-A497 PolarHBondContact O-N 2.86Å; I494-A497 PolarHBondContact O-N 3.07Å; A497-I500 PolarHBondContact O-N 2.95Å; A497-Q501 WeakPolarHBondContact O-CB 3.27Å; A497-Q501 PolarHBondContact O-N 3.46Å
498	M	36.1	Very low	36.7	Very low	86 Å²	86	71.6 Å²	71.6	42%	0.424	38%	0.376	S	S	.	.	H	α-helix	trans	-65.7	-36.6	173.1	-74.9	-161.6	-75.5	0	0	112.1	I494 L495 Q501 R502	I494-M498 HydrophobicContact CG2-CE 3.86Å; I494-M498 HydrophobicContact CG2-CG 4.41Å; I494-M498 WeakPolarHBondContact O-CB 3.42Å; I494-M498 VanDerWaalsContact O-CG 3.32Å; I494-M498 WeakPolarHBondContact O-CG 3.49Å; I494-M498 PolarHBondContact O-N 3.26Å; L495-M498 PolarHBondContact O-N 3.4Å; M498-Q501 PolarHBondContact O-N 3.1Å; M498-R502 VanDerWaalsContact O-CB 3.26Å; M498-R502 WeakPolarHBondContact O-CB 3.5Å; M498-R502 VanDerWaalsContact O-CG 3.27Å; M498-R502 WeakPolarHBondContact O-CG 3.21Å; M498-R502 PolarHBondContact O-N 3.18Å
499	Q	39.7	Very low	36.6	Very low	84 Å²	84	68.5 Å²	68.5	39%	0.393	36%	0.361	S	S	.	.	H	α-helix	trans	-65.4	-45.2	174.1	-81.2	172.6	-12.3	0	0	110.8	L495 Q496 Q501 R502 C503	L495-Q499 VanDerWaalsContact O-CB 3.24Å; L495-Q499 WeakPolarHBondContact O-CB 3.2Å; L495-Q499 WeakPolarHBondContact O-CG 3.28Å; L495-Q499 PolarHBondContact O-N 3.36Å; Q496-Q499 WeakPolarHBondContact O-CB 3.39Å; Q496-Q499 PolarHBondContact O-N 3.01Å; Q499-Q501 VanDerWaalsContact C-N 3.32Å; Q499-Q501 PolarHBondContact O-N 3.36Å; Q499-R502 CarbonylContact O-C 3.58Å; Q499-R502 PolarHBondContact O-N 3.43Å; Q499-C503 WeakPolarHBondContact O-CB 3.34Å; Q499-C503 PolarHBondContact O-N 2.83Å; Q499-C503 PolarHBondContact O-SG 3.43Å
500	I	39.9	Very low	36.3	Very low	57 Å²	57	67.7 Å²	67.7	29%	0.292	36%	0.355	S	S	.	.	H	α-helix	trans	-57.2	-47.1	173.3	-69	164.8	0	0	0	110	L430 L433 Q496 A497 R502 C503 M504	L430-I500 HydrophobicContact CD1-CD1 4.31Å; L430-I500 HydrophobicContact CD1-CG1 3.67Å; L433-I500 HydrophobicContact CD1-CG1 4.17Å; L433-I500 HydrophobicContact CD1-CG2 4.02Å; Q496-I500 VanDerWaalsContact O-CG1 3.25Å; Q496-I500 WeakPolarHBondContact O-CG1 3.23Å; Q496-I500 PolarHBondContact O-N 3.31Å; A497-I500 PolarHBondContact O-N 2.95Å; I500-R502 PolarHBondContact O-N 3.39Å; I500-C503 PolarHBondContact O-N 3.29Å; I500-M504 HydrophobicContact CG2-CG 4.5Å; I500-M504 HydrophobicContact CG2-SD 4.29Å; I500-M504 WeakPolarHBondContact O-CB 3.21Å; I500-M504 WeakPolarHBondContact O-CG 3.39Å; I500-M504 PolarHBondContact O-N 3.09Å
501	Q	38.7	Very low	36.1	Very low	115 Å²	115	67.8 Å²	67.8	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-65.7	-38	178.7	-164	179.8	5.7	0	0	112.7	A497 M498 Q499 K505	A497-Q501 WeakPolarHBondContact O-CB 3.27Å; A497-Q501 PolarHBondContact O-N 3.46Å; M498-Q501 PolarHBondContact O-N 3.1Å; Q499-Q501 VanDerWaalsContact C-N 3.32Å; Q499-Q501 PolarHBondContact O-N 3.36Å; Q501-K505 PolarHBondContact O-N 3.44Å
502	R	41.1	Very low	36.1	Very low	193 Å²	193	72.8 Å²	72.8	73%	0.728	37%	0.369	S	S	*	.	H	α-helix	trans	-69.3	-34.4	175.1	-80	-179.4	178.3	-176.8	0.4	112.5	M498 Q499 I500 P506	M498-R502 VanDerWaalsContact O-CB 3.26Å; M498-R502 WeakPolarHBondContact O-CB 3.5Å; M498-R502 VanDerWaalsContact O-CG 3.27Å; M498-R502 WeakPolarHBondContact O-CG 3.21Å; M498-R502 PolarHBondContact O-N 3.18Å; Q499-R502 CarbonylContact O-C 3.58Å; Q499-R502 PolarHBondContact O-N 3.43Å; I500-R502 PolarHBondContact O-N 3.39Å; R502-P506 WeakPolarHBondContact O-CD 3.32Å; R502-P506 WeakPolarHBondContact O-CG 3.39Å
503	C	34.8	Very low	35.8	Very low	16 Å²	16	77.6 Å²	77.6	11%	0.108	39%	0.387	C	S	.	.	H	α-helix	trans	-75.5	-34.1	175.4	-69.3	0	0	0	0	111.9	D437 Q499 I500 P506 I507	D437-C503 HydrophobicContact CB-CB 4.3Å; Q499-C503 WeakPolarHBondContact O-CB 3.34Å; Q499-C503 PolarHBondContact O-N 2.83Å; Q499-C503 PolarHBondContact O-SG 3.43Å; I500-C503 PolarHBondContact O-N 3.29Å; C503-P506 WeakPolarHBondContact O-CD 3.42Å; C503-I507 WeakPolarHBondContact O-CD1 3.46Å; C503-I507 WeakPolarHBondContact O-CG1 3.21Å
504	M	37.5	Very low	35.5	Very low	41 Å²	41	79.5 Å²	79.5	20%	0.202	40%	0.401	C	S	.	.	H	α-helix	trans	-72.3	-34.4	-178.8	-75.3	-168	121.6	0	0	113.9	I500 I507 L508 L523 F525	I500-M504 HydrophobicContact CG2-CG 4.5Å; I500-M504 HydrophobicContact CG2-SD 4.29Å; I500-M504 WeakPolarHBondContact O-CB 3.21Å; I500-M504 WeakPolarHBondContact O-CG 3.39Å; I500-M504 PolarHBondContact O-N 3.09Å; M504-I507 PolarHBondContact O-N 3.03Å; M504-L508 HydrophobicContact CB-CD1 4.39Å; M504-L508 WeakPolarHBondContact O-CB 3.47Å; M504-L508 WeakPolarHBondContact O-CD1 3.5Å; M504-L508 WeakPolarHBondContact O-CG 3.49Å; M504-L508 PolarHBondContact O-N 3.37Å; M504-L523 HydrophobicContact CE-CD1 3.45Å; M504-L523 VanDerWaalsContact CE-CD1 3.45Å; M504-L523 HydrophobicContact CE-CD2 3.95Å; M504-L523 HydrophobicContact CE-CG 4.35Å; M504-L523 HydrophobicContact SD-CD1 3.99Å; M504-F525 HydrophobicContact SD-CZ 4.4Å
505	K	40.9	Very low	35	Very low	97 Å²	97	81.9 Å²	81.9	42%	0.422	41%	0.405	S	S	.	.	H	α-helix	trans	-61	-48.2	-177.8	-125.2	177.8	-177.9	171	0	113.5	Q501 G509	Q501-K505 PolarHBondContact O-N 3.44Å; K505-G509 PolarHBondContact O-N 2.83Å
506	P	37.5	Very low	34.5	Very low	45 Å²	45	82.6 Å²	82.6	29%	0.292	42%	0.424	S	S	.	.	H	α-helix	trans	-66.5	-35.5	175.7	-19.6	30.7	0	0	0	113.3	K444 R502 C503 G509 A510	K444-P506 PolarHBondContact NZ-O 3.12Å; R502-P506 WeakPolarHBondContact O-CD 3.32Å; R502-P506 WeakPolarHBondContact O-CG 3.39Å; C503-P506 WeakPolarHBondContact O-CD 3.42Å; P506-G509 PolarHBondContact O-N 2.98Å; P506-A510 WeakPolarHBondContact O-CB 3.39Å; P506-A510 PolarHBondContact O-N 3.3Å
507	I	36.5	Very low	33.9	Very low	16 Å²	16	87.2 Å²	87.2	8%	0.082	44%	0.439	C	S	.	.	H	α-helix	trans	-64	-51.6	177.5	-66.1	170.2	0	0	0	110.4	L436 D437 V440 C503 M504 G509 A510 M511	L436-I507 HydrophobicContact CB-CD1 4.1Å; D437-I507 HydrophobicContact CB-CD1 3.99Å; D437-I507 HydrophobicContact CB-CG1 4.19Å; V440-I507 HydrophobicContact CG2-CG1 4.34Å; V440-I507 HydrophobicContact CG2-CG2 4.45Å; C503-I507 WeakPolarHBondContact O-CD1 3.46Å; C503-I507 WeakPolarHBondContact O-CG1 3.21Å; M504-I507 PolarHBondContact O-N 3.03Å; I507-G509 VanDerWaalsContact C-N 3.33Å; I507-G509 PolarHBondContact O-N 3.49Å; I507-A510 PolarHBondContact O-N 3.07Å; I507-A510 VanDerWaalsContact O-N 3.16Å; I507-M511 HydrophobicContact CG2-CE 3.99Å; I507-M511 HydrophobicContact CG2-SD 4.15Å; I507-M511 WeakPolarHBondContact O-CG 3.48Å; I507-M511 PolarHBondContact O-N 3.03Å; I507-M511 VanDerWaalsContact O-N 3.08Å
508	L	36.4	Very low	33.3	Very low	65 Å²	65	92 Å²	92	34%	0.34	46%	0.463	S	S	.	.	H	α-helix	trans	-63.6	-36.9	177.1	-74.1	160.3	0	0	0	112.4	M504 V521 L523	M504-L508 HydrophobicContact CB-CD1 4.39Å; M504-L508 WeakPolarHBondContact O-CB 3.47Å; M504-L508 WeakPolarHBondContact O-CD1 3.5Å; M504-L508 WeakPolarHBondContact O-CG 3.49Å; M504-L508 PolarHBondContact O-N 3.37Å; L508-V521 HydrophobicContact CD2-CB 3.9Å; L508-V521 HydrophobicContact CD2-CG1 4.16Å; L508-L523 HydrophobicContact CD1-CD1 4.15Å
509	G	33	Very low	32.8	Very low	36 Å²	36	91.3 Å²	91.3	37%	0.371	46%	0.461	S	S	.	.	H	α-helix	trans	-71.7	-25.9	175.1	0	0	0	0	0	114	K505 P506 I507	K505-G509 PolarHBondContact O-N 2.83Å; P506-G509 PolarHBondContact O-N 2.98Å; I507-G509 VanDerWaalsContact C-N 3.33Å; I507-G509 PolarHBondContact O-N 3.49Å
510	A	32.4	Very low	32	Very low	8 Å²	8	94.1 Å²	94.1	7%	0.066	47%	0.474	C	S	.	.	H	α-helix	trans	-79.1	-40.5	177	0	0	0	0	0	113.2	V440 K444 P506 I507 K512 M513	V440-A510 HydrophobicContact CB-CB 4.48Å; V440-A510 HydrophobicContact CG1-CB 3.08Å; K444-A510 HydrophobicContact CD-CB 3.86Å; K444-A510 HydrophobicContact CG-CB 4.2Å; K444-A510 VanDerWaalsContact NZ-CB 3.31Å; P506-A510 WeakPolarHBondContact O-CB 3.39Å; P506-A510 PolarHBondContact O-N 3.3Å; I507-A510 PolarHBondContact O-N 3.07Å; I507-A510 VanDerWaalsContact O-N 3.16Å; A510-K512 PolarHBondContact O-N 2.8Å; A510-K512 VanDerWaalsContact O-N 3.17Å; A510-M513 PolarHBondContact O-N 2.73Å; A510-M513 VanDerWaalsContact O-N 3.12Å
511	M	29.8	Very low	31.4	Very low	77 Å²	77	92.9 Å²	92.9	38%	0.379	47%	0.47	S	S	.	.	H	α-helix	trans	-63.9	-19.2	179.3	-72	176.6	168.4	0	0	112.4	I507 L519 V521	I507-M511 HydrophobicContact CG2-CE 3.99Å; I507-M511 HydrophobicContact CG2-SD 4.15Å; I507-M511 WeakPolarHBondContact O-CG 3.48Å; I507-M511 PolarHBondContact O-N 3.03Å; I507-M511 VanDerWaalsContact O-N 3.08Å; M511-L519 HydrophobicContact CB-CD2 4.49Å; M511-L519 HydrophobicContact CE-CD2 4.22Å; M511-L519 HydrophobicContact CG-CD2 4.31Å; M511-L519 HydrophobicContact SD-CD2 3.51Å; M511-L519 VanDerWaalsContact SD-CD2 3.51Å; M511-V521 HydrophobicContact SD-CG2 4.48Å
512	K	31.1	Very low	30.8	Very low	181 Å²	181	92.6 Å²	92.6	79%	0.787	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-8.1	174.8	-85.5	-173.5	173.1	-177.8	0	115.7	A510	A510-K512 PolarHBondContact O-N 2.8Å; A510-K512 VanDerWaalsContact O-N 3.17Å
513	M	27.3	Very low	30.1	Very low	161 Å²	161	85.1 Å²	85.1	79%	0.793	45%	0.445	S	S	*	.	S	Bend	trans	-124.2	12	-163.7	-80.9	-71.3	-171.5	0	0	116.2	A510	A510-M513 PolarHBondContact O-N 2.73Å; A510-M513 VanDerWaalsContact O-N 3.12Å
514	T	28.5	Very low	29.6	Very low	78 Å²	78	88.2 Å²	88.2	48%	0.479	46%	0.463	S	S	.	.	S	Bend	trans	-141.5	109.9	178.2	18.2	0	0	0	0	110.6
515	Y	25.9	Very low	29.1	Very low	146 Å²	146	92.9 Å²	92.9	57%	0.573	48%	0.482	S	S	*	.	S	Bend	trans	76.8	151.9	174.6	-57.7	-81.1	0	0	0	117.2	H455 Y517	H455-Y515 AromaticContact CE1-CE1 3.9Å; H455-Y515 AromaticContact CE1-CZ 3.39Å; H455-Y515 PolarHBondContact CE1-OH 3.45Å; H455-Y515 AromaticContact NE2-CE2 3.94Å; H455-Y515 AromaticContact NE2-CZ 3.51Å; H455-Y515 PolarHBondContact NE2-OH 3.1Å; Y515-Y517 PolarHBondContact O-N 3.07Å
516	A	24.6	Very low	28.5	Very low	105 Å²	105	98 Å²	98	87%	0.868	50%	0.501	S	S	*	.	S	Bend	trans	-69.1	47.5	-174.6	0	0	0	0	0	114.2
517	Y	25.2	Very low	28.2	Very low	178 Å²	178	98.3 Å²	98.3	70%	0.698	50%	0.503	S	S	*	.			trans	-129.4	107.2	178.9	-58.2	-82.9	0	0	0	107.7	Y515 L519	Y515-Y517 PolarHBondContact O-N 3.07Å; Y517-L519 PolarHBondContact O-N 2.82Å; Y517-L519 VanDerWaalsContact O-N 3.1Å
518	T	22.7	Very low	28.1	Very low	146 Å²	146	100.4 Å²	100.4	90%	0.896	52%	0.519	S	S	*	.			trans	-71.2	100.4	170.1	37.1	0	0	0	0	109	E520	T518-E520 PolarHBondContact O-N 3.48Å
519	L	25.2	Very low	28	Very low	73 Å²	73	100.8 Å²	100.8	38%	0.382	53%	0.531	S	S	.	.			trans	-85.1	94.1	161.2	-151.3	96.2	0	0	0	107.7	M511 Y517 V521	M511-L519 HydrophobicContact CB-CD2 4.49Å; M511-L519 HydrophobicContact CE-CD2 4.22Å; M511-L519 HydrophobicContact CG-CD2 4.31Å; M511-L519 HydrophobicContact SD-CD2 3.51Å; M511-L519 VanDerWaalsContact SD-CD2 3.51Å; Y517-L519 PolarHBondContact O-N 2.82Å; Y517-L519 VanDerWaalsContact O-N 3.1Å; L519-V521 HydrophobicContact CD2-CG2 3.64Å; L519-V521 HydrophobicContact CG-CG2 4.26Å; L519-V521 PolarHBondContact O-N 3.04Å
520	E	24.2	Very low	28.3	Very low	142 Å²	142	103.7 Å²	103.7	66%	0.664	54%	0.538	S	S	*	.			trans	-80.5	102.1	168.9	-114.6	-177.5	172.7	0	0	108.7	T518	T518-E520 PolarHBondContact O-N 3.48Å
521	V	27.1	Very low	28.5	Very low	32 Å²	32	105 Å²	105	19%	0.194	54%	0.544	C	S	.	.			trans	-95.9	98.2	168.8	-179.1	0	0	0	0	107.6	I472 L508 M511 L519 L523	I472-V521 HydrophobicContact CD1-CG1 4.16Å; L508-V521 HydrophobicContact CD2-CB 3.9Å; L508-V521 HydrophobicContact CD2-CG1 4.16Å; M511-V521 HydrophobicContact SD-CG2 4.48Å; L519-V521 HydrophobicContact CD2-CG2 3.64Å; L519-V521 HydrophobicContact CG-CG2 4.26Å; L519-V521 PolarHBondContact O-N 3.04Å; V521-L523 HydrophobicContact CG1-CD1 4.23Å; V521-L523 HydrophobicContact CG1-CG 4.14Å; V521-L523 PolarHBondContact O-N 3.37Å
522	I	25.1	Very low	28.9	Very low	109 Å²	109	105.4 Å²	105.4	56%	0.559	55%	0.546	S	S	*	.			trans	-85.2	103.8	172.5	-56.5	176.3	0	0	0	107.8	V524	I522-V524 HydrophobicContact CG2-CG2 3.71Å
523	L	26.3	Very low	29.4	Very low	35 Å²	35	105.2 Å²	105.2	18%	0.183	54%	0.54	C	S	.	.			trans	-92.2	96.1	169.2	-79.8	154.6	0	0	0	108.9	M504 L508 V521 F525	M504-L523 HydrophobicContact CE-CD1 3.45Å; M504-L523 VanDerWaalsContact CE-CD1 3.45Å; M504-L523 HydrophobicContact CE-CD2 3.95Å; M504-L523 HydrophobicContact CE-CG 4.35Å; M504-L523 HydrophobicContact SD-CD1 3.99Å; L508-L523 HydrophobicContact CD1-CD1 4.15Å; V521-L523 HydrophobicContact CG1-CD1 4.23Å; V521-L523 HydrophobicContact CG1-CG 4.14Å; V521-L523 PolarHBondContact O-N 3.37Å; L523-F525 HydrophobicContact CB-CD2 4.1Å; L523-F525 HydrophobicContact CB-CE2 3.73Å; L523-F525 HydrophobicContact CD1-CE2 4.42Å; L523-F525 HydrophobicContact CD2-CE2 4.42Å; L523-F525 HydrophobicContact CG-CE2 4.41Å; L523-F525 PolarHBondContact O-N 3.27Å; L523-F525 VanDerWaalsContact O-N 3.15Å
524	V	24.9	Very low	29.9	Very low	81 Å²	81	105.1 Å²	105.1	49%	0.491	53%	0.531	S	S	.	.			trans	-79.3	95.5	170.8	-170	0	0	0	0	108.5	I522 Y526	I522-V524 HydrophobicContact CG2-CG2 3.71Å; V524-Y526 HydrophobicContact CB-CE2 4.2Å; V524-Y526 HydrophobicContact CG1-CD2 3.86Å; V524-Y526 HydrophobicContact CG1-CE1 4.38Å; V524-Y526 HydrophobicContact CG1-CE2 3.33Å
525	F	27	Very low	30.4	Very low	140 Å²	140	105.3 Å²	105.3	61%	0.614	53%	0.528	S	S	*	.			trans	-77.6	121.8	166.3	-73.2	-88.3	0	0	0	108.5	M504 L523 P527	M504-F525 HydrophobicContact SD-CZ 4.4Å; L523-F525 HydrophobicContact CB-CD2 4.1Å; L523-F525 HydrophobicContact CB-CE2 3.73Å; L523-F525 HydrophobicContact CD1-CE2 4.42Å; L523-F525 HydrophobicContact CD2-CE2 4.42Å; L523-F525 HydrophobicContact CG-CE2 4.41Å; L523-F525 PolarHBondContact O-N 3.27Å; L523-F525 VanDerWaalsContact O-N 3.15Å; F525-P527 WeakPolarHBondContact O-CD 3.37Å
526	Y	27.5	Very low	31.2	Very low	204 Å²	204	102.8 Å²	102.8	80%	0.8	52%	0.524	S	S	*	.			trans	-98.3	80.7	163.2	-70.2	-84.5	0	0	0	108.6	V524 S528	V524-Y526 HydrophobicContact CB-CE2 4.2Å; V524-Y526 HydrophobicContact CG1-CD2 3.86Å; V524-Y526 HydrophobicContact CG1-CE1 4.38Å; V524-Y526 HydrophobicContact CG1-CE2 3.33Å; Y526-S528 PolarHBondContact O-N 3.25Å
527	P	31	Very low	32	Very low	52 Å²	52	100.1 Å²	100.1	34%	0.338	50%	0.503	S	S	.	.			trans	-62.4	135	169.3	28.8	-33.4	0	0	0	107.9	F525 I531 M532	F525-P527 WeakPolarHBondContact O-CD 3.37Å; P527-I531 HydrophobicContact CB-CB 4.25Å; P527-I531 HydrophobicContact CB-CG2 4.04Å; P527-M532 HydrophobicContact CB-CG 3.74Å; P527-M532 HydrophobicContact CB-SD 4.03Å; P527-M532 HydrophobicContact CG-CG 3.38Å; P527-M532 HydrophobicContact CG-SD 3.47Å; P527-M532 WeakPolarHBondContact CG-SD 3.35Å
528	S	34	Very low	32.5	Very low	60 Å²	60	98.3 Å²	98.3	42%	0.42	50%	0.498	S	S	.	.			trans	-57.5	149.4	169.1	79	0	0	0	0	108.8	Y526 D530 I531 M532	Y526-S528 PolarHBondContact O-N 3.25Å; S528-D530 PolarHBondContact O-N 3.42Å; S528-I531 PolarHBondContact O-N 3.35Å; S528-I531 WeakPolarHBondContact OG-CG1 3.4Å; S528-I531 PolarHBondContact OG-N 3.3Å; S528-M532 PolarHBondContact O-N 3.16Å; S528-M532 VanDerWaalsContact O-N 3.11Å
529	A	36	Very low	33.2	Very low	73 Å²	73	95.4 Å²	95.4	60%	0.603	48%	0.477	S	S	*	.	H	α-helix	trans	-52.7	-29.2	179.4	0	0	0	0	0	112.6	R533	A529-R533 WeakPolarHBondContact O-CG 3.16Å; A529-R533 PolarHBondContact O-N 3Å
530	D	38.6	Very low	33.8	Very low	96 Å²	96	94.9 Å²	94.9	51%	0.513	48%	0.483	S	S	.	.	H	α-helix	trans	-73.3	-35.6	175.1	-79.2	-26	0	0	0	113.8	S528 R533 R534	S528-D530 PolarHBondContact O-N 3.42Å; D530-R533 PolarHBondContact O-N 3.47Å; D530-R533 IonicContact OD1-NH1 3.72Å; D530-R534 WeakPolarHBondContact O-CB 3.45Å; D530-R534 WeakPolarHBondContact O-CG 3.01Å; D530-R534 PolarHBondContact O-N 3.43Å
531	I	36.3	Very low	34.4	Very low	36 Å²	36	93.8 Å²	93.8	19%	0.185	48%	0.481	C	S	.	.	H	α-helix	trans	-68	-41.7	174.6	-69	169.8	0	0	0	110	A478 P527 S528 R533 R534 I535	A478-I531 HydrophobicContact CB-CD1 3.34Å; P527-I531 HydrophobicContact CB-CB 4.25Å; P527-I531 HydrophobicContact CB-CG2 4.04Å; S528-I531 PolarHBondContact O-N 3.35Å; S528-I531 WeakPolarHBondContact OG-CG1 3.4Å; S528-I531 PolarHBondContact OG-N 3.3Å; I531-R533 PolarHBondContact O-N 3.49Å; I531-R534 PolarHBondContact O-N 3.18Å; I531-I535 HydrophobicContact CG2-CD1 3.58Å; I531-I535 HydrophobicContact CG2-CG1 4.22Å; I531-I535 WeakPolarHBondContact O-CB 3.5Å; I531-I535 VanDerWaalsContact O-CG1 3.3Å; I531-I535 WeakPolarHBondContact O-CG1 3.32Å; I531-I535 PolarHBondContact O-N 3.49Å
532	M	39	Very low	34.7	Very low	85 Å²	85	94.6 Å²	94.6	42%	0.419	49%	0.486	S	S	.	.	H	α-helix	trans	-62.2	-41.8	173.5	-75.4	-61.7	-77.8	0	0	112.3	P527 S528 R534 N536	P527-M532 HydrophobicContact CB-CG 3.74Å; P527-M532 HydrophobicContact CB-SD 4.03Å; P527-M532 HydrophobicContact CG-CG 3.38Å; P527-M532 HydrophobicContact CG-SD 3.47Å; P527-M532 WeakPolarHBondContact CG-SD 3.35Å; S528-M532 PolarHBondContact O-N 3.16Å; S528-M532 VanDerWaalsContact O-N 3.11Å; M532-R534 PolarHBondContact O-N 3.32Å; M532-N536 VanDerWaalsContact O-CB 3.24Å; M532-N536 WeakPolarHBondContact O-CB 3.45Å; M532-N536 VanDerWaalsContact O-CG 3.23Å; M532-N536 PolarHBondContact O-N 3.33Å; M532-N536 PolarHBondContact O-ND2 3.28Å
533	R	41.4	Very low	35.2	Very low	178 Å²	178	92.4 Å²	92.4	67%	0.672	48%	0.484	S	S	*	.	H	α-helix	trans	-61.9	-41.6	174.6	-82.6	-177.8	-171.8	148.8	-1.6	112.6	A529 D530 I531 A537	A529-R533 WeakPolarHBondContact O-CG 3.16Å; A529-R533 PolarHBondContact O-N 3Å; D530-R533 PolarHBondContact O-N 3.47Å; D530-R533 IonicContact OD1-NH1 3.72Å; I531-R533 PolarHBondContact O-N 3.49Å; R533-A537 VanDerWaalsContact O-CB 3.28Å; R533-A537 WeakPolarHBondContact O-CB 3.41Å; R533-A537 PolarHBondContact O-N 3.06Å
534	R	38.5	Very low	35.7	Very low	159 Å²	159	94.1 Å²	94.1	60%	0.6	50%	0.504	S	S	*	.	H	α-helix	trans	-74.6	-37.8	-178.5	-71.8	-179.7	-176.8	-154.7	-0.2	112.9	Y482 D530 I531 M532 A537 F538	Y482-R534 PolarHBondContact OH-NH1 3.01Å; Y482-R534 VanDerWaalsContact OH-NH1 3.08Å; D530-R534 WeakPolarHBondContact O-CB 3.45Å; D530-R534 WeakPolarHBondContact O-CG 3.01Å; D530-R534 PolarHBondContact O-N 3.43Å; I531-R534 PolarHBondContact O-N 3.18Å; M532-R534 PolarHBondContact O-N 3.32Å; R534-A537 PolarHBondContact O-N 3.22Å; R534-F538 WeakPolarHBondContact O-CB 3.46Å; R534-F538 PolarHBondContact O-N 3.23Å
535	I	38.6	Very low	36.4	Very low	82 Å²	82	97.5 Å²	97.5	42%	0.421	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-43.6	172.2	-68.6	172.6	0	0	0	110	I531 A537 F538 L539	I531-I535 HydrophobicContact CG2-CD1 3.58Å; I531-I535 HydrophobicContact CG2-CG1 4.22Å; I531-I535 WeakPolarHBondContact O-CB 3.5Å; I531-I535 VanDerWaalsContact O-CG1 3.3Å; I531-I535 WeakPolarHBondContact O-CG1 3.32Å; I531-I535 PolarHBondContact O-N 3.49Å; I535-A537 PolarHBondContact O-N 3.29Å; I535-F538 PolarHBondContact O-N 3.43Å; I535-L539 HydrophobicContact CG2-CD1 3.77Å; I535-L539 HydrophobicContact CG2-CG 4.32Å; I535-L539 WeakPolarHBondContact O-CB 3.29Å; I535-L539 VanDerWaalsContact O-CG 3.31Å; I535-L539 WeakPolarHBondContact O-CG 3.48Å; I535-L539 PolarHBondContact O-N 3.02Å
536	N	41.9	Very low	36.7	Very low	92 Å²	92	93.4 Å²	93.4	49%	0.492	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-37.1	175.3	-74.5	-17.6	0	0	0	112.5	M532 A540	M532-N536 VanDerWaalsContact O-CB 3.24Å; M532-N536 WeakPolarHBondContact O-CB 3.45Å; M532-N536 VanDerWaalsContact O-CG 3.23Å; M532-N536 PolarHBondContact O-N 3.33Å; M532-N536 PolarHBondContact O-ND2 3.28Å; N536-A540 WeakPolarHBondContact O-CB 3.41Å; N536-A540 PolarHBondContact O-N 3.43Å
537	A	42.3	Very low	37.1	Very low	50 Å²	50	91.4 Å²	91.4	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-39.7	173.7	0	0	0	0	0	112.1	R533 R534 I535 A540 L541	R533-A537 VanDerWaalsContact O-CB 3.28Å; R533-A537 WeakPolarHBondContact O-CB 3.41Å; R533-A537 PolarHBondContact O-N 3.06Å; R534-A537 PolarHBondContact O-N 3.22Å; I535-A537 PolarHBondContact O-N 3.29Å; A537-A540 PolarHBondContact O-N 3.4Å; A537-L541 WeakPolarHBondContact O-CB 3.41Å; A537-L541 WeakPolarHBondContact O-CD1 3.17Å; A537-L541 VanDerWaalsContact O-CG 3.25Å; A537-L541 WeakPolarHBondContact O-CG 3.41Å; A537-L541 PolarHBondContact O-N 3.46Å
538	F	36	Very low	37.2	Very low	139 Å²	139	92.3 Å²	92.3	61%	0.61	53%	0.533	S	S	*	.	H	α-helix	trans	-69.9	-39.9	176.8	-173.3	-95.7	0	0	0	112.2	R534 I535 A540 L541 T542	R534-F538 WeakPolarHBondContact O-CB 3.46Å; R534-F538 PolarHBondContact O-N 3.23Å; I535-F538 PolarHBondContact O-N 3.43Å; F538-A540 VanDerWaalsContact C-N 3.35Å; F538-L541 PolarHBondContact O-N 3.38Å; F538-T542 HydrophobicContact CD1-CG2 4.28Å; F538-T542 HydrophobicContact CE1-CG2 3.85Å; F538-T542 HydrophobicContact CZ-CG2 3.99Å; F538-T542 WeakPolarHBondContact O-CB 3.26Å; F538-T542 WeakPolarHBondContact O-CG2 3.45Å; F538-T542 PolarHBondContact O-N 2.81Å; F538-T542 PolarHBondContact O-OG1 3.04Å
539	L	36.8	Very low	37	Very low	86 Å²	86	100.4 Å²	100.4	45%	0.45	55%	0.554	S	S	.	*	H	α-helix	trans	-67.1	-35.1	172.6	-71.7	171.1	0	0	0	111.9	I535 T542 A543	I535-L539 HydrophobicContact CG2-CD1 3.77Å; I535-L539 HydrophobicContact CG2-CG 4.32Å; I535-L539 WeakPolarHBondContact O-CB 3.29Å; I535-L539 VanDerWaalsContact O-CG 3.31Å; I535-L539 WeakPolarHBondContact O-CG 3.48Å; I535-L539 PolarHBondContact O-N 3.02Å; L539-T542 WeakPolarHBondContact CA-OG1 3.49Å; L539-T542 PolarHBondContact O-OG1 3.01Å; L539-A543 WeakPolarHBondContact O-CB 3.16Å; L539-A543 PolarHBondContact O-N 3.2Å
540	A	38	Very low	36.7	Very low	62 Å²	62	104.7 Å²	104.7	51%	0.512	57%	0.567	S	S	.	*	H	α-helix	trans	-68.2	-36.7	172.5	0	0	0	0	0	112.5	N536 A537 F538 A544	N536-A540 WeakPolarHBondContact O-CB 3.41Å; N536-A540 PolarHBondContact O-N 3.43Å; A537-A540 PolarHBondContact O-N 3.4Å; F538-A540 VanDerWaalsContact C-N 3.35Å; A540-A544 WeakPolarHBondContact O-CB 3.39Å; A540-A544 PolarHBondContact O-N 3.28Å; A540-A544 VanDerWaalsContact O-N 3.12Å
541	L	36	Very low	36.3	Very low	119 Å²	119	107.5 Å²	107.5	62%	0.623	58%	0.582	S	S	*	*	H	α-helix	trans	-69.6	-42	175.1	-76.1	162.4	0	0	0	112	A537 F538 A544 D545	A537-L541 WeakPolarHBondContact O-CB 3.41Å; A537-L541 WeakPolarHBondContact O-CD1 3.17Å; A537-L541 VanDerWaalsContact O-CG 3.25Å; A537-L541 WeakPolarHBondContact O-CG 3.41Å; A537-L541 PolarHBondContact O-N 3.46Å; F538-L541 PolarHBondContact O-N 3.38Å; L541-A544 PolarHBondContact O-N 3.21Å; L541-D545 PolarHBondContact O-N 3.37Å
542	T	33.8	Very low	35.9	Very low	48 Å²	48	116.5 Å²	116.5	29%	0.294	61%	0.614	S	S	.	*	H	α-helix	trans	-76.8	-21.8	178.3	48.3	0	0	0	0	113.7	F538 L539	F538-T542 HydrophobicContact CD1-CG2 4.28Å; F538-T542 HydrophobicContact CE1-CG2 3.85Å; F538-T542 HydrophobicContact CZ-CG2 3.99Å; F538-T542 WeakPolarHBondContact O-CB 3.26Å; F538-T542 WeakPolarHBondContact O-CG2 3.45Å; F538-T542 PolarHBondContact O-N 2.81Å; F538-T542 PolarHBondContact O-OG1 3.04Å; L539-T542 WeakPolarHBondContact CA-OG1 3.49Å; L539-T542 PolarHBondContact O-OG1 3.01Å
543	A	35	Very low	35.2	Very low	63 Å²	63	116.3 Å²	116.3	52%	0.521	63%	0.633	S	S	.	*	H	α-helix	trans	-80.2	-24.5	169.8	0	0	0	0	0	113	L539	L539-A543 WeakPolarHBondContact O-CB 3.16Å; L539-A543 PolarHBondContact O-N 3.2Å
544	A	37.6	Very low	34.5	Very low	71 Å²	71	114.6 Å²	114.6	59%	0.587	63%	0.631	S	S	*	*	H	α-helix	trans	-80.2	-22.6	177.1	0	0	0	0	0	113.5	A540 L541	A540-A544 WeakPolarHBondContact O-CB 3.39Å; A540-A544 PolarHBondContact O-N 3.28Å; A540-A544 VanDerWaalsContact O-N 3.12Å; L541-A544 PolarHBondContact O-N 3.21Å
545	D	38.5	Very low	33.8	Very low	153 Å²	153	111.7 Å²	111.7	82%	0.818	63%	0.631	S	S	*	*	S	Bend	trans	-94	0.5	176.8	-89.8	-21.3	0	0	0	113.8	L541	L541-D545 PolarHBondContact O-N 3.37Å
546	A	34.8	Very low	33.2	Very low	53 Å²	53	119 Å²	119	44%	0.438	65%	0.653	S	S	.	*			trans	-95	8.7	-173.9	0	0	0	0	0	114.9	G548	A546-G548 PolarHBondContact O-N 3.16Å
547	D	35.1	Very low	32.4	Very low	163 Å²	163	121.1 Å²	121.1	87%	0.872	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	90	171.3	-84.9	-17.4	0	0	0	110.1
548	G	33.4	Very low	31.5	Very low	71 Å²	71	121.4 Å²	121.4	73%	0.732	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	141	4.7	156.6	0	0	0	0	0	118.7	A546	A546-G548 PolarHBondContact O-N 3.16Å
549	R	30.3	Very low	30.9	Very low	229 Å²	229	124 Å²	124	86%	0.864	69%	0.686	S	S	*	*			trans	-140.7	93.4	170.3	-67	-169.9	-147.6	-147.8	5.2	112.3	D551	R549-D551 PolarHBondContact O-N 3.39Å
550	D	29.3	Very low	30.3	Very low	164 Å²	164	127.1 Å²	127.1	88%	0.877	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	97.2	161	-66	-40.8	0	0	0	109.2
551	D	29.2	Very low	29.8	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.4	4.1	159.1	-99.2	-20.6	0	0	0	115.1	R549	R549-D551 PolarHBondContact O-N 3.39Å
552	W	28.2	Very low	29.5	Very low	225 Å²	225	136.3 Å²	136.3	85%	0.852	75%	0.747	S	S	*	*	S	Bend	trans	-114.1	102.6	175.7	-65.1	85.1	0	0	0	110.7	F554	W552-F554 PolarHBondContact O-N 3.3Å
553	G	24.7	Very low	29.2	Very low	80 Å²	80	140.9 Å²	140.9	83%	0.825	77%	0.771	S	S	*	*			trans	-56.6	94.8	177.4	0	0	0	0	0	112.8	V555	G553-V555 PolarHBondContact O-N 3.18Å; G553-V555 VanDerWaalsContact O-N 3.11Å
554	F	25.9	Very low	28.9	Very low	142 Å²	142	145.2 Å²	145.2	62%	0.623	79%	0.785	S	S	*	*			trans	-63.5	104.5	165.4	-93.8	-94.1	0	0	0	109.4	W552 R556	W552-F554 PolarHBondContact O-N 3.3Å; F554-R556 PolarHBondContact O-N 3.37Å
555	V	25.6	Very low	28.4	Very low	98 Å²	98	149.6 Å²	149.6	59%	0.594	80%	0.796	S	S	*	*			trans	-74.2	100	167.3	-177	0	0	0	0	108.4	G553 L557	G553-V555 PolarHBondContact O-N 3.18Å; G553-V555 VanDerWaalsContact O-N 3.11Å; V555-L557 PolarHBondContact O-N 3.46Å
556	R	24.8	Very low	27.8	Very low	237 Å²	237	149.4 Å²	149.4	89%	0.894	80%	0.795	S	S	*	*			trans	-42.3	107.1	162.7	-76.1	-179.1	176.7	-178	-0.6	110	F554 G558	F554-R556 PolarHBondContact O-N 3.37Å; R556-G558 VanDerWaalsContact C-N 3.29Å; R556-G558 PolarHBondContact O-N 3.32Å
557	L	25.4	Very low	27.3	Very low	135 Å²	135	155.8 Å²	155.8	71%	0.707	82%	0.819	S	S	*	*			trans	-93.3	73.4	159.2	-98.1	152.7	0	0	0	106.6	V555	V555-L557 PolarHBondContact O-N 3.46Å
558	G	22.8	Very low	26.8	Very low	56 Å²	56	155.3 Å²	155.3	58%	0.577	82%	0.815	S	S	*	*			trans	-125	131.8	170	0	0	0	0	0	108.4	R556	R556-G558 VanDerWaalsContact C-N 3.29Å; R556-G558 PolarHBondContact O-N 3.32Å
559	Q	23.2	Very low	26.3	Very low	195 Å²	195	161.8 Å²	161.8	91%	0.911	82%	0.821	S	S	*	*			trans	71.3	87.5	169.5	-59.5	178.7	-35.5	0	0	117.4
560	V	25.4	Very low	25.9	Very low	151 Å²	151	156.2 Å²	156.2	92%	0.915	82%	0.818	S	S	*	*				-145	137	130	-173.6	0	0	0	0	106.9
561	I	26.6	Very low	25.6	Very low	236 Å²	236	155.5 Å²	155.5	100%	1.21	81%	0.813	S	S	*	*			trans	-50.7	0	-172.5	-65.2	163	0	0	0	113.7

Retrieved 561 of 561 residues in 812.6 ms (Link to these results)

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