A0A087YND6_POEFO Loading...

T-complex protein 1 subunit alpha

AlphaFold DB , UniProt , Accession A0A087YND6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 558 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	39.3	Very low	55	Low	234 Å²	234	125.7 Å²	125.7	100%	1.153	71%	0.709	S	S	*	*				0	93.4	0	-89.3	174.5	166.4	0	0	108.5
2	S	34.8	Very low	57.2	Low	116 Å²	116	116.9 Å²	116.9	81%	0.811	67%	0.667	S	S	*	*			trans	-108.4	82.8	158	70.4	0	0	0	0	107.3	L4	S2-L4 PolarHBondContact O-N 2.72Å
3	L	49.1	Very low	59.2	Low	126 Å²	126	117.7 Å²	117.7	66%	0.66	66%	0.661	S	S	*	*			trans	-76	105.1	156.5	-76.5	158	0	0	0	104.8
4	L	50	Low	61.1	Low	145 Å²	145	117.7 Å²	117.7	76%	0.759	65%	0.646	S	S	*	*			trans	167.7	131	168.8	-90	158.9	0	0	0	105.2	S2	S2-L4 PolarHBondContact O-N 2.72Å
5	D	50.5	Low	62.8	Low	154 Å²	154	112.6 Å²	112.6	82%	0.824	62%	0.619	S	S	*	*			cis	-164.3	126.7	12.3	-159.3	2.9	0	0	0	107
6	G	53.4	Low	64.3	Low	35 Å²	35	110.2 Å²	110.2	36%	0.361	61%	0.609	S	S	.	*			trans	-176.5	140.7	-178.6	0	0	0	0	0	111.8	L8	G6-L8 PolarHBondContact O-N 2.71Å; G6-L8 VanDerWaalsContact O-N 3.08Å
7	P	59.3	Low	65.7	Low	143 Å²	143	105.6 Å²	105.6	93%	0.929	59%	0.593	S	S	*	*	S	Bend	trans	-69.4	-10.6	-165.9	25.1	-33.9	0	0	0	115.5
8	L	58.8	Low	66.8	Low	132 Å²	132	105.2 Å²	105.2	69%	0.691	59%	0.585	S	S	*	*			trans	-130.8	72.4	176.6	-81	161.8	0	0	0	109	G6 V10	G6-L8 PolarHBondContact O-N 2.71Å; G6-L8 VanDerWaalsContact O-N 3.08Å; L8-V10 PolarHBondContact O-N 2.73Å
9	N	66.8	Low	68	Low	116 Å²	116	102.4 Å²	102.4	62%	0.62	57%	0.574	S	S	*	*			trans	-85.8	106	174.8	-130.9	-3.5	0	0	0	108.8
10	V	67.8	Low	69.1	Low	41 Å²	41	97.3 Å²	97.3	25%	0.248	55%	0.545	C	S	.	.			trans	-83.5	133.1	173.6	-179.8	0	0	0	0	107.8	L8 G12 I534 L536	L8-V10 PolarHBondContact O-N 2.73Å; V10-G12 PolarHBondContact O-N 3.45Å; V10-I534 HydrophobicContact CG1-CG2 3.68Å; V10-I534 HydrophobicContact CG2-CG2 4.48Å; V10-L536 HydrophobicContact CG1-CD2 3.41Å; V10-L536 VanDerWaalsContact CG1-CD2 3.41Å
11	L	75.6	Confident	70.1	Confident	141 Å²	141	94.1 Å²	94.1	74%	0.738	53%	0.525	S	S	*	.	S	Bend	trans	-70.2	69.1	167.3	-73.5	169.7	0	0	0	109.7	F537	L11-F537 VanDerWaalsContact C-CD2 3.47Å; L11-F537 WeakPolarHBondContact O-CD2 3.38Å; L11-F537 PolarHBondContact O-N 3.08Å
12	G	80.4	Confident	72.5	Confident	20 Å²	20	84.9 Å²	84.9	21%	0.206	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170	-168.5	-169.7	0	0	0	0	0	113.4	V10 K535	V10-G12 PolarHBondContact O-N 3.45Å; G12-K535 CarbonylContact C-O 3.57Å; G12-K535 WeakPolarHBondContact CA-O 3.29Å
13	Q	83.3	Confident	75.2	Confident	127 Å²	127	83.3 Å²	83.3	59%	0.593	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	131.1	171.6	-68	179.5	-6.6	0	0	109.5	K535	Q13-K535 PolarHBondContact N-O 2.72Å; Q13-K535 PolarHBondContact O-N 3.24Å
14	R	86.2	Confident	77.3	Confident	118 Å²	118	77.5 Å²	77.5	45%	0.445	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.9	173.4	-178	177.1	179.1	-153.1	2.6	109.4	T16 D532 L533 I534	R14-T16 HydrophobicContact CG-CG2 4.14Å; R14-D532 VanDerWaalsContact CG-OD1 3.29Å; R14-D532 WeakPolarHBondContact CG-OD1 3.49Å; R14-D532 IonicContact CZ-OD2 3.16Å; R14-D532 IonicContact NE-OD1 3.17Å; R14-D532 PolarHBondContact NE-OD1 2.82Å; R14-D532 IonicContact NE-OD2 2.82Å; R14-D532 PolarHBondContact NE-OD2 3.27Å; R14-D532 IonicContact NH2-OD2 2.68Å; R14-D532 PolarHBondContact NH2-OD2 2.96Å; R14-L533 WeakPolarHBondContact CA-O 3.22Å; R14-I534 HydrophobicContact CB-CG1 4.42Å; R14-I534 HydrophobicContact CG-CG1 3.9Å
15	T	87.1	Confident	79.4	Confident	41 Å²	41	71.5 Å²	71.5	25%	0.252	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	136.3	175.4	-57.6	0	0	0	0	107.3	S19 V20 D532 L533	T15-S19 WeakPolarHBondContact CG2-OG 3.15Å; T15-V20 HydrophobicContact CG2-CG2 3.76Å; T15-V20 WeakPolarHBondContact O-CG2 3.5Å; T15-D532 VanDerWaalsContact O-OD1 3.07Å; T15-L533 PolarHBondContact N-O 2.86Å; T15-L533 PolarHBondContact O-N 2.96Å
16	T	87.1	Confident	81.5	Confident	74 Å²	74	70 Å²	70	45%	0.454	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	156.7	-171.1	53.9	0	0	0	0	113	R14 S19 D531 D532	R14-T16 HydrophobicContact CG-CG2 4.14Å; T16-S19 PolarHBondContact O-OG 3.38Å; T16-D531 CarbonylContact C-O 3.59Å; T16-D532 WeakPolarHBondContact CG2-OD1 3.48Å
17	G	86.8	Confident	83.4	Confident	32 Å²	32	69.1 Å²	69.1	33%	0.33	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	-134.4	169.1	0	0	0	0	0	114.1	S19 V20 D531	G17-S19 VanDerWaalsContact C-N 3.28Å; G17-S19 PolarHBondContact O-N 3.42Å; G17-V20 PolarHBondContact O-N 2.86Å; G17-D531 PolarHBondContact N-O 2.84Å
18	E	86.3	Confident	85	Confident	98 Å²	98	62.3 Å²	62.3	46%	0.458	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-31.6	-173.5	-171.5	173.3	170	0	0	113.1	V20 R21 T22	E18-V20 PolarHBondContact O-N 3.22Å; E18-R21 PolarHBondContact O-N 2.67Å; E18-T22 PolarHBondContact O-N 3.28Å; E18-T22 PolarHBondContact O-OG1 3.41Å
19	S	88.8	Confident	86.7	Confident	53 Å²	53	57.5 Å²	57.5	37%	0.371	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-43.1	179.4	62.6	0	0	0	0	112.3	T15 T16 G17 T22 Q23	T15-S19 WeakPolarHBondContact CG2-OG 3.15Å; T16-S19 PolarHBondContact O-OG 3.38Å; G17-S19 VanDerWaalsContact C-N 3.28Å; G17-S19 PolarHBondContact O-N 3.42Å; S19-T22 PolarHBondContact O-N 2.82Å; S19-Q23 VanDerWaalsContact O-CG 3.29Å; S19-Q23 WeakPolarHBondContact O-CG 3.32Å; S19-Q23 PolarHBondContact O-N 2.87Å
20	V	91.2	Very high	88	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63	-43.7	176.1	178.6	0	0	0	0	111.1	T15 G17 E18 Q23 N24 I530 L533	T15-V20 HydrophobicContact CG2-CG2 3.76Å; T15-V20 WeakPolarHBondContact O-CG2 3.5Å; G17-V20 PolarHBondContact O-N 2.86Å; E18-V20 PolarHBondContact O-N 3.22Å; V20-Q23 PolarHBondContact O-N 2.9Å; V20-N24 WeakPolarHBondContact O-CB 3.28Å; V20-N24 PolarHBondContact O-N 3.1Å; V20-N24 PolarHBondContact O-ND2 3.18Å; V20-I530 HydrophobicContact CG1-CG2 4.05Å; V20-L533 HydrophobicContact CG1-CB 3.82Å; V20-L533 HydrophobicContact CG2-CB 3.88Å
21	R	88.6	Confident	89.2	Confident	31 Å²	31	53.8 Å²	53.8	12%	0.117	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-46.1	-179.9	-66.1	172.9	-177.8	-88.7	-13.2	111	E18 Q23 N24 V25 P117 L528	E18-R21 PolarHBondContact O-N 2.67Å; R21-Q23 VanDerWaalsContact C-N 3.34Å; R21-Q23 PolarHBondContact O-N 2.99Å; R21-N24 WeakPolarHBondContact O-CB 3.02Å; R21-N24 PolarHBondContact O-N 2.9Å; R21-V25 WeakPolarHBondContact O-CG2 3.15Å; R21-V25 PolarHBondContact O-N 3.42Å; R21-P117 VanDerWaalsContact CZ-CG 3.44Å; R21-L528 PolarHBondContact NH1-O 2.75Å; R21-L528 PolarHBondContact NH2-O 2.86Å
22	T	90.6	Very high	90.1	Very high	39 Å²	39	47.1 Å²	47.1	24%	0.239	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-43.6	176.8	-53.7	0	0	0	0	111.2	E18 S19 V25 M26	E18-T22 PolarHBondContact O-N 3.28Å; E18-T22 PolarHBondContact O-OG1 3.41Å; S19-T22 PolarHBondContact O-N 2.82Å; T22-V25 PolarHBondContact O-N 2.93Å; T22-M26 HydrophobicContact CG2-CE 3.97Å; T22-M26 HydrophobicContact CG2-SD 4.42Å; T22-M26 WeakPolarHBondContact O-CG 3.22Å; T22-M26 PolarHBondContact O-N 2.9Å
23	Q	92.3	Very high	90.7	Very high	83 Å²	83	50.6 Å²	50.6	39%	0.388	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-44.7	176.2	-74.4	174.2	-1.8	0	0	112.2	S19 V20 R21 V25 M26 A27	S19-Q23 VanDerWaalsContact O-CG 3.29Å; S19-Q23 WeakPolarHBondContact O-CG 3.32Å; S19-Q23 PolarHBondContact O-N 2.87Å; V20-Q23 PolarHBondContact O-N 2.9Å; R21-Q23 VanDerWaalsContact C-N 3.34Å; R21-Q23 PolarHBondContact O-N 2.99Å; Q23-V25 VanDerWaalsContact C-N 3.33Å; Q23-V25 PolarHBondContact O-N 3.01Å; Q23-M26 PolarHBondContact O-N 2.78Å; Q23-A27 WeakPolarHBondContact O-CB 3.38Å; Q23-A27 PolarHBondContact O-N 3.27Å
24	N	93.3	Very high	91.2	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-44.2	176.2	-71.6	-21.8	0	0	0	111.6	V20 R21 A27 A28 H72 A74 I527	V20-N24 WeakPolarHBondContact O-CB 3.28Å; V20-N24 PolarHBondContact O-N 3.1Å; V20-N24 PolarHBondContact O-ND2 3.18Å; R21-N24 WeakPolarHBondContact O-CB 3.02Å; R21-N24 PolarHBondContact O-N 2.9Å; N24-A27 PolarHBondContact O-N 3.32Å; N24-A28 WeakPolarHBondContact O-CB 3.39Å; N24-A28 PolarHBondContact O-N 3.26Å; N24-H72 PolarHBondContact OD1-CE1 3.06Å; N24-H72 VanDerWaalsContact OD1-CE1 3.24Å; N24-A74 HydrophobicContact CB-CB 3.96Å; N24-I527 HydrophobicContact CB-CG2 3.77Å
25	V	93.4	Very high	91.6	Very high	19 Å²	19	42 Å²	42	12%	0.115	24%	0.243	C	C	.	.	H	α-helix	trans	-66	-42.6	178.8	173.7	0	0	0	0	110.9	R21 T22 Q23 A28 A29 L104 K105 D108	R21-V25 WeakPolarHBondContact O-CG2 3.15Å; R21-V25 PolarHBondContact O-N 3.42Å; T22-V25 PolarHBondContact O-N 2.93Å; Q23-V25 VanDerWaalsContact C-N 3.33Å; Q23-V25 PolarHBondContact O-N 3.01Å; V25-A28 PolarHBondContact O-N 2.86Å; V25-A29 VanDerWaalsContact O-CB 3.24Å; V25-A29 WeakPolarHBondContact O-CB 3.38Å; V25-A29 PolarHBondContact O-N 2.93Å; V25-L104 HydrophobicContact CG2-CB 4.4Å; V25-K105 HydrophobicContact CG1-CB 4.26Å; V25-D108 HydrophobicContact CG2-CB 3.8Å
26	M	93.6	Very high	91.9	Very high	123 Å²	123	42.3 Å²	42.3	61%	0.606	24%	0.241	S	C	*	.	H	α-helix	trans	-61.2	-46	175.4	-75.2	-178	173.5	0	0	111.6	T22 Q23 A28 A29 S30	T22-M26 HydrophobicContact CG2-CE 3.97Å; T22-M26 HydrophobicContact CG2-SD 4.42Å; T22-M26 WeakPolarHBondContact O-CG 3.22Å; T22-M26 PolarHBondContact O-N 2.9Å; Q23-M26 PolarHBondContact O-N 2.78Å; M26-A28 PolarHBondContact O-N 3.36Å; M26-A29 PolarHBondContact O-N 2.84Å; M26-S30 PolarHBondContact O-N 3.45Å; M26-S30 PolarHBondContact O-OG 3.41Å; M26-S30 VanDerWaalsContact O-OG 3.04Å
27	A	93.8	Very high	92.2	Very high	17 Å²	17	40.7 Å²	40.7	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-43.9	177.6	0	0	0	0	0	111.9	Q23 N24 S30 I31 H72 A75	Q23-A27 WeakPolarHBondContact O-CB 3.38Å; Q23-A27 PolarHBondContact O-N 3.27Å; N24-A27 PolarHBondContact O-N 3.32Å; A27-S30 PolarHBondContact O-N 2.98Å; A27-I31 PolarHBondContact O-N 3.4Å; A27-H72 HydrophobicContact CB-CB 4.18Å; A27-H72 WeakPolarHBondContact CB-ND1 3.28Å; A27-A75 HydrophobicContact CB-CB 4.24Å
28	A	93.8	Very high	92.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.8	-44.3	175.7	0	0	0	0	0	112.6	N24 V25 M26 S30 I31 A32 L78 A101 L104	N24-A28 WeakPolarHBondContact O-CB 3.39Å; N24-A28 PolarHBondContact O-N 3.26Å; V25-A28 PolarHBondContact O-N 2.86Å; M26-A28 PolarHBondContact O-N 3.36Å; A28-S30 VanDerWaalsContact C-N 3.34Å; A28-S30 PolarHBondContact O-N 2.96Å; A28-I31 PolarHBondContact O-N 2.93Å; A28-A32 PolarHBondContact O-N 3.19Å; A28-L78 HydrophobicContact CB-CD1 3.63Å; A28-A101 HydrophobicContact CB-CB 4.48Å; A28-L104 HydrophobicContact CB-CD1 3.79Å
29	A	94.1	Very high	92.8	Very high	30 Å²	30	35 Å²	35	25%	0.248	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-37.8	178.8	0	0	0	0	0	112	V25 M26 A32 N33	V25-A29 VanDerWaalsContact O-CB 3.24Å; V25-A29 WeakPolarHBondContact O-CB 3.38Å; V25-A29 PolarHBondContact O-N 2.93Å; M26-A29 PolarHBondContact O-N 2.84Å; A29-A32 PolarHBondContact O-N 3.39Å; A29-N33 WeakPolarHBondContact O-CB 3.37Å; A29-N33 PolarHBondContact O-N 3.37Å; A29-N33 PolarHBondContact O-ND2 3.43Å
30	S	93.6	Very high	92.8	Very high	71 Å²	71	33.1 Å²	33.1	50%	0.497	19%	0.187	S	C	.	.	H	α-helix	trans	-60.5	-47.6	175.1	-66.3	0	0	0	0	111.7	M26 A27 A28 A32 N33 I34	M26-S30 PolarHBondContact O-N 3.45Å; M26-S30 PolarHBondContact O-OG 3.41Å; M26-S30 VanDerWaalsContact O-OG 3.04Å; A27-S30 PolarHBondContact O-N 2.98Å; A28-S30 VanDerWaalsContact C-N 3.34Å; A28-S30 PolarHBondContact O-N 2.96Å; S30-A32 PolarHBondContact O-N 3.29Å; S30-N33 PolarHBondContact O-N 3.47Å; S30-I34 WeakPolarHBondContact O-CG1 3.34Å; S30-I34 PolarHBondContact O-N 2.78Å
31	I	93.6	Very high	92.5	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.046	21%	0.207	C	C	.	.	H	α-helix	trans	-60.4	-46.9	174.8	-78	-162.1	0	0	0	111.5	A27 A28 N33 I34 V35 L65 V70 A75 L78 V97	A27-I31 PolarHBondContact O-N 3.4Å; A28-I31 PolarHBondContact O-N 2.93Å; I31-N33 VanDerWaalsContact C-N 3.3Å; I31-N33 PolarHBondContact O-N 3.11Å; I31-I34 WeakPolarHBondContact O-CB 3.34Å; I31-I34 PolarHBondContact O-N 3.16Å; I31-V35 PolarHBondContact O-N 2.99Å; I31-L65 HydrophobicContact CG2-CD1 4.22Å; I31-L65 HydrophobicContact CG2-CD2 3.71Å; I31-V70 HydrophobicContact CD1-CG1 4.12Å; I31-V70 HydrophobicContact CD1-CG2 3.98Å; I31-A75 HydrophobicContact CD1-CB 3.44Å; I31-A75 VanDerWaalsContact CD1-CB 3.44Å; I31-A75 WeakPolarHBondContact CD1-O 3.45Å; I31-A75 HydrophobicContact CG1-CB 4.08Å; I31-L78 HydrophobicContact CG2-CB 4.3Å; I31-L78 HydrophobicContact CG2-CD1 4.32Å; I31-V97 HydrophobicContact CG2-CG1 3.76Å
32	A	94.7	Very high	92.4	Very high	1 Å²	1	37 Å²	37	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-38.4	179.2	0	0	0	0	0	112	A28 A29 S30 I34 V35 K36 A101	A28-A32 PolarHBondContact O-N 3.19Å; A29-A32 PolarHBondContact O-N 3.39Å; S30-A32 PolarHBondContact O-N 3.29Å; A32-I34 VanDerWaalsContact C-N 3.28Å; A32-I34 PolarHBondContact O-N 3.33Å; A32-V35 WeakPolarHBondContact O-CG2 3.38Å; A32-V35 PolarHBondContact O-N 3.37Å; A32-K36 WeakPolarHBondContact O-CB 3.44Å; A32-K36 VanDerWaalsContact O-CG 3.25Å; A32-K36 WeakPolarHBondContact O-CG 3.48Å; A32-K36 PolarHBondContact O-N 2.92Å; A32-A101 HydrophobicContact CB-CB 3.36Å
33	N	93.8	Very high	92.2	Very high	93 Å²	93	35.8 Å²	35.8	50%	0.497	21%	0.21	S	C	.	.	H	α-helix	trans	-64.9	-31.2	178	-72.1	-19.9	0	0	0	112.9	A29 S30 I31 K36	A29-N33 WeakPolarHBondContact O-CB 3.37Å; A29-N33 PolarHBondContact O-N 3.37Å; A29-N33 PolarHBondContact O-ND2 3.43Å; S30-N33 PolarHBondContact O-N 3.47Å; I31-N33 VanDerWaalsContact C-N 3.3Å; I31-N33 PolarHBondContact O-N 3.11Å; N33-K36 WeakPolarHBondContact OD1-CD 3.22Å; N33-K36 PolarHBondContact OD1-NZ 2.91Å
34	I	93.2	Very high	92	Very high	63 Å²	63	37.7 Å²	37.7	32%	0.323	22%	0.222	S	C	.	.	H	α-helix	trans	-59.6	-58	171.4	-64.9	167.7	0	0	0	108.3	S30 I31 A32 K36 K46 I64 L68	S30-I34 WeakPolarHBondContact O-CG1 3.34Å; S30-I34 PolarHBondContact O-N 2.78Å; I31-I34 WeakPolarHBondContact O-CB 3.34Å; I31-I34 PolarHBondContact O-N 3.16Å; A32-I34 VanDerWaalsContact C-N 3.28Å; A32-I34 PolarHBondContact O-N 3.33Å; I34-K36 PolarHBondContact O-N 3.1Å; I34-K46 HydrophobicContact CG2-CD 3.99Å; I34-K46 WeakPolarHBondContact O-CE 3.34Å; I34-K46 PolarHBondContact O-NZ 2.86Å; I34-I64 HydrophobicContact CG2-CG2 3.99Å; I34-L68 HydrophobicContact CD1-CD1 3.83Å; I34-L68 HydrophobicContact CG2-CD1 4.34Å
35	V	94.1	Very high	91.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-75.5	-17.8	-173.5	-60.9	0	0	0	0	114.6	I31 A32 S37 S38 I64 L65 T94 V97 I98	I31-V35 PolarHBondContact O-N 2.99Å; A32-V35 WeakPolarHBondContact O-CG2 3.38Å; A32-V35 PolarHBondContact O-N 3.37Å; V35-S37 VanDerWaalsContact C-N 3.3Å; V35-S37 PolarHBondContact O-N 3.18Å; V35-S38 PolarHBondContact O-N 2.81Å; V35-I64 HydrophobicContact CG1-CG2 4.46Å; V35-L65 HydrophobicContact CG1-CD1 4.46Å; V35-L65 HydrophobicContact CG1-CD2 4.07Å; V35-L65 HydrophobicContact CG1-CG 4.17Å; V35-T94 HydrophobicContact CB-CG2 3.84Å; V35-T94 HydrophobicContact CG2-CG2 4.1Å; V35-T94 VanDerWaalsContact O-CG2 3.31Å; V35-T94 WeakPolarHBondContact O-CG2 3.34Å; V35-V97 HydrophobicContact CG2-CB 4.3Å; V35-V97 HydrophobicContact CG2-CG1 3.99Å; V35-I98 HydrophobicContact CG2-CD1 4.47Å; V35-I98 HydrophobicContact CG2-CG1 4Å
36	K	94	Very high	91.8	Very high	48 Å²	48	41.5 Å²	41.5	21%	0.209	24%	0.24	C	C	.	.	H	α-helix	trans	-53.6	-41.5	-179.6	-90.8	176.3	-165.7	169.7	0	113.7	A32 N33 I34 S38 L39 I98 T454 N458	A32-K36 WeakPolarHBondContact O-CB 3.44Å; A32-K36 VanDerWaalsContact O-CG 3.25Å; A32-K36 WeakPolarHBondContact O-CG 3.48Å; A32-K36 PolarHBondContact O-N 2.92Å; N33-K36 WeakPolarHBondContact OD1-CD 3.22Å; N33-K36 PolarHBondContact OD1-NZ 2.91Å; I34-K36 PolarHBondContact O-N 3.1Å; K36-S38 PolarHBondContact O-N 2.78Å; K36-L39 PolarHBondContact O-N 3.4Å; K36-I98 HydrophobicContact CG-CD1 3.93Å; K36-I98 HydrophobicContact CG-CG1 3.96Å; K36-I98 HydrophobicContact CG-CG2 4.31Å; K36-T454 HydrophobicContact CB-CG2 4.18Å; K36-T454 HydrophobicContact CG-CG2 4.15Å; K36-T454 WeakPolarHBondContact O-CG2 3.36Å; K36-N458 PolarHBondContact O-ND2 3.48Å
37	S	93.6	Very high	91.7	Very high	40 Å²	40	41.7 Å²	41.7	28%	0.28	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-15.8	-178.5	70.7	0	0	0	0	113.5	V35 G43 L44 K46	V35-S37 VanDerWaalsContact C-N 3.3Å; V35-S37 PolarHBondContact O-N 3.18Å; S37-G43 CarbonylContact O-C 3.58Å; S37-G43 WeakPolarHBondContact O-CA 3.37Å; S37-L44 PolarHBondContact O-N 3.4Å; S37-K46 PolarHBondContact OG-NZ 2.78Å
38	S	91.9	Very high	91.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-2.8	-179.7	-53.8	0	0	0	0	112	V35 K36 L44 N59	V35-S38 PolarHBondContact O-N 2.81Å; K36-S38 PolarHBondContact O-N 2.78Å; S38-L44 PolarHBondContact OG-O 3.31Å; S38-N59 PolarHBondContact O-OD1 3.33Å
39	L	92.9	Very high	91.5	Very high	11 Å²	11	47.1 Å²	47.1	6%	0.058	27%	0.271	C	S	.	.			trans	-76.2	128.6	-179.2	-173.4	71.3	0	0	0	112.5	K36 T94 S95 I98 I451 T454 L455 N458	K36-L39 PolarHBondContact O-N 3.4Å; L39-T94 HydrophobicContact CB-CG2 4.08Å; L39-T94 HydrophobicContact CD1-CG2 4.01Å; L39-S95 WeakPolarHBondContact CD1-OG 3.3Å; L39-I98 HydrophobicContact CB-CD1 4.05Å; L39-I98 HydrophobicContact CD1-CD1 4.34Å; L39-I98 HydrophobicContact CD2-CD1 3.86Å; L39-I98 HydrophobicContact CG-CD1 4.29Å; L39-I451 HydrophobicContact CD2-CD1 4.15Å; L39-I451 HydrophobicContact CD2-CG2 4.39Å; L39-T454 HydrophobicContact CB-CG2 4.15Å; L39-T454 HydrophobicContact CD2-CG2 3.8Å; L39-L455 HydrophobicContact CD2-CD2 4.25Å; L39-L455 HydrophobicContact CD2-CG 4.28Å; L39-L455 HydrophobicContact CG-CD2 3.99Å; L39-N458 PolarHBondContact O-ND2 3.44Å
40	G	89.3	Confident	91.4	Very high	12 Å²	12	50.1 Å²	50.1	12%	0.124	28%	0.283	C	S	.	.	S	Bend	trans	93.1	174.1	169	0	0	0	0	0	114.4	V42 G43 S161	G40-V42 PolarHBondContact O-N 3.25Å; G40-V42 VanDerWaalsContact O-N 3.12Å; G40-G43 WeakPolarHBondContact O-CA 3.49Å; G40-G43 PolarHBondContact O-N 3.38Å; G40-S161 VanDerWaalsContact C-CB 3.5Å; G40-S161 WeakPolarHBondContact O-CA 3.31Å; G40-S161 WeakPolarHBondContact O-CB 3.43Å
41	P	85.1	Confident	91.2	Very high	64 Å²	64	54.3 Å²	54.3	42%	0.416	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.6	-175.1	26.8	-36.3	0	0	0	114.2	S160 L493	P41-S160 WeakPolarHBondContact CA-O 3.44Å; P41-L493 HydrophobicContact CG-CD1 3.81Å
42	V	86.4	Confident	91.1	Very high	50 Å²	50	60.6 Å²	60.6	30%	0.303	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	11.6	176.2	-67.3	0	0	0	0	111.8	G40 N458 A459 L493	G40-V42 PolarHBondContact O-N 3.25Å; G40-V42 VanDerWaalsContact O-N 3.12Å; V42-N458 HydrophobicContact CG2-CB 3.96Å; V42-A459 HydrophobicContact CG2-CB 3.86Å; V42-L493 HydrophobicContact CG2-CD1 3.9Å
43	G	85.9	Confident	90.8	Very high	12 Å²	12	62.7 Å²	62.7	12%	0.124	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-66.9	147.5	174.5	0	0	0	0	0	111.1	S37 G40	S37-G43 CarbonylContact O-C 3.58Å; S37-G43 WeakPolarHBondContact O-CA 3.37Å; G40-G43 WeakPolarHBondContact O-CA 3.49Å; G40-G43 PolarHBondContact O-N 3.38Å
44	L	88.4	Confident	90.6	Very high	123 Å²	123	63.3 Å²	63.3	64%	0.644	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-101.5	140	-179.4	-59.3	175.1	0	0	0	111.2	S37 S38	S37-L44 PolarHBondContact O-N 3.4Å; S38-L44 PolarHBondContact OG-O 3.31Å
45	D	90.6	Very high	90.4	Very high	63 Å²	63	62.3 Å²	62.3	34%	0.337	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-68.4	154.3	175	-59.8	-10.3	0	0	0	110.9	I57 N59	D45-I57 HydrophobicContact CB-CG2 3.94Å; D45-N59 VanDerWaalsContact OD1-CB 3.3Å; D45-N59 WeakPolarHBondContact OD1-CB 3.45Å; D45-N59 PolarHBondContact OD1-ND2 3.49Å
46	K	91.5	Very high	90.2	Very high	40 Å²	40	64 Å²	64	17%	0.174	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	141.4	174.2	-62.5	-168.6	-172.1	-68.6	0	110.6	I34 S37 I57 T58 I64	I34-K46 HydrophobicContact CG2-CD 3.99Å; I34-K46 WeakPolarHBondContact O-CE 3.34Å; I34-K46 PolarHBondContact O-NZ 2.86Å; S37-K46 PolarHBondContact OG-NZ 2.78Å; K46-I57 CarbonylContact O-C 3.53Å; K46-I57 VanDerWaalsContact O-CA 3.29Å; K46-I57 WeakPolarHBondContact O-CA 3.45Å; K46-T58 PolarHBondContact N-O 2.67Å; K46-T58 PolarHBondContact O-N 2.82Å; K46-I64 HydrophobicContact CB-CD1 4.38Å; K46-I64 HydrophobicContact CD-CD1 3.87Å; K46-I64 HydrophobicContact CD-CG1 4.38Å; K46-I64 HydrophobicContact CD-CG2 4.14Å; K46-I64 HydrophobicContact CG-CD1 4.16Å
47	M	91.9	Very high	90.1	Very high	127 Å²	127	64.4 Å²	64.4	63%	0.626	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.4	169	-174.5	178.4	-74.3	0	0	108.6	V55 I57	M47-V55 HydrophobicContact CE-CG1 4.28Å; M47-V55 HydrophobicContact CG-CG1 3.39Å; M47-V55 HydrophobicContact SD-CG1 3.91Å; M47-I57 HydrophobicContact CE-CD1 3.94Å; M47-I57 HydrophobicContact CE-CG1 4.17Å; M47-I57 HydrophobicContact CG-CG1 4.38Å
48	L	91.3	Very high	89.9	Confident	34 Å²	34	62.5 Å²	62.5	18%	0.178	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.7	176.3	-61.6	170.2	0	0	0	107.8	V55 T56 I64 L67	L48-V55 CarbonylContact O-C 3.43Å; L48-V55 WeakPolarHBondContact O-CA 3.4Å; L48-T56 PolarHBondContact N-O 3.11Å; L48-T56 PolarHBondContact O-N 3.16Å; L48-I64 HydrophobicContact CD1-CB 4.44Å; L48-I64 HydrophobicContact CD1-CG1 4.39Å; L48-I64 HydrophobicContact CD1-CG2 4.39Å; L48-L67 HydrophobicContact CB-CD1 4.4Å; L48-L67 HydrophobicContact CD1-CB 3.88Å; L48-L67 HydrophobicContact CD1-CD1 3.62Å; L48-L67 HydrophobicContact CD1-CG 4.39Å
49	V	92.4	Very high	89.8	Confident	98 Å²	98	62.6 Å²	62.6	59%	0.594	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.9	-179.3	-172.7	0	0	0	0	107.4	D54 V55	V49-D54 WeakPolarHBondContact CA-O 3.46Å; V49-V55 HydrophobicContact CG2-CG2 4.21Å
50	D	90.4	Very high	89.6	Confident	93 Å²	93	62.5 Å²	62.5	50%	0.497	35%	0.354	S	S	.	.			trans	-78.7	166.9	175.3	-164.5	9.7	0	0	0	111.1	I52 G53 D54	D50-I52 PolarHBondContact O-N 2.95Å; D50-I52 VanDerWaalsContact O-N 3.12Å; D50-G53 WeakPolarHBondContact O-CA 3.48Å; D50-G53 PolarHBondContact O-N 3.5Å; D50-D54 HydrophobicContact CB-CB 4.44Å; D50-D54 PolarHBondContact N-O 3.02Å
51	D	89.7	Confident	89.6	Confident	159 Å²	159	62 Å²	62	85%	0.85	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-27.1	-179.6	-74.2	-19.1	0	0	0	112.9	G53	D51-G53 VanDerWaalsContact C-N 3.3Å
52	I	91.8	Very high	89.9	Confident	141 Å²	141	58.9 Å²	58.9	72%	0.723	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.3	178	-59	170.7	0	0	0	111.4	D50	D50-I52 PolarHBondContact O-N 2.95Å; D50-I52 VanDerWaalsContact O-N 3.12Å
53	G	88.5	Confident	90.1	Very high	44 Å²	44	57.6 Å²	57.6	45%	0.454	32%	0.321	S	S	.	.			trans	96.5	4.9	-175.5	0	0	0	0	0	114.5	D50 D51	D50-G53 WeakPolarHBondContact O-CA 3.48Å; D50-G53 PolarHBondContact O-N 3.5Å; D51-G53 VanDerWaalsContact C-N 3.3Å
54	D	89.1	Confident	90.4	Very high	107 Å²	107	57 Å²	57	57%	0.572	32%	0.315	S	S	*	.			trans	-68.4	131.2	173.7	-76.4	-20.4	0	0	0	110.3	V49 D50	V49-D54 WeakPolarHBondContact CA-O 3.46Å; D50-D54 HydrophobicContact CB-CB 4.44Å; D50-D54 PolarHBondContact N-O 3.02Å
55	V	90.3	Very high	90.6	Very high	41 Å²	41	51.3 Å²	51.3	25%	0.248	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.3	-174.7	-175.1	0	0	0	0	110.1	M47 L48 V49 I57 F386	M47-V55 HydrophobicContact CE-CG1 4.28Å; M47-V55 HydrophobicContact CG-CG1 3.39Å; M47-V55 HydrophobicContact SD-CG1 3.91Å; L48-V55 CarbonylContact O-C 3.43Å; L48-V55 WeakPolarHBondContact O-CA 3.4Å; V49-V55 HydrophobicContact CG2-CG2 4.21Å; V55-I57 HydrophobicContact CG1-CG1 4.26Å; V55-F386 HydrophobicContact CB-CE1 4.38Å; V55-F386 VanDerWaalsContact O-CD1 3.22Å; V55-F386 WeakPolarHBondContact O-CD1 3.37Å; V55-F386 WeakPolarHBondContact O-CE1 3.06Å
56	T	89.7	Confident	90.7	Very high	36 Å²	36	53 Å²	53	22%	0.221	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.9	169.1	-62.2	0	0	0	0	109.7	L48 T58 L67	L48-T56 PolarHBondContact N-O 3.11Å; L48-T56 PolarHBondContact O-N 3.16Å; T56-T58 HydrophobicContact CG2-CG2 4.45Å; T56-L67 HydrophobicContact CG2-CD1 3.93Å
57	I	91.4	Very high	90.6	Very high	56 Å²	56	55.3 Å²	55.3	29%	0.287	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	126.3	171.1	-56.2	172.5	0	0	0	107.4	D45 K46 M47 V55 R393	D45-I57 HydrophobicContact CB-CG2 3.94Å; K46-I57 CarbonylContact O-C 3.53Å; K46-I57 VanDerWaalsContact O-CA 3.29Å; K46-I57 WeakPolarHBondContact O-CA 3.45Å; M47-I57 HydrophobicContact CE-CD1 3.94Å; M47-I57 HydrophobicContact CE-CG1 4.17Å; M47-I57 HydrophobicContact CG-CG1 4.38Å; V55-I57 HydrophobicContact CG1-CG1 4.26Å; I57-R393 PolarHBondContact O-NH1 3.35Å
58	T	90	Very high	90.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	151.5	178.5	-166.9	0	0	0	0	114.2	K46 T56 D60 T63 I64 E390	K46-T58 PolarHBondContact N-O 2.67Å; K46-T58 PolarHBondContact O-N 2.82Å; T56-T58 HydrophobicContact CG2-CG2 4.45Å; T58-D60 PolarHBondContact OG1-N 3.45Å; T58-T63 HydrophobicContact CG2-CG2 4Å; T58-I64 HydrophobicContact CG2-CD1 4.49Å; T58-I64 HydrophobicContact CG2-CG1 3.69Å; T58-E390 VanDerWaalsContact CA-OE2 3.26Å; T58-E390 WeakPolarHBondContact CA-OE2 3.2Å; T58-E390 WeakPolarHBondContact CB-OE2 3.37Å; T58-E390 PolarHBondContact OG1-OE1 2.91Å; T58-E390 PolarHBondContact OG1-OE2 2.96Å
59	N	89.3	Confident	90.4	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.021	32%	0.32	C	S	.	.			trans	-97	-21	169.9	-157.2	-79.1	0	0	0	112.7	S38 D45 G61 S161 E390	S38-N59 PolarHBondContact O-OD1 3.33Å; D45-N59 VanDerWaalsContact OD1-CB 3.3Å; D45-N59 WeakPolarHBondContact OD1-CB 3.45Å; D45-N59 PolarHBondContact OD1-ND2 3.49Å; N59-G61 PolarHBondContact O-N 3.31Å; N59-S161 PolarHBondContact ND2-O 3.18Å; N59-S161 PolarHBondContact OD1-O 2.93Å; N59-E390 PolarHBondContact N-OE1 2.85Å
60	D	88.9	Confident	90.3	Very high	9 Å²	9	55.8 Å²	55.8	5%	0.048	30%	0.3	C	S	.	.			trans	-68.8	118.5	-173.2	169.8	36.2	0	0	0	111.6	T58 A62 T63 I64 T93	T58-D60 PolarHBondContact OG1-N 3.45Å; D60-A62 VanDerWaalsContact C-N 3.28Å; D60-A62 PolarHBondContact O-N 2.94Å; D60-A62 PolarHBondContact OD1-N 2.78Å; D60-A62 VanDerWaalsContact OD1-N 3.07Å; D60-T63 PolarHBondContact O-N 2.88Å; D60-T63 WeakPolarHBondContact OD2-CB 3.48Å; D60-T63 PolarHBondContact OD2-N 2.6Å; D60-T63 PolarHBondContact OD2-OG1 2.68Å; D60-I64 VanDerWaalsContact O-CG1 3.29Å; D60-I64 WeakPolarHBondContact O-CG1 3.43Å; D60-I64 PolarHBondContact O-N 2.9Å; D60-T93 PolarHBondContact OD1-OG1 3.22Å
61	G	89.6	Confident	90.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.9	-36.4	179.5	0	0	0	0	0	113.3	N59 L65 T94	N59-G61 PolarHBondContact O-N 3.31Å; G61-L65 WeakPolarHBondContact O-CB 3.41Å; G61-L65 WeakPolarHBondContact O-CG 3.43Å; G61-L65 PolarHBondContact O-N 3.02Å; G61-T94 PolarHBondContact N-OG1 2.98Å
62	A	90.9	Very high	90.3	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-68.8	-45.6	178.7	0	0	0	0	0	111	D60 I64 L65 K66 A82 D86 T93	D60-A62 VanDerWaalsContact C-N 3.28Å; D60-A62 PolarHBondContact O-N 2.94Å; D60-A62 PolarHBondContact OD1-N 2.78Å; D60-A62 VanDerWaalsContact OD1-N 3.07Å; A62-I64 PolarHBondContact O-N 2.87Å; A62-L65 PolarHBondContact O-N 3.06Å; A62-K66 VanDerWaalsContact O-CG 3.28Å; A62-K66 WeakPolarHBondContact O-CG 3.27Å; A62-K66 PolarHBondContact O-N 3.36Å; A62-A82 HydrophobicContact CB-CB 4.32Å; A62-D86 HydrophobicContact CB-CB 3.88Å; A62-T93 HydrophobicContact CB-CG2 3.75Å
63	T	90.6	Very high	90.3	Very high	22 Å²	22	51.2 Å²	51.2	14%	0.135	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-42.6	175.8	-58.1	0	0	0	0	112	T58 D60 L65 K66 L67	T58-T63 HydrophobicContact CG2-CG2 4Å; D60-T63 PolarHBondContact O-N 2.88Å; D60-T63 WeakPolarHBondContact OD2-CB 3.48Å; D60-T63 PolarHBondContact OD2-N 2.6Å; D60-T63 PolarHBondContact OD2-OG1 2.68Å; T63-L65 VanDerWaalsContact C-N 3.33Å; T63-L65 PolarHBondContact O-N 2.84Å; T63-K66 PolarHBondContact O-N 2.83Å; T63-L67 HydrophobicContact CG2-CD1 4.21Å; T63-L67 WeakPolarHBondContact O-CG 3.16Å; T63-L67 PolarHBondContact O-N 2.79Å
64	I	92.8	Very high	90.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-48.6	174.8	-66.7	161.6	0	0	0	110.4	I34 V35 K46 L48 T58 D60 A62 L67 L68	I34-I64 HydrophobicContact CG2-CG2 3.99Å; V35-I64 HydrophobicContact CG1-CG2 4.46Å; K46-I64 HydrophobicContact CB-CD1 4.38Å; K46-I64 HydrophobicContact CD-CD1 3.87Å; K46-I64 HydrophobicContact CD-CG1 4.38Å; K46-I64 HydrophobicContact CD-CG2 4.14Å; K46-I64 HydrophobicContact CG-CD1 4.16Å; L48-I64 HydrophobicContact CD1-CB 4.44Å; L48-I64 HydrophobicContact CD1-CG1 4.39Å; L48-I64 HydrophobicContact CD1-CG2 4.39Å; T58-I64 HydrophobicContact CG2-CD1 4.49Å; T58-I64 HydrophobicContact CG2-CG1 3.69Å; D60-I64 VanDerWaalsContact O-CG1 3.29Å; D60-I64 WeakPolarHBondContact O-CG1 3.43Å; D60-I64 PolarHBondContact O-N 2.9Å; A62-I64 PolarHBondContact O-N 2.87Å; I64-L67 PolarHBondContact O-N 3.12Å; I64-L68 HydrophobicContact CG2-CD1 4.23Å; I64-L68 WeakPolarHBondContact O-CG 3.35Å; I64-L68 PolarHBondContact O-N 2.87Å
65	L	92.9	Very high	90.6	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-73.2	-26.9	-176	-65.1	-178.9	0	0	0	113.9	I31 V35 G61 A62 T63 L68 C79 A82 V97	I31-L65 HydrophobicContact CG2-CD1 4.22Å; I31-L65 HydrophobicContact CG2-CD2 3.71Å; V35-L65 HydrophobicContact CG1-CD1 4.46Å; V35-L65 HydrophobicContact CG1-CD2 4.07Å; V35-L65 HydrophobicContact CG1-CG 4.17Å; G61-L65 WeakPolarHBondContact O-CB 3.41Å; G61-L65 WeakPolarHBondContact O-CG 3.43Å; G61-L65 PolarHBondContact O-N 3.02Å; A62-L65 PolarHBondContact O-N 3.06Å; T63-L65 VanDerWaalsContact C-N 3.33Å; T63-L65 PolarHBondContact O-N 2.84Å; L65-L68 HydrophobicContact CD2-CD1 4.01Å; L65-C79 HydrophobicContact CB-CB 4.34Å; L65-A82 HydrophobicContact CD1-CB 3.78Å; L65-V97 HydrophobicContact CD1-CG1 4.29Å; L65-V97 HydrophobicContact CD1-CG2 3.76Å
66	K	91.3	Very high	90.7	Very high	99 Å²	99	47.2 Å²	47.2	43%	0.43	24%	0.236	S	C	.	.	H	α-helix	trans	-68.6	-34.6	173.6	-74.9	169.5	-166.9	164.4	0	112.5	A62 T63 L68 D83 D86	A62-K66 VanDerWaalsContact O-CG 3.28Å; A62-K66 WeakPolarHBondContact O-CG 3.27Å; A62-K66 PolarHBondContact O-N 3.36Å; T63-K66 PolarHBondContact O-N 2.83Å; K66-L68 VanDerWaalsContact C-N 3.34Å; K66-D83 VanDerWaalsContact CE-CG 3.41Å; K66-D83 WeakPolarHBondContact CE-OD1 3.36Å; K66-D83 VanDerWaalsContact CG-OD1 3.26Å; K66-D83 WeakPolarHBondContact CG-OD1 3.38Å; K66-D83 IonicContact NZ-OD1 2.72Å; K66-D86 IonicContact NZ-OD2 3.7Å; K66-D86 PolarHBondContact NZ-OD2 3.5Å
67	L	90.6	Very high	90.9	Very high	89 Å²	89	47.5 Å²	47.5	47%	0.466	24%	0.238	S	C	.	.	H	α-helix	trans	-81.8	-14.9	179.9	-69.1	173	0	0	0	112.8	L48 T56 T63 I64	L48-L67 HydrophobicContact CB-CD1 4.4Å; L48-L67 HydrophobicContact CD1-CB 3.88Å; L48-L67 HydrophobicContact CD1-CD1 3.62Å; L48-L67 HydrophobicContact CD1-CG 4.39Å; T56-L67 HydrophobicContact CG2-CD1 3.93Å; T63-L67 HydrophobicContact CG2-CD1 4.21Å; T63-L67 WeakPolarHBondContact O-CG 3.16Å; T63-L67 PolarHBondContact O-N 2.79Å; I64-L67 PolarHBondContact O-N 3.12Å
68	L	90.2	Very high	91	Very high	53 Å²	53	44.9 Å²	44.9	28%	0.277	22%	0.224	S	C	.	.	S	Bend	trans	-83.5	124.9	176.1	-70.2	172.9	0	0	0	111	I34 I64 L65 K66 V70	I34-L68 HydrophobicContact CD1-CD1 3.83Å; I34-L68 HydrophobicContact CG2-CD1 4.34Å; I64-L68 HydrophobicContact CG2-CD1 4.23Å; I64-L68 WeakPolarHBondContact O-CG 3.35Å; I64-L68 PolarHBondContact O-N 2.87Å; L65-L68 HydrophobicContact CD2-CD1 4.01Å; K66-L68 VanDerWaalsContact C-N 3.34Å; L68-V70 HydrophobicContact CB-CG2 4.15Å; L68-V70 PolarHBondContact O-N 2.96Å; L68-V70 VanDerWaalsContact O-N 3.1Å
69	E	88.6	Confident	91.1	Very high	187 Å²	187	45.6 Å²	45.6	87%	0.874	23%	0.229	S	C	*	.			trans	-75.7	98.4	168.6	-64.1	-161.6	154.3	0	0	110.5
70	V	90.3	Very high	91.3	Very high	29 Å²	29	51.2 Å²	51.2	18%	0.176	26%	0.255	C	S	.	.			trans	-95.8	115.5	-178.3	-180	0	0	0	0	110.4	I31 L68 A75 K76	I31-V70 HydrophobicContact CD1-CG1 4.12Å; I31-V70 HydrophobicContact CD1-CG2 3.98Å; L68-V70 HydrophobicContact CB-CG2 4.15Å; L68-V70 PolarHBondContact O-N 2.96Å; L68-V70 VanDerWaalsContact O-N 3.1Å; V70-A75 HydrophobicContact CG1-CB 3.28Å; V70-K76 HydrophobicContact CB-CG 4.32Å; V70-K76 HydrophobicContact CG1-CG 4.09Å; V70-K76 WeakPolarHBondContact O-CE 3.2Å
71	E	88.4	Confident	91.6	Very high	172 Å²	172	51.2 Å²	51.2	80%	0.804	26%	0.255	S	S	*	.			trans	-79.9	-39.4	176.9	-63.6	-166.6	158.7	0	0	113.1
72	H	91.1	Very high	91.8	Very high	52 Å²	52	51.2 Å²	51.2	24%	0.241	26%	0.255	C	S	.	.	S	Bend	trans	-74.7	129.7	-169.1	-170.2	-78.4	0	0	0	112.3	N24 A27 A74 A75 K76	N24-H72 PolarHBondContact OD1-CE1 3.06Å; N24-H72 VanDerWaalsContact OD1-CE1 3.24Å; A27-H72 HydrophobicContact CB-CB 4.18Å; A27-H72 WeakPolarHBondContact CB-ND1 3.28Å; H72-A74 PolarHBondContact ND1-N 3Å; H72-A74 PolarHBondContact O-N 3.23Å; H72-A75 HydrophobicContact CB-CB 4.02Å; H72-A75 WeakPolarHBondContact O-CB 3.33Å; H72-A75 PolarHBondContact O-N 3.1Å; H72-K76 PolarHBondContact O-N 3.49Å
73	P	90.9	Very high	91.9	Very high	72 Å²	72	53 Å²	53	47%	0.468	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-44.6	-175.1	-26.8	34.7	0	0	0	114.9	A75 K76 V77	P73-A75 PolarHBondContact O-N 3.4Å; P73-K76 WeakPolarHBondContact O-CB 3.49Å; P73-K76 PolarHBondContact O-N 2.81Å; P73-K76 VanDerWaalsContact O-N 3.17Å; P73-V77 PolarHBondContact O-N 3.32Å; P73-V77 VanDerWaalsContact O-N 3.11Å
74	A	91.1	Very high	92	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-62	-29.1	178.2	0	0	0	0	0	112.8	N24 H72 I527	N24-A74 HydrophobicContact CB-CB 3.96Å; H72-A74 PolarHBondContact ND1-N 3Å; H72-A74 PolarHBondContact O-N 3.23Å; A74-I527 HydrophobicContact CB-CD1 4.25Å; A74-I527 HydrophobicContact CB-CG1 4.32Å; A74-I527 HydrophobicContact CB-CG2 4.17Å
75	A	92.7	Very high	92	Very high	4 Å²	4	56.3 Å²	56.3	3%	0.033	28%	0.281	C	S	.	.	H	α-helix	trans	-78.7	-38.2	179.3	0	0	0	0	0	110.2	A27 I31 V70 H72 P73 V77 L78 C79	A27-A75 HydrophobicContact CB-CB 4.24Å; I31-A75 HydrophobicContact CD1-CB 3.44Å; I31-A75 VanDerWaalsContact CD1-CB 3.44Å; I31-A75 WeakPolarHBondContact CD1-O 3.45Å; I31-A75 HydrophobicContact CG1-CB 4.08Å; V70-A75 HydrophobicContact CG1-CB 3.28Å; H72-A75 HydrophobicContact CB-CB 4.02Å; H72-A75 WeakPolarHBondContact O-CB 3.33Å; H72-A75 PolarHBondContact O-N 3.1Å; P73-A75 PolarHBondContact O-N 3.4Å; A75-V77 VanDerWaalsContact C-N 3.31Å; A75-V77 PolarHBondContact O-N 3.43Å; A75-L78 WeakPolarHBondContact O-CB 3.34Å; A75-L78 PolarHBondContact O-N 3.17Å; A75-C79 PolarHBondContact O-N 2.74Å; A75-C79 VanDerWaalsContact O-N 3.09Å
76	K	93.1	Very high	91.9	Very high	103 Å²	103	57.4 Å²	57.4	45%	0.448	29%	0.287	S	S	.	.	H	α-helix	trans	-57.1	-41.5	170.1	-68.7	-174.7	178	-176.1	0	112.7	V70 H72 P73 L78 C79 E80	V70-K76 HydrophobicContact CB-CG 4.32Å; V70-K76 HydrophobicContact CG1-CG 4.09Å; V70-K76 WeakPolarHBondContact O-CE 3.2Å; H72-K76 PolarHBondContact O-N 3.49Å; P73-K76 WeakPolarHBondContact O-CB 3.49Å; P73-K76 PolarHBondContact O-N 2.81Å; P73-K76 VanDerWaalsContact O-N 3.17Å; K76-L78 PolarHBondContact O-N 3.48Å; K76-C79 WeakPolarHBondContact O-CB 3.41Å; K76-C79 PolarHBondContact O-N 2.77Å; K76-C79 VanDerWaalsContact O-N 3.08Å; K76-E80 WeakPolarHBondContact O-CG 3.35Å; K76-E80 PolarHBondContact O-N 3.34Å
77	V	93.7	Very high	91.8	Very high	43 Å²	43	59.8 Å²	59.8	26%	0.261	30%	0.297	S	S	.	.	H	α-helix	trans	-58.2	-36.7	175.8	173.6	0	0	0	0	111.5	P73 A75 L81 I527	P73-V77 PolarHBondContact O-N 3.32Å; P73-V77 VanDerWaalsContact O-N 3.11Å; A75-V77 VanDerWaalsContact C-N 3.31Å; A75-V77 PolarHBondContact O-N 3.43Å; V77-L81 WeakPolarHBondContact O-CB 3.42Å; V77-L81 PolarHBondContact O-N 2.9Å; V77-I527 HydrophobicContact CB-CD1 4.21Å; V77-I527 HydrophobicContact CB-CG1 4.48Å; V77-I527 HydrophobicContact CG1-CD1 4.05Å; V77-I527 HydrophobicContact CG1-CG1 4.27Å
78	L	93.4	Very high	91.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-74.2	-32.4	175.4	-66.6	-175.8	0	0	0	113.3	A28 I31 A75 K76 L81 A82 A100	A28-L78 HydrophobicContact CB-CD1 3.63Å; I31-L78 HydrophobicContact CG2-CB 4.3Å; I31-L78 HydrophobicContact CG2-CD1 4.32Å; A75-L78 WeakPolarHBondContact O-CB 3.34Å; A75-L78 PolarHBondContact O-N 3.17Å; K76-L78 PolarHBondContact O-N 3.48Å; L78-L81 HydrophobicContact CD2-CD2 3.93Å; L78-L81 WeakPolarHBondContact O-CB 3.32Å; L78-L81 PolarHBondContact O-N 2.94Å; L78-A82 PolarHBondContact O-N 3.31Å; L78-A82 VanDerWaalsContact O-N 3.14Å; L78-A100 HydrophobicContact CD2-CB 3.67Å
79	C	93.6	Very high	91.5	Very high	16 Å²	16	57.4 Å²	57.4	11%	0.108	28%	0.283	C	S	.	.	H	α-helix	trans	-64.9	-47.3	171.6	-62.7	0	0	0	0	110.9	L65 A75 K76 L81 A82 D83	L65-C79 HydrophobicContact CB-CB 4.34Å; A75-C79 PolarHBondContact O-N 2.74Å; A75-C79 VanDerWaalsContact O-N 3.09Å; K76-C79 WeakPolarHBondContact O-CB 3.41Å; K76-C79 PolarHBondContact O-N 2.77Å; K76-C79 VanDerWaalsContact O-N 3.08Å; C79-L81 PolarHBondContact O-N 3.08Å; C79-A82 PolarHBondContact O-N 2.84Å; C79-A82 VanDerWaalsContact O-N 3.15Å; C79-D83 PolarHBondContact O-N 3.18Å
80	E	92.8	Very high	91.3	Very high	121 Å²	121	48.5 Å²	48.5	57%	0.565	24%	0.241	S	C	*	.	H	α-helix	trans	-60.5	-35.1	175.5	-70.4	176.6	-172.1	0	0	112	K76 D83 L84	K76-E80 WeakPolarHBondContact O-CG 3.35Å; K76-E80 PolarHBondContact O-N 3.34Å; E80-D83 WeakPolarHBondContact O-CB 3.48Å; E80-D83 PolarHBondContact O-N 2.81Å; E80-L84 WeakPolarHBondContact O-CB 3.32Å; E80-L84 VanDerWaalsContact O-CG 3.25Å; E80-L84 WeakPolarHBondContact O-CG 3.29Å; E80-L84 PolarHBondContact O-N 3.24Å
81	L	94.2	Very high	91.2	Very high	10 Å²	10	48.7 Å²	48.7	5%	0.052	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-45.5	174.5	-176	67.7	0	0	0	112.5	V77 L78 C79 D83 L84 Q85 V96 A100 F519 A523	V77-L81 WeakPolarHBondContact O-CB 3.42Å; V77-L81 PolarHBondContact O-N 2.9Å; L78-L81 HydrophobicContact CD2-CD2 3.93Å; L78-L81 WeakPolarHBondContact O-CB 3.32Å; L78-L81 PolarHBondContact O-N 2.94Å; C79-L81 PolarHBondContact O-N 3.08Å; L81-D83 VanDerWaalsContact C-N 3.35Å; L81-L84 PolarHBondContact O-N 3Å; L81-Q85 PolarHBondContact O-N 3.3Å; L81-V96 HydrophobicContact CD1-CG2 4.27Å; L81-V96 HydrophobicContact CD2-CG2 3.91Å; L81-V96 HydrophobicContact CG-CG1 4.4Å; L81-V96 HydrophobicContact CG-CG2 3.95Å; L81-A100 HydrophobicContact CD2-CB 3.78Å; L81-F519 HydrophobicContact CD1-CB 3.61Å; L81-F519 WeakPolarHBondContact CD1-O 3.43Å; L81-A523 HydrophobicContact CD1-CB 3.97Å; L81-A523 HydrophobicContact CD2-CB 3.67Å; L81-A523 HydrophobicContact CG-CB 4.35Å
82	A	94.3	Very high	91.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-43.3	177	0	0	0	0	0	110.9	A62 L65 L78 C79 L84 Q85 D86 V97	A62-A82 HydrophobicContact CB-CB 4.32Å; L65-A82 HydrophobicContact CD1-CB 3.78Å; L78-A82 PolarHBondContact O-N 3.31Å; L78-A82 VanDerWaalsContact O-N 3.14Å; C79-A82 PolarHBondContact O-N 2.84Å; C79-A82 VanDerWaalsContact O-N 3.15Å; A82-L84 VanDerWaalsContact C-N 3.34Å; A82-L84 PolarHBondContact O-N 2.95Å; A82-Q85 PolarHBondContact O-N 3.2Å; A82-D86 WeakPolarHBondContact O-CB 3.34Å; A82-D86 PolarHBondContact O-N 2.79Å; A82-V97 HydrophobicContact CB-CG2 3.81Å
83	D	92.7	Very high	91.3	Very high	37 Å²	37	38.9 Å²	38.9	20%	0.198	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-39.2	175.7	-82.1	16	0	0	0	113.1	K66 C79 E80 L81 K87	K66-D83 VanDerWaalsContact CE-CG 3.41Å; K66-D83 WeakPolarHBondContact CE-OD1 3.36Å; K66-D83 VanDerWaalsContact CG-OD1 3.26Å; K66-D83 WeakPolarHBondContact CG-OD1 3.38Å; K66-D83 IonicContact NZ-OD1 2.72Å; C79-D83 PolarHBondContact O-N 3.18Å; E80-D83 WeakPolarHBondContact O-CB 3.48Å; E80-D83 PolarHBondContact O-N 2.81Å; L81-D83 VanDerWaalsContact C-N 3.35Å; D83-K87 WeakPolarHBondContact O-CB 3.25Å; D83-K87 VanDerWaalsContact O-CG 3.29Å; D83-K87 WeakPolarHBondContact O-CG 3.28Å; D83-K87 PolarHBondContact O-N 3.09Å
84	L	93.3	Very high	91.5	Very high	91 Å²	91	36 Å²	36	48%	0.476	18%	0.179	S	C	.	.	H	α-helix	trans	-66.7	-43.2	176.1	-76	172.2	0	0	0	111	E80 L81 A82 K87 E88	E80-L84 WeakPolarHBondContact O-CB 3.32Å; E80-L84 VanDerWaalsContact O-CG 3.25Å; E80-L84 WeakPolarHBondContact O-CG 3.29Å; E80-L84 PolarHBondContact O-N 3.24Å; L81-L84 PolarHBondContact O-N 3Å; A82-L84 VanDerWaalsContact C-N 3.34Å; A82-L84 PolarHBondContact O-N 2.95Å; L84-K87 PolarHBondContact O-N 2.9Å; L84-E88 VanDerWaalsContact O-CB 3.22Å; L84-E88 WeakPolarHBondContact O-CB 3.5Å; L84-E88 PolarHBondContact O-N 2.91Å
85	Q	93.3	Very high	91.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-43	176.3	-179	68.3	21.7	0	0	111.6	L81 A82 E88 V89 G90 D91 T93 V96 S516 F519	L81-Q85 PolarHBondContact O-N 3.3Å; A82-Q85 PolarHBondContact O-N 3.2Å; Q85-E88 PolarHBondContact O-N 3.33Å; Q85-V89 WeakPolarHBondContact O-CA 3.49Å; Q85-V89 WeakPolarHBondContact O-CB 3.4Å; Q85-V89 PolarHBondContact O-N 3.33Å; Q85-G90 PolarHBondContact O-N 3.35Å; Q85-G90 VanDerWaalsContact O-N 3.12Å; Q85-D91 WeakPolarHBondContact CG-O 2.83Å; Q85-D91 PolarHBondContact NE2-O 3.09Å; Q85-T93 HydrophobicContact CG-CG2 4.38Å; Q85-V96 HydrophobicContact CB-CG1 3.9Å; Q85-V96 HydrophobicContact CG-CG1 4Å; Q85-S516 PolarHBondContact NE2-OG 3.3Å; Q85-S516 VanDerWaalsContact NE2-OG 3.13Å; Q85-F519 VanDerWaalsContact OE1-CD2 3.23Å
86	D	91.1	Very high	91.8	Very high	26 Å²	26	37 Å²	37	14%	0.139	19%	0.186	C	C	.	.	H	α-helix	trans	-58.4	-50.5	175.4	-178.1	35.4	0	0	0	111.3	A62 K66 A82 E88 G90 T93	A62-D86 HydrophobicContact CB-CB 3.88Å; K66-D86 IonicContact NZ-OD2 3.7Å; K66-D86 PolarHBondContact NZ-OD2 3.5Å; A82-D86 WeakPolarHBondContact O-CB 3.34Å; A82-D86 PolarHBondContact O-N 2.79Å; D86-E88 PolarHBondContact O-N 2.75Å; D86-G90 WeakPolarHBondContact O-CA 3.25Å; D86-G90 PolarHBondContact O-N 3.22Å; D86-T93 HydrophobicContact CB-CG2 3.81Å
87	K	89.2	Confident	91.9	Very high	149 Å²	149	32.1 Å²	32.1	65%	0.648	17%	0.165	S	C	*	.	H	α-helix	trans	-67	-39.9	179.1	-70.3	167.1	-174.3	162.6	0	113.7	D83 L84	D83-K87 WeakPolarHBondContact O-CB 3.25Å; D83-K87 VanDerWaalsContact O-CG 3.29Å; D83-K87 WeakPolarHBondContact O-CG 3.28Å; D83-K87 PolarHBondContact O-N 3.09Å; L84-K87 PolarHBondContact O-N 2.9Å
88	E	86.8	Confident	92	Very high	91 Å²	91	30 Å²	30	43%	0.425	15%	0.152	S	C	.	.	H	α-helix	trans	-86	-25.1	-173.3	-82.6	-69.6	148.5	0	0	114.1	L84 Q85 D86 R404 K515 F519	L84-E88 VanDerWaalsContact O-CB 3.22Å; L84-E88 WeakPolarHBondContact O-CB 3.5Å; L84-E88 PolarHBondContact O-N 2.91Å; Q85-E88 PolarHBondContact O-N 3.33Å; D86-E88 PolarHBondContact O-N 2.75Å; E88-R404 VanDerWaalsContact O-CZ 3.22Å; E88-R404 PolarHBondContact O-NE 3.5Å; E88-R404 PolarHBondContact O-NH2 3.49Å; E88-K515 HydrophobicContact CB-CD 4.45Å; E88-K515 PolarHBondContact O-NZ 3.24Å; E88-K515 IonicContact OE2-NZ 3.15Å; E88-K515 PolarHBondContact OE2-NZ 3.43Å; E88-F519 HydrophobicContact CB-CE2 4.25Å; E88-F519 HydrophobicContact CB-CZ 4.42Å; E88-F519 HydrophobicContact CG-CZ 4.3Å
89	V	86.2	Confident	92.2	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.012	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130	-47.6	-174.2	-176.3	0	0	0	0	110.5	Q85 V512 K515	Q85-V89 WeakPolarHBondContact O-CA 3.49Å; Q85-V89 WeakPolarHBondContact O-CB 3.4Å; Q85-V89 PolarHBondContact O-N 3.33Å; V89-V512 HydrophobicContact CG1-CB 4.01Å; V89-V512 HydrophobicContact CG1-CG1 4.32Å; V89-V512 HydrophobicContact CG1-CG2 3.35Å; V89-K515 HydrophobicContact CG2-CB 4.06Å; V89-K515 HydrophobicContact CG2-CD 3.44Å; V89-K515 VanDerWaalsContact CG2-CD 3.44Å; V89-K515 HydrophobicContact CG2-CG 4.36Å
90	G	84.6	Confident	92.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	81.5	19.2	-176.7	0	0	0	0	0	113.8	Q85 D86 D397	Q85-G90 PolarHBondContact O-N 3.35Å; Q85-G90 VanDerWaalsContact O-N 3.12Å; D86-G90 WeakPolarHBondContact O-CA 3.25Å; D86-G90 PolarHBondContact O-N 3.22Å; G90-D397 WeakPolarHBondContact O-CA 3.22Å
91	D	88.3	Confident	92.5	Very high	33 Å²	33	24.3 Å²	24.3	18%	0.176	13%	0.125	C	C	.	.	S	Bend	trans	-159.4	163.8	171.5	-166.2	12.2	0	0	0	110.2	Q85 T93 V401 V512	Q85-D91 WeakPolarHBondContact CG-O 2.83Å; Q85-D91 PolarHBondContact NE2-O 3.09Å; D91-T93 VanDerWaalsContact C-N 3.34Å; D91-V401 HydrophobicContact CB-CG2 3.53Å; D91-V401 VanDerWaalsContact OD2-CG2 3.28Å; D91-V401 WeakPolarHBondContact OD2-CG2 3.1Å; D91-V512 HydrophobicContact CB-CG2 4.49Å
92	G	89.9	Confident	92.6	Very high	9 Å²	9	25.8 Å²	25.8	9%	0.093	13%	0.132	C	C	.	.			trans	77.2	18.4	179	0	0	0	0	0	114.2	S95 V96	G92-S95 PolarHBondContact O-N 3.34Å; G92-V96 PolarHBondContact O-N 2.8Å
93	T	92.7	Very high	92.7	Very high	8 Å²	8	25.8 Å²	25.8	5%	0.049	13%	0.132	C	C	.	.	H	α-helix	trans	-59.4	-45.6	178.9	53.9	0	0	0	0	111.4	D60 A62 Q85 D86 D91 V96 V97	D60-T93 PolarHBondContact OD1-OG1 3.22Å; A62-T93 HydrophobicContact CB-CG2 3.75Å; Q85-T93 HydrophobicContact CG-CG2 4.38Å; D86-T93 HydrophobicContact CB-CG2 3.81Å; D91-T93 VanDerWaalsContact C-N 3.34Å; T93-V96 WeakPolarHBondContact O-CG1 3.46Å; T93-V97 WeakPolarHBondContact O-CG2 3.32Å
94	T	93.8	Very high	92.8	Very high	12 Å²	12	24.1 Å²	24.1	7%	0.074	12%	0.123	C	C	.	.	H	α-helix	trans	-68	-41.6	176.8	-51.8	0	0	0	0	112.1	V35 L39 G61 V96 V97 I98	V35-T94 HydrophobicContact CB-CG2 3.84Å; V35-T94 HydrophobicContact CG2-CG2 4.1Å; V35-T94 VanDerWaalsContact O-CG2 3.31Å; V35-T94 WeakPolarHBondContact O-CG2 3.34Å; L39-T94 HydrophobicContact CB-CG2 4.08Å; L39-T94 HydrophobicContact CD1-CG2 4.01Å; G61-T94 PolarHBondContact N-OG1 2.98Å; T94-V96 PolarHBondContact O-N 2.93Å; T94-V97 PolarHBondContact O-N 3.45Å; T94-I98 HydrophobicContact CG2-CD1 3.69Å; T94-I98 HydrophobicContact CG2-CG1 4.48Å; T94-I98 WeakPolarHBondContact O-CD1 3.44Å; T94-I98 VanDerWaalsContact O-CG1 3.27Å; T94-I98 WeakPolarHBondContact O-CG1 3.4Å; T94-I98 PolarHBondContact O-N 3.47Å; T94-I98 VanDerWaalsContact O-N 3.17Å
95	S	94.3	Very high	92.9	Very high	26 Å²	26	25 Å²	25	18%	0.182	12%	0.123	C	C	.	.	H	α-helix	trans	-65.3	-40.4	-177.6	-65.9	0	0	0	0	112.4	L39 G92 V97 I98 L99	L39-S95 WeakPolarHBondContact CD1-OG 3.3Å; G92-S95 PolarHBondContact O-N 3.34Å; S95-V97 PolarHBondContact O-N 3.46Å; S95-I98 PolarHBondContact O-N 3.36Å; S95-L99 VanDerWaalsContact O-CB 3.32Å; S95-L99 WeakPolarHBondContact O-CB 3.27Å; S95-L99 PolarHBondContact O-N 2.95Å
96	V	95.8	Very high	92.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-65.7	-38.1	-179	68.9	0	0	0	0	111.9	L81 Q85 G92 T93 T94 A100 F519 A520	L81-V96 HydrophobicContact CD1-CG2 4.27Å; L81-V96 HydrophobicContact CD2-CG2 3.91Å; L81-V96 HydrophobicContact CG-CG1 4.4Å; L81-V96 HydrophobicContact CG-CG2 3.95Å; Q85-V96 HydrophobicContact CB-CG1 3.9Å; Q85-V96 HydrophobicContact CG-CG1 4Å; G92-V96 PolarHBondContact O-N 2.8Å; T93-V96 WeakPolarHBondContact O-CG1 3.46Å; T94-V96 PolarHBondContact O-N 2.93Å; V96-A100 VanDerWaalsContact O-CB 3.32Å; V96-A100 WeakPolarHBondContact O-CB 3.36Å; V96-A100 PolarHBondContact O-N 3.21Å; V96-F519 HydrophobicContact CG2-CB 4.07Å; V96-A520 HydrophobicContact CG2-CB 3.98Å
97	V	96.2	Very high	93	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-69.2	-45.6	178.9	175.6	0	0	0	0	111.2	I31 V35 L65 A82 T93 T94 S95 L99 A100 A101	I31-V97 HydrophobicContact CG2-CG1 3.76Å; V35-V97 HydrophobicContact CG2-CB 4.3Å; V35-V97 HydrophobicContact CG2-CG1 3.99Å; L65-V97 HydrophobicContact CD1-CG1 4.29Å; L65-V97 HydrophobicContact CD1-CG2 3.76Å; A82-V97 HydrophobicContact CB-CG2 3.81Å; T93-V97 WeakPolarHBondContact O-CG2 3.32Å; T94-V97 PolarHBondContact O-N 3.45Å; S95-V97 PolarHBondContact O-N 3.46Å; V97-L99 VanDerWaalsContact C-N 3.33Å; V97-L99 PolarHBondContact O-N 2.84Å; V97-A100 PolarHBondContact O-N 3.29Å; V97-A101 PolarHBondContact O-N 3.05Å
98	I	96.7	Very high	93.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.4	-43.8	178.9	-64.2	167.7	0	0	0	110.3	V35 K36 L39 T94 S95 A101 E102 V450 I451	V35-I98 HydrophobicContact CG2-CD1 4.47Å; V35-I98 HydrophobicContact CG2-CG1 4Å; K36-I98 HydrophobicContact CG-CD1 3.93Å; K36-I98 HydrophobicContact CG-CG1 3.96Å; K36-I98 HydrophobicContact CG-CG2 4.31Å; L39-I98 HydrophobicContact CB-CD1 4.05Å; L39-I98 HydrophobicContact CD1-CD1 4.34Å; L39-I98 HydrophobicContact CD2-CD1 3.86Å; L39-I98 HydrophobicContact CG-CD1 4.29Å; T94-I98 HydrophobicContact CG2-CD1 3.69Å; T94-I98 HydrophobicContact CG2-CG1 4.48Å; T94-I98 WeakPolarHBondContact O-CD1 3.44Å; T94-I98 VanDerWaalsContact O-CG1 3.27Å; T94-I98 WeakPolarHBondContact O-CG1 3.4Å; T94-I98 PolarHBondContact O-N 3.47Å; T94-I98 VanDerWaalsContact O-N 3.17Å; S95-I98 PolarHBondContact O-N 3.36Å; I98-A101 PolarHBondContact O-N 3.36Å; I98-E102 PolarHBondContact O-N 2.88Å; I98-V450 HydrophobicContact CG2-CG1 3.92Å; I98-V450 HydrophobicContact CG2-CG2 3.87Å; I98-I451 HydrophobicContact CB-CD1 4.26Å; I98-I451 HydrophobicContact CG2-CD1 4.15Å
99	L	96.4	Very high	93.4	Very high	11 Å²	11	17.7 Å²	17.7	6%	0.058	9%	0.092	C	C	.	.	H	α-helix	trans	-65.6	-44	178.9	-177.8	61.8	0	0	0	112	S95 V97 A101 E102 L103 L448 L517 A520	S95-L99 VanDerWaalsContact O-CB 3.32Å; S95-L99 WeakPolarHBondContact O-CB 3.27Å; S95-L99 PolarHBondContact O-N 2.95Å; V97-L99 VanDerWaalsContact C-N 3.33Å; V97-L99 PolarHBondContact O-N 2.84Å; L99-A101 VanDerWaalsContact C-N 3.33Å; L99-A101 PolarHBondContact O-N 2.92Å; L99-E102 PolarHBondContact O-N 2.87Å; L99-L103 HydrophobicContact CD1-CG 4.35Å; L99-L103 HydrophobicContact CG-CD1 4.2Å; L99-L103 HydrophobicContact CG-CG 4.47Å; L99-L103 WeakPolarHBondContact O-CB 3.49Å; L99-L103 VanDerWaalsContact O-CG 3.31Å; L99-L103 WeakPolarHBondContact O-CG 3.3Å; L99-L103 PolarHBondContact O-N 3.41Å; L99-L448 HydrophobicContact CD1-CD2 3.9Å; L99-L448 HydrophobicContact CD2-CD2 4.23Å; L99-L517 HydrophobicContact CD2-CD2 3.81Å; L99-A520 HydrophobicContact CB-CB 4.17Å; L99-A520 HydrophobicContact CD2-CB 3.94Å; L99-A520 HydrophobicContact CG-CB 3.99Å
100	A	96.4	Very high	93.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.6	-42.5	178.3	0	0	0	0	0	112	L78 L81 V96 V97 L103 L104 A520	L78-A100 HydrophobicContact CD2-CB 3.67Å; L81-A100 HydrophobicContact CD2-CB 3.78Å; V96-A100 VanDerWaalsContact O-CB 3.32Å; V96-A100 WeakPolarHBondContact O-CB 3.36Å; V96-A100 PolarHBondContact O-N 3.21Å; V97-A100 PolarHBondContact O-N 3.29Å; A100-L103 PolarHBondContact O-N 2.95Å; A100-L104 WeakPolarHBondContact O-CG 3.33Å; A100-L104 PolarHBondContact O-N 3.08Å; A100-A520 HydrophobicContact CB-CB 4.02Å
101	A	96.2	Very high	94	Very high	6 Å²	6	18.9 Å²	18.9	5%	0.05	10%	0.099	C	C	.	.	H	α-helix	trans	-67.3	-39	177.5	0	0	0	0	0	112.7	A28 A32 V97 I98 L99 L104 K105	A28-A101 HydrophobicContact CB-CB 4.48Å; A32-A101 HydrophobicContact CB-CB 3.36Å; V97-A101 PolarHBondContact O-N 3.05Å; I98-A101 PolarHBondContact O-N 3.36Å; L99-A101 VanDerWaalsContact C-N 3.33Å; L99-A101 PolarHBondContact O-N 2.92Å; A101-L104 PolarHBondContact O-N 3.11Å; A101-K105 PolarHBondContact O-N 3.27Å
102	E	96.3	Very high	94.1	Very high	40 Å²	40	20.9 Å²	20.9	19%	0.187	11%	0.106	C	C	.	.	H	α-helix	trans	-67.6	-40.6	176.3	-164.5	70.7	-167	0	0	111.5	I98 L99 L104 K105 S106 V450	I98-E102 PolarHBondContact O-N 2.88Å; L99-E102 PolarHBondContact O-N 2.87Å; E102-L104 VanDerWaalsContact C-N 3.29Å; E102-L104 PolarHBondContact O-N 2.94Å; E102-K105 PolarHBondContact O-N 3.39Å; E102-S106 PolarHBondContact O-N 3.46Å; E102-S106 PolarHBondContact O-OG 3.32Å; E102-S106 VanDerWaalsContact O-OG 3.12Å; E102-V450 HydrophobicContact CB-CB 4.13Å; E102-V450 HydrophobicContact CB-CG1 3.97Å; E102-V450 HydrophobicContact CB-CG2 4.24Å; E102-V450 HydrophobicContact CG-CB 3.89Å; E102-V450 HydrophobicContact CG-CG1 4.23Å; E102-V450 HydrophobicContact CG-CG2 4.12Å
103	L	96.2	Very high	94.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-40.6	174	-73.3	174.2	0	0	0	111.9	L99 A100 A107 Y124 F444 A520 A524	L99-L103 HydrophobicContact CD1-CG 4.35Å; L99-L103 HydrophobicContact CG-CD1 4.2Å; L99-L103 HydrophobicContact CG-CG 4.47Å; L99-L103 WeakPolarHBondContact O-CB 3.49Å; L99-L103 VanDerWaalsContact O-CG 3.31Å; L99-L103 WeakPolarHBondContact O-CG 3.3Å; L99-L103 PolarHBondContact O-N 3.41Å; A100-L103 PolarHBondContact O-N 2.95Å; L103-A107 VanDerWaalsContact O-CB 3.26Å; L103-A107 WeakPolarHBondContact O-CB 3.48Å; L103-A107 PolarHBondContact O-N 3.44Å; L103-Y124 HydrophobicContact CB-CE2 4.11Å; L103-Y124 HydrophobicContact CD2-CE2 4.06Å; L103-Y124 PolarHBondContact O-OH 3.21Å; L103-F444 HydrophobicContact CD1-CD2 4.42Å; L103-F444 HydrophobicContact CD1-CE2 3.9Å; L103-F444 HydrophobicContact CD2-CB 4.44Å; L103-F444 HydrophobicContact CD2-CD2 3.36Å; L103-F444 HydrophobicContact CD2-CE2 3.66Å; L103-F444 HydrophobicContact CD2-CG 3.95Å; L103-F444 HydrophobicContact CD2-CZ 4.46Å; L103-F444 HydrophobicContact CG-CE2 4.46Å; L103-A520 HydrophobicContact CD1-CB 4.38Å; L103-A524 HydrophobicContact CB-CB 3.91Å; L103-A524 HydrophobicContact CD1-CB 4.5Å
104	L	94.8	Very high	94	Very high	3 Å²	3	34 Å²	34	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-65	-43.1	175.6	-76.8	171.3	0	0	0	112.5	V25 A28 A100 A101 E102 A107 D108 A524 I527	V25-L104 HydrophobicContact CG2-CB 4.4Å; A28-L104 HydrophobicContact CB-CD1 3.79Å; A100-L104 WeakPolarHBondContact O-CG 3.33Å; A100-L104 PolarHBondContact O-N 3.08Å; A101-L104 PolarHBondContact O-N 3.11Å; E102-L104 VanDerWaalsContact C-N 3.29Å; E102-L104 PolarHBondContact O-N 2.94Å; L104-A107 PolarHBondContact O-N 2.91Å; L104-D108 PolarHBondContact O-N 3.16Å; L104-A524 HydrophobicContact CD2-CB 4.08Å; L104-A524 WeakPolarHBondContact CD2-O 3.18Å; L104-A524 HydrophobicContact CG-CB 4.02Å; L104-I527 HydrophobicContact CD1-CB 4.25Å; L104-I527 HydrophobicContact CD1-CD1 3.73Å; L104-I527 HydrophobicContact CD1-CG2 4.1Å; L104-I527 HydrophobicContact CD2-CB 3.9Å; L104-I527 HydrophobicContact CD2-CG2 3.85Å
105	K	95.1	Very high	93.8	Very high	108 Å²	108	34.3 Å²	34.3	47%	0.47	16%	0.163	S	C	.	.	H	α-helix	trans	-61.8	-46.4	177.6	-176.2	-175.2	173.1	-167.4	0	111.5	V25 A101 E102 A107 D108 E109	V25-K105 HydrophobicContact CG1-CB 4.26Å; A101-K105 PolarHBondContact O-N 3.27Å; E102-K105 PolarHBondContact O-N 3.39Å; K105-A107 VanDerWaalsContact C-N 3.34Å; K105-D108 PolarHBondContact O-N 3.34Å; K105-E109 PolarHBondContact O-N 3.25Å
106	S	93.7	Very high	93.6	Very high	11 Å²	11	38.7 Å²	38.7	8%	0.077	18%	0.18	C	C	.	.	H	α-helix	trans	-66.2	-37.3	177.5	-58.8	0	0	0	0	112.1	E102 E109 L110 S447	E102-S106 PolarHBondContact O-N 3.46Å; E102-S106 PolarHBondContact O-OG 3.32Å; E102-S106 VanDerWaalsContact O-OG 3.12Å; S106-E109 PolarHBondContact O-N 2.91Å; S106-L110 PolarHBondContact O-N 3.42Å; S106-S447 WeakPolarHBondContact CB-OG 3.34Å; S106-S447 PolarHBondContact OG-OG 3.42Å
107	A	93.3	Very high	93.4	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-65.1	-38.6	175.2	0	0	0	0	0	112.6	L103 L104 K105 E109 L110 V111 V120 Y124 L528	L103-A107 VanDerWaalsContact O-CB 3.26Å; L103-A107 WeakPolarHBondContact O-CB 3.48Å; L103-A107 PolarHBondContact O-N 3.44Å; L104-A107 PolarHBondContact O-N 2.91Å; K105-A107 VanDerWaalsContact C-N 3.34Å; A107-E109 PolarHBondContact O-N 3.28Å; A107-L110 PolarHBondContact O-N 2.83Å; A107-V111 WeakPolarHBondContact O-CG2 3.38Å; A107-V111 PolarHBondContact O-N 2.99Å; A107-V120 HydrophobicContact CB-CG1 3.99Å; A107-Y124 HydrophobicContact CB-CE2 4.06Å; A107-Y124 PolarHBondContact N-OH 2.87Å; A107-L528 HydrophobicContact CB-CD1 4Å; A107-L528 HydrophobicContact CB-CD2 3.88Å
108	D	92.4	Very high	93.2	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.043	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-42.6	177	-170.9	58.4	0	0	0	112	V25 L104 K105 L110 V111 K112	V25-D108 HydrophobicContact CG2-CB 3.8Å; L104-D108 PolarHBondContact O-N 3.16Å; K105-D108 PolarHBondContact O-N 3.34Å; D108-L110 VanDerWaalsContact C-N 3.33Å; D108-L110 PolarHBondContact O-N 3.34Å; D108-V111 PolarHBondContact O-N 3.19Å; D108-V111 VanDerWaalsContact O-N 3.15Å; D108-K112 WeakPolarHBondContact O-CG 3.48Å; D108-K112 PolarHBondContact O-N 3.03Å; D108-K112 WeakPolarHBondContact OD2-CE 3.37Å; D108-K112 IonicContact OD2-NZ 3.91Å; D108-K112 PolarHBondContact OD2-NZ 3.49Å
109	E	92.2	Very high	93	Very high	93 Å²	93	45 Å²	45	44%	0.435	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-38.8	175.1	-68.1	-56.4	138.2	0	0	112.6	K105 S106 A107 K112 Q113	K105-E109 PolarHBondContact O-N 3.25Å; S106-E109 PolarHBondContact O-N 2.91Å; A107-E109 PolarHBondContact O-N 3.28Å; E109-K112 PolarHBondContact O-N 2.95Å; E109-K112 IonicContact OE1-NZ 2.74Å; E109-K112 PolarHBondContact OE1-NZ 3.18Å; E109-Q113 WeakPolarHBondContact O-CG 3.27Å; E109-Q113 PolarHBondContact O-N 3.46Å; E109-Q113 VanDerWaalsContact O-N 3.17Å
110	L	92.2	Very high	92.8	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-38	174.2	-67.6	174	0	0	0	112.2	S106 A107 D108 Q113 I115 V120 L439 A440 E443	S106-L110 PolarHBondContact O-N 3.42Å; A107-L110 PolarHBondContact O-N 2.83Å; D108-L110 VanDerWaalsContact C-N 3.33Å; D108-L110 PolarHBondContact O-N 3.34Å; L110-Q113 WeakPolarHBondContact O-CB 3.26Å; L110-Q113 PolarHBondContact O-N 2.91Å; L110-I115 HydrophobicContact CB-CD1 4.16Å; L110-I115 HydrophobicContact CD2-CD1 3.78Å; L110-I115 WeakPolarHBondContact O-CB 3.32Å; L110-I115 PolarHBondContact O-N 3.34Å; L110-V120 HydrophobicContact CB-CG2 4.07Å; L110-V120 HydrophobicContact CD1-CG1 4.05Å; L110-V120 HydrophobicContact CD1-CG2 4.19Å; L110-L439 HydrophobicContact CD2-CB 4.18Å; L110-A440 HydrophobicContact CD1-CB 4.27Å; L110-E443 HydrophobicContact CD1-CB 4.02Å; L110-E443 HydrophobicContact CD1-CG 4.01Å; L110-E443 HydrophobicContact CD2-CG 3.85Å; L110-E443 HydrophobicContact CG-CG 4.04Å
111	V	91.1	Very high	92.7	Very high	24 Å²	24	45 Å²	45	15%	0.145	22%	0.221	C	C	.	.	H	α-helix	trans	-67.8	-38.7	177.6	174	0	0	0	0	111	A107 D108 Q113 K114 P117 L528	A107-V111 WeakPolarHBondContact O-CG2 3.38Å; A107-V111 PolarHBondContact O-N 2.99Å; D108-V111 PolarHBondContact O-N 3.19Å; D108-V111 VanDerWaalsContact O-N 3.15Å; V111-Q113 PolarHBondContact O-N 3.32Å; V111-K114 WeakPolarHBondContact O-CA 3.47Å; V111-K114 PolarHBondContact O-N 3.48Å; V111-P117 HydrophobicContact CG1-CG 4.46Å; V111-P117 HydrophobicContact CG2-CB 4.47Å; V111-P117 HydrophobicContact CG2-CG 3.99Å; V111-L528 HydrophobicContact CG2-CD1 4.25Å
112	K	90.3	Very high	92.5	Very high	75 Å²	75	47 Å²	47	33%	0.326	24%	0.235	S	C	.	.	H	α-helix	trans	-59.1	-35.2	171.8	-72	172.6	-171.1	153.3	0	112.2	D108 E109 K114	D108-K112 WeakPolarHBondContact O-CG 3.48Å; D108-K112 PolarHBondContact O-N 3.03Å; D108-K112 WeakPolarHBondContact OD2-CE 3.37Å; D108-K112 IonicContact OD2-NZ 3.91Å; D108-K112 PolarHBondContact OD2-NZ 3.49Å; E109-K112 PolarHBondContact O-N 2.95Å; E109-K112 IonicContact OE1-NZ 2.74Å; E109-K112 PolarHBondContact OE1-NZ 3.18Å; K112-K114 PolarHBondContact O-N 3.19Å
113	Q	90.5	Very high	92.4	Very high	123 Å²	123	45.1 Å²	45.1	58%	0.575	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	13.4	172.2	-65.1	173.9	18.9	0	0	114.1	E109 L110 V111 I115	E109-Q113 WeakPolarHBondContact O-CG 3.27Å; E109-Q113 PolarHBondContact O-N 3.46Å; E109-Q113 VanDerWaalsContact O-N 3.17Å; L110-Q113 WeakPolarHBondContact O-CB 3.26Å; L110-Q113 PolarHBondContact O-N 2.91Å; V111-Q113 PolarHBondContact O-N 3.32Å; Q113-I115 VanDerWaalsContact C-N 3.26Å; Q113-I115 PolarHBondContact O-N 2.84Å
114	K	89.2	Confident	92.4	Very high	168 Å²	168	45.1 Å²	45.1	73%	0.73	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	23.7	179.1	-52.7	-57.3	-175.3	-169.4	0	114.3	V111 K112	V111-K114 WeakPolarHBondContact O-CA 3.47Å; V111-K114 PolarHBondContact O-N 3.48Å; K112-K114 PolarHBondContact O-N 3.19Å
115	I	90.6	Very high	92.4	Very high	20 Å²	20	50.4 Å²	50.4	10%	0.103	25%	0.245	C	C	.	.			trans	-81.3	129.4	169.1	-58	170.7	0	0	0	108.5	L110 Q113 V120 L439	L110-I115 HydrophobicContact CB-CD1 4.16Å; L110-I115 HydrophobicContact CD2-CD1 3.78Å; L110-I115 WeakPolarHBondContact O-CB 3.32Å; L110-I115 PolarHBondContact O-N 3.34Å; Q113-I115 VanDerWaalsContact C-N 3.26Å; Q113-I115 PolarHBondContact O-N 2.84Å; I115-V120 HydrophobicContact CG2-CG2 3.84Å; I115-L439 HydrophobicContact CD1-CB 4.25Å; I115-L439 HydrophobicContact CD1-CD1 3.66Å
116	H	90.3	Very high	92.3	Very high	117 Å²	117	47.4 Å²	47.4	54%	0.542	23%	0.234	S	C	.	.			trans	-64.7	133	-179.5	-165.1	-86.2	0	0	0	110.6	T118 S119 V120	H116-T118 PolarHBondContact CE1-OG1 3.28Å; H116-T118 WeakPolarHBondContact ND1-CB 3.49Å; H116-T118 PolarHBondContact ND1-N 2.82Å; H116-T118 PolarHBondContact ND1-OG1 3.2Å; H116-T118 PolarHBondContact O-N 3.44Å; H116-T118 VanDerWaalsContact O-N 3.09Å; H116-S119 WeakPolarHBondContact O-CB 3.37Å; H116-S119 PolarHBondContact O-N 3.41Å; H116-V120 PolarHBondContact O-N 2.9Å
117	P	91.3	Very high	92.4	Very high	17 Å²	17	46.9 Å²	46.9	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-52	-36.9	-178.1	-28.5	33.5	0	0	0	114	R21 V111 S119 V120 I121 L528	R21-P117 VanDerWaalsContact CZ-CG 3.44Å; V111-P117 HydrophobicContact CG1-CG 4.46Å; V111-P117 HydrophobicContact CG2-CB 4.47Å; V111-P117 HydrophobicContact CG2-CG 3.99Å; P117-S119 VanDerWaalsContact C-N 3.31Å; P117-S119 PolarHBondContact O-N 2.78Å; P117-V120 WeakPolarHBondContact O-CB 3.28Å; P117-V120 PolarHBondContact O-N 3.3Å; P117-V120 VanDerWaalsContact O-N 3.14Å; P117-I121 VanDerWaalsContact O-CG1 3.28Å; P117-I121 WeakPolarHBondContact O-CG1 3.28Å; P117-I121 PolarHBondContact O-N 2.89Å; P117-L528 HydrophobicContact CB-CG 4.33Å
118	T	91.6	Very high	92.5	Very high	81 Å²	81	47.4 Å²	47.4	50%	0.497	23%	0.234	S	C	.	.	H	α-helix	trans	-58.7	-38.8	176.2	-45.9	0	0	0	0	113.1	H116 V120 I121 S122	H116-T118 PolarHBondContact CE1-OG1 3.28Å; H116-T118 WeakPolarHBondContact ND1-CB 3.49Å; H116-T118 PolarHBondContact ND1-N 2.82Å; H116-T118 PolarHBondContact ND1-OG1 3.2Å; H116-T118 PolarHBondContact O-N 3.44Å; H116-T118 VanDerWaalsContact O-N 3.09Å; T118-V120 VanDerWaalsContact C-N 3.35Å; T118-I121 PolarHBondContact O-N 3.42Å; T118-S122 PolarHBondContact O-N 3.49Å; T118-S122 PolarHBondContact O-OG 3.28Å
119	S	92.2	Very high	92.6	Very high	35 Å²	35	54.2 Å²	54.2	25%	0.245	26%	0.263	C	S	.	.	H	α-helix	trans	-68	-37.2	176.9	-60.5	0	0	0	0	111.5	H116 P117 S122 G123	H116-S119 WeakPolarHBondContact O-CB 3.37Å; H116-S119 PolarHBondContact O-N 3.41Å; P117-S119 VanDerWaalsContact C-N 3.31Å; P117-S119 PolarHBondContact O-N 2.78Å; S119-S122 PolarHBondContact O-N 2.99Å; S119-G123 PolarHBondContact O-N 2.81Å
120	V	93.1	Very high	92.8	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-44.7	174	-175.7	0	0	0	0	110.6	A107 L110 I115 H116 P117 T118 S122 G123 Y124 A440 L528	A107-V120 HydrophobicContact CB-CG1 3.99Å; L110-V120 HydrophobicContact CB-CG2 4.07Å; L110-V120 HydrophobicContact CD1-CG1 4.05Å; L110-V120 HydrophobicContact CD1-CG2 4.19Å; I115-V120 HydrophobicContact CG2-CG2 3.84Å; H116-V120 PolarHBondContact O-N 2.9Å; P117-V120 WeakPolarHBondContact O-CB 3.28Å; P117-V120 PolarHBondContact O-N 3.3Å; P117-V120 VanDerWaalsContact O-N 3.14Å; T118-V120 VanDerWaalsContact C-N 3.35Å; V120-S122 PolarHBondContact O-N 3.31Å; V120-G123 PolarHBondContact O-N 2.86Å; V120-Y124 HydrophobicContact CG1-CD1 4.17Å; V120-Y124 HydrophobicContact CG1-CE1 3.87Å; V120-Y124 HydrophobicContact CG1-CE2 4.27Å; V120-Y124 PolarHBondContact O-N 2.97Å; V120-A440 HydrophobicContact CB-CB 4.5Å; V120-A440 HydrophobicContact CG1-CB 4.27Å; V120-L528 HydrophobicContact CB-CD2 4.17Å; V120-L528 HydrophobicContact CG1-CD2 4Å
121	I	93.8	Very high	92.9	Very high	11 Å²	11	50.1 Å²	50.1	6%	0.056	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-46.3	177.1	-68.2	166.3	0	0	0	111.3	P117 T118 Y124 R125 I525 L528 R529	P117-I121 VanDerWaalsContact O-CG1 3.28Å; P117-I121 WeakPolarHBondContact O-CG1 3.28Å; P117-I121 PolarHBondContact O-N 2.89Å; T118-I121 PolarHBondContact O-N 3.42Å; I121-Y124 PolarHBondContact O-N 3.32Å; I121-R125 WeakPolarHBondContact O-CG 3.43Å; I121-R125 PolarHBondContact O-N 3.44Å; I121-I525 HydrophobicContact CB-CG2 4.5Å; I121-I525 HydrophobicContact CD1-CG2 4.29Å; I121-I525 HydrophobicContact CG1-CG1 4.34Å; I121-I525 HydrophobicContact CG1-CG2 4.12Å; I121-I525 HydrophobicContact CG2-CB 4.47Å; I121-I525 HydrophobicContact CG2-CD1 4.16Å; I121-I525 HydrophobicContact CG2-CG1 4.04Å; I121-I525 HydrophobicContact CG2-CG2 3.63Å; I121-L528 HydrophobicContact CG1-CD2 3.89Å; I121-R529 HydrophobicContact CD1-CG 3.61Å
122	S	92.7	Very high	93.1	Very high	49 Å²	49	49.7 Å²	49.7	34%	0.343	24%	0.242	S	C	.	.	H	α-helix	trans	-60.9	-45.6	177	-65.8	0	0	0	0	111.7	T118 S119 V120 Y124 R125 L126 E437	T118-S122 PolarHBondContact O-N 3.49Å; T118-S122 PolarHBondContact O-OG 3.28Å; S119-S122 PolarHBondContact O-N 2.99Å; V120-S122 PolarHBondContact O-N 3.31Å; S122-Y124 PolarHBondContact O-N 2.96Å; S122-R125 PolarHBondContact O-N 3.4Å; S122-L126 PolarHBondContact O-N 2.89Å; S122-E437 VanDerWaalsContact CB-OE1 3.3Å; S122-E437 WeakPolarHBondContact CB-OE1 3.43Å
123	G	93.8	Very high	93.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-43.6	176.2	0	0	0	0	0	113.1	S119 V120 L126 A127	S119-G123 PolarHBondContact O-N 2.81Å; V120-G123 PolarHBondContact O-N 2.86Å; G123-L126 PolarHBondContact O-N 3.3Å; G123-A127 WeakPolarHBondContact O-CB 3.41Å; G123-A127 PolarHBondContact O-N 3.48Å
124	Y	95.6	Very high	93.5	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.5	-39.4	178.1	-79.3	15.7	0	0	0	112.4	L103 A107 V120 I121 S122 A127 C128 A440 F444	L103-Y124 HydrophobicContact CB-CE2 4.11Å; L103-Y124 HydrophobicContact CD2-CE2 4.06Å; L103-Y124 PolarHBondContact O-OH 3.21Å; A107-Y124 HydrophobicContact CB-CE2 4.06Å; A107-Y124 PolarHBondContact N-OH 2.87Å; V120-Y124 HydrophobicContact CG1-CD1 4.17Å; V120-Y124 HydrophobicContact CG1-CE1 3.87Å; V120-Y124 HydrophobicContact CG1-CE2 4.27Å; V120-Y124 PolarHBondContact O-N 2.97Å; I121-Y124 PolarHBondContact O-N 3.32Å; S122-Y124 PolarHBondContact O-N 2.96Å; Y124-A127 PolarHBondContact O-N 2.97Å; Y124-C128 WeakPolarHBondContact O-CB 3.32Å; Y124-C128 PolarHBondContact O-N 3.4Å; Y124-A440 HydrophobicContact CD1-CB 4.19Å; Y124-A440 HydrophobicContact CE1-CB 4.25Å; Y124-A440 VanDerWaalsContact CE1-O 3.23Å; Y124-A440 WeakPolarHBondContact CE1-O 3.33Å; Y124-F444 HydrophobicContact CD1-CB 3.99Å; Y124-F444 AromaticContact CD1-CD2 3.86Å; Y124-F444 HydrophobicContact CD1-CD2 3.86Å; Y124-F444 HydrophobicContact CD1-CG 4.41Å; Y124-F444 HydrophobicContact CD2-CD2 4.21Å; Y124-F444 HydrophobicContact CE1-CB 3.96Å; Y124-F444 HydrophobicContact CE1-CD2 4.28Å; Y124-F444 AromaticContact CG-CD2 3.82Å; Y124-F444 HydrophobicContact CG-CD2 3.82Å
125	R	95	Very high	93.6	Very high	113 Å²	113	38 Å²	38	43%	0.426	19%	0.186	S	C	.	.	H	α-helix	trans	-62.8	-42.8	174.4	-76.5	-179.1	168.2	-179.4	-5.7	112	I121 S122 K129 E522 I525	I121-R125 WeakPolarHBondContact O-CG 3.43Å; I121-R125 PolarHBondContact O-N 3.44Å; S122-R125 PolarHBondContact O-N 3.4Å; R125-K129 PolarHBondContact O-N 3.34Å; R125-E522 IonicContact NE-OE1 3.77Å; R125-E522 IonicContact NH2-OE2 2.89Å; R125-I525 HydrophobicContact CG-CD1 3.57Å
126	L	93.9	Very high	93.7	Very high	45 Å²	45	41 Å²	41	24%	0.236	20%	0.202	C	C	.	.	H	α-helix	trans	-66.2	-45.8	177.6	-174.5	60.2	0	0	0	111.2	S122 G123 C128 K129 E130 Y429 M433 I441	S122-L126 PolarHBondContact O-N 2.89Å; G123-L126 PolarHBondContact O-N 3.3Å; L126-C128 PolarHBondContact O-N 3.38Å; L126-K129 PolarHBondContact O-N 3.48Å; L126-E130 HydrophobicContact CD1-CG 4.41Å; L126-E130 WeakPolarHBondContact O-CG 3.34Å; L126-E130 PolarHBondContact O-N 3.29Å; L126-Y429 HydrophobicContact CD2-CE1 4.25Å; L126-Y429 HydrophobicContact CG-CE1 4.23Å; L126-M433 HydrophobicContact CD2-CE 3.43Å; L126-M433 VanDerWaalsContact CD2-CE 3.43Å; L126-M433 HydrophobicContact CD2-SD 3.82Å; L126-I441 HydrophobicContact CD2-CD1 4.11Å; L126-I441 HydrophobicContact CG-CD1 4.49Å
127	A	95.1	Very high	93.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-46.5	175.8	0	0	0	0	0	112	G123 Y124 K129 E130 A131 L426 I441 F444	G123-A127 WeakPolarHBondContact O-CB 3.41Å; G123-A127 PolarHBondContact O-N 3.48Å; Y124-A127 PolarHBondContact O-N 2.97Å; A127-K129 PolarHBondContact O-N 3.35Å; A127-E130 PolarHBondContact O-N 3.38Å; A127-A131 VanDerWaalsContact O-CB 3.23Å; A127-A131 WeakPolarHBondContact O-CB 3.24Å; A127-A131 PolarHBondContact O-N 2.98Å; A127-L426 HydrophobicContact CB-CD1 4.43Å; A127-L426 HydrophobicContact CB-CD2 4.33Å; A127-I441 HydrophobicContact CB-CG1 4.22Å; A127-I441 HydrophobicContact CB-CG2 4.2Å; A127-F444 HydrophobicContact CB-CB 4.06Å; A127-F444 HydrophobicContact CB-CD1 3.73Å; A127-F444 HydrophobicContact CB-CD2 4.17Å; A127-F444 HydrophobicContact CB-CE1 4.19Å; A127-F444 HydrophobicContact CB-CG 3.72Å
128	C	95.8	Very high	93.3	Very high	13 Å²	13	42.6 Å²	42.6	9%	0.088	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-44.6	176.7	177.5	0	0	0	0	111.9	Y124 L126 E130 A131 V132 F444 T521	Y124-C128 WeakPolarHBondContact O-CB 3.32Å; Y124-C128 PolarHBondContact O-N 3.4Å; L126-C128 PolarHBondContact O-N 3.38Å; C128-E130 PolarHBondContact O-N 3.31Å; C128-A131 PolarHBondContact O-N 2.85Å; C128-V132 WeakPolarHBondContact O-CG2 3.43Å; C128-V132 PolarHBondContact O-N 2.91Å; C128-F444 HydrophobicContact CB-CZ 4.43Å; C128-T521 HydrophobicContact CB-CG2 4.03Å
129	K	95.5	Very high	93	Very high	150 Å²	150	38.7 Å²	38.7	65%	0.652	19%	0.186	S	C	*	.	H	α-helix	trans	-61.4	-46.8	178.6	-173.9	-178.7	177.9	-174.5	0	111.7	R125 L126 A127 R133	R125-K129 PolarHBondContact O-N 3.34Å; L126-K129 PolarHBondContact O-N 3.48Å; A127-K129 PolarHBondContact O-N 3.35Å; K129-R133 PolarHBondContact O-N 2.83Å; K129-R133 VanDerWaalsContact O-N 3.09Å
130	E	94.8	Very high	92.8	Very high	11 Å²	11	39.3 Å²	39.3	5%	0.051	19%	0.188	C	C	.	.	H	α-helix	trans	-68.3	-37.6	179	-71.6	-63.8	123.5	0	0	112.3	L126 A127 C128 R133 Y134 Y425 L426 Y429	L126-E130 HydrophobicContact CD1-CG 4.41Å; L126-E130 WeakPolarHBondContact O-CG 3.34Å; L126-E130 PolarHBondContact O-N 3.29Å; A127-E130 PolarHBondContact O-N 3.38Å; C128-E130 PolarHBondContact O-N 3.31Å; E130-R133 VanDerWaalsContact CD-NH1 3.28Å; E130-R133 PolarHBondContact O-N 3.35Å; E130-R133 IonicContact OE1-CZ 3.69Å; E130-R133 IonicContact OE1-NH1 2.72Å; E130-R133 PolarHBondContact OE1-NH1 2.72Å; E130-R133 IonicContact OE1-NH2 4Å; E130-R133 IonicContact OE2-CZ 2.62Å; E130-R133 IonicContact OE2-NE 3.44Å; E130-R133 IonicContact OE2-NH1 2.79Å; E130-R133 PolarHBondContact OE2-NH1 3.15Å; E130-R133 IonicContact OE2-NH2 2.61Å; E130-R133 PolarHBondContact OE2-NH2 3.03Å; E130-Y134 WeakPolarHBondContact O-CB 3.21Å; E130-Y134 PolarHBondContact O-N 3.07Å; E130-Y425 HydrophobicContact CB-CE1 4.34Å; E130-Y425 PolarHBondContact OE2-OH 2.92Å; E130-L426 HydrophobicContact CB-CD2 4.17Å; E130-Y429 HydrophobicContact CG-CD1 4.33Å; E130-Y429 HydrophobicContact CG-CE1 3.77Å; E130-Y429 HydrophobicContact CG-CE2 4.25Å
131	A	95.3	Very high	92.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-47.6	174.8	0	0	0	0	0	111.8	A127 C128 R133 Y134 I135 L422 L426 L517	A127-A131 VanDerWaalsContact O-CB 3.23Å; A127-A131 WeakPolarHBondContact O-CB 3.24Å; A127-A131 PolarHBondContact O-N 2.98Å; C128-A131 PolarHBondContact O-N 2.85Å; A131-R133 VanDerWaalsContact C-N 3.31Å; A131-R133 PolarHBondContact O-N 3.27Å; A131-Y134 PolarHBondContact O-N 3.21Å; A131-I135 WeakPolarHBondContact O-CG1 3.31Å; A131-I135 PolarHBondContact O-N 3.03Å; A131-L422 HydrophobicContact CB-CD1 4.38Å; A131-L422 HydrophobicContact CB-CD2 3.82Å; A131-L426 HydrophobicContact CB-CD1 4.29Å; A131-L517 HydrophobicContact CB-CD1 4.47Å
132	V	94.8	Very high	91.9	Very high	16 Å²	16	40.6 Å²	40.6	10%	0.097	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-38.5	178	171.2	0	0	0	0	111.3	C128 N136 T514 K518	C128-V132 WeakPolarHBondContact O-CG2 3.43Å; C128-V132 PolarHBondContact O-N 2.91Å; V132-N136 PolarHBondContact O-N 2.61Å; V132-N136 PolarHBondContact O-ND2 3.01Å; V132-N136 VanDerWaalsContact O-ND2 3.08Å; V132-T514 HydrophobicContact CB-CG2 4.46Å; V132-T514 HydrophobicContact CG1-CG2 3.66Å; V132-T514 HydrophobicContact CG2-CG2 3.95Å; V132-K518 HydrophobicContact CG2-CG 4.49Å
133	R	95.1	Very high	91	Very high	103 Å²	103	39 Å²	39	39%	0.389	19%	0.191	S	C	.	.	H	α-helix	trans	-60.2	-49.4	173.9	-168.3	-177.8	76.9	-156.1	4.3	110.9	K129 E130 A131 I135 N136 E137 Y425	K129-R133 PolarHBondContact O-N 2.83Å; K129-R133 VanDerWaalsContact O-N 3.09Å; E130-R133 VanDerWaalsContact CD-NH1 3.28Å; E130-R133 PolarHBondContact O-N 3.35Å; E130-R133 IonicContact OE1-CZ 3.69Å; E130-R133 IonicContact OE1-NH1 2.72Å; E130-R133 PolarHBondContact OE1-NH1 2.72Å; E130-R133 IonicContact OE1-NH2 4Å; E130-R133 IonicContact OE2-CZ 2.62Å; E130-R133 IonicContact OE2-NE 3.44Å; E130-R133 IonicContact OE2-NH1 2.79Å; E130-R133 PolarHBondContact OE2-NH1 3.15Å; E130-R133 IonicContact OE2-NH2 2.61Å; E130-R133 PolarHBondContact OE2-NH2 3.03Å; A131-R133 VanDerWaalsContact C-N 3.31Å; A131-R133 PolarHBondContact O-N 3.27Å; R133-I135 PolarHBondContact O-N 3.12Å; R133-N136 PolarHBondContact O-N 3.04Å; R133-E137 VanDerWaalsContact CG-OE1 3.24Å; R133-E137 WeakPolarHBondContact CG-OE1 3.4Å; R133-E137 WeakPolarHBondContact O-CG 3.25Å; R133-E137 PolarHBondContact O-N 3.41Å; R133-E137 VanDerWaalsContact O-N 3.11Å; R133-Y425 PolarHBondContact NH2-OH 2.94Å; R133-Y425 VanDerWaalsContact NH2-OH 3.09Å
134	Y	93.8	Very high	89.9	Confident	17 Å²	17	45 Å²	45	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-41.6	-180	-174.7	-93.8	0	0	0	113.2	E130 A131 N136 E137 N138 L139 A421 L422 Y425 Q478	E130-Y134 WeakPolarHBondContact O-CB 3.21Å; E130-Y134 PolarHBondContact O-N 3.07Å; A131-Y134 PolarHBondContact O-N 3.21Å; Y134-N136 PolarHBondContact O-N 3.29Å; Y134-E137 PolarHBondContact O-N 2.83Å; Y134-N138 HydrophobicContact CD2-CB 4.33Å; Y134-N138 VanDerWaalsContact CD2-ND2 3.26Å; Y134-N138 WeakPolarHBondContact CD2-ND2 3.46Å; Y134-N138 HydrophobicContact CE1-CB 4.24Å; Y134-N138 HydrophobicContact CE2-CB 4.01Å; Y134-N138 VanDerWaalsContact CE2-ND2 3.25Å; Y134-N138 WeakPolarHBondContact CE2-ND2 3.34Å; Y134-N138 WeakPolarHBondContact O-CB 3.43Å; Y134-N138 PolarHBondContact O-N 2.82Å; Y134-L139 HydrophobicContact CD1-CD1 3.92Å; Y134-L139 HydrophobicContact CD1-CG 4.18Å; Y134-L139 HydrophobicContact CE1-CD1 3.8Å; Y134-L139 HydrophobicContact CE1-CD2 4.17Å; Y134-L139 HydrophobicContact CE1-CG 3.85Å; Y134-A421 HydrophobicContact CE1-CB 4.27Å; Y134-L422 HydrophobicContact CD1-CD2 3.77Å; Y134-L422 HydrophobicContact CG-CD2 4.36Å; Y134-Y425 HydrophobicContact CD1-CG 4.45Å; Y134-Y425 AromaticContact CD2-CD1 3.86Å; Y134-Y425 HydrophobicContact CD2-CD1 3.86Å; Y134-Y425 AromaticContact CD2-CD2 3.37Å; Y134-Y425 HydrophobicContact CD2-CD2 3.37Å; Y134-Y425 HydrophobicContact CD2-CE1 4.04Å; Y134-Y425 AromaticContact CD2-CE2 3.56Å; Y134-Y425 HydrophobicContact CD2-CE2 3.56Å; Y134-Y425 AromaticContact CD2-CG 3.52Å; Y134-Y425 HydrophobicContact CD2-CG 3.52Å; Y134-Y425 AromaticContact CD2-CZ 3.91Å; Y134-Y425 AromaticContact CE2-CD2 3.52Å; Y134-Y425 HydrophobicContact CE2-CD2 3.52Å; Y134-Y425 HydrophobicContact CE2-CE2 4.05Å; Y134-Y425 AromaticContact CE2-CG 3.82Å; Y134-Y425 HydrophobicContact CE2-CG 3.82Å; Y134-Y425 AromaticContact CG-CD1 3.84Å; Y134-Y425 HydrophobicContact CG-CD1 3.84Å; Y134-Y425 HydrophobicContact CG-CD2 4.18Å; Y134-Y425 HydrophobicContact CG-CE1 4.14Å; Y134-Y425 HydrophobicContact CG-CE2 4.44Å; Y134-Y425 AromaticContact CG-CG 3.87Å; Y134-Y425 HydrophobicContact CG-CG 3.87Å; Y134-Q478 PolarHBondContact OH-NE2 3.11Å
135	I	92.9	Very high	88.3	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.254	C	S	.	.	I	π-helix	trans	-55.8	-53	175.7	-69.4	168.7	0	0	0	109.9	A131 R133 E137 L139 T140 V412 V418 L422 T510 K513 L517	A131-I135 WeakPolarHBondContact O-CG1 3.31Å; A131-I135 PolarHBondContact O-N 3.03Å; R133-I135 PolarHBondContact O-N 3.12Å; I135-E137 VanDerWaalsContact C-N 3.34Å; I135-E137 PolarHBondContact O-N 2.9Å; I135-L139 HydrophobicContact CG1-CD1 4.39Å; I135-L139 PolarHBondContact O-N 3.13Å; I135-T140 PolarHBondContact O-N 3.25Å; I135-V412 HydrophobicContact CG2-CG1 4.08Å; I135-V418 HydrophobicContact CD1-CG1 4.25Å; I135-V418 HydrophobicContact CG1-CG1 4.16Å; I135-L422 HydrophobicContact CD1-CD1 3.96Å; I135-L422 HydrophobicContact CG1-CD1 4.06Å; I135-L422 HydrophobicContact CG1-CD2 4.13Å; I135-L422 HydrophobicContact CG1-CG 4.44Å; I135-T510 HydrophobicContact CG2-CG2 3.64Å; I135-K513 HydrophobicContact CD1-CB 4.44Å; I135-L517 HydrophobicContact CD1-CD1 3.55Å
136	N	90.9	Very high	86.8	Confident	82 Å²	82	47.6 Å²	47.6	44%	0.439	25%	0.245	S	C	.	.	I	π-helix	trans	-64.6	-37.4	-173.8	-70.3	-34.9	0	0	0	112.7	V132 R133 Y134 T140	V132-N136 PolarHBondContact O-N 2.61Å; V132-N136 PolarHBondContact O-ND2 3.01Å; V132-N136 VanDerWaalsContact O-ND2 3.08Å; R133-N136 PolarHBondContact O-N 3.04Å; Y134-N136 PolarHBondContact O-N 3.29Å; N136-T140 PolarHBondContact O-OG1 2.74Å
137	E	89.2	Confident	86.1	Confident	124 Å²	124	47.5 Å²	47.5	58%	0.579	26%	0.255	S	S	*	.	I	π-helix	trans	-83.2	-35.9	-176.5	-69.5	172.3	-178.5	0	0	113.4	R133 Y134 I135	R133-E137 VanDerWaalsContact CG-OE1 3.24Å; R133-E137 WeakPolarHBondContact CG-OE1 3.4Å; R133-E137 WeakPolarHBondContact O-CG 3.25Å; R133-E137 PolarHBondContact O-N 3.41Å; R133-E137 VanDerWaalsContact O-N 3.11Å; Y134-E137 PolarHBondContact O-N 2.83Å; I135-E137 VanDerWaalsContact C-N 3.34Å; I135-E137 PolarHBondContact O-N 2.9Å
138	N	85.4	Confident	85.6	Confident	44 Å²	44	53.2 Å²	53.2	24%	0.235	28%	0.276	C	S	.	.	I	π-helix	trans	-120.3	-22.9	-165.1	-67.9	-53.2	0	0	0	115.4	Y134 K487	Y134-N138 HydrophobicContact CD2-CB 4.33Å; Y134-N138 VanDerWaalsContact CD2-ND2 3.26Å; Y134-N138 WeakPolarHBondContact CD2-ND2 3.46Å; Y134-N138 HydrophobicContact CE1-CB 4.24Å; Y134-N138 HydrophobicContact CE2-CB 4.01Å; Y134-N138 VanDerWaalsContact CE2-ND2 3.25Å; Y134-N138 WeakPolarHBondContact CE2-ND2 3.34Å; Y134-N138 WeakPolarHBondContact O-CB 3.43Å; Y134-N138 PolarHBondContact O-N 2.82Å; N138-K487 WeakPolarHBondContact O-CE 3.34Å; N138-K487 PolarHBondContact O-NZ 3.27Å
139	L	85.3	Confident	85.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.304	C	S	.	.	I	π-helix	trans	-113.6	-4.5	-172	-59.6	176.5	0	0	0	113.9	Y134 I135 V418 A421 K487 W488	Y134-L139 HydrophobicContact CD1-CD1 3.92Å; Y134-L139 HydrophobicContact CD1-CG 4.18Å; Y134-L139 HydrophobicContact CE1-CD1 3.8Å; Y134-L139 HydrophobicContact CE1-CD2 4.17Å; Y134-L139 HydrophobicContact CE1-CG 3.85Å; I135-L139 HydrophobicContact CG1-CD1 4.39Å; I135-L139 PolarHBondContact O-N 3.13Å; L139-V418 HydrophobicContact CD1-CB 4.45Å; L139-V418 HydrophobicContact CD1-CG1 4.1Å; L139-V418 HydrophobicContact CD1-CG2 4.34Å; L139-A421 HydrophobicContact CD1-CB 4.02Å; L139-A421 HydrophobicContact CD2-CB 4.11Å; L139-K487 HydrophobicContact CD2-CB 4.43Å; L139-W488 WeakPolarHBondContact O-CZ3 3.46Å
140	T	87.7	Confident	84.8	Confident	47 Å²	47	52.3 Å²	52.3	29%	0.288	27%	0.273	S	S	.	.			trans	-76.9	142.3	178	49.2	0	0	0	0	112	I135 N136 V411 T510	I135-T140 PolarHBondContact O-N 3.25Å; N136-T140 PolarHBondContact O-OG1 2.74Å; T140-V411 CarbonylContact C-O 3.58Å; T140-T510 HydrophobicContact CG2-CG2 3.75Å
141	I	85.6	Confident	84.5	Confident	8 Å²	8	52.6 Å²	52.6	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.7	169.3	-55	163.3	0	0	0	107.1	L146 S410 V411 W488 R502 Y507	I141-L146 HydrophobicContact CG2-CD1 3.61Å; I141-L146 HydrophobicContact CG2-CG 4.28Å; I141-S410 WeakPolarHBondContact O-CA 3.33Å; I141-V411 HydrophobicContact CB-CG2 3.99Å; I141-V411 PolarHBondContact N-O 3.43Å; I141-V411 PolarHBondContact O-N 2.93Å; I141-W488 HydrophobicContact CD1-CE3 3.95Å; I141-W488 HydrophobicContact CD1-CH2 3.86Å; I141-W488 HydrophobicContact CD1-CZ2 4.44Å; I141-W488 HydrophobicContact CD1-CZ3 3.6Å; I141-W488 HydrophobicContact CG1-CE3 4.33Å; I141-W488 HydrophobicContact CG1-CH2 3.33Å; I141-W488 HydrophobicContact CG1-CZ2 4.06Å; I141-W488 HydrophobicContact CG1-CZ3 3.51Å; I141-R502 HydrophobicContact CD1-CG 4.13Å; I141-Y507 HydrophobicContact CD1-CD1 4.37Å; I141-Y507 HydrophobicContact CD1-CE1 3.74Å
142	G	82.5	Confident	84.4	Confident	30 Å²	30	53.5 Å²	53.5	31%	0.309	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	133.3	176.9	0	0	0	0	0	111	D144 D145	G142-D144 VanDerWaalsContact C-N 3.27Å; G142-D144 PolarHBondContact O-N 3.04Å; G142-D145 WeakPolarHBondContact O-CB 3.23Å; G142-D145 PolarHBondContact O-N 3.4Å
143	T	72.6	Confident	84.3	Confident	17 Å²	17	54.5 Å²	54.5	10%	0.104	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-68.7	-28.1	175.8	52.2	0	0	0	0	112.8	D145 L146 G147 V405 K409 V411	T143-D145 PolarHBondContact O-N 2.84Å; T143-L146 PolarHBondContact O-N 3.25Å; T143-L146 VanDerWaalsContact O-N 3.11Å; T143-G147 PolarHBondContact O-N 3.42Å; T143-G147 VanDerWaalsContact O-N 3.08Å; T143-V405 HydrophobicContact CG2-CG1 3.41Å; T143-V405 VanDerWaalsContact CG2-CG1 3.41Å; T143-K409 WeakPolarHBondContact CB-O 3.35Å; T143-K409 WeakPolarHBondContact CG2-O 3.39Å; T143-K409 PolarHBondContact N-O 3.41Å; T143-K409 WeakPolarHBondContact OG1-CA 3.27Å; T143-K409 WeakPolarHBondContact OG1-CB 3.45Å; T143-K409 PolarHBondContact OG1-O 3.42Å; T143-V411 HydrophobicContact CG2-CG1 3.99Å
144	D	71.1	Confident	84.1	Confident	124 Å²	124	49.6 Å²	49.6	66%	0.663	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-63.4	-26	177	-65	-34.1	0	0	0	111.3	G142 L146 K409	G142-D144 VanDerWaalsContact C-N 3.27Å; G142-D144 PolarHBondContact O-N 3.04Å; D144-L146 VanDerWaalsContact C-N 3.34Å; D144-K409 IonicContact OD1-NZ 2.77Å; D144-K409 IonicContact OD2-NZ 2.63Å
145	D	62.6	Low	84.1	Confident	126 Å²	126	48.8 Å²	48.8	67%	0.674	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-76.2	-19.8	177.4	-59.5	-32.7	0	0	0	113.3	G142 T143	G142-D145 WeakPolarHBondContact O-CB 3.23Å; G142-D145 PolarHBondContact O-N 3.4Å; T143-D145 PolarHBondContact O-N 2.84Å
146	L	62.8	Low	84.1	Confident	43 Å²	43	51.6 Å²	51.6	23%	0.225	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-12.6	-168.7	-68	166.6	0	0	0	113.5	I141 T143 D144 C150 V411 Y507	I141-L146 HydrophobicContact CG2-CD1 3.61Å; I141-L146 HydrophobicContact CG2-CG 4.28Å; T143-L146 PolarHBondContact O-N 3.25Å; T143-L146 VanDerWaalsContact O-N 3.11Å; D144-L146 VanDerWaalsContact C-N 3.34Å; L146-C150 HydrophobicContact CB-CB 3.51Å; L146-C150 HydrophobicContact CD1-CB 4.28Å; L146-C150 PolarHBondContact O-N 2.8Å; L146-V411 HydrophobicContact CD1-CG2 4.19Å; L146-Y507 HydrophobicContact CD1-CE1 4.41Å; L146-Y507 HydrophobicContact CD1-CE2 4.18Å
147	G	79.4	Confident	84.1	Confident	43 Å²	43	48.9 Å²	48.9	44%	0.443	26%	0.261	S	S	.	.	H	α-helix	trans	61.1	-152.4	174.7	0	0	0	0	0	114.8	T143 E149 C150	T143-G147 PolarHBondContact O-N 3.42Å; T143-G147 VanDerWaalsContact O-N 3.08Å; G147-E149 VanDerWaalsContact C-N 3.26Å; G147-E149 PolarHBondContact O-N 3.46Å; G147-C150 VanDerWaalsContact O-CB 3.26Å; G147-C150 WeakPolarHBondContact O-CB 3.39Å; G147-C150 PolarHBondContact O-N 2.85Å
148	R	85.1	Confident	84.2	Confident	120 Å²	120	43.2 Å²	43.2	45%	0.453	24%	0.235	S	C	.	.	H	α-helix	trans	-63.8	-30.4	-178.2	-176	174.7	176.7	-122.1	3.8	112.7	C150 L151 I152 V176 D177	R148-C150 PolarHBondContact O-N 2.82Å; R148-L151 WeakPolarHBondContact O-CB 3.47Å; R148-L151 PolarHBondContact O-N 3.48Å; R148-L151 VanDerWaalsContact O-N 3.09Å; R148-I152 HydrophobicContact CG-CD1 4.19Å; R148-I152 PolarHBondContact O-N 3.38Å; R148-V176 HydrophobicContact CG-CG1 4.24Å; R148-D177 IonicContact CZ-OD1 2.78Å; R148-D177 IonicContact NE-OD1 2.67Å; R148-D177 IonicContact NH2-OD1 3.31Å; R148-D177 PolarHBondContact NH2-OD1 3.28Å; R148-D177 IonicContact NH2-OD2 3.61Å; R148-D177 PolarHBondContact NH2-OD2 2.91Å
149	E	87	Confident	84.5	Confident	142 Å²	142	41.1 Å²	41.1	66%	0.664	22%	0.224	S	C	*	.	H	α-helix	trans	-62.1	-32.7	178.1	-66.4	-172.1	171.7	0	0	112	G147 L151 I152 N153	G147-E149 VanDerWaalsContact C-N 3.26Å; G147-E149 PolarHBondContact O-N 3.46Å; E149-L151 VanDerWaalsContact C-N 3.29Å; E149-L151 PolarHBondContact O-N 2.92Å; E149-I152 PolarHBondContact O-N 3.46Å; E149-N153 WeakPolarHBondContact O-CB 3.39Å; E149-N153 VanDerWaalsContact O-CG 3.24Å; E149-N153 PolarHBondContact O-N 3.34Å; E149-N153 PolarHBondContact O-ND2 2.94Å
150	C	87.2	Confident	84.6	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.014	24%	0.239	C	C	.	.	H	α-helix	trans	-56.3	-43.2	172.6	-165.4	0	0	0	0	112.7	L146 G147 R148 A154	L146-C150 HydrophobicContact CB-CB 3.51Å; L146-C150 HydrophobicContact CD1-CB 4.28Å; L146-C150 PolarHBondContact O-N 2.8Å; G147-C150 VanDerWaalsContact O-CB 3.26Å; G147-C150 WeakPolarHBondContact O-CB 3.39Å; G147-C150 PolarHBondContact O-N 2.85Å; R148-C150 PolarHBondContact O-N 2.82Å; C150-A154 VanDerWaalsContact O-CB 3.31Å; C150-A154 WeakPolarHBondContact O-CB 3.45Å; C150-A154 PolarHBondContact O-N 3.35Å
151	L	89.6	Confident	84.4	Confident	16 Å²	16	42.3 Å²	42.3	8%	0.084	23%	0.234	C	C	.	.	H	α-helix	trans	-70.1	-42.6	-177.1	-61	171.4	0	0	0	110.6	R148 E149 N153 A154 A155 V176 V402 V405 L406	R148-L151 WeakPolarHBondContact O-CB 3.47Å; R148-L151 PolarHBondContact O-N 3.48Å; R148-L151 VanDerWaalsContact O-N 3.09Å; E149-L151 VanDerWaalsContact C-N 3.29Å; E149-L151 PolarHBondContact O-N 2.92Å; L151-N153 VanDerWaalsContact C-N 3.35Å; L151-A154 PolarHBondContact O-N 3.04Å; L151-A155 WeakPolarHBondContact O-CB 3.37Å; L151-A155 PolarHBondContact O-N 2.66Å; L151-V176 HydrophobicContact CB-CG1 4.13Å; L151-V176 HydrophobicContact CB-CG2 3.74Å; L151-V176 HydrophobicContact CD1-CG1 4.17Å; L151-V402 HydrophobicContact CD2-CG1 4.41Å; L151-V405 HydrophobicContact CD2-CB 3.88Å; L151-V405 HydrophobicContact CD2-CG1 3.56Å; L151-L406 HydrophobicContact CD1-CD2 3.72Å; L151-L406 HydrophobicContact CD1-CG 4.4Å; L151-L406 HydrophobicContact CD2-CD2 3.87Å; L151-L406 HydrophobicContact CD2-CG 3.88Å; L151-L406 HydrophobicContact CG-CD2 4.46Å
152	I	92.5	Very high	84.4	Confident	19 Å²	19	42.9 Å²	42.9	10%	0.097	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-48.2	176	-68.8	166.7	0	0	0	109.4	R148 E149 A155 K156 A172 N173 V176	R148-I152 HydrophobicContact CG-CD1 4.19Å; R148-I152 PolarHBondContact O-N 3.38Å; E149-I152 PolarHBondContact O-N 3.46Å; I152-A155 WeakPolarHBondContact O-CB 3.19Å; I152-A155 PolarHBondContact O-N 2.88Å; I152-K156 HydrophobicContact CG2-CD 4.41Å; I152-K156 WeakPolarHBondContact O-CG 2.73Å; I152-K156 PolarHBondContact O-N 2.87Å; I152-A172 HydrophobicContact CG2-CB 4.08Å; I152-N173 VanDerWaalsContact CD1-OD1 3.27Å; I152-N173 WeakPolarHBondContact CD1-OD1 3.24Å; I152-V176 HydrophobicContact CG1-CG2 4.05Å
153	N	92	Very high	84.5	Confident	38 Å²	38	43.7 Å²	43.7	20%	0.203	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-41.9	179.8	-77.2	-13.9	0	0	0	112.6	E149 L151 A155 K156 T157 G505 Y507	E149-N153 WeakPolarHBondContact O-CB 3.39Å; E149-N153 VanDerWaalsContact O-CG 3.24Å; E149-N153 PolarHBondContact O-N 3.34Å; E149-N153 PolarHBondContact O-ND2 2.94Å; L151-N153 VanDerWaalsContact C-N 3.35Å; N153-A155 VanDerWaalsContact C-N 3.35Å; N153-A155 PolarHBondContact O-N 2.88Å; N153-K156 PolarHBondContact O-N 3.11Å; N153-T157 PolarHBondContact O-N 3.29Å; N153-T157 PolarHBondContact O-OG1 2.63Å; N153-T157 VanDerWaalsContact O-OG1 3.06Å; N153-G505 VanDerWaalsContact CB-O 3.31Å; N153-G505 WeakPolarHBondContact CB-O 3.29Å; N153-Y507 HydrophobicContact CB-CD2 3.9Å; N153-Y507 HydrophobicContact CB-CE2 4.33Å
154	A	91.7	Very high	85.2	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-40.2	173.8	0	0	0	0	0	112.3	C150 L151 T157 S158 V401 V405	C150-A154 VanDerWaalsContact O-CB 3.31Å; C150-A154 WeakPolarHBondContact O-CB 3.45Å; C150-A154 PolarHBondContact O-N 3.35Å; L151-A154 PolarHBondContact O-N 3.04Å; A154-T157 PolarHBondContact O-N 2.93Å; A154-S158 PolarHBondContact O-N 3.43Å; A154-V401 HydrophobicContact CB-CG1 4.18Å; A154-V405 HydrophobicContact CB-CG2 3.94Å
155	A	92.7	Very high	85.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-44.5	174.1	0	0	0	0	0	111.5	L151 I152 N153 T157 S158 M159 A172 V402	L151-A155 WeakPolarHBondContact O-CB 3.37Å; L151-A155 PolarHBondContact O-N 2.66Å; I152-A155 WeakPolarHBondContact O-CB 3.19Å; I152-A155 PolarHBondContact O-N 2.88Å; N153-A155 VanDerWaalsContact C-N 3.35Å; N153-A155 PolarHBondContact O-N 2.88Å; A155-T157 VanDerWaalsContact C-N 3.32Å; A155-T157 PolarHBondContact O-N 3.41Å; A155-S158 PolarHBondContact O-N 2.85Å; A155-M159 VanDerWaalsContact O-CG 3.31Å; A155-M159 WeakPolarHBondContact O-CG 3.43Å; A155-M159 PolarHBondContact O-N 2.8Å; A155-M159 VanDerWaalsContact O-N 3.12Å; A155-A172 HydrophobicContact CB-CB 3.92Å; A155-V402 HydrophobicContact CB-CG2 3.79Å
156	K	93.1	Very high	87	Confident	59 Å²	59	38.4 Å²	38.4	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-57.6	-43	175.6	-71.6	178.6	-169.5	-169.6	0	112.2	I152 N153 S158 M159 S160 A168 D169 A172	I152-K156 HydrophobicContact CG2-CD 4.41Å; I152-K156 WeakPolarHBondContact O-CG 2.73Å; I152-K156 PolarHBondContact O-N 2.87Å; N153-K156 PolarHBondContact O-N 3.11Å; K156-S158 VanDerWaalsContact C-N 3.34Å; K156-S158 PolarHBondContact O-N 3.33Å; K156-M159 PolarHBondContact O-N 3.47Å; K156-S160 PolarHBondContact O-N 3.42Å; K156-A168 HydrophobicContact CB-CB 4.5Å; K156-A168 HydrophobicContact CG-CB 4.23Å; K156-D169 WeakPolarHBondContact CD-OD1 3.45Å; K156-D169 WeakPolarHBondContact CE-OD1 3.25Å; K156-D169 IonicContact NZ-OD1 3.4Å; K156-D169 PolarHBondContact NZ-OD1 2.99Å; K156-A172 HydrophobicContact CG-CB 3.76Å
157	T	91.9	Very high	88.2	Confident	24 Å²	24	37.6 Å²	37.6	15%	0.147	21%	0.211	C	C	.	.	H	α-helix	trans	-57.3	-47.4	176.9	-51.8	0	0	0	0	111.3	N153 A154 A155 M159 S160 V506 Y507 E508	N153-T157 PolarHBondContact O-N 3.29Å; N153-T157 PolarHBondContact O-OG1 2.63Å; N153-T157 VanDerWaalsContact O-OG1 3.06Å; A154-T157 PolarHBondContact O-N 2.93Å; A155-T157 VanDerWaalsContact C-N 3.32Å; A155-T157 PolarHBondContact O-N 3.41Å; T157-M159 VanDerWaalsContact C-N 3.27Å; T157-M159 PolarHBondContact O-N 2.88Å; T157-S160 WeakPolarHBondContact O-CB 3.38Å; T157-S160 PolarHBondContact O-N 3.2Å; T157-S160 PolarHBondContact O-OG 3.38Å; T157-V506 HydrophobicContact CG2-CG1 3.87Å; T157-Y507 VanDerWaalsContact CB-O 3.28Å; T157-Y507 WeakPolarHBondContact CB-O 3.2Å; T157-Y507 PolarHBondContact OG1-N 2.97Å; T157-Y507 VanDerWaalsContact OG1-N 3.15Å; T157-Y507 PolarHBondContact OG1-O 3.35Å; T157-E508 HydrophobicContact CG2-CG 4.12Å
158	S	91.4	Very high	88.7	Confident	5 Å²	5	36.1 Å²	36.1	4%	0.035	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-28.6	-179.3	-171.2	0	0	0	0	113.6	A154 A155 K156 K162	A154-S158 PolarHBondContact O-N 3.43Å; A155-S158 PolarHBondContact O-N 2.85Å; K156-S158 VanDerWaalsContact C-N 3.34Å; K156-S158 PolarHBondContact O-N 3.33Å; S158-K162 WeakPolarHBondContact O-CE 3.05Å; S158-K162 PolarHBondContact O-NZ 2.93Å
159	M	90.6	Very high	89	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-83.6	-16	177.9	-66.4	-177	-174.6	0	0	113.4	A155 K156 T157 S161 K162 I164 G165 A168 F171 V175 A398	A155-M159 VanDerWaalsContact O-CG 3.31Å; A155-M159 WeakPolarHBondContact O-CG 3.43Å; A155-M159 PolarHBondContact O-N 2.8Å; A155-M159 VanDerWaalsContact O-N 3.12Å; K156-M159 PolarHBondContact O-N 3.47Å; T157-M159 VanDerWaalsContact C-N 3.27Å; T157-M159 PolarHBondContact O-N 2.88Å; M159-S161 VanDerWaalsContact C-N 3.28Å; M159-S161 PolarHBondContact O-N 2.9Å; M159-K162 PolarHBondContact O-N 2.99Å; M159-I164 HydrophobicContact CB-CD1 4.26Å; M159-I164 HydrophobicContact CB-CG1 4.05Å; M159-I164 HydrophobicContact CE-CD1 4.02Å; M159-I164 HydrophobicContact CG-CD1 3.62Å; M159-I164 HydrophobicContact CG-CG1 3.98Å; M159-I164 HydrophobicContact SD-CD1 3.65Å; M159-I164 HydrophobicContact SD-CG1 4.2Å; M159-G165 VanDerWaalsContact O-CA 3.27Å; M159-G165 WeakPolarHBondContact O-CA 3.28Å; M159-G165 PolarHBondContact O-N 2.87Å; M159-A168 HydrophobicContact CB-CB 4.28Å; M159-F171 HydrophobicContact CE-CB 3.81Å; M159-F171 HydrophobicContact SD-CB 3.66Å; M159-V175 HydrophobicContact CE-CB 4.24Å; M159-V175 HydrophobicContact CE-CG2 3.52Å; M159-A398 HydrophobicContact CE-CB 3.33Å; M159-A398 HydrophobicContact CG-CB 4.02Å
160	S	87.3	Confident	89.3	Confident	46 Å²	46	32.2 Å²	32.2	32%	0.322	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.2	-168.3	68	0	0	0	0	114.4	P41 K156 T157 K162	P41-S160 WeakPolarHBondContact CA-O 3.44Å; K156-S160 PolarHBondContact O-N 3.42Å; T157-S160 WeakPolarHBondContact O-CB 3.38Å; T157-S160 PolarHBondContact O-N 3.2Å; T157-S160 PolarHBondContact O-OG 3.38Å; S160-K162 VanDerWaalsContact C-N 3.33Å
161	S	83.7	Confident	89.6	Confident	27 Å²	27	32.1 Å²	32.1	19%	0.189	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	7.6	177.7	66.5	0	0	0	0	114.2	G40 N59 M159	G40-S161 VanDerWaalsContact C-CB 3.5Å; G40-S161 WeakPolarHBondContact O-CA 3.31Å; G40-S161 WeakPolarHBondContact O-CB 3.43Å; N59-S161 PolarHBondContact ND2-O 3.18Å; N59-S161 PolarHBondContact OD1-O 2.93Å; M159-S161 VanDerWaalsContact C-N 3.28Å; M159-S161 PolarHBondContact O-N 2.9Å
162	K	85.7	Confident	89.8	Confident	19 Å²	19	31.4 Å²	31.4	8%	0.083	18%	0.178	C	C	.	.	S	Bend	trans	-124.4	168.5	-166.8	-55.8	-176.5	-179.1	151	0	111.7	S158 M159 S160 I164 G165 S394 D397	S158-K162 WeakPolarHBondContact O-CE 3.05Å; S158-K162 PolarHBondContact O-NZ 2.93Å; M159-K162 PolarHBondContact O-N 2.99Å; S160-K162 VanDerWaalsContact C-N 3.33Å; K162-I164 HydrophobicContact CB-CG1 4.44Å; K162-I164 PolarHBondContact O-N 2.95Å; K162-I164 VanDerWaalsContact O-N 3.1Å; K162-G165 PolarHBondContact O-N 2.92Å; K162-S394 WeakPolarHBondContact CB-OG 3.37Å; K162-S394 VanDerWaalsContact CD-CB 3.49Å; K162-S394 WeakPolarHBondContact CD-OG 3.47Å; K162-D397 VanDerWaalsContact CE-OD2 3.3Å; K162-D397 WeakPolarHBondContact CE-OD2 3.5Å; K162-D397 VanDerWaalsContact NZ-CG 3.3Å; K162-D397 IonicContact NZ-OD2 2.93Å; K162-D397 PolarHBondContact NZ-OD2 3.24Å
163	I	84.8	Confident	89.8	Confident	48 Å²	48	33.5 Å²	33.5	25%	0.246	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-58.1	-29.1	-177.1	-157.7	161.9	0	0	0	113.7	G165 M387 E390 M391	I163-G165 VanDerWaalsContact C-N 3.28Å; I163-G165 PolarHBondContact O-N 2.91Å; I163-M387 HydrophobicContact CD1-CB 4.39Å; I163-M387 HydrophobicContact CD1-CE 3.56Å; I163-M387 HydrophobicContact CD1-CG 4.02Å; I163-M387 HydrophobicContact CG1-CE 4Å; I163-E390 HydrophobicContact CB-CG 4.4Å; I163-E390 HydrophobicContact CG2-CB 4.26Å; I163-E390 HydrophobicContact CG2-CG 3.97Å; I163-M391 HydrophobicContact CG2-CG 3.81Å
164	I	87	Confident	89.9	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-82.2	-0.6	177.1	60.4	175.2	0	0	0	113.8	M159 K162 V166 D167 A168 F171 M391 S394	M159-I164 HydrophobicContact CB-CD1 4.26Å; M159-I164 HydrophobicContact CB-CG1 4.05Å; M159-I164 HydrophobicContact CE-CD1 4.02Å; M159-I164 HydrophobicContact CG-CD1 3.62Å; M159-I164 HydrophobicContact CG-CG1 3.98Å; M159-I164 HydrophobicContact SD-CD1 3.65Å; M159-I164 HydrophobicContact SD-CG1 4.2Å; K162-I164 HydrophobicContact CB-CG1 4.44Å; K162-I164 PolarHBondContact O-N 2.95Å; K162-I164 VanDerWaalsContact O-N 3.1Å; I164-V166 VanDerWaalsContact C-N 3.27Å; I164-V166 PolarHBondContact O-N 3.24Å; I164-D167 CarbonylContact O-C 3.6Å; I164-D167 PolarHBondContact O-N 3.44Å; I164-A168 PolarHBondContact O-N 3.19Å; I164-A168 VanDerWaalsContact O-N 3.13Å; I164-F171 HydrophobicContact CB-CD2 3.93Å; I164-F171 HydrophobicContact CB-CE2 4.21Å; I164-F171 HydrophobicContact CG2-CD2 4.22Å; I164-F171 HydrophobicContact CG2-CE2 4.08Å; I164-F171 HydrophobicContact CG2-CZ 4.47Å; I164-M391 HydrophobicContact CG2-CB 4.05Å; I164-M391 HydrophobicContact CG2-CE 4.01Å; I164-M391 HydrophobicContact CG2-CG 3.59Å; I164-S394 VanDerWaalsContact CD1-CB 3.4Å
165	G	83.9	Confident	90	Very high	24 Å²	24	32.2 Å²	32.2	25%	0.247	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-61.4	-30.9	-177.6	0	0	0	0	0	114	M159 K162 I163 D167 A168	M159-G165 VanDerWaalsContact O-CA 3.27Å; M159-G165 WeakPolarHBondContact O-CA 3.28Å; M159-G165 PolarHBondContact O-N 2.87Å; K162-G165 PolarHBondContact O-N 2.92Å; I163-G165 VanDerWaalsContact C-N 3.28Å; I163-G165 PolarHBondContact O-N 2.91Å; G165-D167 VanDerWaalsContact C-N 3.3Å; G165-D167 PolarHBondContact O-N 2.89Å; G165-A168 WeakPolarHBondContact O-CB 3.45Å; G165-A168 PolarHBondContact O-N 3.05Å
166	V	86.9	Confident	90	Very high	131 Å²	131	32.2 Å²	32.2	79%	0.794	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-63.3	-38	178.3	-178.2	0	0	0	0	111.6	I164	I164-V166 VanDerWaalsContact C-N 3.27Å; I164-V166 PolarHBondContact O-N 3.24Å
167	D	89.5	Confident	89.9	Confident	26 Å²	26	32.4 Å²	32.4	14%	0.139	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-111.3	30.5	-179.1	-70.1	-34.8	0	0	0	111.7	I164 G165 D169 F170 F171 K209	I164-D167 CarbonylContact O-C 3.6Å; I164-D167 PolarHBondContact O-N 3.44Å; G165-D167 VanDerWaalsContact C-N 3.3Å; G165-D167 PolarHBondContact O-N 2.89Å; D167-D169 PolarHBondContact O-N 2.87Å; D167-D169 VanDerWaalsContact O-N 3.13Å; D167-F170 WeakPolarHBondContact O-CB 2.83Å; D167-F170 PolarHBondContact O-N 3.3Å; D167-F171 HydrophobicContact CB-CD2 4.19Å; D167-F171 HydrophobicContact CB-CE2 4.12Å; D167-F171 WeakPolarHBondContact O-CD2 3.44Å; D167-F171 PolarHBondContact O-N 3.02Å; D167-K209 WeakPolarHBondContact OD1-CE 3.45Å; D167-K209 IonicContact OD1-NZ 3.8Å; D167-K209 PolarHBondContact OD1-NZ 3.43Å; D167-K209 WeakPolarHBondContact OD2-CE 3.32Å; D167-K209 WeakPolarHBondContact OD2-CG 3.36Å
168	A	88.8	Confident	89.9	Confident	11 Å²	11	31.2 Å²	31.2	9%	0.091	18%	0.179	C	C	.	.	H	α-helix	trans	-56.9	-32.8	-175.4	0	0	0	0	0	112.9	K156 M159 I164 G165 F170 A172	K156-A168 HydrophobicContact CB-CB 4.5Å; K156-A168 HydrophobicContact CG-CB 4.23Å; M159-A168 HydrophobicContact CB-CB 4.28Å; I164-A168 PolarHBondContact O-N 3.19Å; I164-A168 VanDerWaalsContact O-N 3.13Å; G165-A168 WeakPolarHBondContact O-CB 3.45Å; G165-A168 PolarHBondContact O-N 3.05Å; A168-F170 VanDerWaalsContact C-N 3.31Å; A168-F170 PolarHBondContact O-N 3.29Å; A168-A172 WeakPolarHBondContact O-CA 3.34Å; A168-A172 WeakPolarHBondContact O-CB 3.5Å; A168-A172 PolarHBondContact O-N 2.99Å
169	D	91.6	Very high	89.8	Confident	99 Å²	99	31.1 Å²	31.1	53%	0.529	18%	0.179	S	C	.	.	H	α-helix	trans	-61.2	-39.9	177.1	-69.5	-12	0	0	0	112.6	K156 D167 N173	K156-D169 WeakPolarHBondContact CD-OD1 3.45Å; K156-D169 WeakPolarHBondContact CE-OD1 3.25Å; K156-D169 IonicContact NZ-OD1 3.4Å; K156-D169 PolarHBondContact NZ-OD1 2.99Å; D167-D169 PolarHBondContact O-N 2.87Å; D167-D169 VanDerWaalsContact O-N 3.13Å; D169-N173 PolarHBondContact O-ND2 3.13Å
170	F	93.3	Very high	89.7	Confident	82 Å²	82	34.6 Å²	34.6	36%	0.36	20%	0.197	S	C	.	.	H	α-helix	trans	-71.2	-50.7	179.9	178.6	-106.2	0	0	0	110.9	D167 A168 M174 K209 S211	D167-F170 WeakPolarHBondContact O-CB 2.83Å; D167-F170 PolarHBondContact O-N 3.3Å; A168-F170 VanDerWaalsContact C-N 3.31Å; A168-F170 PolarHBondContact O-N 3.29Å; F170-M174 HydrophobicContact CD1-CE 4.29Å; F170-M174 HydrophobicContact CE1-CE 3.52Å; F170-M174 HydrophobicContact CZ-CE 3.75Å; F170-M174 PolarHBondContact O-N 2.98Å; F170-K209 VanDerWaalsContact CZ-O 3.25Å; F170-K209 WeakPolarHBondContact CZ-O 3.1Å; F170-S211 VanDerWaalsContact CE1-O 3.32Å; F170-S211 WeakPolarHBondContact CE1-O 3.42Å; F170-S211 WeakPolarHBondContact CZ-O 3.49Å
171	F	93.7	Very high	89.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.7	-33.9	-179	-71.8	-70.6	0	0	0	113	M159 I164 D167 N173 M174 V175 Q208 L380 M391 L395	M159-F171 HydrophobicContact CE-CB 3.81Å; M159-F171 HydrophobicContact SD-CB 3.66Å; I164-F171 HydrophobicContact CB-CD2 3.93Å; I164-F171 HydrophobicContact CB-CE2 4.21Å; I164-F171 HydrophobicContact CG2-CD2 4.22Å; I164-F171 HydrophobicContact CG2-CE2 4.08Å; I164-F171 HydrophobicContact CG2-CZ 4.47Å; D167-F171 HydrophobicContact CB-CD2 4.19Å; D167-F171 HydrophobicContact CB-CE2 4.12Å; D167-F171 WeakPolarHBondContact O-CD2 3.44Å; D167-F171 PolarHBondContact O-N 3.02Å; F171-N173 PolarHBondContact O-N 2.77Å; F171-M174 HydrophobicContact CD1-SD 4.42Å; F171-M174 WeakPolarHBondContact O-CB 3.01Å; F171-M174 PolarHBondContact O-N 2.66Å; F171-V175 WeakPolarHBondContact O-CB 3.28Å; F171-V175 VanDerWaalsContact O-CG2 3.31Å; F171-V175 WeakPolarHBondContact O-CG2 3.23Å; F171-V175 PolarHBondContact O-N 3.16Å; F171-Q208 HydrophobicContact CE2-CB 4.44Å; F171-Q208 HydrophobicContact CZ-CB 4.3Å; F171-L380 HydrophobicContact CE1-CD2 3.96Å; F171-M391 HydrophobicContact CE1-CE 4Å; F171-M391 HydrophobicContact CE2-CE 4.15Å; F171-M391 HydrophobicContact CZ-CE 3.4Å; F171-L395 HydrophobicContact CD1-CD1 4.36Å
172	A	93.6	Very high	89.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.3	-43.4	178.1	0	0	0	0	0	112	I152 A155 K156 A168 M174 V175 V176	I152-A172 HydrophobicContact CG2-CB 4.08Å; A155-A172 HydrophobicContact CB-CB 3.92Å; K156-A172 HydrophobicContact CG-CB 3.76Å; A168-A172 WeakPolarHBondContact O-CA 3.34Å; A168-A172 WeakPolarHBondContact O-CB 3.5Å; A168-A172 PolarHBondContact O-N 2.99Å; A172-M174 VanDerWaalsContact C-N 3.34Å; A172-M174 PolarHBondContact O-N 2.86Å; A172-V175 PolarHBondContact O-N 2.92Å; A172-V176 VanDerWaalsContact O-CG2 3.26Å; A172-V176 WeakPolarHBondContact O-CG2 3.31Å; A172-V176 PolarHBondContact O-N 3.1Å
173	N	93.4	Very high	89.8	Confident	63 Å²	63	36.9 Å²	36.9	34%	0.337	20%	0.201	S	C	.	.	H	α-helix	trans	-61.2	-45.6	174.8	-75.9	-56.7	0	0	0	111.2	I152 D169 F171 V175 V176 D177	I152-N173 VanDerWaalsContact CD1-OD1 3.27Å; I152-N173 WeakPolarHBondContact CD1-OD1 3.24Å; D169-N173 PolarHBondContact O-ND2 3.13Å; F171-N173 PolarHBondContact O-N 2.77Å; N173-V175 PolarHBondContact O-N 3.03Å; N173-V176 PolarHBondContact O-N 3.2Å; N173-D177 WeakPolarHBondContact O-CB 3.44Å; N173-D177 VanDerWaalsContact O-CG 3.31Å; N173-D177 PolarHBondContact O-N 3.17Å
174	M	93.2	Very high	89.7	Confident	12 Å²	12	37.9 Å²	37.9	6%	0.059	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-45.1	178.1	-174.3	-179.2	-60.3	0	0	112.8	F170 F171 A172 D177 A178 S211 L213 I378	F170-M174 HydrophobicContact CD1-CE 4.29Å; F170-M174 HydrophobicContact CE1-CE 3.52Å; F170-M174 HydrophobicContact CZ-CE 3.75Å; F170-M174 PolarHBondContact O-N 2.98Å; F171-M174 HydrophobicContact CD1-SD 4.42Å; F171-M174 WeakPolarHBondContact O-CB 3.01Å; F171-M174 PolarHBondContact O-N 2.66Å; A172-M174 VanDerWaalsContact C-N 3.34Å; A172-M174 PolarHBondContact O-N 2.86Å; M174-D177 PolarHBondContact O-N 2.81Å; M174-A178 VanDerWaalsContact O-CB 3.3Å; M174-A178 WeakPolarHBondContact O-CB 3.49Å; M174-A178 PolarHBondContact O-N 3.5Å; M174-S211 WeakPolarHBondContact CE-O 3.36Å; M174-L213 HydrophobicContact CG-CB 4.06Å; M174-L213 HydrophobicContact CG-CD1 4.41Å; M174-I378 HydrophobicContact CG-CD1 4.02Å; M174-I378 HydrophobicContact CG-CG1 4.12Å; M174-I378 HydrophobicContact SD-CB 4.38Å; M174-I378 HydrophobicContact SD-CD1 4.29Å; M174-I378 HydrophobicContact SD-CG1 4.1Å; M174-I378 HydrophobicContact SD-CG2 3.48Å; M174-I378 WeakPolarHBondContact SD-CG2 3.45Å
175	V	93.6	Very high	89.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.1	-43.9	178.6	165.8	0	0	0	0	111.2	M159 F171 A172 N173 A178 A179 L395 A398 L399 V402	M159-V175 HydrophobicContact CE-CB 4.24Å; M159-V175 HydrophobicContact CE-CG2 3.52Å; F171-V175 WeakPolarHBondContact O-CB 3.28Å; F171-V175 VanDerWaalsContact O-CG2 3.31Å; F171-V175 WeakPolarHBondContact O-CG2 3.23Å; F171-V175 PolarHBondContact O-N 3.16Å; A172-V175 PolarHBondContact O-N 2.92Å; N173-V175 PolarHBondContact O-N 3.03Å; V175-A178 PolarHBondContact O-N 3.4Å; V175-A179 VanDerWaalsContact O-CB 3.27Å; V175-A179 WeakPolarHBondContact O-CB 3.43Å; V175-A179 PolarHBondContact O-N 3.09Å; V175-L395 HydrophobicContact CG2-CD1 3.29Å; V175-L395 HydrophobicContact CG2-CG 4.06Å; V175-A398 HydrophobicContact CG1-CB 4.18Å; V175-A398 HydrophobicContact CG2-CB 4.3Å; V175-L399 HydrophobicContact CB-CD2 4.4Å; V175-L399 HydrophobicContact CG1-CD2 3.77Å; V175-L399 HydrophobicContact CG1-CG 3.96Å; V175-L399 HydrophobicContact CG2-CG 4.41Å; V175-V402 HydrophobicContact CG1-CB 4.4Å; V175-V402 HydrophobicContact CG1-CG2 3.9Å
176	V	92.5	Very high	89.2	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-44	179.1	171.7	0	0	0	0	110.8	R148 L151 I152 A172 N173 A179 I180 V402	R148-V176 HydrophobicContact CG-CG1 4.24Å; L151-V176 HydrophobicContact CB-CG1 4.13Å; L151-V176 HydrophobicContact CB-CG2 3.74Å; L151-V176 HydrophobicContact CD1-CG1 4.17Å; I152-V176 HydrophobicContact CG1-CG2 4.05Å; A172-V176 VanDerWaalsContact O-CG2 3.26Å; A172-V176 WeakPolarHBondContact O-CG2 3.31Å; A172-V176 PolarHBondContact O-N 3.1Å; N173-V176 PolarHBondContact O-N 3.2Å; V176-A179 PolarHBondContact O-N 3.09Å; V176-I180 HydrophobicContact CG1-CD1 3.69Å; V176-I180 HydrophobicContact CG1-CG1 4.46Å; V176-I180 WeakPolarHBondContact O-CB 3.47Å; V176-I180 VanDerWaalsContact O-CG1 3.27Å; V176-I180 WeakPolarHBondContact O-CG1 3.22Å; V176-I180 PolarHBondContact O-N 2.79Å; V176-V402 HydrophobicContact CG2-CG1 4.45Å; V176-V402 HydrophobicContact CG2-CG2 4.22Å
177	D	91.5	Very high	88.4	Confident	62 Å²	62	40.7 Å²	40.7	33%	0.332	23%	0.231	S	C	.	.	H	α-helix	trans	-65.7	-41.9	178.5	-69.3	-18	0	0	0	111.6	R148 N173 M174 I180 A181 L213	R148-D177 IonicContact CZ-OD1 2.78Å; R148-D177 IonicContact NE-OD1 2.67Å; R148-D177 IonicContact NH2-OD1 3.31Å; R148-D177 PolarHBondContact NH2-OD1 3.28Å; R148-D177 IonicContact NH2-OD2 3.61Å; R148-D177 PolarHBondContact NH2-OD2 2.91Å; N173-D177 WeakPolarHBondContact O-CB 3.44Å; N173-D177 VanDerWaalsContact O-CG 3.31Å; N173-D177 PolarHBondContact O-N 3.17Å; M174-D177 PolarHBondContact O-N 2.81Å; D177-I180 PolarHBondContact O-N 2.72Å; D177-A181 VanDerWaalsContact O-CB 3.28Å; D177-A181 WeakPolarHBondContact O-CB 3.48Å; D177-A181 PolarHBondContact O-N 3.46Å; D177-L213 HydrophobicContact CB-CD2 3.68Å
178	A	91.6	Very high	87.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-43	174.5	0	0	0	0	0	112.5	M174 V175 A181 V182 V198 L213 A376 I378 L399	M174-A178 VanDerWaalsContact O-CB 3.3Å; M174-A178 WeakPolarHBondContact O-CB 3.49Å; M174-A178 PolarHBondContact O-N 3.5Å; V175-A178 PolarHBondContact O-N 3.4Å; A178-A181 PolarHBondContact O-N 2.72Å; A178-V182 PolarHBondContact O-N 2.62Å; A178-V198 HydrophobicContact CB-CG1 4.37Å; A178-V198 HydrophobicContact CB-CG2 4.5Å; A178-L213 HydrophobicContact CB-CD1 3.85Å; A178-A376 HydrophobicContact CB-CB 3.83Å; A178-I378 HydrophobicContact CB-CD1 3.81Å; A178-I378 HydrophobicContact CB-CG1 4.36Å; A178-L399 HydrophobicContact CB-CD2 4.35Å
179	A	90.2	Very high	87.3	Confident	3 Å²	3	50.7 Å²	50.7	3%	0.025	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-42.6	179.2	0	0	0	0	0	112	V175 V176 A181 V182 Y193 L399 V402 L406	V175-A179 VanDerWaalsContact O-CB 3.27Å; V175-A179 WeakPolarHBondContact O-CB 3.43Å; V175-A179 PolarHBondContact O-N 3.09Å; V176-A179 PolarHBondContact O-N 3.09Å; A179-A181 VanDerWaalsContact C-N 3.35Å; A179-V182 VanDerWaalsContact O-CG2 3.28Å; A179-V182 WeakPolarHBondContact O-CG2 3.37Å; A179-V182 PolarHBondContact O-N 3.12Å; A179-Y193 WeakPolarHBondContact O-CD1 3.22Å; A179-L399 HydrophobicContact CB-CD2 4.38Å; A179-V402 HydrophobicContact CB-CG1 3.68Å; A179-L406 HydrophobicContact CB-CD1 4.38Å
180	I	88.7	Confident	86.8	Confident	73 Å²	73	50 Å²	50	37%	0.374	29%	0.287	S	S	.	.	H	α-helix	trans	-66.6	-39.3	176.9	-67.8	168.2	0	0	0	110.5	V176 D177 V182 K183	V176-I180 HydrophobicContact CG1-CD1 3.69Å; V176-I180 HydrophobicContact CG1-CG1 4.46Å; V176-I180 WeakPolarHBondContact O-CB 3.47Å; V176-I180 VanDerWaalsContact O-CG1 3.27Å; V176-I180 WeakPolarHBondContact O-CG1 3.22Å; V176-I180 PolarHBondContact O-N 2.79Å; D177-I180 PolarHBondContact O-N 2.72Å; I180-V182 VanDerWaalsContact C-N 3.29Å; I180-V182 PolarHBondContact O-N 3.14Å; I180-K183 WeakPolarHBondContact O-CB 3.31Å; I180-K183 PolarHBondContact O-N 2.79Å
181	A	86.4	Confident	86.2	Confident	18 Å²	18	47.6 Å²	47.6	15%	0.149	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-36	179	0	0	0	0	0	112.5	D177 A178 A179 K183 T374 A376	D177-A181 VanDerWaalsContact O-CB 3.28Å; D177-A181 WeakPolarHBondContact O-CB 3.48Å; D177-A181 PolarHBondContact O-N 3.46Å; A178-A181 PolarHBondContact O-N 2.72Å; A179-A181 VanDerWaalsContact C-N 3.35Å; A181-K183 VanDerWaalsContact C-N 3.26Å; A181-K183 PolarHBondContact O-N 3.35Å; A181-T374 CarbonylContact O-C 3.54Å; A181-T374 WeakPolarHBondContact O-CB 3.49Å; A181-T374 PolarHBondContact O-OG1 3.23Å; A181-A376 HydrophobicContact CB-CB 3.95Å
182	V	85.6	Confident	85.8	Confident	10 Å²	10	52.3 Å²	52.3	6%	0.061	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	7.6	-179.7	-63	0	0	0	0	114.5	A178 A179 I180 F184 P194 V198	A178-V182 PolarHBondContact O-N 2.62Å; A179-V182 VanDerWaalsContact O-CG2 3.28Å; A179-V182 WeakPolarHBondContact O-CG2 3.37Å; A179-V182 PolarHBondContact O-N 3.12Å; I180-V182 VanDerWaalsContact C-N 3.29Å; I180-V182 PolarHBondContact O-N 3.14Å; V182-F184 PolarHBondContact O-N 2.93Å; V182-P194 VanDerWaalsContact O-CD 3.31Å; V182-P194 WeakPolarHBondContact O-CD 3.38Å; V182-V198 HydrophobicContact CB-CG2 4.45Å; V182-V198 HydrophobicContact CG1-CG2 3.6Å; V182-V198 HydrophobicContact CG2-CG2 4.05Å
183	K	86	Confident	85.5	Confident	111 Å²	111	53.3 Å²	53.3	48%	0.483	31%	0.308	S	S	.	.			trans	-52.4	123.7	-179.7	-177.5	177.6	177.3	-178.7	0	111.4	I180 A181 Y193	I180-K183 WeakPolarHBondContact O-CB 3.31Å; I180-K183 PolarHBondContact O-N 2.79Å; A181-K183 VanDerWaalsContact C-N 3.26Å; A181-K183 PolarHBondContact O-N 3.35Å; K183-Y193 HydrophobicContact CB-CD1 3.99Å; K183-Y193 HydrophobicContact CB-CE1 3.62Å; K183-Y193 HydrophobicContact CD-CE1 4.01Å; K183-Y193 HydrophobicContact CG-CD1 4.29Å; K183-Y193 HydrophobicContact CG-CE1 3.61Å
184	F	82.6	Confident	85	Confident	69 Å²	69	52.5 Å²	52.5	30%	0.303	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.1	175.4	175.1	-113.8	0	0	0	110.1	V182 K192 R373	V182-F184 PolarHBondContact O-N 2.93Å; F184-K192 PolarHBondContact N-O 3.37Å; F184-K192 PolarHBondContact O-N 3.13Å; F184-R373 VanDerWaalsContact CD2-CZ 3.43Å; F184-R373 VanDerWaalsContact CE2-CZ 3.41Å; F184-R373 VanDerWaalsContact CE2-NH1 3.35Å
185	V	81.6	Confident	84.6	Confident	79 Å²	79	52.3 Å²	52.3	48%	0.479	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.8	173.2	-175.2	0	0	0	0	108
186	D	78	Confident	84.1	Confident	53 Å²	53	57.9 Å²	57.9	28%	0.283	33%	0.334	S	S	.	.			trans	-66.2	161.5	175.7	-155.5	-9.3	0	0	0	110.3	K188 G189 V190 K192	D186-K188 PolarHBondContact O-N 3.42Å; D186-G189 PolarHBondContact O-N 3.22Å; D186-V190 PolarHBondContact N-O 3.41Å; D186-K192 IonicContact OD2-NZ 3.66Å; D186-K192 PolarHBondContact OD2-NZ 2.89Å
187	G	71.8	Confident	83.7	Confident	83 Å²	83	59.9 Å²	59.9	86%	0.856	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.9	179.4	0	0	0	0	0	114.2
188	K	77.9	Confident	83.6	Confident	188 Å²	188	57.5 Å²	57.5	82%	0.817	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	6.2	174.7	-61	-176	179.1	-176.4	0	114	D186 V190	D186-K188 PolarHBondContact O-N 3.42Å; K188-V190 VanDerWaalsContact C-N 3.27Å; K188-V190 PolarHBondContact O-N 3.29Å
189	G	77.1	Confident	83.6	Confident	59 Å²	59	58.1 Å²	58.1	61%	0.608	34%	0.34	S	S	*	.	S	Bend	trans	78.3	1.5	-179.2	0	0	0	0	0	115.3	D186	D186-G189 PolarHBondContact O-N 3.22Å
190	V	80.6	Confident	83.7	Confident	84 Å²	84	59.2 Å²	59.2	51%	0.509	35%	0.346	S	S	.	.			trans	-82.6	121.3	177.1	-178	0	0	0	0	109.5	D186 K188 K192	D186-V190 PolarHBondContact N-O 3.41Å; K188-V190 VanDerWaalsContact C-N 3.27Å; K188-V190 PolarHBondContact O-N 3.29Å; V190-K192 PolarHBondContact O-N 2.93Å
191	A	81.5	Confident	83.9	Confident	33 Å²	33	56.7 Å²	56.7	27%	0.273	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.3	173	0	0	0	0	0	110.2	Y193	A191-Y193 HydrophobicContact CB-CE2 4.28Å
192	K	84	Confident	84.2	Confident	98 Å²	98	59.5 Å²	59.5	43%	0.426	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.2	173.3	-72	178	176.8	164.2	0	109.4	F184 D186 V190 P194	F184-K192 PolarHBondContact N-O 3.37Å; F184-K192 PolarHBondContact O-N 3.13Å; D186-K192 IonicContact OD2-NZ 3.66Å; D186-K192 PolarHBondContact OD2-NZ 2.89Å; V190-K192 PolarHBondContact O-N 2.93Å; K192-P194 WeakPolarHBondContact O-CD 3.47Å
193	Y	86.8	Confident	84.4	Confident	22 Å²	22	59.1 Å²	59.1	9%	0.086	34%	0.34	C	S	.	.			trans	-118.1	93.3	-179.7	-57.5	-91.1	0	0	0	108.9	A179 K183 A191 I195 K403 L406 E407	A179-Y193 WeakPolarHBondContact O-CD1 3.22Å; K183-Y193 HydrophobicContact CB-CD1 3.99Å; K183-Y193 HydrophobicContact CB-CE1 3.62Å; K183-Y193 HydrophobicContact CD-CE1 4.01Å; K183-Y193 HydrophobicContact CG-CD1 4.29Å; K183-Y193 HydrophobicContact CG-CE1 3.61Å; A191-Y193 HydrophobicContact CB-CE2 4.28Å; Y193-I195 PolarHBondContact O-N 3.14Å; Y193-K403 VanDerWaalsContact O-CD 3.32Å; Y193-K403 WeakPolarHBondContact O-CD 3.26Å; Y193-K403 WeakPolarHBondContact O-CE 3.27Å; Y193-L406 HydrophobicContact CD1-CD1 3.89Å; Y193-L406 HydrophobicContact CD2-CB 3.82Å; Y193-L406 HydrophobicContact CD2-CD1 4.26Å; Y193-L406 HydrophobicContact CE1-CD1 3.78Å; Y193-L406 HydrophobicContact CE2-CB 3.51Å; Y193-L406 HydrophobicContact CE2-CD1 4.2Å; Y193-L406 HydrophobicContact CE2-CG 4.35Å; Y193-L406 HydrophobicContact CG-CB 4.49Å; Y193-L406 HydrophobicContact CG-CD1 4.12Å; Y193-E407 HydrophobicContact CD2-CG 4.27Å
194	P	84.6	Confident	84.6	Confident	46 Å²	46	57.5 Å²	57.5	30%	0.299	33%	0.334	S	S	.	.			trans	-77.8	88	-179.9	32.8	-35.3	0	0	0	110.4	V182 K192 N196 S197	V182-P194 VanDerWaalsContact O-CD 3.31Å; V182-P194 WeakPolarHBondContact O-CD 3.38Å; K192-P194 WeakPolarHBondContact O-CD 3.47Å; P194-N196 PolarHBondContact O-N 2.94Å; P194-S197 WeakPolarHBondContact CB-OG 3.44Å; P194-S197 WeakPolarHBondContact CG-OG 3.3Å; P194-S197 VanDerWaalsContact O-CB 3.23Å; P194-S197 WeakPolarHBondContact O-CB 3.31Å; P194-S197 PolarHBondContact O-N 3.19Å; P194-S197 PolarHBondContact O-OG 3.18Å; P194-S197 VanDerWaalsContact O-OG 3.05Å
195	I	84.2	Confident	84.7	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.041	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-53.1	-38	177.6	-62.4	158.1	0	0	0	112	Y193 S197 V198 L399 C400 K403	Y193-I195 PolarHBondContact O-N 3.14Å; I195-S197 PolarHBondContact O-N 3.02Å; I195-V198 WeakPolarHBondContact O-CB 3.5Å; I195-V198 PolarHBondContact O-N 3.47Å; I195-L399 VanDerWaalsContact CD1-C 3.46Å; I195-L399 HydrophobicContact CD1-CB 4.36Å; I195-L399 VanDerWaalsContact CD1-O 3.25Å; I195-L399 WeakPolarHBondContact CD1-O 3.34Å; I195-L399 HydrophobicContact CG1-CB 4.2Å; I195-L399 HydrophobicContact CG2-CB 3.54Å; I195-L399 HydrophobicContact CG2-CD1 4.01Å; I195-L399 HydrophobicContact CG2-CG 4.31Å; I195-C400 HydrophobicContact CD1-CB 4.18Å; I195-K403 HydrophobicContact CD1-CB 3.53Å; I195-K403 HydrophobicContact CD1-CD 3.31Å; I195-K403 HydrophobicContact CD1-CG 4.05Å; I195-K403 HydrophobicContact CG1-CB 3.95Å; I195-K403 HydrophobicContact CG1-CD 3.84Å; I195-K403 HydrophobicContact CG1-CG 4.45Å
196	N	82.4	Confident	85.1	Confident	116 Å²	116	59.7 Å²	59.7	62%	0.62	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-61.5	-2.9	176.5	-62.2	3.7	0	0	0	113.3	P194 R321	P194-N196 PolarHBondContact O-N 2.94Å; N196-R321 PolarHBondContact O-NE 2.63Å; N196-R321 VanDerWaalsContact O-NE 3.13Å; N196-R321 PolarHBondContact O-NH2 3.31Å
197	S	83.9	Confident	85.6	Confident	42 Å²	42	60 Å²	60	29%	0.294	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-91	-20.4	172.2	-46.7	0	0	0	0	112.8	P194 I195 N199	P194-S197 WeakPolarHBondContact CB-OG 3.44Å; P194-S197 WeakPolarHBondContact CG-OG 3.3Å; P194-S197 VanDerWaalsContact O-CB 3.23Å; P194-S197 WeakPolarHBondContact O-CB 3.31Å; P194-S197 PolarHBondContact O-N 3.19Å; P194-S197 PolarHBondContact O-OG 3.18Å; P194-S197 VanDerWaalsContact O-OG 3.05Å; I195-S197 PolarHBondContact O-N 3.02Å; S197-N199 PolarHBondContact O-N 3.33Å
198	V	89.7	Confident	86.5	Confident	12 Å²	12	57.4 Å²	57.4	7%	0.073	31%	0.309	C	S	.	.	S	Bend	trans	-70.8	122.3	172	-177.4	0	0	0	0	107.3	A178 V182 I195 A376 I378 L399	A178-V198 HydrophobicContact CB-CG1 4.37Å; A178-V198 HydrophobicContact CB-CG2 4.5Å; V182-V198 HydrophobicContact CB-CG2 4.45Å; V182-V198 HydrophobicContact CG1-CG2 3.6Å; V182-V198 HydrophobicContact CG2-CG2 4.05Å; I195-V198 WeakPolarHBondContact O-CB 3.5Å; I195-V198 PolarHBondContact O-N 3.47Å; V198-A376 WeakPolarHBondContact CA-O 3.29Å; V198-I378 HydrophobicContact CG1-CD1 4.28Å; V198-I378 HydrophobicContact CG1-CG1 4.42Å; V198-L399 HydrophobicContact CG1-CD1 4.42Å
199	N	91.6	Very high	87	Confident	14 Å²	14	54.2 Å²	54.2	8%	0.075	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129.7	174.6	-161	32.9	0	0	0	109.4	S197 Y217 A218 A376 S377 I378	S197-N199 PolarHBondContact O-N 3.33Å; N199-Y217 HydrophobicContact CB-CE1 4.38Å; N199-Y217 HydrophobicContact CB-CE2 3.82Å; N199-A218 PolarHBondContact ND2-O 3.15Å; N199-A376 PolarHBondContact N-O 3Å; N199-S377 CarbonylContact O-C 3.57Å; N199-S377 WeakPolarHBondContact O-CA 3.47Å; N199-S377 WeakPolarHBondContact O-CB 3.16Å; N199-I378 PolarHBondContact O-N 2.66Å
200	V	93.1	Very high	87.7	Confident	26 Å²	26	55.4 Å²	55.4	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.3	175	-174.1	0	0	0	0	107.1	I378 L380 E392 L395	V200-I378 WeakPolarHBondContact CA-O 3.48Å; V200-L380 HydrophobicContact CG1-CD1 3.51Å; V200-L380 HydrophobicContact CG1-CG 3.88Å; V200-E392 HydrophobicContact CB-CG 4.41Å; V200-E392 HydrophobicContact CG1-CB 4.45Å; V200-E392 HydrophobicContact CG1-CG 4.02Å; V200-L395 HydrophobicContact CG1-CD2 4.03Å; V200-L395 HydrophobicContact CG2-CD2 3.9Å
201	L	92.3	Very high	88.3	Confident	20 Å²	20	51.5 Å²	51.5	11%	0.105	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	143.3	175.4	-66.1	-179.7	0	0	0	109.1	A218 N220 L364 I378 I379 L380	L201-A218 HydrophobicContact CD1-CB 3.59Å; L201-A218 HydrophobicContact CG-CB 4.5Å; L201-N220 HydrophobicContact CD1-CB 4.44Å; L201-N220 HydrophobicContact CD2-CB 3.99Å; L201-L364 HydrophobicContact CD1-CD1 4.04Å; L201-L364 HydrophobicContact CD1-CD2 4.02Å; L201-I378 PolarHBondContact N-O 3.18Å; L201-I379 HydrophobicContact CB-CG1 4.38Å; L201-L380 PolarHBondContact O-N 3.03Å
202	K	92.4	Very high	88.8	Confident	77 Å²	77	53.4 Å²	53.4	34%	0.335	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.7	177.4	-64.1	177.9	-68.4	-153	0	108.6	C388 D389 E392	K202-C388 HydrophobicContact CB-CB 4.09Å; K202-C388 HydrophobicContact CD-CB 3.99Å; K202-C388 HydrophobicContact CG-CB 4.07Å; K202-D389 VanDerWaalsContact CD-OD1 3.31Å; K202-D389 WeakPolarHBondContact CD-OD1 3.36Å; K202-D389 WeakPolarHBondContact CE-OD1 3.21Å; K202-D389 IonicContact NZ-OD1 3.97Å; K202-D389 PolarHBondContact NZ-OD1 2.82Å; K202-E392 HydrophobicContact CD-CB 4.33Å; K202-E392 VanDerWaalsContact CD-OE2 3.27Å; K202-E392 WeakPolarHBondContact CD-OE2 3.46Å; K202-E392 VanDerWaalsContact CE-OE2 3.23Å; K202-E392 WeakPolarHBondContact CE-OE2 3.38Å; K202-E392 IonicContact NZ-OE2 3.36Å; K202-E392 PolarHBondContact NZ-OE2 3.38Å
203	A	90.6	Very high	89.2	Confident	2 Å²	2	50.8 Å²	50.8	2%	0.017	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	105.2	170.2	0	0	0	0	0	108	V359 L380 R381	A203-V359 HydrophobicContact CB-CG1 3.93Å; A203-L380 PolarHBondContact N-O 2.97Å; A203-R381 WeakPolarHBondContact O-CA 3.47Å
204	H	89.5	Confident	89.4	Confident	76 Å²	76	50 Å²	50	35%	0.352	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	154.4	177.6	62	-103.4	0	0	0	111.3	C360 G382 D385	H204-C360 WeakPolarHBondContact O-CB 3.5Å; H204-C360 PolarHBondContact O-SG 2.83Å; H204-G382 CarbonylContact C-O 3.37Å; H204-G382 WeakPolarHBondContact CA-O 3.26Å; H204-D385 WeakPolarHBondContact CB-OD1 3.46Å; H204-D385 IonicContact CE1-OD1 3.89Å; H204-D385 IonicContact CG-OD1 3.68Å; H204-D385 IonicContact ND1-OD1 4Å; H204-D385 PolarHBondContact ND1-OD1 3.47Å; H204-D385 IonicContact ND1-OD2 2.66Å
205	G	86.1	Confident	89.6	Confident	19 Å²	19	52.4 Å²	52.4	20%	0.196	26%	0.262	C	S	.	.	S	Bend	trans	101.7	155.7	-175.4	0	0	0	0	0	113.8	R381 G382	G205-R381 VanDerWaalsContact C-NH2 3.29Å; G205-R381 VanDerWaalsContact O-CZ 3.27Å; G205-R381 PolarHBondContact O-NE 3.39Å; G205-R381 PolarHBondContact O-NH2 3.4Å; G205-G382 PolarHBondContact N-O 3.39Å
206	R	88.3	Confident	89.8	Confident	176 Å²	176	52 Å²	52	66%	0.664	26%	0.26	S	S	*	.	S	Bend	trans	63.7	-172.3	-174.2	-56.4	-165.1	-172.5	-178	-3	113.9	E210	R206-E210 WeakPolarHBondContact CD-OE2 3.39Å; R206-E210 IonicContact CZ-OE2 2.78Å; R206-E210 IonicContact NE-OE2 2.66Å; R206-E210 IonicContact NH1-OE2 3.63Å; R206-E210 PolarHBondContact NH1-OE2 3.28Å
207	S	90.1	Very high	90.2	Very high	59 Å²	59	46.6 Å²	46.6	41%	0.413	23%	0.231	S	C	.	.			trans	-83.3	153.5	-177.8	-175.8	0	0	0	0	112.4	K209 E210 R381	S207-K209 PolarHBondContact O-N 3.39Å; S207-E210 WeakPolarHBondContact O-CB 3.34Å; S207-E210 PolarHBondContact O-N 3.07Å; S207-R381 WeakPolarHBondContact O-CB 3.47Å
208	Q	89	Confident	90.6	Very high	28 Å²	28	44.6 Å²	44.6	13%	0.131	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-58.7	-34.1	174.9	-62.3	177.8	2	0	0	113	F171 E210 S211 R381 M387 M391	F171-Q208 HydrophobicContact CE2-CB 4.44Å; F171-Q208 HydrophobicContact CZ-CB 4.3Å; Q208-E210 PolarHBondContact O-N 3.23Å; Q208-S211 VanDerWaalsContact O-CB 3.25Å; Q208-S211 WeakPolarHBondContact O-CB 3.43Å; Q208-S211 PolarHBondContact O-N 3.12Å; Q208-S211 PolarHBondContact O-OG 3.2Å; Q208-R381 WeakPolarHBondContact CA-O 3.32Å; Q208-M387 HydrophobicContact CG-SD 4.14Å; Q208-M387 PolarHBondContact NE2-SD 3.01Å; Q208-M391 HydrophobicContact CB-CE 3.97Å; Q208-M391 HydrophobicContact CG-CE 3.9Å; Q208-M391 HydrophobicContact CG-SD 3.93Å
209	K	90.3	Very high	90.8	Very high	121 Å²	121	44.1 Å²	44.1	53%	0.526	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-66	-16.1	177.4	-66.2	-172.5	177.2	-176	0	113.9	D167 F170 S207	D167-K209 WeakPolarHBondContact OD1-CE 3.45Å; D167-K209 IonicContact OD1-NZ 3.8Å; D167-K209 PolarHBondContact OD1-NZ 3.43Å; D167-K209 WeakPolarHBondContact OD2-CE 3.32Å; D167-K209 WeakPolarHBondContact OD2-CG 3.36Å; F170-K209 VanDerWaalsContact CZ-O 3.25Å; F170-K209 WeakPolarHBondContact CZ-O 3.1Å; S207-K209 PolarHBondContact O-N 3.39Å
210	E	90.8	Very high	90.7	Very high	85 Å²	85	47.8 Å²	47.8	40%	0.397	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-85.9	2	174.7	-62.6	-173.4	-133.6	0	0	112.6	R206 S207 Q208 F212 R381	R206-E210 WeakPolarHBondContact CD-OE2 3.39Å; R206-E210 IonicContact CZ-OE2 2.78Å; R206-E210 IonicContact NE-OE2 2.66Å; R206-E210 IonicContact NH1-OE2 3.63Å; R206-E210 PolarHBondContact NH1-OE2 3.28Å; S207-E210 WeakPolarHBondContact O-CB 3.34Å; S207-E210 PolarHBondContact O-N 3.07Å; Q208-E210 PolarHBondContact O-N 3.23Å; E210-F212 WeakPolarHBondContact O-CD1 3.29Å; E210-R381 HydrophobicContact CB-CG 4.37Å
211	S	92.4	Very high	90.5	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.014	23%	0.234	C	C	.	.			trans	-61.3	141.9	166.4	-54.6	0	0	0	0	109.4	F170 M174 Q208 I379 R381	F170-S211 VanDerWaalsContact CE1-O 3.32Å; F170-S211 WeakPolarHBondContact CE1-O 3.42Å; F170-S211 WeakPolarHBondContact CZ-O 3.49Å; M174-S211 WeakPolarHBondContact CE-O 3.36Å; Q208-S211 VanDerWaalsContact O-CB 3.25Å; Q208-S211 WeakPolarHBondContact O-CB 3.43Å; Q208-S211 PolarHBondContact O-N 3.12Å; Q208-S211 PolarHBondContact O-OG 3.2Å; S211-I379 VanDerWaalsContact CA-O 3.23Å; S211-I379 WeakPolarHBondContact CA-O 3.23Å; S211-I379 VanDerWaalsContact CB-O 3.28Å; S211-I379 WeakPolarHBondContact CB-O 3.43Å; S211-R381 PolarHBondContact OG-N 3.11Å
212	F	92.5	Very high	90.3	Very high	73 Å²	73	50.3 Å²	50.3	32%	0.32	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	154	-177.8	61.4	-86.6	0	0	0	112.9	E210 V214 V359 I379	E210-F212 WeakPolarHBondContact O-CD1 3.29Å; F212-V214 HydrophobicContact CD2-CG2 3.83Å; F212-V214 HydrophobicContact CE2-CG2 3.56Å; F212-V359 HydrophobicContact CZ-CG2 4.48Å; F212-I379 HydrophobicContact CE1-CB 4.38Å; F212-I379 HydrophobicContact CE1-CD1 4.39Å; F212-I379 HydrophobicContact CE1-CG2 4.43Å; F212-I379 HydrophobicContact CE2-CD1 3.75Å; F212-I379 HydrophobicContact CZ-CB 4.39Å; F212-I379 HydrophobicContact CZ-CD1 3.61Å; F212-I379 PolarHBondContact N-O 3.43Å; F212-I379 PolarHBondContact O-N 3.29Å; F212-I379 VanDerWaalsContact O-N 3.09Å
213	L	93.2	Very high	90.2	Very high	43 Å²	43	47.2 Å²	47.2	23%	0.225	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	127.4	173.5	-173.7	62.9	0	0	0	109.7	M174 D177 A178 A376 I378	M174-L213 HydrophobicContact CG-CB 4.06Å; M174-L213 HydrophobicContact CG-CD1 4.41Å; D177-L213 HydrophobicContact CB-CD2 3.68Å; A178-L213 HydrophobicContact CB-CD1 3.85Å; L213-A376 HydrophobicContact CD1-CB 3.99Å; L213-I378 HydrophobicContact CD1-CD1 4.4Å; L213-I378 HydrophobicContact CD1-CG1 3.65Å
214	V	91.3	Very high	90	Very high	6 Å²	6	47.6 Å²	47.6	4%	0.036	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.5	168.3	-178.4	0	0	0	0	108.1	F212 G216 L366 K368 S377 I379	F212-V214 HydrophobicContact CD2-CG2 3.83Å; F212-V214 HydrophobicContact CE2-CG2 3.56Å; V214-G216 PolarHBondContact O-N 3.01Å; V214-L366 HydrophobicContact CG1-CB 4.48Å; V214-L366 HydrophobicContact CG2-CD1 4.36Å; V214-L366 HydrophobicContact CG2-CD2 4.22Å; V214-K368 HydrophobicContact CG1-CG 4.31Å; V214-S377 PolarHBondContact N-O 3.05Å; V214-S377 PolarHBondContact O-N 3.34Å; V214-I379 HydrophobicContact CG2-CD1 3.85Å; V214-I379 HydrophobicContact CG2-CG1 4.46Å
215	N	87.7	Confident	90	Very high	96 Å²	96	45.5 Å²	45.5	51%	0.513	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	81.3	170.1	-69.7	-16.6	0	0	0	109.1	K368 N369	N215-K368 WeakPolarHBondContact O-CA 3.32Å; N215-N369 PolarHBondContact O-N 3.15Å
216	G	88.6	Confident	90.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.1	-147.3	-173	0	0	0	0	0	112.5	V214 I367 S375 A376 S377	V214-G216 PolarHBondContact O-N 3.01Å; G216-I367 CarbonylContact C-O 3.54Å; G216-I367 WeakPolarHBondContact CA-O 3.24Å; G216-S375 WeakPolarHBondContact CA-O 3.49Å; G216-S375 WeakPolarHBondContact CA-OG 3.32Å; G216-S375 PolarHBondContact N-O 3.28Å; G216-S375 CarbonylContact O-C 3.6Å; G216-S375 VanDerWaalsContact O-C 3.24Å; G216-S375 PolarHBondContact O-OG 3.42Å; G216-A376 CarbonylContact O-C 3.58Å; G216-A376 VanDerWaalsContact O-C 3.28Å; G216-A376 WeakPolarHBondContact O-CA 3.37Å; G216-A376 PolarHBondContact O-N 3.09Å; G216-S377 PolarHBondContact O-N 2.66Å; G216-S377 PolarHBondContact O-OG 2.73Å
217	Y	91.5	Very high	90.1	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.6	178.5	-156.3	-91.7	0	0	0	110.6	N199 D318 R321 I322 I367 S377	N199-Y217 HydrophobicContact CB-CE1 4.38Å; N199-Y217 HydrophobicContact CB-CE2 3.82Å; Y217-D318 HydrophobicContact CE1-CB 3.92Å; Y217-D318 PolarHBondContact OH-OD1 3.02Å; Y217-R321 HydrophobicContact CD2-CB 4.43Å; Y217-R321 HydrophobicContact CE2-CB 3.73Å; Y217-R321 HydrophobicContact CE2-CG 4.47Å; Y217-R321 VanDerWaalsContact OH-CD 3.3Å; Y217-R321 WeakPolarHBondContact OH-CD 3.31Å; Y217-R321 PolarHBondContact OH-NH1 2.96Å; Y217-I322 HydrophobicContact CD1-CD1 3.63Å; Y217-I322 HydrophobicContact CD1-CG1 3.35Å; Y217-I322 HydrophobicContact CD2-CG1 4.33Å; Y217-I322 HydrophobicContact CE1-CD1 3.95Å; Y217-I322 HydrophobicContact CE1-CG1 3.84Å; Y217-I322 HydrophobicContact CG-CD1 4.39Å; Y217-I322 HydrophobicContact CG-CG1 3.64Å; Y217-I367 PolarHBondContact N-O 3.5Å; Y217-I367 PolarHBondContact O-N 2.88Å; Y217-S377 WeakPolarHBondContact CA-OG 3.26Å
218	A	92.7	Very high	90.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	134.6	173	0	0	0	0	0	109.9	N199 L201 L366 S377 I379	N199-A218 PolarHBondContact ND2-O 3.15Å; L201-A218 HydrophobicContact CD1-CB 3.59Å; L201-A218 HydrophobicContact CG-CB 4.5Å; A218-L366 HydrophobicContact CB-CD2 3.65Å; A218-S377 PolarHBondContact N-OG 3.26Å; A218-I379 HydrophobicContact CB-CD1 4.26Å; A218-I379 HydrophobicContact CB-CG1 4.38Å
219	L	92.2	Very high	90.1	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.3	-175.8	-177.6	114.5	0	0	0	109.7	C221 V311 V314 D318 I322 I365	L219-C221 VanDerWaalsContact C-N 3.28Å; L219-C221 HydrophobicContact CD2-CB 3.41Å; L219-C221 VanDerWaalsContact CD2-CB 3.41Å; L219-C221 VanDerWaalsContact CD2-SG 3.54Å; L219-C221 HydrophobicContact CG-CB 4.27Å; L219-C221 PolarHBondContact O-N 2.94Å; L219-C221 VanDerWaalsContact O-N 3.11Å; L219-V311 HydrophobicContact CD2-CG1 3.91Å; L219-V314 HydrophobicContact CD1-CG1 3.67Å; L219-V314 HydrophobicContact CD1-CG2 4.22Å; L219-V314 HydrophobicContact CD2-CG2 4.29Å; L219-D318 HydrophobicContact CD1-CB 4.35Å; L219-I322 HydrophobicContact CD1-CD1 3.72Å; L219-I365 HydrophobicContact CB-CB 4.35Å; L219-I365 HydrophobicContact CD2-CB 4.21Å; L219-I365 HydrophobicContact CD2-CD1 4.21Å; L219-I365 PolarHBondContact N-O 2.86Å; L219-I365 PolarHBondContact O-N 3.47Å
220	N	90.8	Very high	90.1	Very high	91 Å²	91	50.3 Å²	50.3	49%	0.487	26%	0.259	S	S	.	.			trans	-85.7	70.3	173.8	-168.8	1.4	0	0	0	110.7	L201 L364	L201-N220 HydrophobicContact CD1-CB 4.44Å; L201-N220 HydrophobicContact CD2-CB 3.99Å; N220-L364 HydrophobicContact CB-CD2 3.82Å
221	C	89.1	Confident	90.2	Very high	25 Å²	25	53.9 Å²	53.9	17%	0.169	27%	0.269	C	S	.	.			trans	-142.4	155.9	168.3	-52.3	0	0	0	0	110	L219 V311 I365	L219-C221 VanDerWaalsContact C-N 3.28Å; L219-C221 HydrophobicContact CD2-CB 3.41Å; L219-C221 VanDerWaalsContact CD2-CB 3.41Å; L219-C221 VanDerWaalsContact CD2-SG 3.54Å; L219-C221 HydrophobicContact CG-CB 4.27Å; L219-C221 PolarHBondContact O-N 2.94Å; L219-C221 VanDerWaalsContact O-N 3.11Å; C221-V311 HydrophobicContact CB-CG1 3.68Å; C221-I365 WeakPolarHBondContact O-CD1 3.3Å; C221-I365 WeakPolarHBondContact O-CG1 3.49Å
222	T	88.2	Confident	90.3	Very high	74 Å²	74	54.4 Å²	54.4	45%	0.454	27%	0.272	S	S	.	.			trans	-93.1	158.5	173.4	50.4	0	0	0	0	111.7	E363	T222-E363 HydrophobicContact CG2-CB 4.07Å
223	V	90.4	Very high	90.2	Very high	13 Å²	13	55.2 Å²	55.2	8%	0.079	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-63.2	150.7	168.7	-66.9	0	0	0	0	111.1	S225 M309 Q356 I365	V223-S225 VanDerWaalsContact C-N 3.34Å; V223-S225 VanDerWaalsContact CG2-O 3.3Å; V223-S225 WeakPolarHBondContact CG2-O 3.24Å; V223-S225 PolarHBondContact O-N 3.02Å; V223-M309 HydrophobicContact CG1-CE 4.23Å; V223-M309 HydrophobicContact CG1-CG 3.92Å; V223-M309 HydrophobicContact CG1-SD 4.2Å; V223-Q356 VanDerWaalsContact CG2-OE1 3.28Å; V223-I365 HydrophobicContact CG1-CD1 4.34Å
224	G	85.3	Confident	90.1	Very high	9 Å²	9	58.2 Å²	58.2	9%	0.093	30%	0.299	C	S	.	.	S	Bend	trans	-64	-35.7	-176.3	0	0	0	0	0	114.1	L300 A310	G224-L300 WeakPolarHBondContact O-CD1 3.37Å; G224-A310 PolarHBondContact N-O 3.47Å
225	S	89.5	Confident	90.1	Very high	33 Å²	33	58 Å²	58	23%	0.231	30%	0.298	C	S	.	.			trans	-135.9	147.9	175	174.6	0	0	0	0	110.5	V223 E227 M228	V223-S225 VanDerWaalsContact C-N 3.34Å; V223-S225 VanDerWaalsContact CG2-O 3.3Å; V223-S225 WeakPolarHBondContact CG2-O 3.24Å; V223-S225 PolarHBondContact O-N 3.02Å; S225-E227 VanDerWaalsContact C-N 3.25Å; S225-E227 PolarHBondContact O-N 3.06Å; S225-E227 PolarHBondContact OG-N 3.47Å; S225-M228 WeakPolarHBondContact O-CB 3.45Å; S225-M228 PolarHBondContact O-N 3.27Å
226	Q	87.7	Confident	90.4	Very high	178 Å²	178	57.8 Å²	57.8	83%	0.832	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-22.9	178.1	-67.6	-175.8	-6	0	0	113.4	M228	Q226-M228 PolarHBondContact O-N 2.97Å
227	E	88.3	Confident	90.6	Very high	156 Å²	156	57.8 Å²	57.8	73%	0.729	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-8.5	176.7	-64.1	-177	163	0	0	112.7	S225 V304	S225-E227 VanDerWaalsContact C-N 3.25Å; S225-E227 PolarHBondContact O-N 3.06Å; S225-E227 PolarHBondContact OG-N 3.47Å; E227-V304 HydrophobicContact CB-CG1 3.96Å; E227-V304 HydrophobicContact CB-CG2 4.25Å
228	M	90.4	Very high	90.8	Very high	8 Å²	8	57.8 Å²	57.8	4%	0.039	29%	0.292	C	S	.	.	S	Bend	trans	-70.7	151.7	177.6	-68	-178.5	173.1	0	0	111.9	S225 Q226 K230 L300 F303 V304 A310	S225-M228 WeakPolarHBondContact O-CB 3.45Å; S225-M228 PolarHBondContact O-N 3.27Å; Q226-M228 PolarHBondContact O-N 2.97Å; M228-K230 PolarHBondContact O-N 3.49Å; M228-L300 HydrophobicContact CE-CB 3.99Å; M228-L300 HydrophobicContact CE-CD2 3.51Å; M228-L300 HydrophobicContact CE-CG 4.34Å; M228-F303 HydrophobicContact CE-CB 3.74Å; M228-V304 HydrophobicContact CE-CG2 4.02Å; M228-V304 HydrophobicContact CG-CG2 3.67Å; M228-A310 HydrophobicContact CE-CB 3.93Å; M228-A310 HydrophobicContact SD-CB 4.07Å; M228-A310 PolarHBondContact SD-N 3.37Å
229	V	89.5	Confident	90.8	Very high	64 Å²	64	57.8 Å²	57.8	39%	0.388	29%	0.292	S	S	.	.			trans	-64.5	123.9	175.4	-171.6	0	0	0	0	109.4	R231 I232 M309	V229-R231 VanDerWaalsContact CG1-O 3.22Å; V229-R231 WeakPolarHBondContact CG1-O 3.39Å; V229-I232 HydrophobicContact CG1-CG1 4.25Å; V229-M309 WeakPolarHBondContact O-CE 3.3Å
230	K	90.5	Very high	90.9	Very high	98 Å²	98	57.7 Å²	57.7	43%	0.426	29%	0.292	S	S	.	.	S	Bend	trans	-84.2	-14.1	-178.4	-62.5	-171.3	179.3	-171.3	0	114.1	M228 M309 V355 Q356	M228-K230 PolarHBondContact O-N 3.49Å; K230-M309 WeakPolarHBondContact O-CE 3.42Å; K230-V355 CarbonylContact O-C 3.48Å; K230-V355 WeakPolarHBondContact O-CA 3.24Å; K230-Q356 HydrophobicContact CB-CB 4.28Å; K230-Q356 PolarHBondContact O-N 2.93Å
231	R	93.2	Very high	91	Very high	159 Å²	159	55.1 Å²	55.1	60%	0.6	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	122	-176.1	-178.7	175.1	-170.6	-164.1	2.6	110.7	V229 E353 V355	V229-R231 VanDerWaalsContact CG1-O 3.22Å; V229-R231 WeakPolarHBondContact CG1-O 3.39Å; R231-E353 IonicContact CZ-OE1 3.12Å; R231-E353 IonicContact NE-OE1 3.34Å; R231-E353 PolarHBondContact NE-OE1 3.43Å; R231-E353 IonicContact NH2-OE1 2.72Å; R231-E353 PolarHBondContact NH2-OE1 2.92Å; R231-V355 HydrophobicContact CB-CG1 4.43Å; R231-V355 HydrophobicContact CG-CG1 4.46Å; R231-V355 HydrophobicContact CG-CG2 4.12Å
232	I	92.8	Very high	91.1	Very high	14 Å²	14	55.7 Å²	55.7	7%	0.072	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	120.9	-179.9	-62.1	-179.8	0	0	0	109.2	V229 A235 N287 V288 M309 E353 V354	V229-I232 HydrophobicContact CG1-CG1 4.25Å; I232-A235 HydrophobicContact CG2-CB 4.07Å; I232-N287 HydrophobicContact CD1-CB 4.46Å; I232-N287 VanDerWaalsContact CD1-O 3.28Å; I232-N287 WeakPolarHBondContact CD1-O 3.08Å; I232-N287 HydrophobicContact CG2-CB 3.99Å; I232-V288 HydrophobicContact CB-CG2 4.48Å; I232-V288 HydrophobicContact CD1-CG2 3.87Å; I232-V288 HydrophobicContact CG2-CG2 4.49Å; I232-M309 HydrophobicContact CD1-CB 3.54Å; I232-E353 WeakPolarHBondContact O-CA 3.46Å; I232-V354 PolarHBondContact N-O 3.37Å; I232-V354 PolarHBondContact O-N 3.06Å
233	V	91.9	Very high	91.3	Very high	89 Å²	89	54.8 Å²	54.8	54%	0.539	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	140.9	173.6	-175.5	0	0	0	0	109	E352	V233-E352 CarbonylContact C-O 3.59Å
234	N	91.1	Very high	91.3	Very high	107 Å²	107	54.3 Å²	54.3	57%	0.572	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	55	58.6	-170.8	-65.4	-54.1	0	0	0	112.4	K236 A351 E352	N234-K236 PolarHBondContact O-N 3.46Å; N234-A351 CarbonylContact C-O 3.41Å; N234-E352 WeakPolarHBondContact CA-O 3.33Å; N234-E352 PolarHBondContact N-O 3.38Å
235	A	90.4	Very high	91.4	Very high	2 Å²	2	58.5 Å²	58.5	2%	0.017	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	126	-176.5	0	0	0	0	0	112.3	I232 V237 V288 A351 V354	I232-A235 HydrophobicContact CG2-CB 4.07Å; A235-V237 HydrophobicContact CB-CG2 4.37Å; A235-V288 HydrophobicContact CB-CG2 3.89Å; A235-A351 HydrophobicContact CB-CB 4.41Å; A235-A351 PolarHBondContact N-O 3.23Å; A235-A351 PolarHBondContact O-N 3.09Å; A235-V354 HydrophobicContact CB-CB 4.15Å; A235-V354 HydrophobicContact CB-CG2 3.5Å; A235-V354 VanDerWaalsContact CB-CG2 3.5Å
236	K	93.9	Very high	91.2	Very high	91 Å²	91	61.7 Å²	61.7	40%	0.396	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.9	164.4	-71	173.3	176.1	-178.6	0	108.8	N234 G285 N287 V288 L348 G349	N234-K236 PolarHBondContact O-N 3.46Å; K236-G285 WeakPolarHBondContact CB-O 3.34Å; K236-G285 WeakPolarHBondContact CD-O 3.13Å; K236-N287 PolarHBondContact O-N 2.69Å; K236-V288 PolarHBondContact O-N 3.23Å; K236-L348 HydrophobicContact CB-CD1 4.31Å; K236-L348 HydrophobicContact CD-CD1 4.42Å; K236-G349 CarbonylContact C-O 3.58Å; K236-G349 WeakPolarHBondContact CA-O 3.4Å
237	V	93.6	Very high	90.9	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.2	-169.9	-174.3	0	0	0	0	110.3	A235 V288 L290 I322 T326 G349 A351 V354	A235-V237 HydrophobicContact CB-CG2 4.37Å; V237-V288 CarbonylContact C-O 3.58Å; V237-V288 WeakPolarHBondContact CA-O 3.15Å; V237-V288 HydrophobicContact CG1-CG1 4.35Å; V237-V288 HydrophobicContact CG2-CB 4.21Å; V237-V288 HydrophobicContact CG2-CG1 4.48Å; V237-L290 HydrophobicContact CG1-CD1 3.83Å; V237-L290 HydrophobicContact CG1-CG 4.12Å; V237-I322 HydrophobicContact CG1-CG2 4.49Å; V237-T326 HydrophobicContact CG2-CG2 4.33Å; V237-G349 PolarHBondContact N-O 2.91Å; V237-G349 PolarHBondContact O-N 3.22Å; V237-A351 HydrophobicContact CG2-CB 4.44Å; V237-V354 HydrophobicContact CG2-CG2 4.48Å
238	A	94.4	Very high	90.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.6	170.2	0	0	0	0	0	110.3	I281 A286 V288 V289 L290 F343 L348	A238-I281 HydrophobicContact CB-CG2 4.35Å; A238-A286 HydrophobicContact CB-CB 4.02Å; A238-V288 PolarHBondContact N-O 3.2Å; A238-V289 HydrophobicContact CB-CG2 4.35Å; A238-L290 PolarHBondContact O-N 3.34Å; A238-F343 HydrophobicContact CB-CE1 4.31Å; A238-F343 HydrophobicContact CB-CZ 3.9Å; A238-L348 HydrophobicContact CB-CD2 3.72Å
239	C	94.4	Very high	90.1	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	108.4	177.8	-67.3	0	0	0	0	110.5	L319 A323 A328 V330 C331	C239-L319 HydrophobicContact CB-CD1 3.73Å; C239-L319 HydrophobicContact CB-CD2 4.31Å; C239-L319 HydrophobicContact CB-CG 3.95Å; C239-A323 HydrophobicContact CB-CB 4.39Å; C239-A328 HydrophobicContact CB-CB 4.37Å; C239-V330 HydrophobicContact CB-CG2 4.32Å; C239-C331 PolarHBondContact O-N 3.46Å
240	L	94	Very high	89.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.4	-174.9	-51.6	178.5	0	0	0	111	F242 L244 I281 V289 L290 T291 T292 L319 C331 F343	L240-F242 HydrophobicContact CB-CD1 4.27Å; L240-F242 HydrophobicContact CB-CE1 3.95Å; L240-F242 HydrophobicContact CB-CZ 4.34Å; L240-F242 HydrophobicContact CD1-CE1 4.47Å; L240-F242 HydrophobicContact CD1-CZ 4.09Å; L240-F242 HydrophobicContact CD2-CE1 3.88Å; L240-F242 HydrophobicContact CD2-CZ 4.1Å; L240-F242 HydrophobicContact CG-CE1 4.31Å; L240-F242 HydrophobicContact CG-CZ 4.41Å; L240-L244 HydrophobicContact CD1-CD1 4.3Å; L240-I281 HydrophobicContact CD1-CD1 3.78Å; L240-V289 HydrophobicContact CD1-CG1 3.58Å; L240-V289 HydrophobicContact CG-CG1 4.26Å; L240-L290 PolarHBondContact N-O 2.89Å; L240-T291 VanDerWaalsContact O-CA 3.31Å; L240-T291 WeakPolarHBondContact O-CA 3.46Å; L240-T292 PolarHBondContact O-N 2.89Å; L240-L319 VanDerWaalsContact O-CD2 3.29Å; L240-L319 WeakPolarHBondContact O-CD2 3.09Å; L240-C331 HydrophobicContact CD2-CB 4.14Å; L240-F343 HydrophobicContact CD2-CE2 3.86Å; L240-F343 HydrophobicContact CD2-CZ 4.44Å
241	D	93.5	Very high	89.3	Confident	38 Å²	38	70.8 Å²	70.8	20%	0.203	34%	0.339	C	S	.	.	S	Bend	trans	-108.4	39.7	176	-169.5	33.9	0	0	0	112	T292 K316 V330 C331	D241-T292 VanDerWaalsContact CA-OG1 3.32Å; D241-T292 WeakPolarHBondContact CA-OG1 3.46Å; D241-T292 HydrophobicContact CB-CG2 4.4Å; D241-T292 WeakPolarHBondContact OD1-CB 3.43Å; D241-T292 VanDerWaalsContact OD1-CG2 3.24Å; D241-T292 WeakPolarHBondContact OD1-CG2 3.44Å; D241-T292 PolarHBondContact OD1-OG1 2.9Å; D241-K316 IonicContact OD1-NZ 2.73Å; D241-K316 WeakPolarHBondContact OD2-CE 3.35Å; D241-K316 IonicContact OD2-NZ 3.05Å; D241-K316 PolarHBondContact OD2-NZ 3.22Å; D241-V330 HydrophobicContact CB-CG1 3.88Å; D241-C331 PolarHBondContact N-O 2.9Å
242	F	90.8	Very high	88.8	Confident	37 Å²	37	67.1 Å²	67.1	16%	0.162	35%	0.351	C	S	.	.	S	Bend	trans	-150.5	155.8	175.1	63.8	-88.3	0	0	0	111.3	L240 L244 T291 L334	L240-F242 HydrophobicContact CB-CD1 4.27Å; L240-F242 HydrophobicContact CB-CE1 3.95Å; L240-F242 HydrophobicContact CB-CZ 4.34Å; L240-F242 HydrophobicContact CD1-CE1 4.47Å; L240-F242 HydrophobicContact CD1-CZ 4.09Å; L240-F242 HydrophobicContact CD2-CE1 3.88Å; L240-F242 HydrophobicContact CD2-CZ 4.1Å; L240-F242 HydrophobicContact CG-CE1 4.31Å; L240-F242 HydrophobicContact CG-CZ 4.41Å; F242-L244 HydrophobicContact CD2-CD2 4.4Å; F242-L244 HydrophobicContact CE2-CD2 3.66Å; F242-L244 HydrophobicContact CZ-CD2 4.47Å; F242-T291 PolarHBondContact O-OG1 3.33Å; F242-L334 HydrophobicContact CE1-CD2 4.32Å; F242-L334 HydrophobicContact CE1-CG 4.06Å; F242-L334 HydrophobicContact CE2-CD1 4.17Å; F242-L334 HydrophobicContact CE2-CG 4.33Å; F242-L334 HydrophobicContact CZ-CD1 3.77Å; F242-L334 HydrophobicContact CZ-CD2 3.94Å; F242-L334 HydrophobicContact CZ-CG 3.55Å
243	S	91.3	Very high	88.5	Confident	55 Å²	55	70.5 Å²	70.5	39%	0.385	37%	0.372	S	S	.	.			trans	-77.6	142.6	-179.9	-59.8	0	0	0	0	112.8	Q245 G293 G294	S243-Q245 PolarHBondContact O-N 3.43Å; S243-G293 VanDerWaalsContact OG-CA 3.24Å; S243-G293 WeakPolarHBondContact OG-CA 3.27Å; S243-G294 CarbonylContact C-O 3.52Å; S243-G294 WeakPolarHBondContact CA-O 3.35Å; S243-G294 WeakPolarHBondContact CB-O 3.16Å; S243-G294 PolarHBondContact OG-N 3.45Å
244	L	89.9	Confident	88	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.01	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-100.3	75.2	170.7	-65	175	0	0	0	109.3	L240 F242 I278 G294 I295 D296 F303	L240-L244 HydrophobicContact CD1-CD1 4.3Å; F242-L244 HydrophobicContact CD2-CD2 4.4Å; F242-L244 HydrophobicContact CE2-CD2 3.66Å; F242-L244 HydrophobicContact CZ-CD2 4.47Å; L244-I278 HydrophobicContact CD1-CG1 4.37Å; L244-I278 HydrophobicContact CD2-CG1 4.39Å; L244-G294 PolarHBondContact N-O 3.13Å; L244-I295 HydrophobicContact CB-CG1 4.34Å; L244-I295 HydrophobicContact CB-CG2 4.25Å; L244-I295 WeakPolarHBondContact O-CA 3.44Å; L244-D296 PolarHBondContact O-N 2.65Å; L244-F303 HydrophobicContact CD1-CE2 3.9Å; L244-F303 HydrophobicContact CD1-CZ 3.7Å
245	Q	88.8	Confident	87.4	Confident	97 Å²	97	72.9 Å²	72.9	45%	0.453	38%	0.379	S	S	.	.	S	Bend	trans	-122.8	167.6	179.2	-66.5	177.5	-17.8	0	0	110	S243 T247 T274 D296	S243-Q245 PolarHBondContact O-N 3.43Å; Q245-T247 PolarHBondContact O-N 3.29Å; Q245-T247 VanDerWaalsContact O-N 3.17Å; Q245-T274 PolarHBondContact O-OG1 3.41Å; Q245-D296 HydrophobicContact CB-CB 4.49Å; Q245-D296 HydrophobicContact CG-CB 4.33Å
246	K	84.8	Confident	87.2	Confident	100 Å²	100	78.3 Å²	78.3	44%	0.435	41%	0.411	S	S	.	.			trans	-52.9	124.1	169.9	-69.3	179.6	-176.4	179.7	0	109.1	K248	K246-K248 PolarHBondContact O-N 2.97Å; K246-K248 VanDerWaalsContact O-N 3.09Å
247	T	80.9	Confident	86.7	Confident	43 Å²	43	77.2 Å²	77.2	26%	0.264	41%	0.409	S	S	.	.			trans	-71	110.4	-173.9	-61.4	0	0	0	0	108.4	Q245 T274 R277	Q245-T247 PolarHBondContact O-N 3.29Å; Q245-T247 VanDerWaalsContact O-N 3.17Å; T247-T274 PolarHBondContact OG1-OG1 2.88Å; T247-R277 PolarHBondContact OG1-NH1 2.87Å
248	K	80.9	Confident	86.4	Confident	182 Å²	182	84 Å²	84	79%	0.791	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-80.4	145.8	171.9	-65.6	-174.4	179.7	-178	0	109.9	K246	K246-K248 PolarHBondContact O-N 2.97Å; K246-K248 VanDerWaalsContact O-N 3.09Å
249	M	80.9	Confident	86.2	Confident	102 Å²	102	87.5 Å²	87.5	50%	0.502	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-60.1	147	171	-65.1	-65	179.1	0	0	110.8	V253 V255	M249-V253 HydrophobicContact CB-CB 4.19Å; M249-V253 HydrophobicContact CB-CG1 4.32Å; M249-V253 HydrophobicContact CG-CG1 4.46Å; M249-V255 HydrophobicContact CG-CG2 4.32Å
250	K	81.7	Confident	85.8	Confident	173 Å²	173	92.7 Å²	92.7	75%	0.752	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-64.1	149.6	176.9	-68.3	-174.5	179.9	179.1	0	110.3	G252 V253	K250-G252 PolarHBondContact O-N 3.09Å; K250-V253 PolarHBondContact O-N 3.25Å; K250-V253 VanDerWaalsContact O-N 3.13Å
251	M	82	Confident	85.4	Confident	195 Å²	195	100.1 Å²	100.1	96%	0.961	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	130	173.3	-69.8	-64.9	-69.9	0	0	110.3
252	G	83.3	Confident	85	Confident	83 Å²	83	103.5 Å²	103.5	86%	0.856	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.4	-7.8	-176.9	0	0	0	0	0	115	K250	K250-G252 PolarHBondContact O-N 3.09Å
253	V	85.3	Confident	84.7	Confident	84 Å²	84	104.2 Å²	104.2	51%	0.509	55%	0.551	S	S	.	*			trans	-92.3	112.9	170.5	-178.5	0	0	0	0	109.2	M249 K250 V255	M249-V253 HydrophobicContact CB-CB 4.19Å; M249-V253 HydrophobicContact CB-CG1 4.32Å; M249-V253 HydrophobicContact CG-CG1 4.46Å; K250-V253 PolarHBondContact O-N 3.25Å; K250-V253 VanDerWaalsContact O-N 3.13Å; V253-V255 HydrophobicContact CG1-CG2 4.5Å
254	Q	80.9	Confident	84.4	Confident	174 Å²	174	105.8 Å²	105.8	81%	0.813	56%	0.555	S	S	*	*			trans	-101.4	119.8	170.1	-71.9	-176	-7.3	0	0	109.4	V256	Q254-V256 PolarHBondContact O-N 2.73Å
255	V	80.2	Confident	84.2	Confident	73 Å²	73	111.6 Å²	111.6	44%	0.442	58%	0.582	S	S	.	*			trans	-86.9	105.3	175.8	-176.9	0	0	0	0	107.8	M249 V253 I257 I266	M249-V255 HydrophobicContact CG-CG2 4.32Å; V253-V255 HydrophobicContact CG1-CG2 4.5Å; V255-I257 HydrophobicContact CG1-CD1 4.35Å; V255-I257 HydrophobicContact CG1-CG1 3.89Å; V255-I266 HydrophobicContact CG1-CD1 3.88Å
256	V	84.7	Confident	84.1	Confident	116 Å²	116	109.4 Å²	109.4	70%	0.703	57%	0.572	S	S	*	*			trans	-88.2	119.4	173	-177	0	0	0	0	108.3	Q254	Q254-V256 PolarHBondContact O-N 2.73Å
257	I	84.4	Confident	84.1	Confident	68 Å²	68	111.9 Å²	111.9	35%	0.349	58%	0.579	S	S	.	*			trans	-107.5	112.7	-175.6	-55.9	175.7	0	0	0	108.3	V255 D259 L263 I266	V255-I257 HydrophobicContact CG1-CD1 4.35Å; V255-I257 HydrophobicContact CG1-CG1 3.89Å; I257-D259 WeakPolarHBondContact CG2-O 3.47Å; I257-L263 HydrophobicContact CD1-CB 4.07Å; I257-L263 HydrophobicContact CD1-CD1 3.63Å; I257-L263 HydrophobicContact CD1-CG 3.71Å; I257-L263 HydrophobicContact CG2-CB 4.21Å; I257-I266 HydrophobicContact CG1-CD1 4.49Å
258	N	87.6	Confident	84.3	Confident	141 Å²	141	115.5 Å²	115.5	75%	0.754	59%	0.593	S	S	*	*	S	Bend	trans	-92.4	-25.9	176.5	-62.6	-19.1	0	0	0	112.3
259	D	89.6	Confident	84.7	Confident	74 Å²	74	112.8 Å²	112.8	40%	0.396	58%	0.578	S	S	.	*	S	Bend	trans	-119.5	126.2	-178.3	-57.9	-45.6	0	0	0	110.5	I257 E261 K262	I257-D259 WeakPolarHBondContact CG2-O 3.47Å; D259-E261 VanDerWaalsContact C-N 3.31Å; D259-E261 PolarHBondContact O-N 2.82Å; D259-K262 HydrophobicContact CB-CD 4.13Å; D259-K262 HydrophobicContact CB-CG 4.24Å; D259-K262 PolarHBondContact O-N 3.37Å; D259-K262 WeakPolarHBondContact OD2-CE 3.43Å; D259-K262 IonicContact OD2-NZ 3.74Å; D259-K262 PolarHBondContact OD2-NZ 2.8Å
260	P	85.7	Confident	84.9	Confident	109 Å²	109	110.5 Å²	110.5	71%	0.708	57%	0.566	S	S	*	*	H	α-helix	trans	-59.8	-35.4	-179.8	-23.4	32.4	0	0	0	114	K262 L263	P260-K262 VanDerWaalsContact C-N 3.29Å; P260-K262 PolarHBondContact O-N 3.35Å; P260-L263 WeakPolarHBondContact O-CB 3.48Å; P260-L263 PolarHBondContact O-N 2.95Å; P260-L263 VanDerWaalsContact O-N 3.12Å
261	E	85.3	Confident	85	Confident	157 Å²	157	103.2 Å²	103.2	73%	0.734	54%	0.537	S	S	*	.	H	α-helix	trans	-65.7	-30.9	-178.1	-64.5	-177.3	170.6	0	0	113.1	D259 L263 D264	D259-E261 VanDerWaalsContact C-N 3.31Å; D259-E261 PolarHBondContact O-N 2.82Å; E261-L263 PolarHBondContact O-N 3.46Å; E261-D264 PolarHBondContact O-N 3.49Å
262	K	85.4	Confident	85.3	Confident	109 Å²	109	96.8 Å²	96.8	47%	0.474	51%	0.506	S	S	.	.	H	α-helix	trans	-70.5	-22.3	177.1	-70.3	177.6	-178.6	153.9	0	112.1	D259 P260 D264 Q265 I266	D259-K262 HydrophobicContact CB-CD 4.13Å; D259-K262 HydrophobicContact CB-CG 4.24Å; D259-K262 PolarHBondContact O-N 3.37Å; D259-K262 WeakPolarHBondContact OD2-CE 3.43Å; D259-K262 IonicContact OD2-NZ 3.74Å; D259-K262 PolarHBondContact OD2-NZ 2.8Å; P260-K262 VanDerWaalsContact C-N 3.29Å; P260-K262 PolarHBondContact O-N 3.35Å; K262-D264 VanDerWaalsContact C-N 3.35Å; K262-Q265 PolarHBondContact O-N 3.02Å; K262-I266 WeakPolarHBondContact O-CD1 3.35Å; K262-I266 WeakPolarHBondContact O-CG1 3.45Å; K262-I266 PolarHBondContact O-N 2.95Å
263	L	84.6	Confident	85.6	Confident	52 Å²	52	94.9 Å²	94.9	27%	0.272	48%	0.476	S	S	.	.	H	α-helix	trans	-62.8	-43.3	178	-167.5	150.7	0	0	0	111.2	I257 P260 E261 I266 R267	I257-L263 HydrophobicContact CD1-CB 4.07Å; I257-L263 HydrophobicContact CD1-CD1 3.63Å; I257-L263 HydrophobicContact CD1-CG 3.71Å; I257-L263 HydrophobicContact CG2-CB 4.21Å; P260-L263 WeakPolarHBondContact O-CB 3.48Å; P260-L263 PolarHBondContact O-N 2.95Å; P260-L263 VanDerWaalsContact O-N 3.12Å; E261-L263 PolarHBondContact O-N 3.46Å; L263-I266 PolarHBondContact O-N 2.86Å; L263-R267 HydrophobicContact CD2-CG 4.45Å; L263-R267 WeakPolarHBondContact O-CG 3.23Å; L263-R267 PolarHBondContact O-N 2.9Å; L263-R267 VanDerWaalsContact O-N 3.09Å
264	D	85.2	Confident	85.7	Confident	88 Å²	88	91 Å²	91	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-70.1	-37.5	178.6	-72.5	-25.1	0	0	0	111.8	E261 K262 I266 R267 Q268	E261-D264 PolarHBondContact O-N 3.49Å; K262-D264 VanDerWaalsContact C-N 3.35Å; D264-I266 VanDerWaalsContact C-N 3.35Å; D264-I266 PolarHBondContact O-N 3.02Å; D264-R267 PolarHBondContact O-N 3.47Å; D264-R267 IonicContact OD1-NH1 3.9Å; D264-Q268 WeakPolarHBondContact O-CB 3.31Å; D264-Q268 WeakPolarHBondContact O-CG 3.31Å; D264-Q268 PolarHBondContact O-N 3.44Å
265	Q	86.3	Confident	86.1	Confident	124 Å²	124	85.9 Å²	85.9	58%	0.579	43%	0.428	S	S	*	.	H	α-helix	trans	-62.8	-40.2	173.9	-66.1	178.9	2.7	0	0	112.2	K262 Q268 R269	K262-Q265 PolarHBondContact O-N 3.02Å; Q265-Q268 PolarHBondContact O-N 2.86Å; Q265-R269 WeakPolarHBondContact O-CB 3.28Å; Q265-R269 PolarHBondContact O-N 2.86Å
266	I	85.9	Confident	86.5	Confident	50 Å²	50	85.6 Å²	85.6	26%	0.256	42%	0.422	S	S	.	.	H	α-helix	trans	-64.4	-45.8	176.7	-68.7	161.9	0	0	0	110.3	V255 I257 K262 L263 D264 Q268 R269 E270	V255-I266 HydrophobicContact CG1-CD1 3.88Å; I257-I266 HydrophobicContact CG1-CD1 4.49Å; K262-I266 WeakPolarHBondContact O-CD1 3.35Å; K262-I266 WeakPolarHBondContact O-CG1 3.45Å; K262-I266 PolarHBondContact O-N 2.95Å; L263-I266 PolarHBondContact O-N 2.86Å; D264-I266 VanDerWaalsContact C-N 3.35Å; D264-I266 PolarHBondContact O-N 3.02Å; I266-Q268 VanDerWaalsContact C-N 3.34Å; I266-Q268 PolarHBondContact O-N 3.44Å; I266-R269 PolarHBondContact O-N 3.34Å; I266-E270 WeakPolarHBondContact O-CG 3.28Å; I266-E270 PolarHBondContact O-N 3.45Å
267	R	84.5	Confident	86.8	Confident	152 Å²	152	82.7 Å²	82.7	57%	0.574	40%	0.398	S	S	*	.	H	α-helix	trans	-61.6	-39.9	176.3	-73.7	176.6	172.5	168.9	-2.6	112.8	L263 D264 S271	L263-R267 HydrophobicContact CD2-CG 4.45Å; L263-R267 WeakPolarHBondContact O-CG 3.23Å; L263-R267 PolarHBondContact O-N 2.9Å; L263-R267 VanDerWaalsContact O-N 3.09Å; D264-R267 PolarHBondContact O-N 3.47Å; D264-R267 IonicContact OD1-NH1 3.9Å; R267-S271 PolarHBondContact O-N 3.13Å; R267-S271 PolarHBondContact O-OG 2.65Å
268	Q	86.5	Confident	87	Confident	120 Å²	120	79.5 Å²	79.5	56%	0.561	38%	0.381	S	S	*	.	H	α-helix	trans	-63.4	-47.7	173.8	-76.1	176.6	5.9	0	0	110.3	D264 Q265 I266 E270 S271 D272	D264-Q268 WeakPolarHBondContact O-CB 3.31Å; D264-Q268 WeakPolarHBondContact O-CG 3.31Å; D264-Q268 PolarHBondContact O-N 3.44Å; Q265-Q268 PolarHBondContact O-N 2.86Å; I266-Q268 VanDerWaalsContact C-N 3.34Å; I266-Q268 PolarHBondContact O-N 3.44Å; Q268-E270 VanDerWaalsContact C-N 3.33Å; Q268-E270 PolarHBondContact O-N 2.99Å; Q268-S271 CarbonylContact O-C 3.56Å; Q268-S271 WeakPolarHBondContact O-CA 3.18Å; Q268-S271 WeakPolarHBondContact O-CB 3.39Å; Q268-S271 PolarHBondContact O-N 3.15Å; Q268-D272 VanDerWaalsContact O-CG 3.28Å; Q268-D272 PolarHBondContact O-N 3.47Å
269	R	87.8	Confident	87.2	Confident	125 Å²	125	77.7 Å²	77.7	47%	0.472	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-40.2	179.7	-169.8	63.8	-175.9	153.9	7	112.9	Q265 I266 S271 D272 I273 E276	Q265-R269 WeakPolarHBondContact O-CB 3.28Å; Q265-R269 PolarHBondContact O-N 2.86Å; I266-R269 PolarHBondContact O-N 3.34Å; R269-S271 PolarHBondContact O-N 3.4Å; R269-D272 PolarHBondContact O-N 2.94Å; R269-I273 HydrophobicContact CG-CD1 4.29Å; R269-I273 WeakPolarHBondContact O-CD1 3.32Å; R269-I273 VanDerWaalsContact O-CG1 3.23Å; R269-I273 WeakPolarHBondContact O-CG1 3.37Å; R269-I273 PolarHBondContact O-N 3.31Å; R269-E276 IonicContact CZ-OE1 3.44Å; R269-E276 IonicContact NH1-OE1 2.65Å; R269-E276 PolarHBondContact NH1-OE1 2.91Å; R269-E276 IonicContact NH2-OE1 3.51Å; R269-E276 IonicContact NH2-OE2 2.64Å
270	E	85.1	Confident	87.2	Confident	53 Å²	53	77.7 Å²	77.7	25%	0.248	37%	0.365	C	S	.	.	H	α-helix	trans	-58.5	-34.5	174.5	-74	-178.2	166	0	0	112.8	I266 Q268	I266-E270 WeakPolarHBondContact O-CG 3.28Å; I266-E270 PolarHBondContact O-N 3.45Å; Q268-E270 VanDerWaalsContact C-N 3.33Å; Q268-E270 PolarHBondContact O-N 2.99Å
271	S	85.2	Confident	87.5	Confident	20 Å²	20	72.5 Å²	72.5	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-81.6	-38.7	177.7	-55.4	0	0	0	0	111.7	R267 Q268 R269 T274 K275	R267-S271 PolarHBondContact O-N 3.13Å; R267-S271 PolarHBondContact O-OG 2.65Å; Q268-S271 CarbonylContact O-C 3.56Å; Q268-S271 WeakPolarHBondContact O-CA 3.18Å; Q268-S271 WeakPolarHBondContact O-CB 3.39Å; Q268-S271 PolarHBondContact O-N 3.15Å; R269-S271 PolarHBondContact O-N 3.4Å; S271-T274 PolarHBondContact O-N 3.32Å; S271-K275 PolarHBondContact O-N 3.42Å
272	D	88.9	Confident	87.8	Confident	60 Å²	60	66.6 Å²	66.6	32%	0.321	30%	0.304	S	S	.	.	H	α-helix	trans	-65.5	-37.7	179.8	-70	-28.7	0	0	0	112.1	Q268 R269 T274 K275 E276	Q268-D272 VanDerWaalsContact O-CG 3.28Å; Q268-D272 PolarHBondContact O-N 3.47Å; R269-D272 PolarHBondContact O-N 2.94Å; D272-T274 VanDerWaalsContact C-N 3.27Å; D272-T274 PolarHBondContact O-N 2.66Å; D272-K275 WeakPolarHBondContact O-CB 3.48Å; D272-K275 PolarHBondContact O-N 2.8Å; D272-K275 VanDerWaalsContact O-N 3.12Å; D272-E276 WeakPolarHBondContact O-CB 3.39Å; D272-E276 WeakPolarHBondContact O-CG 3.42Å; D272-E276 PolarHBondContact O-N 3.39Å
273	I	88	Confident	88	Confident	43 Å²	43	65.6 Å²	65.6	22%	0.221	32%	0.317	C	S	.	.	H	α-helix	trans	-55.3	-46.2	174.7	-69.9	161.5	0	0	0	110.5	R269 E276 R277	R269-I273 HydrophobicContact CG-CD1 4.29Å; R269-I273 WeakPolarHBondContact O-CD1 3.32Å; R269-I273 VanDerWaalsContact O-CG1 3.23Å; R269-I273 WeakPolarHBondContact O-CG1 3.37Å; R269-I273 PolarHBondContact O-N 3.31Å; I273-E276 PolarHBondContact O-N 3.07Å; I273-R277 WeakPolarHBondContact O-CG 3.45Å; I273-R277 PolarHBondContact O-N 2.9Å; I273-R277 VanDerWaalsContact O-N 3.17Å
274	T	87	Confident	88.2	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-70.8	-35.2	-179.8	-52.5	0	0	0	0	111.4	Q245 T247 S271 D272 R277 I278 C299	Q245-T274 PolarHBondContact O-OG1 3.41Å; T247-T274 PolarHBondContact OG1-OG1 2.88Å; S271-T274 PolarHBondContact O-N 3.32Å; D272-T274 VanDerWaalsContact C-N 3.27Å; D272-T274 PolarHBondContact O-N 2.66Å; T274-R277 PolarHBondContact O-N 2.92Å; T274-I278 HydrophobicContact CG2-CD1 4.2Å; T274-I278 VanDerWaalsContact O-CG1 3.32Å; T274-I278 WeakPolarHBondContact O-CG1 3.47Å; T274-I278 PolarHBondContact O-N 3.46Å; T274-I278 VanDerWaalsContact O-N 3.1Å; T274-C299 WeakPolarHBondContact CG2-SG 3.33Å
275	K	89.8	Confident	88.4	Confident	67 Å²	67	60.7 Å²	60.7	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-62.5	-47.3	173.6	-175.1	-174.4	-177.7	-179	0	112.1	S271 D272 R277 I278 Q279 Y302	S271-K275 PolarHBondContact O-N 3.42Å; D272-K275 WeakPolarHBondContact O-CB 3.48Å; D272-K275 PolarHBondContact O-N 2.8Å; D272-K275 VanDerWaalsContact O-N 3.12Å; K275-R277 VanDerWaalsContact C-N 3.3Å; K275-R277 PolarHBondContact O-N 3.42Å; K275-I278 PolarHBondContact O-N 3.47Å; K275-Q279 WeakPolarHBondContact O-CG 3.45Å; K275-Q279 PolarHBondContact O-N 2.84Å; K275-Y302 HydrophobicContact CB-CE2 4.11Å; K275-Y302 HydrophobicContact CD-CE1 4.12Å; K275-Y302 HydrophobicContact CD-CE2 4.48Å; K275-Y302 HydrophobicContact CG-CD2 4.47Å; K275-Y302 HydrophobicContact CG-CE1 4.1Å; K275-Y302 HydrophobicContact CG-CE2 3.95Å
276	E	90.1	Very high	88.6	Confident	67 Å²	67	54.9 Å²	54.9	31%	0.313	27%	0.271	S	S	.	.	H	α-helix	trans	-58	-43	177.2	-73.8	173.1	-163.3	0	0	110.9	R269 D272 I273 Q279 K280	R269-E276 IonicContact CZ-OE1 3.44Å; R269-E276 IonicContact NH1-OE1 2.65Å; R269-E276 PolarHBondContact NH1-OE1 2.91Å; R269-E276 IonicContact NH2-OE1 3.51Å; R269-E276 IonicContact NH2-OE2 2.64Å; D272-E276 WeakPolarHBondContact O-CB 3.39Å; D272-E276 WeakPolarHBondContact O-CG 3.42Å; D272-E276 PolarHBondContact O-N 3.39Å; I273-E276 PolarHBondContact O-N 3.07Å; E276-Q279 PolarHBondContact O-N 3.24Å; E276-K280 WeakPolarHBondContact O-CG 3.38Å; E276-K280 PolarHBondContact O-N 3.39Å
277	R	89.3	Confident	89	Confident	55 Å²	55	55.6 Å²	55.6	21%	0.208	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-45.6	176	-72.4	175.6	175.8	167.4	1.1	112.8	T247 I273 T274 K275 Q279 K280 I281 L334 E341	T247-R277 PolarHBondContact OG1-NH1 2.87Å; I273-R277 WeakPolarHBondContact O-CG 3.45Å; I273-R277 PolarHBondContact O-N 2.9Å; I273-R277 VanDerWaalsContact O-N 3.17Å; T274-R277 PolarHBondContact O-N 2.92Å; K275-R277 VanDerWaalsContact C-N 3.3Å; K275-R277 PolarHBondContact O-N 3.42Å; R277-Q279 VanDerWaalsContact C-N 3.35Å; R277-K280 PolarHBondContact O-N 3.09Å; R277-I281 WeakPolarHBondContact O-CD1 3.44Å; R277-I281 WeakPolarHBondContact O-CG1 3.25Å; R277-I281 PolarHBondContact O-N 3.36Å; R277-I281 VanDerWaalsContact O-N 3.16Å; R277-L334 HydrophobicContact CB-CD1 3.62Å; R277-L334 HydrophobicContact CG-CD1 3.54Å; R277-E341 VanDerWaalsContact CG-OE2 3.27Å; R277-E341 WeakPolarHBondContact CG-OE2 3.36Å; R277-E341 IonicContact CZ-OE1 2.83Å; R277-E341 IonicContact CZ-OE2 3.11Å; R277-E341 IonicContact NE-OE1 3.84Å; R277-E341 PolarHBondContact NE-OE1 2.88Å; R277-E341 VanDerWaalsContact NE-OE1 3.15Å; R277-E341 IonicContact NE-OE2 2.72Å; R277-E341 PolarHBondContact NE-OE2 3.36Å; R277-E341 IonicContact NH2-OE1 2.66Å; R277-E341 PolarHBondContact NH2-OE1 3.12Å; R277-E341 IonicContact NH2-OE2 3.74Å
278	I	90.1	Very high	89.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-43.5	178	-67.9	164.5	0	0	0	110.4	L244 T274 K275 K280 I281 L282 C299 Y302 F303	L244-I278 HydrophobicContact CD1-CG1 4.37Å; L244-I278 HydrophobicContact CD2-CG1 4.39Å; T274-I278 HydrophobicContact CG2-CD1 4.2Å; T274-I278 VanDerWaalsContact O-CG1 3.32Å; T274-I278 WeakPolarHBondContact O-CG1 3.47Å; T274-I278 PolarHBondContact O-N 3.46Å; T274-I278 VanDerWaalsContact O-N 3.1Å; K275-I278 PolarHBondContact O-N 3.47Å; I278-K280 VanDerWaalsContact C-N 3.31Å; I278-K280 PolarHBondContact O-N 3.1Å; I278-I281 PolarHBondContact O-N 3.06Å; I278-L282 HydrophobicContact CG2-CD1 3.68Å; I278-L282 HydrophobicContact CG2-CG 4.26Å; I278-L282 WeakPolarHBondContact O-CG 3.48Å; I278-L282 PolarHBondContact O-N 3.27Å; I278-C299 HydrophobicContact CD1-CB 3.51Å; I278-Y302 HydrophobicContact CD1-CD2 4.15Å; I278-F303 HydrophobicContact CB-CZ 4.38Å; I278-F303 HydrophobicContact CD1-CE2 4.1Å; I278-F303 HydrophobicContact CD1-CZ 4.42Å; I278-F303 HydrophobicContact CG1-CE2 4.13Å; I278-F303 HydrophobicContact CG1-CZ 3.95Å; I278-F303 HydrophobicContact CG2-CD1 4.35Å; I278-F303 HydrophobicContact CG2-CE1 3.81Å; I278-F303 HydrophobicContact CG2-CE2 4.1Å; I278-F303 HydrophobicContact CG2-CZ 3.68Å
279	Q	91.4	Very high	89.8	Confident	104 Å²	104	42.6 Å²	42.6	49%	0.486	22%	0.221	S	C	.	.	H	α-helix	trans	-60.8	-39	177	-74.6	180	-16.4	0	0	112.3	K275 E276 R277 L282 A283	K275-Q279 WeakPolarHBondContact O-CG 3.45Å; K275-Q279 PolarHBondContact O-N 2.84Å; E276-Q279 PolarHBondContact O-N 3.24Å; R277-Q279 VanDerWaalsContact C-N 3.35Å; Q279-L282 PolarHBondContact O-N 2.82Å; Q279-A283 WeakPolarHBondContact O-CB 3.34Å; Q279-A283 PolarHBondContact O-N 2.64Å
280	K	89.9	Confident	90.2	Very high	73 Å²	73	36.7 Å²	36.7	32%	0.317	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-42.2	174.6	-71.3	170.3	-178.1	-178.4	0	112.4	E276 R277 I278 A283 A284 E341	E276-K280 WeakPolarHBondContact O-CG 3.38Å; E276-K280 PolarHBondContact O-N 3.39Å; R277-K280 PolarHBondContact O-N 3.09Å; I278-K280 VanDerWaalsContact C-N 3.31Å; I278-K280 PolarHBondContact O-N 3.1Å; K280-A283 PolarHBondContact O-N 3.09Å; K280-A284 PolarHBondContact O-N 3.44Å; K280-A284 VanDerWaalsContact O-N 3.11Å; K280-E341 VanDerWaalsContact CD-O 3.28Å; K280-E341 WeakPolarHBondContact CD-O 3.28Å; K280-E341 VanDerWaalsContact CE-O 3.31Å; K280-E341 WeakPolarHBondContact CE-O 3.44Å; K280-E341 PolarHBondContact NZ-O 3.4Å
281	I	90.7	Very high	90.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-43.7	177	-65.2	158.9	0	0	0	110.8	A238 L240 R277 I278 A284 A286 V289 L334 F343	A238-I281 HydrophobicContact CB-CG2 4.35Å; L240-I281 HydrophobicContact CD1-CD1 3.78Å; R277-I281 WeakPolarHBondContact O-CD1 3.44Å; R277-I281 WeakPolarHBondContact O-CG1 3.25Å; R277-I281 PolarHBondContact O-N 3.36Å; R277-I281 VanDerWaalsContact O-N 3.16Å; I278-I281 PolarHBondContact O-N 3.06Å; I281-A284 PolarHBondContact O-N 2.88Å; I281-A286 HydrophobicContact CG2-CB 3.74Å; I281-A286 WeakPolarHBondContact O-CB 2.98Å; I281-A286 PolarHBondContact O-N 2.85Å; I281-V289 HydrophobicContact CG2-CG2 4.06Å; I281-L334 HydrophobicContact CD1-CD2 4.49Å; I281-L334 HydrophobicContact CG1-CD2 4.31Å; I281-F343 HydrophobicContact CG1-CB 4.43Å; I281-F343 HydrophobicContact CG1-CD1 4.44Å; I281-F343 HydrophobicContact CG1-CD2 4.37Å; I281-F343 HydrophobicContact CG1-CG 4.15Å
282	L	91.3	Very high	91	Very high	33 Å²	33	34.8 Å²	34.8	17%	0.173	19%	0.19	C	C	.	.	H	α-helix	trans	-69.4	-38.2	177.9	-68.4	169.5	0	0	0	112.1	I278 Q279 A284 G285 F303 S306 A308	I278-L282 HydrophobicContact CG2-CD1 3.68Å; I278-L282 HydrophobicContact CG2-CG 4.26Å; I278-L282 WeakPolarHBondContact O-CG 3.48Å; I278-L282 PolarHBondContact O-N 3.27Å; Q279-L282 PolarHBondContact O-N 2.82Å; L282-A284 VanDerWaalsContact C-N 3.27Å; L282-A284 PolarHBondContact O-N 3.39Å; L282-G285 VanDerWaalsContact O-CA 3.32Å; L282-G285 WeakPolarHBondContact O-CA 3.44Å; L282-G285 PolarHBondContact O-N 2.82Å; L282-F303 HydrophobicContact CD2-CD1 4.1Å; L282-F303 HydrophobicContact CD2-CE1 4.29Å; L282-F303 HydrophobicContact CG-CE1 4.46Å; L282-S306 WeakPolarHBondContact CD1-OG 3.28Å; L282-A308 HydrophobicContact CD2-CB 3.72Å
283	A	90.7	Very high	91.1	Very high	88 Å²	88	32.4 Å²	32.4	73%	0.727	18%	0.18	S	C	*	.	H	α-helix	trans	-64.8	-30.6	177.1	0	0	0	0	0	112.5	Q279 K280 G285	Q279-A283 WeakPolarHBondContact O-CB 3.34Å; Q279-A283 PolarHBondContact O-N 2.64Å; K280-A283 PolarHBondContact O-N 3.09Å; A283-G285 PolarHBondContact O-N 3.41Å
284	A	88.6	Confident	91.2	Very high	17 Å²	17	30.8 Å²	30.8	14%	0.14	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.9	169.6	0	0	0	0	0	113.3	K280 I281 L282 F343 L348	K280-A284 PolarHBondContact O-N 3.44Å; K280-A284 VanDerWaalsContact O-N 3.11Å; I281-A284 PolarHBondContact O-N 2.88Å; L282-A284 VanDerWaalsContact C-N 3.27Å; L282-A284 PolarHBondContact O-N 3.39Å; A284-F343 HydrophobicContact CB-CD1 3.6Å; A284-F343 HydrophobicContact CB-CE1 4.23Å; A284-F343 WeakPolarHBondContact CB-O 3.46Å; A284-L348 HydrophobicContact CB-CD1 4.31Å; A284-L348 VanDerWaalsContact O-CD1 3.28Å; A284-L348 WeakPolarHBondContact O-CD1 3.28Å
285	G	89.2	Confident	91.5	Very high	20 Å²	20	31 Å²	31	21%	0.206	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	28.7	179.1	0	0	0	0	0	113.8	K236 L282 A283 N287	K236-G285 WeakPolarHBondContact CB-O 3.34Å; K236-G285 WeakPolarHBondContact CD-O 3.13Å; L282-G285 VanDerWaalsContact O-CA 3.32Å; L282-G285 WeakPolarHBondContact O-CA 3.44Å; L282-G285 PolarHBondContact O-N 2.82Å; A283-G285 PolarHBondContact O-N 3.41Å; G285-N287 PolarHBondContact O-N 3.2Å
286	A	91.7	Very high	91.5	Very high	2 Å²	2	30.1 Å²	30.1	2%	0.017	17%	0.173	C	C	.	.			trans	-70.5	122.6	174.2	0	0	0	0	0	110.8	A238 I281 V289 L348	A238-A286 HydrophobicContact CB-CB 4.02Å; I281-A286 HydrophobicContact CG2-CB 3.74Å; I281-A286 WeakPolarHBondContact O-CB 2.98Å; I281-A286 PolarHBondContact O-N 2.85Å; A286-V289 HydrophobicContact CB-CG2 4.2Å; A286-L348 HydrophobicContact CB-CD2 3.77Å
287	N	92.9	Very high	91.4	Very high	65 Å²	65	32.3 Å²	32.3	35%	0.348	19%	0.187	S	C	.	.	S	Bend	trans	-100.1	-26.9	175.7	-68	-1.7	0	0	0	111.8	I232 K236 G285 A308 M309	I232-N287 HydrophobicContact CD1-CB 4.46Å; I232-N287 VanDerWaalsContact CD1-O 3.28Å; I232-N287 WeakPolarHBondContact CD1-O 3.08Å; I232-N287 HydrophobicContact CG2-CB 3.99Å; K236-N287 PolarHBondContact O-N 2.69Å; G285-N287 PolarHBondContact O-N 3.2Å; N287-A308 CarbonylContact O-C 3.57Å; N287-A308 WeakPolarHBondContact O-CA 2.99Å; N287-M309 PolarHBondContact O-N 3.35Å
288	V	94.1	Very high	91.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.7	177.3	177.8	0	0	0	0	108.1	I232 A235 K236 V237 A238 L290 M309 V354	I232-V288 HydrophobicContact CB-CG2 4.48Å; I232-V288 HydrophobicContact CD1-CG2 3.87Å; I232-V288 HydrophobicContact CG2-CG2 4.49Å; A235-V288 HydrophobicContact CB-CG2 3.89Å; K236-V288 PolarHBondContact O-N 3.23Å; V237-V288 CarbonylContact C-O 3.58Å; V237-V288 WeakPolarHBondContact CA-O 3.15Å; V237-V288 HydrophobicContact CG1-CG1 4.35Å; V237-V288 HydrophobicContact CG2-CB 4.21Å; V237-V288 HydrophobicContact CG2-CG1 4.48Å; A238-V288 PolarHBondContact N-O 3.2Å; V288-L290 HydrophobicContact CG1-CD2 4.15Å; V288-L290 HydrophobicContact CG1-CG 4.37Å; V288-M309 CarbonylContact C-O 3.56Å; V288-M309 WeakPolarHBondContact CA-O 3.28Å; V288-M309 HydrophobicContact CG2-CB 4.36Å; V288-V354 HydrophobicContact CG1-CG1 4.35Å; V288-V354 HydrophobicContact CG2-CB 3.98Å; V288-V354 HydrophobicContact CG2-CG1 4.16Å; V288-V354 HydrophobicContact CG2-CG2 4.04Å
289	V	94.4	Very high	91.2	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.2	-179.8	-176.8	0	0	0	0	109.2	A238 L240 I281 A286 F303 M309 A310 V311	A238-V289 HydrophobicContact CB-CG2 4.35Å; L240-V289 HydrophobicContact CD1-CG1 3.58Å; L240-V289 HydrophobicContact CG-CG1 4.26Å; I281-V289 HydrophobicContact CG2-CG2 4.06Å; A286-V289 HydrophobicContact CB-CG2 4.2Å; V289-F303 HydrophobicContact CB-CE1 4.37Å; V289-F303 HydrophobicContact CG2-CD1 4.46Å; V289-F303 HydrophobicContact CG2-CE1 3.85Å; V289-M309 PolarHBondContact N-O 2.67Å; V289-A310 CarbonylContact O-C 3.52Å; V289-A310 WeakPolarHBondContact O-CA 3.23Å; V289-V311 PolarHBondContact O-N 3.36Å
290	L	95.1	Very high	91.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.9	176.1	-56.2	179.7	0	0	0	108.6	V237 A238 L240 V288 V311 V314 L319 I322 I367	V237-L290 HydrophobicContact CG1-CD1 3.83Å; V237-L290 HydrophobicContact CG1-CG 4.12Å; A238-L290 PolarHBondContact O-N 3.34Å; L240-L290 PolarHBondContact N-O 2.89Å; V288-L290 HydrophobicContact CG1-CD2 4.15Å; V288-L290 HydrophobicContact CG1-CG 4.37Å; L290-V311 HydrophobicContact CD2-CB 3.63Å; L290-V311 HydrophobicContact CD2-CG1 4.34Å; L290-V311 HydrophobicContact CD2-CG2 3.55Å; L290-V314 HydrophobicContact CB-CG2 4.38Å; L290-L319 HydrophobicContact CB-CD1 3.54Å; L290-L319 HydrophobicContact CD1-CD1 4.22Å; L290-I322 HydrophobicContact CD1-CD1 3.87Å; L290-I322 HydrophobicContact CD1-CG2 3.83Å; L290-I367 HydrophobicContact CD1-CD1 4.22Å
291	T	94.1	Very high	91.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	140.3	174.1	176.6	0	0	0	0	112.4	L240 F242 G293 I295 V311 R312 R313 V314	L240-T291 VanDerWaalsContact O-CA 3.31Å; L240-T291 WeakPolarHBondContact O-CA 3.46Å; F242-T291 PolarHBondContact O-OG1 3.33Å; T291-G293 VanDerWaalsContact C-N 3.27Å; T291-G293 PolarHBondContact OG1-N 3.4Å; T291-I295 HydrophobicContact CG2-CD1 3.71Å; T291-I295 HydrophobicContact CG2-CG1 3.49Å; T291-I295 VanDerWaalsContact CG2-CG1 3.49Å; T291-V311 WeakPolarHBondContact CG2-O 3.48Å; T291-V311 PolarHBondContact N-O 3.41Å; T291-R312 HydrophobicContact CG2-CB 4.46Å; T291-R313 PolarHBondContact O-N 2.88Å; T291-V314 PolarHBondContact O-N 3.48Å
292	T	94.1	Very high	91.2	Very high	33 Å²	33	34.7 Å²	34.7	20%	0.202	20%	0.2	C	C	.	.	S	Bend	trans	-70	-27.7	167.8	62.2	0	0	0	0	112.5	L240 D241 R313 V314 K316 L319	L240-T292 PolarHBondContact O-N 2.89Å; D241-T292 VanDerWaalsContact CA-OG1 3.32Å; D241-T292 WeakPolarHBondContact CA-OG1 3.46Å; D241-T292 HydrophobicContact CB-CG2 4.4Å; D241-T292 WeakPolarHBondContact OD1-CB 3.43Å; D241-T292 VanDerWaalsContact OD1-CG2 3.24Å; D241-T292 WeakPolarHBondContact OD1-CG2 3.44Å; D241-T292 PolarHBondContact OD1-OG1 2.9Å; T292-R313 WeakPolarHBondContact O-CA 3.47Å; T292-V314 WeakPolarHBondContact CA-O 3.08Å; T292-K316 HydrophobicContact CG2-CB 4.23Å; T292-L319 HydrophobicContact CG2-CB 4.36Å; T292-L319 HydrophobicContact CG2-CD2 3.49Å; T292-L319 VanDerWaalsContact CG2-CD2 3.49Å
293	G	90.6	Very high	91.2	Very high	10 Å²	10	33.1 Å²	33.1	10%	0.103	19%	0.191	C	C	.	.	S	Bend	trans	-83.6	-174.5	-178.8	0	0	0	0	0	113.9	S243 T291 R313	S243-G293 VanDerWaalsContact OG-CA 3.24Å; S243-G293 WeakPolarHBondContact OG-CA 3.27Å; T291-G293 VanDerWaalsContact C-N 3.27Å; T291-G293 PolarHBondContact OG1-N 3.4Å; G293-R313 PolarHBondContact O-N 3.02Å
294	G	90.9	Very high	91.3	Very high	10 Å²	10	30.5 Å²	30.5	10%	0.103	17%	0.167	C	C	.	.			trans	-81.2	154.7	169.2	0	0	0	0	0	111.6	S243 L244	S243-G294 CarbonylContact C-O 3.52Å; S243-G294 WeakPolarHBondContact CA-O 3.35Å; S243-G294 WeakPolarHBondContact CB-O 3.16Å; S243-G294 PolarHBondContact OG-N 3.45Å; L244-G294 PolarHBondContact N-O 3.13Å
295	I	91.8	Very high	91.4	Very high	6 Å²	6	35.1 Å²	35.1	3%	0.031	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-114.8	130.1	165.6	-52.9	176.6	0	0	0	107	L244 T291 C299 L300 F303 A310 R312	L244-I295 HydrophobicContact CB-CG1 4.34Å; L244-I295 HydrophobicContact CB-CG2 4.25Å; L244-I295 WeakPolarHBondContact O-CA 3.44Å; T291-I295 HydrophobicContact CG2-CD1 3.71Å; T291-I295 HydrophobicContact CG2-CG1 3.49Å; T291-I295 VanDerWaalsContact CG2-CG1 3.49Å; I295-C299 HydrophobicContact CG2-CB 3.79Å; I295-L300 HydrophobicContact CB-CD2 4.06Å; I295-L300 HydrophobicContact CD1-CD2 4.32Å; I295-L300 HydrophobicContact CG2-CD2 3.63Å; I295-L300 HydrophobicContact CG2-CG 3.94Å; I295-F303 HydrophobicContact CG2-CE2 4.43Å; I295-A310 HydrophobicContact CD1-CB 3.75Å; I295-R312 HydrophobicContact CB-CB 4.38Å; I295-R312 HydrophobicContact CD1-CB 4.16Å; I295-R312 HydrophobicContact CG1-CB 3.94Å
296	D	90.9	Very high	91.4	Very high	50 Å²	50	37.7 Å²	37.7	27%	0.267	20%	0.204	S	C	.	.			trans	-75.7	150.3	175.2	-170	30.1	0	0	0	111.4	L244 Q245 M298 C299 L300	L244-D296 PolarHBondContact O-N 2.65Å; Q245-D296 HydrophobicContact CB-CB 4.49Å; Q245-D296 HydrophobicContact CG-CB 4.33Å; D296-M298 VanDerWaalsContact C-N 3.28Å; D296-M298 PolarHBondContact O-N 2.94Å; D296-C299 WeakPolarHBondContact O-CA 3.44Å; D296-C299 VanDerWaalsContact O-CB 3.24Å; D296-C299 WeakPolarHBondContact O-CB 3.28Å; D296-C299 PolarHBondContact O-N 3.44Å; D296-L300 PolarHBondContact O-N 3.32Å; D296-L300 VanDerWaalsContact O-N 3.16Å
297	D	87.3	Confident	91.2	Very high	112 Å²	112	39.4 Å²	39.4	60%	0.599	22%	0.222	S	C	*	.	H	α-helix	trans	-65.5	-33.6	-171.6	-67.2	-19.5	0	0	0	112.3	C299 L300 K301 R312	D297-C299 PolarHBondContact O-N 2.78Å; D297-L300 WeakPolarHBondContact O-CB 3.3Å; D297-L300 PolarHBondContact O-N 3.34Å; D297-K301 PolarHBondContact O-N 2.79Å; D297-R312 IonicContact OD1-NH1 3.84Å
298	M	86.8	Confident	91.1	Very high	84 Å²	84	36.4 Å²	36.4	41%	0.414	21%	0.206	S	C	.	.	H	α-helix	trans	-60.6	-33.1	172.7	-171	-179.8	-172.8	0	0	112	D296	D296-M298 VanDerWaalsContact C-N 3.28Å; D296-M298 PolarHBondContact O-N 2.94Å
299	C	88.6	Confident	91.1	Very high	6 Å²	6	36.4 Å²	36.4	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-76.4	-33.8	179.4	-63.2	0	0	0	0	111.9	T274 I278 I295 D296 D297 K301 Y302 F303	T274-C299 WeakPolarHBondContact CG2-SG 3.33Å; I278-C299 HydrophobicContact CD1-CB 3.51Å; I295-C299 HydrophobicContact CG2-CB 3.79Å; D296-C299 WeakPolarHBondContact O-CA 3.44Å; D296-C299 VanDerWaalsContact O-CB 3.24Å; D296-C299 WeakPolarHBondContact O-CB 3.28Å; D296-C299 PolarHBondContact O-N 3.44Å; D297-C299 PolarHBondContact O-N 2.78Å; C299-K301 PolarHBondContact O-N 3.46Å; C299-Y302 PolarHBondContact O-N 3.46Å; C299-F303 VanDerWaalsContact O-CD2 3.27Å; C299-F303 WeakPolarHBondContact O-CD2 3.41Å
300	L	90.5	Very high	91.1	Very high	9 Å²	9	36.4 Å²	36.4	5%	0.047	21%	0.206	C	C	.	.	H	α-helix	trans	-59	-36.8	177.4	-67	175.2	0	0	0	111.8	G224 M228 I295 D296 D297 Y302 F303 V304	G224-L300 WeakPolarHBondContact O-CD1 3.37Å; M228-L300 HydrophobicContact CE-CB 3.99Å; M228-L300 HydrophobicContact CE-CD2 3.51Å; M228-L300 HydrophobicContact CE-CG 4.34Å; I295-L300 HydrophobicContact CB-CD2 4.06Å; I295-L300 HydrophobicContact CD1-CD2 4.32Å; I295-L300 HydrophobicContact CG2-CD2 3.63Å; I295-L300 HydrophobicContact CG2-CG 3.94Å; D296-L300 PolarHBondContact O-N 3.32Å; D296-L300 VanDerWaalsContact O-N 3.16Å; D297-L300 WeakPolarHBondContact O-CB 3.3Å; D297-L300 PolarHBondContact O-N 3.34Å; L300-Y302 VanDerWaalsContact C-N 3.31Å; L300-Y302 PolarHBondContact O-N 3.04Å; L300-F303 WeakPolarHBondContact O-CB 3.45Å; L300-F303 PolarHBondContact O-N 3.11Å; L300-F303 VanDerWaalsContact O-N 3.11Å; L300-V304 WeakPolarHBondContact O-CG2 3.36Å; L300-V304 PolarHBondContact O-N 2.66Å
301	K	90.6	Very high	91	Very high	133 Å²	133	36.4 Å²	36.4	58%	0.578	21%	0.206	S	C	*	.	H	α-helix	trans	-56	-43.8	177.1	-173.6	176.8	178.8	176.1	0	112.6	D297 C299 F303 V304 D305	D297-K301 PolarHBondContact O-N 2.79Å; C299-K301 PolarHBondContact O-N 3.46Å; K301-F303 VanDerWaalsContact C-N 3.26Å; K301-F303 PolarHBondContact O-N 3.25Å; K301-V304 PolarHBondContact O-N 3.08Å; K301-V304 VanDerWaalsContact O-N 3.16Å; K301-D305 PolarHBondContact O-N 3.48Å
302	Y	90.7	Very high	90.9	Very high	50 Å²	50	40.9 Å²	40.9	20%	0.196	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-32.6	179.3	-59.9	-56.7	0	0	0	112.9	K275 I278 C299 L300 S306	K275-Y302 HydrophobicContact CB-CE2 4.11Å; K275-Y302 HydrophobicContact CD-CE1 4.12Å; K275-Y302 HydrophobicContact CD-CE2 4.48Å; K275-Y302 HydrophobicContact CG-CD2 4.47Å; K275-Y302 HydrophobicContact CG-CE1 4.1Å; K275-Y302 HydrophobicContact CG-CE2 3.95Å; I278-Y302 HydrophobicContact CD1-CD2 4.15Å; C299-Y302 PolarHBondContact O-N 3.46Å; L300-Y302 VanDerWaalsContact C-N 3.31Å; L300-Y302 PolarHBondContact O-N 3.04Å; Y302-S306 WeakPolarHBondContact O-CB 3.39Å; Y302-S306 PolarHBondContact O-N 3.33Å; Y302-S306 PolarHBondContact O-OG 3.07Å
303	F	91.8	Very high	90.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-72.2	-39.9	174.5	-68.8	-67.5	0	0	0	111.9	M228 L244 I278 L282 V289 I295 C299 L300 K301 S306 G307 A308 A310	M228-F303 HydrophobicContact CE-CB 3.74Å; L244-F303 HydrophobicContact CD1-CE2 3.9Å; L244-F303 HydrophobicContact CD1-CZ 3.7Å; I278-F303 HydrophobicContact CB-CZ 4.38Å; I278-F303 HydrophobicContact CD1-CE2 4.1Å; I278-F303 HydrophobicContact CD1-CZ 4.42Å; I278-F303 HydrophobicContact CG1-CE2 4.13Å; I278-F303 HydrophobicContact CG1-CZ 3.95Å; I278-F303 HydrophobicContact CG2-CD1 4.35Å; I278-F303 HydrophobicContact CG2-CE1 3.81Å; I278-F303 HydrophobicContact CG2-CE2 4.1Å; I278-F303 HydrophobicContact CG2-CZ 3.68Å; L282-F303 HydrophobicContact CD2-CD1 4.1Å; L282-F303 HydrophobicContact CD2-CE1 4.29Å; L282-F303 HydrophobicContact CG-CE1 4.46Å; V289-F303 HydrophobicContact CB-CE1 4.37Å; V289-F303 HydrophobicContact CG2-CD1 4.46Å; V289-F303 HydrophobicContact CG2-CE1 3.85Å; I295-F303 HydrophobicContact CG2-CE2 4.43Å; C299-F303 VanDerWaalsContact O-CD2 3.27Å; C299-F303 WeakPolarHBondContact O-CD2 3.41Å; L300-F303 WeakPolarHBondContact O-CB 3.45Å; L300-F303 PolarHBondContact O-N 3.11Å; L300-F303 VanDerWaalsContact O-N 3.11Å; K301-F303 VanDerWaalsContact C-N 3.26Å; K301-F303 PolarHBondContact O-N 3.25Å; F303-S306 PolarHBondContact O-N 2.77Å; F303-G307 PolarHBondContact O-N 3.05Å; F303-G307 VanDerWaalsContact O-N 3.1Å; F303-A308 HydrophobicContact CD1-CB 4.13Å; F303-A308 PolarHBondContact O-N 3.47Å; F303-A310 HydrophobicContact CB-CB 4.26Å; F303-A310 HydrophobicContact CD1-CB 4.32Å; F303-A310 HydrophobicContact CD2-CB 3.87Å; F303-A310 HydrophobicContact CE2-CB 4.28Å; F303-A310 HydrophobicContact CG-CB 3.9Å
304	V	92.1	Very high	91	Very high	34 Å²	34	48.1 Å²	48.1	21%	0.206	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-50.2	175.2	175	0	0	0	0	110.7	E227 M228 L300 K301 S306 G307	E227-V304 HydrophobicContact CB-CG1 3.96Å; E227-V304 HydrophobicContact CB-CG2 4.25Å; M228-V304 HydrophobicContact CE-CG2 4.02Å; M228-V304 HydrophobicContact CG-CG2 3.67Å; L300-V304 WeakPolarHBondContact O-CG2 3.36Å; L300-V304 PolarHBondContact O-N 2.66Å; K301-V304 PolarHBondContact O-N 3.08Å; K301-V304 VanDerWaalsContact O-N 3.16Å; V304-S306 PolarHBondContact O-N 2.89Å; V304-G307 PolarHBondContact O-N 2.95Å
305	D	90.8	Very high	91.1	Very high	114 Å²	114	52 Å²	52	61%	0.61	26%	0.261	S	S	*	.	H	α-helix	trans	-59.5	-30.9	179.7	-68.6	-18.5	0	0	0	112.1	K301	K301-D305 PolarHBondContact O-N 3.48Å
306	S	88.6	Confident	91	Very high	74 Å²	74	56.6 Å²	56.6	52%	0.517	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-2.1	179.5	-51.6	0	0	0	0	113.7	L282 Y302 F303 V304 A308	L282-S306 WeakPolarHBondContact CD1-OG 3.28Å; Y302-S306 WeakPolarHBondContact O-CB 3.39Å; Y302-S306 PolarHBondContact O-N 3.33Å; Y302-S306 PolarHBondContact O-OG 3.07Å; F303-S306 PolarHBondContact O-N 2.77Å; V304-S306 PolarHBondContact O-N 2.89Å; S306-A308 VanDerWaalsContact C-N 3.3Å; S306-A308 PolarHBondContact O-N 2.96Å
307	G	89.4	Confident	91	Very high	38 Å²	38	61.7 Å²	61.7	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	23.5	-177.7	0	0	0	0	0	114.8	F303 V304	F303-G307 PolarHBondContact O-N 3.05Å; F303-G307 VanDerWaalsContact O-N 3.1Å; V304-G307 PolarHBondContact O-N 2.95Å
308	A	90.9	Very high	91.2	Very high	2 Å²	2	57 Å²	57	2%	0.017	27%	0.271	C	S	.	.			trans	-97.2	142.1	-179.7	0	0	0	0	0	111.8	L282 N287 F303 S306	L282-A308 HydrophobicContact CD2-CB 3.72Å; N287-A308 CarbonylContact O-C 3.57Å; N287-A308 WeakPolarHBondContact O-CA 2.99Å; F303-A308 HydrophobicContact CD1-CB 4.13Å; F303-A308 PolarHBondContact O-N 3.47Å; S306-A308 VanDerWaalsContact C-N 3.3Å; S306-A308 PolarHBondContact O-N 2.96Å
309	M	93.4	Very high	91.5	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.3	174.1	179.6	-175.2	-73.7	0	0	109.6	V223 V229 K230 I232 N287 V288 V289 V311 V354	V223-M309 HydrophobicContact CG1-CE 4.23Å; V223-M309 HydrophobicContact CG1-CG 3.92Å; V223-M309 HydrophobicContact CG1-SD 4.2Å; V229-M309 WeakPolarHBondContact O-CE 3.3Å; K230-M309 WeakPolarHBondContact O-CE 3.42Å; I232-M309 HydrophobicContact CD1-CB 3.54Å; N287-M309 PolarHBondContact O-N 3.35Å; V288-M309 CarbonylContact C-O 3.56Å; V288-M309 WeakPolarHBondContact CA-O 3.28Å; V288-M309 HydrophobicContact CG2-CB 4.36Å; V289-M309 PolarHBondContact N-O 2.67Å; M309-V311 HydrophobicContact CG-CG2 4.42Å; M309-V354 HydrophobicContact CE-CG1 4.45Å; M309-V354 HydrophobicContact SD-CG1 3.82Å
310	A	93.6	Very high	91.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133	174.4	0	0	0	0	0	111.2	G224 M228 V289 I295 F303	G224-A310 PolarHBondContact N-O 3.47Å; M228-A310 HydrophobicContact CE-CB 3.93Å; M228-A310 HydrophobicContact SD-CB 4.07Å; M228-A310 PolarHBondContact SD-N 3.37Å; V289-A310 CarbonylContact O-C 3.52Å; V289-A310 WeakPolarHBondContact O-CA 3.23Å; I295-A310 HydrophobicContact CD1-CB 3.75Å; F303-A310 HydrophobicContact CB-CB 4.26Å; F303-A310 HydrophobicContact CD1-CB 4.32Å; F303-A310 HydrophobicContact CD2-CB 3.87Å; F303-A310 HydrophobicContact CE2-CB 4.28Å; F303-A310 HydrophobicContact CG-CB 3.9Å
311	V	93.6	Very high	91.5	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.4	180	-171.8	0	0	0	0	108.8	L219 C221 V289 L290 T291 M309 V314 I365	L219-V311 HydrophobicContact CD2-CG1 3.91Å; C221-V311 HydrophobicContact CB-CG1 3.68Å; V289-V311 PolarHBondContact O-N 3.36Å; L290-V311 HydrophobicContact CD2-CB 3.63Å; L290-V311 HydrophobicContact CD2-CG1 4.34Å; L290-V311 HydrophobicContact CD2-CG2 3.55Å; T291-V311 WeakPolarHBondContact CG2-O 3.48Å; T291-V311 PolarHBondContact N-O 3.41Å; M309-V311 HydrophobicContact CG-CG2 4.42Å; V311-V314 HydrophobicContact CB-CG2 4.29Å; V311-V314 HydrophobicContact CG1-CG2 3.72Å; V311-I365 HydrophobicContact CB-CD1 4.3Å; V311-I365 HydrophobicContact CG1-CD1 3.94Å; V311-I365 HydrophobicContact CG2-CD1 3.33Å
312	R	92.8	Very high	91.6	Very high	93 Å²	93	54.1 Å²	54.1	35%	0.351	25%	0.254	S	S	.	.			trans	-104.3	155.5	-177.8	63.6	-175.2	179.1	-176.6	-2.1	111.7	T291 I295 D297 V314	T291-R312 HydrophobicContact CG2-CB 4.46Å; I295-R312 HydrophobicContact CB-CB 4.38Å; I295-R312 HydrophobicContact CD1-CB 4.16Å; I295-R312 HydrophobicContact CG1-CB 3.94Å; D297-R312 IonicContact OD1-NH1 3.84Å; R312-V314 VanDerWaalsContact C-N 3.33Å; R312-V314 PolarHBondContact O-N 3.41Å
313	R	91.8	Very high	91.6	Very high	192 Å²	192	52 Å²	52	73%	0.725	25%	0.247	S	C	*	.	S	Bend	trans	57.4	38.5	174	-57.6	-175.9	180	-175.8	0.9	114.6	T291 T292 G293	T291-R313 PolarHBondContact O-N 2.88Å; T292-R313 WeakPolarHBondContact O-CA 3.47Å; G293-R313 PolarHBondContact O-N 3.02Å
314	V	93.6	Very high	91.4	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.018	28%	0.276	C	S	.	.			trans	-68.6	134	173.5	174.5	0	0	0	0	110.1	L219 L290 T291 T292 V311 R312 K316 D318 L319	L219-V314 HydrophobicContact CD1-CG1 3.67Å; L219-V314 HydrophobicContact CD1-CG2 4.22Å; L219-V314 HydrophobicContact CD2-CG2 4.29Å; L290-V314 HydrophobicContact CB-CG2 4.38Å; T291-V314 PolarHBondContact O-N 3.48Å; T292-V314 WeakPolarHBondContact CA-O 3.08Å; V311-V314 HydrophobicContact CB-CG2 4.29Å; V311-V314 HydrophobicContact CG1-CG2 3.72Å; R312-V314 VanDerWaalsContact C-N 3.33Å; R312-V314 PolarHBondContact O-N 3.41Å; V314-K316 PolarHBondContact O-N 3.49Å; V314-D318 HydrophobicContact CG1-CB 4.4Å; V314-L319 HydrophobicContact CG1-CB 4.1Å; V314-L319 HydrophobicContact CG1-CD1 4.3Å
315	L	92.6	Very high	91.2	Very high	91 Å²	91	57.4 Å²	57.4	48%	0.476	27%	0.268	S	S	.	.			trans	-60.4	131.4	174.8	-65.4	173.8	0	0	0	110.5	R317 D318 L319	L315-R317 HydrophobicContact CB-CG 4.1Å; L315-R317 PolarHBondContact O-N 2.99Å; L315-R317 VanDerWaalsContact O-N 3.1Å; L315-D318 HydrophobicContact CB-CB 4.46Å; L315-D318 WeakPolarHBondContact CB-OD2 3.27Å; L315-D318 WeakPolarHBondContact O-CB 3.33Å; L315-D318 PolarHBondContact O-N 3.27Å; L315-L319 PolarHBondContact O-N 2.92Å
316	K	91.4	Very high	91.2	Very high	103 Å²	103	52.1 Å²	52.1	45%	0.448	24%	0.24	S	C	.	.	H	α-helix	trans	-55.9	-32.7	-178.5	-172.2	169.6	-170.8	151.4	0	113.4	D241 T292 V314 D318 K320	D241-K316 IonicContact OD1-NZ 2.73Å; D241-K316 WeakPolarHBondContact OD2-CE 3.35Å; D241-K316 IonicContact OD2-NZ 3.05Å; D241-K316 PolarHBondContact OD2-NZ 3.22Å; T292-K316 HydrophobicContact CG2-CB 4.23Å; V314-K316 PolarHBondContact O-N 3.49Å; K316-D318 VanDerWaalsContact C-N 3.35Å; K316-K320 WeakPolarHBondContact O-CG 3.31Å; K316-K320 PolarHBondContact O-N 3.11Å; K316-K320 VanDerWaalsContact O-N 3.16Å
317	R	91.1	Very high	91.2	Very high	158 Å²	158	50.5 Å²	50.5	60%	0.596	24%	0.235	S	C	*	.	H	α-helix	trans	-63.1	-41	175.3	67.6	-178.2	-175.5	-177.3	-0.4	111.9	L315 R321	L315-R317 HydrophobicContact CB-CG 4.1Å; L315-R317 PolarHBondContact O-N 2.99Å; L315-R317 VanDerWaalsContact O-N 3.1Å; R317-R321 WeakPolarHBondContact O-CG 3.41Å; R317-R321 PolarHBondContact O-N 3.25Å
318	D	91.4	Very high	91.3	Very high	12 Å²	12	49.2 Å²	49.2	6%	0.064	22%	0.22	C	C	.	.	H	α-helix	trans	-75.8	-41.8	-178.4	-62.5	-30.4	0	0	0	110.2	Y217 L219 V314 L315 K316 K320 R321 I322	Y217-D318 HydrophobicContact CE1-CB 3.92Å; Y217-D318 PolarHBondContact OH-OD1 3.02Å; L219-D318 HydrophobicContact CD1-CB 4.35Å; V314-D318 HydrophobicContact CG1-CB 4.4Å; L315-D318 HydrophobicContact CB-CB 4.46Å; L315-D318 WeakPolarHBondContact CB-OD2 3.27Å; L315-D318 WeakPolarHBondContact O-CB 3.33Å; L315-D318 PolarHBondContact O-N 3.27Å; K316-D318 VanDerWaalsContact C-N 3.35Å; D318-K320 VanDerWaalsContact C-N 3.28Å; D318-K320 PolarHBondContact O-N 2.69Å; D318-R321 WeakPolarHBondContact O-CB 3.39Å; D318-R321 PolarHBondContact O-N 3.08Å; D318-R321 IonicContact OD1-NH1 3.66Å; D318-R321 PolarHBondContact OD1-NH1 3.13Å; D318-I322 WeakPolarHBondContact O-CG1 3.18Å; D318-I322 PolarHBondContact O-N 3.48Å
319	L	91.9	Very high	91.3	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-56.6	-43.2	175.6	-166	70.6	0	0	0	111.9	C239 L240 L290 T292 V314 L315 R321 I322 A323 V330	C239-L319 HydrophobicContact CB-CD1 3.73Å; C239-L319 HydrophobicContact CB-CD2 4.31Å; C239-L319 HydrophobicContact CB-CG 3.95Å; L240-L319 VanDerWaalsContact O-CD2 3.29Å; L240-L319 WeakPolarHBondContact O-CD2 3.09Å; L290-L319 HydrophobicContact CB-CD1 3.54Å; L290-L319 HydrophobicContact CD1-CD1 4.22Å; T292-L319 HydrophobicContact CG2-CB 4.36Å; T292-L319 HydrophobicContact CG2-CD2 3.49Å; T292-L319 VanDerWaalsContact CG2-CD2 3.49Å; V314-L319 HydrophobicContact CG1-CB 4.1Å; V314-L319 HydrophobicContact CG1-CD1 4.3Å; L315-L319 PolarHBondContact O-N 2.92Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 3.12Å; L319-I322 PolarHBondContact O-N 3.2Å; L319-A323 VanDerWaalsContact O-CB 3.25Å; L319-A323 WeakPolarHBondContact O-CB 3.23Å; L319-A323 PolarHBondContact O-N 2.88Å; L319-V330 HydrophobicContact CD2-CG1 3.98Å
320	K	90.9	Very high	91.2	Very high	109 Å²	109	54.8 Å²	54.8	47%	0.474	25%	0.254	S	S	.	.	H	α-helix	trans	-64.1	-34.5	175.7	-74.9	179	179.5	-175.9	0	113	K316 D318 K324 V330	K316-K320 WeakPolarHBondContact O-CG 3.31Å; K316-K320 PolarHBondContact O-N 3.11Å; K316-K320 VanDerWaalsContact O-N 3.16Å; D318-K320 VanDerWaalsContact C-N 3.28Å; D318-K320 PolarHBondContact O-N 2.69Å; K320-K324 WeakPolarHBondContact O-CG 3.48Å; K320-K324 PolarHBondContact O-N 3.45Å; K320-V330 HydrophobicContact CG-CG2 4.49Å
321	R	89.1	Confident	91.1	Very high	63 Å²	63	55 Å²	55	24%	0.238	26%	0.256	C	S	.	.	H	α-helix	trans	-73.5	-45.5	177.6	-71.8	172.4	-177.2	163.5	-1.4	110.9	N196 Y217 R317 D318 L319 A323 K324 A325	N196-R321 PolarHBondContact O-NE 2.63Å; N196-R321 VanDerWaalsContact O-NE 3.13Å; N196-R321 PolarHBondContact O-NH2 3.31Å; Y217-R321 HydrophobicContact CD2-CB 4.43Å; Y217-R321 HydrophobicContact CE2-CB 3.73Å; Y217-R321 HydrophobicContact CE2-CG 4.47Å; Y217-R321 VanDerWaalsContact OH-CD 3.3Å; Y217-R321 WeakPolarHBondContact OH-CD 3.31Å; Y217-R321 PolarHBondContact OH-NH1 2.96Å; R317-R321 WeakPolarHBondContact O-CG 3.41Å; R317-R321 PolarHBondContact O-N 3.25Å; D318-R321 WeakPolarHBondContact O-CB 3.39Å; D318-R321 PolarHBondContact O-N 3.08Å; D318-R321 IonicContact OD1-NH1 3.66Å; D318-R321 PolarHBondContact OD1-NH1 3.13Å; L319-R321 VanDerWaalsContact C-N 3.33Å; L319-R321 PolarHBondContact O-N 3.12Å; R321-A323 VanDerWaalsContact C-N 3.34Å; R321-A323 PolarHBondContact O-N 3.12Å; R321-K324 PolarHBondContact O-N 3.25Å; R321-A325 PolarHBondContact O-N 2.83Å
322	I	91.3	Very high	90.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-47.2	176.2	-65.8	165.7	0	0	0	110	Y217 L219 V237 L290 D318 L319 K324 A325 T326 I367	Y217-I322 HydrophobicContact CD1-CD1 3.63Å; Y217-I322 HydrophobicContact CD1-CG1 3.35Å; Y217-I322 HydrophobicContact CD2-CG1 4.33Å; Y217-I322 HydrophobicContact CE1-CD1 3.95Å; Y217-I322 HydrophobicContact CE1-CG1 3.84Å; Y217-I322 HydrophobicContact CG-CD1 4.39Å; Y217-I322 HydrophobicContact CG-CG1 3.64Å; L219-I322 HydrophobicContact CD1-CD1 3.72Å; V237-I322 HydrophobicContact CG1-CG2 4.49Å; L290-I322 HydrophobicContact CD1-CD1 3.87Å; L290-I322 HydrophobicContact CD1-CG2 3.83Å; D318-I322 WeakPolarHBondContact O-CG1 3.18Å; D318-I322 PolarHBondContact O-N 3.48Å; L319-I322 PolarHBondContact O-N 3.2Å; I322-K324 VanDerWaalsContact C-N 3.29Å; I322-K324 PolarHBondContact O-N 2.98Å; I322-A325 PolarHBondContact O-N 3.42Å; I322-T326 HydrophobicContact CG2-CG2 4.01Å; I322-T326 WeakPolarHBondContact O-CG2 3.28Å; I322-T326 PolarHBondContact O-N 3.09Å; I322-T326 PolarHBondContact O-OG1 3.44Å; I322-I367 HydrophobicContact CD1-CD1 4.01Å; I322-I367 HydrophobicContact CG1-CD1 4.18Å; I322-I367 HydrophobicContact CG2-CD1 3.67Å
323	A	91.5	Very high	90.5	Very high	6 Å²	6	58 Å²	58	5%	0.05	29%	0.289	C	S	.	.	H	α-helix	trans	-56.6	-42.6	177.3	0	0	0	0	0	112.3	C239 L319 R321 A325 G327 A328 V330	C239-A323 HydrophobicContact CB-CB 4.39Å; L319-A323 VanDerWaalsContact O-CB 3.25Å; L319-A323 WeakPolarHBondContact O-CB 3.23Å; L319-A323 PolarHBondContact O-N 2.88Å; R321-A323 VanDerWaalsContact C-N 3.34Å; R321-A323 PolarHBondContact O-N 3.12Å; A323-A325 PolarHBondContact O-N 3.19Å; A323-G327 CarbonylContact O-C 3.59Å; A323-G327 VanDerWaalsContact O-CA 3.29Å; A323-G327 WeakPolarHBondContact O-CA 3.43Å; A323-G327 PolarHBondContact O-N 3.17Å; A323-A328 CarbonylContact C-O 3.58Å; A323-A328 HydrophobicContact CB-CB 4.25Å; A323-A328 WeakPolarHBondContact CB-O 3.39Å; A323-A328 PolarHBondContact O-N 3.02Å; A323-V330 HydrophobicContact CB-CG2 3.49Å; A323-V330 VanDerWaalsContact CB-CG2 3.49Å
324	K	88.4	Confident	90	Very high	142 Å²	142	49.3 Å²	49.3	62%	0.617	26%	0.257	S	S	*	.	H	α-helix	trans	-67.2	-33.9	174.7	-72.1	175.1	-178.5	-176.6	0	113.6	K320 R321 I322	K320-K324 WeakPolarHBondContact O-CG 3.48Å; K320-K324 PolarHBondContact O-N 3.45Å; R321-K324 PolarHBondContact O-N 3.25Å; I322-K324 VanDerWaalsContact C-N 3.29Å; I322-K324 PolarHBondContact O-N 2.98Å
325	A	88.1	Confident	89.4	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.033	28%	0.278	C	S	.	.	H	α-helix	trans	-73.5	-47	179.6	0	0	0	0	0	111.4	R321 I322 A323 T370 A372 R373	R321-A325 PolarHBondContact O-N 2.83Å; I322-A325 PolarHBondContact O-N 3.42Å; A323-A325 PolarHBondContact O-N 3.19Å; A325-T370 HydrophobicContact CB-CG2 4.05Å; A325-T370 WeakPolarHBondContact O-CB 3.08Å; A325-A372 WeakPolarHBondContact O-CB 3.33Å; A325-A372 PolarHBondContact O-N 3.09Å; A325-R373 PolarHBondContact O-N 3.21Å
326	T	89.3	Confident	88.7	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-81.7	-17.8	-178.2	61.3	0	0	0	0	113.4	V237 I322 A328 G349 Q350 I367 T370	V237-T326 HydrophobicContact CG2-CG2 4.33Å; I322-T326 HydrophobicContact CG2-CG2 4.01Å; I322-T326 WeakPolarHBondContact O-CG2 3.28Å; I322-T326 PolarHBondContact O-N 3.09Å; I322-T326 PolarHBondContact O-OG1 3.44Å; T326-A328 VanDerWaalsContact C-N 3.34Å; T326-A328 PolarHBondContact OG1-N 3.35Å; T326-G349 WeakPolarHBondContact O-CA 3.47Å; T326-Q350 PolarHBondContact O-N 2.99Å; T326-I367 HydrophobicContact CG2-CG2 4.29Å; T326-T370 HydrophobicContact CG2-CG2 3.75Å
327	G	88.8	Confident	87.8	Confident	39 Å²	39	54.3 Å²	54.3	40%	0.402	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	8.6	-172.4	0	0	0	0	0	113.8	A323	A323-G327 CarbonylContact O-C 3.59Å; A323-G327 VanDerWaalsContact O-CA 3.29Å; A323-G327 WeakPolarHBondContact O-CA 3.43Å; A323-G327 PolarHBondContact O-N 3.17Å
328	A	91.8	Very high	86.9	Confident	11 Å²	11	54.5 Å²	54.5	9%	0.091	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-67.1	154.4	175.3	0	0	0	0	0	111.5	C239 A323 T326 M347 G349	C239-A328 HydrophobicContact CB-CB 4.37Å; A323-A328 CarbonylContact C-O 3.58Å; A323-A328 HydrophobicContact CB-CB 4.25Å; A323-A328 WeakPolarHBondContact CB-O 3.39Å; A323-A328 PolarHBondContact O-N 3.02Å; T326-A328 VanDerWaalsContact C-N 3.34Å; T326-A328 PolarHBondContact OG1-N 3.35Å; A328-M347 WeakPolarHBondContact CA-O 3.26Å; A328-G349 VanDerWaalsContact CB-N 3.34Å
329	T	91.1	Very high	85.8	Confident	80 Å²	80	56.9 Å²	56.9	49%	0.491	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-97.5	132.7	166.6	-59.2	0	0	0	0	108.7	C331 M347	T329-C331 PolarHBondContact O-N 3.41Å; T329-M347 PolarHBondContact N-O 2.66Å
330	V	92.1	Very high	85.1	Confident	39 Å²	39	62.6 Å²	62.6	24%	0.236	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	116.1	174.8	-179	0	0	0	0	108.1	C239 D241 L319 K320 A323 P332	C239-V330 HydrophobicContact CB-CG2 4.32Å; D241-V330 HydrophobicContact CB-CG1 3.88Å; L319-V330 HydrophobicContact CD2-CG1 3.98Å; K320-V330 HydrophobicContact CG-CG2 4.49Å; A323-V330 HydrophobicContact CB-CG2 3.49Å; A323-V330 VanDerWaalsContact CB-CG2 3.49Å; V330-P332 VanDerWaalsContact O-CD 3.24Å; V330-P332 WeakPolarHBondContact O-CD 3.4Å
331	C	89.9	Confident	84.5	Confident	5 Å²	5	60 Å²	60	3%	0.034	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	108.4	-177.7	-61.3	0	0	0	0	110.5	C239 L240 D241 T329 F343 M347	C239-C331 PolarHBondContact O-N 3.46Å; L240-C331 HydrophobicContact CD2-CB 4.14Å; D241-C331 PolarHBondContact N-O 2.9Å; T329-C331 PolarHBondContact O-N 3.41Å; C331-F343 HydrophobicContact CB-CE2 4.28Å; C331-F343 VanDerWaalsContact SG-CE2 3.59Å; C331-M347 PolarHBondContact SG-SD 2.95Å
332	P	89.2	Confident	84.2	Confident	93 Å²	93	59.4 Å²	59.4	60%	0.604	35%	0.348	S	S	*	.	S	Bend	trans	-76	-25.4	175.7	31.5	-35.1	0	0	0	113	V330	V330-P332 VanDerWaalsContact O-CD 3.24Å; V330-P332 WeakPolarHBondContact O-CD 3.4Å
333	S	85.2	Confident	83.7	Confident	63 Å²	63	60.3 Å²	60.3	44%	0.441	35%	0.352	S	S	.	.			trans	-149.2	158.4	178.1	179.4	0	0	0	0	108.8	S335	S333-S335 VanDerWaalsContact C-N 3.32Å; S333-S335 WeakPolarHBondContact CB-OG 3.37Å; S333-S335 PolarHBondContact OG-N 2.95Å; S333-S335 PolarHBondContact OG-OG 3.35Å
334	L	82.1	Confident	83.4	Confident	9 Å²	9	64.9 Å²	64.9	5%	0.047	37%	0.372	C	S	.	.	S	Bend	trans	-86.8	-2	173.6	-66.7	172.1	0	0	0	113	F242 R277 I281 E341 T342 F343	F242-L334 HydrophobicContact CE1-CD2 4.32Å; F242-L334 HydrophobicContact CE1-CG 4.06Å; F242-L334 HydrophobicContact CE2-CD1 4.17Å; F242-L334 HydrophobicContact CE2-CG 4.33Å; F242-L334 HydrophobicContact CZ-CD1 3.77Å; F242-L334 HydrophobicContact CZ-CD2 3.94Å; F242-L334 HydrophobicContact CZ-CG 3.55Å; R277-L334 HydrophobicContact CB-CD1 3.62Å; R277-L334 HydrophobicContact CG-CD1 3.54Å; I281-L334 HydrophobicContact CD1-CD2 4.49Å; I281-L334 HydrophobicContact CG1-CD2 4.31Å; L334-E341 HydrophobicContact CB-CB 4.35Å; L334-E341 HydrophobicContact CB-CG 4.48Å; L334-E341 CarbonylContact O-C 3.49Å; L334-E341 VanDerWaalsContact O-CA 3.25Å; L334-E341 WeakPolarHBondContact O-CA 2.85Å; L334-T342 PolarHBondContact O-N 2.98Å; L334-T342 VanDerWaalsContact O-O 3.08Å; L334-F343 HydrophobicContact CD2-CB 4.12Å; L334-F343 HydrophobicContact CD2-CD2 3.6Å; L334-F343 HydrophobicContact CD2-CE2 4.49Å; L334-F343 HydrophobicContact CD2-CG 4.24Å
335	S	80.8	Confident	83.3	Confident	68 Å²	68	61.2 Å²	61.2	48%	0.476	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-73.2	127.6	179.5	53	0	0	0	0	111.7	S333	S333-S335 VanDerWaalsContact C-N 3.32Å; S333-S335 WeakPolarHBondContact CB-OG 3.37Å; S333-S335 PolarHBondContact OG-N 2.95Å; S333-S335 PolarHBondContact OG-OG 3.35Å
336	N	78	Confident	83.2	Confident	46 Å²	46	66.1 Å²	66.1	25%	0.246	40%	0.398	C	S	.	.			trans	-84.7	178.5	168.2	72.1	8.8	0	0	0	111.6	E338 G339 E340 T342	N336-E338 PolarHBondContact O-N 3.11Å; N336-E338 WeakPolarHBondContact OD1-CA 3.38Å; N336-E338 WeakPolarHBondContact OD1-CB 3.45Å; N336-E338 PolarHBondContact OD1-N 2.72Å; N336-G339 PolarHBondContact O-N 3.02Å; N336-G339 PolarHBondContact OD1-N 3.3Å; N336-E340 PolarHBondContact N-O 3Å; N336-E340 PolarHBondContact OD1-N 3.26Å; N336-E340 PolarHBondContact OD1-O 3.42Å; N336-E340 VanDerWaalsContact OD1-O 3.08Å; N336-T342 PolarHBondContact ND2-OG1 3.44Å
337	L	71.6	Confident	83.1	Confident	188 Å²	188	68.4 Å²	68.4	98%	0.984	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.6	178.1	-71.1	169	0	0	0	113.4	G339	L337-G339 VanDerWaalsContact C-N 3.31Å
338	E	71.6	Confident	83.2	Confident	162 Å²	162	67.3 Å²	67.3	76%	0.757	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-2.2	179.8	-61.1	177.4	165.4	0	0	112.3	N336 E340	N336-E338 PolarHBondContact O-N 3.11Å; N336-E338 WeakPolarHBondContact OD1-CA 3.38Å; N336-E338 WeakPolarHBondContact OD1-CB 3.45Å; N336-E338 PolarHBondContact OD1-N 2.72Å; E338-E340 VanDerWaalsContact C-N 3.32Å
339	G	69.2	Low	83.2	Confident	62 Å²	62	66.8 Å²	66.8	64%	0.639	39%	0.39	S	S	*	.	S	Bend	trans	83.9	2.2	179.7	0	0	0	0	0	114.5	N336 L337	N336-G339 PolarHBondContact O-N 3.02Å; N336-G339 PolarHBondContact OD1-N 3.3Å; L337-G339 VanDerWaalsContact C-N 3.31Å
340	E	77.3	Confident	83.3	Confident	121 Å²	121	67.2 Å²	67.2	57%	0.565	39%	0.386	S	S	*	.			trans	-87.3	143.8	175.2	-60.2	-169.2	168.2	0	0	111.4	N336 E338 T342	N336-E340 PolarHBondContact N-O 3Å; N336-E340 PolarHBondContact OD1-N 3.26Å; N336-E340 PolarHBondContact OD1-O 3.42Å; N336-E340 VanDerWaalsContact OD1-O 3.08Å; E338-E340 VanDerWaalsContact C-N 3.32Å; E340-T342 HydrophobicContact CB-CG2 4.5Å; E340-T342 PolarHBondContact O-N 3.21Å
341	E	78.6	Confident	83.2	Confident	56 Å²	56	65.5 Å²	65.5	26%	0.262	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-80.9	106.6	173.2	-68.7	-171.3	173.2	0	0	109.7	R277 K280 L334	R277-E341 VanDerWaalsContact CG-OE2 3.27Å; R277-E341 WeakPolarHBondContact CG-OE2 3.36Å; R277-E341 IonicContact CZ-OE1 2.83Å; R277-E341 IonicContact CZ-OE2 3.11Å; R277-E341 IonicContact NE-OE1 3.84Å; R277-E341 PolarHBondContact NE-OE1 2.88Å; R277-E341 VanDerWaalsContact NE-OE1 3.15Å; R277-E341 IonicContact NE-OE2 2.72Å; R277-E341 PolarHBondContact NE-OE2 3.36Å; R277-E341 IonicContact NH2-OE1 2.66Å; R277-E341 PolarHBondContact NH2-OE1 3.12Å; R277-E341 IonicContact NH2-OE2 3.74Å; K280-E341 VanDerWaalsContact CD-O 3.28Å; K280-E341 WeakPolarHBondContact CD-O 3.28Å; K280-E341 VanDerWaalsContact CE-O 3.31Å; K280-E341 WeakPolarHBondContact CE-O 3.44Å; K280-E341 PolarHBondContact NZ-O 3.4Å; L334-E341 HydrophobicContact CB-CB 4.35Å; L334-E341 HydrophobicContact CB-CG 4.48Å; L334-E341 CarbonylContact O-C 3.49Å; L334-E341 VanDerWaalsContact O-CA 3.25Å; L334-E341 WeakPolarHBondContact O-CA 2.85Å
342	T	81.6	Confident	83.3	Confident	50 Å²	50	69.9 Å²	69.9	31%	0.307	40%	0.396	S	S	.	.			trans	-135	148.6	177.9	51.2	0	0	0	0	110.4	L334 N336 E340	L334-T342 PolarHBondContact O-N 2.98Å; L334-T342 VanDerWaalsContact O-O 3.08Å; N336-T342 PolarHBondContact ND2-OG1 3.44Å; E340-T342 HydrophobicContact CB-CG2 4.5Å; E340-T342 PolarHBondContact O-N 3.21Å
343	F	82.8	Confident	83.5	Confident	18 Å²	18	67 Å²	67	8%	0.079	37%	0.374	C	S	.	.			trans	-127.3	112.1	174.9	-167.8	-95.7	0	0	0	108.5	A238 L240 I281 A284 C331 L334 M347 L348	A238-F343 HydrophobicContact CB-CE1 4.31Å; A238-F343 HydrophobicContact CB-CZ 3.9Å; L240-F343 HydrophobicContact CD2-CE2 3.86Å; L240-F343 HydrophobicContact CD2-CZ 4.44Å; I281-F343 HydrophobicContact CG1-CB 4.43Å; I281-F343 HydrophobicContact CG1-CD1 4.44Å; I281-F343 HydrophobicContact CG1-CD2 4.37Å; I281-F343 HydrophobicContact CG1-CG 4.15Å; A284-F343 HydrophobicContact CB-CD1 3.6Å; A284-F343 HydrophobicContact CB-CE1 4.23Å; A284-F343 WeakPolarHBondContact CB-O 3.46Å; C331-F343 HydrophobicContact CB-CE2 4.28Å; C331-F343 VanDerWaalsContact SG-CE2 3.59Å; L334-F343 HydrophobicContact CD2-CB 4.12Å; L334-F343 HydrophobicContact CD2-CD2 3.6Å; L334-F343 HydrophobicContact CD2-CE2 4.49Å; L334-F343 HydrophobicContact CD2-CG 4.24Å; F343-M347 HydrophobicContact CD2-SD 4.4Å; F343-M347 HydrophobicContact CE2-CB 4.38Å; F343-M347 HydrophobicContact CE2-SD 4.41Å; F343-M347 HydrophobicContact CZ-CB 4.18Å; F343-L348 HydrophobicContact CE1-CD2 3.67Å; F343-L348 HydrophobicContact CE1-CG 4.02Å; F343-L348 HydrophobicContact CZ-CD2 4.14Å
344	E	84.9	Confident	83.9	Confident	102 Å²	102	64 Å²	64	48%	0.477	35%	0.353	S	S	.	.			trans	-88	147.3	-175.1	-64.5	-179.9	-172.8	0	0	111.6	T346 M347	E344-T346 VanDerWaalsContact CB-OG1 3.22Å; E344-T346 WeakPolarHBondContact CB-OG1 3.25Å; E344-T346 PolarHBondContact O-N 3.43Å; E344-T346 PolarHBondContact OE2-OG1 3Å; E344-M347 HydrophobicContact CB-CE 4.47Å; E344-M347 HydrophobicContact CB-CG 4.38Å; E344-M347 WeakPolarHBondContact O-CB 3.11Å; E344-M347 PolarHBondContact O-N 3.13Å; E344-M347 VanDerWaalsContact O-N 3.1Å
345	A	85.6	Confident	84.5	Confident	66 Å²	66	64.2 Å²	64.2	55%	0.545	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-63.5	-20.3	174.4	0	0	0	0	0	113.1	M347 L348	A345-M347 PolarHBondContact O-N 3.29Å; A345-L348 WeakPolarHBondContact O-CB 3.43Å; A345-L348 PolarHBondContact O-N 3.07Å
346	T	87	Confident	85	Confident	106 Å²	106	61.7 Å²	61.7	65%	0.65	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-64	-26.1	174.5	53.4	0	0	0	0	112.7	E344 L348	E344-T346 VanDerWaalsContact CB-OG1 3.22Å; E344-T346 WeakPolarHBondContact CB-OG1 3.25Å; E344-T346 PolarHBondContact O-N 3.43Å; E344-T346 PolarHBondContact OE2-OG1 3Å; T346-L348 VanDerWaalsContact C-N 3.3Å
347	M	86.6	Confident	85.6	Confident	53 Å²	53	62.6 Å²	62.6	26%	0.261	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-80.7	-13.2	-179.4	-57.5	-175.3	-177.7	0	0	112.6	A328 T329 C331 F343 E344 A345	A328-M347 WeakPolarHBondContact CA-O 3.26Å; T329-M347 PolarHBondContact N-O 2.66Å; C331-M347 PolarHBondContact SG-SD 2.95Å; F343-M347 HydrophobicContact CD2-SD 4.4Å; F343-M347 HydrophobicContact CE2-CB 4.38Å; F343-M347 HydrophobicContact CE2-SD 4.41Å; F343-M347 HydrophobicContact CZ-CB 4.18Å; E344-M347 HydrophobicContact CB-CE 4.47Å; E344-M347 HydrophobicContact CB-CG 4.38Å; E344-M347 WeakPolarHBondContact O-CB 3.11Å; E344-M347 PolarHBondContact O-N 3.13Å; E344-M347 VanDerWaalsContact O-N 3.1Å; A345-M347 PolarHBondContact O-N 3.29Å
348	L	91.5	Very high	86.4	Confident	16 Å²	16	61.8 Å²	61.8	8%	0.084	32%	0.322	C	S	.	.			trans	-77.6	132.8	-178.8	-66.8	172.2	0	0	0	111.9	K236 A238 A284 A286 F343 A345 T346	K236-L348 HydrophobicContact CB-CD1 4.31Å; K236-L348 HydrophobicContact CD-CD1 4.42Å; A238-L348 HydrophobicContact CB-CD2 3.72Å; A284-L348 HydrophobicContact CB-CD1 4.31Å; A284-L348 VanDerWaalsContact O-CD1 3.28Å; A284-L348 WeakPolarHBondContact O-CD1 3.28Å; A286-L348 HydrophobicContact CB-CD2 3.77Å; F343-L348 HydrophobicContact CE1-CD2 3.67Å; F343-L348 HydrophobicContact CE1-CG 4.02Å; F343-L348 HydrophobicContact CZ-CD2 4.14Å; A345-L348 WeakPolarHBondContact O-CB 3.43Å; A345-L348 PolarHBondContact O-N 3.07Å; T346-L348 VanDerWaalsContact C-N 3.3Å
349	G	91.1	Very high	87.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	161.9	168	0	0	0	0	0	112	K236 V237 T326 A328	K236-G349 CarbonylContact C-O 3.58Å; K236-G349 WeakPolarHBondContact CA-O 3.4Å; V237-G349 PolarHBondContact N-O 2.91Å; V237-G349 PolarHBondContact O-N 3.22Å; T326-G349 WeakPolarHBondContact O-CA 3.47Å; A328-G349 VanDerWaalsContact CB-N 3.34Å
350	Q	92.2	Very high	87.9	Confident	89 Å²	89	53.6 Å²	53.6	42%	0.416	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.3	178	-61	-174.4	13.9	0	0	111.3	T326 K371	T326-Q350 PolarHBondContact O-N 2.99Å; Q350-K371 HydrophobicContact CB-CB 4.34Å; Q350-K371 HydrophobicContact CB-CD 3.78Å; Q350-K371 HydrophobicContact CB-CG 4.13Å; Q350-K371 PolarHBondContact O-N 3.01Å; Q350-K371 VanDerWaalsContact OE1-CD 3.26Å
351	A	91.6	Very high	88.2	Confident	2 Å²	2	53.1 Å²	53.1	2%	0.017	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.2	170.9	0	0	0	0	0	109.9	N234 A235 V237 V354 I367 T370	N234-A351 CarbonylContact C-O 3.41Å; A235-A351 HydrophobicContact CB-CB 4.41Å; A235-A351 PolarHBondContact N-O 3.23Å; A235-A351 PolarHBondContact O-N 3.09Å; V237-A351 HydrophobicContact CG2-CB 4.44Å; A351-V354 HydrophobicContact CB-CG2 4.42Å; A351-I367 HydrophobicContact CB-CG2 3.65Å; A351-T370 HydrophobicContact CB-CG2 4.45Å
352	E	92	Very high	88.6	Confident	98 Å²	98	53.2 Å²	53.2	46%	0.458	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	-42.7	177.8	-171.3	178.8	175.3	0	0	111.4	V233 N234 K368 N369	V233-E352 CarbonylContact C-O 3.59Å; N234-E352 WeakPolarHBondContact CA-O 3.33Å; N234-E352 PolarHBondContact N-O 3.38Å; E352-K368 PolarHBondContact N-O 3.48Å; E352-N369 HydrophobicContact CB-CB 3.78Å; E352-N369 PolarHBondContact N-O 3.43Å; E352-N369 WeakPolarHBondContact OE2-CB 3.47Å; E352-N369 PolarHBondContact OE2-ND2 2.88Å
353	E	92.6	Very high	89	Confident	32 Å²	32	54 Å²	54	15%	0.15	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	138.2	-176.5	-164.3	-176	-151	0	0	111.2	R231 I232 V355 K368	R231-E353 IonicContact CZ-OE1 3.12Å; R231-E353 IonicContact NE-OE1 3.34Å; R231-E353 PolarHBondContact NE-OE1 3.43Å; R231-E353 IonicContact NH2-OE1 2.72Å; R231-E353 PolarHBondContact NH2-OE1 2.92Å; I232-E353 WeakPolarHBondContact O-CA 3.46Å; E353-V355 HydrophobicContact CG-CG2 3.5Å; E353-K368 HydrophobicContact CB-CB 4.47Å; E353-K368 PolarHBondContact N-O 3.5Å; E353-K368 PolarHBondContact O-N 2.94Å
354	V	93.3	Very high	89.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	118.9	167.9	179.3	0	0	0	0	108.3	I232 A235 V237 V288 M309 A351 I365 L366 I367	I232-V354 PolarHBondContact N-O 3.37Å; I232-V354 PolarHBondContact O-N 3.06Å; A235-V354 HydrophobicContact CB-CB 4.15Å; A235-V354 HydrophobicContact CB-CG2 3.5Å; A235-V354 VanDerWaalsContact CB-CG2 3.5Å; V237-V354 HydrophobicContact CG2-CG2 4.48Å; V288-V354 HydrophobicContact CG1-CG1 4.35Å; V288-V354 HydrophobicContact CG2-CB 3.98Å; V288-V354 HydrophobicContact CG2-CG1 4.16Å; V288-V354 HydrophobicContact CG2-CG2 4.04Å; M309-V354 HydrophobicContact CE-CG1 4.45Å; M309-V354 HydrophobicContact SD-CG1 3.82Å; A351-V354 HydrophobicContact CB-CG2 4.42Å; V354-I365 HydrophobicContact CG1-CG2 3.74Å; V354-L366 WeakPolarHBondContact CA-O 3.22Å; V354-I367 HydrophobicContact CG1-CG1 4.3Å; V354-I367 HydrophobicContact CG2-CB 4.31Å; V354-I367 HydrophobicContact CG2-CG1 4.06Å; V354-I367 HydrophobicContact CG2-CG2 4.05Å
355	V	94	Very high	89.9	Confident	13 Å²	13	48.4 Å²	48.4	8%	0.079	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.9	-177.2	-166	0	0	0	0	109.6	K230 R231 E353 E357 L366	K230-V355 CarbonylContact O-C 3.48Å; K230-V355 WeakPolarHBondContact O-CA 3.24Å; R231-V355 HydrophobicContact CB-CG1 4.43Å; R231-V355 HydrophobicContact CG-CG1 4.46Å; R231-V355 HydrophobicContact CG-CG2 4.12Å; E353-V355 HydrophobicContact CG-CG2 3.5Å; V355-E357 HydrophobicContact CB-CG 4.28Å; V355-E357 HydrophobicContact CG1-CG 3.69Å; V355-L366 PolarHBondContact N-O 3.29Å; V355-L366 PolarHBondContact O-N 2.72Å
356	Q	92.2	Very high	90.3	Very high	16 Å²	16	45.3 Å²	45.3	8%	0.075	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	111.7	162.5	-167.6	-174	14.8	0	0	108.5	V223 K230 E363 L364 I365	V223-Q356 VanDerWaalsContact CG2-OE1 3.28Å; K230-Q356 HydrophobicContact CB-CB 4.28Å; K230-Q356 PolarHBondContact O-N 2.93Å; Q356-E363 HydrophobicContact CG-CB 4.42Å; Q356-E363 PolarHBondContact NE2-OE2 3.34Å; Q356-L364 CarbonylContact C-O 3.59Å; Q356-L364 WeakPolarHBondContact CA-O 3.44Å; Q356-I365 HydrophobicContact CB-CG1 4.38Å; Q356-I365 HydrophobicContact CG-CG1 4.18Å
357	E	90.6	Very high	90.5	Very high	65 Å²	65	40.3 Å²	40.3	30%	0.304	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	137	176.8	-70.6	-177.8	-165.6	0	0	109.5	V355 L364 L366 K368	V355-E357 HydrophobicContact CB-CG 4.28Å; V355-E357 HydrophobicContact CG1-CG 3.69Å; E357-L364 PolarHBondContact N-O 3.46Å; E357-L364 PolarHBondContact O-N 3Å; E357-L366 HydrophobicContact CB-CD1 4.25Å; E357-L366 HydrophobicContact CG-CD1 4.26Å; E357-L366 WeakPolarHBondContact OE2-CD1 3.35Å; E357-K368 IonicContact OE1-NZ 2.67Å; E357-K368 PolarHBondContact OE1-NZ 2.92Å
358	R	88.8	Confident	90.7	Very high	170 Å²	170	40.3 Å²	40.3	64%	0.642	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	118.9	172.6	-176.8	173.9	174.4	172.1	1.7	108.9	C360 D361	R358-C360 VanDerWaalsContact CG-O 3.28Å; R358-C360 WeakPolarHBondContact CG-O 2.95Å; R358-C360 PolarHBondContact NE-O 2.81Å; R358-D361 IonicContact NH2-OD1 2.93Å; R358-D361 PolarHBondContact NH2-OD1 2.95Å; R358-D361 VanDerWaalsContact NH2-OD1 3.12Å
359	V	86.9	Confident	90.5	Very high	10 Å²	10	43.2 Å²	43.2	6%	0.061	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	98.1	-178.9	178.8	0	0	0	0	107.5	A203 F212 D362 L364 I379	A203-V359 HydrophobicContact CB-CG1 3.93Å; F212-V359 HydrophobicContact CZ-CG2 4.48Å; V359-D362 CarbonylContact C-O 3.42Å; V359-D362 PolarHBondContact N-O 3.13Å; V359-D362 PolarHBondContact O-N 3.42Å; V359-L364 HydrophobicContact CB-CD1 3.94Å; V359-L364 HydrophobicContact CB-CG 4.35Å; V359-L364 HydrophobicContact CG1-CD1 4.3Å; V359-L364 HydrophobicContact CG2-CD1 4.02Å; V359-L364 HydrophobicContact CG2-CG 4.46Å; V359-I379 HydrophobicContact CG1-CG2 4.05Å
360	C	84.9	Confident	90.3	Very high	42 Å²	42	43.9 Å²	43.9	28%	0.284	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	-125.3	-166.1	-143.3	0	0	0	0	112.4	H204 R358	H204-C360 WeakPolarHBondContact O-CB 3.5Å; H204-C360 PolarHBondContact O-SG 2.83Å; R358-C360 VanDerWaalsContact CG-O 3.28Å; R358-C360 WeakPolarHBondContact CG-O 2.95Å; R358-C360 PolarHBondContact NE-O 2.81Å
361	D	84.4	Confident	89.6	Confident	111 Å²	111	46.1 Å²	46.1	59%	0.594	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-14.4	174.9	-67	-36.6	0	0	0	113.3	R358	R358-D361 IonicContact NH2-OD1 2.93Å; R358-D361 PolarHBondContact NH2-OD1 2.95Å; R358-D361 VanDerWaalsContact NH2-OD1 3.12Å
362	D	86.3	Confident	88.9	Confident	59 Å²	59	48.9 Å²	48.9	32%	0.316	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	145	176.6	-65.9	-36	0	0	0	111.9	V359 L364	V359-D362 CarbonylContact C-O 3.42Å; V359-D362 PolarHBondContact N-O 3.13Å; V359-D362 PolarHBondContact O-N 3.42Å; D362-L364 HydrophobicContact CB-CD2 4.49Å
363	E	89.3	Confident	88.2	Confident	66 Å²	66	49.7 Å²	49.7	31%	0.308	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.7	169.7	-63	-173.5	154.6	0	0	109.1	T222 Q356	T222-E363 HydrophobicContact CG2-CB 4.07Å; Q356-E363 HydrophobicContact CG-CB 4.42Å; Q356-E363 PolarHBondContact NE2-OE2 3.34Å
364	L	92.5	Very high	87.4	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	142.4	-177.8	-58.9	-179	0	0	0	110.3	L201 N220 Q356 E357 V359 D362 L366 I379	L201-L364 HydrophobicContact CD1-CD1 4.04Å; L201-L364 HydrophobicContact CD1-CD2 4.02Å; N220-L364 HydrophobicContact CB-CD2 3.82Å; Q356-L364 CarbonylContact C-O 3.59Å; Q356-L364 WeakPolarHBondContact CA-O 3.44Å; E357-L364 PolarHBondContact N-O 3.46Å; E357-L364 PolarHBondContact O-N 3Å; V359-L364 HydrophobicContact CB-CD1 3.94Å; V359-L364 HydrophobicContact CB-CG 4.35Å; V359-L364 HydrophobicContact CG1-CD1 4.3Å; V359-L364 HydrophobicContact CG2-CD1 4.02Å; V359-L364 HydrophobicContact CG2-CG 4.46Å; D362-L364 HydrophobicContact CB-CD2 4.49Å; L364-L366 HydrophobicContact CB-CD2 4.25Å; L364-I379 HydrophobicContact CD1-CD1 3.89Å; L364-I379 HydrophobicContact CD1-CG1 4.37Å; L364-I379 HydrophobicContact CD1-CG2 4.4Å
365	I	93.4	Very high	86.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.4	171.6	-63.7	173	0	0	0	108.2	L219 C221 V223 V311 V354 Q356 I367	L219-I365 HydrophobicContact CB-CB 4.35Å; L219-I365 HydrophobicContact CD2-CB 4.21Å; L219-I365 HydrophobicContact CD2-CD1 4.21Å; L219-I365 PolarHBondContact N-O 2.86Å; L219-I365 PolarHBondContact O-N 3.47Å; C221-I365 WeakPolarHBondContact O-CD1 3.3Å; C221-I365 WeakPolarHBondContact O-CG1 3.49Å; V223-I365 HydrophobicContact CG1-CD1 4.34Å; V311-I365 HydrophobicContact CB-CD1 4.3Å; V311-I365 HydrophobicContact CG1-CD1 3.94Å; V311-I365 HydrophobicContact CG2-CD1 3.33Å; V354-I365 HydrophobicContact CG1-CG2 3.74Å; Q356-I365 HydrophobicContact CB-CG1 4.38Å; Q356-I365 HydrophobicContact CG-CG1 4.18Å; I365-I367 HydrophobicContact CG2-CG1 4.49Å
366	L	93.9	Very high	86.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	114.8	179.4	-52.5	-173.8	0	0	0	109	V214 A218 V354 V355 E357 L364 K368 I379	V214-L366 HydrophobicContact CG1-CB 4.48Å; V214-L366 HydrophobicContact CG2-CD1 4.36Å; V214-L366 HydrophobicContact CG2-CD2 4.22Å; A218-L366 HydrophobicContact CB-CD2 3.65Å; V354-L366 WeakPolarHBondContact CA-O 3.22Å; V355-L366 PolarHBondContact N-O 3.29Å; V355-L366 PolarHBondContact O-N 2.72Å; E357-L366 HydrophobicContact CB-CD1 4.25Å; E357-L366 HydrophobicContact CG-CD1 4.26Å; E357-L366 WeakPolarHBondContact OE2-CD1 3.35Å; L364-L366 HydrophobicContact CB-CD2 4.25Å; L366-K368 HydrophobicContact CB-CG 4.37Å; L366-I379 HydrophobicContact CD2-CD1 3.85Å
367	I	92.9	Very high	86.6	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	100.3	172.4	-55.4	175.7	0	0	0	106.4	G216 Y217 L290 I322 T326 A351 V354 I365 T370	G216-I367 CarbonylContact C-O 3.54Å; G216-I367 WeakPolarHBondContact CA-O 3.24Å; Y217-I367 PolarHBondContact N-O 3.5Å; Y217-I367 PolarHBondContact O-N 2.88Å; L290-I367 HydrophobicContact CD1-CD1 4.22Å; I322-I367 HydrophobicContact CD1-CD1 4.01Å; I322-I367 HydrophobicContact CG1-CD1 4.18Å; I322-I367 HydrophobicContact CG2-CD1 3.67Å; T326-I367 HydrophobicContact CG2-CG2 4.29Å; A351-I367 HydrophobicContact CB-CG2 3.65Å; V354-I367 HydrophobicContact CG1-CG1 4.3Å; V354-I367 HydrophobicContact CG2-CB 4.31Å; V354-I367 HydrophobicContact CG2-CG1 4.06Å; V354-I367 HydrophobicContact CG2-CG2 4.05Å; I365-I367 HydrophobicContact CG2-CG1 4.49Å; I367-T370 HydrophobicContact CG2-CG2 3.84Å
368	K	91	Very high	86.8	Confident	54 Å²	54	48.8 Å²	48.8	24%	0.235	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	143.3	-175.1	-60.8	178.2	-173.2	170.5	0	110.8	V214 N215 E352 E353 E357 L366	V214-K368 HydrophobicContact CG1-CG 4.31Å; N215-K368 WeakPolarHBondContact O-CA 3.32Å; E352-K368 PolarHBondContact N-O 3.48Å; E353-K368 HydrophobicContact CB-CB 4.47Å; E353-K368 PolarHBondContact N-O 3.5Å; E353-K368 PolarHBondContact O-N 2.94Å; E357-K368 IonicContact OE1-NZ 2.67Å; E357-K368 PolarHBondContact OE1-NZ 2.92Å; L366-K368 HydrophobicContact CB-CG 4.37Å
369	N	87.4	Confident	87	Confident	76 Å²	76	40.7 Å²	40.7	41%	0.406	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	48.3	76.2	175.1	-62.5	-28.1	0	0	0	113.7	N215 E352	N215-N369 PolarHBondContact O-N 3.15Å; E352-N369 HydrophobicContact CB-CB 3.78Å; E352-N369 PolarHBondContact N-O 3.43Å; E352-N369 WeakPolarHBondContact OE2-CB 3.47Å; E352-N369 PolarHBondContact OE2-ND2 2.88Å
370	T	85.4	Confident	87.4	Confident	14 Å²	14	40.3 Å²	40.3	9%	0.086	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	136.9	176.1	50.6	0	0	0	0	111.5	A325 T326 A351 I367 R373	A325-T370 HydrophobicContact CB-CG2 4.05Å; A325-T370 WeakPolarHBondContact O-CB 3.08Å; T326-T370 HydrophobicContact CG2-CG2 3.75Å; A351-T370 HydrophobicContact CB-CG2 4.45Å; I367-T370 HydrophobicContact CG2-CG2 3.84Å; T370-R373 PolarHBondContact OG1-O 2.94Å
371	K	78.9	Confident	87.6	Confident	137 Å²	137	38.7 Å²	38.7	60%	0.596	20%	0.2	S	C	*	.	S	Bend	trans	-78.7	-35	-170.3	-68.6	-166.6	-171.3	175.1	0	115.3	Q350	Q350-K371 HydrophobicContact CB-CB 4.34Å; Q350-K371 HydrophobicContact CB-CD 3.78Å; Q350-K371 HydrophobicContact CB-CG 4.13Å; Q350-K371 PolarHBondContact O-N 3.01Å; Q350-K371 VanDerWaalsContact OE1-CD 3.26Å
372	A	76.1	Confident	87.9	Confident	59 Å²	59	33.4 Å²	33.4	49%	0.488	17%	0.171	S	C	.	.	S	Bend	trans	-80.3	-45.9	-170.2	0	0	0	0	0	112.1	A325	A325-A372 WeakPolarHBondContact O-CB 3.33Å; A325-A372 PolarHBondContact O-N 3.09Å
373	R	77.5	Confident	88.1	Confident	115 Å²	115	34.2 Å²	34.2	43%	0.434	19%	0.187	S	C	.	.	S	Bend	trans	-137.2	145.5	172.6	-64.5	-175.8	-174.8	-168.8	1	109.4	F184 A325 T370 S375	F184-R373 VanDerWaalsContact CD2-CZ 3.43Å; F184-R373 VanDerWaalsContact CE2-CZ 3.41Å; F184-R373 VanDerWaalsContact CE2-NH1 3.35Å; A325-R373 PolarHBondContact O-N 3.21Å; T370-R373 PolarHBondContact OG1-O 2.94Å; R373-S375 PolarHBondContact O-N 3.34Å
374	T	75.4	Confident	88.1	Confident	95 Å²	95	34.6 Å²	34.6	58%	0.583	19%	0.191	S	C	*	.			trans	-66.2	128.1	163.8	42.2	0	0	0	0	108.6	A181	A181-T374 CarbonylContact O-C 3.54Å; A181-T374 WeakPolarHBondContact O-CB 3.49Å; A181-T374 PolarHBondContact O-OG1 3.23Å
375	S	82.1	Confident	88	Confident	13 Å²	13	38.5 Å²	38.5	9%	0.091	21%	0.211	C	C	.	.			trans	-123	158.2	167.9	66	0	0	0	0	108.5	G216 R373	G216-S375 WeakPolarHBondContact CA-O 3.49Å; G216-S375 WeakPolarHBondContact CA-OG 3.32Å; G216-S375 PolarHBondContact N-O 3.28Å; G216-S375 CarbonylContact O-C 3.6Å; G216-S375 VanDerWaalsContact O-C 3.24Å; G216-S375 PolarHBondContact O-OG 3.42Å; R373-S375 PolarHBondContact O-N 3.34Å
376	A	88.4	Confident	87.8	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.9	177.1	0	0	0	0	0	109.3	A178 A181 V198 N199 L213 G216	A178-A376 HydrophobicContact CB-CB 3.83Å; A181-A376 HydrophobicContact CB-CB 3.95Å; V198-A376 WeakPolarHBondContact CA-O 3.29Å; N199-A376 PolarHBondContact N-O 3Å; L213-A376 HydrophobicContact CD1-CB 3.99Å; G216-A376 CarbonylContact O-C 3.58Å; G216-A376 VanDerWaalsContact O-C 3.28Å; G216-A376 WeakPolarHBondContact O-CA 3.37Å; G216-A376 PolarHBondContact O-N 3.09Å
377	S	92.4	Very high	87.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	139.3	167.2	-60.6	0	0	0	0	109.6	N199 V214 G216 Y217 A218	N199-S377 CarbonylContact O-C 3.57Å; N199-S377 WeakPolarHBondContact O-CA 3.47Å; N199-S377 WeakPolarHBondContact O-CB 3.16Å; V214-S377 PolarHBondContact N-O 3.05Å; V214-S377 PolarHBondContact O-N 3.34Å; G216-S377 PolarHBondContact O-N 2.66Å; G216-S377 PolarHBondContact O-OG 2.73Å; Y217-S377 WeakPolarHBondContact CA-OG 3.26Å; A218-S377 PolarHBondContact N-OG 3.26Å
378	I	94.3	Very high	87.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.3	179.9	-65.2	170.3	0	0	0	107.6	M174 A178 V198 N199 V200 L201 L213 L380 L395	M174-I378 HydrophobicContact CG-CD1 4.02Å; M174-I378 HydrophobicContact CG-CG1 4.12Å; M174-I378 HydrophobicContact SD-CB 4.38Å; M174-I378 HydrophobicContact SD-CD1 4.29Å; M174-I378 HydrophobicContact SD-CG1 4.1Å; M174-I378 HydrophobicContact SD-CG2 3.48Å; M174-I378 WeakPolarHBondContact SD-CG2 3.45Å; A178-I378 HydrophobicContact CB-CD1 3.81Å; A178-I378 HydrophobicContact CB-CG1 4.36Å; V198-I378 HydrophobicContact CG1-CD1 4.28Å; V198-I378 HydrophobicContact CG1-CG1 4.42Å; N199-I378 PolarHBondContact O-N 2.66Å; V200-I378 WeakPolarHBondContact CA-O 3.48Å; L201-I378 PolarHBondContact N-O 3.18Å; L213-I378 HydrophobicContact CD1-CD1 4.4Å; L213-I378 HydrophobicContact CD1-CG1 3.65Å; I378-L380 HydrophobicContact CG2-CD2 3.75Å; I378-L380 HydrophobicContact CG2-CG 4.15Å; I378-L395 HydrophobicContact CB-CD2 4.09Å; I378-L395 HydrophobicContact CD1-CD1 4.35Å; I378-L395 HydrophobicContact CD1-CD2 3.72Å; I378-L395 HydrophobicContact CD1-CG 4.36Å; I378-L395 HydrophobicContact CG1-CD2 4.5Å; I378-L395 HydrophobicContact CG2-CD2 3.78Å
379	I	94	Very high	87.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.2	173.9	-61.7	169.8	0	0	0	107.1	L201 S211 F212 V214 A218 V359 L364 L366	L201-I379 HydrophobicContact CB-CG1 4.38Å; S211-I379 VanDerWaalsContact CA-O 3.23Å; S211-I379 WeakPolarHBondContact CA-O 3.23Å; S211-I379 VanDerWaalsContact CB-O 3.28Å; S211-I379 WeakPolarHBondContact CB-O 3.43Å; F212-I379 HydrophobicContact CE1-CB 4.38Å; F212-I379 HydrophobicContact CE1-CD1 4.39Å; F212-I379 HydrophobicContact CE1-CG2 4.43Å; F212-I379 HydrophobicContact CE2-CD1 3.75Å; F212-I379 HydrophobicContact CZ-CB 4.39Å; F212-I379 HydrophobicContact CZ-CD1 3.61Å; F212-I379 PolarHBondContact N-O 3.43Å; F212-I379 PolarHBondContact O-N 3.29Å; F212-I379 VanDerWaalsContact O-N 3.09Å; V214-I379 HydrophobicContact CG2-CD1 3.85Å; V214-I379 HydrophobicContact CG2-CG1 4.46Å; A218-I379 HydrophobicContact CB-CD1 4.26Å; A218-I379 HydrophobicContact CB-CG1 4.38Å; V359-I379 HydrophobicContact CG1-CG2 4.05Å; L364-I379 HydrophobicContact CD1-CD1 3.89Å; L364-I379 HydrophobicContact CD1-CG1 4.37Å; L364-I379 HydrophobicContact CD1-CG2 4.4Å; L366-I379 HydrophobicContact CD2-CD1 3.85Å
380	L	93.8	Very high	87.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	131.6	179.4	-65	179	0	0	0	110.5	F171 V200 L201 A203 I378 M391 E392 L395	F171-L380 HydrophobicContact CE1-CD2 3.96Å; V200-L380 HydrophobicContact CG1-CD1 3.51Å; V200-L380 HydrophobicContact CG1-CG 3.88Å; L201-L380 PolarHBondContact O-N 3.03Å; A203-L380 PolarHBondContact N-O 2.97Å; I378-L380 HydrophobicContact CG2-CD2 3.75Å; I378-L380 HydrophobicContact CG2-CG 4.15Å; L380-M391 HydrophobicContact CD1-CB 4.01Å; L380-M391 HydrophobicContact CD2-CE 4.34Å; L380-E392 HydrophobicContact CD1-CB 4.08Å; L380-L395 HydrophobicContact CD1-CD2 4.25Å; L380-L395 HydrophobicContact CD2-CD2 4.19Å; L380-L395 HydrophobicContact CG-CD2 4.47Å
381	R	91.1	Very high	87.9	Confident	8 Å²	8	40.6 Å²	40.6	3%	0.03	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.1	174.4	-59.2	-63.6	-60.8	-156.2	5.8	108.4	A203 G205 S207 Q208 E210 S211 M391	A203-R381 WeakPolarHBondContact O-CA 3.47Å; G205-R381 VanDerWaalsContact C-NH2 3.29Å; G205-R381 VanDerWaalsContact O-CZ 3.27Å; G205-R381 PolarHBondContact O-NE 3.39Å; G205-R381 PolarHBondContact O-NH2 3.4Å; S207-R381 WeakPolarHBondContact O-CB 3.47Å; Q208-R381 WeakPolarHBondContact CA-O 3.32Å; E210-R381 HydrophobicContact CB-CG 4.37Å; S211-R381 PolarHBondContact OG-N 3.11Å; R381-M391 WeakPolarHBondContact O-CE 3.36Å
382	G	90.2	Very high	88.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	163.8	-179	0	0	0	0	0	111.4	H204 G205 N384	H204-G382 CarbonylContact C-O 3.37Å; H204-G382 WeakPolarHBondContact CA-O 3.26Å; G205-G382 PolarHBondContact N-O 3.39Å; G382-N384 PolarHBondContact O-N 3.09Å
383	A	89.9	Confident	89.1	Confident	77 Å²	77	37.4 Å²	37.4	64%	0.636	19%	0.194	S	C	*	.	S	Bend	trans	-65.9	-38.1	-174.4	0	0	0	0	0	112.9	M387	A383-M387 HydrophobicContact CB-SD 4.08Å
384	N	90	Very high	89.7	Confident	74 Å²	74	32 Å²	32	40%	0.396	17%	0.174	S	C	.	.	S	Bend	trans	-143.8	167.2	-179.3	59.8	6.1	0	0	0	110.2	G382 F386 M387 C388	G382-N384 PolarHBondContact O-N 3.09Å; N384-F386 VanDerWaalsContact C-N 3.3Å; N384-F386 PolarHBondContact O-N 3.35Å; N384-M387 PolarHBondContact O-N 3.2Å; N384-M387 WeakPolarHBondContact OD1-CB 3.44Å; N384-M387 PolarHBondContact OD1-N 3.49Å; N384-C388 PolarHBondContact O-N 3.12Å; N384-C388 VanDerWaalsContact O-N 3.09Å; N384-C388 PolarHBondContact O-SG 2.85Å; N384-C388 VanDerWaalsContact O-SG 3.41Å
385	D	89.2	Confident	90.5	Very high	84 Å²	84	27.4 Å²	27.4	45%	0.449	15%	0.146	S	C	.	.	H	α-helix	trans	-62.7	-37.1	-179.1	-66.4	-34.8	0	0	0	112.1	H204 M387 C388 D389	H204-D385 WeakPolarHBondContact CB-OD1 3.46Å; H204-D385 IonicContact CE1-OD1 3.89Å; H204-D385 IonicContact CG-OD1 3.68Å; H204-D385 IonicContact ND1-OD1 4Å; H204-D385 PolarHBondContact ND1-OD1 3.47Å; H204-D385 IonicContact ND1-OD2 2.66Å; D385-M387 VanDerWaalsContact C-N 3.33Å; D385-M387 PolarHBondContact O-N 3.23Å; D385-C388 CarbonylContact O-C 3.28Å; D385-C388 WeakPolarHBondContact O-CB 3.38Å; D385-C388 PolarHBondContact O-N 3.31Å; D385-C388 VanDerWaalsContact O-N 3.09Å; D385-D389 VanDerWaalsContact O-CG 3.31Å; D385-D389 PolarHBondContact O-N 2.95Å
386	F	89.5	Confident	90.9	Very high	94 Å²	94	30.3 Å²	30.3	41%	0.412	16%	0.158	S	C	.	.	H	α-helix	trans	-58.6	-42.1	176.4	-56.3	-60.9	0	0	0	113	V55 N384 E390	V55-F386 HydrophobicContact CB-CE1 4.38Å; V55-F386 VanDerWaalsContact O-CD1 3.22Å; V55-F386 WeakPolarHBondContact O-CD1 3.37Å; V55-F386 WeakPolarHBondContact O-CE1 3.06Å; N384-F386 VanDerWaalsContact C-N 3.3Å; N384-F386 PolarHBondContact O-N 3.35Å; F386-E390 PolarHBondContact O-N 3.29Å
387	M	89.7	Confident	91.1	Very high	39 Å²	39	30.7 Å²	30.7	19%	0.192	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-44.7	173.8	170.5	175.6	-94.3	0	0	110.7	I163 Q208 A383 N384 D385 D389 E390 M391	I163-M387 HydrophobicContact CD1-CB 4.39Å; I163-M387 HydrophobicContact CD1-CE 3.56Å; I163-M387 HydrophobicContact CD1-CG 4.02Å; I163-M387 HydrophobicContact CG1-CE 4Å; Q208-M387 HydrophobicContact CG-SD 4.14Å; Q208-M387 PolarHBondContact NE2-SD 3.01Å; A383-M387 HydrophobicContact CB-SD 4.08Å; N384-M387 PolarHBondContact O-N 3.2Å; N384-M387 WeakPolarHBondContact OD1-CB 3.44Å; N384-M387 PolarHBondContact OD1-N 3.49Å; D385-M387 VanDerWaalsContact C-N 3.33Å; D385-M387 PolarHBondContact O-N 3.23Å; M387-D389 VanDerWaalsContact C-N 3.29Å; M387-D389 PolarHBondContact O-N 2.95Å; M387-E390 PolarHBondContact O-N 3.43Å; M387-M391 HydrophobicContact CG-CG 4.18Å; M387-M391 HydrophobicContact CG-SD 3.79Å; M387-M391 WeakPolarHBondContact O-CB 3.42Å; M387-M391 WeakPolarHBondContact O-CG 3.49Å; M387-M391 PolarHBondContact O-N 3.24Å; M387-M391 HydrophobicContact SD-SD 4.49Å
388	C	90.8	Very high	91.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-38.6	178.3	-69.2	0	0	0	0	112.3	K202 N384 D385 M391 E392	K202-C388 HydrophobicContact CB-CB 4.09Å; K202-C388 HydrophobicContact CD-CB 3.99Å; K202-C388 HydrophobicContact CG-CB 4.07Å; N384-C388 PolarHBondContact O-N 3.12Å; N384-C388 VanDerWaalsContact O-N 3.09Å; N384-C388 PolarHBondContact O-SG 2.85Å; N384-C388 VanDerWaalsContact O-SG 3.41Å; D385-C388 CarbonylContact O-C 3.28Å; D385-C388 WeakPolarHBondContact O-CB 3.38Å; D385-C388 PolarHBondContact O-N 3.31Å; D385-C388 VanDerWaalsContact O-N 3.09Å; C388-M391 PolarHBondContact O-N 2.81Å; C388-E392 WeakPolarHBondContact O-CB 3.38Å; C388-E392 PolarHBondContact O-N 3.45Å
389	D	90.5	Very high	91	Very high	53 Å²	53	30.9 Å²	30.9	28%	0.283	16%	0.161	S	C	.	.	H	α-helix	trans	-63.4	-45.1	176	-73.4	-11.8	0	0	0	111.4	K202 D385 M387 E392 R393	K202-D389 VanDerWaalsContact CD-OD1 3.31Å; K202-D389 WeakPolarHBondContact CD-OD1 3.36Å; K202-D389 WeakPolarHBondContact CE-OD1 3.21Å; K202-D389 IonicContact NZ-OD1 3.97Å; K202-D389 PolarHBondContact NZ-OD1 2.82Å; D385-D389 VanDerWaalsContact O-CG 3.31Å; D385-D389 PolarHBondContact O-N 2.95Å; M387-D389 VanDerWaalsContact C-N 3.29Å; M387-D389 PolarHBondContact O-N 2.95Å; D389-E392 PolarHBondContact O-N 3.33Å; D389-R393 WeakPolarHBondContact O-CG 3.46Å; D389-R393 PolarHBondContact O-N 2.83Å; D389-R393 VanDerWaalsContact O-N 3.13Å
390	E	89.3	Confident	90.9	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.019	17%	0.165	C	C	.	.	H	α-helix	trans	-70.1	-34.5	177.3	-172.1	59.1	-172.1	0	0	112.2	T58 N59 I163 F386 M387 R393 S394	T58-E390 VanDerWaalsContact CA-OE2 3.26Å; T58-E390 WeakPolarHBondContact CA-OE2 3.2Å; T58-E390 WeakPolarHBondContact CB-OE2 3.37Å; T58-E390 PolarHBondContact OG1-OE1 2.91Å; T58-E390 PolarHBondContact OG1-OE2 2.96Å; N59-E390 PolarHBondContact N-OE1 2.85Å; I163-E390 HydrophobicContact CB-CG 4.4Å; I163-E390 HydrophobicContact CG2-CB 4.26Å; I163-E390 HydrophobicContact CG2-CG 3.97Å; F386-E390 PolarHBondContact O-N 3.29Å; M387-E390 PolarHBondContact O-N 3.43Å; E390-R393 PolarHBondContact O-N 2.85Å; E390-R393 IonicContact OE2-NH1 3.03Å; E390-R393 PolarHBondContact OE2-NH1 2.92Å; E390-R393 VanDerWaalsContact OE2-NH1 3.11Å; E390-S394 VanDerWaalsContact O-CB 3.28Å; E390-S394 WeakPolarHBondContact O-CB 3.38Å; E390-S394 PolarHBondContact O-N 3.45Å; E390-S394 PolarHBondContact O-OG 3.41Å
391	M	91.8	Very high	90.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.1	-41.8	172	-69.3	175.9	72.5	0	0	111.6	I163 I164 F171 Q208 L380 R381 M387 C388 S394 L395	I163-M391 HydrophobicContact CG2-CG 3.81Å; I164-M391 HydrophobicContact CG2-CB 4.05Å; I164-M391 HydrophobicContact CG2-CE 4.01Å; I164-M391 HydrophobicContact CG2-CG 3.59Å; F171-M391 HydrophobicContact CE1-CE 4Å; F171-M391 HydrophobicContact CE2-CE 4.15Å; F171-M391 HydrophobicContact CZ-CE 3.4Å; Q208-M391 HydrophobicContact CB-CE 3.97Å; Q208-M391 HydrophobicContact CG-CE 3.9Å; Q208-M391 HydrophobicContact CG-SD 3.93Å; L380-M391 HydrophobicContact CD1-CB 4.01Å; L380-M391 HydrophobicContact CD2-CE 4.34Å; R381-M391 WeakPolarHBondContact O-CE 3.36Å; M387-M391 HydrophobicContact CG-CG 4.18Å; M387-M391 HydrophobicContact CG-SD 3.79Å; M387-M391 WeakPolarHBondContact O-CB 3.42Å; M387-M391 WeakPolarHBondContact O-CG 3.49Å; M387-M391 PolarHBondContact O-N 3.24Å; M387-M391 HydrophobicContact SD-SD 4.49Å; C388-M391 PolarHBondContact O-N 2.81Å; M391-S394 PolarHBondContact O-N 3.1Å; M391-L395 VanDerWaalsContact O-CB 3.23Å; M391-L395 WeakPolarHBondContact O-CB 3.38Å; M391-L395 PolarHBondContact O-N 2.96Å
392	E	91.6	Very high	90.9	Very high	67 Å²	67	31.2 Å²	31.2	31%	0.313	16%	0.164	S	C	.	.	H	α-helix	trans	-59.6	-48.1	176.6	179.8	-178.7	-174	0	0	111	V200 K202 L380 C388 D389 L395 H396	V200-E392 HydrophobicContact CB-CG 4.41Å; V200-E392 HydrophobicContact CG1-CB 4.45Å; V200-E392 HydrophobicContact CG1-CG 4.02Å; K202-E392 HydrophobicContact CD-CB 4.33Å; K202-E392 VanDerWaalsContact CD-OE2 3.27Å; K202-E392 WeakPolarHBondContact CD-OE2 3.46Å; K202-E392 VanDerWaalsContact CE-OE2 3.23Å; K202-E392 WeakPolarHBondContact CE-OE2 3.38Å; K202-E392 IonicContact NZ-OE2 3.36Å; K202-E392 PolarHBondContact NZ-OE2 3.38Å; L380-E392 HydrophobicContact CD1-CB 4.08Å; C388-E392 WeakPolarHBondContact O-CB 3.38Å; C388-E392 PolarHBondContact O-N 3.45Å; D389-E392 PolarHBondContact O-N 3.33Å; E392-L395 PolarHBondContact O-N 3.31Å; E392-H396 PolarHBondContact O-N 3.47Å
393	R	89.1	Confident	90.9	Very high	62 Å²	62	33.3 Å²	33.3	23%	0.234	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-47.8	175.8	-66.6	-178	-165.2	128.4	-0.3	111.5	I57 D389 E390 L395 H396 D397	I57-R393 PolarHBondContact O-NH1 3.35Å; D389-R393 WeakPolarHBondContact O-CG 3.46Å; D389-R393 PolarHBondContact O-N 2.83Å; D389-R393 VanDerWaalsContact O-N 3.13Å; E390-R393 PolarHBondContact O-N 2.85Å; E390-R393 IonicContact OE2-NH1 3.03Å; E390-R393 PolarHBondContact OE2-NH1 2.92Å; E390-R393 VanDerWaalsContact OE2-NH1 3.11Å; R393-L395 VanDerWaalsContact C-N 3.27Å; R393-L395 PolarHBondContact O-N 2.95Å; R393-H396 WeakPolarHBondContact O-CB 3.49Å; R393-H396 PolarHBondContact O-N 3.23Å; R393-H396 VanDerWaalsContact O-N 3.09Å; R393-D397 PolarHBondContact O-N 3.01Å; R393-D397 VanDerWaalsContact O-N 3.08Å
394	S	90.9	Very high	90.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-58.8	-40.4	-179.9	-58.3	0	0	0	0	112.8	K162 I164 E390 M391 A398	K162-S394 WeakPolarHBondContact CB-OG 3.37Å; K162-S394 VanDerWaalsContact CD-CB 3.49Å; K162-S394 WeakPolarHBondContact CD-OG 3.47Å; I164-S394 VanDerWaalsContact CD1-CB 3.4Å; E390-S394 VanDerWaalsContact O-CB 3.28Å; E390-S394 WeakPolarHBondContact O-CB 3.38Å; E390-S394 PolarHBondContact O-N 3.45Å; E390-S394 PolarHBondContact O-OG 3.41Å; M391-S394 PolarHBondContact O-N 3.1Å; S394-A398 PolarHBondContact O-N 3.2Å
395	L	92.3	Very high	90.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-69.5	-39.3	177.2	-167.7	81.7	0	0	0	111.6	F171 V175 V200 I378 L380 M391 E392 R393 A398 L399	F171-L395 HydrophobicContact CD1-CD1 4.36Å; V175-L395 HydrophobicContact CG2-CD1 3.29Å; V175-L395 HydrophobicContact CG2-CG 4.06Å; V200-L395 HydrophobicContact CG1-CD2 4.03Å; V200-L395 HydrophobicContact CG2-CD2 3.9Å; I378-L395 HydrophobicContact CB-CD2 4.09Å; I378-L395 HydrophobicContact CD1-CD1 4.35Å; I378-L395 HydrophobicContact CD1-CD2 3.72Å; I378-L395 HydrophobicContact CD1-CG 4.36Å; I378-L395 HydrophobicContact CG1-CD2 4.5Å; I378-L395 HydrophobicContact CG2-CD2 3.78Å; L380-L395 HydrophobicContact CD1-CD2 4.25Å; L380-L395 HydrophobicContact CD2-CD2 4.19Å; L380-L395 HydrophobicContact CG-CD2 4.47Å; M391-L395 VanDerWaalsContact O-CB 3.23Å; M391-L395 WeakPolarHBondContact O-CB 3.38Å; M391-L395 PolarHBondContact O-N 2.96Å; E392-L395 PolarHBondContact O-N 3.31Å; R393-L395 VanDerWaalsContact C-N 3.27Å; R393-L395 PolarHBondContact O-N 2.95Å; L395-A398 PolarHBondContact O-N 3.14Å; L395-L399 HydrophobicContact CG-CD1 4.32Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 3.47Å
396	H	91.3	Very high	90.9	Very high	73 Å²	73	25.2 Å²	25.2	34%	0.338	12%	0.117	S	C	.	.	H	α-helix	trans	-59.2	-48.3	176.6	-174.6	69.8	0	0	0	111.6	E392 R393 A398 L399 C400	E392-H396 PolarHBondContact O-N 3.47Å; R393-H396 WeakPolarHBondContact O-CB 3.49Å; R393-H396 PolarHBondContact O-N 3.23Å; R393-H396 VanDerWaalsContact O-N 3.09Å; H396-A398 VanDerWaalsContact C-N 3.33Å; H396-A398 PolarHBondContact O-N 3.5Å; H396-L399 WeakPolarHBondContact O-CB 3.35Å; H396-L399 PolarHBondContact O-N 3.44Å; H396-C400 PolarHBondContact O-N 3.29Å; H396-C400 PolarHBondContact O-SG 3.25Å
397	D	90.9	Very high	90.7	Very high	9 Å²	9	24.2 Å²	24.2	5%	0.048	11%	0.113	C	C	.	.	H	α-helix	trans	-61.6	-42	177.6	-66.6	-2.4	0	0	0	111.9	G90 K162 R393 L399 C400 V401	G90-D397 WeakPolarHBondContact O-CA 3.22Å; K162-D397 VanDerWaalsContact CE-OD2 3.3Å; K162-D397 WeakPolarHBondContact CE-OD2 3.5Å; K162-D397 VanDerWaalsContact NZ-CG 3.3Å; K162-D397 IonicContact NZ-OD2 2.93Å; K162-D397 PolarHBondContact NZ-OD2 3.24Å; R393-D397 PolarHBondContact O-N 3.01Å; R393-D397 VanDerWaalsContact O-N 3.08Å; D397-L399 VanDerWaalsContact C-N 3.35Å; D397-L399 PolarHBondContact O-N 3.48Å; D397-C400 CarbonylContact O-C 3.58Å; D397-C400 WeakPolarHBondContact O-CA 3.13Å; D397-C400 VanDerWaalsContact O-CB 3.28Å; D397-C400 WeakPolarHBondContact O-CB 3.39Å; D397-C400 PolarHBondContact O-N 3.07Å; D397-C400 VanDerWaalsContact O-N 3.13Å; D397-V401 WeakPolarHBondContact O-CG2 3.29Å; D397-V401 PolarHBondContact O-N 3.23Å
398	A	92.5	Very high	90.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.7	-39.6	177.3	0	0	0	0	0	111.9	M159 V175 S394 L395 H396 C400 V401 V402	M159-A398 HydrophobicContact CE-CB 3.33Å; M159-A398 HydrophobicContact CG-CB 4.02Å; V175-A398 HydrophobicContact CG1-CB 4.18Å; V175-A398 HydrophobicContact CG2-CB 4.3Å; S394-A398 PolarHBondContact O-N 3.2Å; L395-A398 PolarHBondContact O-N 3.14Å; H396-A398 VanDerWaalsContact C-N 3.33Å; H396-A398 PolarHBondContact O-N 3.5Å; A398-C400 VanDerWaalsContact C-N 3.31Å; A398-C400 PolarHBondContact O-N 3.47Å; A398-V401 PolarHBondContact O-N 3.33Å; A398-V402 WeakPolarHBondContact O-CG2 3.29Å; A398-V402 PolarHBondContact O-N 3.17Å
399	L	92.9	Very high	90.2	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-40.3	172.1	-73.6	162.9	0	0	0	111.1	V175 A178 A179 I195 V198 L395 H396 D397 V402 K403	V175-L399 HydrophobicContact CB-CD2 4.4Å; V175-L399 HydrophobicContact CG1-CD2 3.77Å; V175-L399 HydrophobicContact CG1-CG 3.96Å; V175-L399 HydrophobicContact CG2-CG 4.41Å; A178-L399 HydrophobicContact CB-CD2 4.35Å; A179-L399 HydrophobicContact CB-CD2 4.38Å; I195-L399 VanDerWaalsContact CD1-C 3.46Å; I195-L399 HydrophobicContact CD1-CB 4.36Å; I195-L399 VanDerWaalsContact CD1-O 3.25Å; I195-L399 WeakPolarHBondContact CD1-O 3.34Å; I195-L399 HydrophobicContact CG1-CB 4.2Å; I195-L399 HydrophobicContact CG2-CB 3.54Å; I195-L399 HydrophobicContact CG2-CD1 4.01Å; I195-L399 HydrophobicContact CG2-CG 4.31Å; V198-L399 HydrophobicContact CG1-CD1 4.42Å; L395-L399 HydrophobicContact CG-CD1 4.32Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 3.47Å; H396-L399 WeakPolarHBondContact O-CB 3.35Å; H396-L399 PolarHBondContact O-N 3.44Å; D397-L399 VanDerWaalsContact C-N 3.35Å; D397-L399 PolarHBondContact O-N 3.48Å; L399-V402 PolarHBondContact O-N 3.37Å; L399-K403 WeakPolarHBondContact O-CB 3.4Å; L399-K403 PolarHBondContact O-N 3.37Å
400	C	91.8	Very high	90.1	Very high	14 Å²	14	28.5 Å²	28.5	10%	0.095	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-49.7	173.9	-77.9	0	0	0	0	112	I195 H396 D397 A398 V402 K403 R404	I195-C400 HydrophobicContact CD1-CB 4.18Å; H396-C400 PolarHBondContact O-N 3.29Å; H396-C400 PolarHBondContact O-SG 3.25Å; D397-C400 CarbonylContact O-C 3.58Å; D397-C400 WeakPolarHBondContact O-CA 3.13Å; D397-C400 VanDerWaalsContact O-CB 3.28Å; D397-C400 WeakPolarHBondContact O-CB 3.39Å; D397-C400 PolarHBondContact O-N 3.07Å; D397-C400 VanDerWaalsContact O-N 3.13Å; A398-C400 VanDerWaalsContact C-N 3.31Å; A398-C400 PolarHBondContact O-N 3.47Å; C400-V402 PolarHBondContact O-N 3.42Å; C400-K403 WeakPolarHBondContact O-CB 3.49Å; C400-K403 PolarHBondContact O-N 2.95Å; C400-R404 WeakPolarHBondContact O-CG 3.34Å; C400-R404 PolarHBondContact O-N 2.94Å
401	V	92.1	Very high	90.3	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-57.9	-51.3	175.9	168.6	0	0	0	0	111.2	D91 A154 D397 A398 K403 R404 V405 P509	D91-V401 HydrophobicContact CB-CG2 3.53Å; D91-V401 VanDerWaalsContact OD2-CG2 3.28Å; D91-V401 WeakPolarHBondContact OD2-CG2 3.1Å; A154-V401 HydrophobicContact CB-CG1 4.18Å; D397-V401 WeakPolarHBondContact O-CG2 3.29Å; D397-V401 PolarHBondContact O-N 3.23Å; A398-V401 PolarHBondContact O-N 3.33Å; V401-K403 VanDerWaalsContact C-N 3.34Å; V401-K403 PolarHBondContact O-N 3.03Å; V401-R404 PolarHBondContact O-N 3.46Å; V401-V405 WeakPolarHBondContact O-CG2 3.33Å; V401-V405 PolarHBondContact O-N 3.24Å; V401-P509 HydrophobicContact CB-CG 4.45Å; V401-P509 HydrophobicContact CG1-CG 3.76Å
402	V	91.9	Very high	90.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.6	-41.9	-179.2	170.8	0	0	0	0	111.7	L151 A155 V175 V176 A179 A398 L399 C400 R404 V405 L406	L151-V402 HydrophobicContact CD2-CG1 4.41Å; A155-V402 HydrophobicContact CB-CG2 3.79Å; V175-V402 HydrophobicContact CG1-CB 4.4Å; V175-V402 HydrophobicContact CG1-CG2 3.9Å; V176-V402 HydrophobicContact CG2-CG1 4.45Å; V176-V402 HydrophobicContact CG2-CG2 4.22Å; A179-V402 HydrophobicContact CB-CG1 3.68Å; A398-V402 WeakPolarHBondContact O-CG2 3.29Å; A398-V402 PolarHBondContact O-N 3.17Å; L399-V402 PolarHBondContact O-N 3.37Å; C400-V402 PolarHBondContact O-N 3.42Å; V402-R404 VanDerWaalsContact C-N 3.33Å; V402-R404 PolarHBondContact O-N 3.31Å; V402-V405 PolarHBondContact O-N 3.41Å; V402-L406 HydrophobicContact CG1-CD1 3.86Å; V402-L406 HydrophobicContact CG1-CG 4.38Å; V402-L406 WeakPolarHBondContact O-CB 3.07Å; V402-L406 VanDerWaalsContact O-CG 3.31Å; V402-L406 WeakPolarHBondContact O-CG 3.42Å; V402-L406 PolarHBondContact O-N 3Å
403	K	90.9	Very high	90.4	Very high	44 Å²	44	25.1 Å²	25.1	19%	0.191	12%	0.122	C	C	.	.	H	α-helix	trans	-56.7	-46.5	172.1	168.6	-173.4	178.2	-171.6	0	111.6	Y193 I195 L399 C400 V401 V405 L406 E407	Y193-K403 VanDerWaalsContact O-CD 3.32Å; Y193-K403 WeakPolarHBondContact O-CD 3.26Å; Y193-K403 WeakPolarHBondContact O-CE 3.27Å; I195-K403 HydrophobicContact CD1-CB 3.53Å; I195-K403 HydrophobicContact CD1-CD 3.31Å; I195-K403 HydrophobicContact CD1-CG 4.05Å; I195-K403 HydrophobicContact CG1-CB 3.95Å; I195-K403 HydrophobicContact CG1-CD 3.84Å; I195-K403 HydrophobicContact CG1-CG 4.45Å; L399-K403 WeakPolarHBondContact O-CB 3.4Å; L399-K403 PolarHBondContact O-N 3.37Å; C400-K403 WeakPolarHBondContact O-CB 3.49Å; C400-K403 PolarHBondContact O-N 2.95Å; V401-K403 VanDerWaalsContact C-N 3.34Å; V401-K403 PolarHBondContact O-N 3.03Å; K403-V405 VanDerWaalsContact C-N 3.32Å; K403-V405 PolarHBondContact O-N 3.48Å; K403-L406 PolarHBondContact O-N 3.44Å; K403-E407 WeakPolarHBondContact CE-OE1 3.31Å; K403-E407 HydrophobicContact CG-CG 4.26Å; K403-E407 WeakPolarHBondContact O-CB 3.32Å; K403-E407 WeakPolarHBondContact O-CG 3.45Å; K403-E407 PolarHBondContact O-N 2.91Å
404	R	90.5	Very high	90.5	Very high	32 Å²	32	22.2 Å²	22.2	12%	0.121	11%	0.11	C	C	.	.	H	α-helix	trans	-65.3	-37.3	-179.1	-63.6	-42.7	178.8	177.1	1.6	111.9	E88 C400 V401 V402 E407 S408 P509 M511	E88-R404 VanDerWaalsContact O-CZ 3.22Å; E88-R404 PolarHBondContact O-NE 3.5Å; E88-R404 PolarHBondContact O-NH2 3.49Å; C400-R404 WeakPolarHBondContact O-CG 3.34Å; C400-R404 PolarHBondContact O-N 2.94Å; V401-R404 PolarHBondContact O-N 3.46Å; V402-R404 VanDerWaalsContact C-N 3.33Å; V402-R404 PolarHBondContact O-N 3.31Å; R404-E407 IonicContact CZ-OE2 2.72Å; R404-E407 IonicContact NH1-OE2 3.26Å; R404-E407 PolarHBondContact NH1-OE2 2.92Å; R404-S408 VanDerWaalsContact O-CB 3.28Å; R404-S408 WeakPolarHBondContact O-CB 3.29Å; R404-S408 PolarHBondContact O-N 3Å; R404-S408 PolarHBondContact O-OG 3.32Å; R404-P509 HydrophobicContact CB-CB 4.03Å; R404-P509 HydrophobicContact CB-CG 4.14Å; R404-M511 HydrophobicContact CG-SD 4.47Å
405	V	90.3	Very high	90.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-45.7	173.1	-177	0	0	0	0	110.8	T143 L151 A154 V401 V402 K403 E407 K409 V411 P509	T143-V405 HydrophobicContact CG2-CG1 3.41Å; T143-V405 VanDerWaalsContact CG2-CG1 3.41Å; L151-V405 HydrophobicContact CD2-CB 3.88Å; L151-V405 HydrophobicContact CD2-CG1 3.56Å; A154-V405 HydrophobicContact CB-CG2 3.94Å; V401-V405 WeakPolarHBondContact O-CG2 3.33Å; V401-V405 PolarHBondContact O-N 3.24Å; V402-V405 PolarHBondContact O-N 3.41Å; K403-V405 VanDerWaalsContact C-N 3.32Å; K403-V405 PolarHBondContact O-N 3.48Å; V405-E407 PolarHBondContact O-N 3.25Å; V405-K409 WeakPolarHBondContact O-CA 3.07Å; V405-K409 PolarHBondContact O-N 2.89Å; V405-V411 HydrophobicContact CG1-CG1 3.74Å; V405-V411 HydrophobicContact CG2-CG1 3.98Å; V405-P509 HydrophobicContact CG2-CB 4.12Å; V405-P509 HydrophobicContact CG2-CG 3.75Å
406	L	88.1	Confident	90.4	Very high	34 Å²	34	23 Å²	23	18%	0.178	12%	0.119	C	C	.	.	H	α-helix	trans	-65.6	-34.3	179.5	-72.3	168.9	0	0	0	113.7	L151 A179 Y193 V402 K403	L151-L406 HydrophobicContact CD1-CD2 3.72Å; L151-L406 HydrophobicContact CD1-CG 4.4Å; L151-L406 HydrophobicContact CD2-CD2 3.87Å; L151-L406 HydrophobicContact CD2-CG 3.88Å; L151-L406 HydrophobicContact CG-CD2 4.46Å; A179-L406 HydrophobicContact CB-CD1 4.38Å; Y193-L406 HydrophobicContact CD1-CD1 3.89Å; Y193-L406 HydrophobicContact CD2-CB 3.82Å; Y193-L406 HydrophobicContact CD2-CD1 4.26Å; Y193-L406 HydrophobicContact CE1-CD1 3.78Å; Y193-L406 HydrophobicContact CE2-CB 3.51Å; Y193-L406 HydrophobicContact CE2-CD1 4.2Å; Y193-L406 HydrophobicContact CE2-CG 4.35Å; Y193-L406 HydrophobicContact CG-CB 4.49Å; Y193-L406 HydrophobicContact CG-CD1 4.12Å; V402-L406 HydrophobicContact CG1-CD1 3.86Å; V402-L406 HydrophobicContact CG1-CG 4.38Å; V402-L406 WeakPolarHBondContact O-CB 3.07Å; V402-L406 VanDerWaalsContact O-CG 3.31Å; V402-L406 WeakPolarHBondContact O-CG 3.42Å; V402-L406 PolarHBondContact O-N 3Å; K403-L406 PolarHBondContact O-N 3.44Å
407	E	86.4	Confident	90.5	Very high	72 Å²	72	19.5 Å²	19.5	34%	0.336	10%	0.103	S	C	.	.	H	α-helix	trans	-79.6	-42.8	178.8	-72.6	176.5	168.1	0	0	112.5	Y193 K403 R404 V405	Y193-E407 HydrophobicContact CD2-CG 4.27Å; K403-E407 WeakPolarHBondContact CE-OE1 3.31Å; K403-E407 HydrophobicContact CG-CG 4.26Å; K403-E407 WeakPolarHBondContact O-CB 3.32Å; K403-E407 WeakPolarHBondContact O-CG 3.45Å; K403-E407 PolarHBondContact O-N 2.91Å; R404-E407 IonicContact CZ-OE2 2.72Å; R404-E407 IonicContact NH1-OE2 3.26Å; R404-E407 PolarHBondContact NH1-OE2 2.92Å; V405-E407 PolarHBondContact O-N 3.25Å
408	S	82.8	Confident	90.7	Very high	43 Å²	43	19.1 Å²	19.1	30%	0.301	10%	0.101	S	C	.	.	H	α-helix	trans	-93.1	-15.7	-172.6	68.5	0	0	0	0	114.5	R404 S410	R404-S408 VanDerWaalsContact O-CB 3.28Å; R404-S408 WeakPolarHBondContact O-CB 3.29Å; R404-S408 PolarHBondContact O-N 3Å; R404-S408 PolarHBondContact O-OG 3.32Å; S408-S410 PolarHBondContact O-N 3.4Å; S408-S410 PolarHBondContact O-OG 3.34Å
409	K	85.6	Confident	90.8	Very high	112 Å²	112	20 Å²	20	49%	0.487	11%	0.105	S	C	.	.			trans	52.8	16.1	-179.1	-65.1	-169.5	169.7	-153.8	0	116.1	T143 D144 V405	T143-K409 WeakPolarHBondContact CB-O 3.35Å; T143-K409 WeakPolarHBondContact CG2-O 3.39Å; T143-K409 PolarHBondContact N-O 3.41Å; T143-K409 WeakPolarHBondContact OG1-CA 3.27Å; T143-K409 WeakPolarHBondContact OG1-CB 3.45Å; T143-K409 PolarHBondContact OG1-O 3.42Å; D144-K409 IonicContact OD1-NZ 2.77Å; D144-K409 IonicContact OD2-NZ 2.63Å; V405-K409 WeakPolarHBondContact O-CA 3.07Å; V405-K409 PolarHBondContact O-N 2.89Å
410	S	89.6	Confident	90.9	Very high	28 Å²	28	19.9 Å²	19.9	20%	0.196	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.8	-178.6	59.9	0	0	0	0	111	I141 S408 T510	I141-S410 WeakPolarHBondContact O-CA 3.33Å; S408-S410 PolarHBondContact O-N 3.4Å; S408-S410 PolarHBondContact O-OG 3.34Å; S410-T510 WeakPolarHBondContact CB-OG1 3.44Å; S410-T510 PolarHBondContact O-N 3.03Å; S410-T510 PolarHBondContact O-OG1 2.92Å; S410-T510 WeakPolarHBondContact OG-CB 3.43Å; S410-T510 PolarHBondContact OG-OG1 3.35Å
411	V	92.2	Very high	91	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	159.6	176.7	-61.4	0	0	0	0	110.6	T140 I141 T143 L146 V405 Y507 E508 T510	T140-V411 CarbonylContact C-O 3.58Å; I141-V411 HydrophobicContact CB-CG2 3.99Å; I141-V411 PolarHBondContact N-O 3.43Å; I141-V411 PolarHBondContact O-N 2.93Å; T143-V411 HydrophobicContact CG2-CG1 3.99Å; L146-V411 HydrophobicContact CD1-CG2 4.19Å; V405-V411 HydrophobicContact CG1-CG1 3.74Å; V405-V411 HydrophobicContact CG2-CG1 3.98Å; V411-Y507 HydrophobicContact CG2-CD1 3.97Å; V411-Y507 HydrophobicContact CG2-CG 4.19Å; V411-E508 CarbonylContact C-O 3.51Å; V411-E508 WeakPolarHBondContact CA-O 3.3Å; V411-T510 PolarHBondContact N-OG1 3.11Å
412	V	93.2	Very high	91.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	153.9	176.4	-65	0	0	0	0	109.4	I135 G414 V418 E508 T510 K513	I135-V412 HydrophobicContact CG2-CG1 4.08Å; V412-G414 PolarHBondContact O-N 2.9Å; V412-V418 HydrophobicContact CB-CG2 3.88Å; V412-V418 HydrophobicContact CG2-CG2 4Å; V412-E508 HydrophobicContact CG2-CB 4.3Å; V412-E508 WeakPolarHBondContact CG2-O 3.24Å; V412-E508 PolarHBondContact N-O 3.35Å; V412-E508 PolarHBondContact O-N 3.04Å; V412-T510 HydrophobicContact CG1-CG2 4Å; V412-K513 HydrophobicContact CG2-CG 3.83Å
413	P	92.9	Very high	91.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	132	174.3	30.1	-38.9	0	0	0	110.7	A417 V418 W488 N501	P413-A417 HydrophobicContact CB-CB 4.09Å; P413-A417 HydrophobicContact CG-CB 4.04Å; P413-V418 HydrophobicContact CG-CG2 4.34Å; P413-V418 WeakPolarHBondContact O-CG2 3.5Å; P413-W488 HydrophobicContact CB-CE3 4.39Å; P413-W488 HydrophobicContact CG-CE3 3.84Å; P413-W488 HydrophobicContact CG-CZ3 4.27Å; P413-N501 HydrophobicContact CB-CB 4.33Å
414	G	91.3	Very high	91.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-162.9	175.2	0	0	0	0	0	113.3	V412 A417 N501 V506 E508	V412-G414 PolarHBondContact O-N 2.9Å; G414-A417 WeakPolarHBondContact O-CB 3.27Å; G414-N501 PolarHBondContact O-ND2 3.31Å; G414-V506 PolarHBondContact N-O 3.28Å; G414-E508 WeakPolarHBondContact CA-OE1 3.19Å
415	G	89.4	Confident	91.6	Very high	16 Å²	16	17.8 Å²	17.8	17%	0.165	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	35.2	170.5	0	0	0	0	0	114.9	A417 L491	G415-A417 VanDerWaalsContact C-N 3.26Å; G415-A417 PolarHBondContact O-N 2.67Å; G415-L491 PolarHBondContact O-N 3.47Å
416	G	91.9	Very high	91.8	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.01	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	2.7	177.6	0	0	0	0	0	115.2	E419 A420	G416-E419 VanDerWaalsContact CA-OE2 3.26Å; G416-E419 WeakPolarHBondContact CA-OE2 3.45Å; G416-A420 WeakPolarHBondContact O-CB 3.32Å; G416-A420 PolarHBondContact O-N 3.02Å; G416-A420 VanDerWaalsContact O-N 3.13Å
417	A	93.5	Very high	92.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.1	-46.2	-178.9	0	0	0	0	0	112.1	P413 G414 G415 A420 A421 H474 I489	P413-A417 HydrophobicContact CB-CB 4.09Å; P413-A417 HydrophobicContact CG-CB 4.04Å; G414-A417 WeakPolarHBondContact O-CB 3.27Å; G415-A417 VanDerWaalsContact C-N 3.26Å; G415-A417 PolarHBondContact O-N 2.67Å; A417-A420 PolarHBondContact O-N 3.32Å; A417-A421 WeakPolarHBondContact O-CB 3.2Å; A417-A421 PolarHBondContact O-N 2.91Å; A417-H474 PolarHBondContact O-CE1 3.01Å; A417-H474 VanDerWaalsContact O-CE1 3.29Å; A417-H474 PolarHBondContact O-NE2 3.46Å; A417-I489 WeakPolarHBondContact CB-O 3.41Å
418	V	94.6	Very high	92.3	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-63.7	-44.6	-179.7	173.4	0	0	0	0	110.7	I135 L139 V412 P413 A420 A421 L422 K513	I135-V418 HydrophobicContact CD1-CG1 4.25Å; I135-V418 HydrophobicContact CG1-CG1 4.16Å; L139-V418 HydrophobicContact CD1-CB 4.45Å; L139-V418 HydrophobicContact CD1-CG1 4.1Å; L139-V418 HydrophobicContact CD1-CG2 4.34Å; V412-V418 HydrophobicContact CB-CG2 3.88Å; V412-V418 HydrophobicContact CG2-CG2 4Å; P413-V418 HydrophobicContact CG-CG2 4.34Å; P413-V418 WeakPolarHBondContact O-CG2 3.5Å; V418-A420 PolarHBondContact O-N 2.84Å; V418-A421 PolarHBondContact O-N 3.13Å; V418-L422 HydrophobicContact CG1-CD1 3.75Å; V418-L422 HydrophobicContact CG1-CG 4.3Å; V418-L422 WeakPolarHBondContact O-CB 3.48Å; V418-L422 WeakPolarHBondContact O-CG 3.44Å; V418-L422 PolarHBondContact O-N 2.88Å; V418-K513 HydrophobicContact CG1-CG 4.39Å
419	E	95.3	Very high	92.7	Very high	18 Å²	18	19.2 Å²	19.2	8%	0.084	10%	0.095	C	C	.	.	H	α-helix	trans	-63.8	-40.5	-179.7	-67.6	78.1	-172.2	0	0	112	G416 S423 L448 I451 K513	G416-E419 VanDerWaalsContact CA-OE2 3.26Å; G416-E419 WeakPolarHBondContact CA-OE2 3.45Å; E419-S423 WeakPolarHBondContact O-CB 3.49Å; E419-S423 PolarHBondContact O-N 3.05Å; E419-L448 HydrophobicContact CB-CB 4.39Å; E419-I451 HydrophobicContact CG-CB 4.12Å; E419-I451 HydrophobicContact CG-CG1 4.3Å; E419-I451 HydrophobicContact CG-CG2 4.43Å; E419-K513 WeakPolarHBondContact OE1-CE 3.38Å; E419-K513 IonicContact OE1-NZ 3.12Å; E419-K513 PolarHBondContact OE1-NZ 3.5Å; E419-K513 IonicContact OE2-NZ 3.85Å
420	A	94.3	Very high	93	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-68.2	-42.6	176.1	0	0	0	0	0	112.7	G416 A417 V418 L422 S423 I424 L470	G416-A420 WeakPolarHBondContact O-CB 3.32Å; G416-A420 PolarHBondContact O-N 3.02Å; G416-A420 VanDerWaalsContact O-N 3.13Å; A417-A420 PolarHBondContact O-N 3.32Å; V418-A420 PolarHBondContact O-N 2.84Å; A420-L422 VanDerWaalsContact C-N 3.35Å; A420-L422 PolarHBondContact O-N 3.39Å; A420-S423 WeakPolarHBondContact O-CB 3.28Å; A420-S423 PolarHBondContact O-N 3.39Å; A420-I424 PolarHBondContact O-N 3.5Å; A420-L470 HydrophobicContact CB-CD1 4.46Å; A420-L470 HydrophobicContact CB-CD2 3.54Å; A420-L470 HydrophobicContact CB-CG 3.61Å
421	A	93.9	Very high	93	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-60.5	-45.8	175.8	0	0	0	0	0	111.5	Y134 L139 A417 V418 I424 Y425 Q478	Y134-A421 HydrophobicContact CE1-CB 4.27Å; L139-A421 HydrophobicContact CD1-CB 4.02Å; L139-A421 HydrophobicContact CD2-CB 4.11Å; A417-A421 WeakPolarHBondContact O-CB 3.2Å; A417-A421 PolarHBondContact O-N 2.91Å; V418-A421 PolarHBondContact O-N 3.13Å; A421-I424 PolarHBondContact O-N 3.03Å; A421-Y425 WeakPolarHBondContact O-CB 3.46Å; A421-Y425 PolarHBondContact O-N 3.37Å; A421-Q478 PolarHBondContact O-NE2 3.17Å
422	L	95.1	Very high	92.8	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-65.6	-39	178.5	-73.3	174.3	0	0	0	112.7	A131 Y134 I135 V418 A420 I424 Y425 L426 L448 L517	A131-L422 HydrophobicContact CB-CD1 4.38Å; A131-L422 HydrophobicContact CB-CD2 3.82Å; Y134-L422 HydrophobicContact CD1-CD2 3.77Å; Y134-L422 HydrophobicContact CG-CD2 4.36Å; I135-L422 HydrophobicContact CD1-CD1 3.96Å; I135-L422 HydrophobicContact CG1-CD1 4.06Å; I135-L422 HydrophobicContact CG1-CD2 4.13Å; I135-L422 HydrophobicContact CG1-CG 4.44Å; V418-L422 HydrophobicContact CG1-CD1 3.75Å; V418-L422 HydrophobicContact CG1-CG 4.3Å; V418-L422 WeakPolarHBondContact O-CB 3.48Å; V418-L422 WeakPolarHBondContact O-CG 3.44Å; V418-L422 PolarHBondContact O-N 2.88Å; A420-L422 VanDerWaalsContact C-N 3.35Å; A420-L422 PolarHBondContact O-N 3.39Å; L422-I424 VanDerWaalsContact C-N 3.32Å; L422-I424 PolarHBondContact O-N 3.39Å; L422-Y425 PolarHBondContact O-N 3.07Å; L422-L426 VanDerWaalsContact O-CB 3.28Å; L422-L426 WeakPolarHBondContact O-CB 3.26Å; L422-L426 VanDerWaalsContact O-CG 3.28Å; L422-L426 WeakPolarHBondContact O-CG 3.28Å; L422-L426 PolarHBondContact O-N 3.46Å; L422-L448 HydrophobicContact CB-CD1 3.64Å; L422-L517 HydrophobicContact CD1-CD1 3.91Å
423	S	95.4	Very high	92.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-54.9	-49.1	176.5	-173.2	0	0	0	0	111.1	E419 A420 E427 A445	E419-S423 WeakPolarHBondContact O-CB 3.49Å; E419-S423 PolarHBondContact O-N 3.05Å; A420-S423 WeakPolarHBondContact O-CB 3.28Å; A420-S423 PolarHBondContact O-N 3.39Å; S423-E427 WeakPolarHBondContact O-CB 3.32Å; S423-E427 WeakPolarHBondContact O-CG 3.2Å; S423-E427 PolarHBondContact O-N 2.83Å; S423-A445 VanDerWaalsContact CB-O 3.28Å; S423-A445 WeakPolarHBondContact CB-O 3.35Å; S423-A445 WeakPolarHBondContact O-CB 3.42Å; S423-A445 PolarHBondContact OG-O 2.98Å
424	I	94.2	Very high	91.4	Very high	7 Å²	7	27.6 Å²	27.6	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-72	-41.8	-177.7	-61.1	168	0	0	0	111.6	A420 A421 L422 L426 E427 N428 R471 H474 N475	A420-I424 PolarHBondContact O-N 3.5Å; A421-I424 PolarHBondContact O-N 3.03Å; L422-I424 VanDerWaalsContact C-N 3.32Å; L422-I424 PolarHBondContact O-N 3.39Å; I424-L426 VanDerWaalsContact C-N 3.33Å; I424-L426 PolarHBondContact O-N 2.98Å; I424-E427 PolarHBondContact O-N 3.47Å; I424-N428 PolarHBondContact O-N 3.21Å; I424-N428 PolarHBondContact O-ND2 2.8Å; I424-R471 HydrophobicContact CD1-CB 4.24Å; I424-R471 WeakPolarHBondContact CD1-O 3.47Å; I424-H474 HydrophobicContact CD1-CB 3.48Å; I424-H474 VanDerWaalsContact CD1-CB 3.48Å; I424-N475 HydrophobicContact CD1-CB 3.99Å; I424-N475 VanDerWaalsContact CD1-N 3.28Å; I424-N475 HydrophobicContact CG2-CB 4.32Å
425	Y	94.4	Very high	90.9	Very high	40 Å²	40	30 Å²	30	16%	0.157	19%	0.192	C	C	.	.	H	α-helix	trans	-60.2	-45.5	178.5	171.6	-102.5	0	0	0	111.1	E130 R133 Y134 A421 L422 N428 Y429	E130-Y425 HydrophobicContact CB-CE1 4.34Å; E130-Y425 PolarHBondContact OE2-OH 2.92Å; R133-Y425 PolarHBondContact NH2-OH 2.94Å; R133-Y425 VanDerWaalsContact NH2-OH 3.09Å; Y134-Y425 HydrophobicContact CD1-CG 4.45Å; Y134-Y425 AromaticContact CD2-CD1 3.86Å; Y134-Y425 HydrophobicContact CD2-CD1 3.86Å; Y134-Y425 AromaticContact CD2-CD2 3.37Å; Y134-Y425 HydrophobicContact CD2-CD2 3.37Å; Y134-Y425 HydrophobicContact CD2-CE1 4.04Å; Y134-Y425 AromaticContact CD2-CE2 3.56Å; Y134-Y425 HydrophobicContact CD2-CE2 3.56Å; Y134-Y425 AromaticContact CD2-CG 3.52Å; Y134-Y425 HydrophobicContact CD2-CG 3.52Å; Y134-Y425 AromaticContact CD2-CZ 3.91Å; Y134-Y425 AromaticContact CE2-CD2 3.52Å; Y134-Y425 HydrophobicContact CE2-CD2 3.52Å; Y134-Y425 HydrophobicContact CE2-CE2 4.05Å; Y134-Y425 AromaticContact CE2-CG 3.82Å; Y134-Y425 HydrophobicContact CE2-CG 3.82Å; Y134-Y425 AromaticContact CG-CD1 3.84Å; Y134-Y425 HydrophobicContact CG-CD1 3.84Å; Y134-Y425 HydrophobicContact CG-CD2 4.18Å; Y134-Y425 HydrophobicContact CG-CE1 4.14Å; Y134-Y425 HydrophobicContact CG-CE2 4.44Å; Y134-Y425 AromaticContact CG-CG 3.87Å; Y134-Y425 HydrophobicContact CG-CG 3.87Å; A421-Y425 WeakPolarHBondContact O-CB 3.46Å; A421-Y425 PolarHBondContact O-N 3.37Å; L422-Y425 PolarHBondContact O-N 3.07Å; Y425-N428 PolarHBondContact O-N 3.43Å; Y425-Y429 WeakPolarHBondContact O-CB 2.82Å; Y425-Y429 PolarHBondContact O-N 2.74Å
426	L	94.7	Very high	90.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-71.3	-33.5	179.7	-70.4	175.4	0	0	0	112.8	A127 E130 A131 L422 I424 Y429 A430 I441 F444 A445 L448	A127-L426 HydrophobicContact CB-CD1 4.43Å; A127-L426 HydrophobicContact CB-CD2 4.33Å; E130-L426 HydrophobicContact CB-CD2 4.17Å; A131-L426 HydrophobicContact CB-CD1 4.29Å; L422-L426 VanDerWaalsContact O-CB 3.28Å; L422-L426 WeakPolarHBondContact O-CB 3.26Å; L422-L426 VanDerWaalsContact O-CG 3.28Å; L422-L426 WeakPolarHBondContact O-CG 3.28Å; L422-L426 PolarHBondContact O-N 3.46Å; I424-L426 VanDerWaalsContact C-N 3.33Å; I424-L426 PolarHBondContact O-N 2.98Å; L426-Y429 PolarHBondContact O-N 2.93Å; L426-A430 VanDerWaalsContact O-CB 3.31Å; L426-A430 WeakPolarHBondContact O-CB 3.35Å; L426-A430 PolarHBondContact O-N 2.91Å; L426-I441 HydrophobicContact CB-CG2 4.32Å; L426-I441 HydrophobicContact CD2-CG2 4.48Å; L426-F444 HydrophobicContact CD1-CD1 3.7Å; L426-F444 HydrophobicContact CD1-CE1 4Å; L426-A445 HydrophobicContact CB-CB 3.63Å; L426-A445 HydrophobicContact CD1-CB 4.44Å; L426-L448 HydrophobicContact CD1-CD1 3.93Å
427	E	92.7	Very high	90.1	Very high	42 Å²	42	41 Å²	41	20%	0.196	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-43.8	172.3	-79.6	178.3	160.2	0	0	111.4	S423 I424 A430 T431 A445 R471	S423-E427 WeakPolarHBondContact O-CB 3.32Å; S423-E427 WeakPolarHBondContact O-CG 3.2Å; S423-E427 PolarHBondContact O-N 2.83Å; I424-E427 PolarHBondContact O-N 3.47Å; E427-A430 WeakPolarHBondContact O-CB 3.28Å; E427-A430 PolarHBondContact O-N 2.96Å; E427-T431 PolarHBondContact O-N 3.28Å; E427-T431 PolarHBondContact O-OG1 2.84Å; E427-A445 HydrophobicContact CG-CB 3.89Å; E427-R471 IonicContact OE1-CZ 3.35Å; E427-R471 IonicContact OE1-NH2 2.88Å; E427-R471 PolarHBondContact OE1-NH2 3.12Å; E427-R471 IonicContact OE2-CZ 2.79Å; E427-R471 IonicContact OE2-NH2 3.44Å; E427-R471 PolarHBondContact OE2-NH2 3.47Å
428	N	91.8	Very high	90	Very high	84 Å²	84	44.2 Å²	44.2	45%	0.449	25%	0.246	S	C	.	.	H	α-helix	trans	-65.5	-43.2	175.2	-71.7	-29.7	0	0	0	111.4	I424 Y425 A430 T431 S432	I424-N428 PolarHBondContact O-N 3.21Å; I424-N428 PolarHBondContact O-ND2 2.8Å; Y425-N428 PolarHBondContact O-N 3.43Å; N428-A430 VanDerWaalsContact C-N 3.34Å; N428-A430 PolarHBondContact O-N 3Å; N428-T431 WeakPolarHBondContact O-CB 3.26Å; N428-T431 PolarHBondContact O-N 3.16Å; N428-S432 PolarHBondContact O-N 2.96Å
429	Y	91.6	Very high	89.9	Confident	52 Å²	52	48.1 Å²	48.1	20%	0.204	27%	0.266	C	S	.	.	H	α-helix	trans	-62.2	-40.1	175.5	-178.2	-104.1	0	0	0	112.2	L126 E130 Y425 L426 T431 S432 M433 I441	L126-Y429 HydrophobicContact CD2-CE1 4.25Å; L126-Y429 HydrophobicContact CG-CE1 4.23Å; E130-Y429 HydrophobicContact CG-CD1 4.33Å; E130-Y429 HydrophobicContact CG-CE1 3.77Å; E130-Y429 HydrophobicContact CG-CE2 4.25Å; Y425-Y429 WeakPolarHBondContact O-CB 2.82Å; Y425-Y429 PolarHBondContact O-N 2.74Å; L426-Y429 PolarHBondContact O-N 2.93Å; Y429-T431 PolarHBondContact O-N 3.01Å; Y429-S432 WeakPolarHBondContact O-CB 3.33Å; Y429-S432 PolarHBondContact O-N 3.24Å; Y429-S432 PolarHBondContact O-OG 2.87Å; Y429-M433 HydrophobicContact CE1-CG 4.35Å; Y429-I441 HydrophobicContact CD1-CD1 4.29Å; Y429-I441 HydrophobicContact CD1-CG2 4.36Å; Y429-I441 HydrophobicContact CE1-CD1 4.11Å
430	A	91.6	Very high	89.8	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-38.1	175.3	0	0	0	0	0	111.3	L426 E427 N428 S432 M433 Q438 I441 A442	L426-A430 VanDerWaalsContact O-CB 3.31Å; L426-A430 WeakPolarHBondContact O-CB 3.35Å; L426-A430 PolarHBondContact O-N 2.91Å; E427-A430 WeakPolarHBondContact O-CB 3.28Å; E427-A430 PolarHBondContact O-N 2.96Å; N428-A430 VanDerWaalsContact C-N 3.34Å; N428-A430 PolarHBondContact O-N 3Å; A430-S432 VanDerWaalsContact C-N 3.26Å; A430-S432 PolarHBondContact O-N 3.37Å; A430-M433 WeakPolarHBondContact O-CB 3.28Å; A430-M433 PolarHBondContact O-N 3.39Å; A430-M433 VanDerWaalsContact O-O 3.13Å; A430-Q438 HydrophobicContact CB-CG 4.15Å; A430-Q438 VanDerWaalsContact O-CG 3.25Å; A430-Q438 WeakPolarHBondContact O-CG 3.23Å; A430-Q438 PolarHBondContact O-NE2 2.87Å; A430-I441 HydrophobicContact CB-CB 4.02Å; A430-I441 HydrophobicContact CB-CG2 3.83Å; A430-A442 HydrophobicContact CB-CB 4.4Å
431	T	89	Confident	89.8	Confident	106 Å²	106	47.3 Å²	47.3	65%	0.65	26%	0.262	S	S	*	.	H	α-helix	trans	-66.9	-26.4	178.2	-52.8	0	0	0	0	113	E427 N428 Y429 M433	E427-T431 PolarHBondContact O-N 3.28Å; E427-T431 PolarHBondContact O-OG1 2.84Å; N428-T431 WeakPolarHBondContact O-CB 3.26Å; N428-T431 PolarHBondContact O-N 3.16Å; Y429-T431 PolarHBondContact O-N 3.01Å; T431-M433 PolarHBondContact O-N 3.25Å
432	S	87.9	Confident	89.7	Confident	88 Å²	88	48.3 Å²	48.3	62%	0.615	27%	0.271	S	S	*	.	H	α-helix	trans	-73.2	-15.2	173.1	76.5	0	0	0	0	113.4	N428 Y429 A430	N428-S432 PolarHBondContact O-N 2.96Å; Y429-S432 WeakPolarHBondContact O-CB 3.33Å; Y429-S432 PolarHBondContact O-N 3.24Å; Y429-S432 PolarHBondContact O-OG 2.87Å; A430-S432 VanDerWaalsContact C-N 3.26Å; A430-S432 PolarHBondContact O-N 3.37Å
433	M	82.7	Confident	89.7	Confident	32 Å²	32	50.3 Å²	50.3	16%	0.158	28%	0.28	C	S	.	.			trans	-96.8	126.2	179	-65.4	-104.8	-65.1	0	0	110.1	L126 Y429 A430 T431 E437 Q438 I441	L126-M433 HydrophobicContact CD2-CE 3.43Å; L126-M433 VanDerWaalsContact CD2-CE 3.43Å; L126-M433 HydrophobicContact CD2-SD 3.82Å; Y429-M433 HydrophobicContact CE1-CG 4.35Å; A430-M433 WeakPolarHBondContact O-CB 3.28Å; A430-M433 PolarHBondContact O-N 3.39Å; A430-M433 VanDerWaalsContact O-O 3.13Å; T431-M433 PolarHBondContact O-N 3.25Å; M433-E437 HydrophobicContact CE-CB 3.88Å; M433-Q438 PolarHBondContact O-OE1 2.69Å; M433-I441 HydrophobicContact CE-CD1 3.62Å; M433-I441 HydrophobicContact CG-CD1 4.42Å
434	G	74.3	Confident	89.7	Confident	88 Å²	88	50.3 Å²	50.3	91%	0.907	28%	0.28	S	S	*	.			trans	-91.9	4.4	177.9	0	0	0	0	0	115.5
435	S	80.4	Confident	89.8	Confident	51 Å²	51	50 Å²	50	36%	0.357	28%	0.278	S	S	.	.	S	Bend	trans	-98	169.2	-172.5	75.9	0	0	0	0	112.6	E437 Q438	S435-E437 PolarHBondContact O-N 2.93Å; S435-E437 WeakPolarHBondContact OG-CB 3.19Å; S435-E437 PolarHBondContact OG-N 3.09Å; S435-Q438 WeakPolarHBondContact O-CB 3.5Å; S435-Q438 PolarHBondContact O-N 3.39Å
436	R	80.6	Confident	89.7	Confident	189 Å²	189	54.5 Å²	54.5	71%	0.713	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.6	173.4	-68.1	-178.9	179.3	176.2	-1.2	113.6	Q438 L439	R436-Q438 PolarHBondContact O-N 3.1Å; R436-L439 PolarHBondContact O-N 3.23Å
437	E	84.8	Confident	89.8	Confident	59 Å²	59	54.6 Å²	54.6	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-68.1	-21.2	176.2	-56.9	175.4	152.6	0	0	112	S122 M433 S435 L439 A440 I441	S122-E437 VanDerWaalsContact CB-OE1 3.3Å; S122-E437 WeakPolarHBondContact CB-OE1 3.43Å; M433-E437 HydrophobicContact CE-CB 3.88Å; S435-E437 PolarHBondContact O-N 2.93Å; S435-E437 WeakPolarHBondContact OG-CB 3.19Å; S435-E437 PolarHBondContact OG-N 3.09Å; E437-L439 VanDerWaalsContact C-N 3.26Å; E437-L439 PolarHBondContact O-N 3.34Å; E437-A440 WeakPolarHBondContact O-CB 3.27Å; E437-A440 PolarHBondContact O-N 3.39Å; E437-A440 VanDerWaalsContact O-N 3.12Å; E437-I441 WeakPolarHBondContact O-CG1 3.4Å; E437-I441 PolarHBondContact O-N 3.03Å
438	Q	91.4	Very high	89.9	Confident	68 Å²	68	52.6 Å²	52.6	32%	0.318	29%	0.287	S	S	.	.	H	α-helix	trans	-51.7	-45.9	172.5	173.8	176.6	24.8	0	0	111.7	A430 M433 S435 R436 A440 I441 A442	A430-Q438 HydrophobicContact CB-CG 4.15Å; A430-Q438 VanDerWaalsContact O-CG 3.25Å; A430-Q438 WeakPolarHBondContact O-CG 3.23Å; A430-Q438 PolarHBondContact O-NE2 2.87Å; M433-Q438 PolarHBondContact O-OE1 2.69Å; S435-Q438 WeakPolarHBondContact O-CB 3.5Å; S435-Q438 PolarHBondContact O-N 3.39Å; R436-Q438 PolarHBondContact O-N 3.1Å; Q438-A440 VanDerWaalsContact C-N 3.32Å; Q438-A440 PolarHBondContact O-N 3.19Å; Q438-I441 PolarHBondContact O-N 3.33Å; Q438-A442 WeakPolarHBondContact O-CB 3.23Å; Q438-A442 PolarHBondContact O-N 2.77Å
439	L	91	Very high	90.1	Very high	82 Å²	82	48.9 Å²	48.9	43%	0.429	27%	0.267	S	S	.	.	H	α-helix	trans	-64.1	-39.9	-179.1	-63.6	176.2	0	0	0	111.3	L110 I115 R436 E437 A442 E443	L110-L439 HydrophobicContact CD2-CB 4.18Å; I115-L439 HydrophobicContact CD1-CB 4.25Å; I115-L439 HydrophobicContact CD1-CD1 3.66Å; R436-L439 PolarHBondContact O-N 3.23Å; E437-L439 VanDerWaalsContact C-N 3.26Å; E437-L439 PolarHBondContact O-N 3.34Å; L439-A442 PolarHBondContact O-N 3.29Å; L439-E443 WeakPolarHBondContact O-CG 3.46Å; L439-E443 PolarHBondContact O-N 2.92Å
440	A	93.2	Very high	90.4	Very high	2 Å²	2	47 Å²	47	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-65.6	-41.6	176.4	0	0	0	0	0	111.9	L110 V120 Y124 E437 Q438 E443 F444	L110-A440 HydrophobicContact CD1-CB 4.27Å; V120-A440 HydrophobicContact CB-CB 4.5Å; V120-A440 HydrophobicContact CG1-CB 4.27Å; Y124-A440 HydrophobicContact CD1-CB 4.19Å; Y124-A440 HydrophobicContact CE1-CB 4.25Å; Y124-A440 VanDerWaalsContact CE1-O 3.23Å; Y124-A440 WeakPolarHBondContact CE1-O 3.33Å; E437-A440 WeakPolarHBondContact O-CB 3.27Å; E437-A440 PolarHBondContact O-N 3.39Å; E437-A440 VanDerWaalsContact O-N 3.12Å; Q438-A440 VanDerWaalsContact C-N 3.32Å; Q438-A440 PolarHBondContact O-N 3.19Å; A440-E443 PolarHBondContact O-N 2.94Å; A440-F444 WeakPolarHBondContact O-CB 3.11Å; A440-F444 PolarHBondContact O-N 3.44Å
441	I	94.4	Very high	90.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-67.1	-42.1	177.5	-62.4	171.8	0	0	0	110.9	L126 A127 L426 Y429 A430 M433 E437 Q438 E443 F444 A445	L126-I441 HydrophobicContact CD2-CD1 4.11Å; L126-I441 HydrophobicContact CG-CD1 4.49Å; A127-I441 HydrophobicContact CB-CG1 4.22Å; A127-I441 HydrophobicContact CB-CG2 4.2Å; L426-I441 HydrophobicContact CB-CG2 4.32Å; L426-I441 HydrophobicContact CD2-CG2 4.48Å; Y429-I441 HydrophobicContact CD1-CD1 4.29Å; Y429-I441 HydrophobicContact CD1-CG2 4.36Å; Y429-I441 HydrophobicContact CE1-CD1 4.11Å; A430-I441 HydrophobicContact CB-CB 4.02Å; A430-I441 HydrophobicContact CB-CG2 3.83Å; M433-I441 HydrophobicContact CE-CD1 3.62Å; M433-I441 HydrophobicContact CG-CD1 4.42Å; E437-I441 WeakPolarHBondContact O-CG1 3.4Å; E437-I441 PolarHBondContact O-N 3.03Å; Q438-I441 PolarHBondContact O-N 3.33Å; I441-E443 VanDerWaalsContact C-N 3.35Å; I441-E443 PolarHBondContact O-N 3.33Å; I441-F444 WeakPolarHBondContact O-CB 3.48Å; I441-F444 PolarHBondContact O-N 3.42Å; I441-A445 WeakPolarHBondContact O-CB 3.48Å; I441-A445 PolarHBondContact O-N 3.38Å
442	A	93.5	Very high	90.9	Very high	22 Å²	22	42.1 Å²	42.1	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-61	-43.1	177.1	0	0	0	0	0	111.8	A430 Q438 L439 A445 R446	A430-A442 HydrophobicContact CB-CB 4.4Å; Q438-A442 WeakPolarHBondContact O-CB 3.23Å; Q438-A442 PolarHBondContact O-N 2.77Å; L439-A442 PolarHBondContact O-N 3.29Å; A442-A445 WeakPolarHBondContact O-CB 3.23Å; A442-A445 PolarHBondContact O-N 3.21Å; A442-R446 WeakPolarHBondContact O-CG 3.46Å; A442-R446 PolarHBondContact O-N 3.46Å
443	E	94.2	Very high	91.2	Very high	43 Å²	43	42.5 Å²	42.5	20%	0.201	22%	0.22	C	C	.	.	H	α-helix	trans	-71	-34.2	176.1	-72.6	-52.1	141.8	0	0	113.2	L110 L439 A440 I441 A445 R446 S447	L110-E443 HydrophobicContact CD1-CB 4.02Å; L110-E443 HydrophobicContact CD1-CG 4.01Å; L110-E443 HydrophobicContact CD2-CG 3.85Å; L110-E443 HydrophobicContact CG-CG 4.04Å; L439-E443 WeakPolarHBondContact O-CG 3.46Å; L439-E443 PolarHBondContact O-N 2.92Å; A440-E443 PolarHBondContact O-N 2.94Å; I441-E443 VanDerWaalsContact C-N 3.35Å; I441-E443 PolarHBondContact O-N 3.33Å; E443-A445 VanDerWaalsContact C-N 3.31Å; E443-A445 PolarHBondContact O-N 3.31Å; E443-R446 PolarHBondContact O-N 3.48Å; E443-R446 IonicContact OE1-CZ 3.73Å; E443-R446 IonicContact OE1-NH1 2.82Å; E443-R446 PolarHBondContact OE1-NH1 3.09Å; E443-S447 WeakPolarHBondContact O-CB 3.16Å; E443-S447 PolarHBondContact O-N 3.08Å; E443-S447 PolarHBondContact O-OG 3.16Å
444	F	95.4	Very high	91.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.8	-46.3	170.5	-172.4	-78.5	0	0	0	110.5	L103 Y124 A127 C128 L426 A440 I441 R446 S447 L448 T521	L103-F444 HydrophobicContact CD1-CD2 4.42Å; L103-F444 HydrophobicContact CD1-CE2 3.9Å; L103-F444 HydrophobicContact CD2-CB 4.44Å; L103-F444 HydrophobicContact CD2-CD2 3.36Å; L103-F444 HydrophobicContact CD2-CE2 3.66Å; L103-F444 HydrophobicContact CD2-CG 3.95Å; L103-F444 HydrophobicContact CD2-CZ 4.46Å; L103-F444 HydrophobicContact CG-CE2 4.46Å; Y124-F444 HydrophobicContact CD1-CB 3.99Å; Y124-F444 AromaticContact CD1-CD2 3.86Å; Y124-F444 HydrophobicContact CD1-CD2 3.86Å; Y124-F444 HydrophobicContact CD1-CG 4.41Å; Y124-F444 HydrophobicContact CD2-CD2 4.21Å; Y124-F444 HydrophobicContact CE1-CB 3.96Å; Y124-F444 HydrophobicContact CE1-CD2 4.28Å; Y124-F444 AromaticContact CG-CD2 3.82Å; Y124-F444 HydrophobicContact CG-CD2 3.82Å; A127-F444 HydrophobicContact CB-CB 4.06Å; A127-F444 HydrophobicContact CB-CD1 3.73Å; A127-F444 HydrophobicContact CB-CD2 4.17Å; A127-F444 HydrophobicContact CB-CE1 4.19Å; A127-F444 HydrophobicContact CB-CG 3.72Å; C128-F444 HydrophobicContact CB-CZ 4.43Å; L426-F444 HydrophobicContact CD1-CD1 3.7Å; L426-F444 HydrophobicContact CD1-CE1 4Å; A440-F444 WeakPolarHBondContact O-CB 3.11Å; A440-F444 PolarHBondContact O-N 3.44Å; I441-F444 WeakPolarHBondContact O-CB 3.48Å; I441-F444 PolarHBondContact O-N 3.42Å; F444-R446 VanDerWaalsContact C-N 3.34Å; F444-R446 PolarHBondContact O-N 3.04Å; F444-S447 WeakPolarHBondContact O-CB 3.33Å; F444-S447 PolarHBondContact O-N 3.14Å; F444-L448 HydrophobicContact CD1-CD1 4.35Å; F444-L448 HydrophobicContact CD1-CG 4.47Å; F444-L448 HydrophobicContact CE1-CD1 4.21Å; F444-L448 HydrophobicContact CE1-CD2 4.27Å; F444-L448 HydrophobicContact CE1-CG 4.32Å; F444-L448 PolarHBondContact O-N 3.42Å; F444-T521 HydrophobicContact CE2-CG2 4.27Å; F444-T521 WeakPolarHBondContact CE2-OG1 3.46Å
445	A	95.4	Very high	92.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-38.6	178.5	0	0	0	0	0	112.8	S423 L426 E427 I441 A442 E443	S423-A445 VanDerWaalsContact CB-O 3.28Å; S423-A445 WeakPolarHBondContact CB-O 3.35Å; S423-A445 WeakPolarHBondContact O-CB 3.42Å; S423-A445 PolarHBondContact OG-O 2.98Å; L426-A445 HydrophobicContact CB-CB 3.63Å; L426-A445 HydrophobicContact CD1-CB 4.44Å; E427-A445 HydrophobicContact CG-CB 3.89Å; I441-A445 WeakPolarHBondContact O-CB 3.48Å; I441-A445 PolarHBondContact O-N 3.38Å; A442-A445 WeakPolarHBondContact O-CB 3.23Å; A442-A445 PolarHBondContact O-N 3.21Å; E443-A445 VanDerWaalsContact C-N 3.31Å; E443-A445 PolarHBondContact O-N 3.31Å
446	R	94.3	Very high	93.3	Very high	134 Å²	134	35.7 Å²	35.7	51%	0.506	16%	0.16	S	C	.	.	H	α-helix	trans	-68.2	-38.7	174.5	-73.5	172.6	177.6	176.2	-2.6	112.5	A442 E443 F444 L448 L449	A442-R446 WeakPolarHBondContact O-CG 3.46Å; A442-R446 PolarHBondContact O-N 3.46Å; E443-R446 PolarHBondContact O-N 3.48Å; E443-R446 IonicContact OE1-CZ 3.73Å; E443-R446 IonicContact OE1-NH1 2.82Å; E443-R446 PolarHBondContact OE1-NH1 3.09Å; F444-R446 VanDerWaalsContact C-N 3.34Å; F444-R446 PolarHBondContact O-N 3.04Å; R446-L448 PolarHBondContact O-N 3.05Å; R446-L449 WeakPolarHBondContact O-CB 3.38Å; R446-L449 PolarHBondContact O-N 3.27Å; R446-L449 VanDerWaalsContact O-N 3.1Å
447	S	95.9	Very high	94	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.014	15%	0.151	C	C	.	.	H	α-helix	trans	-62.6	-32.1	-179.6	-57.3	0	0	0	0	112.1	S106 E443 F444 L449 V450	S106-S447 WeakPolarHBondContact CB-OG 3.34Å; S106-S447 PolarHBondContact OG-OG 3.42Å; E443-S447 WeakPolarHBondContact O-CB 3.16Å; E443-S447 PolarHBondContact O-N 3.08Å; E443-S447 PolarHBondContact O-OG 3.16Å; F444-S447 WeakPolarHBondContact O-CB 3.33Å; F444-S447 PolarHBondContact O-N 3.14Å; S447-L449 PolarHBondContact O-N 3.38Å; S447-V450 WeakPolarHBondContact O-CB 3.41Å; S447-V450 WeakPolarHBondContact O-CG1 3.25Å; S447-V450 PolarHBondContact O-N 2.92Å; S447-V450 VanDerWaalsContact O-N 3.09Å
448	L	95.7	Very high	94.3	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-29	175.4	-66.5	171.9	0	0	0	113.2	L99 E419 L422 L426 F444 R446 V450 I451 L517	L99-L448 HydrophobicContact CD1-CD2 3.9Å; L99-L448 HydrophobicContact CD2-CD2 4.23Å; E419-L448 HydrophobicContact CB-CB 4.39Å; L422-L448 HydrophobicContact CB-CD1 3.64Å; L426-L448 HydrophobicContact CD1-CD1 3.93Å; F444-L448 HydrophobicContact CD1-CD1 4.35Å; F444-L448 HydrophobicContact CD1-CG 4.47Å; F444-L448 HydrophobicContact CE1-CD1 4.21Å; F444-L448 HydrophobicContact CE1-CD2 4.27Å; F444-L448 HydrophobicContact CE1-CG 4.32Å; F444-L448 PolarHBondContact O-N 3.42Å; R446-L448 PolarHBondContact O-N 3.05Å; L448-V450 PolarHBondContact O-N 3.18Å; L448-V450 VanDerWaalsContact O-N 3.14Å; L448-I451 PolarHBondContact O-N 3.47Å; L448-L517 HydrophobicContact CD2-CD2 3.58Å
449	L	95.9	Very high	94.3	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.031	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-6.6	179.3	-60.4	175.4	0	0	0	113.2	R446 S447 I451 P452 K453 V467 R471	R446-L449 WeakPolarHBondContact O-CB 3.38Å; R446-L449 PolarHBondContact O-N 3.27Å; R446-L449 VanDerWaalsContact O-N 3.1Å; S447-L449 PolarHBondContact O-N 3.38Å; L449-I451 VanDerWaalsContact C-N 3.26Å; L449-I451 PolarHBondContact O-N 2.8Å; L449-P452 HydrophobicContact CD2-CG 4.36Å; L449-P452 WeakPolarHBondContact O-CD 3.31Å; L449-P452 WeakPolarHBondContact O-CG 3.48Å; L449-K453 WeakPolarHBondContact O-CB 2.77Å; L449-K453 WeakPolarHBondContact O-CD 3.16Å; L449-K453 WeakPolarHBondContact O-CG 3.38Å; L449-K453 PolarHBondContact O-N 3.28Å; L449-K453 VanDerWaalsContact O-N 3.1Å; L449-V467 HydrophobicContact CD1-CG1 4.45Å; L449-V467 HydrophobicContact CD2-CG1 4.23Å; L449-R471 HydrophobicContact CD2-CG 4.29Å
450	V	96.1	Very high	94.3	Very high	11 Å²	11	28 Å²	28	7%	0.067	16%	0.156	C	C	.	.	H	α-helix	trans	-59.7	-38.4	175.4	73.3	0	0	0	0	111.8	I98 E102 S447 L448 K453 T454	I98-V450 HydrophobicContact CG2-CG1 3.92Å; I98-V450 HydrophobicContact CG2-CG2 3.87Å; E102-V450 HydrophobicContact CB-CB 4.13Å; E102-V450 HydrophobicContact CB-CG1 3.97Å; E102-V450 HydrophobicContact CB-CG2 4.24Å; E102-V450 HydrophobicContact CG-CB 3.89Å; E102-V450 HydrophobicContact CG-CG1 4.23Å; E102-V450 HydrophobicContact CG-CG2 4.12Å; S447-V450 WeakPolarHBondContact O-CB 3.41Å; S447-V450 WeakPolarHBondContact O-CG1 3.25Å; S447-V450 PolarHBondContact O-N 2.92Å; S447-V450 VanDerWaalsContact O-N 3.09Å; L448-V450 PolarHBondContact O-N 3.18Å; L448-V450 VanDerWaalsContact O-N 3.14Å; V450-K453 PolarHBondContact O-N 3.38Å; V450-T454 WeakPolarHBondContact O-CB 3.36Å; V450-T454 PolarHBondContact O-N 2.99Å; V450-T454 PolarHBondContact O-OG1 3.3Å
451	I	95.6	Very high	94.3	Very high	6 Å²	6	31.5 Å²	31.5	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-58.1	-179	-60.6	-60.2	0	0	0	111.3	L39 I98 E419 L448 L449 K453 T454 L455	L39-I451 HydrophobicContact CD2-CD1 4.15Å; L39-I451 HydrophobicContact CD2-CG2 4.39Å; I98-I451 HydrophobicContact CB-CD1 4.26Å; I98-I451 HydrophobicContact CG2-CD1 4.15Å; E419-I451 HydrophobicContact CG-CB 4.12Å; E419-I451 HydrophobicContact CG-CG1 4.3Å; E419-I451 HydrophobicContact CG-CG2 4.43Å; L448-I451 PolarHBondContact O-N 3.47Å; L449-I451 VanDerWaalsContact C-N 3.26Å; L449-I451 PolarHBondContact O-N 2.8Å; I451-K453 VanDerWaalsContact C-N 3.26Å; I451-K453 PolarHBondContact O-N 3.38Å; I451-T454 PolarHBondContact O-N 3.47Å; I451-L455 HydrophobicContact CG2-CD1 4.16Å; I451-L455 VanDerWaalsContact O-CG 3.31Å; I451-L455 WeakPolarHBondContact O-CG 3.36Å; I451-L455 PolarHBondContact O-N 2.99Å
452	P	95.4	Very high	94.1	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-31.3	177.8	23.5	-33.4	0	0	0	113	L449 A456 V467 L470 L491	L449-P452 HydrophobicContact CD2-CG 4.36Å; L449-P452 WeakPolarHBondContact O-CD 3.31Å; L449-P452 WeakPolarHBondContact O-CG 3.48Å; P452-A456 PolarHBondContact O-N 3.42Å; P452-A456 VanDerWaalsContact O-N 3.12Å; P452-V467 HydrophobicContact CB-CG2 4.23Å; P452-L470 HydrophobicContact CB-CD2 4.07Å; P452-L491 HydrophobicContact CB-CD1 3.71Å; P452-L491 WeakPolarHBondContact O-CD1 3.34Å
453	K	95.1	Very high	94.1	Very high	96 Å²	96	36.3 Å²	36.3	42%	0.417	20%	0.197	S	C	.	.	H	α-helix	trans	-63.1	-50.7	172.6	-74.8	173.1	-176.8	177	0	111.6	L449 V450 I451 L455 A456 V457 V467	L449-K453 WeakPolarHBondContact O-CB 2.77Å; L449-K453 WeakPolarHBondContact O-CD 3.16Å; L449-K453 WeakPolarHBondContact O-CG 3.38Å; L449-K453 PolarHBondContact O-N 3.28Å; L449-K453 VanDerWaalsContact O-N 3.1Å; V450-K453 PolarHBondContact O-N 3.38Å; I451-K453 VanDerWaalsContact C-N 3.26Å; I451-K453 PolarHBondContact O-N 3.38Å; K453-L455 VanDerWaalsContact C-N 3.34Å; K453-L455 PolarHBondContact O-N 2.9Å; K453-A456 PolarHBondContact O-N 3.05Å; K453-V457 WeakPolarHBondContact O-CG2 3.48Å; K453-V457 PolarHBondContact O-N 3.05Å; K453-V467 HydrophobicContact CG-CG2 3.81Å
454	T	94.9	Very high	94	Very high	15 Å²	15	40.5 Å²	40.5	9%	0.092	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-39.9	-179.9	-62	0	0	0	0	111.6	K36 L39 V450 I451 A456 V457 N458	K36-T454 HydrophobicContact CB-CG2 4.18Å; K36-T454 HydrophobicContact CG-CG2 4.15Å; K36-T454 WeakPolarHBondContact O-CG2 3.36Å; L39-T454 HydrophobicContact CB-CG2 4.15Å; L39-T454 HydrophobicContact CD2-CG2 3.8Å; V450-T454 WeakPolarHBondContact O-CB 3.36Å; V450-T454 PolarHBondContact O-N 2.99Å; V450-T454 PolarHBondContact O-OG1 3.3Å; I451-T454 PolarHBondContact O-N 3.47Å; T454-A456 VanDerWaalsContact C-N 3.34Å; T454-A456 PolarHBondContact O-N 3.36Å; T454-V457 PolarHBondContact O-N 3.15Å; T454-N458 VanDerWaalsContact O-CG 3.31Å; T454-N458 PolarHBondContact O-N 3.29Å
455	L	93.8	Very high	93.9	Very high	13 Å²	13	43.8 Å²	43.8	7%	0.068	24%	0.237	C	C	.	.	H	α-helix	trans	-57.1	-45.9	173.6	-72.8	175.6	0	0	0	112.2	L39 I451 K453 A459 L493	L39-L455 HydrophobicContact CD2-CD2 4.25Å; L39-L455 HydrophobicContact CD2-CG 4.28Å; L39-L455 HydrophobicContact CG-CD2 3.99Å; I451-L455 HydrophobicContact CG2-CD1 4.16Å; I451-L455 VanDerWaalsContact O-CG 3.31Å; I451-L455 WeakPolarHBondContact O-CG 3.36Å; I451-L455 PolarHBondContact O-N 2.99Å; K453-L455 VanDerWaalsContact C-N 3.34Å; K453-L455 PolarHBondContact O-N 2.9Å; L455-A459 PolarHBondContact O-N 2.87Å; L455-L493 HydrophobicContact CB-CD1 4Å; L455-L493 HydrophobicContact CB-CD2 4.21Å; L455-L493 HydrophobicContact CD2-CD1 4.2Å
456	A	93.9	Very high	93.8	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.1	-39.5	178.2	0	0	0	0	0	112.9	P452 K453 T454 A459 A460 Q461 L466	P452-A456 PolarHBondContact O-N 3.42Å; P452-A456 VanDerWaalsContact O-N 3.12Å; K453-A456 PolarHBondContact O-N 3.05Å; T454-A456 VanDerWaalsContact C-N 3.34Å; T454-A456 PolarHBondContact O-N 3.36Å; A456-A459 WeakPolarHBondContact O-CB 3.49Å; A456-A459 PolarHBondContact O-N 3.36Å; A456-A460 PolarHBondContact O-N 3.01Å; A456-Q461 PolarHBondContact O-N 3.34Å; A456-L466 HydrophobicContact CB-CD1 3.97Å
457	V	93.5	Very high	93.7	Very high	85 Å²	85	38 Å²	38	52%	0.515	22%	0.216	S	C	.	.	H	α-helix	trans	-63.1	-44.9	176.8	170.7	0	0	0	0	111.2	K453 T454 A459 A460	K453-V457 WeakPolarHBondContact O-CG2 3.48Å; K453-V457 PolarHBondContact O-N 3.05Å; T454-V457 PolarHBondContact O-N 3.15Å; V457-A459 PolarHBondContact O-N 2.63Å; V457-A460 PolarHBondContact O-N 3.31Å
458	N	92.6	Very high	93.6	Very high	42 Å²	42	40.6 Å²	40.6	23%	0.225	24%	0.238	C	C	.	.	H	α-helix	trans	-64.5	-26.8	177.6	-68.2	-9.8	0	0	0	111.8	K36 L39 V42 T454 A460	K36-N458 PolarHBondContact O-ND2 3.48Å; L39-N458 PolarHBondContact O-ND2 3.44Å; V42-N458 HydrophobicContact CG2-CB 3.96Å; T454-N458 VanDerWaalsContact O-CG 3.31Å; T454-N458 PolarHBondContact O-N 3.29Å; N458-A460 PolarHBondContact O-N 2.94Å
459	A	91.1	Very high	93.5	Very high	17 Å²	17	44.9 Å²	44.9	14%	0.14	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	1.3	173.8	0	0	0	0	0	114.1	V42 L455 A456 V457 Q461 L493	V42-A459 HydrophobicContact CG2-CB 3.86Å; L455-A459 PolarHBondContact O-N 2.87Å; A456-A459 WeakPolarHBondContact O-CB 3.49Å; A456-A459 PolarHBondContact O-N 3.36Å; V457-A459 PolarHBondContact O-N 2.63Å; A459-Q461 HydrophobicContact CB-CB 4.4Å; A459-Q461 HydrophobicContact CB-CG 3.82Å; A459-Q461 PolarHBondContact O-N 2.93Å; A459-L493 HydrophobicContact CB-CB 3.86Å; A459-L493 HydrophobicContact CB-CD2 4.05Å; A459-L493 HydrophobicContact CB-CG 4.35Å
460	A	91.1	Very high	93.4	Very high	93 Å²	93	44.6 Å²	44.6	77%	0.769	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	29.6	-170.5	0	0	0	0	0	113.6	A456 V457 N458	A456-A460 PolarHBondContact O-N 3.01Å; V457-A460 PolarHBondContact O-N 3.31Å; N458-A460 PolarHBondContact O-N 2.94Å
461	Q	91.6	Very high	93.2	Very high	76 Å²	76	48 Å²	48	36%	0.355	27%	0.267	S	S	.	.	S	Bend	trans	-97.5	162.2	176.8	-63.3	-65	-21.8	0	0	110.8	A456 A459 S463 L466	A456-Q461 PolarHBondContact O-N 3.34Å; A459-Q461 HydrophobicContact CB-CB 4.4Å; A459-Q461 HydrophobicContact CB-CG 3.82Å; A459-Q461 PolarHBondContact O-N 2.93Å; Q461-S463 PolarHBondContact O-N 3.05Å; Q461-L466 HydrophobicContact CB-CD1 3.62Å; Q461-L466 HydrophobicContact CG-CD1 4.24Å
462	D	92.1	Very high	93.1	Very high	95 Å²	95	50.6 Å²	50.6	51%	0.508	29%	0.289	S	S	.	.			trans	-70.4	99.4	172.4	-172.1	-9.5	0	0	0	110.6	I464 D465 L466	D462-I464 PolarHBondContact O-N 2.84Å; D462-I464 WeakPolarHBondContact OD1-CB 3.31Å; D462-I464 PolarHBondContact OD1-N 3.18Å; D462-D465 HydrophobicContact CB-CB 4.22Å; D462-D465 PolarHBondContact O-N 3.2Å; D462-D465 PolarHBondContact OD1-N 3.39Å; D462-L466 WeakPolarHBondContact O-CB 3.49Å; D462-L466 PolarHBondContact O-N 3.35Å; D462-L466 VanDerWaalsContact O-N 3.09Å
463	S	92.4	Very high	93	Very high	27 Å²	27	54 Å²	54	19%	0.189	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-27.2	178.3	68.1	0	0	0	0	113.6	Q461 V467	Q461-S463 PolarHBondContact O-N 3.05Å; S463-V467 VanDerWaalsContact O-CB 3.23Å; S463-V467 WeakPolarHBondContact O-CB 3.32Å; S463-V467 WeakPolarHBondContact O-CG2 3.49Å; S463-V467 PolarHBondContact O-N 3.12Å; S463-V467 VanDerWaalsContact O-N 3.16Å
464	I	92.4	Very high	92.8	Very high	132 Å²	132	49.4 Å²	49.4	68%	0.677	28%	0.284	S	S	*	.	H	α-helix	trans	-73.1	-50.9	-178.3	-61.2	173.9	0	0	0	109	D462 A468	D462-I464 PolarHBondContact O-N 2.84Å; D462-I464 WeakPolarHBondContact OD1-CB 3.31Å; D462-I464 PolarHBondContact OD1-N 3.18Å; I464-A468 VanDerWaalsContact O-CB 3.23Å; I464-A468 WeakPolarHBondContact O-CB 3.35Å; I464-A468 PolarHBondContact O-N 3.38Å
465	D	93	Very high	92.7	Very high	68 Å²	68	52.2 Å²	52.2	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-63.4	-46.7	179.3	179.8	50.6	0	0	0	111.9	D462 V467 A468 K469	D462-D465 HydrophobicContact CB-CB 4.22Å; D462-D465 PolarHBondContact O-N 3.2Å; D462-D465 PolarHBondContact OD1-N 3.39Å; D465-V467 PolarHBondContact O-N 3.3Å; D465-A468 PolarHBondContact O-N 2.84Å; D465-K469 WeakPolarHBondContact O-CG 3.48Å; D465-K469 PolarHBondContact O-N 3.5Å; D465-K469 WeakPolarHBondContact OD1-CE 3.39Å; D465-K469 IonicContact OD1-NZ 3.58Å; D465-K469 PolarHBondContact OD1-NZ 3.49Å; D465-K469 WeakPolarHBondContact OD2-CE 3.45Å; D465-K469 IonicContact OD2-NZ 3.87Å; D465-K469 PolarHBondContact OD2-NZ 3.1Å
466	L	92.8	Very high	92.5	Very high	4 Å²	4	54.1 Å²	54.1	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-44.7	-179.3	-76.7	179.5	0	0	0	113	A456 Q461 D462 K469 L470 L491 G496	A456-L466 HydrophobicContact CB-CD1 3.97Å; Q461-L466 HydrophobicContact CB-CD1 3.62Å; Q461-L466 HydrophobicContact CG-CD1 4.24Å; D462-L466 WeakPolarHBondContact O-CB 3.49Å; D462-L466 PolarHBondContact O-N 3.35Å; D462-L466 VanDerWaalsContact O-N 3.09Å; L466-K469 PolarHBondContact O-N 2.99Å; L466-L470 VanDerWaalsContact O-CB 3.29Å; L466-L470 WeakPolarHBondContact O-CB 3.38Å; L466-L470 PolarHBondContact O-N 2.72Å; L466-L491 HydrophobicContact CB-CD2 4.1Å; L466-G496 WeakPolarHBondContact CD2-O 3.4Å
467	V	93.6	Very high	92.3	Very high	8 Å²	8	54.6 Å²	54.6	5%	0.048	31%	0.311	C	S	.	.	H	α-helix	trans	-69.8	-35.9	179.3	174.8	0	0	0	0	110.8	L449 P452 K453 S463 D465 L470 R471	L449-V467 HydrophobicContact CD1-CG1 4.45Å; L449-V467 HydrophobicContact CD2-CG1 4.23Å; P452-V467 HydrophobicContact CB-CG2 4.23Å; K453-V467 HydrophobicContact CG-CG2 3.81Å; S463-V467 VanDerWaalsContact O-CB 3.23Å; S463-V467 WeakPolarHBondContact O-CB 3.32Å; S463-V467 WeakPolarHBondContact O-CG2 3.49Å; S463-V467 PolarHBondContact O-N 3.12Å; S463-V467 VanDerWaalsContact O-N 3.16Å; D465-V467 PolarHBondContact O-N 3.3Å; V467-L470 PolarHBondContact O-N 3.34Å; V467-R471 HydrophobicContact CG1-CG 4.47Å; V467-R471 WeakPolarHBondContact O-CB 3.31Å; V467-R471 WeakPolarHBondContact O-CG 3.42Å; V467-R471 PolarHBondContact O-N 2.79Å
468	A	93.4	Very high	92	Very high	57 Å²	57	53.1 Å²	53.1	47%	0.471	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-47.6	174.2	0	0	0	0	0	111.7	I464 D465 R471 A472	I464-A468 VanDerWaalsContact O-CB 3.23Å; I464-A468 WeakPolarHBondContact O-CB 3.35Å; I464-A468 PolarHBondContact O-N 3.38Å; D465-A468 PolarHBondContact O-N 2.84Å; A468-R471 PolarHBondContact O-N 3.47Å; A468-A472 PolarHBondContact O-N 2.93Å
469	K	93.3	Very high	91.7	Very high	92 Å²	92	55.5 Å²	55.5	40%	0.4	31%	0.314	S	S	.	.	H	α-helix	trans	-61.5	-46.1	175.6	-73.1	170.7	176	162.1	0	111.9	D465 L466 R471 A472 F473 P498	D465-K469 WeakPolarHBondContact O-CG 3.48Å; D465-K469 PolarHBondContact O-N 3.5Å; D465-K469 WeakPolarHBondContact OD1-CE 3.39Å; D465-K469 IonicContact OD1-NZ 3.58Å; D465-K469 PolarHBondContact OD1-NZ 3.49Å; D465-K469 WeakPolarHBondContact OD2-CE 3.45Å; D465-K469 IonicContact OD2-NZ 3.87Å; D465-K469 PolarHBondContact OD2-NZ 3.1Å; L466-K469 PolarHBondContact O-N 2.99Å; K469-R471 VanDerWaalsContact C-N 3.31Å; K469-R471 PolarHBondContact O-N 3.38Å; K469-A472 WeakPolarHBondContact O-CB 3.45Å; K469-A472 PolarHBondContact O-N 3.25Å; K469-A472 VanDerWaalsContact O-N 3.17Å; K469-F473 HydrophobicContact CB-CE2 4.48Å; K469-F473 WeakPolarHBondContact O-CD2 3.48Å; K469-F473 PolarHBondContact O-N 3.01Å; K469-F473 VanDerWaalsContact O-N 3.09Å; K469-P498 HydrophobicContact CB-CG 3.87Å
470	L	93.1	Very high	91.5	Very high	0 Å²	0	58 Å²	58	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.2	-46.8	177.2	-175.4	64.7	0	0	0	110.7	A420 P452 L466 V467 A472 F473 H474 I489 L491	A420-L470 HydrophobicContact CB-CD1 4.46Å; A420-L470 HydrophobicContact CB-CD2 3.54Å; A420-L470 HydrophobicContact CB-CG 3.61Å; P452-L470 HydrophobicContact CB-CD2 4.07Å; L466-L470 VanDerWaalsContact O-CB 3.29Å; L466-L470 WeakPolarHBondContact O-CB 3.38Å; L466-L470 PolarHBondContact O-N 2.72Å; V467-L470 PolarHBondContact O-N 3.34Å; L470-A472 PolarHBondContact O-N 3.21Å; L470-F473 PolarHBondContact O-N 3.36Å; L470-H474 PolarHBondContact O-CD2 2.71Å; L470-H474 PolarHBondContact O-N 3.06Å; L470-H474 VanDerWaalsContact O-N 3.12Å; L470-I489 HydrophobicContact CD1-CG2 4.06Å; L470-I489 WeakPolarHBondContact CD1-O 3.4Å; L470-L491 HydrophobicContact CB-CD2 4.28Å; L470-L491 HydrophobicContact CD2-CD1 4.45Å; L470-L491 HydrophobicContact CD2-CD2 4.03Å; L470-L491 HydrophobicContact CD2-CG 4.03Å
471	R	93.6	Very high	90.9	Very high	82 Å²	82	59 Å²	59	31%	0.309	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-41	176.5	-74	-179.3	76.1	-171.6	8	112.6	I424 E427 L449 V467 A468 K469 F473 H474 N475	I424-R471 HydrophobicContact CD1-CB 4.24Å; I424-R471 WeakPolarHBondContact CD1-O 3.47Å; E427-R471 IonicContact OE1-CZ 3.35Å; E427-R471 IonicContact OE1-NH2 2.88Å; E427-R471 PolarHBondContact OE1-NH2 3.12Å; E427-R471 IonicContact OE2-CZ 2.79Å; E427-R471 IonicContact OE2-NH2 3.44Å; E427-R471 PolarHBondContact OE2-NH2 3.47Å; L449-R471 HydrophobicContact CD2-CG 4.29Å; V467-R471 HydrophobicContact CG1-CG 4.47Å; V467-R471 WeakPolarHBondContact O-CB 3.31Å; V467-R471 WeakPolarHBondContact O-CG 3.42Å; V467-R471 PolarHBondContact O-N 2.79Å; A468-R471 PolarHBondContact O-N 3.47Å; K469-R471 VanDerWaalsContact C-N 3.31Å; K469-R471 PolarHBondContact O-N 3.38Å; R471-F473 VanDerWaalsContact C-N 3.34Å; R471-F473 PolarHBondContact O-N 3.06Å; R471-H474 PolarHBondContact O-N 3.38Å; R471-N475 WeakPolarHBondContact O-CB 3.25Å; R471-N475 PolarHBondContact O-N 3.46Å
472	A	92.8	Very high	90.3	Very high	60 Å²	60	64.3 Å²	64.3	50%	0.496	35%	0.349	S	S	.	.	H	α-helix	trans	-58.9	-45.5	177.7	0	0	0	0	0	111.9	A468 K469 L470 N475 E476	A468-A472 PolarHBondContact O-N 2.93Å; K469-A472 WeakPolarHBondContact O-CB 3.45Å; K469-A472 PolarHBondContact O-N 3.25Å; K469-A472 VanDerWaalsContact O-N 3.17Å; L470-A472 PolarHBondContact O-N 3.21Å; A472-N475 PolarHBondContact O-N 3.38Å; A472-E476 WeakPolarHBondContact O-CB 3.44Å; A472-E476 PolarHBondContact O-N 2.9Å
473	F	92.6	Very high	90	Very high	71 Å²	71	66.4 Å²	66.4	31%	0.311	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-44.5	177.3	-73.1	-60.5	0	0	0	113.1	K469 L470 R471 E476 A477 L486 I489 P498	K469-F473 HydrophobicContact CB-CE2 4.48Å; K469-F473 WeakPolarHBondContact O-CD2 3.48Å; K469-F473 PolarHBondContact O-N 3.01Å; K469-F473 VanDerWaalsContact O-N 3.09Å; L470-F473 PolarHBondContact O-N 3.36Å; R471-F473 VanDerWaalsContact C-N 3.34Å; R471-F473 PolarHBondContact O-N 3.06Å; F473-E476 PolarHBondContact O-N 3.27Å; F473-A477 WeakPolarHBondContact O-CB 3.34Å; F473-A477 PolarHBondContact O-N 3.3Å; F473-L486 HydrophobicContact CD1-CD1 4.32Å; F473-L486 HydrophobicContact CD1-CD2 4.21Å; F473-I489 HydrophobicContact CB-CB 4.48Å; F473-I489 HydrophobicContact CB-CD1 3.87Å; F473-I489 HydrophobicContact CB-CG2 4.41Å; F473-I489 HydrophobicContact CD1-CD1 3.67Å; F473-I489 HydrophobicContact CD2-CD1 4.17Å; F473-I489 HydrophobicContact CD2-CG2 4.08Å; F473-I489 HydrophobicContact CE1-CD1 4.24Å; F473-I489 HydrophobicContact CG-CD1 3.64Å; F473-I489 HydrophobicContact CG-CG2 4.38Å; F473-P498 HydrophobicContact CD2-CB 4.06Å; F473-P498 HydrophobicContact CD2-CG 4.35Å; F473-P498 HydrophobicContact CE2-CB 3.9Å; F473-P498 HydrophobicContact CE2-CG 4.01Å
474	H	91.9	Very high	89.5	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-70.6	-31.5	179.3	-78.8	-76.7	0	0	0	112.7	A417 I424 L470 R471 A477 Q478 K487 I489	A417-H474 PolarHBondContact O-CE1 3.01Å; A417-H474 VanDerWaalsContact O-CE1 3.29Å; A417-H474 PolarHBondContact O-NE2 3.46Å; I424-H474 HydrophobicContact CD1-CB 3.48Å; I424-H474 VanDerWaalsContact CD1-CB 3.48Å; L470-H474 PolarHBondContact O-CD2 2.71Å; L470-H474 PolarHBondContact O-N 3.06Å; L470-H474 VanDerWaalsContact O-N 3.12Å; R471-H474 PolarHBondContact O-N 3.38Å; H474-A477 PolarHBondContact O-N 3.17Å; H474-Q478 WeakPolarHBondContact O-CG 3.41Å; H474-Q478 PolarHBondContact O-N 3.38Å; H474-K487 PolarHBondContact CE1-O 3.46Å; H474-K487 VanDerWaalsContact CE1-O 3.25Å; H474-I489 PolarHBondContact CE1-O 2.88Å; H474-I489 PolarHBondContact NE2-O 3.21Å
475	N	92.3	Very high	89.1	Confident	74 Å²	74	69.3 Å²	69.3	40%	0.396	36%	0.359	S	S	.	.	H	α-helix	trans	-65.3	-48.4	173.2	-169.9	17.5	0	0	0	110.2	I424 R471 A472 A477 Q478 V479	I424-N475 HydrophobicContact CD1-CB 3.99Å; I424-N475 VanDerWaalsContact CD1-N 3.28Å; I424-N475 HydrophobicContact CG2-CB 4.32Å; R471-N475 WeakPolarHBondContact O-CB 3.25Å; R471-N475 PolarHBondContact O-N 3.46Å; A472-N475 PolarHBondContact O-N 3.38Å; N475-A477 VanDerWaalsContact C-N 3.27Å; N475-A477 PolarHBondContact O-N 2.95Å; N475-Q478 PolarHBondContact O-N 3.29Å; N475-Q478 VanDerWaalsContact O-N 3.09Å; N475-V479 WeakPolarHBondContact O-CG2 3.4Å; N475-V479 PolarHBondContact O-N 3.01Å
476	E	90.6	Very high	88.8	Confident	53 Å²	53	68 Å²	68	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-38.9	176.6	-174	166.8	-153	0	0	112	A472 F473 Q478 V479 N480 R483 L486	A472-E476 WeakPolarHBondContact O-CB 3.44Å; A472-E476 PolarHBondContact O-N 2.9Å; F473-E476 PolarHBondContact O-N 3.27Å; E476-Q478 VanDerWaalsContact C-N 3.26Å; E476-Q478 PolarHBondContact O-N 3.45Å; E476-V479 PolarHBondContact O-N 2.92Å; E476-N480 HydrophobicContact CG-CB 4.41Å; E476-N480 WeakPolarHBondContact O-CB 3.39Å; E476-N480 PolarHBondContact O-N 3.36Å; E476-R483 HydrophobicContact CG-CB 4.41Å; E476-R483 WeakPolarHBondContact OE1-CD 3.25Å; E476-R483 IonicContact OE1-CZ 3.7Å; E476-R483 IonicContact OE1-NE 3.04Å; E476-R483 IonicContact OE1-NH1 3.97Å; E476-R483 PolarHBondContact OE1-NH1 3.12Å; E476-R483 IonicContact OE2-NH1 4Å; E476-R483 PolarHBondContact OE2-NH1 3.31Å; E476-L486 HydrophobicContact CB-CD1 4.21Å; E476-L486 HydrophobicContact CG-CD1 4.01Å
477	A	88.8	Confident	88.5	Confident	10 Å²	10	69.2 Å²	69.2	8%	0.083	36%	0.357	C	S	.	.	H	α-helix	trans	-62.6	-30.3	176.4	0	0	0	0	0	113.8	F473 H474 N475 L486 K487	F473-A477 WeakPolarHBondContact O-CB 3.34Å; F473-A477 PolarHBondContact O-N 3.3Å; H474-A477 PolarHBondContact O-N 3.17Å; N475-A477 VanDerWaalsContact C-N 3.27Å; N475-A477 PolarHBondContact O-N 2.95Å; A477-L486 HydrophobicContact CB-CB 3.9Å; A477-K487 HydrophobicContact CB-CB 4.16Å
478	Q	86.9	Confident	88.3	Confident	53 Å²	53	69.5 Å²	69.5	25%	0.248	36%	0.357	C	S	.	.	H	α-helix	trans	-87.5	-34.6	-178.9	-70.7	-178	27.8	0	0	112.5	Y134 A421 H474 N475 E476	Y134-Q478 PolarHBondContact OH-NE2 3.11Å; A421-Q478 PolarHBondContact O-NE2 3.17Å; H474-Q478 WeakPolarHBondContact O-CG 3.41Å; H474-Q478 PolarHBondContact O-N 3.38Å; N475-Q478 PolarHBondContact O-N 3.29Å; N475-Q478 VanDerWaalsContact O-N 3.09Å; E476-Q478 VanDerWaalsContact C-N 3.26Å; E476-Q478 PolarHBondContact O-N 3.45Å
479	V	87.3	Confident	88.3	Confident	93 Å²	93	67.6 Å²	67.6	56%	0.564	34%	0.339	S	S	*	.	H	α-helix	trans	-82.4	-43.1	-179.6	177.5	0	0	0	0	111.6	N475 E476 P481	N475-V479 WeakPolarHBondContact O-CG2 3.4Å; N475-V479 PolarHBondContact O-N 3.01Å; E476-V479 PolarHBondContact O-N 2.92Å; V479-P481 WeakPolarHBondContact O-CD 3.45Å
480	N	86.1	Confident	88.2	Confident	68 Å²	68	63.2 Å²	63.2	36%	0.364	32%	0.32	S	S	.	.			trans	-101.5	109.7	-173.5	-68.8	-25.4	0	0	0	111.4	E476 E482 R483	E476-N480 HydrophobicContact CG-CB 4.41Å; E476-N480 WeakPolarHBondContact O-CB 3.39Å; E476-N480 PolarHBondContact O-N 3.36Å; N480-E482 VanDerWaalsContact C-N 3.25Å; N480-E482 PolarHBondContact O-N 2.96Å; N480-R483 HydrophobicContact CB-CB 4.38Å; N480-R483 PolarHBondContact O-N 3.37Å; N480-R483 VanDerWaalsContact O-N 3.11Å
481	P	78.6	Confident	88.2	Confident	115 Å²	115	63.6 Å²	63.6	75%	0.747	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-64.5	-27.5	-178.5	23.3	-31.7	0	0	0	113.5	V479 R483	V479-P481 WeakPolarHBondContact O-CD 3.45Å; P481-R483 VanDerWaalsContact C-N 3.29Å; P481-R483 PolarHBondContact O-N 2.97Å
482	E	79.3	Confident	88.1	Confident	188 Å²	188	60.1 Å²	60.1	88%	0.879	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-69.4	-25	176.8	-63.2	-174.1	169.6	0	0	113.2	N480	N480-E482 VanDerWaalsContact C-N 3.25Å; N480-E482 PolarHBondContact O-N 2.96Å
483	R	84.6	Confident	87.9	Confident	138 Å²	138	58 Å²	58	52%	0.521	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-107.7	25.8	-178	-65.8	-176.1	178.3	-166.4	-0.2	112.8	E476 N480 P481 N485 L486	E476-R483 HydrophobicContact CG-CB 4.41Å; E476-R483 WeakPolarHBondContact OE1-CD 3.25Å; E476-R483 IonicContact OE1-CZ 3.7Å; E476-R483 IonicContact OE1-NE 3.04Å; E476-R483 IonicContact OE1-NH1 3.97Å; E476-R483 PolarHBondContact OE1-NH1 3.12Å; E476-R483 IonicContact OE2-NH1 4Å; E476-R483 PolarHBondContact OE2-NH1 3.31Å; N480-R483 HydrophobicContact CB-CB 4.38Å; N480-R483 PolarHBondContact O-N 3.37Å; N480-R483 VanDerWaalsContact O-N 3.11Å; P481-R483 VanDerWaalsContact C-N 3.29Å; P481-R483 PolarHBondContact O-N 2.97Å; R483-N485 PolarHBondContact O-N 3.4Å; R483-L486 HydrophobicContact CB-CD1 3.78Å; R483-L486 HydrophobicContact CB-CG 4.22Å; R483-L486 HydrophobicContact CG-CD1 4.47Å; R483-L486 WeakPolarHBondContact O-CB 3.47Å; R483-L486 WeakPolarHBondContact O-CG 3.2Å; R483-L486 PolarHBondContact O-N 3.39Å
484	K	82.3	Confident	87.5	Confident	107 Å²	107	60.4 Å²	60.4	47%	0.465	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-57.2	-23.6	-179.9	-164.8	172.4	-173.1	177.3	0	113.8	L486 K487	K484-L486 PolarHBondContact O-N 3.37Å; K484-K487 HydrophobicContact CG-CD 4.3Å; K484-K487 WeakPolarHBondContact O-CD 3.5Å; K484-K487 WeakPolarHBondContact O-CG 3.42Å; K484-K487 PolarHBondContact O-N 3.47Å
485	N	83.9	Confident	87.3	Confident	114 Å²	114	65.5 Å²	65.5	61%	0.61	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-65.6	-20.6	177.1	-67.3	-25.7	0	0	0	113.5	R483 K487 W488	R483-N485 PolarHBondContact O-N 3.4Å; N485-K487 PolarHBondContact O-N 2.88Å; N485-K487 VanDerWaalsContact O-N 3.15Å; N485-W488 PolarHBondContact O-N 3.49Å
486	L	87.1	Confident	87	Confident	39 Å²	39	62.7 Å²	62.7	20%	0.204	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-65.9	-14.7	177.6	-61.9	176.7	0	0	0	113	F473 E476 A477 R483 K484 W488 I489	F473-L486 HydrophobicContact CD1-CD1 4.32Å; F473-L486 HydrophobicContact CD1-CD2 4.21Å; E476-L486 HydrophobicContact CB-CD1 4.21Å; E476-L486 HydrophobicContact CG-CD1 4.01Å; A477-L486 HydrophobicContact CB-CB 3.9Å; R483-L486 HydrophobicContact CB-CD1 3.78Å; R483-L486 HydrophobicContact CB-CG 4.22Å; R483-L486 HydrophobicContact CG-CD1 4.47Å; R483-L486 WeakPolarHBondContact O-CB 3.47Å; R483-L486 WeakPolarHBondContact O-CG 3.2Å; R483-L486 PolarHBondContact O-N 3.39Å; K484-L486 PolarHBondContact O-N 3.37Å; L486-W488 PolarHBondContact O-N 2.91Å; L486-W488 VanDerWaalsContact O-N 3.11Å; L486-I489 HydrophobicContact CB-CD1 4.02Å; L486-I489 HydrophobicContact CD2-CD1 3.43Å; L486-I489 VanDerWaalsContact CD2-CD1 3.43Å; L486-I489 HydrophobicContact CG-CD1 4.3Å; L486-I489 VanDerWaalsContact O-CB 3.3Å; L486-I489 WeakPolarHBondContact O-CB 3.43Å; L486-I489 WeakPolarHBondContact O-CG1 3.43Å; L486-I489 PolarHBondContact O-N 3.27Å
487	K	85.8	Confident	87	Confident	31 Å²	31	67 Å²	67	14%	0.135	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-62.7	-15.3	175	77.5	-173.2	-179.2	163	0	114	N138 L139 H474 A477 K484 N485 I489	N138-K487 WeakPolarHBondContact O-CE 3.34Å; N138-K487 PolarHBondContact O-NZ 3.27Å; L139-K487 HydrophobicContact CD2-CB 4.43Å; H474-K487 PolarHBondContact CE1-O 3.46Å; H474-K487 VanDerWaalsContact CE1-O 3.25Å; A477-K487 HydrophobicContact CB-CB 4.16Å; K484-K487 HydrophobicContact CG-CD 4.3Å; K484-K487 WeakPolarHBondContact O-CD 3.5Å; K484-K487 WeakPolarHBondContact O-CG 3.42Å; K484-K487 PolarHBondContact O-N 3.47Å; N485-K487 PolarHBondContact O-N 2.88Å; N485-K487 VanDerWaalsContact O-N 3.15Å; K487-I489 VanDerWaalsContact C-N 3.32Å
488	W	90.5	Very high	87.2	Confident	14 Å²	14	68 Å²	68	5%	0.053	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-87.6	-3.1	177.2	-50.4	124.6	0	0	0	113.1	L139 I141 P413 N485 L486 G490 D500 N501 R502	L139-W488 WeakPolarHBondContact O-CZ3 3.46Å; I141-W488 HydrophobicContact CD1-CE3 3.95Å; I141-W488 HydrophobicContact CD1-CH2 3.86Å; I141-W488 HydrophobicContact CD1-CZ2 4.44Å; I141-W488 HydrophobicContact CD1-CZ3 3.6Å; I141-W488 HydrophobicContact CG1-CE3 4.33Å; I141-W488 HydrophobicContact CG1-CH2 3.33Å; I141-W488 HydrophobicContact CG1-CZ2 4.06Å; I141-W488 HydrophobicContact CG1-CZ3 3.51Å; P413-W488 HydrophobicContact CB-CE3 4.39Å; P413-W488 HydrophobicContact CG-CE3 3.84Å; P413-W488 HydrophobicContact CG-CZ3 4.27Å; N485-W488 PolarHBondContact O-N 3.49Å; L486-W488 PolarHBondContact O-N 2.91Å; L486-W488 VanDerWaalsContact O-N 3.11Å; W488-G490 PolarHBondContact O-N 3.41Å; W488-D500 VanDerWaalsContact CB-OD1 3.28Å; W488-D500 WeakPolarHBondContact CB-OD1 3.46Å; W488-N501 PolarHBondContact O-N 2.94Å; W488-R502 HydrophobicContact CB-CB 4.05Å; W488-R502 HydrophobicContact CG-CB 4.16Å
489	I	92.5	Very high	87.4	Confident	16 Å²	16	69.7 Å²	69.7	8%	0.082	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	126.4	-177.8	-67	176.2	0	0	0	110.1	A417 L470 F473 H474 L486 K487 P498 R499	A417-I489 WeakPolarHBondContact CB-O 3.41Å; L470-I489 HydrophobicContact CD1-CG2 4.06Å; L470-I489 WeakPolarHBondContact CD1-O 3.4Å; F473-I489 HydrophobicContact CB-CB 4.48Å; F473-I489 HydrophobicContact CB-CD1 3.87Å; F473-I489 HydrophobicContact CB-CG2 4.41Å; F473-I489 HydrophobicContact CD1-CD1 3.67Å; F473-I489 HydrophobicContact CD2-CD1 4.17Å; F473-I489 HydrophobicContact CD2-CG2 4.08Å; F473-I489 HydrophobicContact CE1-CD1 4.24Å; F473-I489 HydrophobicContact CG-CD1 3.64Å; F473-I489 HydrophobicContact CG-CG2 4.38Å; H474-I489 PolarHBondContact CE1-O 2.88Å; H474-I489 PolarHBondContact NE2-O 3.21Å; L486-I489 HydrophobicContact CB-CD1 4.02Å; L486-I489 HydrophobicContact CD2-CD1 3.43Å; L486-I489 VanDerWaalsContact CD2-CD1 3.43Å; L486-I489 HydrophobicContact CG-CD1 4.3Å; L486-I489 VanDerWaalsContact O-CB 3.3Å; L486-I489 WeakPolarHBondContact O-CB 3.43Å; L486-I489 WeakPolarHBondContact O-CG1 3.43Å; L486-I489 PolarHBondContact O-N 3.27Å; K487-I489 VanDerWaalsContact C-N 3.32Å; I489-P498 HydrophobicContact CG2-CB 3.55Å; I489-R499 CarbonylContact C-O 3.24Å; I489-R499 VanDerWaalsContact CA-O 3.28Å; I489-R499 WeakPolarHBondContact CA-O 3.49Å
490	G	92.6	Very high	87.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	-172.1	169.5	0	0	0	0	0	111.3	W488 P498 R499 N501	W488-G490 PolarHBondContact O-N 3.41Å; G490-P498 CarbonylContact O-C 3.59Å; G490-P498 VanDerWaalsContact O-CA 3.28Å; G490-P498 WeakPolarHBondContact O-CA 3.4Å; G490-R499 PolarHBondContact N-O 3.47Å; G490-R499 PolarHBondContact O-N 3.22Å; G490-N501 WeakPolarHBondContact CA-ND2 3.48Å
491	L	92.1	Very high	87.9	Confident	9 Å²	9	63.9 Å²	63.9	5%	0.047	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.5	-177.5	-61.4	177.7	0	0	0	111.7	G415 P452 L466 L470 L493	G415-L491 PolarHBondContact O-N 3.47Å; P452-L491 HydrophobicContact CB-CD1 3.71Å; P452-L491 WeakPolarHBondContact O-CD1 3.34Å; L466-L491 HydrophobicContact CB-CD2 4.1Å; L470-L491 HydrophobicContact CB-CD2 4.28Å; L470-L491 HydrophobicContact CD2-CD1 4.45Å; L470-L491 HydrophobicContact CD2-CD2 4.03Å; L470-L491 HydrophobicContact CD2-CG 4.03Å; L491-L493 HydrophobicContact CB-CD2 4.04Å; L491-L493 HydrophobicContact CD1-CD2 4.5Å
492	D	91.4	Very high	88.4	Confident	9 Å²	9	63 Å²	63	5%	0.048	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	105.8	160.3	-167.1	-15.2	0	0	0	109.3	V494 N495 G496 K497 R499	D492-V494 VanDerWaalsContact C-N 3.34Å; D492-V494 PolarHBondContact OD1-N 3.41Å; D492-N495 PolarHBondContact OD1-N 2.92Å; D492-N495 PolarHBondContact OD2-ND2 3.45Å; D492-G496 WeakPolarHBondContact O-CA 3.42Å; D492-G496 PolarHBondContact O-N 3.09Å; D492-K497 WeakPolarHBondContact CA-O 3.5Å; D492-K497 WeakPolarHBondContact CB-O 3.33Å; D492-K497 PolarHBondContact N-O 3.03Å; D492-K497 PolarHBondContact O-N 2.71Å; D492-R499 HydrophobicContact CB-CB 4.34Å; D492-R499 HydrophobicContact CB-CG 3.86Å; D492-R499 IonicContact OD1-CZ 3.63Å; D492-R499 IonicContact OD1-NH1 3.68Å; D492-R499 PolarHBondContact OD1-NH1 3.25Å; D492-R499 WeakPolarHBondContact OD2-CD 3.26Å; D492-R499 IonicContact OD2-CZ 2.77Å; D492-R499 IonicContact OD2-NE 3.86Å; D492-R499 IonicContact OD2-NH1 2.79Å; D492-R499 PolarHBondContact OD2-NH1 2.83Å
493	L	87.9	Confident	88.8	Confident	15 Å²	15	61.8 Å²	61.8	8%	0.079	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-21.8	-178.3	-58.6	-178.8	0	0	0	112.7	P41 V42 L455 A459 L491	P41-L493 HydrophobicContact CG-CD1 3.81Å; V42-L493 HydrophobicContact CG2-CD1 3.9Å; L455-L493 HydrophobicContact CB-CD1 4Å; L455-L493 HydrophobicContact CB-CD2 4.21Å; L455-L493 HydrophobicContact CD2-CD1 4.2Å; A459-L493 HydrophobicContact CB-CB 3.86Å; A459-L493 HydrophobicContact CB-CD2 4.05Å; A459-L493 HydrophobicContact CB-CG 4.35Å; L491-L493 HydrophobicContact CB-CD2 4.04Å; L491-L493 HydrophobicContact CD1-CD2 4.5Å
494	V	86	Confident	88.9	Confident	122 Å²	122	57.5 Å²	57.5	74%	0.739	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-46.1	179.8	-179	0	0	0	0	110.2	D492	D492-V494 VanDerWaalsContact C-N 3.34Å; D492-V494 PolarHBondContact OD1-N 3.41Å
495	N	86.3	Confident	89.2	Confident	108 Å²	108	52.7 Å²	52.7	58%	0.578	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-8.1	-178.8	-66.5	-52.8	0	0	0	113.7	D492 K497	D492-N495 PolarHBondContact OD1-N 2.92Å; D492-N495 PolarHBondContact OD2-ND2 3.45Å; N495-K497 PolarHBondContact O-N 3.35Å
496	G	87.1	Confident	89.5	Confident	15 Å²	15	48.5 Å²	48.5	16%	0.155	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	39.3	-177.4	0	0	0	0	0	113	L466 D492	L466-G496 WeakPolarHBondContact CD2-O 3.4Å; D492-G496 WeakPolarHBondContact O-CA 3.42Å; D492-G496 PolarHBondContact O-N 3.09Å
497	K	90.9	Very high	89.8	Confident	142 Å²	142	47 Å²	47	62%	0.617	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	148.6	-178.4	-66.2	-179.9	-173.9	175	0	111.6	D492 N495	D492-K497 WeakPolarHBondContact CA-O 3.5Å; D492-K497 WeakPolarHBondContact CB-O 3.33Å; D492-K497 PolarHBondContact N-O 3.03Å; D492-K497 PolarHBondContact O-N 2.71Å; N495-K497 PolarHBondContact O-N 3.35Å
498	P	91.3	Very high	90.1	Very high	31 Å²	31	47 Å²	47	20%	0.201	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	136.6	167.3	-19.7	33.3	0	0	0	110.7	K469 F473 I489 G490	K469-P498 HydrophobicContact CB-CG 3.87Å; F473-P498 HydrophobicContact CD2-CB 4.06Å; F473-P498 HydrophobicContact CD2-CG 4.35Å; F473-P498 HydrophobicContact CE2-CB 3.9Å; F473-P498 HydrophobicContact CE2-CG 4.01Å; I489-P498 HydrophobicContact CG2-CB 3.55Å; G490-P498 CarbonylContact O-C 3.59Å; G490-P498 VanDerWaalsContact O-CA 3.28Å; G490-P498 WeakPolarHBondContact O-CA 3.4Å
499	R	92.6	Very high	90.2	Very high	90 Å²	90	46.4 Å²	46.4	34%	0.34	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	161.4	178	74.6	174.4	176.5	-165	10.8	111.7	I489 G490 D492 N501	I489-R499 CarbonylContact C-O 3.24Å; I489-R499 VanDerWaalsContact CA-O 3.28Å; I489-R499 WeakPolarHBondContact CA-O 3.49Å; G490-R499 PolarHBondContact N-O 3.47Å; G490-R499 PolarHBondContact O-N 3.22Å; D492-R499 HydrophobicContact CB-CB 4.34Å; D492-R499 HydrophobicContact CB-CG 3.86Å; D492-R499 IonicContact OD1-CZ 3.63Å; D492-R499 IonicContact OD1-NH1 3.68Å; D492-R499 PolarHBondContact OD1-NH1 3.25Å; D492-R499 WeakPolarHBondContact OD2-CD 3.26Å; D492-R499 IonicContact OD2-CZ 2.77Å; D492-R499 IonicContact OD2-NE 3.86Å; D492-R499 IonicContact OD2-NH1 2.79Å; D492-R499 PolarHBondContact OD2-NH1 2.83Å; R499-N501 WeakPolarHBondContact CG-OD1 3.23Å; R499-N501 PolarHBondContact NE-OD1 2.97Å; R499-N501 PolarHBondContact O-N 3.44Å
500	D	91.9	Very high	90.2	Very high	38 Å²	38	45.8 Å²	45.8	20%	0.203	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	107.1	171.1	-173.8	-13.6	0	0	0	110.4	W488 R502 Q503 A504	W488-D500 VanDerWaalsContact CB-OD1 3.28Å; W488-D500 WeakPolarHBondContact CB-OD1 3.46Å; D500-R502 VanDerWaalsContact C-N 3.29Å; D500-R502 PolarHBondContact O-N 3.34Å; D500-R502 VanDerWaalsContact OD1-CB 3.23Å; D500-R502 WeakPolarHBondContact OD1-CB 3.14Å; D500-R502 PolarHBondContact OD1-N 3.04Å; D500-Q503 HydrophobicContact CB-CB 4.42Å; D500-Q503 HydrophobicContact CB-CG 4.39Å; D500-Q503 PolarHBondContact O-N 3.38Å; D500-Q503 PolarHBondContact OD1-N 2.95Å; D500-Q503 PolarHBondContact OD2-NE2 2.92Å; D500-A504 PolarHBondContact O-N 3.2Å; D500-A504 VanDerWaalsContact O-N 3.14Å
501	N	90.8	Very high	90.1	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-16.8	-178.4	-85	-3.6	0	0	0	113.1	P413 G414 W488 G490 R499 G505 V506	P413-N501 HydrophobicContact CB-CB 4.33Å; G414-N501 PolarHBondContact O-ND2 3.31Å; W488-N501 PolarHBondContact O-N 2.94Å; G490-N501 WeakPolarHBondContact CA-ND2 3.48Å; R499-N501 WeakPolarHBondContact CG-OD1 3.23Å; R499-N501 PolarHBondContact NE-OD1 2.97Å; R499-N501 PolarHBondContact O-N 3.44Å; N501-G505 PolarHBondContact O-N 3.48Å; N501-V506 HydrophobicContact CB-CB 4.05Å; N501-V506 PolarHBondContact O-N 3.34Å
502	R	88.6	Confident	90.1	Very high	95 Å²	95	48.5 Å²	48.5	36%	0.358	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-45	171.7	-175.6	-177.6	177.6	-176.9	0.6	110.2	I141 W488 D500 G505 Y507	I141-R502 HydrophobicContact CD1-CG 4.13Å; W488-R502 HydrophobicContact CB-CB 4.05Å; W488-R502 HydrophobicContact CG-CB 4.16Å; D500-R502 VanDerWaalsContact C-N 3.29Å; D500-R502 PolarHBondContact O-N 3.34Å; D500-R502 VanDerWaalsContact OD1-CB 3.23Å; D500-R502 WeakPolarHBondContact OD1-CB 3.14Å; D500-R502 PolarHBondContact OD1-N 3.04Å; R502-G505 PolarHBondContact O-N 3.01Å; R502-Y507 WeakPolarHBondContact CA-OH 3.35Å; R502-Y507 HydrophobicContact CB-CE1 4.48Å; R502-Y507 HydrophobicContact CG-CE1 4.23Å; R502-Y507 WeakPolarHBondContact CG-OH 3.4Å; R502-Y507 PolarHBondContact O-OH 3.21Å
503	Q	87.8	Confident	90.2	Very high	164 Å²	164	48.7 Å²	48.7	77%	0.766	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-36.9	178.3	-67	178.2	39.7	0	0	112.1	D500 G505	D500-Q503 HydrophobicContact CB-CB 4.42Å; D500-Q503 HydrophobicContact CB-CG 4.39Å; D500-Q503 PolarHBondContact O-N 3.38Å; D500-Q503 PolarHBondContact OD1-N 2.95Å; D500-Q503 PolarHBondContact OD2-NE2 2.92Å; Q503-G505 PolarHBondContact O-N 3.42Å
504	A	87.3	Confident	90.5	Very high	47 Å²	47	48.8 Å²	48.8	39%	0.388	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-6.6	176.7	0	0	0	0	0	114	D500 V506	D500-A504 PolarHBondContact O-N 3.2Å; D500-A504 VanDerWaalsContact O-N 3.14Å; A504-V506 HydrophobicContact CB-CG2 4.25Å
505	G	87.9	Confident	90.8	Very high	7 Å²	7	44.7 Å²	44.7	7%	0.072	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	26.5	-179.9	0	0	0	0	0	114.2	N153 N501 R502 Q503 Y507	N153-G505 VanDerWaalsContact CB-O 3.31Å; N153-G505 WeakPolarHBondContact CB-O 3.29Å; N501-G505 PolarHBondContact O-N 3.48Å; R502-G505 PolarHBondContact O-N 3.01Å; Q503-G505 PolarHBondContact O-N 3.42Å; G505-Y507 PolarHBondContact O-N 3.25Å
506	V	92.1	Very high	91.2	Very high	26 Å²	26	40 Å²	40	16%	0.158	20%	0.199	C	C	.	.			trans	-92.5	91.2	178.5	-175.8	0	0	0	0	109.1	T157 G414 N501 A504	T157-V506 HydrophobicContact CG2-CG1 3.87Å; G414-V506 PolarHBondContact N-O 3.28Å; N501-V506 HydrophobicContact CB-CB 4.05Å; N501-V506 PolarHBondContact O-N 3.34Å; A504-V506 HydrophobicContact CB-CG2 4.25Å
507	Y	92	Very high	91.6	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.027	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.4	-178.6	-61	-58.6	0	0	0	112.8	I141 L146 N153 T157 V411 R502 G505	I141-Y507 HydrophobicContact CD1-CD1 4.37Å; I141-Y507 HydrophobicContact CD1-CE1 3.74Å; L146-Y507 HydrophobicContact CD1-CE1 4.41Å; L146-Y507 HydrophobicContact CD1-CE2 4.18Å; N153-Y507 HydrophobicContact CB-CD2 3.9Å; N153-Y507 HydrophobicContact CB-CE2 4.33Å; T157-Y507 VanDerWaalsContact CB-O 3.28Å; T157-Y507 WeakPolarHBondContact CB-O 3.2Å; T157-Y507 PolarHBondContact OG1-N 2.97Å; T157-Y507 VanDerWaalsContact OG1-N 3.15Å; T157-Y507 PolarHBondContact OG1-O 3.35Å; V411-Y507 HydrophobicContact CG2-CD1 3.97Å; V411-Y507 HydrophobicContact CG2-CG 4.19Å; R502-Y507 WeakPolarHBondContact CA-OH 3.35Å; R502-Y507 HydrophobicContact CB-CE1 4.48Å; R502-Y507 HydrophobicContact CG-CE1 4.23Å; R502-Y507 WeakPolarHBondContact CG-OH 3.4Å; R502-Y507 PolarHBondContact O-OH 3.21Å; G505-Y507 PolarHBondContact O-N 3.25Å
508	E	91.9	Very high	91.8	Very high	32 Å²	32	37.8 Å²	37.8	15%	0.15	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.6	168.7	-66.8	175.8	-153.4	0	0	109.2	T157 V411 V412 G414 T510 K513	T157-E508 HydrophobicContact CG2-CG 4.12Å; V411-E508 CarbonylContact C-O 3.51Å; V411-E508 WeakPolarHBondContact CA-O 3.3Å; V412-E508 HydrophobicContact CG2-CB 4.3Å; V412-E508 WeakPolarHBondContact CG2-O 3.24Å; V412-E508 PolarHBondContact N-O 3.35Å; V412-E508 PolarHBondContact O-N 3.04Å; G414-E508 WeakPolarHBondContact CA-OE1 3.19Å; E508-T510 PolarHBondContact O-N 3.03Å; E508-K513 IonicContact OE1-NZ 2.69Å; E508-K513 WeakPolarHBondContact OE2-CE 3.33Å; E508-K513 IonicContact OE2-NZ 3.98Å; E508-K513 PolarHBondContact OE2-NZ 3.42Å
509	P	92.4	Very high	92	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	135.5	173.4	-12.8	18.7	0	0	0	111.6	V401 R404 V405 M511 V512	V401-P509 HydrophobicContact CB-CG 4.45Å; V401-P509 HydrophobicContact CG1-CG 3.76Å; R404-P509 HydrophobicContact CB-CB 4.03Å; R404-P509 HydrophobicContact CB-CG 4.14Å; V405-P509 HydrophobicContact CG2-CB 4.12Å; V405-P509 HydrophobicContact CG2-CG 3.75Å; P509-M511 PolarHBondContact O-N 3.14Å; P509-V512 HydrophobicContact CB-CG2 3.91Å; P509-V512 HydrophobicContact CG-CG2 3.69Å; P509-V512 WeakPolarHBondContact O-CB 2.79Å; P509-V512 PolarHBondContact O-N 3.23Å
510	T	92.5	Very high	92.2	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.018	17%	0.171	C	C	.	.	H	α-helix	trans	-54.4	-33.9	176.9	-45.7	0	0	0	0	112.3	I135 T140 S410 V411 V412 E508 V512 K513 T514	I135-T510 HydrophobicContact CG2-CG2 3.64Å; T140-T510 HydrophobicContact CG2-CG2 3.75Å; S410-T510 WeakPolarHBondContact CB-OG1 3.44Å; S410-T510 PolarHBondContact O-N 3.03Å; S410-T510 PolarHBondContact O-OG1 2.92Å; S410-T510 WeakPolarHBondContact OG-CB 3.43Å; S410-T510 PolarHBondContact OG-OG1 3.35Å; V411-T510 PolarHBondContact N-OG1 3.11Å; V412-T510 HydrophobicContact CG1-CG2 4Å; E508-T510 PolarHBondContact O-N 3.03Å; T510-V512 VanDerWaalsContact C-N 3.3Å; T510-V512 PolarHBondContact O-N 3.41Å; T510-K513 PolarHBondContact O-N 2.8Å; T510-T514 WeakPolarHBondContact O-CB 3.46Å; T510-T514 PolarHBondContact O-N 3.08Å; T510-T514 PolarHBondContact O-OG1 2.91Å
511	M	90.9	Very high	92.4	Very high	62 Å²	62	32.9 Å²	32.9	31%	0.305	16%	0.162	S	C	.	.	H	α-helix	trans	-62.9	-35	179.7	-164.6	-174.9	-139.8	0	0	112.4	R404 P509 K515	R404-M511 HydrophobicContact CG-SD 4.47Å; P509-M511 PolarHBondContact O-N 3.14Å; M511-K515 HydrophobicContact CG-CD 4.12Å; M511-K515 HydrophobicContact CG-CG 4.41Å; M511-K515 WeakPolarHBondContact O-CB 3.34Å; M511-K515 PolarHBondContact O-N 3.02Å
512	V	92.6	Very high	92.6	Very high	4 Å²	4	37 Å²	37	2%	0.024	18%	0.181	C	C	.	.	H	α-helix	trans	-59.9	-60.5	177.4	177.9	0	0	0	0	108.7	V89 D91 P509 T510 T514 K515 S516	V89-V512 HydrophobicContact CG1-CB 4.01Å; V89-V512 HydrophobicContact CG1-CG1 4.32Å; V89-V512 HydrophobicContact CG1-CG2 3.35Å; D91-V512 HydrophobicContact CB-CG2 4.49Å; P509-V512 HydrophobicContact CB-CG2 3.91Å; P509-V512 HydrophobicContact CG-CG2 3.69Å; P509-V512 WeakPolarHBondContact O-CB 2.79Å; P509-V512 PolarHBondContact O-N 3.23Å; T510-V512 VanDerWaalsContact C-N 3.3Å; T510-V512 PolarHBondContact O-N 3.41Å; V512-T514 PolarHBondContact O-N 3.46Å; V512-K515 PolarHBondContact O-N 3.3Å; V512-S516 WeakPolarHBondContact O-CB 3.36Å; V512-S516 PolarHBondContact O-N 2.99Å; V512-S516 PolarHBondContact O-OG 2.87Å
513	K	92.8	Very high	92.9	Very high	13 Å²	13	32.9 Å²	32.9	6%	0.057	17%	0.167	C	C	.	.	H	α-helix	trans	-57.8	-45.3	-179.3	-64.9	-56.4	-161	-163.6	0	112.8	I135 V412 V418 E419 E508 T510 K515 S516 L517	I135-K513 HydrophobicContact CD1-CB 4.44Å; V412-K513 HydrophobicContact CG2-CG 3.83Å; V418-K513 HydrophobicContact CG1-CG 4.39Å; E419-K513 WeakPolarHBondContact OE1-CE 3.38Å; E419-K513 IonicContact OE1-NZ 3.12Å; E419-K513 PolarHBondContact OE1-NZ 3.5Å; E419-K513 IonicContact OE2-NZ 3.85Å; E508-K513 IonicContact OE1-NZ 2.69Å; E508-K513 WeakPolarHBondContact OE2-CE 3.33Å; E508-K513 IonicContact OE2-NZ 3.98Å; E508-K513 PolarHBondContact OE2-NZ 3.42Å; T510-K513 PolarHBondContact O-N 2.8Å; K513-K515 PolarHBondContact O-N 3.27Å; K513-S516 PolarHBondContact O-N 3.09Å; K513-L517 WeakPolarHBondContact O-CB 3.34Å; K513-L517 WeakPolarHBondContact O-CG 3.45Å; K513-L517 PolarHBondContact O-N 2.89Å
514	T	93.8	Very high	93.2	Very high	18 Å²	18	25.1 Å²	25.1	11%	0.11	13%	0.131	C	C	.	.	H	α-helix	trans	-63.3	-43	-178	-58.4	0	0	0	0	112	V132 T510 V512 K518	V132-T514 HydrophobicContact CB-CG2 4.46Å; V132-T514 HydrophobicContact CG1-CG2 3.66Å; V132-T514 HydrophobicContact CG2-CG2 3.95Å; T510-T514 WeakPolarHBondContact O-CB 3.46Å; T510-T514 PolarHBondContact O-N 3.08Å; T510-T514 PolarHBondContact O-OG1 2.91Å; V512-T514 PolarHBondContact O-N 3.46Å; T514-K518 WeakPolarHBondContact O-CG 3.5Å; T514-K518 PolarHBondContact O-N 2.74Å
515	K	93.8	Very high	93.5	Very high	35 Å²	35	23 Å²	23	15%	0.152	11%	0.113	C	C	.	.	H	α-helix	trans	-73	-43.3	177.7	-79.8	-175.5	171	-179.8	0	111.6	E88 V89 M511 V512 K513 L517 K518 F519	E88-K515 HydrophobicContact CB-CD 4.45Å; E88-K515 PolarHBondContact O-NZ 3.24Å; E88-K515 IonicContact OE2-NZ 3.15Å; E88-K515 PolarHBondContact OE2-NZ 3.43Å; V89-K515 HydrophobicContact CG2-CB 4.06Å; V89-K515 HydrophobicContact CG2-CD 3.44Å; V89-K515 VanDerWaalsContact CG2-CD 3.44Å; V89-K515 HydrophobicContact CG2-CG 4.36Å; M511-K515 HydrophobicContact CG-CD 4.12Å; M511-K515 HydrophobicContact CG-CG 4.41Å; M511-K515 WeakPolarHBondContact O-CB 3.34Å; M511-K515 PolarHBondContact O-N 3.02Å; V512-K515 PolarHBondContact O-N 3.3Å; K513-K515 PolarHBondContact O-N 3.27Å; K515-L517 VanDerWaalsContact C-N 3.3Å; K515-L517 PolarHBondContact O-N 3.27Å; K515-K518 PolarHBondContact O-N 3.33Å; K515-K518 VanDerWaalsContact O-N 3.13Å; K515-F519 HydrophobicContact CB-CD2 4.22Å; K515-F519 HydrophobicContact CB-CE2 3.96Å; K515-F519 HydrophobicContact CB-CZ 4.4Å; K515-F519 HydrophobicContact CD-CE2 4.27Å; K515-F519 HydrophobicContact CD-CZ 4.3Å; K515-F519 HydrophobicContact CG-CE2 4.41Å; K515-F519 HydrophobicContact CG-CZ 4.42Å; K515-F519 WeakPolarHBondContact O-CB 3.05Å; K515-F519 VanDerWaalsContact O-CG 3.27Å; K515-F519 WeakPolarHBondContact O-CG 3.42Å; K515-F519 PolarHBondContact O-N 2.96Å
516	S	94.4	Very high	93.8	Very high	10 Å²	10	26.1 Å²	26.1	7%	0.07	13%	0.131	C	C	.	.	H	α-helix	trans	-56.1	-43.8	176.9	-60.5	0	0	0	0	111.8	Q85 V512 K513 A520	Q85-S516 PolarHBondContact NE2-OG 3.3Å; Q85-S516 VanDerWaalsContact NE2-OG 3.13Å; V512-S516 WeakPolarHBondContact O-CB 3.36Å; V512-S516 PolarHBondContact O-N 2.99Å; V512-S516 PolarHBondContact O-OG 2.87Å; K513-S516 PolarHBondContact O-N 3.09Å; S516-A520 WeakPolarHBondContact O-CB 3.28Å; S516-A520 PolarHBondContact O-N 3.44Å
517	L	95.1	Very high	93.8	Very high	10 Å²	10	25 Å²	25	5%	0.052	12%	0.124	C	C	.	.	H	α-helix	trans	-62	-46.4	176.1	-76.5	167.3	0	0	0	112.5	L99 A131 I135 L422 L448 K513 K515 T521	L99-L517 HydrophobicContact CD2-CD2 3.81Å; A131-L517 HydrophobicContact CB-CD1 4.47Å; I135-L517 HydrophobicContact CD1-CD1 3.55Å; L422-L517 HydrophobicContact CD1-CD1 3.91Å; L448-L517 HydrophobicContact CD2-CD2 3.58Å; K513-L517 WeakPolarHBondContact O-CB 3.34Å; K513-L517 WeakPolarHBondContact O-CG 3.45Å; K513-L517 PolarHBondContact O-N 2.89Å; K515-L517 VanDerWaalsContact C-N 3.3Å; K515-L517 PolarHBondContact O-N 3.27Å; L517-T521 VanDerWaalsContact O-CB 3.26Å; L517-T521 WeakPolarHBondContact O-CB 3.43Å; L517-T521 PolarHBondContact O-N 3.22Å; L517-T521 PolarHBondContact O-OG1 3.17Å
518	K	95.4	Very high	93.8	Very high	101 Å²	101	25.2 Å²	25.2	44%	0.439	13%	0.126	S	C	.	.	H	α-helix	trans	-63.8	-48.5	179.6	-72.5	176	-178.9	-176.7	0	111.6	V132 T514 K515 T521 E522	V132-K518 HydrophobicContact CG2-CG 4.49Å; T514-K518 WeakPolarHBondContact O-CG 3.5Å; T514-K518 PolarHBondContact O-N 2.74Å; K515-K518 PolarHBondContact O-N 3.33Å; K515-K518 VanDerWaalsContact O-N 3.13Å; K518-T521 PolarHBondContact O-N 2.93Å; K518-E522 WeakPolarHBondContact O-CG 3.35Å; K518-E522 PolarHBondContact O-N 3.33Å
519	F	95.7	Very high	93.7	Very high	54 Å²	54	30.1 Å²	30.1	24%	0.237	14%	0.143	C	C	.	.	H	α-helix	trans	-64.8	-47.4	-178.8	-68.7	-19.1	0	0	0	111.4	L81 Q85 E88 V96 K515 T521 E522 A523	L81-F519 HydrophobicContact CD1-CB 3.61Å; L81-F519 WeakPolarHBondContact CD1-O 3.43Å; Q85-F519 VanDerWaalsContact OE1-CD2 3.23Å; E88-F519 HydrophobicContact CB-CE2 4.25Å; E88-F519 HydrophobicContact CB-CZ 4.42Å; E88-F519 HydrophobicContact CG-CZ 4.3Å; V96-F519 HydrophobicContact CG2-CB 4.07Å; K515-F519 HydrophobicContact CB-CD2 4.22Å; K515-F519 HydrophobicContact CB-CE2 3.96Å; K515-F519 HydrophobicContact CB-CZ 4.4Å; K515-F519 HydrophobicContact CD-CE2 4.27Å; K515-F519 HydrophobicContact CD-CZ 4.3Å; K515-F519 HydrophobicContact CG-CE2 4.41Å; K515-F519 HydrophobicContact CG-CZ 4.42Å; K515-F519 WeakPolarHBondContact O-CB 3.05Å; K515-F519 VanDerWaalsContact O-CG 3.27Å; K515-F519 WeakPolarHBondContact O-CG 3.42Å; K515-F519 PolarHBondContact O-N 2.96Å; F519-T521 VanDerWaalsContact C-N 3.31Å; F519-T521 PolarHBondContact O-N 3.15Å; F519-E522 PolarHBondContact O-N 3.41Å; F519-A523 WeakPolarHBondContact O-CB 3.43Å; F519-A523 PolarHBondContact O-N 2.97Å
520	A	96.1	Very high	93.7	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-41.9	176	0	0	0	0	0	112.2	V96 L99 A100 L103 S516 A524	V96-A520 HydrophobicContact CG2-CB 3.98Å; L99-A520 HydrophobicContact CB-CB 4.17Å; L99-A520 HydrophobicContact CD2-CB 3.94Å; L99-A520 HydrophobicContact CG-CB 3.99Å; A100-A520 HydrophobicContact CB-CB 4.02Å; L103-A520 HydrophobicContact CD1-CB 4.38Å; S516-A520 WeakPolarHBondContact O-CB 3.28Å; S516-A520 PolarHBondContact O-N 3.44Å; A520-A524 WeakPolarHBondContact O-CB 3.37Å; A520-A524 PolarHBondContact O-N 3.41Å
521	T	95.8	Very high	93.5	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-65.3	-46.1	178.7	-56.3	0	0	0	0	111.6	C128 F444 L517 K518 F519 A524 I525	C128-T521 HydrophobicContact CB-CG2 4.03Å; F444-T521 HydrophobicContact CE2-CG2 4.27Å; F444-T521 WeakPolarHBondContact CE2-OG1 3.46Å; L517-T521 VanDerWaalsContact O-CB 3.26Å; L517-T521 WeakPolarHBondContact O-CB 3.43Å; L517-T521 PolarHBondContact O-N 3.22Å; L517-T521 PolarHBondContact O-OG1 3.17Å; K518-T521 PolarHBondContact O-N 2.93Å; F519-T521 VanDerWaalsContact C-N 3.31Å; F519-T521 PolarHBondContact O-N 3.15Å; T521-A524 PolarHBondContact O-N 3.24Å; T521-I525 HydrophobicContact CG2-CD1 3.74Å; T521-I525 HydrophobicContact CG2-CG1 4.43Å; T521-I525 WeakPolarHBondContact O-CB 3.44Å; T521-I525 WeakPolarHBondContact O-CD1 3.5Å; T521-I525 WeakPolarHBondContact O-CG1 3.33Å; T521-I525 PolarHBondContact O-N 3.21Å
522	E	95.1	Very high	93.4	Very high	88 Å²	88	36.5 Å²	36.5	41%	0.411	18%	0.178	S	C	.	.	H	α-helix	trans	-68	-36.6	179	-71.6	-58.4	144.7	0	0	112.4	R125 K518 F519 I525 T526	R125-E522 IonicContact NE-OE1 3.77Å; R125-E522 IonicContact NH2-OE2 2.89Å; K518-E522 WeakPolarHBondContact O-CG 3.35Å; K518-E522 PolarHBondContact O-N 3.33Å; F519-E522 PolarHBondContact O-N 3.41Å; E522-I525 PolarHBondContact O-N 2.97Å; E522-T526 WeakPolarHBondContact O-CB 3.44Å; E522-T526 PolarHBondContact O-N 3.48Å; E522-T526 PolarHBondContact O-OG1 3.43Å
523	A	94.8	Very high	93.2	Very high	8 Å²	8	38.4 Å²	38.4	7%	0.066	19%	0.188	C	C	.	.	H	α-helix	trans	-62.6	-46.2	173.4	0	0	0	0	0	111.5	L81 F519 I525 T526 I527	L81-A523 HydrophobicContact CD1-CB 3.97Å; L81-A523 HydrophobicContact CD2-CB 3.67Å; L81-A523 HydrophobicContact CG-CB 4.35Å; F519-A523 WeakPolarHBondContact O-CB 3.43Å; F519-A523 PolarHBondContact O-N 2.97Å; A523-I525 PolarHBondContact O-N 3.35Å; A523-T526 PolarHBondContact O-N 3.42Å; A523-I527 PolarHBondContact O-N 3.28Å; A523-I527 VanDerWaalsContact O-N 3.09Å
524	A	94.7	Very high	93	Very high	2 Å²	2	41.9 Å²	41.9	2%	0.017	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-43.8	176.8	0	0	0	0	0	111.8	L103 L104 A520 T521 T526 I527 L528	L103-A524 HydrophobicContact CB-CB 3.91Å; L103-A524 HydrophobicContact CD1-CB 4.5Å; L104-A524 HydrophobicContact CD2-CB 4.08Å; L104-A524 WeakPolarHBondContact CD2-O 3.18Å; L104-A524 HydrophobicContact CG-CB 4.02Å; A520-A524 WeakPolarHBondContact O-CB 3.37Å; A520-A524 PolarHBondContact O-N 3.41Å; T521-A524 PolarHBondContact O-N 3.24Å; A524-T526 VanDerWaalsContact C-N 3.34Å; A524-T526 PolarHBondContact O-N 3.37Å; A524-I527 PolarHBondContact O-N 3.39Å; A524-L528 WeakPolarHBondContact O-CB 3.29Å; A524-L528 PolarHBondContact O-N 3.42Å
525	I	93.8	Very high	92.6	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-42.1	176.4	-71	166.8	0	0	0	111.4	I121 R125 T521 E522 A523 L528 R529	I121-I525 HydrophobicContact CB-CG2 4.5Å; I121-I525 HydrophobicContact CD1-CG2 4.29Å; I121-I525 HydrophobicContact CG1-CG1 4.34Å; I121-I525 HydrophobicContact CG1-CG2 4.12Å; I121-I525 HydrophobicContact CG2-CB 4.47Å; I121-I525 HydrophobicContact CG2-CD1 4.16Å; I121-I525 HydrophobicContact CG2-CG1 4.04Å; I121-I525 HydrophobicContact CG2-CG2 3.63Å; R125-I525 HydrophobicContact CG-CD1 3.57Å; T521-I525 HydrophobicContact CG2-CD1 3.74Å; T521-I525 HydrophobicContact CG2-CG1 4.43Å; T521-I525 WeakPolarHBondContact O-CB 3.44Å; T521-I525 WeakPolarHBondContact O-CD1 3.5Å; T521-I525 WeakPolarHBondContact O-CG1 3.33Å; T521-I525 PolarHBondContact O-N 3.21Å; E522-I525 PolarHBondContact O-N 2.97Å; A523-I525 PolarHBondContact O-N 3.35Å; I525-L528 PolarHBondContact O-N 3.06Å; I525-R529 VanDerWaalsContact O-CG 3.29Å; I525-R529 WeakPolarHBondContact O-CG 3.44Å; I525-R529 PolarHBondContact O-N 2.92Å
526	T	93.6	Very high	92.3	Very high	73 Å²	73	51.3 Å²	51.3	45%	0.448	25%	0.25	S	S	.	.	H	α-helix	trans	-61.8	-46.2	-179	-59.5	0	0	0	0	110.7	E522 A523 A524	E522-T526 WeakPolarHBondContact O-CB 3.44Å; E522-T526 PolarHBondContact O-N 3.48Å; E522-T526 PolarHBondContact O-OG1 3.43Å; A523-T526 PolarHBondContact O-N 3.42Å; A524-T526 VanDerWaalsContact C-N 3.34Å; A524-T526 PolarHBondContact O-N 3.37Å
527	I	93.6	Very high	91.8	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.015	27%	0.273	C	S	.	.	H	α-helix	trans	-71.2	-38.3	179.1	-67.1	162.9	0	0	0	111.3	N24 A74 V77 L104 A523 A524 R529 I530	N24-I527 HydrophobicContact CB-CG2 3.77Å; A74-I527 HydrophobicContact CB-CD1 4.25Å; A74-I527 HydrophobicContact CB-CG1 4.32Å; A74-I527 HydrophobicContact CB-CG2 4.17Å; V77-I527 HydrophobicContact CB-CD1 4.21Å; V77-I527 HydrophobicContact CB-CG1 4.48Å; V77-I527 HydrophobicContact CG1-CD1 4.05Å; V77-I527 HydrophobicContact CG1-CG1 4.27Å; L104-I527 HydrophobicContact CD1-CB 4.25Å; L104-I527 HydrophobicContact CD1-CD1 3.73Å; L104-I527 HydrophobicContact CD1-CG2 4.1Å; L104-I527 HydrophobicContact CD2-CB 3.9Å; L104-I527 HydrophobicContact CD2-CG2 3.85Å; A523-I527 PolarHBondContact O-N 3.28Å; A523-I527 VanDerWaalsContact O-N 3.09Å; A524-I527 PolarHBondContact O-N 3.39Å; I527-R529 PolarHBondContact O-N 3.17Å; I527-I530 WeakPolarHBondContact O-CB 2.95Å; I527-I530 WeakPolarHBondContact O-CG1 3.09Å; I527-I530 PolarHBondContact O-N 3.2Å; I527-I530 VanDerWaalsContact O-N 3.08Å
528	L	91.1	Very high	91	Very high	11 Å²	11	62 Å²	62	6%	0.058	31%	0.307	C	S	.	.	H	α-helix	trans	-66.2	-22.1	-179.1	-173.4	64.4	0	0	0	113.6	R21 A107 V111 P117 V120 I121 A524 I525 I530	R21-L528 PolarHBondContact NH1-O 2.75Å; R21-L528 PolarHBondContact NH2-O 2.86Å; A107-L528 HydrophobicContact CB-CD1 4Å; A107-L528 HydrophobicContact CB-CD2 3.88Å; V111-L528 HydrophobicContact CG2-CD1 4.25Å; P117-L528 HydrophobicContact CB-CG 4.33Å; V120-L528 HydrophobicContact CB-CD2 4.17Å; V120-L528 HydrophobicContact CG1-CD2 4Å; I121-L528 HydrophobicContact CG1-CD2 3.89Å; A524-L528 WeakPolarHBondContact O-CB 3.29Å; A524-L528 PolarHBondContact O-N 3.42Å; I525-L528 PolarHBondContact O-N 3.06Å; L528-I530 VanDerWaalsContact C-N 3.27Å
529	R	90.8	Very high	90.1	Very high	136 Å²	136	65.7 Å²	65.7	51%	0.513	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-18	174.9	-74.7	170.9	-177.3	-143.7	-2.7	113.3	I121 I525 I527 D531	I121-R529 HydrophobicContact CD1-CG 3.61Å; I525-R529 VanDerWaalsContact O-CG 3.29Å; I525-R529 WeakPolarHBondContact O-CG 3.44Å; I525-R529 PolarHBondContact O-N 2.92Å; I527-R529 PolarHBondContact O-N 3.17Å; R529-D531 PolarHBondContact O-N 2.93Å
530	I	90.8	Very high	88.8	Confident	59 Å²	59	68.7 Å²	68.7	30%	0.303	35%	0.351	S	S	.	.			trans	-77.6	119.1	-178.4	-53.6	172.8	0	0	0	108.8	V20 I527 L528	V20-I530 HydrophobicContact CG1-CG2 4.05Å; I527-I530 WeakPolarHBondContact O-CB 2.95Å; I527-I530 WeakPolarHBondContact O-CG1 3.09Å; I527-I530 PolarHBondContact O-N 3.2Å; I527-I530 VanDerWaalsContact O-N 3.08Å; L528-I530 VanDerWaalsContact C-N 3.27Å
531	D	88.3	Confident	87	Confident	96 Å²	96	78.2 Å²	78.2	51%	0.513	39%	0.392	S	S	.	.			trans	-118.3	-12.7	175.6	66.6	-29.4	0	0	0	113.5	T16 G17 R529	T16-D531 CarbonylContact C-O 3.59Å; G17-D531 PolarHBondContact N-O 2.84Å; R529-D531 PolarHBondContact O-N 2.93Å
532	D	88.8	Confident	84.9	Confident	44 Å²	44	87.9 Å²	87.9	24%	0.235	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.2	178.9	-157.3	-9.7	0	0	0	110.1	R14 T15 T16	R14-D532 VanDerWaalsContact CG-OD1 3.29Å; R14-D532 WeakPolarHBondContact CG-OD1 3.49Å; R14-D532 IonicContact CZ-OD2 3.16Å; R14-D532 IonicContact NE-OD1 3.17Å; R14-D532 PolarHBondContact NE-OD1 2.82Å; R14-D532 IonicContact NE-OD2 2.82Å; R14-D532 PolarHBondContact NE-OD2 3.27Å; R14-D532 IonicContact NH2-OD2 2.68Å; R14-D532 PolarHBondContact NH2-OD2 2.96Å; T15-D532 VanDerWaalsContact O-OD1 3.07Å; T16-D532 WeakPolarHBondContact CG2-OD1 3.48Å
533	L	88.3	Confident	82.7	Confident	44 Å²	44	86.6 Å²	86.6	23%	0.23	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	111.2	175.9	-179.1	67.9	0	0	0	108.7	R14 T15 V20	R14-L533 WeakPolarHBondContact CA-O 3.22Å; T15-L533 PolarHBondContact N-O 2.86Å; T15-L533 PolarHBondContact O-N 2.96Å; V20-L533 HydrophobicContact CG1-CB 3.82Å; V20-L533 HydrophobicContact CG2-CB 3.88Å
534	I	89.4	Confident	80.4	Confident	85 Å²	85	89.8 Å²	89.8	44%	0.436	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	109.9	179.3	-63.9	165.6	0	0	0	108.8	V10 R14 L536	V10-I534 HydrophobicContact CG1-CG2 3.68Å; V10-I534 HydrophobicContact CG2-CG2 4.48Å; R14-I534 HydrophobicContact CB-CG1 4.42Å; R14-I534 HydrophobicContact CG-CG1 3.9Å; I534-L536 HydrophobicContact CG2-CD2 3.94Å; I534-L536 HydrophobicContact CG2-CG 4.44Å
535	K	85.3	Confident	78.4	Confident	137 Å²	137	96.8 Å²	96.8	60%	0.596	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	104.5	173.8	-171.3	174.5	-175.9	176	0	109.1	G12 Q13	G12-K535 CarbonylContact C-O 3.57Å; G12-K535 WeakPolarHBondContact CA-O 3.29Å; Q13-K535 PolarHBondContact N-O 2.72Å; Q13-K535 PolarHBondContact O-N 3.24Å
536	L	87.4	Confident	76.7	Confident	115 Å²	115	99.8 Å²	99.8	60%	0.602	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	144.9	174	-58.1	179.1	0	0	0	110	V10 I534	V10-L536 HydrophobicContact CG1-CD2 3.41Å; V10-L536 VanDerWaalsContact CG1-CD2 3.41Å; I534-L536 HydrophobicContact CG2-CD2 3.94Å; I534-L536 HydrophobicContact CG2-CG 4.44Å
537	F	83.7	Confident	75.1	Confident	127 Å²	127	104 Å²	104	56%	0.557	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-64.4	140.4	165.3	-66.3	-59	0	0	0	108.8	L11 E539	L11-F537 VanDerWaalsContact C-CD2 3.47Å; L11-F537 WeakPolarHBondContact O-CD2 3.38Å; L11-F537 PolarHBondContact O-N 3.08Å; F537-E539 PolarHBondContact O-N 2.68Å
538	P	79.6	Confident	73.3	Confident	117 Å²	117	113.2 Å²	113.2	76%	0.76	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-55.6	132.5	174	22.3	-30.3	0	0	0	108.6
539	E	75.9	Confident	72	Confident	179 Å²	179	116.6 Å²	116.6	84%	0.836	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-55.4	130.7	173.7	-72.3	-178.1	168.1	0	0	107.9	F537 K541	F537-E539 PolarHBondContact O-N 2.68Å; E539-K541 PolarHBondContact O-N 2.82Å
540	P	67.2	Low	70.7	Confident	117 Å²	117	110.7 Å²	110.7	76%	0.76	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-56.3	117.2	170.5	22.8	-28.9	0	0	0	106	E542	P540-E542 PolarHBondContact O-N 2.92Å
541	K	59.9	Low	69.5	Low	199 Å²	199	110.8 Å²	110.8	87%	0.865	58%	0.577	S	S	*	*			trans	-52.2	111.7	173.5	-73.6	-178.1	177	178	0	106	E539 G543	E539-K541 PolarHBondContact O-N 2.82Å; K541-G543 PolarHBondContact O-N 3.49Å
542	E	51.1	Low	68.3	Low	204 Å²	204	114 Å²	114	95%	0.953	59%	0.59	S	S	*	*			trans	-67.7	70.1	167.7	-76.9	-170.8	152.5	0	0	108.4	P540	P540-E542 PolarHBondContact O-N 2.92Å
543	G	48.7	Very low	67.5	Low	61 Å²	61	115.2 Å²	115.2	63%	0.629	60%	0.601	S	S	*	*			trans	-123.9	88.3	159.1	0	0	0	0	0	103.8	K541 K545	K541-G543 PolarHBondContact O-N 3.49Å; G543-K545 PolarHBondContact O-N 3.05Å
544	G	46.2	Very low	66.3	Low	75 Å²	75	116 Å²	116	77%	0.773	62%	0.619	S	S	*	*			trans	-46.8	131.5	171.5	0	0	0	0	0	108.4	S546	G544-S546 PolarHBondContact O-N 3.43Å; G544-S546 VanDerWaalsContact O-N 3.08Å
545	K	52.2	Low	65.1	Low	150 Å²	150	115.4 Å²	115.4	65%	0.652	62%	0.623	S	S	*	*			trans	-40.3	124	165.1	-71.4	-177.8	176.1	-174.3	0	106.9	G543 Y547 D549	G543-K545 PolarHBondContact O-N 3.05Å; K545-Y547 PolarHBondContact O-N 3.04Å; K545-D549 HydrophobicContact CB-CB 4.21Å
546	S	58.9	Low	63.6	Low	63 Å²	63	113 Å²	113	44%	0.441	62%	0.616	S	S	.	*			trans	-51.6	144.8	174.5	171.9	0	0	0	0	107.4	G544 R548 D549 A550	G544-S546 PolarHBondContact O-N 3.43Å; G544-S546 VanDerWaalsContact O-N 3.08Å; S546-R548 CarbonylContact O-C 3.58Å; S546-R548 PolarHBondContact O-N 3.39Å; S546-R548 PolarHBondContact OG-N 2.9Å; S546-D549 WeakPolarHBondContact CB-OD2 3.48Å; S546-D549 PolarHBondContact N-OD2 3.33Å; S546-D549 WeakPolarHBondContact O-CA 3.37Å; S546-D549 WeakPolarHBondContact O-CB 3.47Å; S546-D549 PolarHBondContact O-N 2.81Å; S546-A550 PolarHBondContact O-N 3.09Å; S546-A550 VanDerWaalsContact O-N 3.16Å
547	Y	60.3	Low	62.1	Low	162 Å²	162	115.4 Å²	115.4	64%	0.635	63%	0.63	S	S	*	*	H	α-helix	trans	-49.4	-32.1	175.1	179.9	-96.8	0	0	0	111.3	K545 A550 V551 L556	K545-Y547 PolarHBondContact O-N 3.04Å; Y547-A550 PolarHBondContact O-N 3.41Å; Y547-V551 HydrophobicContact CD1-CG2 4.16Å; Y547-V551 HydrophobicContact CE1-CG2 3.83Å; Y547-V551 VanDerWaalsContact O-CG2 3.27Å; Y547-V551 WeakPolarHBondContact O-CG2 3.08Å; Y547-V551 PolarHBondContact O-N 3.16Å; Y547-V551 VanDerWaalsContact O-N 3.09Å; Y547-L556 HydrophobicContact CD2-CD1 4.37Å; Y547-L556 HydrophobicContact CE2-CD1 4.25Å
548	R	56.5	Low	60.6	Low	196 Å²	196	115.1 Å²	115.1	74%	0.74	66%	0.663	S	S	*	*	H	α-helix	trans	-60	-46.1	170.7	-88.5	-178.5	168.6	157.8	-3.1	114.1	S546 A550 V551 E552	S546-R548 CarbonylContact O-C 3.58Å; S546-R548 PolarHBondContact O-N 3.39Å; S546-R548 PolarHBondContact OG-N 2.9Å; R548-A550 VanDerWaalsContact C-N 3.28Å; R548-A550 PolarHBondContact O-N 3.41Å; R548-V551 PolarHBondContact O-N 2.79Å; R548-E552 WeakPolarHBondContact O-CB 3.27Å; R548-E552 PolarHBondContact O-N 2.98Å
549	D	63.4	Low	59.6	Low	82 Å²	82	115 Å²	115	44%	0.439	66%	0.658	S	S	.	*	H	α-helix	trans	-67.9	-31.2	-179.2	-55.6	-27.1	0	0	0	111.4	K545 S546 S553	K545-D549 HydrophobicContact CB-CB 4.21Å; S546-D549 WeakPolarHBondContact CB-OD2 3.48Å; S546-D549 PolarHBondContact N-OD2 3.33Å; S546-D549 WeakPolarHBondContact O-CA 3.37Å; S546-D549 WeakPolarHBondContact O-CB 3.47Å; S546-D549 PolarHBondContact O-N 2.81Å; D549-S553 WeakPolarHBondContact O-CB 3.4Å; D549-S553 PolarHBondContact O-N 2.77Å; D549-S553 PolarHBondContact O-OG 3.19Å; D549-S553 VanDerWaalsContact O-OG 3.05Å
550	A	63.1	Low	58.8	Low	13 Å²	13	111.6 Å²	111.6	11%	0.107	65%	0.648	C	S	.	*	H	α-helix	trans	-76.3	-30.7	177.5	0	0	0	0	0	113.3	S546 Y547 R548 S553 S555 L556	S546-A550 PolarHBondContact O-N 3.09Å; S546-A550 VanDerWaalsContact O-N 3.16Å; Y547-A550 PolarHBondContact O-N 3.41Å; R548-A550 VanDerWaalsContact C-N 3.28Å; R548-A550 PolarHBondContact O-N 3.41Å; A550-S553 PolarHBondContact O-OG 3.15Å; A550-S555 PolarHBondContact O-N 3.49Å; A550-S555 VanDerWaalsContact O-N 3.15Å; A550-S555 PolarHBondContact O-OG 3.42Å; A550-L556 HydrophobicContact CB-CD1 3.83Å; A550-L556 PolarHBondContact O-N 3.44Å
551	V	65.2	Low	58.3	Low	60 Å²	60	111.3 Å²	111.3	36%	0.364	64%	0.642	S	S	.	*	H	α-helix	trans	-75.5	-42.4	172	174.3	0	0	0	0	110.5	Y547 R548 S553 G554	Y547-V551 HydrophobicContact CD1-CG2 4.16Å; Y547-V551 HydrophobicContact CE1-CG2 3.83Å; Y547-V551 VanDerWaalsContact O-CG2 3.27Å; Y547-V551 WeakPolarHBondContact O-CG2 3.08Å; Y547-V551 PolarHBondContact O-N 3.16Å; Y547-V551 VanDerWaalsContact O-N 3.09Å; R548-V551 PolarHBondContact O-N 2.79Å; V551-S553 VanDerWaalsContact C-N 3.32Å; V551-S553 PolarHBondContact O-N 3.43Å; V551-G554 PolarHBondContact O-N 2.76Å; V551-G554 VanDerWaalsContact O-N 3.16Å
552	E	63.7	Low	58.2	Low	165 Å²	165	106.2 Å²	106.2	77%	0.771	63%	0.629	S	S	*	*	H	α-helix	trans	-66.4	-31.4	176.4	-79.7	-175.5	172.5	0	0	113	R548 G554	R548-E552 WeakPolarHBondContact O-CB 3.27Å; R548-E552 PolarHBondContact O-N 2.98Å; E552-G554 PolarHBondContact O-N 3.44Å
553	S	71.4	Confident	58.7	Low	69 Å²	69	100.1 Å²	100.1	48%	0.483	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	4.2	174.6	68.3	0	0	0	0	114.6	D549 A550 V551 S555	D549-S553 WeakPolarHBondContact O-CB 3.4Å; D549-S553 PolarHBondContact O-N 2.77Å; D549-S553 PolarHBondContact O-OG 3.19Å; D549-S553 VanDerWaalsContact O-OG 3.05Å; A550-S553 PolarHBondContact O-OG 3.15Å; V551-S553 VanDerWaalsContact C-N 3.32Å; V551-S553 PolarHBondContact O-N 3.43Å; S553-S555 PolarHBondContact O-N 3.37Å; S553-S555 PolarHBondContact OG-OG 3.16Å
554	G	62.5	Low	59.3	Low	59 Å²	59	102.7 Å²	102.7	61%	0.608	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.7	18.9	178.8	0	0	0	0	0	114.4	V551 E552	V551-G554 PolarHBondContact O-N 2.76Å; V551-G554 VanDerWaalsContact O-N 3.16Å; E552-G554 PolarHBondContact O-N 3.44Å
555	S	65.6	Low	60.3	Low	74 Å²	74	104.6 Å²	104.6	52%	0.517	60%	0.595	S	S	.	*	S	Bend	trans	-87.6	-8.8	-178.6	45.3	0	0	0	0	113.7	A550 S553	A550-S555 PolarHBondContact O-N 3.49Å; A550-S555 VanDerWaalsContact O-N 3.15Å; A550-S555 PolarHBondContact O-OG 3.42Å; S553-S555 PolarHBondContact O-N 3.37Å; S553-S555 PolarHBondContact OG-OG 3.16Å
556	L	52.6	Low	60.9	Low	85 Å²	85	101.2 Å²	101.2	45%	0.445	59%	0.591	S	S	.	*	S	Bend	trans	-132.6	120.5	171.6	-75.1	163.7	0	0	0	107.2	Y547 A550 G558	Y547-L556 HydrophobicContact CD2-CD1 4.37Å; Y547-L556 HydrophobicContact CE2-CD1 4.25Å; A550-L556 HydrophobicContact CB-CD1 3.83Å; A550-L556 PolarHBondContact O-N 3.44Å; L556-G558 PolarHBondContact O-N 3.08Å
557	D	57.2	Low	61	Low	166 Å²	166	104.3 Å²	104.3	89%	0.888	60%	0.604	S	S	*	*			trans	-67.7	121.7	164.7	-71.4	-38.7	0	0	0	107.1
558	G	51.2	Low	61.1	Low	121 Å²	121	99.1 Å²	99.1	100%	1.247	60%	0.601	S	S	*	*			trans	-61.2	0	-173.2	0	0	0	0	0	114.9	L556	L556-G558 PolarHBondContact O-N 3.08Å

Retrieved 558 of 558 residues in 204.7 ms (Link to these results)

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