A0A087XME0_POEFO Loading...

Ro60, Y RNA binding protein

AlphaFold DB , UniProt , Accession A0A087XME0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 537 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	41.5	Very low	28.9	Very low	248 Å²	248	156.8 Å²	156.8	100%	1.222	86%	0.859	S	S	*	*				0	89.2	0	-101.3	179.6	168.6	0	0	106.8
2	E	24.5	Very low	28.5	Very low	186 Å²	186	150.8 Å²	150.8	87%	0.869	85%	0.846	S	S	*	*			trans	178.7	162.7	175.2	-118	-174.9	-167.7	0	0	104.6
3	P	33.8	Very low	28.6	Very low	116 Å²	116	148 Å²	148	75%	0.753	84%	0.838	S	S	*	*				-107.4	175.8	-80.8	19.9	1.8	0	0	0	112.7
4	S	30.2	Very low	28.7	Very low	122 Å²	122	148.8 Å²	148.8	85%	0.853	84%	0.839	S	S	*	*			trans	-68.9	128	178.7	49	0	0	0	0	114
5	E	27.5	Very low	28.7	Very low	196 Å²	196	145.9 Å²	145.9	92%	0.916	83%	0.832	S	S	*	*			trans	-108.9	149.4	167.5	-88.7	-172.4	157.4	0	0	112.7
6	N	26.6	Very low	29.3	Very low	154 Å²	154	145.7 Å²	145.7	82%	0.824	84%	0.835	S	S	*	*			trans	-53.6	144.4	-179.2	-74	-38.1	0	0	0	115.8
7	T	25.8	Very low	29.6	Very low	143 Å²	143	141.8 Å²	141.8	88%	0.877	83%	0.834	S	S	*	*			trans	-133.1	111	142.5	41.2	0	0	0	0	110
8	T	27.7	Very low	30.1	Very low	130 Å²	130	137.7 Å²	137.7	80%	0.798	82%	0.819	S	S	*	*			trans	-66.4	128.7	168.7	35.6	0	0	0	0	110.7
9	S	25.2	Very low	30.6	Very low	99 Å²	99	140.3 Å²	140.3	69%	0.692	82%	0.822	S	S	*	*			trans	-115.7	105.5	156.9	74.7	0	0	0	0	109.5	H11	S9-H11 PolarHBondContact O-N 3.5Å; S9-H11 VanDerWaalsContact O-N 3.13Å
10	N	27.7	Very low	31.5	Very low	159 Å²	159	136.1 Å²	136.1	85%	0.85	81%	0.81	S	S	*	*			trans	-60.7	104.9	165.2	-82.8	-22.9	0	0	0	109.6
11	H	27.4	Very low	32.9	Very low	172 Å²	172	132.1 Å²	132.1	80%	0.796	79%	0.789	S	S	*	*			trans	-112.7	101.9	154.5	-81.6	-66.4	0	0	0	108	S9	S9-H11 PolarHBondContact O-N 3.5Å; S9-H11 VanDerWaalsContact O-N 3.13Å
12	A	24.7	Very low	34.6	Very low	85 Å²	85	121.7 Å²	121.7	70%	0.702	74%	0.736	S	S	*	*			trans	-65.1	130.8	168.2	0	0	0	0	0	109.3	N14	A12-N14 PolarHBondContact O-N 3.03Å
13	P	29.7	Very low	37.4	Very low	114 Å²	114	118.7 Å²	118.7	74%	0.74	72%	0.722	S	S	*	*			trans	-80.2	98.9	169.4	31	-28.1	0	0	0	108.4	S15	P13-S15 PolarHBondContact O-N 3.03Å
14	N	29.2	Very low	39.7	Very low	159 Å²	159	115.2 Å²	115.2	85%	0.85	70%	0.696	S	S	*	*			trans	-86.9	89.2	159.7	-89.9	-6.1	0	0	0	108.6	A12	A12-N14 PolarHBondContact O-N 3.03Å
15	S	28.8	Very low	42.5	Very low	106 Å²	106	112 Å²	112	74%	0.741	67%	0.674	S	S	*	*			trans	-157.2	68.5	159.3	57.3	0	0	0	0	109	P13	P13-S15 PolarHBondContact O-N 3.03Å
16	T	38.6	Very low	45.4	Very low	142 Å²	142	104.4 Å²	104.4	87%	0.871	64%	0.64	S	S	*	*			trans	-82.6	120.7	172.4	35.2	0	0	0	0	110.2
17	G	33.8	Very low	48.4	Very low	79 Å²	79	101 Å²	101	81%	0.814	62%	0.618	S	S	*	*	S	Bend	trans	128.6	60.9	154	0	0	0	0	0	117
18	A	39.3	Very low	51.5	Low	69 Å²	69	95.1 Å²	95.1	57%	0.57	58%	0.582	S	S	*	*	S	Bend	trans	-168.4	-33.9	154.7	0	0	0	0	0	113.3	S21	A18-S21 PolarHBondContact O-OG 3.4Å; A18-S21 VanDerWaalsContact O-OG 3.04Å
19	E	39.7	Very low	54.5	Low	186 Å²	186	92.9 Å²	92.9	87%	0.869	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-73.3	-35.4	-168.7	-75.3	-178.6	151	0	0	113.9	S21	E19-S21 PolarHBondContact O-N 3.22Å
20	G	48	Very low	57.8	Low	57 Å²	57	88.2 Å²	88.2	59%	0.588	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-81.7	-4.9	179.8	0	0	0	0	0	116	W22	G20-W22 VanDerWaalsContact C-N 3.32Å
21	S	60.4	Low	60.9	Low	53 Å²	53	80.9 Å²	80.9	37%	0.371	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-80.2	-15	-176.3	62.9	0	0	0	0	113.9	A18 E19 R513	A18-S21 PolarHBondContact O-OG 3.4Å; A18-S21 VanDerWaalsContact O-OG 3.04Å; E19-S21 PolarHBondContact O-N 3.22Å; S21-R513 PolarHBondContact O-NE 3.34Å; S21-R513 VanDerWaalsContact O-NE 3.1Å; S21-R513 PolarHBondContact O-NH1 3.17Å; S21-R513 PolarHBondContact O-NH2 3.09Å
22	W	79	Confident	64	Low	28 Å²	28	72.7 Å²	72.7	11%	0.106	45%	0.449	C	S	.	.	S	Bend	trans	-105.2	-8	-174.2	-68.7	97.1	0	0	0	113.8	G20 D492 K494 D512 R513	G20-W22 VanDerWaalsContact C-N 3.32Å; W22-D492 HydrophobicContact CH2-CB 3.88Å; W22-D492 HydrophobicContact CZ2-CB 3.68Å; W22-K494 HydrophobicContact CH2-CG 4.48Å; W22-K494 HydrophobicContact CZ3-CG 4.42Å; W22-D512 WeakPolarHBondContact O-CA 3.37Å; W22-R513 HydrophobicContact CE3-CG 3.66Å; W22-R513 HydrophobicContact CZ3-CG 4.15Å; W22-R513 PolarHBondContact O-N 3.37Å
23	E	81.5	Confident	67.2	Low	124 Å²	124	68.7 Å²	68.7	58%	0.579	42%	0.416	S	S	*	.	B	Isolated β-bridge	trans	-60.8	139.5	172.2	-73.8	179.8	-176.1	0	0	111.5	S25 E511	E23-S25 PolarHBondContact O-N 2.84Å; E23-E511 WeakPolarHBondContact CA-O 3.28Å
24	I	83	Confident	70.2	Confident	42 Å²	42	63.2 Å²	63.2	22%	0.215	38%	0.381	C	S	.	.			trans	-77.1	104.9	180	-70.2	165	0	0	0	109.8	R29 E511 R513	I24-R29 HydrophobicContact CG2-CG 3.27Å; I24-E511 WeakPolarHBondContact CG1-O 3.33Å; I24-E511 PolarHBondContact N-O 2.9Å; I24-R513 HydrophobicContact CG1-CB 3.9Å
25	S	88.2	Confident	73.1	Confident	56 Å²	56	55.7 Å²	55.7	39%	0.392	34%	0.34	S	S	.	.			trans	-72	156.2	171.8	75.5	0	0	0	0	112.4	E23 K27 T28 R29	E23-S25 PolarHBondContact O-N 2.84Å; S25-K27 PolarHBondContact O-N 3.33Å; S25-K27 VanDerWaalsContact O-N 3.16Å; S25-K27 PolarHBondContact OG-N 2.96Å; S25-T28 WeakPolarHBondContact O-CA 3.48Å; S25-T28 WeakPolarHBondContact O-CB 3.49Å; S25-T28 PolarHBondContact O-N 3.43Å; S25-T28 PolarHBondContact OG-N 3.08Å; S25-T28 VanDerWaalsContact OG-N 3.13Å; S25-T28 PolarHBondContact OG-OG1 3.23Å; S25-R29 PolarHBondContact O-N 3.38Å
26	D	89	Confident	75.9	Confident	36 Å²	36	50.7 Å²	50.7	19%	0.193	31%	0.305	C	S	.	.	H	α-helix	trans	-56.6	-30.6	171.7	-83.8	-8.4	0	0	0	112.7	R29 L30 A58 S61 L62	D26-R29 PolarHBondContact O-N 2.66Å; D26-R29 IonicContact OD1-NH1 3.58Å; D26-R29 PolarHBondContact OD1-NH1 3.47Å; D26-L30 WeakPolarHBondContact O-CB 3.12Å; D26-L30 PolarHBondContact O-N 2.68Å; D26-A58 HydrophobicContact CB-CB 4.25Å; D26-S61 WeakPolarHBondContact OD2-CB 3.4Å; D26-S61 PolarHBondContact OD2-OG 3.22Å; D26-L62 HydrophobicContact CB-CD2 4.25Å; D26-L62 HydrophobicContact CB-CG 4.28Å
27	K	90.4	Very high	78.2	Confident	81 Å²	81	44.1 Å²	44.1	35%	0.352	27%	0.266	S	S	.	.	H	α-helix	trans	-64.6	-43.5	173.1	-177.7	174	-175.6	153	0	111.7	S25 L30 C31 E70 E74	S25-K27 PolarHBondContact O-N 3.33Å; S25-K27 VanDerWaalsContact O-N 3.16Å; S25-K27 PolarHBondContact OG-N 2.96Å; K27-L30 PolarHBondContact O-N 3.05Å; K27-C31 PolarHBondContact O-N 3.05Å; K27-C31 PolarHBondContact O-SG 3.07Å; K27-E70 IonicContact NZ-OE1 3.31Å; K27-E74 WeakPolarHBondContact CE-OE1 3.48Å; K27-E74 IonicContact NZ-OE1 2.78Å; K27-E74 PolarHBondContact NZ-OE1 3.36Å
28	T	90.2	Very high	80.7	Confident	20 Å²	20	42 Å²	42	12%	0.123	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-45.7	177.3	-55.5	0	0	0	0	110.7	S25 L30 C31 R32 R513 I537	S25-T28 WeakPolarHBondContact O-CA 3.48Å; S25-T28 WeakPolarHBondContact O-CB 3.49Å; S25-T28 PolarHBondContact O-N 3.43Å; S25-T28 PolarHBondContact OG-N 3.08Å; S25-T28 VanDerWaalsContact OG-N 3.13Å; S25-T28 PolarHBondContact OG-OG1 3.23Å; T28-L30 PolarHBondContact O-N 2.94Å; T28-C31 PolarHBondContact O-N 3.49Å; T28-C31 VanDerWaalsContact O-N 3.11Å; T28-R32 PolarHBondContact O-N 3.33Å; T28-R513 HydrophobicContact CG2-CB 4.31Å; T28-I537 WeakPolarHBondContact CG2-OXT 2.79Å
29	R	91.3	Very high	82.9	Confident	83 Å²	83	39.6 Å²	39.6	31%	0.313	22%	0.216	S	C	.	.	H	α-helix	trans	-58.6	-44.9	174.6	-66.9	175.8	61.8	-170.5	2.3	112.2	I24 S25 D26 C31 R32 F33 E39 A58	I24-R29 HydrophobicContact CG2-CG 3.27Å; S25-R29 PolarHBondContact O-N 3.38Å; D26-R29 PolarHBondContact O-N 2.66Å; D26-R29 IonicContact OD1-NH1 3.58Å; D26-R29 PolarHBondContact OD1-NH1 3.47Å; R29-C31 VanDerWaalsContact C-N 3.33Å; R29-C31 PolarHBondContact O-N 3.37Å; R29-R32 WeakPolarHBondContact O-CB 3.39Å; R29-R32 PolarHBondContact O-N 3.26Å; R29-F33 WeakPolarHBondContact O-CB 3.39Å; R29-F33 PolarHBondContact O-N 2.89Å; R29-E39 HydrophobicContact CB-CB 4.1Å; R29-E39 HydrophobicContact CB-CG 4.24Å; R29-E39 IonicContact CZ-OE2 3.68Å; R29-E39 IonicContact NE-OE2 2.83Å; R29-E39 PolarHBondContact NE-OE2 3.25Å; R29-E39 IonicContact NH2-OE2 2.98Å; R29-E39 PolarHBondContact NH2-OE2 3.09Å; R29-A58 HydrophobicContact CB-CB 3.44Å; R29-A58 VanDerWaalsContact CB-CB 3.44Å; R29-A58 HydrophobicContact CG-CB 4.41Å
30	L	93.4	Very high	84.9	Confident	1 Å²	1	32 Å²	32	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-43.5	174.4	176.1	66.6	0	0	0	111.2	D26 K27 T28 F33 L34 L59 L62 A71 E74	D26-L30 WeakPolarHBondContact O-CB 3.12Å; D26-L30 PolarHBondContact O-N 2.68Å; K27-L30 PolarHBondContact O-N 3.05Å; T28-L30 PolarHBondContact O-N 2.94Å; L30-F33 HydrophobicContact CD1-CD1 4.4Å; L30-F33 WeakPolarHBondContact O-CB 3.44Å; L30-F33 PolarHBondContact O-N 3.32Å; L30-L34 HydrophobicContact CD1-CD1 4.13Å; L30-L34 HydrophobicContact CD1-CG 4.06Å; L30-L34 HydrophobicContact CD2-CD1 4.32Å; L30-L34 HydrophobicContact CG-CD1 3.86Å; L30-L34 HydrophobicContact CG-CG 4.22Å; L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 VanDerWaalsContact O-CG 3.25Å; L30-L34 WeakPolarHBondContact O-CG 3.39Å; L30-L34 PolarHBondContact O-N 3.22Å; L30-L59 HydrophobicContact CD1-CB 4.16Å; L30-L59 HydrophobicContact CD1-CD1 4.19Å; L30-L62 HydrophobicContact CB-CD1 4.15Å; L30-L62 HydrophobicContact CD2-CD1 3.69Å; L30-L62 HydrophobicContact CG-CD1 4.43Å; L30-A71 HydrophobicContact CD2-CB 3.69Å; L30-E74 HydrophobicContact CD2-CB 4.18Å
31	C	93	Very high	86.6	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.034	17%	0.165	C	C	.	.	H	α-helix	trans	-65.4	-39.5	179.4	-66.7	0	0	0	0	112	K27 T28 R29 L34 C35 F78 L536 I537	K27-C31 PolarHBondContact O-N 3.05Å; K27-C31 PolarHBondContact O-SG 3.07Å; T28-C31 PolarHBondContact O-N 3.49Å; T28-C31 VanDerWaalsContact O-N 3.11Å; R29-C31 VanDerWaalsContact C-N 3.33Å; R29-C31 PolarHBondContact O-N 3.37Å; C31-L34 PolarHBondContact O-N 2.98Å; C31-C35 VanDerWaalsContact O-CB 3.26Å; C31-C35 WeakPolarHBondContact O-CB 3.5Å; C31-C35 PolarHBondContact O-N 3.22Å; C31-F78 HydrophobicContact CB-CE2 3.93Å; C31-F78 HydrophobicContact CB-CZ 3.92Å; C31-L536 WeakPolarHBondContact CB-O 3.22Å; C31-I537 HydrophobicContact CB-CG2 4.1Å
32	R	91.8	Very high	87.8	Confident	1 Å²	1	30 Å²	30	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-58.1	-48.1	170.8	-74.1	178.3	178.8	-163.8	-6.6	111.5	T28 R29 L34 C35 Y36 S38 R513 I537	T28-R32 PolarHBondContact O-N 3.33Å; R29-R32 WeakPolarHBondContact O-CB 3.39Å; R29-R32 PolarHBondContact O-N 3.26Å; R32-L34 PolarHBondContact O-N 3.47Å; R32-C35 WeakPolarHBondContact O-CB 3.26Å; R32-C35 PolarHBondContact O-N 2.75Å; R32-C35 VanDerWaalsContact O-N 3.11Å; R32-Y36 HydrophobicContact CB-CE1 4.02Å; R32-Y36 WeakPolarHBondContact CB-OH 3.18Å; R32-Y36 WeakPolarHBondContact CD-OH 3.32Å; R32-Y36 HydrophobicContact CG-CE1 4.23Å; R32-Y36 WeakPolarHBondContact CG-OH 3.37Å; R32-Y36 WeakPolarHBondContact O-CD1 3.46Å; R32-Y36 PolarHBondContact O-N 2.86Å; R32-S38 CarbonylContact C-O 3.58Å; R32-R513 PolarHBondContact NH2-O 3.15Å; R32-I537 HydrophobicContact CG-CB 3.95Å; R32-I537 VanDerWaalsContact CG-OXT 3.22Å; R32-I537 WeakPolarHBondContact CG-OXT 3.41Å; R32-I537 PolarHBondContact NE-OXT 2.81Å
33	F	92.6	Very high	88.3	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-46.3	175.8	175	-99	0	0	0	112.1	R29 L30 C35 G37 S38 E39 V51 T55 A56 P89 F92 T93	R29-F33 WeakPolarHBondContact O-CB 3.39Å; R29-F33 PolarHBondContact O-N 2.89Å; L30-F33 HydrophobicContact CD1-CD1 4.4Å; L30-F33 WeakPolarHBondContact O-CB 3.44Å; L30-F33 PolarHBondContact O-N 3.32Å; F33-C35 PolarHBondContact O-N 3.44Å; F33-G37 WeakPolarHBondContact O-CA 3.24Å; F33-G37 PolarHBondContact O-N 3.25Å; F33-S38 VanDerWaalsContact CA-O 3.29Å; F33-S38 WeakPolarHBondContact CA-O 3.33Å; F33-S38 PolarHBondContact N-O 2.95Å; F33-E39 HydrophobicContact CB-CG 3.85Å; F33-E39 HydrophobicContact CD2-CG 4.48Å; F33-E39 HydrophobicContact CG-CG 4.5Å; F33-V51 HydrophobicContact CE1-CG1 4.43Å; F33-V51 HydrophobicContact CE2-CG1 3.5Å; F33-V51 VanDerWaalsContact CE2-CG1 3.5Å; F33-V51 HydrophobicContact CZ-CG1 3.26Å; F33-T55 VanDerWaalsContact CD2-O 3.23Å; F33-T55 WeakPolarHBondContact CD2-O 3.3Å; F33-T55 WeakPolarHBondContact CE2-O 3.49Å; F33-A56 HydrophobicContact CE1-CB 4.39Å; F33-A56 HydrophobicContact CE2-CB 3.86Å; F33-A56 HydrophobicContact CZ-CB 3.76Å; F33-P89 HydrophobicContact CD1-CB 4.11Å; F33-P89 HydrophobicContact CE1-CB 3.95Å; F33-P89 HydrophobicContact CZ-CB 4.31Å; F33-P89 WeakPolarHBondContact O-CB 3.4Å; F33-P89 VanDerWaalsContact O-CG 3.3Å; F33-P89 WeakPolarHBondContact O-CG 3.36Å; F33-F92 HydrophobicContact CE1-CD1 4.14Å; F33-F92 AromaticContact CZ-CD1 3.67Å; F33-F92 HydrophobicContact CZ-CD1 3.67Å; F33-F92 HydrophobicContact CZ-CE1 4.14Å; F33-T93 WeakPolarHBondContact CE1-OG1 3.43Å
34	L	92.4	Very high	88.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.7	-30.9	177	-70.6	173.2	0	0	0	112.5	L30 C31 R32 E74 A75 F78 A84 A90 T93	L30-L34 HydrophobicContact CD1-CD1 4.13Å; L30-L34 HydrophobicContact CD1-CG 4.06Å; L30-L34 HydrophobicContact CD2-CD1 4.32Å; L30-L34 HydrophobicContact CG-CD1 3.86Å; L30-L34 HydrophobicContact CG-CG 4.22Å; L30-L34 WeakPolarHBondContact O-CB 3.3Å; L30-L34 VanDerWaalsContact O-CG 3.25Å; L30-L34 WeakPolarHBondContact O-CG 3.39Å; L30-L34 PolarHBondContact O-N 3.22Å; C31-L34 PolarHBondContact O-N 2.98Å; R32-L34 PolarHBondContact O-N 3.47Å; L34-E74 HydrophobicContact CD1-CB 3.73Å; L34-A75 HydrophobicContact CD1-CB 4.35Å; L34-A75 HydrophobicContact CD2-CB 3.8Å; L34-F78 HydrophobicContact CB-CB 4.16Å; L34-F78 HydrophobicContact CB-CD1 4.13Å; L34-F78 HydrophobicContact CB-CD2 3.94Å; L34-F78 HydrophobicContact CB-CE2 4.38Å; L34-F78 HydrophobicContact CB-CG 3.8Å; L34-F78 HydrophobicContact CD1-CD2 4Å; L34-A84 WeakPolarHBondContact O-CB 3.44Å; L34-A90 HydrophobicContact CD2-CB 4.29Å; L34-T93 HydrophobicContact CD2-CG2 4.46Å; L34-T93 WeakPolarHBondContact CD2-OG1 3.38Å
35	C	90.8	Very high	88.3	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-72.3	-52.2	178.1	-171.7	0	0	0	0	112	C31 R32 F33 F78 V85 N531 I537	C31-C35 VanDerWaalsContact O-CB 3.26Å; C31-C35 WeakPolarHBondContact O-CB 3.5Å; C31-C35 PolarHBondContact O-N 3.22Å; R32-C35 WeakPolarHBondContact O-CB 3.26Å; R32-C35 PolarHBondContact O-N 2.75Å; R32-C35 VanDerWaalsContact O-N 3.11Å; F33-C35 PolarHBondContact O-N 3.44Å; C35-F78 HydrophobicContact CB-CD1 4.38Å; C35-F78 HydrophobicContact CB-CE1 3.73Å; C35-V85 WeakPolarHBondContact O-CB 3.28Å; C35-V85 PolarHBondContact O-N 2.96Å; C35-N531 PolarHBondContact SG-ND2 3.25Å; C35-I537 HydrophobicContact CB-CG2 3.75Å
36	Y	88.1	Confident	87.3	Confident	1 Å²	1	27.2 Å²	27.2	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-138.3	5.1	-170.8	54.9	-98.8	0	0	0	116	R32 S38 G40 I42 Y43 Q48 V528 I537	R32-Y36 HydrophobicContact CB-CE1 4.02Å; R32-Y36 WeakPolarHBondContact CB-OH 3.18Å; R32-Y36 WeakPolarHBondContact CD-OH 3.32Å; R32-Y36 HydrophobicContact CG-CE1 4.23Å; R32-Y36 WeakPolarHBondContact CG-OH 3.37Å; R32-Y36 WeakPolarHBondContact O-CD1 3.46Å; R32-Y36 PolarHBondContact O-N 2.86Å; Y36-S38 VanDerWaalsContact CE2-O 3.26Å; Y36-S38 WeakPolarHBondContact CE2-O 3.42Å; Y36-G40 PolarHBondContact OH-O 3.08Å; Y36-I42 WeakPolarHBondContact CE2-O 3.49Å; Y36-Y43 VanDerWaalsContact CB-CD2 3.43Å; Y36-Y43 HydrophobicContact CD1-CD2 4.34Å; Y36-Y43 HydrophobicContact CD2-CD2 4.12Å; Y36-Y43 AromaticContact CG-CD2 3.73Å; Y36-Y43 HydrophobicContact CG-CD2 3.73Å; Y36-Q48 PolarHBondContact O-NE2 3.38Å; Y36-Q48 PolarHBondContact O-OE1 2.89Å; Y36-V528 HydrophobicContact CD1-CG2 3.91Å; Y36-I537 HydrophobicContact CE1-CD1 4.14Å
37	G	86.8	Confident	85.8	Confident	5 Å²	5	31.5 Å²	31.5	5%	0.052	15%	0.154	C	C	.	.	S	Bend	trans	87.6	10.7	170.4	0	0	0	0	0	115.7	F33	F33-G37 WeakPolarHBondContact O-CA 3.24Å; F33-G37 PolarHBondContact O-N 3.25Å
38	S	85.6	Confident	84.3	Confident	35 Å²	35	29.9 Å²	29.9	25%	0.245	15%	0.147	C	C	.	.			trans	-133.4	146.1	170.3	176	0	0	0	0	109.7	R32 F33 Y36 G40	R32-S38 CarbonylContact C-O 3.58Å; F33-S38 VanDerWaalsContact CA-O 3.29Å; F33-S38 WeakPolarHBondContact CA-O 3.33Å; F33-S38 PolarHBondContact N-O 2.95Å; Y36-S38 VanDerWaalsContact CE2-O 3.26Å; Y36-S38 WeakPolarHBondContact CE2-O 3.42Å; S38-G40 PolarHBondContact OG-N 3.41Å
39	E	85.4	Confident	82.9	Confident	18 Å²	18	32.1 Å²	32.1	8%	0.084	17%	0.174	C	C	.	.	S	Bend	trans	-84.5	-18.9	175.9	-68	-178.7	175.1	0	0	113	R29 F33 A56 G57 A58	R29-E39 HydrophobicContact CB-CB 4.1Å; R29-E39 HydrophobicContact CB-CG 4.24Å; R29-E39 IonicContact CZ-OE2 3.68Å; R29-E39 IonicContact NE-OE2 2.83Å; R29-E39 PolarHBondContact NE-OE2 3.25Å; R29-E39 IonicContact NH2-OE2 2.98Å; R29-E39 PolarHBondContact NH2-OE2 3.09Å; F33-E39 HydrophobicContact CB-CG 3.85Å; F33-E39 HydrophobicContact CD2-CG 4.48Å; F33-E39 HydrophobicContact CG-CG 4.5Å; E39-A56 WeakPolarHBondContact OE1-CA 3.48Å; E39-G57 VanDerWaalsContact CD-N 3.33Å; E39-G57 PolarHBondContact OE1-N 3.49Å; E39-G57 PolarHBondContact OE2-N 3.28Å; E39-A58 HydrophobicContact CG-CB 4.49Å; E39-A58 WeakPolarHBondContact OE1-CA 3.21Å; E39-A58 WeakPolarHBondContact OE1-CB 3.36Å; E39-A58 PolarHBondContact OE1-N 3.06Å; E39-A58 PolarHBondContact OE2-N 3.32Å
40	G	82.7	Confident	82	Confident	25 Å²	25	32.9 Å²	32.9	26%	0.258	18%	0.177	S	C	.	.	S	Bend	trans	-76.3	174.8	-178.7	0	0	0	0	0	112.9	Y36 S38 I42	Y36-G40 PolarHBondContact OH-O 3.08Å; S38-G40 PolarHBondContact OG-N 3.41Å; G40-I42 PolarHBondContact O-N 3.06Å
41	E	83.1	Confident	81.5	Confident	31 Å²	31	33.6 Å²	33.6	15%	0.145	18%	0.181	C	C	.	.	S	Bend	trans	-78.2	3.3	-178.8	66.6	-70.3	159.2	0	0	114.2	A506 L516 S517	E41-A506 HydrophobicContact CG-CB 4.42Å; E41-A506 WeakPolarHBondContact OE1-CB 3.48Å; E41-L516 VanDerWaalsContact O-CD1 3.23Å; E41-L516 WeakPolarHBondContact O-CD1 3.46Å; E41-S517 WeakPolarHBondContact O-CB 3.23Å; E41-S517 PolarHBondContact O-N 2.97Å
42	I	86.4	Confident	80.8	Confident	39 Å²	39	35.2 Å²	35.2	20%	0.2	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.4	178.5	-50.3	175.5	0	0	0	110.8	Y36 G40 A506 S517	Y36-I42 WeakPolarHBondContact CE2-O 3.49Å; G40-I42 PolarHBondContact O-N 3.06Å; I42-A506 HydrophobicContact CD1-CB 3.57Å; I42-A506 HydrophobicContact CG1-CB 3.75Å; I42-S517 CarbonylContact C-O 3.12Å; I42-S517 WeakPolarHBondContact CA-O 3.47Å
43	Y	87.7	Confident	80.2	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127.8	161.1	171.7	-110.7	0	0	0	110.4	Y36 A45 V85 S517 I518 C519 D522 G524 A525 V528	Y36-Y43 VanDerWaalsContact CB-CD2 3.43Å; Y36-Y43 HydrophobicContact CD1-CD2 4.34Å; Y36-Y43 HydrophobicContact CD2-CD2 4.12Å; Y36-Y43 AromaticContact CG-CD2 3.73Å; Y36-Y43 HydrophobicContact CG-CD2 3.73Å; Y43-A45 HydrophobicContact CE1-CB 4.5Å; Y43-V85 HydrophobicContact CE2-CG1 4.23Å; Y43-V85 HydrophobicContact CE2-CG2 4.31Å; Y43-S517 PolarHBondContact N-O 3.3Å; Y43-I518 HydrophobicContact CD1-CG1 4.17Å; Y43-I518 HydrophobicContact CD1-CG2 4Å; Y43-I518 CarbonylContact O-C 3.5Å; Y43-I518 WeakPolarHBondContact O-CA 3.47Å; Y43-C519 PolarHBondContact O-N 2.95Å; Y43-D522 WeakPolarHBondContact CE1-OD1 3.4Å; Y43-D522 PolarHBondContact OH-OD1 2.97Å; Y43-D522 PolarHBondContact OH-OD2 3.38Å; Y43-G524 WeakPolarHBondContact OH-CA 3.38Å; Y43-A525 HydrophobicContact CD1-CB 4.43Å; Y43-A525 HydrophobicContact CE1-CB 4.02Å; Y43-V528 HydrophobicContact CD1-CG2 4.27Å; Y43-V528 HydrophobicContact CD2-CG2 4.03Å; Y43-V528 HydrophobicContact CE2-CG2 4.32Å; Y43-V528 HydrophobicContact CG-CG2 3.99Å
44	T	84.8	Confident	79.7	Confident	19 Å²	19	46.7 Å²	46.7	12%	0.117	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	121.2	176.1	-51.3	0	0	0	0	110.5	R46 E47 C519	T44-R46 VanDerWaalsContact C-N 3.27Å; T44-R46 PolarHBondContact O-N 2.81Å; T44-E47 HydrophobicContact CG2-CB 3.95Å; T44-C519 HydrophobicContact CG2-CB 4.25Å
45	A	79.6	Confident	79	Confident	12 Å²	12	49.5 Å²	49.5	10%	0.099	27%	0.27	C	S	.	.	S	Bend	trans	-60.9	-33.6	-178.4	0	0	0	0	0	113.3	Y43 R86 C519 D522	Y43-A45 HydrophobicContact CE1-CB 4.5Å; A45-R86 PolarHBondContact O-NH2 3.24Å; A45-C519 PolarHBondContact N-O 3.34Å; A45-D522 HydrophobicContact CB-CB 3.84Å
46	R	68.3	Low	78.7	Confident	159 Å²	159	49.5 Å²	49.5	60%	0.6	27%	0.27	S	S	*	.	S	Bend	trans	-101.2	-29.5	-173.5	-91.4	179.7	147.1	-170.9	-7.2	115.3	T44 P384 G385	T44-R46 VanDerWaalsContact C-N 3.27Å; T44-R46 PolarHBondContact O-N 2.81Å; R46-P384 WeakPolarHBondContact CD-O 3.34Å; R46-P384 VanDerWaalsContact CZ-C 3.43Å; R46-P384 PolarHBondContact NE-O 2.81Å; R46-G385 VanDerWaalsContact NH2-N 3.13Å
47	E	57.6	Low	78.8	Confident	127 Å²	127	50.9 Å²	50.9	59%	0.593	29%	0.285	S	S	*	.			trans	-119	101.7	-170.1	-74.4	-179.1	156.1	0	0	111.3	T44	T44-E47 HydrophobicContact CG2-CB 3.95Å
48	Q	58.4	Low	78.9	Confident	46 Å²	46	50.6 Å²	50.6	22%	0.215	28%	0.282	C	S	.	.			trans	-141.4	126.8	132.4	-76	101.1	15.1	0	0	106.5	Y36 R86	Y36-Q48 PolarHBondContact O-NE2 3.38Å; Y36-Q48 PolarHBondContact O-OE1 2.89Å; Q48-R86 PolarHBondContact O-NH1 3.41Å
49	G	60.8	Low	79.3	Confident	67 Å²	67	49 Å²	49	69%	0.691	27%	0.271	S	S	*	.			trans	-61.8	-169.8	168.6	0	0	0	0	0	111.3	V51	G49-V51 PolarHBondContact O-N 3.36Å
50	R	72.9	Confident	79.6	Confident	100 Å²	100	51 Å²	51	38%	0.377	28%	0.282	S	S	.	.	S	Bend	trans	-58.5	127	170.3	-171.1	174.5	-169.6	122.1	19.9	108.9	A52 Y129 E132 E173	R50-A52 PolarHBondContact O-N 3.26Å; R50-Y129 HydrophobicContact CG-CE1 3.78Å; R50-E132 VanDerWaalsContact CZ-CD 3.45Å; R50-E132 IonicContact CZ-OE1 3.58Å; R50-E132 IonicContact CZ-OE2 3.62Å; R50-E132 VanDerWaalsContact CZ-OE2 3.28Å; R50-E132 IonicContact NE-OE1 2.69Å; R50-E132 PolarHBondContact NE-OE1 3.48Å; R50-E132 IonicContact NE-OE2 3.72Å; R50-E132 PolarHBondContact NE-OE2 3.42Å; R50-E132 IonicContact NH1-OE1 3.55Å; R50-E132 PolarHBondContact NH1-OE1 2.97Å; R50-E132 VanDerWaalsContact NH1-OE1 3.14Å; R50-E132 IonicContact NH2-OE1 2.93Å; R50-E132 PolarHBondContact NH2-OE1 3.49Å; R50-E132 IonicContact NH2-OE2 3.62Å; R50-E173 IonicContact CZ-OE2 3.38Å; R50-E173 IonicContact NH1-OE2 2.76Å; R50-E173 PolarHBondContact NH1-OE2 3.19Å; R50-E173 IonicContact NH2-OE2 3.65Å
51	V	81.9	Confident	80	Confident	15 Å²	15	51.3 Å²	51.3	9%	0.091	28%	0.28	C	S	.	.			trans	-52.4	133.3	177.3	-179.8	0	0	0	0	110.1	F33 G49 P89 F92	F33-V51 HydrophobicContact CE1-CG1 4.43Å; F33-V51 HydrophobicContact CE2-CG1 3.5Å; F33-V51 VanDerWaalsContact CE2-CG1 3.5Å; F33-V51 HydrophobicContact CZ-CG1 3.26Å; G49-V51 PolarHBondContact O-N 3.36Å; V51-P89 HydrophobicContact CG2-CG 4.03Å; V51-F92 HydrophobicContact CB-CB 4.22Å; V51-F92 HydrophobicContact CB-CD2 4.35Å; V51-F92 HydrophobicContact CB-CG 4.21Å; V51-F92 HydrophobicContact CG1-CB 3.84Å; V51-F92 HydrophobicContact CG1-CD1 3.7Å; V51-F92 HydrophobicContact CG1-CD2 3.97Å; V51-F92 HydrophobicContact CG1-CE1 4.24Å; V51-F92 HydrophobicContact CG1-CE2 4.48Å; V51-F92 HydrophobicContact CG1-CG 3.54Å
52	A	79.9	Confident	80.5	Confident	39 Å²	39	49.9 Å²	49.9	32%	0.322	27%	0.273	S	S	.	.			trans	-130	167.5	-176.9	0	0	0	0	0	110.9	R50 E54 T55	R50-A52 PolarHBondContact O-N 3.26Å; A52-E54 PolarHBondContact O-N 2.89Å; A52-T55 PolarHBondContact O-N 3.41Å; A52-T55 PolarHBondContact O-OG1 2.89Å; A52-T55 VanDerWaalsContact O-OG1 3.09Å
53	T	79.4	Confident	80.8	Confident	61 Å²	61	48.3 Å²	48.3	37%	0.374	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-61.8	-30.5	178.1	42.5	0	0	0	0	113.1	T55 A56 F92 L96 L133	T53-T55 PolarHBondContact O-N 3.43Å; T53-A56 PolarHBondContact O-N 3.38Å; T53-F92 HydrophobicContact CG2-CZ 3.9Å; T53-L96 HydrophobicContact CG2-CD1 4.49Å; T53-L133 HydrophobicContact CG2-CD2 3.5Å; T53-L133 VanDerWaalsContact CG2-CD2 3.5Å
54	E	80.4	Confident	81	Confident	182 Å²	182	56.2 Å²	56.2	85%	0.85	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-62.9	-29.4	179.2	-64.2	172.1	-170.3	0	0	112.5	A52	A52-E54 PolarHBondContact O-N 2.89Å
55	T	78.6	Confident	81.4	Confident	58 Å²	58	60.4 Å²	60.4	36%	0.356	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-94.6	8.2	-179.2	65.6	0	0	0	0	113.2	F33 A52 T53	F33-T55 VanDerWaalsContact CD2-O 3.23Å; F33-T55 WeakPolarHBondContact CD2-O 3.3Å; F33-T55 WeakPolarHBondContact CE2-O 3.49Å; A52-T55 PolarHBondContact O-N 3.41Å; A52-T55 PolarHBondContact O-OG1 2.89Å; A52-T55 VanDerWaalsContact O-OG1 3.09Å; T53-T55 PolarHBondContact O-N 3.43Å
56	A	85	Confident	82	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.335	C	S	.	.			trans	-126.8	40.4	-172.1	0	0	0	0	0	113	F33 E39 T53 L59 L60 F92	F33-A56 HydrophobicContact CE1-CB 4.39Å; F33-A56 HydrophobicContact CE2-CB 3.86Å; F33-A56 HydrophobicContact CZ-CB 3.76Å; E39-A56 WeakPolarHBondContact OE1-CA 3.48Å; T53-A56 PolarHBondContact O-N 3.38Å; A56-L59 HydrophobicContact CB-CB 4.22Å; A56-L59 HydrophobicContact CB-CD2 4.4Å; A56-L59 WeakPolarHBondContact O-CB 3.41Å; A56-L59 PolarHBondContact O-N 3.41Å; A56-L60 WeakPolarHBondContact O-CG 3.49Å; A56-L60 PolarHBondContact O-N 2.98Å; A56-F92 HydrophobicContact CB-CE1 3.8Å
57	G	88.9	Confident	83.2	Confident	30 Å²	30	58.5 Å²	58.5	31%	0.309	32%	0.323	S	S	.	.	H	α-helix	trans	-58.9	-46.7	-178	0	0	0	0	0	115	E39 L59 L60 S61	E39-G57 VanDerWaalsContact CD-N 3.33Å; E39-G57 PolarHBondContact OE1-N 3.49Å; E39-G57 PolarHBondContact OE2-N 3.28Å; G57-L59 VanDerWaalsContact C-N 3.33Å; G57-L59 PolarHBondContact O-N 2.98Å; G57-L60 WeakPolarHBondContact O-CB 3.39Å; G57-L60 PolarHBondContact O-N 3.17Å; G57-S61 PolarHBondContact O-N 3.43Å
58	A	89.9	Confident	84.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.4	-36.4	176.3	0	0	0	0	0	112.2	D26 R29 E39 L60 S61 L62	D26-A58 HydrophobicContact CB-CB 4.25Å; R29-A58 HydrophobicContact CB-CB 3.44Å; R29-A58 VanDerWaalsContact CB-CB 3.44Å; R29-A58 HydrophobicContact CG-CB 4.41Å; E39-A58 HydrophobicContact CG-CB 4.49Å; E39-A58 WeakPolarHBondContact OE1-CA 3.21Å; E39-A58 WeakPolarHBondContact OE1-CB 3.36Å; E39-A58 PolarHBondContact OE1-N 3.06Å; E39-A58 PolarHBondContact OE2-N 3.32Å; A58-L60 VanDerWaalsContact C-N 3.33Å; A58-L60 PolarHBondContact O-N 2.8Å; A58-S61 WeakPolarHBondContact O-CB 3.33Å; A58-S61 PolarHBondContact O-N 3.42Å; A58-L62 VanDerWaalsContact O-CG 3.32Å; A58-L62 WeakPolarHBondContact O-CG 3.36Å; A58-L62 PolarHBondContact O-N 3.09Å
59	L	92.9	Very high	86.6	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-43	172.4	175.3	59.7	0	0	0	111.2	L30 A56 G57 L63 A71 F92 T93 L96	L30-L59 HydrophobicContact CD1-CB 4.16Å; L30-L59 HydrophobicContact CD1-CD1 4.19Å; A56-L59 HydrophobicContact CB-CB 4.22Å; A56-L59 HydrophobicContact CB-CD2 4.4Å; A56-L59 WeakPolarHBondContact O-CB 3.41Å; A56-L59 PolarHBondContact O-N 3.41Å; G57-L59 VanDerWaalsContact C-N 3.33Å; G57-L59 PolarHBondContact O-N 2.98Å; L59-L63 HydrophobicContact CD1-CD1 4.37Å; L59-L63 HydrophobicContact CD1-CG 4.43Å; L59-L63 HydrophobicContact CG-CD1 4.3Å; L59-L63 VanDerWaalsContact O-CG 3.27Å; L59-L63 WeakPolarHBondContact O-CG 3.4Å; L59-L63 PolarHBondContact O-N 3.28Å; L59-L63 VanDerWaalsContact O-N 3.07Å; L59-A71 HydrophobicContact CD1-CB 3.65Å; L59-F92 HydrophobicContact CD2-CD1 4.49Å; L59-F92 HydrophobicContact CD2-CE1 4.42Å; L59-T93 HydrophobicContact CD1-CG2 3.82Å; L59-T93 HydrophobicContact CD2-CG2 3.94Å; L59-L96 HydrophobicContact CD2-CB 4.47Å; L59-L96 HydrophobicContact CD2-CD2 3.48Å; L59-L96 VanDerWaalsContact CD2-CD2 3.48Å; L59-L96 HydrophobicContact CG-CD2 3.81Å
60	L	92.2	Very high	88.3	Confident	61 Å²	61	52.1 Å²	52.1	32%	0.319	28%	0.283	S	S	.	.	H	α-helix	trans	-64.9	-39.9	176.1	-67.6	170.3	0	0	0	111.8	A56 G57 A58 L63 Q64 L96	A56-L60 WeakPolarHBondContact O-CG 3.49Å; A56-L60 PolarHBondContact O-N 2.98Å; G57-L60 WeakPolarHBondContact O-CB 3.39Å; G57-L60 PolarHBondContact O-N 3.17Å; A58-L60 VanDerWaalsContact C-N 3.33Å; A58-L60 PolarHBondContact O-N 2.8Å; L60-L63 PolarHBondContact O-N 3.43Å; L60-Q64 WeakPolarHBondContact O-CG 3.42Å; L60-Q64 PolarHBondContact O-N 2.81Å; L60-L96 HydrophobicContact CD2-CD2 3.93Å
61	S	92.5	Very high	89.4	Confident	31 Å²	31	47.3 Å²	47.3	22%	0.217	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-52.8	174.2	-175.2	0	0	0	0	111.5	D26 G57 A58 L63 Q64 E65	D26-S61 WeakPolarHBondContact OD2-CB 3.4Å; D26-S61 PolarHBondContact OD2-OG 3.22Å; G57-S61 PolarHBondContact O-N 3.43Å; A58-S61 WeakPolarHBondContact O-CB 3.33Å; A58-S61 PolarHBondContact O-N 3.42Å; S61-L63 PolarHBondContact O-N 3.45Å; S61-Q64 WeakPolarHBondContact O-CB 3.45Å; S61-Q64 PolarHBondContact O-N 3.31Å; S61-E65 WeakPolarHBondContact O-CG 3.38Å; S61-E65 PolarHBondContact O-N 2.76Å
62	L	93.2	Very high	90.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-35.1	177	-70.7	171.2	0	0	0	112.8	D26 L30 A58 G66 R67 A71	D26-L62 HydrophobicContact CB-CD2 4.25Å; D26-L62 HydrophobicContact CB-CG 4.28Å; L30-L62 HydrophobicContact CB-CD1 4.15Å; L30-L62 HydrophobicContact CD2-CD1 3.69Å; L30-L62 HydrophobicContact CG-CD1 4.43Å; A58-L62 VanDerWaalsContact O-CG 3.32Å; A58-L62 WeakPolarHBondContact O-CG 3.36Å; A58-L62 PolarHBondContact O-N 3.09Å; L62-G66 PolarHBondContact O-N 3.45Å; L62-R67 HydrophobicContact CB-CB 4.41Å; L62-R67 HydrophobicContact CD2-CB 4.13Å; L62-R67 CarbonylContact O-C 3.58Å; L62-R67 WeakPolarHBondContact O-CA 3.43Å; L62-R67 WeakPolarHBondContact O-CB 3.37Å; L62-R67 PolarHBondContact O-N 3.48Å; L62-A71 HydrophobicContact CD1-CB 4.45Å
63	L	92.5	Very high	90.9	Very high	6 Å²	6	50 Å²	50	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-68.8	-40.8	175.3	-74.4	171.4	0	0	0	112.3	L59 L60 S61 E65 G66 L96 H100 T105	L59-L63 HydrophobicContact CD1-CD1 4.37Å; L59-L63 HydrophobicContact CD1-CG 4.43Å; L59-L63 HydrophobicContact CG-CD1 4.3Å; L59-L63 VanDerWaalsContact O-CG 3.27Å; L59-L63 WeakPolarHBondContact O-CG 3.4Å; L59-L63 PolarHBondContact O-N 3.28Å; L59-L63 VanDerWaalsContact O-N 3.07Å; L60-L63 PolarHBondContact O-N 3.43Å; S61-L63 PolarHBondContact O-N 3.45Å; L63-E65 VanDerWaalsContact C-N 3.3Å; L63-E65 PolarHBondContact O-N 2.87Å; L63-G66 PolarHBondContact O-N 3.47Å; L63-G66 VanDerWaalsContact O-N 3.16Å; L63-L96 HydrophobicContact CD1-CD2 3.66Å; L63-L96 HydrophobicContact CD1-CG 3.94Å; L63-H100 HydrophobicContact CD2-CB 4.27Å; L63-H100 PolarHBondContact O-CE1 3.03Å; L63-T105 HydrophobicContact CD2-CG2 3.7Å
64	Q	91.9	Very high	91.6	Very high	167 Å²	167	47.9 Å²	47.9	78%	0.78	26%	0.256	S	S	*	.	H	α-helix	trans	-64.4	-36.3	175.7	-71.1	173.7	8.4	0	0	111.8	L60 S61 G66	L60-Q64 WeakPolarHBondContact O-CG 3.42Å; L60-Q64 PolarHBondContact O-N 2.81Å; S61-Q64 WeakPolarHBondContact O-CB 3.45Å; S61-Q64 PolarHBondContact O-N 3.31Å; Q64-G66 PolarHBondContact O-N 2.99Å
65	E	92.8	Very high	92.3	Very high	107 Å²	107	39.2 Å²	39.2	50%	0.5	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-2.6	175.2	-66.2	-177.2	172.6	0	0	114.1	S61 L63 R67	S61-E65 WeakPolarHBondContact O-CG 3.38Å; S61-E65 PolarHBondContact O-N 2.76Å; L63-E65 VanDerWaalsContact C-N 3.3Å; L63-E65 PolarHBondContact O-N 2.87Å; E65-R67 VanDerWaalsContact C-N 3.3Å; E65-R67 HydrophobicContact CB-CG 4.22Å; E65-R67 PolarHBondContact O-N 3.33Å; E65-R67 VanDerWaalsContact OE2-CD 3.29Å; E65-R67 WeakPolarHBondContact OE2-CD 3.46Å; E65-R67 IonicContact OE2-CZ 3.72Å; E65-R67 IonicContact OE2-NH1 2.73Å; E65-R67 PolarHBondContact OE2-NH1 3.43Å
66	G	91.3	Very high	93.1	Very high	39 Å²	39	38.2 Å²	38.2	40%	0.402	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	20.1	-176.8	0	0	0	0	0	114.2	L62 L63 Q64	L62-G66 PolarHBondContact O-N 3.45Å; L63-G66 PolarHBondContact O-N 3.47Å; L63-G66 VanDerWaalsContact O-N 3.16Å; Q64-G66 PolarHBondContact O-N 2.99Å
67	R	93.8	Very high	93.5	Very high	92 Å²	92	42 Å²	42	35%	0.347	22%	0.22	S	C	.	.			trans	-100.1	19.7	-180	-64.6	170.5	61.6	-165.8	1	113.1	L62 E65 A69 E70 A71	L62-R67 HydrophobicContact CB-CB 4.41Å; L62-R67 HydrophobicContact CD2-CB 4.13Å; L62-R67 CarbonylContact O-C 3.58Å; L62-R67 WeakPolarHBondContact O-CA 3.43Å; L62-R67 WeakPolarHBondContact O-CB 3.37Å; L62-R67 PolarHBondContact O-N 3.48Å; E65-R67 VanDerWaalsContact C-N 3.3Å; E65-R67 HydrophobicContact CB-CG 4.22Å; E65-R67 PolarHBondContact O-N 3.33Å; E65-R67 VanDerWaalsContact OE2-CD 3.29Å; E65-R67 WeakPolarHBondContact OE2-CD 3.46Å; E65-R67 IonicContact OE2-CZ 3.72Å; E65-R67 IonicContact OE2-NH1 2.73Å; E65-R67 PolarHBondContact OE2-NH1 3.43Å; R67-A69 PolarHBondContact O-N 3.38Å; R67-A69 VanDerWaalsContact O-N 3.16Å; R67-E70 IonicContact CZ-OE2 2.73Å; R67-E70 VanDerWaalsContact CZ-OE2 3.31Å; R67-E70 IonicContact NE-OE2 2.73Å; R67-E70 PolarHBondContact NE-OE2 3.39Å; R67-E70 IonicContact NH2-OE1 2.74Å; R67-E70 PolarHBondContact NH2-OE1 2.94Å; R67-E70 IonicContact NH2-OE2 3.63Å; R67-E70 PolarHBondContact NH2-OE2 2.92Å; R67-E70 VanDerWaalsContact O-CB 3.29Å; R67-E70 WeakPolarHBondContact O-CB 3.48Å; R67-E70 PolarHBondContact O-N 3.41Å; R67-A71 PolarHBondContact O-N 2.84Å
68	G	93.8	Very high	93.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.2	-28.6	-177.7	0	0	0	0	0	114.8	E70 A71 V72 T105	G68-E70 VanDerWaalsContact C-N 3.31Å; G68-E70 PolarHBondContact O-N 2.88Å; G68-A71 PolarHBondContact O-N 3.28Å; G68-V72 WeakPolarHBondContact O-CG2 3.38Å; G68-V72 PolarHBondContact O-N 2.78Å; G68-V72 VanDerWaalsContact O-N 3.09Å; G68-T105 VanDerWaalsContact CA-OG1 3.3Å; G68-T105 WeakPolarHBondContact CA-OG1 3.16Å
69	A	94.7	Very high	93.7	Very high	47 Å²	47	42 Å²	42	39%	0.388	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-34.7	174.2	0	0	0	0	0	112.8	R67 V72 E73 T105 A108	R67-A69 PolarHBondContact O-N 3.38Å; R67-A69 VanDerWaalsContact O-N 3.16Å; A69-V72 PolarHBondContact O-N 3.34Å; A69-E73 PolarHBondContact O-N 2.77Å; A69-E73 VanDerWaalsContact O-N 3.17Å; A69-T105 PolarHBondContact N-OG1 2.9Å; A69-A108 HydrophobicContact CB-CB 4.25Å
70	E	95.3	Very high	93.4	Very high	58 Å²	58	45.5 Å²	45.5	27%	0.271	23%	0.234	S	C	.	.	H	α-helix	trans	-63.7	-44.3	173.3	-174.9	-177	173.3	0	0	110.2	K27 R67 G68 V72 E73 E74	K27-E70 IonicContact NZ-OE1 3.31Å; R67-E70 IonicContact CZ-OE2 2.73Å; R67-E70 VanDerWaalsContact CZ-OE2 3.31Å; R67-E70 IonicContact NE-OE2 2.73Å; R67-E70 PolarHBondContact NE-OE2 3.39Å; R67-E70 IonicContact NH2-OE1 2.74Å; R67-E70 PolarHBondContact NH2-OE1 2.94Å; R67-E70 IonicContact NH2-OE2 3.63Å; R67-E70 PolarHBondContact NH2-OE2 2.92Å; R67-E70 VanDerWaalsContact O-CB 3.29Å; R67-E70 WeakPolarHBondContact O-CB 3.48Å; R67-E70 PolarHBondContact O-N 3.41Å; G68-E70 VanDerWaalsContact C-N 3.31Å; G68-E70 PolarHBondContact O-N 2.88Å; E70-V72 VanDerWaalsContact C-N 3.31Å; E70-V72 PolarHBondContact O-N 2.87Å; E70-E73 PolarHBondContact O-N 3.27Å; E70-E73 VanDerWaalsContact O-N 3.16Å; E70-E74 PolarHBondContact O-N 3.31Å
71	A	96.1	Very high	92.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-37.3	179.2	0	0	0	0	0	113	L30 L59 L62 R67 G68 A75 T93	L30-A71 HydrophobicContact CD2-CB 3.69Å; L59-A71 HydrophobicContact CD1-CB 3.65Å; L62-A71 HydrophobicContact CD1-CB 4.45Å; R67-A71 PolarHBondContact O-N 2.84Å; G68-A71 PolarHBondContact O-N 3.28Å; A71-A75 WeakPolarHBondContact O-CB 3.3Å; A71-A75 PolarHBondContact O-N 3.02Å; A71-T93 HydrophobicContact CB-CG2 4.5Å
72	V	97	Very high	91.8	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-41.9	174.7	172.5	0	0	0	0	111.6	G68 A69 E70 A75 K76 L94 C97 A108 A109 A112	G68-V72 WeakPolarHBondContact O-CG2 3.38Å; G68-V72 PolarHBondContact O-N 2.78Å; G68-V72 VanDerWaalsContact O-N 3.09Å; A69-V72 PolarHBondContact O-N 3.34Å; E70-V72 VanDerWaalsContact C-N 3.31Å; E70-V72 PolarHBondContact O-N 2.87Å; V72-A75 PolarHBondContact O-N 2.86Å; V72-K76 WeakPolarHBondContact O-CB 3.43Å; V72-K76 PolarHBondContact O-N 3.45Å; V72-L94 HydrophobicContact CG1-CD1 4.14Å; V72-C97 HydrophobicContact CG2-CB 3.64Å; V72-A108 HydrophobicContact CB-CB 4.34Å; V72-A108 HydrophobicContact CG1-CB 4.25Å; V72-A108 HydrophobicContact CG2-CB 4.44Å; V72-A109 HydrophobicContact CG2-CB 3.93Å; V72-A112 HydrophobicContact CG1-CB 3.69Å
73	E	95.8	Very high	91.3	Very high	108 Å²	108	49.3 Å²	49.3	51%	0.505	27%	0.271	S	S	.	.	H	α-helix	trans	-66.6	-40.5	179.7	-169.8	57.8	-146	0	0	111.4	A69 E70 K76 R77	A69-E73 PolarHBondContact O-N 2.77Å; A69-E73 VanDerWaalsContact O-N 3.17Å; E70-E73 PolarHBondContact O-N 3.27Å; E70-E73 VanDerWaalsContact O-N 3.16Å; E73-K76 WeakPolarHBondContact O-CB 3.04Å; E73-K76 PolarHBondContact O-N 3.2Å; E73-R77 WeakPolarHBondContact O-CB 3.39Å; E73-R77 PolarHBondContact O-N 3.41Å
74	E	95.1	Very high	91	Very high	16 Å²	16	50.2 Å²	50.2	8%	0.075	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-43.1	173.2	-69.3	-62.2	164.1	0	0	111.6	K27 L30 L34 E70 K76 R77 F78	K27-E74 WeakPolarHBondContact CE-OE1 3.48Å; K27-E74 IonicContact NZ-OE1 2.78Å; K27-E74 PolarHBondContact NZ-OE1 3.36Å; L30-E74 HydrophobicContact CD2-CB 4.18Å; L34-E74 HydrophobicContact CD1-CB 3.73Å; E70-E74 PolarHBondContact O-N 3.31Å; E74-K76 VanDerWaalsContact C-N 3.29Å; E74-K76 PolarHBondContact O-N 3Å; E74-R77 WeakPolarHBondContact O-CB 3.42Å; E74-R77 PolarHBondContact O-N 3.41Å; E74-R77 VanDerWaalsContact O-N 3.15Å; E74-R77 IonicContact OE1-CZ 3.01Å; E74-R77 IonicContact OE1-NH2 3.38Å; E74-R77 IonicContact OE2-CZ 2.97Å; E74-R77 IonicContact OE2-NE 2.65Å; E74-R77 PolarHBondContact OE2-NE 3.22Å; E74-R77 IonicContact OE2-NH2 2.67Å; E74-R77 PolarHBondContact OE2-NH2 3.25Å; E74-F78 WeakPolarHBondContact O-CD2 3.49Å; E74-F78 PolarHBondContact O-N 3.01Å
75	A	95.1	Very high	90.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-40.8	175.8	0	0	0	0	0	112.2	L34 A71 V72 A79 A90 T93	L34-A75 HydrophobicContact CD1-CB 4.35Å; L34-A75 HydrophobicContact CD2-CB 3.8Å; A71-A75 WeakPolarHBondContact O-CB 3.3Å; A71-A75 PolarHBondContact O-N 3.02Å; V72-A75 PolarHBondContact O-N 2.86Å; A75-A79 WeakPolarHBondContact O-CB 3.4Å; A75-A79 PolarHBondContact O-N 3.29Å; A75-A90 HydrophobicContact CB-CB 4.36Å; A75-T93 HydrophobicContact CB-CG2 3.91Å
76	K	95	Very high	90.4	Very high	36 Å²	36	42.6 Å²	42.6	16%	0.157	24%	0.243	C	C	.	.	H	α-helix	trans	-62.5	-47.6	173.4	173.4	179.6	159.3	169.1	0	111.4	V72 E73 E74 F78 A79 Q80 E115 V116	V72-K76 WeakPolarHBondContact O-CB 3.43Å; V72-K76 PolarHBondContact O-N 3.45Å; E73-K76 WeakPolarHBondContact O-CB 3.04Å; E73-K76 PolarHBondContact O-N 3.2Å; E74-K76 VanDerWaalsContact C-N 3.29Å; E74-K76 PolarHBondContact O-N 3Å; K76-F78 VanDerWaalsContact C-N 3.32Å; K76-F78 PolarHBondContact O-N 3.43Å; K76-A79 PolarHBondContact O-N 3Å; K76-Q80 HydrophobicContact CG-CG 4.31Å; K76-Q80 WeakPolarHBondContact O-CB 3.26Å; K76-Q80 VanDerWaalsContact O-CG 3.31Å; K76-Q80 WeakPolarHBondContact O-CG 3.48Å; K76-Q80 PolarHBondContact O-N 3.31Å; K76-E115 VanDerWaalsContact CE-CD 3.43Å; K76-E115 WeakPolarHBondContact CE-OE1 3.4Å; K76-E115 WeakPolarHBondContact CE-OE2 3.36Å; K76-E115 IonicContact NZ-OE1 2.85Å; K76-E115 PolarHBondContact NZ-OE1 3.13Å; K76-E115 IonicContact NZ-OE2 3.39Å; K76-E115 PolarHBondContact NZ-OE2 2.78Å; K76-V116 HydrophobicContact CB-CG2 4.32Å
77	R	93.4	Very high	90.2	Very high	79 Å²	79	44.1 Å²	44.1	30%	0.298	25%	0.246	S	C	.	.	H	α-helix	trans	-56.7	-44.6	178.3	-171.6	175.5	71.7	138.6	5.3	111.9	E73 E74 G81	E73-R77 WeakPolarHBondContact O-CB 3.39Å; E73-R77 PolarHBondContact O-N 3.41Å; E74-R77 WeakPolarHBondContact O-CB 3.42Å; E74-R77 PolarHBondContact O-N 3.41Å; E74-R77 VanDerWaalsContact O-N 3.15Å; E74-R77 IonicContact OE1-CZ 3.01Å; E74-R77 IonicContact OE1-NH2 3.38Å; E74-R77 IonicContact OE2-CZ 2.97Å; E74-R77 IonicContact OE2-NE 2.65Å; E74-R77 PolarHBondContact OE2-NE 3.22Å; E74-R77 IonicContact OE2-NH2 2.67Å; E74-R77 PolarHBondContact OE2-NH2 3.25Å; R77-G81 PolarHBondContact O-N 3.47Å
78	F	92.1	Very high	90.1	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-68.5	-41.2	177.7	-89.9	-94.4	0	0	0	113.1	C31 L34 C35 E74 K76 Q80 R83 A84 I537	C31-F78 HydrophobicContact CB-CE2 3.93Å; C31-F78 HydrophobicContact CB-CZ 3.92Å; L34-F78 HydrophobicContact CB-CB 4.16Å; L34-F78 HydrophobicContact CB-CD1 4.13Å; L34-F78 HydrophobicContact CB-CD2 3.94Å; L34-F78 HydrophobicContact CB-CE2 4.38Å; L34-F78 HydrophobicContact CB-CG 3.8Å; L34-F78 HydrophobicContact CD1-CD2 4Å; C35-F78 HydrophobicContact CB-CD1 4.38Å; C35-F78 HydrophobicContact CB-CE1 3.73Å; E74-F78 WeakPolarHBondContact O-CD2 3.49Å; E74-F78 PolarHBondContact O-N 3.01Å; K76-F78 VanDerWaalsContact C-N 3.32Å; K76-F78 PolarHBondContact O-N 3.43Å; F78-Q80 VanDerWaalsContact C-N 3.33Å; F78-Q80 PolarHBondContact O-N 3.32Å; F78-R83 HydrophobicContact CD1-CB 3.79Å; F78-R83 HydrophobicContact CE1-CB 4.01Å; F78-R83 HydrophobicContact CG-CB 4.47Å; F78-A84 HydrophobicContact CB-CB 4.42Å; F78-A84 HydrophobicContact CD1-CB 4.28Å; F78-I537 HydrophobicContact CE1-CG2 4.21Å; F78-I537 HydrophobicContact CZ-CG2 3.9Å
79	A	90.6	Very high	90.1	Very high	29 Å²	29	40.6 Å²	40.6	24%	0.24	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-34.3	177.6	0	0	0	0	0	112.7	A75 K76 A90 V116	A75-A79 WeakPolarHBondContact O-CB 3.4Å; A75-A79 PolarHBondContact O-N 3.29Å; K76-A79 PolarHBondContact O-N 3Å; A79-A90 HydrophobicContact CB-CB 4.31Å; A79-V116 HydrophobicContact CB-CB 4.32Å; A79-V116 HydrophobicContact CB-CG1 4.01Å; A79-V116 HydrophobicContact CB-CG2 4.19Å
80	Q	87.5	Confident	90.1	Very high	75 Å²	75	38.4 Å²	38.4	35%	0.35	22%	0.219	S	C	.	.	H	α-helix	trans	-85.1	-37.7	-177	-65.5	-174.3	-31.6	0	0	113.9	K76 F78 G82 E115 R118	K76-Q80 HydrophobicContact CG-CG 4.31Å; K76-Q80 WeakPolarHBondContact O-CB 3.26Å; K76-Q80 VanDerWaalsContact O-CG 3.31Å; K76-Q80 WeakPolarHBondContact O-CG 3.48Å; K76-Q80 PolarHBondContact O-N 3.31Å; F78-Q80 VanDerWaalsContact C-N 3.33Å; F78-Q80 PolarHBondContact O-N 3.32Å; Q80-G82 VanDerWaalsContact C-N 3.34Å; Q80-G82 PolarHBondContact O-N 3.05Å; Q80-E115 PolarHBondContact NE2-OE2 2.97Å; Q80-R118 VanDerWaalsContact CA-NH2 3.31Å
81	G	77.6	Confident	90.1	Very high	43 Å²	43	35.9 Å²	35.9	44%	0.443	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	3.8	-170.2	0	0	0	0	0	116.1	R77 R83	R77-G81 PolarHBondContact O-N 3.47Å; G81-R83 PolarHBondContact O-N 3.25Å; G81-R83 VanDerWaalsContact O-N 3.17Å
82	G	74.1	Confident	90.1	Very high	61 Å²	61	36 Å²	36	63%	0.629	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.3	21.2	-174.6	0	0	0	0	0	113.4	Q80	Q80-G82 VanDerWaalsContact C-N 3.34Å; Q80-G82 PolarHBondContact O-N 3.05Å
83	R	81.8	Confident	90	Very high	69 Å²	69	35.9 Å²	35.9	26%	0.26	21%	0.207	S	C	.	.			trans	-85.4	-28.5	-174.8	-65.3	166.9	-175.2	-161.3	2	111.9	F78 G81 N531 L536	F78-R83 HydrophobicContact CD1-CB 3.79Å; F78-R83 HydrophobicContact CE1-CB 4.01Å; F78-R83 HydrophobicContact CG-CB 4.47Å; G81-R83 PolarHBondContact O-N 3.25Å; G81-R83 VanDerWaalsContact O-N 3.17Å; R83-N531 PolarHBondContact O-ND2 3.16Å; R83-L536 HydrophobicContact CG-CD1 4.4Å
84	A	86.9	Confident	90.1	Very high	24 Å²	24	30.8 Å²	30.8	20%	0.198	18%	0.183	C	C	.	.			trans	-76.4	136	178.3	0	0	0	0	0	111.1	L34 F78 R86	L34-A84 WeakPolarHBondContact O-CB 3.44Å; F78-A84 HydrophobicContact CB-CB 4.42Å; F78-A84 HydrophobicContact CD1-CB 4.28Å; A84-R86 VanDerWaalsContact C-N 3.27Å; A84-R86 WeakPolarHBondContact CB-O 3.18Å
85	V	87.4	Confident	90.1	Very high	35 Å²	35	30 Å²	30	21%	0.212	18%	0.18	C	C	.	.	S	Bend	trans	-65.1	-36.7	170.1	-178.8	0	0	0	0	110.2	C35 Y43 V528	C35-V85 WeakPolarHBondContact O-CB 3.28Å; C35-V85 PolarHBondContact O-N 2.96Å; Y43-V85 HydrophobicContact CE2-CG1 4.23Å; Y43-V85 HydrophobicContact CE2-CG2 4.31Å; V85-V528 HydrophobicContact CG2-CG2 3.7Å
86	R	83.8	Confident	90.1	Very high	79 Å²	79	30.1 Å²	30.1	30%	0.298	18%	0.181	S	C	.	.			trans	-137.6	145	-178.9	-56.7	-177	-176.9	174.9	3.3	110.4	A45 Q48 A84 G88 P89	A45-R86 PolarHBondContact O-NH2 3.24Å; Q48-R86 PolarHBondContact O-NH1 3.41Å; A84-R86 VanDerWaalsContact C-N 3.27Å; A84-R86 WeakPolarHBondContact CB-O 3.18Å; R86-G88 VanDerWaalsContact C-N 3.3Å; R86-G88 PolarHBondContact O-N 2.71Å; R86-P89 WeakPolarHBondContact O-CD 3.38Å
87	P	88.1	Confident	90.1	Very high	72 Å²	72	28.4 Å²	28.4	47%	0.468	17%	0.173	S	C	.	.	S	Bend	trans	-74.8	-19.2	178	29.3	-34.7	0	0	0	113.4	A90 L91	P87-A90 PolarHBondContact O-N 2.92Å; P87-L91 HydrophobicContact CB-CD1 4.28Å; P87-L91 WeakPolarHBondContact O-CG 3.41Å; P87-L91 PolarHBondContact O-N 2.94Å
88	G	91.1	Very high	90.2	Very high	14 Å²	14	24.9 Å²	24.9	14%	0.144	16%	0.161	C	C	.	.	H	α-helix	trans	-51.3	-50.7	-174.1	0	0	0	0	0	115.1	R86 A90 L91 F92	R86-G88 VanDerWaalsContact C-N 3.3Å; R86-G88 PolarHBondContact O-N 2.71Å; G88-A90 PolarHBondContact O-N 2.83Å; G88-L91 PolarHBondContact O-N 2.99Å; G88-F92 WeakPolarHBondContact O-CB 3.48Å; G88-F92 PolarHBondContact O-N 3.47Å
89	P	93.3	Very high	90.2	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.019	16%	0.164	C	C	.	.	H	α-helix	trans	-61	-39.3	-179.2	-26.8	36.1	0	0	0	114.5	F33 V51 R86 F92 T93	F33-P89 HydrophobicContact CD1-CB 4.11Å; F33-P89 HydrophobicContact CE1-CB 3.95Å; F33-P89 HydrophobicContact CZ-CB 4.31Å; F33-P89 WeakPolarHBondContact O-CB 3.4Å; F33-P89 VanDerWaalsContact O-CG 3.3Å; F33-P89 WeakPolarHBondContact O-CG 3.36Å; V51-P89 HydrophobicContact CG2-CG 4.03Å; R86-P89 WeakPolarHBondContact O-CD 3.38Å; P89-F92 PolarHBondContact O-N 3.5Å; P89-T93 WeakPolarHBondContact O-CB 3.12Å; P89-T93 PolarHBondContact O-N 3.29Å; P89-T93 PolarHBondContact O-OG1 3.5Å
90	A	94.9	Very high	90.2	Very high	2 Å²	2	25.9 Å²	25.9	2%	0.017	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-41	175.6	0	0	0	0	0	111.4	L34 A75 A79 P87 G88 T93 L94 V116	L34-A90 HydrophobicContact CD2-CB 4.29Å; A75-A90 HydrophobicContact CB-CB 4.36Å; A79-A90 HydrophobicContact CB-CB 4.31Å; P87-A90 PolarHBondContact O-N 2.92Å; G88-A90 PolarHBondContact O-N 2.83Å; A90-T93 PolarHBondContact O-N 3.42Å; A90-L94 WeakPolarHBondContact O-CB 3.39Å; A90-L94 PolarHBondContact O-N 3.38Å; A90-V116 HydrophobicContact CB-CG1 4.34Å
91	L	95.3	Very high	90.3	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-65.6	-40.6	176.3	-62.8	171.1	0	0	0	112.1	P87 G88 A95 V116 C117 H122 F126 Y129	P87-L91 HydrophobicContact CB-CD1 4.28Å; P87-L91 WeakPolarHBondContact O-CG 3.41Å; P87-L91 PolarHBondContact O-N 2.94Å; G88-L91 PolarHBondContact O-N 2.99Å; L91-A95 WeakPolarHBondContact O-CB 3.19Å; L91-A95 PolarHBondContact O-N 2.57Å; L91-V116 HydrophobicContact CD2-CG1 3.86Å; L91-C117 WeakPolarHBondContact CD2-SG 3.46Å; L91-H122 HydrophobicContact CD1-CB 4.15Å; L91-H122 HydrophobicContact CD2-CB 3.92Å; L91-F126 HydrophobicContact CD2-CB 4.5Å; L91-Y129 HydrophobicContact CB-CD2 4.12Å; L91-Y129 HydrophobicContact CB-CE2 4.02Å
92	F	95.4	Very high	91	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-64.1	-47	174.6	177.8	-91.3	0	0	0	111.4	F33 V51 T53 A56 L59 G88 P89 L94 A95 L96 Y129 L133	F33-F92 HydrophobicContact CE1-CD1 4.14Å; F33-F92 AromaticContact CZ-CD1 3.67Å; F33-F92 HydrophobicContact CZ-CD1 3.67Å; F33-F92 HydrophobicContact CZ-CE1 4.14Å; V51-F92 HydrophobicContact CB-CB 4.22Å; V51-F92 HydrophobicContact CB-CD2 4.35Å; V51-F92 HydrophobicContact CB-CG 4.21Å; V51-F92 HydrophobicContact CG1-CB 3.84Å; V51-F92 HydrophobicContact CG1-CD1 3.7Å; V51-F92 HydrophobicContact CG1-CD2 3.97Å; V51-F92 HydrophobicContact CG1-CE1 4.24Å; V51-F92 HydrophobicContact CG1-CE2 4.48Å; V51-F92 HydrophobicContact CG1-CG 3.54Å; T53-F92 HydrophobicContact CG2-CZ 3.9Å; A56-F92 HydrophobicContact CB-CE1 3.8Å; L59-F92 HydrophobicContact CD2-CD1 4.49Å; L59-F92 HydrophobicContact CD2-CE1 4.42Å; G88-F92 WeakPolarHBondContact O-CB 3.48Å; G88-F92 PolarHBondContact O-N 3.47Å; P89-F92 PolarHBondContact O-N 3.5Å; F92-L94 VanDerWaalsContact C-N 3.29Å; F92-L94 PolarHBondContact O-N 3.35Å; F92-A95 WeakPolarHBondContact O-CB 3.5Å; F92-A95 PolarHBondContact O-N 3.28Å; F92-A95 VanDerWaalsContact O-N 3.11Å; F92-L96 HydrophobicContact CE1-CD2 4.37Å; F92-L96 PolarHBondContact O-N 3.47Å; F92-Y129 HydrophobicContact CB-CD1 4.47Å; F92-Y129 HydrophobicContact CB-CD2 4.32Å; F92-Y129 HydrophobicContact CB-CE1 4.39Å; F92-Y129 HydrophobicContact CB-CE2 4.27Å; F92-Y129 HydrophobicContact CB-CG 4.43Å; F92-Y129 AromaticContact CD2-CD1 3.74Å; F92-Y129 HydrophobicContact CD2-CD1 3.74Å; F92-Y129 AromaticContact CD2-CE1 4Å; F92-Y129 HydrophobicContact CD2-CE1 4Å; F92-Y129 HydrophobicContact CD2-CG 4.22Å; F92-L133 HydrophobicContact CE2-CD1 4.27Å; F92-L133 HydrophobicContact CE2-CD2 3.95Å; F92-L133 HydrophobicContact CE2-CG 4.38Å; F92-L133 HydrophobicContact CZ-CD2 4.12Å
93	T	96	Very high	91.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-56	-46.8	177	-60	0	0	0	0	111	F33 L34 L59 A71 A75 P89 A90 A95 L96 C97	F33-T93 WeakPolarHBondContact CE1-OG1 3.43Å; L34-T93 HydrophobicContact CD2-CG2 4.46Å; L34-T93 WeakPolarHBondContact CD2-OG1 3.38Å; L59-T93 HydrophobicContact CD1-CG2 3.82Å; L59-T93 HydrophobicContact CD2-CG2 3.94Å; A71-T93 HydrophobicContact CB-CG2 4.5Å; A75-T93 HydrophobicContact CB-CG2 3.91Å; P89-T93 WeakPolarHBondContact O-CB 3.12Å; P89-T93 PolarHBondContact O-N 3.29Å; P89-T93 PolarHBondContact O-OG1 3.5Å; A90-T93 PolarHBondContact O-N 3.42Å; T93-A95 PolarHBondContact O-N 2.91Å; T93-L96 PolarHBondContact O-N 3.44Å; T93-C97 WeakPolarHBondContact O-CB 3.49Å; T93-C97 PolarHBondContact O-N 3.05Å; T93-C97 PolarHBondContact O-SG 3.48Å
94	L	96.7	Very high	92.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.2	-42.4	177.3	-161.6	74.5	0	0	0	112.2	V72 A90 F92 S98 A109 A112 L113 V116 F126	V72-L94 HydrophobicContact CG1-CD1 4.14Å; A90-L94 WeakPolarHBondContact O-CB 3.39Å; A90-L94 PolarHBondContact O-N 3.38Å; F92-L94 VanDerWaalsContact C-N 3.29Å; F92-L94 PolarHBondContact O-N 3.35Å; L94-S98 VanDerWaalsContact O-CB 3.24Å; L94-S98 WeakPolarHBondContact O-CB 3.36Å; L94-S98 PolarHBondContact O-N 2.95Å; L94-S98 PolarHBondContact O-OG 2.92Å; L94-A109 HydrophobicContact CD1-CB 3.98Å; L94-A109 VanDerWaalsContact CD1-O 3.27Å; L94-A109 WeakPolarHBondContact CD1-O 3.23Å; L94-A109 HydrophobicContact CG-CB 4.47Å; L94-A112 HydrophobicContact CD1-CB 4.08Å; L94-L113 HydrophobicContact CD2-CB 4.44Å; L94-L113 HydrophobicContact CD2-CD1 3.7Å; L94-V116 HydrophobicContact CD2-CB 4.17Å; L94-V116 HydrophobicContact CD2-CG1 4.35Å; L94-F126 HydrophobicContact CB-CD2 4.21Å; L94-F126 HydrophobicContact CB-CE2 4.12Å; L94-F126 HydrophobicContact CD2-CD2 3.98Å; L94-F126 HydrophobicContact CD2-CE2 3.83Å; L94-F126 HydrophobicContact CG-CD2 4.27Å; L94-F126 HydrophobicContact CG-CE2 3.86Å
95	A	95.6	Very high	93	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.6	-47.9	178	0	0	0	0	0	111.4	L91 F92 T93 S98 Q99 F126 K130 L133	L91-A95 WeakPolarHBondContact O-CB 3.19Å; L91-A95 PolarHBondContact O-N 2.57Å; F92-A95 WeakPolarHBondContact O-CB 3.5Å; F92-A95 PolarHBondContact O-N 3.28Å; F92-A95 VanDerWaalsContact O-N 3.11Å; T93-A95 PolarHBondContact O-N 2.91Å; A95-S98 PolarHBondContact O-N 3Å; A95-S98 PolarHBondContact O-OG 3.45Å; A95-Q99 PolarHBondContact O-N 3.19Å; A95-F126 HydrophobicContact CB-CD2 3.97Å; A95-F126 HydrophobicContact CB-CE2 4.18Å; A95-K130 HydrophobicContact CB-CG 3.73Å; A95-L133 HydrophobicContact CB-CD1 4.1Å
96	L	94.8	Very high	93.3	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.016	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-50.9	178	-169.2	72.2	0	0	0	111.7	T53 L59 L60 L63 F92 T93 S98 Q99 H100 L133 M137	T53-L96 HydrophobicContact CG2-CD1 4.49Å; L59-L96 HydrophobicContact CD2-CB 4.47Å; L59-L96 HydrophobicContact CD2-CD2 3.48Å; L59-L96 VanDerWaalsContact CD2-CD2 3.48Å; L59-L96 HydrophobicContact CG-CD2 3.81Å; L60-L96 HydrophobicContact CD2-CD2 3.93Å; L63-L96 HydrophobicContact CD1-CD2 3.66Å; L63-L96 HydrophobicContact CD1-CG 3.94Å; F92-L96 HydrophobicContact CE1-CD2 4.37Å; F92-L96 PolarHBondContact O-N 3.47Å; T93-L96 PolarHBondContact O-N 3.44Å; L96-S98 VanDerWaalsContact C-N 3.27Å; L96-S98 PolarHBondContact O-N 3.36Å; L96-Q99 PolarHBondContact O-N 2.93Å; L96-H100 PolarHBondContact O-N 3.37Å; L96-L133 HydrophobicContact CB-CD1 4.04Å; L96-L133 HydrophobicContact CD1-CD1 3.95Å; L96-L133 HydrophobicContact CD1-CD2 3.88Å; L96-L133 HydrophobicContact CD1-CG 4.5Å; L96-M137 HydrophobicContact CD1-CE 4.19Å; L96-M137 HydrophobicContact CD1-SD 3.72Å
97	C	95.6	Very high	93.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60	-37.1	179	-67.1	0	0	0	0	112.2	V72 T93 Q99 H100 T105 A109	V72-C97 HydrophobicContact CG2-CB 3.64Å; T93-C97 WeakPolarHBondContact O-CB 3.49Å; T93-C97 PolarHBondContact O-N 3.05Å; T93-C97 PolarHBondContact O-SG 3.48Å; C97-Q99 PolarHBondContact O-N 3.45Å; C97-H100 WeakPolarHBondContact O-CB 3.3Å; C97-H100 PolarHBondContact O-N 3.13Å; C97-T105 HydrophobicContact CB-CG2 3.78Å; C97-A109 HydrophobicContact CB-CB 3.86Å
98	S	95.2	Very high	94.3	Very high	5 Å²	5	34.4 Å²	34.4	4%	0.035	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9	178.8	70.4	0	0	0	0	114.6	L94 A95 L96 K130	L94-S98 VanDerWaalsContact O-CB 3.24Å; L94-S98 WeakPolarHBondContact O-CB 3.36Å; L94-S98 PolarHBondContact O-N 2.95Å; L94-S98 PolarHBondContact O-OG 2.92Å; A95-S98 PolarHBondContact O-N 3Å; A95-S98 PolarHBondContact O-OG 3.45Å; L96-S98 VanDerWaalsContact C-N 3.27Å; L96-S98 PolarHBondContact O-N 3.36Å; S98-K130 PolarHBondContact OG-NZ 3.38Å
99	Q	91.8	Very high	94.6	Very high	17 Å²	17	33.8 Å²	33.8	8%	0.079	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-2.4	172.6	-70.6	178.7	-60.6	0	0	113.2	A95 L96 C97 K130 L133 M137	A95-Q99 PolarHBondContact O-N 3.19Å; L96-Q99 PolarHBondContact O-N 2.93Å; C97-Q99 PolarHBondContact O-N 3.45Å; Q99-K130 PolarHBondContact NE2-O 2.67Å; Q99-K130 PolarHBondContact OE1-O 3.28Å; Q99-L133 VanDerWaalsContact OE1-CB 3.24Å; Q99-M137 VanDerWaalsContact C-CE 3.49Å; Q99-M137 HydrophobicContact CB-CE 3.68Å; Q99-M137 HydrophobicContact CB-SD 3.4Å; Q99-M137 WeakPolarHBondContact CB-SD 3.18Å; Q99-M137 HydrophobicContact CG-SD 4.41Å; Q99-M137 WeakPolarHBondContact O-CE 3.38Å
100	H	92.3	Very high	94.7	Very high	33 Å²	33	35.2 Å²	35.2	15%	0.153	18%	0.177	C	C	.	.	S	Bend	trans	-63.4	153.5	-179.3	-163.6	-111.2	0	0	0	112.4	L63 L96 C97 E102 T105 R106	L63-H100 HydrophobicContact CD2-CB 4.27Å; L63-H100 PolarHBondContact O-CE1 3.03Å; L96-H100 PolarHBondContact O-N 3.37Å; C97-H100 WeakPolarHBondContact O-CB 3.3Å; C97-H100 PolarHBondContact O-N 3.13Å; H100-E102 VanDerWaalsContact C-N 3.31Å; H100-E102 WeakPolarHBondContact ND1-CB 3.45Å; H100-E102 PolarHBondContact ND1-N 2.92Å; H100-E102 PolarHBondContact O-N 3.45Å; H100-T105 HydrophobicContact CB-CG2 4.17Å; H100-R106 WeakPolarHBondContact O-CD 2.95Å; H100-R106 WeakPolarHBondContact O-CG 3.44Å; H100-R106 PolarHBondContact O-NE 2.94Å; H100-R106 VanDerWaalsContact O-NE 3.13Å
101	S	89.4	Confident	94.8	Very high	97 Å²	97	43.5 Å²	43.5	68%	0.678	21%	0.212	S	C	*	.	S	Bend	trans	-65.9	-36.2	-179.5	54.8	0	0	0	0	112	R106	S101-R106 PolarHBondContact O-NH2 3.44Å
102	E	92.4	Very high	94.8	Very high	51 Å²	51	43.5 Å²	43.5	24%	0.238	21%	0.213	C	C	.	.			trans	-66.4	132.5	-177.5	-162.2	-162.2	169.9	0	0	112.7	H100 T105 R106	H100-E102 VanDerWaalsContact C-N 3.31Å; H100-E102 WeakPolarHBondContact ND1-CB 3.45Å; H100-E102 PolarHBondContact ND1-N 2.92Å; H100-E102 PolarHBondContact O-N 3.45Å; E102-T105 PolarHBondContact OE2-OG1 3.02Å; E102-R106 WeakPolarHBondContact O-CG 3.23Å; E102-R106 PolarHBondContact O-N 3.44Å; E102-R106 PolarHBondContact O-NE 3.13Å
103	L	92.8	Very high	94.8	Very high	104 Å²	104	43.4 Å²	43.4	55%	0.545	21%	0.213	S	C	.	.	H	α-helix	trans	-69.4	-43.8	-177.2	-178	61.6	0	0	0	113	R106 Q107	L103-R106 PolarHBondContact O-N 3.38Å; L103-Q107 HydrophobicContact CD1-CG 4.08Å; L103-Q107 HydrophobicContact CG-CG 4.34Å; L103-Q107 WeakPolarHBondContact O-CG 3.16Å; L103-Q107 PolarHBondContact O-N 3.21Å
104	K	95.4	Very high	94.7	Very high	153 Å²	153	48.2 Å²	48.2	67%	0.665	23%	0.231	S	C	*	.	H	α-helix	trans	-60.2	-49	-177.5	-69	-178.6	179.2	177.3	0	111.2	R106 Q107 A108	K104-R106 PolarHBondContact O-N 2.84Å; K104-Q107 PolarHBondContact O-N 2.8Å; K104-A108 WeakPolarHBondContact O-CB 3.17Å; K104-A108 PolarHBondContact O-N 3.41Å
105	T	95.8	Very high	94.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.8	-45.8	176.4	-66.3	0	0	0	0	112.2	L63 G68 A69 C97 H100 E102 Q107 A108 A109	L63-T105 HydrophobicContact CD2-CG2 3.7Å; G68-T105 VanDerWaalsContact CA-OG1 3.3Å; G68-T105 WeakPolarHBondContact CA-OG1 3.16Å; A69-T105 PolarHBondContact N-OG1 2.9Å; C97-T105 HydrophobicContact CB-CG2 3.78Å; H100-T105 HydrophobicContact CB-CG2 4.17Å; E102-T105 PolarHBondContact OE2-OG1 3.02Å; T105-Q107 PolarHBondContact O-N 2.91Å; T105-A108 PolarHBondContact O-N 2.76Å; T105-A109 WeakPolarHBondContact O-CB 3.36Å; T105-A109 PolarHBondContact O-N 3.2Å
106	R	94.8	Very high	94.4	Very high	92 Å²	92	51.5 Å²	51.5	35%	0.347	25%	0.247	S	C	.	.	H	α-helix	trans	-61.5	-44.9	176.3	-77.4	-173.7	-71.6	-179.3	0.4	112.9	H100 S101 E102 L103 K104 A109 F110	H100-R106 WeakPolarHBondContact O-CD 2.95Å; H100-R106 WeakPolarHBondContact O-CG 3.44Å; H100-R106 PolarHBondContact O-NE 2.94Å; H100-R106 VanDerWaalsContact O-NE 3.13Å; S101-R106 PolarHBondContact O-NH2 3.44Å; E102-R106 WeakPolarHBondContact O-CG 3.23Å; E102-R106 PolarHBondContact O-N 3.44Å; E102-R106 PolarHBondContact O-NE 3.13Å; L103-R106 PolarHBondContact O-N 3.38Å; K104-R106 PolarHBondContact O-N 2.84Å; R106-A109 PolarHBondContact O-N 3.33Å; R106-F110 WeakPolarHBondContact O-CD2 3.46Å; R106-F110 PolarHBondContact O-N 3.33Å
107	Q	95.1	Very high	94.5	Very high	115 Å²	115	51.4 Å²	51.4	54%	0.537	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-43.2	179.2	-74.4	176.5	-17.7	0	0	111.4	L103 K104 T105 A109 F110 K111	L103-Q107 HydrophobicContact CD1-CG 4.08Å; L103-Q107 HydrophobicContact CG-CG 4.34Å; L103-Q107 WeakPolarHBondContact O-CG 3.16Å; L103-Q107 PolarHBondContact O-N 3.21Å; K104-Q107 PolarHBondContact O-N 2.8Å; T105-Q107 PolarHBondContact O-N 2.91Å; Q107-A109 PolarHBondContact O-N 3.48Å; Q107-F110 PolarHBondContact O-N 3.05Å; Q107-K111 WeakPolarHBondContact O-CB 3.33Å; Q107-K111 PolarHBondContact O-N 3.24Å
108	A	96.7	Very high	94.2	Very high	26 Å²	26	58.1 Å²	58.1	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-58.2	-48.2	174.6	0	0	0	0	0	111.1	A69 V72 K104 T105 F110 K111 A112	A69-A108 HydrophobicContact CB-CB 4.25Å; V72-A108 HydrophobicContact CB-CB 4.34Å; V72-A108 HydrophobicContact CG1-CB 4.25Å; V72-A108 HydrophobicContact CG2-CB 4.44Å; K104-A108 WeakPolarHBondContact O-CB 3.17Å; K104-A108 PolarHBondContact O-N 3.41Å; T105-A108 PolarHBondContact O-N 2.76Å; A108-F110 PolarHBondContact O-N 3.24Å; A108-K111 PolarHBondContact O-N 3.49Å; A108-A112 PolarHBondContact O-N 3.06Å
109	A	97.1	Very high	94	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.9	-44.1	-179.7	0	0	0	0	0	112.7	V72 L94 C97 T105 R106 Q107 A112 L113	V72-A109 HydrophobicContact CG2-CB 3.93Å; L94-A109 HydrophobicContact CD1-CB 3.98Å; L94-A109 VanDerWaalsContact CD1-O 3.27Å; L94-A109 WeakPolarHBondContact CD1-O 3.23Å; L94-A109 HydrophobicContact CG-CB 4.47Å; C97-A109 HydrophobicContact CB-CB 3.86Å; T105-A109 WeakPolarHBondContact O-CB 3.36Å; T105-A109 PolarHBondContact O-N 3.2Å; R106-A109 PolarHBondContact O-N 3.33Å; Q107-A109 PolarHBondContact O-N 3.48Å; A109-A112 PolarHBondContact O-N 3.4Å; A109-L113 PolarHBondContact O-N 2.97Å
110	F	96.3	Very high	94.1	Very high	33 Å²	33	59 Å²	59	15%	0.145	28%	0.276	C	S	.	.	H	α-helix	trans	-69.2	-33.6	177.4	-72	-59.4	0	0	0	113	R106 Q107 A108 A112 L113 A145 L146 A149	R106-F110 WeakPolarHBondContact O-CD2 3.46Å; R106-F110 PolarHBondContact O-N 3.33Å; Q107-F110 PolarHBondContact O-N 3.05Å; A108-F110 PolarHBondContact O-N 3.24Å; F110-A112 VanDerWaalsContact C-N 3.34Å; F110-L113 VanDerWaalsContact O-CB 3.26Å; F110-L113 WeakPolarHBondContact O-CB 3.35Å; F110-L113 PolarHBondContact O-N 2.76Å; F110-A145 HydrophobicContact CD2-CB 3.81Å; F110-A145 HydrophobicContact CE2-CB 3.49Å; F110-A145 VanDerWaalsContact CE2-CB 3.49Å; F110-A145 HydrophobicContact CZ-CB 4.03Å; F110-L146 HydrophobicContact CE1-CB 4.07Å; F110-L146 HydrophobicContact CE1-CD1 3.94Å; F110-L146 HydrophobicContact CZ-CB 4.17Å; F110-A149 HydrophobicContact CB-CB 4.15Å; F110-A149 HydrophobicContact CD1-CB 3.48Å; F110-A149 VanDerWaalsContact CD1-CB 3.48Å; F110-A149 HydrophobicContact CE1-CB 4.24Å; F110-A149 HydrophobicContact CG-CB 4.12Å
111	K	95.5	Very high	94.2	Very high	177 Å²	177	58.5 Å²	58.5	77%	0.77	28%	0.278	S	S	*	.	H	α-helix	trans	-65.3	-37.9	175.4	-171.8	-179.7	178.4	-174.7	0	111.9	Q107 A108 L113	Q107-K111 WeakPolarHBondContact O-CB 3.33Å; Q107-K111 PolarHBondContact O-N 3.24Å; A108-K111 PolarHBondContact O-N 3.49Å; K111-L113 VanDerWaalsContact C-N 3.27Å; K111-L113 PolarHBondContact O-N 3.46Å
112	A	96.1	Very high	94.5	Very high	4 Å²	4	56.3 Å²	56.3	3%	0.033	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-5.5	178.3	0	0	0	0	0	114	V72 L94 A108 A109 F110 R114 E115 V116	V72-A112 HydrophobicContact CG1-CB 3.69Å; L94-A112 HydrophobicContact CD1-CB 4.08Å; A108-A112 PolarHBondContact O-N 3.06Å; A109-A112 PolarHBondContact O-N 3.4Å; F110-A112 VanDerWaalsContact C-N 3.34Å; A112-R114 PolarHBondContact O-N 3.16Å; A112-E115 PolarHBondContact O-N 2.52Å; A112-E115 VanDerWaalsContact O-N 3.16Å; A112-V116 HydrophobicContact CB-CG2 4.48Å; A112-V116 WeakPolarHBondContact O-CG2 3.26Å; A112-V116 PolarHBondContact O-N 3.01Å
113	L	95.7	Very high	94.7	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-56.1	-50.4	-171.6	-178.1	67.4	0	0	0	113.4	L94 A109 F110 K111 E115 V116 C117 L123 F126 A149	L94-L113 HydrophobicContact CD2-CB 4.44Å; L94-L113 HydrophobicContact CD2-CD1 3.7Å; A109-L113 PolarHBondContact O-N 2.97Å; F110-L113 VanDerWaalsContact O-CB 3.26Å; F110-L113 WeakPolarHBondContact O-CB 3.35Å; F110-L113 PolarHBondContact O-N 2.76Å; K111-L113 VanDerWaalsContact C-N 3.27Å; K111-L113 PolarHBondContact O-N 3.46Å; L113-E115 VanDerWaalsContact C-N 3.27Å; L113-E115 PolarHBondContact O-N 2.69Å; L113-V116 PolarHBondContact O-N 3.16Å; L113-C117 HydrophobicContact CD1-CB 4.36Å; L113-C117 WeakPolarHBondContact O-CA 3.48Å; L113-C117 VanDerWaalsContact O-CB 3.22Å; L113-C117 WeakPolarHBondContact O-CB 2.93Å; L113-C117 PolarHBondContact O-N 2.77Å; L113-L123 HydrophobicContact CD2-CD1 4.45Å; L113-F126 HydrophobicContact CD1-CD1 3.63Å; L113-F126 HydrophobicContact CD1-CD2 4.17Å; L113-F126 HydrophobicContact CD1-CE1 3.47Å; L113-F126 VanDerWaalsContact CD1-CE1 3.47Å; L113-F126 HydrophobicContact CD1-CE2 4.01Å; L113-F126 HydrophobicContact CD1-CG 3.97Å; L113-F126 HydrophobicContact CD1-CZ 3.64Å; L113-F126 HydrophobicContact CD2-CE1 4.36Å; L113-A149 HydrophobicContact CD2-CB 3.68Å
114	R	93.5	Very high	94.9	Very high	101 Å²	101	49 Å²	49	38%	0.381	22%	0.22	S	C	.	.	H	α-helix	trans	-65	-35	-178.7	-176.3	-179.8	174.6	-170.4	1.5	112.3	A112 E156	A112-R114 PolarHBondContact O-N 3.16Å; R114-E156 WeakPolarHBondContact CD-OE2 3.43Å; R114-E156 VanDerWaalsContact CZ-O 3.26Å; R114-E156 IonicContact CZ-OE2 2.68Å; R114-E156 VanDerWaalsContact NH1-CB 3.26Å; R114-E156 PolarHBondContact NH1-O 2.93Å; R114-E156 IonicContact NH1-OE2 3.81Å; R114-E156 PolarHBondContact NH1-OE2 2.96Å; R114-E156 PolarHBondContact NH2-O 3.19Å
115	E	92.7	Very high	94.9	Very high	63 Å²	63	42.6 Å²	42.6	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-72.2	-35.3	-176.9	-65.2	-171.3	-95.5	0	0	112.4	K76 Q80 A112 L113 R118	K76-E115 VanDerWaalsContact CE-CD 3.43Å; K76-E115 WeakPolarHBondContact CE-OE1 3.4Å; K76-E115 WeakPolarHBondContact CE-OE2 3.36Å; K76-E115 IonicContact NZ-OE1 2.85Å; K76-E115 PolarHBondContact NZ-OE1 3.13Å; K76-E115 IonicContact NZ-OE2 3.39Å; K76-E115 PolarHBondContact NZ-OE2 2.78Å; Q80-E115 PolarHBondContact NE2-OE2 2.97Å; A112-E115 PolarHBondContact O-N 2.52Å; A112-E115 VanDerWaalsContact O-N 3.16Å; L113-E115 VanDerWaalsContact C-N 3.27Å; L113-E115 PolarHBondContact O-N 2.69Å; E115-R118 PolarHBondContact O-NE 3Å
116	V	94.3	Very high	94.9	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.036	20%	0.195	C	C	.	.	H	α-helix	trans	-85.1	-47.9	176.7	178.9	0	0	0	0	111	K76 A79 A90 L91 L94 A112 L113 R118	K76-V116 HydrophobicContact CB-CG2 4.32Å; A79-V116 HydrophobicContact CB-CB 4.32Å; A79-V116 HydrophobicContact CB-CG1 4.01Å; A79-V116 HydrophobicContact CB-CG2 4.19Å; A90-V116 HydrophobicContact CB-CG1 4.34Å; L91-V116 HydrophobicContact CD2-CG1 3.86Å; L94-V116 HydrophobicContact CD2-CB 4.17Å; L94-V116 HydrophobicContact CD2-CG1 4.35Å; A112-V116 HydrophobicContact CB-CG2 4.48Å; A112-V116 WeakPolarHBondContact O-CG2 3.26Å; A112-V116 PolarHBondContact O-N 3.01Å; L113-V116 PolarHBondContact O-N 3.16Å; V116-R118 PolarHBondContact O-N 3.37Å; V116-R118 VanDerWaalsContact O-N 3.13Å
117	C	95.1	Very high	94.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.178	C	C	.	.			trans	-88.2	72	-178.9	-60.8	0	0	0	0	111.9	L91 L113 H122 L123 W153	L91-C117 WeakPolarHBondContact CD2-SG 3.46Å; L113-C117 HydrophobicContact CD1-CB 4.36Å; L113-C117 WeakPolarHBondContact O-CA 3.48Å; L113-C117 VanDerWaalsContact O-CB 3.22Å; L113-C117 WeakPolarHBondContact O-CB 2.93Å; L113-C117 PolarHBondContact O-N 2.77Å; C117-H122 HydrophobicContact CB-CB 4.03Å; C117-L123 HydrophobicContact CB-CB 4.42Å; C117-W153 PolarHBondContact O-NE1 2.92Å
118	R	90.4	Very high	95	Very high	141 Å²	141	34 Å²	34	53%	0.532	16%	0.159	S	C	.	.			trans	-72.6	-22.9	-177.3	-62.9	176	175.4	-176.4	-14.2	116	Q80 E115 V116	Q80-R118 VanDerWaalsContact CA-NH2 3.31Å; E115-R118 PolarHBondContact O-NE 3Å; V116-R118 PolarHBondContact O-N 3.37Å; V116-R118 VanDerWaalsContact O-N 3.13Å
119	D	90.7	Very high	94.9	Very high	38 Å²	38	33.6 Å²	33.6	20%	0.203	15%	0.151	C	C	.	.	S	Bend	trans	-126.8	150.2	-176.2	-177.4	-71.2	0	0	0	109.8	A121 H122 L123 R168	D119-A121 PolarHBondContact O-N 3.47Å; D119-A121 VanDerWaalsContact O-N 3.15Å; D119-A121 WeakPolarHBondContact OD1-CB 3.29Å; D119-A121 PolarHBondContact OD1-N 3.17Å; D119-H122 WeakPolarHBondContact O-CB 3.42Å; D119-H122 PolarHBondContact O-N 3.09Å; D119-L123 PolarHBondContact O-N 2.86Å; D119-R168 IonicContact OD2-CZ 3.97Å; D119-R168 IonicContact OD2-NE 3.89Å; D119-R168 IonicContact OD2-NH2 2.8Å; D119-R168 PolarHBondContact OD2-NH2 3.41Å
120	P	94.8	Very high	94.7	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.013	15%	0.152	C	C	.	.	H	α-helix	trans	-41.5	-44.2	170.3	-32.9	34.6	0	0	0	115.3	H122 L123 F124 W153 A165 C169	P120-H122 VanDerWaalsContact C-N 3.28Å; P120-H122 PolarHBondContact O-N 3.36Å; P120-L123 PolarHBondContact O-N 3.12Å; P120-L123 VanDerWaalsContact O-N 3.12Å; P120-F124 HydrophobicContact CB-CD2 4.36Å; P120-F124 HydrophobicContact CB-CE2 3.82Å; P120-F124 HydrophobicContact CB-CZ 4.31Å; P120-F124 WeakPolarHBondContact O-CD2 3.47Å; P120-F124 VanDerWaalsContact O-CG 3.24Å; P120-F124 WeakPolarHBondContact O-CG 3.45Å; P120-F124 PolarHBondContact O-N 3.45Å; P120-W153 HydrophobicContact CG-CH2 4.14Å; P120-A165 HydrophobicContact CG-CB 3.78Å; P120-C169 HydrophobicContact CB-CB 3.93Å; P120-C169 HydrophobicContact CG-CB 4.3Å
121	A	93.6	Very high	94.6	Very high	23 Å²	23	37.3 Å²	37.3	19%	0.19	17%	0.168	C	C	.	.	H	α-helix	trans	-60	-38	179.7	0	0	0	0	0	112.2	D119 S125 R172	D119-A121 PolarHBondContact O-N 3.47Å; D119-A121 VanDerWaalsContact O-N 3.15Å; D119-A121 WeakPolarHBondContact OD1-CB 3.29Å; D119-A121 PolarHBondContact OD1-N 3.17Å; A121-S125 WeakPolarHBondContact O-CB 3.4Å; A121-S125 PolarHBondContact O-N 2.94Å; A121-S125 PolarHBondContact O-OG 3.33Å; A121-S125 VanDerWaalsContact O-OG 3.14Å; A121-R172 HydrophobicContact CB-CG 4.3Å
122	H	94.9	Very high	94.4	Very high	52 Å²	52	32.6 Å²	32.6	24%	0.241	15%	0.148	C	C	.	.	H	α-helix	trans	-67.3	-42.3	175.6	-60.7	161.9	0	0	0	111.7	L91 C117 D119 P120 S125 F126	L91-H122 HydrophobicContact CD1-CB 4.15Å; L91-H122 HydrophobicContact CD2-CB 3.92Å; C117-H122 HydrophobicContact CB-CB 4.03Å; D119-H122 WeakPolarHBondContact O-CB 3.42Å; D119-H122 PolarHBondContact O-N 3.09Å; P120-H122 VanDerWaalsContact C-N 3.28Å; P120-H122 PolarHBondContact O-N 3.36Å; H122-S125 PolarHBondContact O-N 3.33Å; H122-F126 WeakPolarHBondContact O-CB 3.24Å; H122-F126 PolarHBondContact O-N 2.79Å
123	L	96.4	Very high	94.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-44.3	177.2	-177.7	65.7	0	0	0	111.1	L113 C117 D119 P120 F126 V127 W153 L180	L113-L123 HydrophobicContact CD2-CD1 4.45Å; C117-L123 HydrophobicContact CB-CB 4.42Å; D119-L123 PolarHBondContact O-N 2.86Å; P120-L123 PolarHBondContact O-N 3.12Å; P120-L123 VanDerWaalsContact O-N 3.12Å; L123-F126 HydrophobicContact CD1-CD1 4.46Å; L123-F126 PolarHBondContact O-N 3.16Å; L123-V127 WeakPolarHBondContact O-CG2 3.43Å; L123-V127 PolarHBondContact O-N 3.16Å; L123-W153 HydrophobicContact CD1-CG 4.46Å; L123-W153 HydrophobicContact CD2-CD2 3.65Å; L123-W153 HydrophobicContact CD2-CE3 3.63Å; L123-W153 HydrophobicContact CD2-CG 4.14Å; L123-W153 HydrophobicContact CD2-CH2 4.38Å; L123-W153 HydrophobicContact CD2-CZ2 4.39Å; L123-W153 HydrophobicContact CD2-CZ3 4.02Å; L123-L180 HydrophobicContact CD2-CD1 3.51Å; L123-L180 HydrophobicContact CG-CD1 3.72Å
124	F	97.3	Very high	93.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.2	-45.7	175.4	-62.7	-38.3	0	0	0	111.8	P120 F126 V127 Q128 R172 W175 S176 H177 L180	P120-F124 HydrophobicContact CB-CD2 4.36Å; P120-F124 HydrophobicContact CB-CE2 3.82Å; P120-F124 HydrophobicContact CB-CZ 4.31Å; P120-F124 WeakPolarHBondContact O-CD2 3.47Å; P120-F124 VanDerWaalsContact O-CG 3.24Å; P120-F124 WeakPolarHBondContact O-CG 3.45Å; P120-F124 PolarHBondContact O-N 3.45Å; F124-F126 PolarHBondContact O-N 3.43Å; F124-V127 PolarHBondContact O-N 2.96Å; F124-Q128 WeakPolarHBondContact O-CB 3.47Å; F124-Q128 PolarHBondContact O-N 3.33Å; F124-R172 HydrophobicContact CB-CB 4.3Å; F124-R172 HydrophobicContact CD2-CB 3.66Å; F124-R172 HydrophobicContact CE2-CB 4.5Å; F124-R172 HydrophobicContact CG-CB 4.4Å; F124-W175 HydrophobicContact CB-CB 4.08Å; F124-W175 HydrophobicContact CD1-CB 3.59Å; F124-W175 HydrophobicContact CE1-CB 4.32Å; F124-W175 HydrophobicContact CG-CB 4.01Å; F124-S176 VanDerWaalsContact CE1-C 3.48Å; F124-H177 AromaticContact CZ-CD2 3.78Å; F124-H177 AromaticContact CZ-CE1 3.7Å; F124-H177 AromaticContact CZ-CG 3.81Å; F124-H177 AromaticContact CZ-ND1 3.75Å; F124-H177 AromaticContact CZ-NE2 3.72Å; F124-L180 HydrophobicContact CD1-CD1 3.66Å; F124-L180 HydrophobicContact CD1-CG 4.19Å; F124-L180 HydrophobicContact CE1-CD1 3.61Å; F124-L180 HydrophobicContact CE1-CG 4.01Å
125	S	95.3	Very high	93.3	Very high	20 Å²	20	41 Å²	41	14%	0.14	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-42.4	175.6	-70.2	0	0	0	0	112.5	A121 H122 Q128 Y129	A121-S125 WeakPolarHBondContact O-CB 3.4Å; A121-S125 PolarHBondContact O-N 2.94Å; A121-S125 PolarHBondContact O-OG 3.33Å; A121-S125 VanDerWaalsContact O-OG 3.14Å; H122-S125 PolarHBondContact O-N 3.33Å; S125-Q128 PolarHBondContact O-N 3.41Å; S125-Y129 WeakPolarHBondContact O-CD2 3.48Å; S125-Y129 PolarHBondContact O-N 3.25Å
126	F	96.2	Very high	92.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-47.9	174.8	165.7	-101.1	0	0	0	112.1	L91 L94 A95 L113 H122 L123 F124 Q128 Y129 K130 L146	L91-F126 HydrophobicContact CD2-CB 4.5Å; L94-F126 HydrophobicContact CB-CD2 4.21Å; L94-F126 HydrophobicContact CB-CE2 4.12Å; L94-F126 HydrophobicContact CD2-CD2 3.98Å; L94-F126 HydrophobicContact CD2-CE2 3.83Å; L94-F126 HydrophobicContact CG-CD2 4.27Å; L94-F126 HydrophobicContact CG-CE2 3.86Å; A95-F126 HydrophobicContact CB-CD2 3.97Å; A95-F126 HydrophobicContact CB-CE2 4.18Å; L113-F126 HydrophobicContact CD1-CD1 3.63Å; L113-F126 HydrophobicContact CD1-CD2 4.17Å; L113-F126 HydrophobicContact CD1-CE1 3.47Å; L113-F126 VanDerWaalsContact CD1-CE1 3.47Å; L113-F126 HydrophobicContact CD1-CE2 4.01Å; L113-F126 HydrophobicContact CD1-CG 3.97Å; L113-F126 HydrophobicContact CD1-CZ 3.64Å; L113-F126 HydrophobicContact CD2-CE1 4.36Å; H122-F126 WeakPolarHBondContact O-CB 3.24Å; H122-F126 PolarHBondContact O-N 2.79Å; L123-F126 HydrophobicContact CD1-CD1 4.46Å; L123-F126 PolarHBondContact O-N 3.16Å; F124-F126 PolarHBondContact O-N 3.43Å; F126-Q128 VanDerWaalsContact C-N 3.32Å; F126-Q128 PolarHBondContact O-N 3.32Å; F126-Y129 PolarHBondContact O-N 3.1Å; F126-K130 HydrophobicContact CD1-CD 4.18Å; F126-K130 HydrophobicContact CE1-CD 3.57Å; F126-K130 HydrophobicContact CE2-CD 4.01Å; F126-K130 HydrophobicContact CE2-CG 4.38Å; F126-K130 HydrophobicContact CZ-CD 3.5Å; F126-K130 HydrophobicContact CZ-CG 4.35Å; F126-K130 WeakPolarHBondContact O-CG 3.22Å; F126-K130 PolarHBondContact O-N 2.7Å; F126-L146 HydrophobicContact CE1-CD1 3.86Å; F126-L146 HydrophobicContact CZ-CD1 4.49Å
127	V	96.3	Very high	92.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-38.6	178.4	176.8	0	0	0	0	111.1	L123 F124 K130 K131 W142 W175 L180	L123-V127 WeakPolarHBondContact O-CG2 3.43Å; L123-V127 PolarHBondContact O-N 3.16Å; F124-V127 PolarHBondContact O-N 2.96Å; V127-K130 PolarHBondContact O-N 3.31Å; V127-K131 PolarHBondContact O-N 3.03Å; V127-W142 HydrophobicContact CG1-CZ2 4.25Å; V127-W175 HydrophobicContact CG1-CD2 3.95Å; V127-W175 HydrophobicContact CG1-CE3 4.06Å; V127-W175 HydrophobicContact CG1-CH2 3.73Å; V127-W175 HydrophobicContact CG1-CZ2 3.6Å; V127-W175 HydrophobicContact CG1-CZ3 3.96Å; V127-L180 HydrophobicContact CB-CD2 4.26Å; V127-L180 HydrophobicContact CG1-CD2 3.99Å; V127-L180 HydrophobicContact CG2-CD1 4.5Å; V127-L180 HydrophobicContact CG2-CD2 3.88Å
128	Q	95.4	Very high	91.8	Very high	27 Å²	27	53.2 Å²	53.2	13%	0.126	26%	0.263	C	S	.	.	H	α-helix	trans	-64.2	-43.4	175.5	-178.1	59	19.5	0	0	111.9	F124 S125 F126 K130 K131 E132 E173	F124-Q128 WeakPolarHBondContact O-CB 3.47Å; F124-Q128 PolarHBondContact O-N 3.33Å; S125-Q128 PolarHBondContact O-N 3.41Å; F126-Q128 VanDerWaalsContact C-N 3.32Å; F126-Q128 PolarHBondContact O-N 3.32Å; Q128-K130 VanDerWaalsContact C-N 3.33Å; Q128-K130 PolarHBondContact O-N 3.16Å; Q128-K131 WeakPolarHBondContact O-CA 3.42Å; Q128-K131 WeakPolarHBondContact O-CB 3.29Å; Q128-K131 PolarHBondContact O-N 3.19Å; Q128-E132 WeakPolarHBondContact CG-OE1 3.29Å; Q128-E132 PolarHBondContact NE2-OE1 2.81Å; Q128-E132 WeakPolarHBondContact O-CG 3.45Å; Q128-E132 PolarHBondContact O-N 3.46Å; Q128-E173 HydrophobicContact CB-CB 4.23Å; Q128-E173 HydrophobicContact CG-CB 4.32Å
129	Y	94.5	Very high	91.5	Very high	16 Å²	16	48.2 Å²	48.2	6%	0.063	25%	0.25	C	C	.	.	H	α-helix	trans	-59.8	-42.9	174.3	-76.1	-54.5	0	0	0	112	R50 L91 F92 S125 F126 K131 E132 L133	R50-Y129 HydrophobicContact CG-CE1 3.78Å; L91-Y129 HydrophobicContact CB-CD2 4.12Å; L91-Y129 HydrophobicContact CB-CE2 4.02Å; F92-Y129 HydrophobicContact CB-CD1 4.47Å; F92-Y129 HydrophobicContact CB-CD2 4.32Å; F92-Y129 HydrophobicContact CB-CE1 4.39Å; F92-Y129 HydrophobicContact CB-CE2 4.27Å; F92-Y129 HydrophobicContact CB-CG 4.43Å; F92-Y129 AromaticContact CD2-CD1 3.74Å; F92-Y129 HydrophobicContact CD2-CD1 3.74Å; F92-Y129 AromaticContact CD2-CE1 4Å; F92-Y129 HydrophobicContact CD2-CE1 4Å; F92-Y129 HydrophobicContact CD2-CG 4.22Å; S125-Y129 WeakPolarHBondContact O-CD2 3.48Å; S125-Y129 PolarHBondContact O-N 3.25Å; F126-Y129 PolarHBondContact O-N 3.1Å; Y129-K131 PolarHBondContact O-N 3.21Å; Y129-E132 PolarHBondContact O-N 3.44Å; Y129-L133 WeakPolarHBondContact O-CB 3.27Å; Y129-L133 VanDerWaalsContact O-CG 3.26Å; Y129-L133 WeakPolarHBondContact O-CG 3.47Å; Y129-L133 PolarHBondContact O-N 3.33Å
130	K	94.1	Very high	91.2	Very high	3 Å²	3	49.3 Å²	49.3	1%	0.013	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-33.6	174.5	-68.2	180	70.6	68.1	0	112.9	A95 S98 Q99 F126 V127 Q128 K134 I141 L146	A95-K130 HydrophobicContact CB-CG 3.73Å; S98-K130 PolarHBondContact OG-NZ 3.38Å; Q99-K130 PolarHBondContact NE2-O 2.67Å; Q99-K130 PolarHBondContact OE1-O 3.28Å; F126-K130 HydrophobicContact CD1-CD 4.18Å; F126-K130 HydrophobicContact CE1-CD 3.57Å; F126-K130 HydrophobicContact CE2-CD 4.01Å; F126-K130 HydrophobicContact CE2-CG 4.38Å; F126-K130 HydrophobicContact CZ-CD 3.5Å; F126-K130 HydrophobicContact CZ-CG 4.35Å; F126-K130 WeakPolarHBondContact O-CG 3.22Å; F126-K130 PolarHBondContact O-N 2.7Å; V127-K130 PolarHBondContact O-N 3.31Å; Q128-K130 VanDerWaalsContact C-N 3.33Å; Q128-K130 PolarHBondContact O-N 3.16Å; K130-K134 PolarHBondContact O-N 3.28Å; K130-I141 HydrophobicContact CB-CG2 4.38Å; K130-L146 HydrophobicContact CD-CD1 4.11Å; K130-L146 HydrophobicContact CD-CD2 4.37Å
131	K	93.1	Very high	90.9	Very high	109 Å²	109	50.5 Å²	50.5	47%	0.474	28%	0.276	S	S	.	.	H	α-helix	trans	-68.2	-43.2	176.1	177.5	179.7	167.8	-171	0	111.3	V127 Q128 Y129 K134 I141 W175	V127-K131 PolarHBondContact O-N 3.03Å; Q128-K131 WeakPolarHBondContact O-CA 3.42Å; Q128-K131 WeakPolarHBondContact O-CB 3.29Å; Q128-K131 PolarHBondContact O-N 3.19Å; Y129-K131 PolarHBondContact O-N 3.21Å; K131-K134 WeakPolarHBondContact O-CB 3.44Å; K131-K134 PolarHBondContact O-N 3.05Å; K131-I141 HydrophobicContact CB-CD1 3.87Å; K131-I141 HydrophobicContact CG-CD1 4.05Å; K131-W175 HydrophobicContact CB-CZ2 4.25Å; K131-W175 HydrophobicContact CD-CH2 4.49Å; K131-W175 HydrophobicContact CD-CZ2 3.71Å
132	E	91.3	Very high	90.8	Very high	78 Å²	78	52.1 Å²	52.1	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-66.6	-39.6	177.9	-70.5	162.2	-179.9	0	0	112	R50 Q128 Y129 K134	R50-E132 VanDerWaalsContact CZ-CD 3.45Å; R50-E132 IonicContact CZ-OE1 3.58Å; R50-E132 IonicContact CZ-OE2 3.62Å; R50-E132 VanDerWaalsContact CZ-OE2 3.28Å; R50-E132 IonicContact NE-OE1 2.69Å; R50-E132 PolarHBondContact NE-OE1 3.48Å; R50-E132 IonicContact NE-OE2 3.72Å; R50-E132 PolarHBondContact NE-OE2 3.42Å; R50-E132 IonicContact NH1-OE1 3.55Å; R50-E132 PolarHBondContact NH1-OE1 2.97Å; R50-E132 VanDerWaalsContact NH1-OE1 3.14Å; R50-E132 IonicContact NH2-OE1 2.93Å; R50-E132 PolarHBondContact NH2-OE1 3.49Å; R50-E132 IonicContact NH2-OE2 3.62Å; Q128-E132 WeakPolarHBondContact CG-OE1 3.29Å; Q128-E132 PolarHBondContact NE2-OE1 2.81Å; Q128-E132 WeakPolarHBondContact O-CG 3.45Å; Q128-E132 PolarHBondContact O-N 3.46Å; Y129-E132 PolarHBondContact O-N 3.44Å; E132-K134 PolarHBondContact O-N 3.39Å
133	L	90.5	Very high	90.6	Very high	14 Å²	14	51.4 Å²	51.4	7%	0.073	28%	0.284	C	S	.	.	H	α-helix	trans	-72.8	-13.8	178.4	-69.1	170.6	0	0	0	114	T53 F92 A95 L96 Q99 Y129 E135 G136 M137	T53-L133 HydrophobicContact CG2-CD2 3.5Å; T53-L133 VanDerWaalsContact CG2-CD2 3.5Å; F92-L133 HydrophobicContact CE2-CD1 4.27Å; F92-L133 HydrophobicContact CE2-CD2 3.95Å; F92-L133 HydrophobicContact CE2-CG 4.38Å; F92-L133 HydrophobicContact CZ-CD2 4.12Å; A95-L133 HydrophobicContact CB-CD1 4.1Å; L96-L133 HydrophobicContact CB-CD1 4.04Å; L96-L133 HydrophobicContact CD1-CD1 3.95Å; L96-L133 HydrophobicContact CD1-CD2 3.88Å; L96-L133 HydrophobicContact CD1-CG 4.5Å; Q99-L133 VanDerWaalsContact OE1-CB 3.24Å; Y129-L133 WeakPolarHBondContact O-CB 3.27Å; Y129-L133 VanDerWaalsContact O-CG 3.26Å; Y129-L133 WeakPolarHBondContact O-CG 3.47Å; Y129-L133 PolarHBondContact O-N 3.33Å; L133-E135 VanDerWaalsContact C-N 3.35Å; L133-E135 PolarHBondContact O-N 3.34Å; L133-G136 PolarHBondContact O-N 3.25Å; L133-M137 HydrophobicContact CB-CG 4.46Å; L133-M137 HydrophobicContact CB-SD 4.19Å; L133-M137 WeakPolarHBondContact O-CB 3.3Å; L133-M137 WeakPolarHBondContact O-CG 3.37Å; L133-M137 PolarHBondContact O-N 3.21Å
134	K	89.1	Confident	90.4	Very high	100 Å²	100	61.3 Å²	61.3	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-54.1	-47.6	-174.8	-174.7	-157.4	172.4	-168.5	0	112.6	K130 K131 E132 K138 C139 I141	K130-K134 PolarHBondContact O-N 3.28Å; K131-K134 WeakPolarHBondContact O-CB 3.44Å; K131-K134 PolarHBondContact O-N 3.05Å; E132-K134 PolarHBondContact O-N 3.39Å; K134-K138 PolarHBondContact O-N 2.82Å; K134-C139 WeakPolarHBondContact CG-O 3.44Å; K134-C139 PolarHBondContact O-N 3.01Å; K134-I141 HydrophobicContact CB-CD1 4.25Å; K134-I141 HydrophobicContact CB-CG1 4.06Å; K134-I141 HydrophobicContact CD-CD1 3.95Å; K134-I141 HydrophobicContact CD-CG1 4.08Å; K134-I141 HydrophobicContact CG-CD1 4.25Å; K134-I141 HydrophobicContact CG-CG1 3.92Å
135	E	83.8	Confident	90.2	Very high	168 Å²	168	63.8 Å²	63.8	79%	0.785	34%	0.342	S	S	*	.	H	α-helix	trans	-70.5	-47.7	-174.7	-66.8	-179.7	177.6	0	0	111.1	L133 M137 K138	L133-E135 VanDerWaalsContact C-N 3.35Å; L133-E135 PolarHBondContact O-N 3.34Å; E135-M137 PolarHBondContact O-N 3.28Å; E135-K138 PolarHBondContact O-N 2.71Å
136	G	82	Confident	90.3	Very high	72 Å²	72	62.9 Å²	62.9	74%	0.742	34%	0.336	S	S	*	.	H	α-helix	trans	-62.7	-40	177.7	0	0	0	0	0	113.3	L133 K138	L133-G136 PolarHBondContact O-N 3.25Å; G136-K138 VanDerWaalsContact C-N 3.34Å
137	M	84.1	Confident	90.3	Very high	57 Å²	57	67 Å²	67	28%	0.281	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-2.6	179.7	-61.5	-171.4	81.5	0	0	114	L96 Q99 L133 E135 C139	L96-M137 HydrophobicContact CD1-CE 4.19Å; L96-M137 HydrophobicContact CD1-SD 3.72Å; Q99-M137 VanDerWaalsContact C-CE 3.49Å; Q99-M137 HydrophobicContact CB-CE 3.68Å; Q99-M137 HydrophobicContact CB-SD 3.4Å; Q99-M137 WeakPolarHBondContact CB-SD 3.18Å; Q99-M137 HydrophobicContact CG-SD 4.41Å; Q99-M137 WeakPolarHBondContact O-CE 3.38Å; L133-M137 HydrophobicContact CB-CG 4.46Å; L133-M137 HydrophobicContact CB-SD 4.19Å; L133-M137 WeakPolarHBondContact O-CB 3.3Å; L133-M137 WeakPolarHBondContact O-CG 3.37Å; L133-M137 PolarHBondContact O-N 3.21Å; E135-M137 PolarHBondContact O-N 3.28Å; M137-C139 PolarHBondContact O-N 3.41Å; M137-C139 VanDerWaalsContact O-N 3.1Å
138	K	84	Confident	90.2	Very high	197 Å²	197	73.4 Å²	73.4	86%	0.857	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	39.5	-178.5	-59.2	179.8	-178.8	176.5	0	113.2	K134 E135 G136	K134-K138 PolarHBondContact O-N 2.82Å; E135-K138 PolarHBondContact O-N 2.71Å; G136-K138 VanDerWaalsContact C-N 3.34Å
139	C	84.2	Confident	90.3	Very high	36 Å²	36	72.6 Å²	72.6	24%	0.243	38%	0.377	C	S	.	.			trans	-126.1	158.5	-175.8	73.7	0	0	0	0	112.2	K134 M137	K134-C139 WeakPolarHBondContact CG-O 3.44Å; K134-C139 PolarHBondContact O-N 3.01Å; M137-C139 PolarHBondContact O-N 3.41Å; M137-C139 VanDerWaalsContact O-N 3.1Å
140	G	85.1	Confident	90.4	Very high	61 Å²	61	71.9 Å²	71.9	63%	0.629	37%	0.374	S	S	*	.			trans	-74.8	154.4	171.3	0	0	0	0	0	112.1
141	I	87.8	Confident	90.5	Very high	27 Å²	27	72.4 Å²	72.4	14%	0.138	38%	0.378	C	S	.	.	S	Bend	trans	-85.6	-53.8	176.8	-57.4	166.1	0	0	0	110.3	K130 K131 K134 G143 L146	K130-I141 HydrophobicContact CB-CG2 4.38Å; K131-I141 HydrophobicContact CB-CD1 3.87Å; K131-I141 HydrophobicContact CG-CD1 4.05Å; K134-I141 HydrophobicContact CB-CD1 4.25Å; K134-I141 HydrophobicContact CB-CG1 4.06Å; K134-I141 HydrophobicContact CD-CD1 3.95Å; K134-I141 HydrophobicContact CD-CG1 4.08Å; K134-I141 HydrophobicContact CG-CD1 4.25Å; K134-I141 HydrophobicContact CG-CG1 3.92Å; I141-G143 PolarHBondContact O-N 3Å; I141-G143 VanDerWaalsContact O-N 3.13Å; I141-L146 HydrophobicContact CG2-CD2 3.69Å; I141-L146 WeakPolarHBondContact O-CD2 3.39Å
142	W	91.3	Very high	90.7	Very high	57 Å²	57	69.7 Å²	69.7	22%	0.216	37%	0.369	C	S	.	.			trans	-92.4	66.6	-167.9	-69.7	101.7	0	0	0	113.3	V127 L146 R147 V150 W175 L180 L183	V127-W142 HydrophobicContact CG1-CZ2 4.25Å; W142-L146 HydrophobicContact CD2-CD2 3.88Å; W142-L146 HydrophobicContact CE3-CD2 3.73Å; W142-L146 HydrophobicContact CE3-CG 3.98Å; W142-L146 HydrophobicContact CG-CD2 4.48Å; W142-L146 HydrophobicContact CH2-CD2 4.38Å; W142-L146 HydrophobicContact CZ2-CD2 4.49Å; W142-L146 HydrophobicContact CZ3-CD2 3.99Å; W142-L146 HydrophobicContact CZ3-CG 3.99Å; W142-R147 HydrophobicContact CE3-CG 3.98Å; W142-R147 PolarHBondContact O-NH1 2.89Å; W142-V150 HydrophobicContact CH2-CG2 4.37Å; W142-V150 HydrophobicContact CZ3-CG2 4.26Å; W142-W175 HydrophobicContact CZ2-CZ3 4.49Å; W142-L180 HydrophobicContact CH2-CD2 4.11Å; W142-L180 HydrophobicContact CZ2-CD2 4.23Å; W142-L183 HydrophobicContact CD2-CB 3.77Å; W142-L183 VanDerWaalsContact CE2-CB 3.44Å; W142-L183 HydrophobicContact CE3-CB 4.01Å; W142-L183 HydrophobicContact CG-CB 4.48Å; W142-L183 HydrophobicContact CH2-CB 3.63Å; W142-L183 HydrophobicContact CZ2-CB 3.37Å; W142-L183 HydrophobicContact CZ2-CD1 3.6Å; W142-L183 HydrophobicContact CZ2-CG 4.12Å; W142-L183 HydrophobicContact CZ3-CB 3.95Å
143	G	91.1	Very high	90.9	Very high	37 Å²	37	66.2 Å²	66.2	38%	0.381	35%	0.352	S	S	.	.			trans	-78.9	170.6	167.5	0	0	0	0	0	113	I141 A145 L146 R147	I141-G143 PolarHBondContact O-N 3Å; I141-G143 VanDerWaalsContact O-N 3.13Å; G143-A145 PolarHBondContact O-N 2.93Å; G143-L146 PolarHBondContact O-N 3.43Å; G143-R147 WeakPolarHBondContact O-CG 3.4Å; G143-R147 PolarHBondContact O-N 3.1Å; G143-R147 VanDerWaalsContact O-N 3.09Å
144	R	92.6	Very high	91.2	Very high	208 Å²	208	65.7 Å²	65.7	79%	0.785	35%	0.349	S	S	*	.	H	α-helix	trans	-54.3	-38.8	176.9	-173.8	-176.9	-66.3	-169.7	-0.3	112.4	K148	R144-K148 WeakPolarHBondContact O-CB 3.37Å; R144-K148 PolarHBondContact O-N 3.16Å
145	A	93.8	Very high	91.6	Very high	52 Å²	52	62.3 Å²	62.3	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-65	-47.3	-179.3	0	0	0	0	0	112.8	F110 G143 K148 A149	F110-A145 HydrophobicContact CD2-CB 3.81Å; F110-A145 HydrophobicContact CE2-CB 3.49Å; F110-A145 VanDerWaalsContact CE2-CB 3.49Å; F110-A145 HydrophobicContact CZ-CB 4.03Å; G143-A145 PolarHBondContact O-N 2.93Å; A145-K148 PolarHBondContact O-N 3.26Å; A145-A149 WeakPolarHBondContact O-CB 3.24Å; A145-A149 PolarHBondContact O-N 3.07Å
146	L	95.4	Very high	92.1	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-64.9	-43.5	176.9	178.9	63.7	0	0	0	111.4	F110 F126 K130 I141 W142 G143 K148 A149 V150	F110-L146 HydrophobicContact CE1-CB 4.07Å; F110-L146 HydrophobicContact CE1-CD1 3.94Å; F110-L146 HydrophobicContact CZ-CB 4.17Å; F126-L146 HydrophobicContact CE1-CD1 3.86Å; F126-L146 HydrophobicContact CZ-CD1 4.49Å; K130-L146 HydrophobicContact CD-CD1 4.11Å; K130-L146 HydrophobicContact CD-CD2 4.37Å; I141-L146 HydrophobicContact CG2-CD2 3.69Å; I141-L146 WeakPolarHBondContact O-CD2 3.39Å; W142-L146 HydrophobicContact CD2-CD2 3.88Å; W142-L146 HydrophobicContact CE3-CD2 3.73Å; W142-L146 HydrophobicContact CE3-CG 3.98Å; W142-L146 HydrophobicContact CG-CD2 4.48Å; W142-L146 HydrophobicContact CH2-CD2 4.38Å; W142-L146 HydrophobicContact CZ2-CD2 4.49Å; W142-L146 HydrophobicContact CZ3-CD2 3.99Å; W142-L146 HydrophobicContact CZ3-CG 3.99Å; G143-L146 PolarHBondContact O-N 3.43Å; L146-K148 VanDerWaalsContact C-N 3.31Å; L146-K148 PolarHBondContact O-N 3.04Å; L146-A149 PolarHBondContact O-N 3.35Å; L146-V150 HydrophobicContact CD1-CG2 3.79Å; L146-V150 HydrophobicContact CG-CG2 4.22Å; L146-V150 WeakPolarHBondContact O-CB 3.22Å; L146-V150 WeakPolarHBondContact O-CG2 3.47Å; L146-V150 PolarHBondContact O-N 2.6Å
147	R	96.3	Very high	92.5	Very high	85 Å²	85	57.9 Å²	57.9	32%	0.321	30%	0.296	S	S	.	.	H	α-helix	trans	-56.2	-47.3	176.6	-71.6	-159.6	-62.4	-87.6	6.2	111.5	W142 G143 S151 S184	W142-R147 HydrophobicContact CE3-CG 3.98Å; W142-R147 PolarHBondContact O-NH1 2.89Å; G143-R147 WeakPolarHBondContact O-CG 3.4Å; G143-R147 PolarHBondContact O-N 3.1Å; G143-R147 VanDerWaalsContact O-N 3.09Å; R147-S151 WeakPolarHBondContact O-CB 3.42Å; R147-S151 PolarHBondContact O-N 3.33Å; R147-S184 WeakPolarHBondContact CB-O 3.38Å
148	K	96.1	Very high	93	Very high	136 Å²	136	59.2 Å²	59.2	59%	0.591	30%	0.304	S	S	*	.	H	α-helix	trans	-61.2	-52.3	175.4	177.4	169	179.6	169.7	0	111.6	R144 A145 L146 V150 S151 D152	R144-K148 WeakPolarHBondContact O-CB 3.37Å; R144-K148 PolarHBondContact O-N 3.16Å; A145-K148 PolarHBondContact O-N 3.26Å; L146-K148 VanDerWaalsContact C-N 3.31Å; L146-K148 PolarHBondContact O-N 3.04Å; K148-V150 VanDerWaalsContact C-N 3.32Å; K148-V150 PolarHBondContact O-N 3.31Å; K148-S151 CarbonylContact O-C 3.58Å; K148-S151 WeakPolarHBondContact O-CA 3.48Å; K148-S151 WeakPolarHBondContact O-CB 3.4Å; K148-S151 PolarHBondContact O-N 3.44Å; K148-D152 WeakPolarHBondContact CE-OD2 3.05Å; K148-D152 VanDerWaalsContact CG-OD2 3.23Å; K148-D152 WeakPolarHBondContact CG-OD2 3.26Å; K148-D152 WeakPolarHBondContact O-CB 3.3Å; K148-D152 PolarHBondContact O-N 3.05Å
149	A	96.4	Very high	93.5	Very high	10 Å²	10	50.7 Å²	50.7	8%	0.083	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-38.5	-176.5	0	0	0	0	0	113	F110 L113 A145 L146 W153	F110-A149 HydrophobicContact CB-CB 4.15Å; F110-A149 HydrophobicContact CD1-CB 3.48Å; F110-A149 VanDerWaalsContact CD1-CB 3.48Å; F110-A149 HydrophobicContact CE1-CB 4.24Å; F110-A149 HydrophobicContact CG-CB 4.12Å; L113-A149 HydrophobicContact CD2-CB 3.68Å; A145-A149 WeakPolarHBondContact O-CB 3.24Å; A145-A149 PolarHBondContact O-N 3.07Å; L146-A149 PolarHBondContact O-N 3.35Å; A149-W153 WeakPolarHBondContact O-CB 2.84Å; A149-W153 PolarHBondContact O-N 2.73Å
150	V	96.8	Very high	94	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.6	-41.4	173.8	174.3	0	0	0	0	110.9	W142 L146 K148 W153 Y154 L180	W142-V150 HydrophobicContact CH2-CG2 4.37Å; W142-V150 HydrophobicContact CZ3-CG2 4.26Å; L146-V150 HydrophobicContact CD1-CG2 3.79Å; L146-V150 HydrophobicContact CG-CG2 4.22Å; L146-V150 WeakPolarHBondContact O-CB 3.22Å; L146-V150 WeakPolarHBondContact O-CG2 3.47Å; L146-V150 PolarHBondContact O-N 2.6Å; K148-V150 VanDerWaalsContact C-N 3.32Å; K148-V150 PolarHBondContact O-N 3.31Å; V150-W153 WeakPolarHBondContact O-CB 3.31Å; V150-W153 PolarHBondContact O-N 3.04Å; V150-Y154 HydrophobicContact CG1-CD2 4.19Å; V150-Y154 HydrophobicContact CG1-CE2 3.81Å; V150-Y154 WeakPolarHBondContact O-CD2 3.48Å; V150-Y154 PolarHBondContact O-N 3.49Å; V150-L180 HydrophobicContact CG1-CB 4.19Å
151	S	96.7	Very high	94.4	Very high	15 Å²	15	53.1 Å²	53.1	11%	0.105	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-44.1	175.2	-172.3	0	0	0	0	112	R147 K148 W153 Y154 N155 T186	R147-S151 WeakPolarHBondContact O-CB 3.42Å; R147-S151 PolarHBondContact O-N 3.33Å; K148-S151 CarbonylContact O-C 3.58Å; K148-S151 WeakPolarHBondContact O-CA 3.48Å; K148-S151 WeakPolarHBondContact O-CB 3.4Å; K148-S151 PolarHBondContact O-N 3.44Å; S151-W153 VanDerWaalsContact C-N 3.32Å; S151-Y154 PolarHBondContact O-N 2.65Å; S151-N155 WeakPolarHBondContact O-CB 3.25Å; S151-N155 PolarHBondContact O-N 3.02Å; S151-N155 PolarHBondContact O-ND2 2.8Å; S151-N155 PolarHBondContact OG-ND2 2.98Å; S151-T186 WeakPolarHBondContact CA-OG1 3.42Å
152	D	96.2	Very high	94.7	Very high	51 Å²	51	52 Å²	52	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-64.8	-38.9	178.5	-64.2	-13.3	0	0	0	110.1	K148 Y154 N155 E156	K148-D152 WeakPolarHBondContact CE-OD2 3.05Å; K148-D152 VanDerWaalsContact CG-OD2 3.23Å; K148-D152 WeakPolarHBondContact CG-OD2 3.26Å; K148-D152 WeakPolarHBondContact O-CB 3.3Å; K148-D152 PolarHBondContact O-N 3.05Å; D152-Y154 VanDerWaalsContact C-N 3.27Å; D152-Y154 PolarHBondContact O-N 3.4Å; D152-N155 PolarHBondContact O-N 3.36Å; D152-E156 WeakPolarHBondContact O-CB 3.39Å; D152-E156 VanDerWaalsContact O-CG 3.3Å; D152-E156 WeakPolarHBondContact O-CG 3.5Å; D152-E156 PolarHBondContact O-N 3.32Å
153	W	96.7	Very high	94.9	Very high	5 Å²	5	49.3 Å²	49.3	2%	0.019	26%	0.255	C	S	.	.	H	α-helix	trans	-57.5	-36	174.8	-171.8	96	0	0	0	113.4	C117 P120 L123 A149 V150 S151 Q157 L162	C117-W153 PolarHBondContact O-NE1 2.92Å; P120-W153 HydrophobicContact CG-CH2 4.14Å; L123-W153 HydrophobicContact CD1-CG 4.46Å; L123-W153 HydrophobicContact CD2-CD2 3.65Å; L123-W153 HydrophobicContact CD2-CE3 3.63Å; L123-W153 HydrophobicContact CD2-CG 4.14Å; L123-W153 HydrophobicContact CD2-CH2 4.38Å; L123-W153 HydrophobicContact CD2-CZ2 4.39Å; L123-W153 HydrophobicContact CD2-CZ3 4.02Å; A149-W153 WeakPolarHBondContact O-CB 2.84Å; A149-W153 PolarHBondContact O-N 2.73Å; V150-W153 WeakPolarHBondContact O-CB 3.31Å; V150-W153 PolarHBondContact O-N 3.04Å; S151-W153 VanDerWaalsContact C-N 3.32Å; W153-Q157 WeakPolarHBondContact O-CG 3.11Å; W153-L162 HydrophobicContact CZ3-CD1 4.16Å
154	Y	96.5	Very high	95	Very high	4 Å²	4	49 Å²	49	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-79.8	-43.1	174.7	-74.2	-76.7	0	0	0	112.3	V150 S151 D152 L162 H177 L180 L181	V150-Y154 HydrophobicContact CG1-CD2 4.19Å; V150-Y154 HydrophobicContact CG1-CE2 3.81Å; V150-Y154 WeakPolarHBondContact O-CD2 3.48Å; V150-Y154 PolarHBondContact O-N 3.49Å; S151-Y154 PolarHBondContact O-N 2.65Å; D152-Y154 VanDerWaalsContact C-N 3.27Å; D152-Y154 PolarHBondContact O-N 3.4Å; Y154-L162 HydrophobicContact CD1-CD1 3.91Å; Y154-L162 HydrophobicContact CD1-CD2 4.39Å; Y154-L162 HydrophobicContact CE1-CD1 4.4Å; Y154-H177 AromaticContact CE1-ND1 3.53Å; Y154-H177 AromaticContact CZ-ND1 3.63Å; Y154-H177 PolarHBondContact OH-ND1 3.36Å; Y154-L180 HydrophobicContact CE2-CB 4.22Å; Y154-L181 HydrophobicContact CD1-CD2 4.22Å; Y154-L181 HydrophobicContact CD2-CD2 3.78Å; Y154-L181 HydrophobicContact CE1-CD2 4.31Å; Y154-L181 HydrophobicContact CE2-CD2 3.88Å; Y154-L181 HydrophobicContact CE2-CG 4.29Å; Y154-L181 HydrophobicContact CG-CD2 3.98Å
155	N	96.1	Very high	95	Very high	28 Å²	28	39.8 Å²	39.8	15%	0.15	22%	0.217	C	C	.	.	H	α-helix	trans	-73.6	-28.6	-171.2	-79.3	-28.5	0	0	0	113.9	S151 D152 K187 P188 A189 V193	S151-N155 WeakPolarHBondContact O-CB 3.25Å; S151-N155 PolarHBondContact O-N 3.02Å; S151-N155 PolarHBondContact O-ND2 2.8Å; S151-N155 PolarHBondContact OG-ND2 2.98Å; D152-N155 PolarHBondContact O-N 3.36Å; N155-K187 PolarHBondContact ND2-O 3.3Å; N155-P188 WeakPolarHBondContact OD1-CA 3.47Å; N155-A189 HydrophobicContact CB-CB 3.83Å; N155-A189 PolarHBondContact OD1-N 2.92Å; N155-V193 WeakPolarHBondContact OD1-CG1 3.37Å
156	E	94.3	Very high	95.1	Very high	102 Å²	102	37.6 Å²	37.6	48%	0.477	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	2.3	-175.7	-61	-179.4	-179.6	0	0	114	R114 D152	R114-E156 WeakPolarHBondContact CD-OE2 3.43Å; R114-E156 VanDerWaalsContact CZ-O 3.26Å; R114-E156 IonicContact CZ-OE2 2.68Å; R114-E156 VanDerWaalsContact NH1-CB 3.26Å; R114-E156 PolarHBondContact NH1-O 2.93Å; R114-E156 IonicContact NH1-OE2 3.81Å; R114-E156 PolarHBondContact NH1-OE2 2.96Å; R114-E156 PolarHBondContact NH2-O 3.19Å; D152-E156 WeakPolarHBondContact O-CB 3.39Å; D152-E156 VanDerWaalsContact O-CG 3.3Å; D152-E156 WeakPolarHBondContact O-CG 3.5Å; D152-E156 PolarHBondContact O-N 3.32Å
157	Q	92.1	Very high	95	Very high	46 Å²	46	37.6 Å²	37.6	22%	0.215	20%	0.198	C	C	.	.	S	Bend	trans	-83.8	153.4	178.8	-60	-75.1	15.5	0	0	111	W153 L162	W153-Q157 WeakPolarHBondContact O-CG 3.11Å; Q157-L162 HydrophobicContact CB-CB 4.13Å
158	D	94.2	Very high	94.7	Very high	84 Å²	84	37.7 Å²	37.7	45%	0.449	20%	0.198	S	C	.	.			trans	-60.5	128.9	164.3	167.5	67.3	0	0	0	109.7	L160 S161 L162	D158-L160 VanDerWaalsContact C-N 3.34Å; D158-L160 PolarHBondContact O-N 3.35Å; D158-L160 PolarHBondContact OD2-N 3.11Å; D158-S161 PolarHBondContact O-N 3.13Å; D158-S161 WeakPolarHBondContact OD2-CB 3.5Å; D158-S161 PolarHBondContact OD2-N 2.9Å; D158-S161 PolarHBondContact OD2-OG 2.77Å; D158-L162 WeakPolarHBondContact O-CB 3.46Å; D158-L162 PolarHBondContact O-N 3.43Å
159	P	94.6	Very high	94.5	Very high	18 Å²	18	32.2 Å²	32.2	12%	0.117	18%	0.177	C	C	.	.	H	α-helix	trans	-58.4	-39.6	-174.6	-27.4	34.9	0	0	0	114.6	L162 A163 A192 I196 V223	P159-L162 PolarHBondContact O-N 3.24Å; P159-A163 WeakPolarHBondContact O-CB 3.42Å; P159-A163 PolarHBondContact O-N 3.06Å; P159-A192 HydrophobicContact CB-CB 3.66Å; P159-A192 HydrophobicContact CG-CB 3.84Å; P159-I196 HydrophobicContact CB-CD1 4.36Å; P159-I196 WeakPolarHBondContact O-CD1 3.34Å; P159-V223 HydrophobicContact CB-CG2 3.81Å
160	L	93.9	Very high	94.3	Very high	78 Å²	78	37.2 Å²	37.2	41%	0.408	20%	0.197	S	C	.	.	H	α-helix	trans	-70.3	-42.9	-179.6	-173.2	64.7	0	0	0	110.9	D158 L162 A163 A164 Y226	D158-L160 VanDerWaalsContact C-N 3.34Å; D158-L160 PolarHBondContact O-N 3.35Å; D158-L160 PolarHBondContact OD2-N 3.11Å; L160-L162 VanDerWaalsContact C-N 3.29Å; L160-L162 PolarHBondContact O-N 2.78Å; L160-A163 PolarHBondContact O-N 2.7Å; L160-A164 PolarHBondContact O-N 3.15Å; L160-Y226 HydrophobicContact CD1-CD1 4.37Å; L160-Y226 HydrophobicContact CD1-CD2 4.17Å; L160-Y226 HydrophobicContact CD1-CG 3.86Å
161	S	93.2	Very high	94.1	Very high	71 Å²	71	44 Å²	44	50%	0.497	23%	0.228	S	C	.	.	H	α-helix	trans	-60.2	-39.6	173.8	-56.8	0	0	0	0	111.8	D158 A164 A165	D158-S161 PolarHBondContact O-N 3.13Å; D158-S161 WeakPolarHBondContact OD2-CB 3.5Å; D158-S161 PolarHBondContact OD2-N 2.9Å; D158-S161 PolarHBondContact OD2-OG 2.77Å; S161-A164 PolarHBondContact O-N 2.9Å; S161-A165 WeakPolarHBondContact O-CB 3.46Å; S161-A165 PolarHBondContact O-N 2.99Å
162	L	95.2	Very high	93.9	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-43.6	175.2	-179.7	62.3	0	0	0	111.5	W153 Y154 Q157 D158 P159 L160 A164 A165 V166 V193 I196	W153-L162 HydrophobicContact CZ3-CD1 4.16Å; Y154-L162 HydrophobicContact CD1-CD1 3.91Å; Y154-L162 HydrophobicContact CD1-CD2 4.39Å; Y154-L162 HydrophobicContact CE1-CD1 4.4Å; Q157-L162 HydrophobicContact CB-CB 4.13Å; D158-L162 WeakPolarHBondContact O-CB 3.46Å; D158-L162 PolarHBondContact O-N 3.43Å; P159-L162 PolarHBondContact O-N 3.24Å; L160-L162 VanDerWaalsContact C-N 3.29Å; L160-L162 PolarHBondContact O-N 2.78Å; L162-A164 VanDerWaalsContact C-N 3.31Å; L162-A164 PolarHBondContact O-N 3.36Å; L162-A165 PolarHBondContact O-N 3.13Å; L162-V166 HydrophobicContact CD1-CG1 3.99Å; L162-V166 HydrophobicContact CG-CG1 4.41Å; L162-V166 WeakPolarHBondContact O-CG1 3.36Å; L162-V166 WeakPolarHBondContact O-CG2 3.11Å; L162-V166 PolarHBondContact O-N 2.96Å; L162-V193 HydrophobicContact CD2-CG1 4.45Å; L162-V193 HydrophobicContact CD2-CG2 4.36Å; L162-I196 HydrophobicContact CB-CD1 4.17Å; L162-I196 HydrophobicContact CD2-CD1 4.02Å; L162-I196 HydrophobicContact CD2-CG2 4.28Å; L162-I196 HydrophobicContact CG-CD1 4.17Å; L162-I196 HydrophobicContact CG-CG2 4.22Å
163	A	95.1	Very high	93.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-41	176.1	0	0	0	0	0	111.9	P159 L160 V166 T167 I196 V223 Y226 L227	P159-A163 WeakPolarHBondContact O-CB 3.42Å; P159-A163 PolarHBondContact O-N 3.06Å; L160-A163 PolarHBondContact O-N 2.7Å; A163-V166 WeakPolarHBondContact O-CG2 3.42Å; A163-T167 WeakPolarHBondContact O-CB 3.41Å; A163-T167 VanDerWaalsContact O-CG2 3.29Å; A163-T167 WeakPolarHBondContact O-CG2 3.46Å; A163-T167 PolarHBondContact O-N 2.97Å; A163-T167 PolarHBondContact O-OG1 3.36Å; A163-I196 HydrophobicContact CB-CD1 4.1Å; A163-I196 HydrophobicContact CB-CG1 4.28Å; A163-V223 HydrophobicContact CB-CG1 3.96Å; A163-Y226 HydrophobicContact CB-CD1 3.87Å; A163-Y226 HydrophobicContact CB-CE1 4.07Å; A163-L227 HydrophobicContact CB-CD2 4.23Å
164	A	93	Very high	93.3	Very high	31 Å²	31	53 Å²	53	26%	0.256	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-45.9	172.7	0	0	0	0	0	111.9	L160 S161 L162 V166 T167 R168 Y226	L160-A164 PolarHBondContact O-N 3.15Å; S161-A164 PolarHBondContact O-N 2.9Å; L162-A164 VanDerWaalsContact C-N 3.31Å; L162-A164 PolarHBondContact O-N 3.36Å; A164-V166 PolarHBondContact O-N 3.31Å; A164-T167 PolarHBondContact O-N 2.94Å; A164-T167 PolarHBondContact O-OG1 3.47Å; A164-R168 VanDerWaalsContact O-CB 3.25Å; A164-R168 WeakPolarHBondContact O-CB 3.42Å; A164-R168 PolarHBondContact O-N 3.23Å; A164-Y226 WeakPolarHBondContact CA-OH 3.34Å; A164-Y226 HydrophobicContact CB-CE1 4.44Å
165	A	93.1	Very high	93.4	Very high	14 Å²	14	54 Å²	54	12%	0.116	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-47.5	-179.7	0	0	0	0	0	112.9	P120 S161 L162 T167 R168 C169	P120-A165 HydrophobicContact CG-CB 3.78Å; S161-A165 WeakPolarHBondContact O-CB 3.46Å; S161-A165 PolarHBondContact O-N 2.99Å; L162-A165 PolarHBondContact O-N 3.13Å; A165-T167 VanDerWaalsContact C-N 3.3Å; A165-T167 PolarHBondContact O-N 2.81Å; A165-R168 PolarHBondContact O-N 3.41Å; A165-C169 PolarHBondContact O-N 2.98Å
166	V	94.9	Very high	93.4	Very high	6 Å²	6	53.4 Å²	53.4	4%	0.036	28%	0.283	C	S	.	.	H	α-helix	trans	-70.7	-25.5	-178.1	-57	0	0	0	0	113.3	L162 A163 A164 I196 V200	L162-V166 HydrophobicContact CD1-CG1 3.99Å; L162-V166 HydrophobicContact CG-CG1 4.41Å; L162-V166 WeakPolarHBondContact O-CG1 3.36Å; L162-V166 WeakPolarHBondContact O-CG2 3.11Å; L162-V166 PolarHBondContact O-N 2.96Å; A163-V166 WeakPolarHBondContact O-CG2 3.42Å; A164-V166 PolarHBondContact O-N 3.31Å; V166-I196 HydrophobicContact CG1-CG2 4.36Å; V166-I196 HydrophobicContact CG2-CG2 3.9Å; V166-V200 HydrophobicContact CB-CG2 4.04Å; V166-V200 HydrophobicContact CG1-CG2 4.28Å; V166-V200 HydrophobicContact CG2-CG2 4.05Å
167	T	93	Very high	93.6	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.012	26%	0.261	C	S	.	.	H	α-helix	trans	-83.8	-34.2	176.7	52.8	0	0	0	0	111.9	A163 A164 A165 Y199 L227 V230 Q255	A163-T167 WeakPolarHBondContact O-CB 3.41Å; A163-T167 VanDerWaalsContact O-CG2 3.29Å; A163-T167 WeakPolarHBondContact O-CG2 3.46Å; A163-T167 PolarHBondContact O-N 2.97Å; A163-T167 PolarHBondContact O-OG1 3.36Å; A164-T167 PolarHBondContact O-N 2.94Å; A164-T167 PolarHBondContact O-OG1 3.47Å; A165-T167 VanDerWaalsContact C-N 3.3Å; A165-T167 PolarHBondContact O-N 2.81Å; T167-Y199 HydrophobicContact CG2-CE1 3.95Å; T167-L227 HydrophobicContact CG2-CD2 3.82Å; T167-V230 HydrophobicContact CG2-CG1 3.89Å; T167-Q255 PolarHBondContact OG1-NE2 2.81Å
168	R	91.2	Very high	93.8	Very high	87 Å²	87	51.1 Å²	51.1	33%	0.328	27%	0.272	S	S	.	.	H	α-helix	trans	-69.9	-48.9	174.7	-177.9	176.4	69.9	-161.8	3.7	112.7	D119 A164 A165 E252 E254	D119-R168 IonicContact OD2-CZ 3.97Å; D119-R168 IonicContact OD2-NE 3.89Å; D119-R168 IonicContact OD2-NH2 2.8Å; D119-R168 PolarHBondContact OD2-NH2 3.41Å; A164-R168 VanDerWaalsContact O-CB 3.25Å; A164-R168 WeakPolarHBondContact O-CB 3.42Å; A164-R168 PolarHBondContact O-N 3.23Å; A165-R168 PolarHBondContact O-N 3.41Å; R168-E252 WeakPolarHBondContact CD-OE2 3.37Å; R168-E252 IonicContact NH1-OE1 3.52Å; R168-E252 PolarHBondContact NH1-OE1 3.41Å; R168-E252 IonicContact NH1-OE2 2.69Å; R168-E254 HydrophobicContact CG-CB 4.17Å
169	C	91.9	Very high	93.9	Very high	21 Å²	21	49.2 Å²	49.2	14%	0.142	26%	0.262	C	S	.	.			trans	-120.6	84.2	-177.8	-171.2	0	0	0	0	110.9	P120 A165 Q171 H177	P120-C169 HydrophobicContact CB-CB 3.93Å; P120-C169 HydrophobicContact CG-CB 4.3Å; A165-C169 PolarHBondContact O-N 2.98Å; C169-Q171 PolarHBondContact O-N 2.99Å; C169-H177 PolarHBondContact O-CD2 2.95Å; C169-H177 PolarHBondContact O-NE2 3.31Å; C169-H177 VanDerWaalsContact O-NE2 3.12Å
170	K	91.6	Very high	94	Very high	115 Å²	115	48.3 Å²	48.3	50%	0.5	26%	0.256	S	S	.	.	S	Bend	trans	-66.6	-38.8	-178.3	-61.6	-180	-174.1	171.1	0	113.1
171	Q	93.4	Very high	94.2	Very high	141 Å²	141	45.3 Å²	45.3	66%	0.659	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-155.1	151.5	-178.8	62.4	176.8	2.1	0	0	111.8	C169 W175	C169-Q171 PolarHBondContact O-N 2.99Å; Q171-W175 CarbonylContact C-O 3.59Å; Q171-W175 WeakPolarHBondContact CA-O 3.24Å; Q171-W175 VanDerWaalsContact CB-O 3.23Å; Q171-W175 WeakPolarHBondContact CB-O 3.32Å
172	R	92.8	Very high	94.3	Very high	130 Å²	130	48.9 Å²	48.9	49%	0.491	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	150	173.9	-143.6	-83.9	-173	-117.1	-3.7	108.8	A121 F124 G174 W175	A121-R172 HydrophobicContact CB-CG 4.3Å; F124-R172 HydrophobicContact CB-CB 4.3Å; F124-R172 HydrophobicContact CD2-CB 3.66Å; F124-R172 HydrophobicContact CE2-CB 4.5Å; F124-R172 HydrophobicContact CG-CB 4.4Å; R172-G174 PolarHBondContact O-N 3.43Å; R172-W175 PolarHBondContact N-O 3.12Å; R172-W175 PolarHBondContact O-N 3.17Å
173	E	87.4	Confident	94.4	Very high	61 Å²	61	50.7 Å²	50.7	29%	0.285	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	28.1	179	-64	-59.6	131.8	0	0	114	R50 Q128 W175	R50-E173 IonicContact CZ-OE2 3.38Å; R50-E173 IonicContact NH1-OE2 2.76Å; R50-E173 PolarHBondContact NH1-OE2 3.19Å; R50-E173 IonicContact NH2-OE2 3.65Å; Q128-E173 HydrophobicContact CB-CB 4.23Å; Q128-E173 HydrophobicContact CG-CB 4.32Å; E173-W175 VanDerWaalsContact C-N 3.27Å; E173-W175 VanDerWaalsContact O-CD1 3.3Å; E173-W175 PolarHBondContact O-N 3.22Å
174	G	93.1	Very high	94.4	Very high	71 Å²	71	50.9 Å²	50.9	73%	0.732	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	10.6	-176.6	0	0	0	0	0	115.2	R172	R172-G174 PolarHBondContact O-N 3.43Å
175	W	96.8	Very high	94.4	Very high	23 Å²	23	56.3 Å²	56.3	9%	0.087	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.8	173.6	-65.4	91.2	0	0	0	111.3	F124 V127 K131 W142 Q171 R172 E173 D179 L180 L183	F124-W175 HydrophobicContact CB-CB 4.08Å; F124-W175 HydrophobicContact CD1-CB 3.59Å; F124-W175 HydrophobicContact CE1-CB 4.32Å; F124-W175 HydrophobicContact CG-CB 4.01Å; V127-W175 HydrophobicContact CG1-CD2 3.95Å; V127-W175 HydrophobicContact CG1-CE3 4.06Å; V127-W175 HydrophobicContact CG1-CH2 3.73Å; V127-W175 HydrophobicContact CG1-CZ2 3.6Å; V127-W175 HydrophobicContact CG1-CZ3 3.96Å; K131-W175 HydrophobicContact CB-CZ2 4.25Å; K131-W175 HydrophobicContact CD-CH2 4.49Å; K131-W175 HydrophobicContact CD-CZ2 3.71Å; W142-W175 HydrophobicContact CZ2-CZ3 4.49Å; Q171-W175 CarbonylContact C-O 3.59Å; Q171-W175 WeakPolarHBondContact CA-O 3.24Å; Q171-W175 VanDerWaalsContact CB-O 3.23Å; Q171-W175 WeakPolarHBondContact CB-O 3.32Å; R172-W175 PolarHBondContact N-O 3.12Å; R172-W175 PolarHBondContact O-N 3.17Å; E173-W175 VanDerWaalsContact C-N 3.27Å; E173-W175 VanDerWaalsContact O-CD1 3.3Å; E173-W175 PolarHBondContact O-N 3.22Å; W175-D179 HydrophobicContact CE3-CB 4.09Å; W175-D179 HydrophobicContact CZ3-CB 4.49Å; W175-L180 HydrophobicContact CE3-CD2 3.89Å; W175-L180 HydrophobicContact CZ3-CD2 4.39Å; W175-L183 HydrophobicContact CH2-CD1 4.38Å; W175-L183 HydrophobicContact CZ3-CD1 3.66Å
176	S	97.4	Very high	94.4	Very high	17 Å²	17	56.7 Å²	56.7	12%	0.119	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	162.3	172.5	70.9	0	0	0	0	111.6	F124 Q178 D179 L180	F124-S176 VanDerWaalsContact CE1-C 3.48Å; S176-Q178 PolarHBondContact O-N 3.15Å; S176-Q178 PolarHBondContact OG-N 2.88Å; S176-D179 PolarHBondContact N-OD2 2.89Å; S176-D179 PolarHBondContact O-N 3.49Å; S176-D179 PolarHBondContact OG-N 3Å; S176-D179 VanDerWaalsContact OG-N 3.1Å; S176-D179 PolarHBondContact OG-OD2 3.39Å; S176-L180 PolarHBondContact O-N 3.11Å
177	H	97.3	Very high	94.4	Very high	3 Å²	3	64.7 Å²	64.7	1%	0.014	31%	0.309	C	S	.	.	H	α-helix	trans	-59	-35.2	170.5	-73.1	-66.8	0	0	0	112.1	F124 Y154 C169 D179 L180 L181 V200	F124-H177 AromaticContact CZ-CD2 3.78Å; F124-H177 AromaticContact CZ-CE1 3.7Å; F124-H177 AromaticContact CZ-CG 3.81Å; F124-H177 AromaticContact CZ-ND1 3.75Å; F124-H177 AromaticContact CZ-NE2 3.72Å; Y154-H177 AromaticContact CE1-ND1 3.53Å; Y154-H177 AromaticContact CZ-ND1 3.63Å; Y154-H177 PolarHBondContact OH-ND1 3.36Å; C169-H177 PolarHBondContact O-CD2 2.95Å; C169-H177 PolarHBondContact O-NE2 3.31Å; C169-H177 VanDerWaalsContact O-NE2 3.12Å; H177-D179 VanDerWaalsContact C-N 3.34Å; H177-D179 PolarHBondContact O-N 3.5Å; H177-L180 PolarHBondContact O-N 2.96Å; H177-L181 WeakPolarHBondContact O-CB 3.38Å; H177-L181 VanDerWaalsContact O-CG 3.3Å; H177-L181 WeakPolarHBondContact O-CG 3.11Å; H177-L181 PolarHBondContact O-N 2.87Å; H177-V200 HydrophobicContact CB-CG1 3.51Å; H177-V200 HydrophobicContact CB-CG2 4.38Å
178	Q	96.9	Very high	94.5	Very high	97 Å²	97	66.9 Å²	66.9	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-43.2	176.6	-175.7	-178.2	20.3	0	0	111.6	S176 R182 V200 T201	S176-Q178 PolarHBondContact O-N 3.15Å; S176-Q178 PolarHBondContact OG-N 2.88Å; Q178-R182 VanDerWaalsContact O-CB 3.23Å; Q178-R182 WeakPolarHBondContact O-CB 3.36Å; Q178-R182 PolarHBondContact O-N 3.34Å; Q178-V200 HydrophobicContact CB-CG1 4.16Å; Q178-T201 HydrophobicContact CG-CG2 4.38Å; Q178-T201 PolarHBondContact NE2-O 3.29Å
179	D	97	Very high	94.6	Very high	43 Å²	43	66.2 Å²	66.2	23%	0.23	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-46.7	176.7	-69.3	-54.5	0	0	0	111.9	W175 S176 H177 R182 L183	W175-D179 HydrophobicContact CE3-CB 4.09Å; W175-D179 HydrophobicContact CZ3-CB 4.49Å; S176-D179 PolarHBondContact N-OD2 2.89Å; S176-D179 PolarHBondContact O-N 3.49Å; S176-D179 PolarHBondContact OG-N 3Å; S176-D179 VanDerWaalsContact OG-N 3.1Å; S176-D179 PolarHBondContact OG-OD2 3.39Å; H177-D179 VanDerWaalsContact C-N 3.34Å; H177-D179 PolarHBondContact O-N 3.5Å; D179-R182 PolarHBondContact O-N 3.01Å; D179-R182 IonicContact OD1-CZ 2.88Å; D179-R182 IonicContact OD1-NH2 2.78Å; D179-R182 PolarHBondContact OD1-NH2 3.49Å; D179-L183 WeakPolarHBondContact O-CB 3.4Å; D179-L183 WeakPolarHBondContact O-CD1 3.44Å; D179-L183 VanDerWaalsContact O-CG 3.23Å; D179-L183 WeakPolarHBondContact O-CG 3.23Å; D179-L183 PolarHBondContact O-N 3.34Å
180	L	96.9	Very high	94.7	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-44.9	-179.1	-64.5	-165.1	0	0	0	111.6	L123 F124 V127 W142 V150 Y154 W175 S176 H177 R182 L183 S184	L123-L180 HydrophobicContact CD2-CD1 3.51Å; L123-L180 HydrophobicContact CG-CD1 3.72Å; F124-L180 HydrophobicContact CD1-CD1 3.66Å; F124-L180 HydrophobicContact CD1-CG 4.19Å; F124-L180 HydrophobicContact CE1-CD1 3.61Å; F124-L180 HydrophobicContact CE1-CG 4.01Å; V127-L180 HydrophobicContact CB-CD2 4.26Å; V127-L180 HydrophobicContact CG1-CD2 3.99Å; V127-L180 HydrophobicContact CG2-CD1 4.5Å; V127-L180 HydrophobicContact CG2-CD2 3.88Å; W142-L180 HydrophobicContact CH2-CD2 4.11Å; W142-L180 HydrophobicContact CZ2-CD2 4.23Å; V150-L180 HydrophobicContact CG1-CB 4.19Å; Y154-L180 HydrophobicContact CE2-CB 4.22Å; W175-L180 HydrophobicContact CE3-CD2 3.89Å; W175-L180 HydrophobicContact CZ3-CD2 4.39Å; S176-L180 PolarHBondContact O-N 3.11Å; H177-L180 PolarHBondContact O-N 2.96Å; L180-R182 VanDerWaalsContact C-N 3.34Å; L180-R182 PolarHBondContact O-N 3.36Å; L180-L183 PolarHBondContact O-N 3.44Å; L180-S184 WeakPolarHBondContact O-CB 3.11Å; L180-S184 PolarHBondContact O-N 2.95Å; L180-S184 PolarHBondContact O-OG 2.88Å
181	L	96.6	Very high	94.8	Very high	15 Å²	15	66.6 Å²	66.6	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-61.7	-42	176.7	-70.6	171.6	0	0	0	111.8	Y154 H177 S184 H185 T186 V200 T201	Y154-L181 HydrophobicContact CD1-CD2 4.22Å; Y154-L181 HydrophobicContact CD2-CD2 3.78Å; Y154-L181 HydrophobicContact CE1-CD2 4.31Å; Y154-L181 HydrophobicContact CE2-CD2 3.88Å; Y154-L181 HydrophobicContact CE2-CG 4.29Å; Y154-L181 HydrophobicContact CG-CD2 3.98Å; H177-L181 WeakPolarHBondContact O-CB 3.38Å; H177-L181 VanDerWaalsContact O-CG 3.3Å; H177-L181 WeakPolarHBondContact O-CG 3.11Å; H177-L181 PolarHBondContact O-N 2.87Å; L181-S184 PolarHBondContact O-OG 3.3Å; L181-H185 PolarHBondContact O-N 2.91Å; L181-T186 HydrophobicContact CD2-CG2 4Å; L181-T186 PolarHBondContact O-N 3.36Å; L181-V200 HydrophobicContact CD1-CB 4.11Å; L181-V200 HydrophobicContact CD1-CG1 3.89Å; L181-T201 HydrophobicContact CB-CG2 4.33Å; L181-T201 HydrophobicContact CD1-CG2 4.05Å
182	R	96.3	Very high	94.8	Very high	146 Å²	146	60 Å²	60	55%	0.551	31%	0.311	S	S	*	.	H	α-helix	trans	-64.1	-47.1	177.9	179.4	176.5	59.5	86.1	-0.1	112.2	Q178 D179 L180	Q178-R182 VanDerWaalsContact O-CB 3.23Å; Q178-R182 WeakPolarHBondContact O-CB 3.36Å; Q178-R182 PolarHBondContact O-N 3.34Å; D179-R182 PolarHBondContact O-N 3.01Å; D179-R182 IonicContact OD1-CZ 2.88Å; D179-R182 IonicContact OD1-NH2 2.78Å; D179-R182 PolarHBondContact OD1-NH2 3.49Å; L180-R182 VanDerWaalsContact C-N 3.34Å; L180-R182 PolarHBondContact O-N 3.36Å
183	L	96.1	Very high	94.9	Very high	41 Å²	41	53.8 Å²	53.8	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-80.2	-29.3	-173.9	-66.2	166.7	0	0	0	113.2	W142 W175 D179 L180 H185	W142-L183 HydrophobicContact CD2-CB 3.77Å; W142-L183 VanDerWaalsContact CE2-CB 3.44Å; W142-L183 HydrophobicContact CE3-CB 4.01Å; W142-L183 HydrophobicContact CG-CB 4.48Å; W142-L183 HydrophobicContact CH2-CB 3.63Å; W142-L183 HydrophobicContact CZ2-CB 3.37Å; W142-L183 HydrophobicContact CZ2-CD1 3.6Å; W142-L183 HydrophobicContact CZ2-CG 4.12Å; W142-L183 HydrophobicContact CZ3-CB 3.95Å; W175-L183 HydrophobicContact CH2-CD1 4.38Å; W175-L183 HydrophobicContact CZ3-CD1 3.66Å; D179-L183 WeakPolarHBondContact O-CB 3.4Å; D179-L183 WeakPolarHBondContact O-CD1 3.44Å; D179-L183 VanDerWaalsContact O-CG 3.23Å; D179-L183 WeakPolarHBondContact O-CG 3.23Å; D179-L183 PolarHBondContact O-N 3.34Å; L180-L183 PolarHBondContact O-N 3.44Å; L183-H185 VanDerWaalsContact C-N 3.3Å; L183-H185 PolarHBondContact O-CD2 2.9Å
184	S	94.9	Very high	95.2	Very high	4 Å²	4	52.1 Å²	52.1	3%	0.028	28%	0.284	C	S	.	.	H	α-helix	trans	-76.3	-19.3	173.3	58.3	0	0	0	0	113	R147 L180 L181 T186	R147-S184 WeakPolarHBondContact CB-O 3.38Å; L180-S184 WeakPolarHBondContact O-CB 3.11Å; L180-S184 PolarHBondContact O-N 2.95Å; L180-S184 PolarHBondContact O-OG 2.88Å; L181-S184 PolarHBondContact O-OG 3.3Å; S184-T186 PolarHBondContact O-N 2.97Å; S184-T186 PolarHBondContact OG-N 3.01Å; S184-T186 PolarHBondContact OG-OG1 3.19Å
185	H	93.4	Very high	95.3	Very high	146 Å²	146	48.7 Å²	48.7	68%	0.676	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	41.9	-168.7	-59.3	-101.6	0	0	0	111.4	L181 L183 K187	L181-H185 PolarHBondContact O-N 2.91Å; L183-H185 VanDerWaalsContact C-N 3.3Å; L183-H185 PolarHBondContact O-CD2 2.9Å; H185-K187 PolarHBondContact O-N 3.07Å
186	T	93.9	Very high	95.3	Very high	21 Å²	21	47.7 Å²	47.7	13%	0.129	25%	0.246	C	C	.	.			trans	-52.5	122.5	-179.9	-66.5	0	0	0	0	110.2	S151 L181 S184 P188	S151-T186 WeakPolarHBondContact CA-OG1 3.42Å; L181-T186 HydrophobicContact CD2-CG2 4Å; L181-T186 PolarHBondContact O-N 3.36Å; S184-T186 PolarHBondContact O-N 2.97Å; S184-T186 PolarHBondContact OG-N 3.01Å; S184-T186 PolarHBondContact OG-OG1 3.19Å; T186-P188 WeakPolarHBondContact O-CD 3.44Å
187	K	94.6	Very high	95.2	Very high	175 Å²	175	47.6 Å²	47.6	76%	0.761	25%	0.245	S	C	*	.			trans	-94.2	114.1	165.7	-172.4	176.9	178.7	-177.6	0	107.4	N155 H185 A189	N155-K187 PolarHBondContact ND2-O 3.3Å; H185-K187 PolarHBondContact O-N 3.07Å; K187-A189 PolarHBondContact O-N 3.33Å
188	P	94.6	Very high	95.1	Very high	47 Å²	47	50.8 Å²	50.8	31%	0.305	26%	0.259	S	S	.	.			trans	-56.9	131.7	178.3	-26.1	35.5	0	0	0	111.6	N155 T186 V193 A194	N155-P188 WeakPolarHBondContact OD1-CA 3.47Å; T186-P188 WeakPolarHBondContact O-CD 3.44Å; P188-V193 HydrophobicContact CB-CB 4.3Å; P188-V193 HydrophobicContact CB-CG1 4.1Å; P188-A194 HydrophobicContact CB-CB 3.65Å; P188-A194 HydrophobicContact CG-CB 3.93Å
189	A	93.8	Very high	95.1	Very high	73 Å²	73	47.3 Å²	47.3	60%	0.603	24%	0.241	S	C	*	.	S	Bend	trans	-80.3	-31.3	179.2	0	0	0	0	0	112.8	N155 K187	N155-A189 HydrophobicContact CB-CB 3.83Å; N155-A189 PolarHBondContact OD1-N 2.92Å; K187-A189 PolarHBondContact O-N 3.33Å
190	T	93.6	Very high	95	Very high	59 Å²	59	46.8 Å²	46.8	36%	0.362	24%	0.24	S	C	.	.	S	Bend	trans	-125.2	158	179.1	66.5	0	0	0	0	110.7	A192 V193 A194	T190-A192 PolarHBondContact O-N 2.93Å; T190-V193 PolarHBondContact O-N 2.88Å; T190-V193 WeakPolarHBondContact OG1-CG2 3.27Å; T190-V193 PolarHBondContact OG1-N 3.34Å; T190-A194 PolarHBondContact O-N 3.42Å
191	E	93.3	Very high	94.9	Very high	85 Å²	85	49 Å²	49	40%	0.397	25%	0.253	S	S	.	.	H	α-helix	trans	-62.2	-32.7	176.9	-170.3	64	-161.2	0	0	111.6	A194 L195 Y211 K214 V220	E191-A194 WeakPolarHBondContact O-CB 3.49Å; E191-A194 PolarHBondContact O-N 3.06Å; E191-L195 WeakPolarHBondContact O-CB 3.39Å; E191-L195 PolarHBondContact O-N 3.4Å; E191-Y211 HydrophobicContact CG-CE1 4.02Å; E191-Y211 WeakPolarHBondContact OE1-CE1 3.26Å; E191-Y211 PolarHBondContact OE1-OH 3.13Å; E191-K214 IonicContact OE1-NZ 2.7Å; E191-K214 PolarHBondContact OE1-NZ 3.04Å; E191-V220 HydrophobicContact CB-CG2 3.99Å; E191-V220 HydrophobicContact CG-CG2 3.98Å
192	A	94.1	Very high	94.8	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	28%	0.281	C	S	.	.	H	α-helix	trans	-66.6	-41.5	176.1	0	0	0	0	0	112.2	P159 T190 A194 L195 I196 V220	P159-A192 HydrophobicContact CB-CB 3.66Å; P159-A192 HydrophobicContact CG-CB 3.84Å; T190-A192 PolarHBondContact O-N 2.93Å; A192-A194 VanDerWaalsContact C-N 3.29Å; A192-A194 PolarHBondContact O-N 3.46Å; A192-L195 WeakPolarHBondContact O-CB 3.17Å; A192-L195 PolarHBondContact O-N 3.32Å; A192-I196 VanDerWaalsContact O-CG1 3.32Å; A192-I196 WeakPolarHBondContact O-CG1 3.43Å; A192-I196 PolarHBondContact O-N 3.2Å; A192-I196 VanDerWaalsContact O-N 3.08Å; A192-V220 HydrophobicContact CB-CG2 4.12Å
193	V	94.4	Very high	94.6	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-68	-32.4	172.9	177.4	0	0	0	0	110.9	N155 L162 P188 T190 I196 S197	N155-V193 WeakPolarHBondContact OD1-CG1 3.37Å; L162-V193 HydrophobicContact CD2-CG1 4.45Å; L162-V193 HydrophobicContact CD2-CG2 4.36Å; P188-V193 HydrophobicContact CB-CB 4.3Å; P188-V193 HydrophobicContact CB-CG1 4.1Å; T190-V193 PolarHBondContact O-N 2.88Å; T190-V193 WeakPolarHBondContact OG1-CG2 3.27Å; T190-V193 PolarHBondContact OG1-N 3.34Å; V193-I196 PolarHBondContact O-N 3.29Å; V193-S197 VanDerWaalsContact O-CB 3.26Å; V193-S197 WeakPolarHBondContact O-CB 3.47Å; V193-S197 PolarHBondContact O-N 3.31Å; V193-S197 PolarHBondContact O-OG 2.99Å
194	A	94.7	Very high	94.5	Very high	25 Å²	25	49.4 Å²	49.4	21%	0.207	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-42.7	175.3	0	0	0	0	0	111.8	P188 T190 E191 A192 S197 K198	P188-A194 HydrophobicContact CB-CB 3.65Å; P188-A194 HydrophobicContact CG-CB 3.93Å; T190-A194 PolarHBondContact O-N 3.42Å; E191-A194 WeakPolarHBondContact O-CB 3.49Å; E191-A194 PolarHBondContact O-N 3.06Å; A192-A194 VanDerWaalsContact C-N 3.29Å; A192-A194 PolarHBondContact O-N 3.46Å; A194-S197 PolarHBondContact O-N 3.01Å; A194-K198 WeakPolarHBondContact O-CB 3.34Å; A194-K198 PolarHBondContact O-N 2.95Å
195	L	95.1	Very high	94.4	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.9	-51.7	172.9	177	113.4	0	0	0	111.4	E191 A192 S197 K198 Y199 V207 Y211 V220 V223 L224 L227	E191-L195 WeakPolarHBondContact O-CB 3.39Å; E191-L195 PolarHBondContact O-N 3.4Å; A192-L195 WeakPolarHBondContact O-CB 3.17Å; A192-L195 PolarHBondContact O-N 3.32Å; L195-S197 VanDerWaalsContact C-N 3.34Å; L195-S197 PolarHBondContact O-N 3.3Å; L195-K198 PolarHBondContact O-N 3.37Å; L195-Y199 PolarHBondContact O-N 3.44Å; L195-V207 HydrophobicContact CD1-CG1 3.6Å; L195-V207 HydrophobicContact CG-CG1 4.03Å; L195-Y211 HydrophobicContact CB-CE1 4.44Å; L195-Y211 HydrophobicContact CB-CE2 4.19Å; L195-Y211 HydrophobicContact CD1-CD1 3.92Å; L195-Y211 HydrophobicContact CD1-CD2 3.64Å; L195-Y211 HydrophobicContact CD1-CE1 3.88Å; L195-Y211 HydrophobicContact CD1-CE2 3.6Å; L195-Y211 HydrophobicContact CD1-CG 3.81Å; L195-Y211 HydrophobicContact CG-CE2 4.33Å; L195-Y211 PolarHBondContact N-OH 2.93Å; L195-V220 HydrophobicContact CD1-CG1 4.31Å; L195-V223 HydrophobicContact CD2-CB 3.91Å; L195-V223 HydrophobicContact CD2-CG1 3.34Å; L195-L224 HydrophobicContact CD1-CD1 4.08Å; L195-L224 HydrophobicContact CD1-CD2 3.47Å; L195-L224 VanDerWaalsContact CD1-CD2 3.47Å; L195-L224 HydrophobicContact CD1-CG 3.51Å; L195-L224 HydrophobicContact CD2-CG 4.26Å; L195-L227 HydrophobicContact CD2-CD1 3.89Å
196	I	95.9	Very high	94.4	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-42.3	-179.9	-62.5	161.8	0	0	0	110.9	P159 L162 A163 V166 A192 V193 K198 Y199 V200 V223	P159-I196 HydrophobicContact CB-CD1 4.36Å; P159-I196 WeakPolarHBondContact O-CD1 3.34Å; L162-I196 HydrophobicContact CB-CD1 4.17Å; L162-I196 HydrophobicContact CD2-CD1 4.02Å; L162-I196 HydrophobicContact CD2-CG2 4.28Å; L162-I196 HydrophobicContact CG-CD1 4.17Å; L162-I196 HydrophobicContact CG-CG2 4.22Å; A163-I196 HydrophobicContact CB-CD1 4.1Å; A163-I196 HydrophobicContact CB-CG1 4.28Å; V166-I196 HydrophobicContact CG1-CG2 4.36Å; V166-I196 HydrophobicContact CG2-CG2 3.9Å; A192-I196 VanDerWaalsContact O-CG1 3.32Å; A192-I196 WeakPolarHBondContact O-CG1 3.43Å; A192-I196 PolarHBondContact O-N 3.2Å; A192-I196 VanDerWaalsContact O-N 3.08Å; V193-I196 PolarHBondContact O-N 3.29Å; I196-K198 VanDerWaalsContact C-N 3.3Å; I196-K198 PolarHBondContact O-N 3.45Å; I196-Y199 WeakPolarHBondContact O-CB 3.44Å; I196-Y199 PolarHBondContact O-N 3.15Å; I196-V200 WeakPolarHBondContact O-CG2 3.46Å; I196-V200 PolarHBondContact O-N 3.35Å; I196-V223 HydrophobicContact CD1-CG1 3.97Å; I196-V223 HydrophobicContact CG1-CG1 3.7Å
197	S	95.6	Very high	94.3	Very high	14 Å²	14	54.9 Å²	54.9	10%	0.098	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-40.1	176.6	-60.4	0	0	0	0	111.5	V193 A194 L195 T201	V193-S197 VanDerWaalsContact O-CB 3.26Å; V193-S197 WeakPolarHBondContact O-CB 3.47Å; V193-S197 PolarHBondContact O-N 3.31Å; V193-S197 PolarHBondContact O-OG 2.99Å; A194-S197 PolarHBondContact O-N 3.01Å; L195-S197 VanDerWaalsContact C-N 3.34Å; L195-S197 PolarHBondContact O-N 3.3Å; S197-T201 WeakPolarHBondContact O-CB 3.27Å; S197-T201 VanDerWaalsContact O-CG2 3.28Å; S197-T201 WeakPolarHBondContact O-CG2 3.29Å; S197-T201 PolarHBondContact O-N 3.38Å; S197-T201 PolarHBondContact O-OG1 3.32Å
198	K	95.5	Very high	94.1	Very high	70 Å²	70	50.7 Å²	50.7	30%	0.304	27%	0.268	S	S	.	.	H	α-helix	trans	-66.2	-44.5	174.7	-174.7	176	-67.2	-151.8	0	111.4	A194 L195 I196 V200 T201 K202 V207 A210	A194-K198 WeakPolarHBondContact O-CB 3.34Å; A194-K198 PolarHBondContact O-N 2.95Å; L195-K198 PolarHBondContact O-N 3.37Å; I196-K198 VanDerWaalsContact C-N 3.3Å; I196-K198 PolarHBondContact O-N 3.45Å; K198-V200 VanDerWaalsContact C-N 3.34Å; K198-V200 PolarHBondContact O-N 3.02Å; K198-T201 PolarHBondContact O-N 2.97Å; K198-T201 PolarHBondContact O-OG1 3.49Å; K198-K202 HydrophobicContact CG-CB 4.33Å; K198-K202 HydrophobicContact CG-CG 4.42Å; K198-K202 WeakPolarHBondContact O-CB 2.96Å; K198-K202 PolarHBondContact O-N 3.1Å; K198-V207 HydrophobicContact CB-CG2 4.14Å; K198-V207 HydrophobicContact CD-CG2 4.26Å; K198-V207 HydrophobicContact CG-CG2 3.92Å; K198-A210 HydrophobicContact CD-CB 3.96Å
199	Y	96.4	Very high	94	Very high	24 Å²	24	51.8 Å²	51.8	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-54.3	-49.8	175.4	172.2	-104.7	0	0	0	111.6	T167 L195 I196 T201 G203 W204 L227 E231 K234	T167-Y199 HydrophobicContact CG2-CE1 3.95Å; L195-Y199 PolarHBondContact O-N 3.44Å; I196-Y199 WeakPolarHBondContact O-CB 3.44Å; I196-Y199 PolarHBondContact O-N 3.15Å; Y199-T201 PolarHBondContact O-N 3.26Å; Y199-G203 WeakPolarHBondContact O-CA 3.11Å; Y199-G203 PolarHBondContact O-N 3.44Å; Y199-W204 HydrophobicContact CD2-CB 4.38Å; Y199-W204 AromaticContact CD2-CE3 3.9Å; Y199-W204 HydrophobicContact CD2-CE3 3.9Å; Y199-W204 HydrophobicContact CE2-CB 4.18Å; Y199-W204 HydrophobicContact CE2-CE3 4.14Å; Y199-L227 HydrophobicContact CD1-CD1 4.31Å; Y199-L227 HydrophobicContact CD1-CD2 4.02Å; Y199-L227 HydrophobicContact CD2-CD1 4.32Å; Y199-L227 HydrophobicContact CE1-CD2 3.95Å; Y199-L227 HydrophobicContact CG-CD1 3.97Å; Y199-L227 HydrophobicContact CG-CD2 4.36Å; Y199-E231 HydrophobicContact CE2-CG 4.02Å; Y199-E231 WeakPolarHBondContact CE2-OE1 3.32Å; Y199-E231 PolarHBondContact OH-OE1 3.39Å; Y199-K234 PolarHBondContact OH-NZ 3.05Å; Y199-K234 VanDerWaalsContact OH-NZ 3.13Å
200	V	95.6	Very high	93.8	Very high	32 Å²	32	49.5 Å²	49.5	19%	0.194	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-38.8	-180	169.7	0	0	0	0	112.4	V166 H177 Q178 L181 I196 K198	V166-V200 HydrophobicContact CB-CG2 4.04Å; V166-V200 HydrophobicContact CG1-CG2 4.28Å; V166-V200 HydrophobicContact CG2-CG2 4.05Å; H177-V200 HydrophobicContact CB-CG1 3.51Å; H177-V200 HydrophobicContact CB-CG2 4.38Å; Q178-V200 HydrophobicContact CB-CG1 4.16Å; L181-V200 HydrophobicContact CD1-CB 4.11Å; L181-V200 HydrophobicContact CD1-CG1 3.89Å; I196-V200 WeakPolarHBondContact O-CG2 3.46Å; I196-V200 PolarHBondContact O-N 3.35Å; K198-V200 VanDerWaalsContact C-N 3.34Å; K198-V200 PolarHBondContact O-N 3.02Å
201	T	94.4	Very high	93.6	Very high	46 Å²	46	47.1 Å²	47.1	28%	0.282	25%	0.247	S	C	.	.	H	α-helix	trans	-90.7	-27.6	-171.2	55	0	0	0	0	114.5	Q178 L181 S197 K198 Y199	Q178-T201 HydrophobicContact CG-CG2 4.38Å; Q178-T201 PolarHBondContact NE2-O 3.29Å; L181-T201 HydrophobicContact CB-CG2 4.33Å; L181-T201 HydrophobicContact CD1-CG2 4.05Å; S197-T201 WeakPolarHBondContact O-CB 3.27Å; S197-T201 VanDerWaalsContact O-CG2 3.28Å; S197-T201 WeakPolarHBondContact O-CG2 3.29Å; S197-T201 PolarHBondContact O-N 3.38Å; S197-T201 PolarHBondContact O-OG1 3.32Å; K198-T201 PolarHBondContact O-N 2.97Å; K198-T201 PolarHBondContact O-OG1 3.49Å; Y199-T201 PolarHBondContact O-N 3.26Å
202	K	93.8	Very high	93.2	Very high	151 Å²	151	46 Å²	46	66%	0.657	25%	0.252	S	S	*	.	H	α-helix	trans	-124.9	-16.9	-172.8	-60	-62.3	-176.9	178.6	0	113.9	K198 E206	K198-K202 HydrophobicContact CG-CB 4.33Å; K198-K202 HydrophobicContact CG-CG 4.42Å; K198-K202 WeakPolarHBondContact O-CB 2.96Å; K198-K202 PolarHBondContact O-N 3.1Å; K202-E206 HydrophobicContact CB-CB 3.81Å; K202-E206 HydrophobicContact CB-CG 4.01Å
203	G	93.7	Very high	92.4	Very high	29 Å²	29	53.6 Å²	53.6	30%	0.299	29%	0.293	S	S	.	.			trans	89	174.7	-179.5	0	0	0	0	0	114.1	Y199 V207	Y199-G203 WeakPolarHBondContact O-CA 3.11Å; Y199-G203 PolarHBondContact O-N 3.44Å; G203-V207 PolarHBondContact O-N 3.37Å
204	W	93.6	Very high	91.8	Very high	32 Å²	32	58.6 Å²	58.6	12%	0.121	31%	0.314	C	S	.	.	H	α-helix	trans	-65.2	-42.6	-170.1	-177.1	-122.7	0	0	0	114.8	Y199 E206 V207 Q208 L224 L227 E228 E231	Y199-W204 HydrophobicContact CD2-CB 4.38Å; Y199-W204 AromaticContact CD2-CE3 3.9Å; Y199-W204 HydrophobicContact CD2-CE3 3.9Å; Y199-W204 HydrophobicContact CE2-CB 4.18Å; Y199-W204 HydrophobicContact CE2-CE3 4.14Å; W204-E206 VanDerWaalsContact C-N 3.27Å; W204-E206 PolarHBondContact O-N 3.03Å; W204-V207 HydrophobicContact CE3-CB 4.27Å; W204-V207 HydrophobicContact CE3-CG1 4.31Å; W204-V207 HydrophobicContact CZ3-CB 4.49Å; W204-V207 HydrophobicContact CZ3-CG1 4.04Å; W204-V207 WeakPolarHBondContact O-CA 3.49Å; W204-V207 WeakPolarHBondContact O-CB 3.4Å; W204-V207 PolarHBondContact O-N 3.02Å; W204-Q208 HydrophobicContact CD2-CG 4.16Å; W204-Q208 HydrophobicContact CG-CG 4.46Å; W204-Q208 HydrophobicContact CZ2-CG 3.83Å; W204-Q208 PolarHBondContact O-N 3.2Å; W204-L224 HydrophobicContact CH2-CD2 4.1Å; W204-L224 WeakPolarHBondContact CH2-O 3.19Å; W204-L224 HydrophobicContact CZ3-CD2 4.33Å; W204-L227 HydrophobicContact CE3-CB 4.1Å; W204-L227 HydrophobicContact CH2-CB 4.09Å; W204-L227 HydrophobicContact CZ3-CB 3.45Å; W204-L227 VanDerWaalsContact CZ3-CB 3.45Å; W204-L227 HydrophobicContact CZ3-CD1 4.41Å; W204-E228 HydrophobicContact CH2-CB 3.69Å; W204-E228 HydrophobicContact CZ2-CB 3.45Å; W204-E228 VanDerWaalsContact CZ2-CB 3.45Å; W204-E228 HydrophobicContact CZ2-CG 3.86Å; W204-E231 HydrophobicContact CB-CG 3.81Å; W204-E231 HydrophobicContact CD2-CB 4.33Å; W204-E231 HydrophobicContact CD2-CG 3.84Å; W204-E231 HydrophobicContact CE3-CG 4.33Å; W204-E231 HydrophobicContact CG-CB 4.09Å; W204-E231 HydrophobicContact CG-CG 3.58Å
205	K	92.4	Very high	91	Very high	177 Å²	177	67 Å²	67	77%	0.77	35%	0.349	S	S	*	.	H	α-helix	trans	-57.6	-40.5	-177.9	-65.1	-174.7	178.9	-177.8	0	112.6	V207 Q208 A209	K205-V207 VanDerWaalsContact C-N 3.33Å; K205-Q208 PolarHBondContact O-N 3.17Å; K205-A209 PolarHBondContact O-N 3.01Å
206	E	92.8	Very high	90.5	Very high	108 Å²	108	71.1 Å²	71.1	51%	0.505	37%	0.367	S	S	.	.	H	α-helix	trans	-70.5	-30	178.3	-72.3	-74.2	177.1	0	0	112.5	K202 W204 A210	K202-E206 HydrophobicContact CB-CB 3.81Å; K202-E206 HydrophobicContact CB-CG 4.01Å; W204-E206 VanDerWaalsContact C-N 3.27Å; W204-E206 PolarHBondContact O-N 3.03Å; E206-A210 WeakPolarHBondContact O-CB 3.18Å; E206-A210 PolarHBondContact O-N 3.16Å; E206-A210 VanDerWaalsContact O-N 3.09Å
207	V	92.8	Very high	90.2	Very high	0 Å²	0	74 Å²	74	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-70.3	-46.1	172.3	174.9	0	0	0	0	110.2	L195 K198 G203 W204 K205 A209 A210 Y211 L224	L195-V207 HydrophobicContact CD1-CG1 3.6Å; L195-V207 HydrophobicContact CG-CG1 4.03Å; K198-V207 HydrophobicContact CB-CG2 4.14Å; K198-V207 HydrophobicContact CD-CG2 4.26Å; K198-V207 HydrophobicContact CG-CG2 3.92Å; G203-V207 PolarHBondContact O-N 3.37Å; W204-V207 HydrophobicContact CE3-CB 4.27Å; W204-V207 HydrophobicContact CE3-CG1 4.31Å; W204-V207 HydrophobicContact CZ3-CB 4.49Å; W204-V207 HydrophobicContact CZ3-CG1 4.04Å; W204-V207 WeakPolarHBondContact O-CA 3.49Å; W204-V207 WeakPolarHBondContact O-CB 3.4Å; W204-V207 PolarHBondContact O-N 3.02Å; K205-V207 VanDerWaalsContact C-N 3.33Å; V207-A209 VanDerWaalsContact C-N 3.34Å; V207-A209 PolarHBondContact O-N 3.23Å; V207-A210 PolarHBondContact O-N 3.17Å; V207-Y211 HydrophobicContact CG1-CD2 4.1Å; V207-Y211 WeakPolarHBondContact O-CD2 3.46Å; V207-Y211 PolarHBondContact O-N 2.87Å; V207-Y211 VanDerWaalsContact O-N 3.08Å; V207-L224 HydrophobicContact CG1-CD2 3.86Å
208	Q	90.9	Very high	89.9	Confident	87 Å²	87	79.8 Å²	79.8	41%	0.407	41%	0.413	S	S	.	.	H	α-helix	trans	-57.5	-47.5	177.1	-69.5	-179.1	-51.1	0	0	111.5	W204 K205 A210 Y211 A212	W204-Q208 HydrophobicContact CD2-CG 4.16Å; W204-Q208 HydrophobicContact CG-CG 4.46Å; W204-Q208 HydrophobicContact CZ2-CG 3.83Å; W204-Q208 PolarHBondContact O-N 3.2Å; K205-Q208 PolarHBondContact O-N 3.17Å; Q208-A210 PolarHBondContact O-N 3.36Å; Q208-Y211 PolarHBondContact O-N 2.96Å; Q208-A212 PolarHBondContact O-N 2.99Å
209	A	91.3	Very high	89.6	Confident	70 Å²	70	81.9 Å²	81.9	58%	0.579	42%	0.424	S	S	*	.	H	α-helix	trans	-62.6	-43	177.8	0	0	0	0	0	112.6	K205 V207 Y211	K205-A209 PolarHBondContact O-N 3.01Å; V207-A209 VanDerWaalsContact C-N 3.34Å; V207-A209 PolarHBondContact O-N 3.23Å; A209-Y211 VanDerWaalsContact C-N 3.29Å; A209-Y211 PolarHBondContact O-N 3.24Å
210	A	89.4	Confident	89.3	Confident	25 Å²	25	80.8 Å²	80.8	21%	0.207	42%	0.42	C	S	.	.	H	α-helix	trans	-72.7	-19.5	-176.7	0	0	0	0	0	114.6	K198 E206 V207 Q208 K214	K198-A210 HydrophobicContact CD-CB 3.96Å; E206-A210 WeakPolarHBondContact O-CB 3.18Å; E206-A210 PolarHBondContact O-N 3.16Å; E206-A210 VanDerWaalsContact O-N 3.09Å; V207-A210 PolarHBondContact O-N 3.17Å; Q208-A210 PolarHBondContact O-N 3.36Å; A210-K214 WeakPolarHBondContact O-CD 3.4Å; A210-K214 WeakPolarHBondContact O-CE 3.25Å
211	Y	89.4	Confident	89.1	Confident	10 Å²	10	82.7 Å²	82.7	4%	0.039	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	14.7	-176.3	-69.9	-94.4	0	0	0	112.6	E191 L195 V207 Q208 A209 K214 K216 V220	E191-Y211 HydrophobicContact CG-CE1 4.02Å; E191-Y211 WeakPolarHBondContact OE1-CE1 3.26Å; E191-Y211 PolarHBondContact OE1-OH 3.13Å; L195-Y211 HydrophobicContact CB-CE1 4.44Å; L195-Y211 HydrophobicContact CB-CE2 4.19Å; L195-Y211 HydrophobicContact CD1-CD1 3.92Å; L195-Y211 HydrophobicContact CD1-CD2 3.64Å; L195-Y211 HydrophobicContact CD1-CE1 3.88Å; L195-Y211 HydrophobicContact CD1-CE2 3.6Å; L195-Y211 HydrophobicContact CD1-CG 3.81Å; L195-Y211 HydrophobicContact CG-CE2 4.33Å; L195-Y211 PolarHBondContact N-OH 2.93Å; V207-Y211 HydrophobicContact CG1-CD2 4.1Å; V207-Y211 WeakPolarHBondContact O-CD2 3.46Å; V207-Y211 PolarHBondContact O-N 2.87Å; V207-Y211 VanDerWaalsContact O-N 3.08Å; Q208-Y211 PolarHBondContact O-N 2.96Å; A209-Y211 VanDerWaalsContact C-N 3.29Å; A209-Y211 PolarHBondContact O-N 3.24Å; Y211-K214 HydrophobicContact CD1-CD 4.23Å; Y211-K214 HydrophobicContact CE1-CD 4.37Å; Y211-K216 WeakPolarHBondContact O-CE 3.45Å; Y211-K216 PolarHBondContact O-NZ 3.39Å; Y211-V220 HydrophobicContact CD1-CG1 4.15Å; Y211-V220 HydrophobicContact CE1-CG1 4.13Å
212	A	84.9	Confident	89	Confident	60 Å²	60	85.8 Å²	85.8	50%	0.496	44%	0.441	S	S	.	.	S	Bend	trans	-64.3	-51.1	176.1	0	0	0	0	0	111.5	Q208	Q208-A212 PolarHBondContact O-N 2.99Å
213	D	78	Confident	89	Confident	163 Å²	163	78.7 Å²	78.7	87%	0.872	41%	0.41	S	S	*	.	S	Bend	trans	-109	7.7	-170.2	-53.5	-50.6	0	0	0	114.1
214	K	81.6	Confident	89	Confident	106 Å²	106	78.2 Å²	78.2	46%	0.461	40%	0.4	S	S	.	.	S	Bend	trans	-84.4	142.7	179.5	-75.5	-169.8	175.6	-170.1	0	111.5	E191 A210 Y211 K216	E191-K214 IonicContact OE1-NZ 2.7Å; E191-K214 PolarHBondContact OE1-NZ 3.04Å; A210-K214 WeakPolarHBondContact O-CD 3.4Å; A210-K214 WeakPolarHBondContact O-CE 3.25Å; Y211-K214 HydrophobicContact CD1-CD 4.23Å; Y211-K214 HydrophobicContact CE1-CD 4.37Å; K214-K216 WeakPolarHBondContact O-CG 3.42Å; K214-K216 PolarHBondContact O-N 3.46Å
215	E	78.7	Confident	88.9	Confident	201 Å²	201	79.2 Å²	79.2	94%	0.939	41%	0.412	S	S	*	.			trans	-63.8	125.5	163.3	-167.4	173.4	-171.8	0	0	109.3
216	K	84.6	Confident	89	Confident	86 Å²	86	72 Å²	72	37%	0.374	38%	0.38	S	S	.	.			trans	-111	128.9	-172.7	-64.2	162.6	-171.9	173.5	0	109.1	Y211 K214 V220 V221 L224	Y211-K216 WeakPolarHBondContact O-CE 3.45Å; Y211-K216 PolarHBondContact O-NZ 3.39Å; K214-K216 WeakPolarHBondContact O-CG 3.42Å; K214-K216 PolarHBondContact O-N 3.46Å; K216-V220 HydrophobicContact CB-CB 4.49Å; K216-V220 HydrophobicContact CB-CG1 4.38Å; K216-V220 HydrophobicContact CG-CG1 4.32Å; K216-V221 HydrophobicContact CB-CG2 3.51Å; K216-V221 HydrophobicContact CD-CG2 4.11Å; K216-V221 HydrophobicContact CG-CG2 4.41Å; K216-L224 HydrophobicContact CD-CD1 3.7Å; K216-L224 HydrophobicContact CG-CD1 4.33Å
217	S	88.2	Confident	89.1	Confident	62 Å²	62	66.9 Å²	66.9	43%	0.434	36%	0.356	S	S	.	.			trans	-66.6	157.7	164.9	66.9	0	0	0	0	110.4	E219 V220 V221	S217-E219 PolarHBondContact O-N 3.16Å; S217-V220 PolarHBondContact O-N 2.95Å; S217-V220 VanDerWaalsContact OG-CG2 3.28Å; S217-V220 WeakPolarHBondContact OG-CG2 3.35Å; S217-V220 PolarHBondContact OG-N 3.45Å; S217-V221 WeakPolarHBondContact O-CG2 3.42Å; S217-V221 PolarHBondContact O-N 3.11Å
218	E	89.3	Confident	89.1	Confident	137 Å²	137	71.7 Å²	71.7	64%	0.64	38%	0.379	S	S	*	.	H	α-helix	trans	-54.6	-39.6	179.8	-166.5	-169.9	152.7	0	0	112.4	V221 K222	E218-V221 PolarHBondContact O-N 3.44Å; E218-K222 WeakPolarHBondContact O-CG 3.34Å; E218-K222 PolarHBondContact O-N 3.41Å; E218-K222 VanDerWaalsContact OE1-CE 3.24Å; E218-K222 WeakPolarHBondContact OE1-CE 3.49Å; E218-K222 IonicContact OE1-NZ 3.33Å; E218-K222 PolarHBondContact OE1-NZ 2.97Å
219	E	89.2	Confident	89.2	Confident	113 Å²	113	68.1 Å²	68.1	53%	0.528	36%	0.363	S	S	.	.	H	α-helix	trans	-62.6	-43.4	176.1	-66.1	178.9	179.4	0	0	112.5	S217 V221 K222 V223	S217-E219 PolarHBondContact O-N 3.16Å; E219-V221 VanDerWaalsContact C-N 3.33Å; E219-V221 PolarHBondContact O-N 3.33Å; E219-K222 PolarHBondContact O-N 3.29Å; E219-V223 WeakPolarHBondContact O-CG2 3.47Å; E219-V223 PolarHBondContact O-N 3.4Å
220	V	90.8	Very high	89.2	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.012	34%	0.336	C	S	.	.	H	α-helix	trans	-66.5	-37.9	178.8	175	0	0	0	0	110.6	E191 A192 L195 Y211 K216 S217 V223 L224	E191-V220 HydrophobicContact CB-CG2 3.99Å; E191-V220 HydrophobicContact CG-CG2 3.98Å; A192-V220 HydrophobicContact CB-CG2 4.12Å; L195-V220 HydrophobicContact CD1-CG1 4.31Å; Y211-V220 HydrophobicContact CD1-CG1 4.15Å; Y211-V220 HydrophobicContact CE1-CG1 4.13Å; K216-V220 HydrophobicContact CB-CB 4.49Å; K216-V220 HydrophobicContact CB-CG1 4.38Å; K216-V220 HydrophobicContact CG-CG1 4.32Å; S217-V220 PolarHBondContact O-N 2.95Å; S217-V220 VanDerWaalsContact OG-CG2 3.28Å; S217-V220 WeakPolarHBondContact OG-CG2 3.35Å; S217-V220 PolarHBondContact OG-N 3.45Å; V220-V223 PolarHBondContact O-N 3.16Å; V220-L224 HydrophobicContact CG1-CD1 3.93Å; V220-L224 HydrophobicContact CG1-CG 4.46Å; V220-L224 VanDerWaalsContact O-CB 3.3Å; V220-L224 WeakPolarHBondContact O-CB 3.44Å; V220-L224 WeakPolarHBondContact O-CG 3.2Å; V220-L224 PolarHBondContact O-N 2.79Å
221	V	91.8	Very high	89.4	Confident	71 Å²	71	64.8 Å²	64.8	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-45.7	174.8	176.7	0	0	0	0	111.1	K216 S217 E218 E219 V223 L224 S225	K216-V221 HydrophobicContact CB-CG2 3.51Å; K216-V221 HydrophobicContact CD-CG2 4.11Å; K216-V221 HydrophobicContact CG-CG2 4.41Å; S217-V221 WeakPolarHBondContact O-CG2 3.42Å; S217-V221 PolarHBondContact O-N 3.11Å; E218-V221 PolarHBondContact O-N 3.44Å; E219-V221 VanDerWaalsContact C-N 3.33Å; E219-V221 PolarHBondContact O-N 3.33Å; V221-V223 PolarHBondContact O-N 3Å; V221-L224 PolarHBondContact O-N 3.27Å; V221-S225 WeakPolarHBondContact O-CB 3.39Å; V221-S225 PolarHBondContact O-N 3.44Å
222	K	92.3	Very high	89.5	Confident	112 Å²	112	69 Å²	69	49%	0.487	35%	0.35	S	S	.	.	H	α-helix	trans	-59.8	-46.1	177.7	-72.9	173.3	-175.7	167.6	0	111.8	E218 E219 S225 Y226	E218-K222 WeakPolarHBondContact O-CG 3.34Å; E218-K222 PolarHBondContact O-N 3.41Å; E218-K222 VanDerWaalsContact OE1-CE 3.24Å; E218-K222 WeakPolarHBondContact OE1-CE 3.49Å; E218-K222 IonicContact OE1-NZ 3.33Å; E218-K222 PolarHBondContact OE1-NZ 2.97Å; E219-K222 PolarHBondContact O-N 3.29Å; K222-S225 PolarHBondContact O-N 3.45Å; K222-Y226 WeakPolarHBondContact O-CB 3.47Å; K222-Y226 PolarHBondContact O-N 3.14Å
223	V	93.3	Very high	89.8	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.012	33%	0.326	C	S	.	.	H	α-helix	trans	-68	-40.3	179	-179.6	0	0	0	0	111.7	P159 A163 L195 I196 E219 V220 V221 Y226 L227	P159-V223 HydrophobicContact CB-CG2 3.81Å; A163-V223 HydrophobicContact CB-CG1 3.96Å; L195-V223 HydrophobicContact CD2-CB 3.91Å; L195-V223 HydrophobicContact CD2-CG1 3.34Å; I196-V223 HydrophobicContact CD1-CG1 3.97Å; I196-V223 HydrophobicContact CG1-CG1 3.7Å; E219-V223 WeakPolarHBondContact O-CG2 3.47Å; E219-V223 PolarHBondContact O-N 3.4Å; V220-V223 PolarHBondContact O-N 3.16Å; V221-V223 PolarHBondContact O-N 3Å; V223-Y226 PolarHBondContact O-N 3.07Å; V223-L227 HydrophobicContact CG1-CD1 4.06Å; V223-L227 HydrophobicContact CG1-CG 4.31Å; V223-L227 WeakPolarHBondContact O-CB 3.46Å; V223-L227 WeakPolarHBondContact O-CG 3.29Å; V223-L227 PolarHBondContact O-N 2.89Å
224	L	93	Very high	90.2	Very high	18 Å²	18	59.9 Å²	59.9	9%	0.094	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-50.5	174.3	-89.4	166.9	0	0	0	111.6	L195 W204 V207 K216 V220 V221 Y226 L227 E228	L195-L224 HydrophobicContact CD1-CD1 4.08Å; L195-L224 HydrophobicContact CD1-CD2 3.47Å; L195-L224 VanDerWaalsContact CD1-CD2 3.47Å; L195-L224 HydrophobicContact CD1-CG 3.51Å; L195-L224 HydrophobicContact CD2-CG 4.26Å; W204-L224 HydrophobicContact CH2-CD2 4.1Å; W204-L224 WeakPolarHBondContact CH2-O 3.19Å; W204-L224 HydrophobicContact CZ3-CD2 4.33Å; V207-L224 HydrophobicContact CG1-CD2 3.86Å; K216-L224 HydrophobicContact CD-CD1 3.7Å; K216-L224 HydrophobicContact CG-CD1 4.33Å; V220-L224 HydrophobicContact CG1-CD1 3.93Å; V220-L224 HydrophobicContact CG1-CG 4.46Å; V220-L224 VanDerWaalsContact O-CB 3.3Å; V220-L224 WeakPolarHBondContact O-CB 3.44Å; V220-L224 WeakPolarHBondContact O-CG 3.2Å; V220-L224 PolarHBondContact O-N 2.79Å; V221-L224 PolarHBondContact O-N 3.27Å; L224-Y226 VanDerWaalsContact C-N 3.31Å; L224-Y226 PolarHBondContact O-N 2.93Å; L224-L227 PolarHBondContact O-N 3.5Å; L224-E228 VanDerWaalsContact O-CB 3.3Å; L224-E228 WeakPolarHBondContact O-CB 3.49Å; L224-E228 PolarHBondContact O-N 2.76Å
225	S	92.6	Very high	90.5	Very high	54 Å²	54	61.8 Å²	61.8	38%	0.378	30%	0.302	S	S	.	.	H	α-helix	trans	-58.6	-44.4	178.2	172.7	0	0	0	0	111.2	V221 K222 E228 V229	V221-S225 WeakPolarHBondContact O-CB 3.39Å; V221-S225 PolarHBondContact O-N 3.44Å; K222-S225 PolarHBondContact O-N 3.45Å; S225-E228 PolarHBondContact O-N 2.85Å; S225-V229 VanDerWaalsContact O-CG2 3.26Å; S225-V229 WeakPolarHBondContact O-CG2 3.29Å; S225-V229 PolarHBondContact O-N 2.78Å
226	Y	94.2	Very high	90.9	Very high	25 Å²	25	52.8 Å²	52.8	10%	0.098	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-47	176.6	177.8	-95.7	0	0	0	112.9	L160 A163 A164 K222 V223 L224 E228 V229 V230 L251 Q255	L160-Y226 HydrophobicContact CD1-CD1 4.37Å; L160-Y226 HydrophobicContact CD1-CD2 4.17Å; L160-Y226 HydrophobicContact CD1-CG 3.86Å; A163-Y226 HydrophobicContact CB-CD1 3.87Å; A163-Y226 HydrophobicContact CB-CE1 4.07Å; A164-Y226 WeakPolarHBondContact CA-OH 3.34Å; A164-Y226 HydrophobicContact CB-CE1 4.44Å; K222-Y226 WeakPolarHBondContact O-CB 3.47Å; K222-Y226 PolarHBondContact O-N 3.14Å; V223-Y226 PolarHBondContact O-N 3.07Å; L224-Y226 VanDerWaalsContact C-N 3.31Å; L224-Y226 PolarHBondContact O-N 2.93Å; Y226-E228 VanDerWaalsContact C-N 3.32Å; Y226-E228 PolarHBondContact O-N 3.17Å; Y226-V229 WeakPolarHBondContact O-CB 3.48Å; Y226-V229 PolarHBondContact O-N 2.73Å; Y226-V230 HydrophobicContact CD1-CG2 4.36Å; Y226-V230 HydrophobicContact CE1-CG2 3.88Å; Y226-V230 HydrophobicContact CE2-CG2 4.46Å; Y226-V230 WeakPolarHBondContact O-CG2 3.45Å; Y226-V230 PolarHBondContact O-N 2.68Å; Y226-L251 HydrophobicContact CE2-CD2 4.21Å; Y226-Q255 PolarHBondContact OH-NE2 3.25Å
227	L	94.3	Very high	90.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.3	-34.9	178.9	-70.7	178.2	0	0	0	112.1	A163 T167 L195 Y199 W204 V223 L224 V230 E231	A163-L227 HydrophobicContact CB-CD2 4.23Å; T167-L227 HydrophobicContact CG2-CD2 3.82Å; L195-L227 HydrophobicContact CD2-CD1 3.89Å; Y199-L227 HydrophobicContact CD1-CD1 4.31Å; Y199-L227 HydrophobicContact CD1-CD2 4.02Å; Y199-L227 HydrophobicContact CD2-CD1 4.32Å; Y199-L227 HydrophobicContact CE1-CD2 3.95Å; Y199-L227 HydrophobicContact CG-CD1 3.97Å; Y199-L227 HydrophobicContact CG-CD2 4.36Å; W204-L227 HydrophobicContact CE3-CB 4.1Å; W204-L227 HydrophobicContact CH2-CB 4.09Å; W204-L227 HydrophobicContact CZ3-CB 3.45Å; W204-L227 VanDerWaalsContact CZ3-CB 3.45Å; W204-L227 HydrophobicContact CZ3-CD1 4.41Å; V223-L227 HydrophobicContact CG1-CD1 4.06Å; V223-L227 HydrophobicContact CG1-CG 4.31Å; V223-L227 WeakPolarHBondContact O-CB 3.46Å; V223-L227 WeakPolarHBondContact O-CG 3.29Å; V223-L227 PolarHBondContact O-N 2.89Å; L224-L227 PolarHBondContact O-N 3.5Å; L227-V230 PolarHBondContact O-N 3.47Å; L227-E231 WeakPolarHBondContact O-CG 3.45Å; L227-E231 PolarHBondContact O-N 3.5Å
228	E	93.7	Very high	91	Very high	102 Å²	102	55.7 Å²	55.7	48%	0.477	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-46.3	173.7	-176.5	167.6	-152.7	0	0	111	W204 L224 S225 Y226 V230 E231 K232	W204-E228 HydrophobicContact CH2-CB 3.69Å; W204-E228 HydrophobicContact CZ2-CB 3.45Å; W204-E228 VanDerWaalsContact CZ2-CB 3.45Å; W204-E228 HydrophobicContact CZ2-CG 3.86Å; L224-E228 VanDerWaalsContact O-CB 3.3Å; L224-E228 WeakPolarHBondContact O-CB 3.49Å; L224-E228 PolarHBondContact O-N 2.76Å; S225-E228 PolarHBondContact O-N 2.85Å; Y226-E228 VanDerWaalsContact C-N 3.32Å; Y226-E228 PolarHBondContact O-N 3.17Å; E228-V230 PolarHBondContact O-N 3.06Å; E228-E231 PolarHBondContact O-N 3.47Å; E228-K232 VanDerWaalsContact O-CB 3.24Å; E228-K232 WeakPolarHBondContact O-CB 3.27Å; E228-K232 PolarHBondContact O-N 3.33Å
229	V	93.2	Very high	91	Very high	12 Å²	12	53.4 Å²	53.4	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-58.6	-48.3	175.1	165	0	0	0	0	111.2	S225 Y226 E231 K232 V233 L245 H249 L251	S225-V229 VanDerWaalsContact O-CG2 3.26Å; S225-V229 WeakPolarHBondContact O-CG2 3.29Å; S225-V229 PolarHBondContact O-N 2.78Å; Y226-V229 WeakPolarHBondContact O-CB 3.48Å; Y226-V229 PolarHBondContact O-N 2.73Å; V229-E231 VanDerWaalsContact C-N 3.26Å; V229-E231 PolarHBondContact O-N 3.29Å; V229-K232 WeakPolarHBondContact O-CB 3.4Å; V229-K232 PolarHBondContact O-N 2.93Å; V229-V233 WeakPolarHBondContact O-CG2 3.45Å; V229-V233 PolarHBondContact O-N 2.88Å; V229-L245 HydrophobicContact CG1-CB 4.29Å; V229-L245 HydrophobicContact CG1-CD2 4.09Å; V229-L245 HydrophobicContact CG2-CD2 4.34Å; V229-H249 HydrophobicContact CG1-CB 4.07Å; V229-H249 VanDerWaalsContact CG2-NE2 3.33Å; V229-H249 WeakPolarHBondContact CG2-NE2 3.35Å; V229-L251 HydrophobicContact CG1-CD1 4.03Å
230	V	91.8	Very high	91	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-37.2	179.3	170.7	0	0	0	0	111.5	T167 Y226 L227 E228 K234 L251	T167-V230 HydrophobicContact CG2-CG1 3.89Å; Y226-V230 HydrophobicContact CD1-CG2 4.36Å; Y226-V230 HydrophobicContact CE1-CG2 3.88Å; Y226-V230 HydrophobicContact CE2-CG2 4.46Å; Y226-V230 WeakPolarHBondContact O-CG2 3.45Å; Y226-V230 PolarHBondContact O-N 2.68Å; L227-V230 PolarHBondContact O-N 3.47Å; E228-V230 PolarHBondContact O-N 3.06Å; V230-K234 WeakPolarHBondContact O-CG 3.4Å; V230-L251 HydrophobicContact CG2-CD2 3.94Å
231	E	92.8	Very high	91	Very high	24 Å²	24	55.2 Å²	55.2	11%	0.112	29%	0.288	C	S	.	.	H	α-helix	trans	-74.9	-38.9	175.6	-71	-62.3	139.7	0	0	112.5	Y199 W204 L227 E228 V229 V233 K234 H235	Y199-E231 HydrophobicContact CE2-CG 4.02Å; Y199-E231 WeakPolarHBondContact CE2-OE1 3.32Å; Y199-E231 PolarHBondContact OH-OE1 3.39Å; W204-E231 HydrophobicContact CB-CG 3.81Å; W204-E231 HydrophobicContact CD2-CB 4.33Å; W204-E231 HydrophobicContact CD2-CG 3.84Å; W204-E231 HydrophobicContact CE3-CG 4.33Å; W204-E231 HydrophobicContact CG-CB 4.09Å; W204-E231 HydrophobicContact CG-CG 3.58Å; L227-E231 WeakPolarHBondContact O-CG 3.45Å; L227-E231 PolarHBondContact O-N 3.5Å; E228-E231 PolarHBondContact O-N 3.47Å; V229-E231 VanDerWaalsContact C-N 3.26Å; V229-E231 PolarHBondContact O-N 3.29Å; E231-V233 VanDerWaalsContact C-N 3.32Å; E231-V233 PolarHBondContact O-N 3.34Å; E231-K234 PolarHBondContact O-N 2.95Å; E231-K234 VanDerWaalsContact O-N 3.13Å; E231-K234 IonicContact OE1-NZ 3.14Å; E231-K234 PolarHBondContact OE1-NZ 3.14Å; E231-H235 PolarHBondContact O-N 2.7Å; E231-H235 PolarHBondContact O-ND1 2.79Å; E231-H235 IonicContact OE2-CE1 2.92Å
232	K	91.6	Very high	91	Very high	97 Å²	97	51.9 Å²	51.9	42%	0.422	27%	0.267	S	S	.	.	H	α-helix	trans	-58.9	-44.8	176.4	-169.7	179.6	-175.2	-155	0	111	E228 V229 K234 H235 S236 E241 L245	E228-K232 VanDerWaalsContact O-CB 3.24Å; E228-K232 WeakPolarHBondContact O-CB 3.27Å; E228-K232 PolarHBondContact O-N 3.33Å; V229-K232 WeakPolarHBondContact O-CB 3.4Å; V229-K232 PolarHBondContact O-N 2.93Å; K232-K234 VanDerWaalsContact C-N 3.31Å; K232-K234 PolarHBondContact O-N 3.32Å; K232-H235 PolarHBondContact O-N 2.92Å; K232-H235 VanDerWaalsContact O-N 3.11Å; K232-S236 WeakPolarHBondContact O-CB 3.37Å; K232-S236 PolarHBondContact O-N 2.64Å; K232-E241 WeakPolarHBondContact CE-OE1 3.35Å; K232-E241 IonicContact NZ-OE1 3.29Å; K232-E241 PolarHBondContact NZ-OE1 3.09Å; K232-L245 HydrophobicContact CB-CD1 4.41Å; K232-L245 HydrophobicContact CD-CD1 4.06Å; K232-L245 HydrophobicContact CG-CD1 4.19Å
233	V	91.6	Very high	90.8	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-56.7	-44.5	174.9	169.4	0	0	0	0	111.4	V229 E231 H235 S236 V242 L245 L251 L256 H260	V229-V233 WeakPolarHBondContact O-CG2 3.45Å; V229-V233 PolarHBondContact O-N 2.88Å; E231-V233 VanDerWaalsContact C-N 3.32Å; E231-V233 PolarHBondContact O-N 3.34Å; V233-H235 PolarHBondContact O-N 3.1Å; V233-S236 PolarHBondContact O-N 2.96Å; V233-V242 HydrophobicContact CG1-CG1 4.26Å; V233-L245 HydrophobicContact CG2-CB 3.73Å; V233-L245 HydrophobicContact CG2-CD1 3.5Å; V233-L245 VanDerWaalsContact CG2-CD1 3.5Å; V233-L245 HydrophobicContact CG2-CG 4.25Å; V233-L251 HydrophobicContact CB-CD1 4.45Å; V233-L251 HydrophobicContact CG2-CD1 3.59Å; V233-L256 HydrophobicContact CG1-CD2 3.55Å; V233-H260 PolarHBondContact O-CE1 3.1Å; V233-H260 PolarHBondContact O-NE2 3.26Å
234	K	87	Confident	90.7	Very high	32 Å²	32	48.5 Å²	48.5	14%	0.139	26%	0.263	C	S	.	.	H	α-helix	trans	-65.8	-22.1	180	-66.1	170.2	-162.5	163.8	0	114.1	Y199 V230 E231 K232 L257	Y199-K234 PolarHBondContact OH-NZ 3.05Å; Y199-K234 VanDerWaalsContact OH-NZ 3.13Å; V230-K234 WeakPolarHBondContact O-CG 3.4Å; E231-K234 PolarHBondContact O-N 2.95Å; E231-K234 VanDerWaalsContact O-N 3.13Å; E231-K234 IonicContact OE1-NZ 3.14Å; E231-K234 PolarHBondContact OE1-NZ 3.14Å; K232-K234 VanDerWaalsContact C-N 3.31Å; K232-K234 PolarHBondContact O-N 3.32Å; K234-L257 WeakPolarHBondContact O-CD1 3.48Å
235	H	87.3	Confident	90.6	Very high	145 Å²	145	48.3 Å²	48.3	67%	0.671	26%	0.263	S	S	*	.	H	α-helix	trans	-106	-10.9	-178.4	-63.2	87.2	0	0	0	112.9	E231 K232 V233	E231-H235 PolarHBondContact O-N 2.7Å; E231-H235 PolarHBondContact O-ND1 2.79Å; E231-H235 IonicContact OE2-CE1 2.92Å; K232-H235 PolarHBondContact O-N 2.92Å; K232-H235 VanDerWaalsContact O-N 3.11Å; V233-H235 PolarHBondContact O-N 3.1Å
236	S	87.4	Confident	90.5	Very high	13 Å²	13	45.8 Å²	45.8	9%	0.091	25%	0.245	C	C	.	.			trans	-82.2	134.8	175.9	-171.3	0	0	0	0	111.1	K232 V233 D238 E241 H260	K232-S236 WeakPolarHBondContact O-CB 3.37Å; K232-S236 PolarHBondContact O-N 2.64Å; V233-S236 PolarHBondContact O-N 2.96Å; S236-D238 PolarHBondContact OG-N 3.1Å; S236-E241 VanDerWaalsContact CB-OE2 3.26Å; S236-E241 WeakPolarHBondContact CB-OE2 3.28Å; S236-E241 PolarHBondContact OG-OE2 3.49Å; S236-H260 PolarHBondContact O-NE2 3.28Å
237	C	84.8	Confident	90.2	Very high	125 Å²	125	49 Å²	49	85%	0.845	26%	0.26	S	S	*	.			trans	-102.4	-2.1	168.9	-62.2	0	0	0	0	111.7
238	D	89.5	Confident	89.9	Confident	83 Å²	83	55.8 Å²	55.8	44%	0.444	29%	0.292	S	S	.	.			trans	-85.5	117.5	-179.2	179.6	12.1	0	0	0	110.5	S236 V240 E241 V242	S236-D238 PolarHBondContact OG-N 3.1Å; D238-V240 VanDerWaalsContact C-N 3.27Å; D238-V240 PolarHBondContact O-N 2.73Å; D238-V240 PolarHBondContact OD1-N 2.73Å; D238-E241 HydrophobicContact CB-CB 4.01Å; D238-E241 PolarHBondContact O-N 3.01Å; D238-V242 VanDerWaalsContact O-CG2 3.29Å; D238-V242 WeakPolarHBondContact O-CG2 2.91Å; D238-V242 PolarHBondContact O-N 3.36Å
239	E	88.8	Confident	89.6	Confident	90 Å²	90	53.2 Å²	53.2	42%	0.421	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-32.2	-178.7	-55.7	-173	-176.2	0	0	112.4	S243 S263 V266	E239-S243 WeakPolarHBondContact O-CB 3.49Å; E239-S243 PolarHBondContact O-N 3Å; E239-S243 PolarHBondContact O-OG 2.79Å; E239-S263 VanDerWaalsContact CD-CB 3.41Å; E239-S263 VanDerWaalsContact OE2-CB 3.32Å; E239-S263 WeakPolarHBondContact OE2-CB 3.3Å; E239-S263 PolarHBondContact OE2-OG 3.47Å; E239-V266 HydrophobicContact CB-CG2 4.45Å
240	V	90.3	Very high	89.3	Confident	89 Å²	89	59.4 Å²	59.4	54%	0.539	31%	0.306	S	S	.	.	H	α-helix	trans	-71.4	-47.7	-179.8	-178.6	0	0	0	0	110	D238 S243 G244	D238-V240 VanDerWaalsContact C-N 3.27Å; D238-V240 PolarHBondContact O-N 2.73Å; D238-V240 PolarHBondContact OD1-N 2.73Å; V240-S243 PolarHBondContact O-N 3.29Å; V240-G244 PolarHBondContact O-N 3.19Å
241	E	90.9	Very high	89.1	Confident	64 Å²	64	59.5 Å²	59.5	30%	0.299	31%	0.307	S	S	.	.	H	α-helix	trans	-61.4	-47.2	177.2	-177.7	175	-133.2	0	0	111.4	K232 S236 D238 S243 G244 L245	K232-E241 WeakPolarHBondContact CE-OE1 3.35Å; K232-E241 IonicContact NZ-OE1 3.29Å; K232-E241 PolarHBondContact NZ-OE1 3.09Å; S236-E241 VanDerWaalsContact CB-OE2 3.26Å; S236-E241 WeakPolarHBondContact CB-OE2 3.28Å; S236-E241 PolarHBondContact OG-OE2 3.49Å; D238-E241 HydrophobicContact CB-CB 4.01Å; D238-E241 PolarHBondContact O-N 3.01Å; E241-S243 VanDerWaalsContact C-N 3.28Å; E241-S243 PolarHBondContact O-N 3.45Å; E241-G244 PolarHBondContact O-N 3.03Å; E241-L245 HydrophobicContact CG-CD1 4.09Å; E241-L245 VanDerWaalsContact O-CG 3.3Å; E241-L245 WeakPolarHBondContact O-CG 3.39Å; E241-L245 PolarHBondContact O-N 2.82Å
242	V	90.2	Very high	88.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-41.3	177.5	171.8	0	0	0	0	111	V233 D238 L245 I246 V266	V233-V242 HydrophobicContact CG1-CG1 4.26Å; D238-V242 VanDerWaalsContact O-CG2 3.29Å; D238-V242 WeakPolarHBondContact O-CG2 2.91Å; D238-V242 PolarHBondContact O-N 3.36Å; V242-L245 PolarHBondContact O-N 3.21Å; V242-I246 HydrophobicContact CG1-CD1 3.91Å; V242-I246 VanDerWaalsContact O-CG1 3.27Å; V242-I246 WeakPolarHBondContact O-CG1 3.4Å; V242-I246 PolarHBondContact O-N 2.94Å; V242-V266 HydrophobicContact CB-CG2 4.34Å; V242-V266 HydrophobicContact CG1-CG1 4.23Å; V242-V266 HydrophobicContact CG1-CG2 3.95Å
243	S	88.9	Confident	88.6	Confident	8 Å²	8	61.5 Å²	61.5	6%	0.056	31%	0.314	C	S	.	.	H	α-helix	trans	-62.7	-47	176.9	-60.4	0	0	0	0	111.8	E239 V240 E241 L245 I246 E247 T269	E239-S243 WeakPolarHBondContact O-CB 3.49Å; E239-S243 PolarHBondContact O-N 3Å; E239-S243 PolarHBondContact O-OG 2.79Å; V240-S243 PolarHBondContact O-N 3.29Å; E241-S243 VanDerWaalsContact C-N 3.28Å; E241-S243 PolarHBondContact O-N 3.45Å; S243-L245 VanDerWaalsContact C-N 3.31Å; S243-L245 PolarHBondContact O-N 2.75Å; S243-I246 PolarHBondContact O-N 3.21Å; S243-I246 VanDerWaalsContact O-N 3.15Å; S243-E247 PolarHBondContact O-N 3.47Å; S243-E247 VanDerWaalsContact O-N 3.1Å; S243-T269 WeakPolarHBondContact CB-OG1 3.43Å; S243-T269 WeakPolarHBondContact O-CG2 3.39Å
244	G	90.7	Very high	88.4	Confident	35 Å²	35	65.5 Å²	65.5	36%	0.361	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-42.3	176.5	0	0	0	0	0	112.7	V240 E241 I246 E247 E248	V240-G244 PolarHBondContact O-N 3.19Å; E241-G244 PolarHBondContact O-N 3.03Å; G244-I246 VanDerWaalsContact C-N 3.34Å; G244-I246 PolarHBondContact O-N 3.25Å; G244-E247 PolarHBondContact O-N 3.22Å; G244-E248 WeakPolarHBondContact O-CB 3.26Å; G244-E248 PolarHBondContact O-N 3.24Å
245	L	91	Very high	88.5	Confident	15 Å²	15	64.5 Å²	64.5	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-66.7	-33.2	178.1	-65.6	173	0	0	0	112.8	V229 K232 V233 E241 V242 S243 H249	V229-L245 HydrophobicContact CG1-CB 4.29Å; V229-L245 HydrophobicContact CG1-CD2 4.09Å; V229-L245 HydrophobicContact CG2-CD2 4.34Å; K232-L245 HydrophobicContact CB-CD1 4.41Å; K232-L245 HydrophobicContact CD-CD1 4.06Å; K232-L245 HydrophobicContact CG-CD1 4.19Å; V233-L245 HydrophobicContact CG2-CB 3.73Å; V233-L245 HydrophobicContact CG2-CD1 3.5Å; V233-L245 VanDerWaalsContact CG2-CD1 3.5Å; V233-L245 HydrophobicContact CG2-CG 4.25Å; E241-L245 HydrophobicContact CG-CD1 4.09Å; E241-L245 VanDerWaalsContact O-CG 3.3Å; E241-L245 WeakPolarHBondContact O-CG 3.39Å; E241-L245 PolarHBondContact O-N 2.82Å; V242-L245 PolarHBondContact O-N 3.21Å; S243-L245 VanDerWaalsContact C-N 3.31Å; S243-L245 PolarHBondContact O-N 2.75Å; L245-H249 WeakPolarHBondContact O-CB 3.21Å; L245-H249 PolarHBondContact O-N 2.86Å; L245-H249 VanDerWaalsContact O-N 3.16Å
246	I	90.3	Very high	88.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.8	-45.6	174.3	-67.1	162.6	0	0	0	110.6	V242 S243 G244 K250 L251 L256 V266 T269	V242-I246 HydrophobicContact CG1-CD1 3.91Å; V242-I246 VanDerWaalsContact O-CG1 3.27Å; V242-I246 WeakPolarHBondContact O-CG1 3.4Å; V242-I246 PolarHBondContact O-N 2.94Å; S243-I246 PolarHBondContact O-N 3.21Å; S243-I246 VanDerWaalsContact O-N 3.15Å; G244-I246 VanDerWaalsContact C-N 3.34Å; G244-I246 PolarHBondContact O-N 3.25Å; I246-K250 WeakPolarHBondContact O-CA 3.22Å; I246-K250 PolarHBondContact O-N 3.42Å; I246-L251 HydrophobicContact CG1-CB 4.29Å; I246-L251 PolarHBondContact O-N 3.4Å; I246-L256 HydrophobicContact CD1-CD1 3.86Å; I246-L256 HydrophobicContact CD1-CD2 4.07Å; I246-L256 HydrophobicContact CG1-CD2 4.16Å; I246-V266 HydrophobicContact CD1-CG1 3.77Å; I246-T269 HydrophobicContact CB-CG2 3.9Å; I246-T269 HydrophobicContact CG2-CG2 3.79Å
247	E	87.8	Confident	88.6	Confident	92 Å²	92	61.3 Å²	61.3	43%	0.43	31%	0.314	S	S	.	.	H	α-helix	trans	-65.7	-43.6	-179.3	-64.1	-167	151.5	0	0	112.2	S243 G244 T269 K272	S243-E247 PolarHBondContact O-N 3.47Å; S243-E247 VanDerWaalsContact O-N 3.1Å; G244-E247 PolarHBondContact O-N 3.22Å; E247-T269 HydrophobicContact CB-CG2 4.47Å; E247-T269 HydrophobicContact CG-CG2 3.22Å; E247-K272 IonicContact OE1-NZ 3.04Å; E247-K272 PolarHBondContact OE1-NZ 2.73Å
248	E	88.9	Confident	88.7	Confident	144 Å²	144	60.4 Å²	60.4	67%	0.673	31%	0.306	S	S	*	.	H	α-helix	trans	-70.2	-42.5	-176.4	-173.5	176	177.2	0	0	112.3	G244	G244-E248 WeakPolarHBondContact O-CB 3.26Å; G244-E248 PolarHBondContact O-N 3.24Å
249	H	87.2	Confident	88.5	Confident	48 Å²	48	61 Å²	61	22%	0.222	31%	0.309	C	S	.	.	H	α-helix	trans	-109.2	3.4	-171.1	-61.3	-78.5	0	0	0	114.6	V229 L245 L251	V229-H249 HydrophobicContact CG1-CB 4.07Å; V229-H249 VanDerWaalsContact CG2-NE2 3.33Å; V229-H249 WeakPolarHBondContact CG2-NE2 3.35Å; L245-H249 WeakPolarHBondContact O-CB 3.21Å; L245-H249 PolarHBondContact O-N 2.86Å; L245-H249 VanDerWaalsContact O-N 3.16Å; H249-L251 VanDerWaalsContact C-N 3.3Å; H249-L251 HydrophobicContact CB-CD2 4.15Å; H249-L251 HydrophobicContact CB-CG 4.17Å; H249-L251 PolarHBondContact O-N 3.4Å
250	K	86.8	Confident	88.4	Confident	142 Å²	142	57.5 Å²	57.5	62%	0.617	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	45.1	178	-55.5	-174	179.2	-177.1	0	113.1	I246	I246-K250 WeakPolarHBondContact O-CA 3.22Å; I246-K250 PolarHBondContact O-N 3.42Å
251	L	88.1	Confident	88.1	Confident	2 Å²	2	55 Å²	55	1%	0.01	28%	0.276	C	S	.	.			trans	-67.7	139.4	-178.3	-59.5	178.7	0	0	0	111.1	Y226 V229 V230 V233 I246 H249	Y226-L251 HydrophobicContact CE2-CD2 4.21Å; V229-L251 HydrophobicContact CG1-CD1 4.03Å; V230-L251 HydrophobicContact CG2-CD2 3.94Å; V233-L251 HydrophobicContact CB-CD1 4.45Å; V233-L251 HydrophobicContact CG2-CD1 3.59Å; I246-L251 HydrophobicContact CG1-CB 4.29Å; I246-L251 PolarHBondContact O-N 3.4Å; H249-L251 VanDerWaalsContact C-N 3.3Å; H249-L251 HydrophobicContact CB-CD2 4.15Å; H249-L251 HydrophobicContact CB-CG 4.17Å; H249-L251 PolarHBondContact O-N 3.4Å
252	E	86.3	Confident	87.7	Confident	78 Å²	78	61.3 Å²	61.3	36%	0.364	30%	0.297	S	S	.	.			trans	-89.1	160.3	178.2	-63.9	-175.4	-152.1	0	0	111.6	R168 E254 Q255	R168-E252 WeakPolarHBondContact CD-OE2 3.37Å; R168-E252 IonicContact NH1-OE1 3.52Å; R168-E252 PolarHBondContact NH1-OE1 3.41Å; R168-E252 IonicContact NH1-OE2 2.69Å; E252-E254 PolarHBondContact O-N 2.69Å; E252-E254 VanDerWaalsContact O-N 3.16Å; E252-Q255 WeakPolarHBondContact O-CB 3.4Å; E252-Q255 PolarHBondContact O-N 3.03Å
253	R	87.3	Confident	87.5	Confident	86 Å²	86	61.7 Å²	61.7	33%	0.325	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-54	-38.7	-179.6	-172.8	-168.7	69.7	143.4	4.6	112.7	Q255 L256 L261 L270	R253-Q255 PolarHBondContact O-N 3.37Å; R253-L256 PolarHBondContact O-N 3.15Å; R253-L256 VanDerWaalsContact O-N 3.17Å; R253-L261 HydrophobicContact CG-CD1 4Å; R253-L261 HydrophobicContact CG-CD2 3.84Å; R253-L270 HydrophobicContact CB-CD1 4.49Å; R253-L270 HydrophobicContact CB-CD2 4.05Å; R253-L270 HydrophobicContact CG-CD2 4.08Å
254	E	87.4	Confident	87.2	Confident	85 Å²	85	65.7 Å²	65.7	40%	0.397	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-65.1	-18.3	-177.8	-71.8	61.1	-139.4	0	0	113	R168 E252	R168-E254 HydrophobicContact CG-CB 4.17Å; E252-E254 PolarHBondContact O-N 2.69Å; E252-E254 VanDerWaalsContact O-N 3.16Å
255	Q	89.4	Confident	86.9	Confident	11 Å²	11	67.9 Å²	67.9	5%	0.051	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-90.8	-12.5	179	-59.7	173	-70	0	0	112.7	T167 Y226 E252 R253	T167-Q255 PolarHBondContact OG1-NE2 2.81Å; Y226-Q255 PolarHBondContact OH-NE2 3.25Å; E252-Q255 WeakPolarHBondContact O-CB 3.4Å; E252-Q255 PolarHBondContact O-N 3.03Å; R253-Q255 PolarHBondContact O-N 3.37Å
256	L	88.9	Confident	86.7	Confident	17 Å²	17	67.2 Å²	67.2	9%	0.089	31%	0.313	C	S	.	.	S	Bend	trans	-87.8	158.4	179.8	-52.8	-178	0	0	0	112.1	V233 I246 R253 H260 L261 V266 L270	V233-L256 HydrophobicContact CG1-CD2 3.55Å; I246-L256 HydrophobicContact CD1-CD1 3.86Å; I246-L256 HydrophobicContact CD1-CD2 4.07Å; I246-L256 HydrophobicContact CG1-CD2 4.16Å; R253-L256 PolarHBondContact O-N 3.15Å; R253-L256 VanDerWaalsContact O-N 3.17Å; L256-H260 HydrophobicContact CB-CB 4.4Å; L256-L261 HydrophobicContact CB-CD2 4.35Å; L256-L261 HydrophobicContact CD1-CD2 3.97Å; L256-V266 HydrophobicContact CD1-CG1 4.02Å; L256-L270 HydrophobicContact CD1-CD1 4.34Å; L256-L270 HydrophobicContact CD1-CD2 4.18Å
257	L	88.1	Confident	86.5	Confident	73 Å²	73	68 Å²	68	38%	0.382	32%	0.316	S	S	.	.			trans	-77.5	156	170.2	-62.7	-179.1	0	0	0	111.3	K234 D259 H260 L261	K234-L257 WeakPolarHBondContact O-CD1 3.48Å; L257-D259 PolarHBondContact O-N 2.88Å; L257-H260 WeakPolarHBondContact CB-ND1 3.15Å; L257-H260 PolarHBondContact N-ND1 2.67Å; L257-H260 PolarHBondContact O-N 3.29Å; L257-L261 PolarHBondContact O-N 3.31Å
258	T	85.1	Confident	86.4	Confident	107 Å²	107	65.3 Å²	65.3	66%	0.656	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28	176.3	49.1	0	0	0	0	113.3
259	D	86.1	Confident	86.3	Confident	95 Å²	95	58.8 Å²	58.8	51%	0.508	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-36.1	179.1	-67	-27.5	0	0	0	112	L257 L261 R262	L257-D259 PolarHBondContact O-N 2.88Å; D259-L261 PolarHBondContact O-N 3.07Å; D259-R262 WeakPolarHBondContact O-CB 3.03Å; D259-R262 PolarHBondContact O-N 3.26Å; D259-R262 IonicContact OD1-CZ 3.06Å; D259-R262 IonicContact OD1-NE 3.97Å; D259-R262 IonicContact OD1-NH2 3.01Å
260	H	86.6	Confident	86.3	Confident	17 Å²	17	56.6 Å²	56.6	8%	0.079	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.5	-35.7	171.9	-56	137.9	0	0	0	111.5	V233 S236 L256 L257 R262 S263 V266	V233-H260 PolarHBondContact O-CE1 3.1Å; V233-H260 PolarHBondContact O-NE2 3.26Å; S236-H260 PolarHBondContact O-NE2 3.28Å; L256-H260 HydrophobicContact CB-CB 4.4Å; L257-H260 WeakPolarHBondContact CB-ND1 3.15Å; L257-H260 PolarHBondContact N-ND1 2.67Å; L257-H260 PolarHBondContact O-N 3.29Å; H260-R262 PolarHBondContact O-N 2.87Å; H260-S263 PolarHBondContact O-N 3.3Å; H260-S263 VanDerWaalsContact O-N 3.08Å; H260-V266 HydrophobicContact CB-CG1 4.36Å
261	L	83.9	Confident	86.3	Confident	37 Å²	37	50 Å²	50	19%	0.194	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-71.3	4.1	178.2	-57.1	179.4	0	0	0	114.1	R253 L256 L257 D259 W267 L270	R253-L261 HydrophobicContact CG-CD1 4Å; R253-L261 HydrophobicContact CG-CD2 3.84Å; L256-L261 HydrophobicContact CB-CD2 4.35Å; L256-L261 HydrophobicContact CD1-CD2 3.97Å; L257-L261 PolarHBondContact O-N 3.31Å; D259-L261 PolarHBondContact O-N 3.07Å; L261-W267 HydrophobicContact CD2-CZ2 4.18Å; L261-W267 PolarHBondContact O-NE1 3.4Å; L261-L270 HydrophobicContact CD2-CD2 4.11Å
262	R	82.8	Confident	86.1	Confident	196 Å²	196	55 Å²	55	74%	0.74	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-92.7	-22.3	169	-59	-178.9	-177.8	-174.9	4.2	112.7	D259 H260	D259-R262 WeakPolarHBondContact O-CB 3.03Å; D259-R262 PolarHBondContact O-N 3.26Å; D259-R262 IonicContact OD1-CZ 3.06Å; D259-R262 IonicContact OD1-NE 3.97Å; D259-R262 IonicContact OD1-NH2 3.01Å; H260-R262 PolarHBondContact O-N 2.87Å
263	S	85.3	Confident	86	Confident	8 Å²	8	55.3 Å²	55.3	6%	0.056	26%	0.262	C	S	.	.			trans	-75.6	130	-179.2	164.2	0	0	0	0	111.4	E239 H260 Q265 V266 W267	E239-S263 VanDerWaalsContact CD-CB 3.41Å; E239-S263 VanDerWaalsContact OE2-CB 3.32Å; E239-S263 WeakPolarHBondContact OE2-CB 3.3Å; E239-S263 PolarHBondContact OE2-OG 3.47Å; H260-S263 PolarHBondContact O-N 3.3Å; H260-S263 VanDerWaalsContact O-N 3.08Å; S263-Q265 VanDerWaalsContact C-N 3.29Å; S263-Q265 PolarHBondContact O-N 3.31Å; S263-Q265 PolarHBondContact OG-N 3.39Å; S263-Q265 VanDerWaalsContact OG-N 3.12Å; S263-V266 PolarHBondContact OG-N 2.79Å; S263-V266 VanDerWaalsContact OG-N 3.15Å; S263-W267 VanDerWaalsContact O-CD1 3.24Å; S263-W267 PolarHBondContact O-N 3.19Å
264	K	83	Confident	86	Confident	91 Å²	91	51.9 Å²	51.9	40%	0.396	25%	0.25	S	C	.	.	H	α-helix	trans	-63.3	-37.3	172	-69.1	-171	177	-166.4	0	111.5	W267 S268 K290 L291 E293	K264-W267 PolarHBondContact O-N 3.02Å; K264-S268 PolarHBondContact O-N 3.2Å; K264-K290 WeakPolarHBondContact CE-O 3.44Å; K264-K290 PolarHBondContact NZ-O 3.19Å; K264-L291 HydrophobicContact CG-CD2 3.95Å; K264-E293 IonicContact NZ-OE1 3.47Å; K264-E293 PolarHBondContact NZ-OE1 3.04Å; K264-E293 IonicContact NZ-OE2 2.63Å; K264-E293 PolarHBondContact NZ-OE2 3.28Å
265	Q	85.2	Confident	86	Confident	81 Å²	81	50.7 Å²	50.7	38%	0.379	25%	0.251	S	S	.	.	H	α-helix	trans	-68.7	-40.9	-177.9	-174.3	175.3	-2.8	0	0	112.4	S263 W267 S268 T269	S263-Q265 VanDerWaalsContact C-N 3.29Å; S263-Q265 PolarHBondContact O-N 3.31Å; S263-Q265 PolarHBondContact OG-N 3.39Å; S263-Q265 VanDerWaalsContact OG-N 3.12Å; Q265-W267 VanDerWaalsContact C-N 3.27Å; Q265-W267 PolarHBondContact O-N 3.1Å; Q265-S268 PolarHBondContact O-N 2.78Å; Q265-S268 PolarHBondContact O-OG 3.18Å; Q265-T269 PolarHBondContact O-N 3.46Å; Q265-T269 PolarHBondContact O-OG1 2.92Å
266	V	87.1	Confident	86.1	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-62.7	-39.4	173.5	174.6	0	0	0	0	110.4	E239 V242 I246 L256 H260 S263 T269 L270	E239-V266 HydrophobicContact CB-CG2 4.45Å; V242-V266 HydrophobicContact CB-CG2 4.34Å; V242-V266 HydrophobicContact CG1-CG1 4.23Å; V242-V266 HydrophobicContact CG1-CG2 3.95Å; I246-V266 HydrophobicContact CD1-CG1 3.77Å; L256-V266 HydrophobicContact CD1-CG1 4.02Å; H260-V266 HydrophobicContact CB-CG1 4.36Å; S263-V266 PolarHBondContact OG-N 2.79Å; S263-V266 VanDerWaalsContact OG-N 3.15Å; V266-T269 PolarHBondContact O-N 3.19Å; V266-L270 VanDerWaalsContact O-CB 3.28Å; V266-L270 WeakPolarHBondContact O-CB 3.46Å; V266-L270 PolarHBondContact O-N 3.33Å
267	W	85.7	Confident	86.2	Confident	17 Å²	17	53 Å²	53	6%	0.064	26%	0.261	C	S	.	.	H	α-helix	trans	-67.2	-41.1	177.3	-88	105	0	0	0	113.7	L261 S263 K264 Q265 T269 L270 L271 I274 I282 M286 L291	L261-W267 HydrophobicContact CD2-CZ2 4.18Å; L261-W267 PolarHBondContact O-NE1 3.4Å; S263-W267 VanDerWaalsContact O-CD1 3.24Å; S263-W267 PolarHBondContact O-N 3.19Å; K264-W267 PolarHBondContact O-N 3.02Å; Q265-W267 VanDerWaalsContact C-N 3.27Å; Q265-W267 PolarHBondContact O-N 3.1Å; W267-T269 PolarHBondContact O-N 2.9Å; W267-L270 HydrophobicContact CD2-CD2 4.41Å; W267-L270 HydrophobicContact CE3-CD2 4Å; W267-L270 HydrophobicContact CH2-CD2 4.28Å; W267-L270 HydrophobicContact CZ3-CD2 3.93Å; W267-L270 PolarHBondContact O-N 3.44Å; W267-L271 HydrophobicContact CE3-CD2 4.44Å; W267-L271 HydrophobicContact CE3-CG 4.37Å; W267-L271 VanDerWaalsContact O-CB 3.29Å; W267-L271 WeakPolarHBondContact O-CB 3.29Å; W267-L271 WeakPolarHBondContact O-CG 3.41Å; W267-L271 PolarHBondContact O-N 2.93Å; W267-I274 HydrophobicContact CH2-CD1 4.42Å; W267-I274 HydrophobicContact CZ3-CD1 3.78Å; W267-I282 HydrophobicContact CH2-CD1 3.94Å; W267-I282 HydrophobicContact CZ3-CD1 4.02Å; W267-M286 HydrophobicContact CE3-SD 3.83Å; W267-M286 HydrophobicContact CH2-CG 4.35Å; W267-M286 HydrophobicContact CH2-SD 4.1Å; W267-M286 HydrophobicContact CZ3-CG 4.28Å; W267-M286 HydrophobicContact CZ3-SD 3.49Å; W267-M286 WeakPolarHBondContact CZ3-SD 3.41Å; W267-L291 HydrophobicContact CB-CD1 4.43Å; W267-L291 HydrophobicContact CB-CD2 4.24Å; W267-L291 HydrophobicContact CD2-CD1 3.73Å; W267-L291 HydrophobicContact CG-CD1 3.61Å; W267-L291 HydrophobicContact CG-CD2 4.02Å; W267-L291 HydrophobicContact CG-CG 4.37Å; W267-L291 HydrophobicContact CZ2-CD1 4.33Å; W267-L291 VanDerWaalsContact NE1-CD1 3.35Å
268	S	84.1	Confident	86.2	Confident	35 Å²	35	51.8 Å²	51.8	25%	0.245	26%	0.259	C	S	.	.	H	α-helix	trans	-59.3	-35.2	178.9	68	0	0	0	0	111.7	K264 Q265	K264-S268 PolarHBondContact O-N 3.2Å; Q265-S268 PolarHBondContact O-N 2.78Å; Q265-S268 PolarHBondContact O-OG 3.18Å
269	T	87.7	Confident	86.5	Confident	8 Å²	8	46.8 Å²	46.8	5%	0.049	23%	0.228	C	C	.	.	H	α-helix	trans	-72.2	-51.9	173.8	-54	0	0	0	0	112.1	S243 I246 E247 Q265 V266 W267 L271 K272	S243-T269 WeakPolarHBondContact CB-OG1 3.43Å; S243-T269 WeakPolarHBondContact O-CG2 3.39Å; I246-T269 HydrophobicContact CB-CG2 3.9Å; I246-T269 HydrophobicContact CG2-CG2 3.79Å; E247-T269 HydrophobicContact CB-CG2 4.47Å; E247-T269 HydrophobicContact CG-CG2 3.22Å; Q265-T269 PolarHBondContact O-N 3.46Å; Q265-T269 PolarHBondContact O-OG1 2.92Å; V266-T269 PolarHBondContact O-N 3.19Å; W267-T269 PolarHBondContact O-N 2.9Å; T269-L271 PolarHBondContact O-N 3.35Å; T269-K272 WeakPolarHBondContact O-CB 3.23Å; T269-K272 PolarHBondContact O-N 3.11Å
270	L	87.7	Confident	86.8	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-31.7	-178.8	-174.4	65.6	0	0	0	112.5	R253 L256 L261 V266 W267 K272 E273 I274	R253-L270 HydrophobicContact CB-CD1 4.49Å; R253-L270 HydrophobicContact CB-CD2 4.05Å; R253-L270 HydrophobicContact CG-CD2 4.08Å; L256-L270 HydrophobicContact CD1-CD1 4.34Å; L256-L270 HydrophobicContact CD1-CD2 4.18Å; L261-L270 HydrophobicContact CD2-CD2 4.11Å; V266-L270 VanDerWaalsContact O-CB 3.28Å; V266-L270 WeakPolarHBondContact O-CB 3.46Å; V266-L270 PolarHBondContact O-N 3.33Å; W267-L270 HydrophobicContact CD2-CD2 4.41Å; W267-L270 HydrophobicContact CE3-CD2 4Å; W267-L270 HydrophobicContact CH2-CD2 4.28Å; W267-L270 HydrophobicContact CZ3-CD2 3.93Å; W267-L270 PolarHBondContact O-N 3.44Å; L270-K272 PolarHBondContact O-N 2.86Å; L270-E273 PolarHBondContact O-N 3.06Å; L270-I274 HydrophobicContact CD1-CD1 4.31Å; L270-I274 HydrophobicContact CD1-CG1 4.12Å; L270-I274 HydrophobicContact CD2-CD1 3.76Å; L270-I274 HydrophobicContact CD2-CG1 4.46Å; L270-I274 HydrophobicContact CG-CD1 3.62Å; L270-I274 HydrophobicContact CG-CG1 3.87Å; L270-I274 WeakPolarHBondContact O-CB 3.47Å; L270-I274 PolarHBondContact O-N 2.93Å
271	L	86.7	Confident	86.9	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-64.5	-17.9	176.5	-79.1	174.9	0	0	0	113.6	W267 T269 M286 L292 E298 I302 R305	W267-L271 HydrophobicContact CE3-CD2 4.44Å; W267-L271 HydrophobicContact CE3-CG 4.37Å; W267-L271 VanDerWaalsContact O-CB 3.29Å; W267-L271 WeakPolarHBondContact O-CB 3.29Å; W267-L271 WeakPolarHBondContact O-CG 3.41Å; W267-L271 PolarHBondContact O-N 2.93Å; T269-L271 PolarHBondContact O-N 3.35Å; L271-M286 HydrophobicContact CD2-CE 4.1Å; L271-M286 HydrophobicContact CD2-SD 3.88Å; L271-L292 HydrophobicContact CD1-CD2 4.35Å; L271-E298 HydrophobicContact CD1-CB 3.79Å; L271-E298 HydrophobicContact CD1-CG 4.16Å; L271-I302 HydrophobicContact CD1-CD1 4.21Å; L271-I302 HydrophobicContact CD1-CG1 4.4Å; L271-I302 HydrophobicContact CD2-CD1 3.84Å; L271-I302 HydrophobicContact CD2-CG1 4.1Å; L271-R305 PolarHBondContact O-NH1 3.33Å
272	K	84.5	Confident	87.1	Confident	109 Å²	109	50 Å²	50	47%	0.474	24%	0.238	S	C	.	.	H	α-helix	trans	-77	-40.4	173.1	-59.3	175.9	-170.7	168.9	0	111	E247 T269 L270	E247-K272 IonicContact OE1-NZ 3.04Å; E247-K272 PolarHBondContact OE1-NZ 2.73Å; T269-K272 WeakPolarHBondContact O-CB 3.23Å; T269-K272 PolarHBondContact O-N 3.11Å; L270-K272 PolarHBondContact O-N 2.86Å
273	E	83.8	Confident	87.5	Confident	84 Å²	84	40.8 Å²	40.8	39%	0.393	20%	0.203	S	C	.	.	H	α-helix	trans	-90.8	-29	-173.6	-62.5	-54.3	126.6	0	0	114.1	L270	L270-E273 PolarHBondContact O-N 3.06Å
274	I	86.3	Confident	87.8	Confident	14 Å²	14	40.9 Å²	40.9	7%	0.072	21%	0.205	C	C	.	.	S	Bend	trans	-57.1	142.6	-176.7	-99.7	178.7	0	0	0	111.6	W267 L270 I279 I282 R305	W267-I274 HydrophobicContact CH2-CD1 4.42Å; W267-I274 HydrophobicContact CZ3-CD1 3.78Å; L270-I274 HydrophobicContact CD1-CD1 4.31Å; L270-I274 HydrophobicContact CD1-CG1 4.12Å; L270-I274 HydrophobicContact CD2-CD1 3.76Å; L270-I274 HydrophobicContact CD2-CG1 4.46Å; L270-I274 HydrophobicContact CG-CD1 3.62Å; L270-I274 HydrophobicContact CG-CG1 3.87Å; L270-I274 WeakPolarHBondContact O-CB 3.47Å; L270-I274 PolarHBondContact O-N 2.93Å; I274-I279 HydrophobicContact CG2-CD1 3.91Å; I274-I279 HydrophobicContact CG2-CG1 3.37Å; I274-I282 HydrophobicContact CD1-CD1 4.2Å; I274-R305 VanDerWaalsContact O-CZ 3.24Å; I274-R305 PolarHBondContact O-NH1 3.18Å; I274-R305 PolarHBondContact O-NH2 3.4Å
275	S	88.9	Confident	88	Confident	60 Å²	60	42.2 Å²	42.2	42%	0.42	21%	0.211	S	C	.	.			trans	-66.6	146.1	175	76.3	0	0	0	0	112.4	H277 S278 I279	S275-H277 VanDerWaalsContact C-N 3.26Å; S275-H277 PolarHBondContact O-N 3.2Å; S275-S278 WeakPolarHBondContact O-CB 3.43Å; S275-S278 PolarHBondContact O-N 3.32Å; S275-S278 WeakPolarHBondContact OG-CB 3.29Å; S275-S278 PolarHBondContact OG-N 3.13Å; S275-S278 PolarHBondContact OG-OG 2.74Å; S275-I279 PolarHBondContact O-N 3.41Å
276	L	91.1	Very high	88.2	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-35.1	177.1	-70.2	174.8	0	0	0	112.3	S278 I279 L280 R305 L306 L312 A315 I317	L276-S278 VanDerWaalsContact C-N 3.27Å; L276-S278 PolarHBondContact O-N 3.23Å; L276-I279 HydrophobicContact CD2-CD1 4.21Å; L276-I279 PolarHBondContact O-N 3.33Å; L276-L280 WeakPolarHBondContact O-CG 3.47Å; L276-L280 PolarHBondContact O-N 3.38Å; L276-R305 HydrophobicContact CD2-CB 4.06Å; L276-L306 HydrophobicContact CD2-CD2 4.47Å; L276-L312 HydrophobicContact CD1-CD2 4.21Å; L276-A315 HydrophobicContact CB-CB 4.36Å; L276-A315 HydrophobicContact CD1-CB 4.13Å; L276-I317 HydrophobicContact CB-CD1 3.33Å; L276-I317 HydrophobicContact CB-CG1 4.44Å; L276-I317 HydrophobicContact CD1-CD1 3.7Å; L276-I317 HydrophobicContact CG-CD1 4.13Å
277	H	90	Very high	88.4	Confident	70 Å²	70	39.2 Å²	39.2	32%	0.324	20%	0.198	S	C	.	.	H	α-helix	trans	-57.7	-39.7	172.7	-77	-76	0	0	0	112.5	S275 K281 A315	S275-H277 VanDerWaalsContact C-N 3.26Å; S275-H277 PolarHBondContact O-N 3.2Å; H277-K281 WeakPolarHBondContact O-CG 3.48Å; H277-A315 PolarHBondContact NE2-O 3.4Å
278	S	89.6	Confident	88.5	Confident	49 Å²	49	40.3 Å²	40.3	34%	0.343	21%	0.208	S	C	.	.	H	α-helix	trans	-70.8	-41.2	176.3	-71.5	0	0	0	0	111.5	S275 L276 L280 K281 I282	S275-S278 WeakPolarHBondContact O-CB 3.43Å; S275-S278 PolarHBondContact O-N 3.32Å; S275-S278 WeakPolarHBondContact OG-CB 3.29Å; S275-S278 PolarHBondContact OG-N 3.13Å; S275-S278 PolarHBondContact OG-OG 2.74Å; L276-S278 VanDerWaalsContact C-N 3.27Å; L276-S278 PolarHBondContact O-N 3.23Å; S278-L280 PolarHBondContact O-N 3Å; S278-K281 PolarHBondContact O-N 3.09Å; S278-K281 VanDerWaalsContact O-N 3.15Å; S278-I282 VanDerWaalsContact O-CG1 3.3Å; S278-I282 WeakPolarHBondContact O-CG1 3.45Å; S278-I282 PolarHBondContact O-N 3.3Å; S278-I282 VanDerWaalsContact O-N 3.16Å
279	I	91.3	Very high	88.6	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-54.2	-55.4	176.2	-69	174.6	0	0	0	110.1	I274 S275 L276 K281 I282 L283 I302 R305	I274-I279 HydrophobicContact CG2-CD1 3.91Å; I274-I279 HydrophobicContact CG2-CG1 3.37Å; S275-I279 PolarHBondContact O-N 3.41Å; L276-I279 HydrophobicContact CD2-CD1 4.21Å; L276-I279 PolarHBondContact O-N 3.33Å; I279-K281 PolarHBondContact O-N 3.3Å; I279-I282 PolarHBondContact O-N 3.02Å; I279-L283 HydrophobicContact CG2-CD1 4.06Å; I279-L283 HydrophobicContact CG2-CD2 3.95Å; I279-L283 HydrophobicContact CG2-CG 3.86Å; I279-L283 VanDerWaalsContact O-CG 3.29Å; I279-L283 WeakPolarHBondContact O-CG 3.45Å; I279-L283 PolarHBondContact O-N 3.22Å; I279-I302 HydrophobicContact CG2-CG2 4.22Å; I279-R305 VanDerWaalsContact CD1-NH1 3.28Å
280	L	92	Very high	88.6	Confident	17 Å²	17	49 Å²	49	9%	0.089	25%	0.245	C	C	.	.	H	α-helix	trans	-53.2	-29.9	-178.4	-67.9	178.9	0	0	0	113.3	L276 S278 L306 I317 I322 A325 M351	L276-L280 WeakPolarHBondContact O-CG 3.47Å; L276-L280 PolarHBondContact O-N 3.38Å; S278-L280 PolarHBondContact O-N 3Å; L280-L306 HydrophobicContact CD2-CD2 4.04Å; L280-I317 HydrophobicContact CD1-CD1 4.45Å; L280-I317 HydrophobicContact CD1-CG2 3.93Å; L280-I322 HydrophobicContact CD1-CG1 4.06Å; L280-A325 HydrophobicContact CB-CB 3.82Å; L280-A325 HydrophobicContact CD2-CB 3.9Å; L280-A325 HydrophobicContact CG-CB 4.33Å; L280-M351 HydrophobicContact CD2-CE 3.84Å
281	K	88.6	Confident	88.5	Confident	175 Å²	175	49.5 Å²	49.5	76%	0.761	25%	0.248	S	C	*	.	H	α-helix	trans	-84.5	-28.2	179.2	-67.7	175.4	-176.2	176.2	0	114.1	H277 S278 I279	H277-K281 WeakPolarHBondContact O-CG 3.48Å; S278-K281 PolarHBondContact O-N 3.09Å; S278-K281 VanDerWaalsContact O-N 3.15Å; I279-K281 PolarHBondContact O-N 3.3Å
282	I	88.7	Confident	88.5	Confident	25 Å²	25	49.5 Å²	49.5	13%	0.128	25%	0.248	C	C	.	.	H	α-helix	trans	-109.9	-3.9	-170	72	-173.1	0	0	0	114.1	W267 I274 S278 I279 G284 K285 M286	W267-I282 HydrophobicContact CH2-CD1 3.94Å; W267-I282 HydrophobicContact CZ3-CD1 4.02Å; I274-I282 HydrophobicContact CD1-CD1 4.2Å; S278-I282 VanDerWaalsContact O-CG1 3.3Å; S278-I282 WeakPolarHBondContact O-CG1 3.45Å; S278-I282 PolarHBondContact O-N 3.3Å; S278-I282 VanDerWaalsContact O-N 3.16Å; I279-I282 PolarHBondContact O-N 3.02Å; I282-G284 PolarHBondContact O-N 3.36Å; I282-K285 WeakPolarHBondContact O-CA 3.4Å; I282-K285 WeakPolarHBondContact O-CB 3.28Å; I282-K285 PolarHBondContact O-N 3.25Å; I282-M286 HydrophobicContact CD1-CE 4.33Å; I282-M286 HydrophobicContact CD1-SD 3.94Å; I282-M286 HydrophobicContact CG1-CE 3.75Å; I282-M286 HydrophobicContact CG1-CG 4.13Å; I282-M286 HydrophobicContact CG1-SD 3.85Å; I282-M286 WeakPolarHBondContact O-CG 3.29Å; I282-M286 PolarHBondContact O-N 3.26Å
283	L	91.3	Very high	88.7	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-49.3	-51.9	-179.6	-82.5	164.7	0	0	0	113.9	I279 K285 M286 T287 L292 I302 Y329 I347 M351	I279-L283 HydrophobicContact CG2-CD1 4.06Å; I279-L283 HydrophobicContact CG2-CD2 3.95Å; I279-L283 HydrophobicContact CG2-CG 3.86Å; I279-L283 VanDerWaalsContact O-CG 3.29Å; I279-L283 WeakPolarHBondContact O-CG 3.45Å; I279-L283 PolarHBondContact O-N 3.22Å; L283-K285 VanDerWaalsContact C-N 3.25Å; L283-K285 PolarHBondContact O-N 3Å; L283-M286 HydrophobicContact CD2-CE 3.89Å; L283-M286 HydrophobicContact CG-CE 4.25Å; L283-M286 PolarHBondContact O-N 3.43Å; L283-T287 PolarHBondContact O-N 3.17Å; L283-T287 PolarHBondContact O-OG1 3.3Å; L283-L292 HydrophobicContact CD2-CD1 3.64Å; L283-I302 HydrophobicContact CD2-CD1 3.98Å; L283-I302 HydrophobicContact CD2-CG2 4.11Å; L283-Y329 HydrophobicContact CB-CD2 4.02Å; L283-Y329 HydrophobicContact CB-CE2 4.19Å; L283-I347 HydrophobicContact CD1-CG2 4.32Å; L283-I347 HydrophobicContact CD2-CD1 4.35Å; L283-I347 HydrophobicContact CD2-CG2 4.35Å; L283-M351 HydrophobicContact CD1-CE 2.99Å; L283-M351 HydrophobicContact CG-CE 4.46Å
284	G	90.8	Very high	88.8	Confident	9 Å²	9	48.9 Å²	48.9	9%	0.093	26%	0.255	C	S	.	.	H	α-helix	trans	-58.7	-37.2	178.8	0	0	0	0	0	113.1	I282 S288 W341	I282-G284 PolarHBondContact O-N 3.36Å; G284-S288 VanDerWaalsContact O-CB 3.25Å; G284-S288 WeakPolarHBondContact O-CB 3.29Å; G284-S288 PolarHBondContact O-N 2.69Å; G284-W341 VanDerWaalsContact CA-CD2 3.49Å; G284-W341 VanDerWaalsContact CA-CE2 3.46Å; G284-W341 VanDerWaalsContact O-CE3 3.31Å
285	K	87.6	Confident	88.7	Confident	119 Å²	119	60.1 Å²	60.1	52%	0.517	30%	0.297	S	S	.	.	H	α-helix	trans	-68.4	-41.3	175	-176.5	178.5	177.7	179.9	0	111.5	I282 L283 S288 N289	I282-K285 WeakPolarHBondContact O-CA 3.4Å; I282-K285 WeakPolarHBondContact O-CB 3.28Å; I282-K285 PolarHBondContact O-N 3.25Å; L283-K285 VanDerWaalsContact C-N 3.25Å; L283-K285 PolarHBondContact O-N 3Å; K285-S288 PolarHBondContact O-N 3.16Å; K285-N289 WeakPolarHBondContact O-CB 3.43Å; K285-N289 VanDerWaalsContact O-CG 3.3Å; K285-N289 PolarHBondContact O-N 3.01Å
286	M	88.5	Confident	88.7	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-66	-43.1	178.8	-65	-171.3	-61	0	0	111.7	W267 L271 I282 L283 N289 K290 L291 L292 I302	W267-M286 HydrophobicContact CE3-SD 3.83Å; W267-M286 HydrophobicContact CH2-CG 4.35Å; W267-M286 HydrophobicContact CH2-SD 4.1Å; W267-M286 HydrophobicContact CZ3-CG 4.28Å; W267-M286 HydrophobicContact CZ3-SD 3.49Å; W267-M286 WeakPolarHBondContact CZ3-SD 3.41Å; L271-M286 HydrophobicContact CD2-CE 4.1Å; L271-M286 HydrophobicContact CD2-SD 3.88Å; I282-M286 HydrophobicContact CD1-CE 4.33Å; I282-M286 HydrophobicContact CD1-SD 3.94Å; I282-M286 HydrophobicContact CG1-CE 3.75Å; I282-M286 HydrophobicContact CG1-CG 4.13Å; I282-M286 HydrophobicContact CG1-SD 3.85Å; I282-M286 WeakPolarHBondContact O-CG 3.29Å; I282-M286 PolarHBondContact O-N 3.26Å; L283-M286 HydrophobicContact CD2-CE 3.89Å; L283-M286 HydrophobicContact CG-CE 4.25Å; L283-M286 PolarHBondContact O-N 3.43Å; M286-N289 PolarHBondContact O-N 3.26Å; M286-K290 PolarHBondContact O-N 3.45Å; M286-L291 HydrophobicContact CB-CB 4.31Å; M286-L291 HydrophobicContact CB-CD1 4.23Å; M286-L291 HydrophobicContact CG-CD1 4.23Å; M286-L291 WeakPolarHBondContact O-CB 3.49Å; M286-L291 PolarHBondContact O-N 3.49Å; M286-L292 HydrophobicContact CB-CD1 3.88Å; M286-L292 HydrophobicContact CB-CG 3.94Å; M286-L292 HydrophobicContact CE-CD1 4.07Å; M286-I302 HydrophobicContact CE-CD1 3.96Å
287	T	91.3	Very high	88.5	Confident	18 Å²	18	61 Å²	61	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-42.6	174.3	-53.3	0	0	0	0	111.7	L283 N289 K290 Y329 W341 E342	L283-T287 PolarHBondContact O-N 3.17Å; L283-T287 PolarHBondContact O-OG1 3.3Å; T287-N289 VanDerWaalsContact C-N 3.25Å; T287-N289 PolarHBondContact O-N 2.8Å; T287-K290 PolarHBondContact O-N 2.89Å; T287-Y329 WeakPolarHBondContact OG1-CE2 3.3Å; T287-Y329 PolarHBondContact OG1-OH 3.38Å; T287-W341 HydrophobicContact CG2-CB 3.97Å; T287-E342 VanDerWaalsContact CG2-O 3.27Å; T287-E342 WeakPolarHBondContact CG2-O 3.16Å
288	S	89.1	Confident	88.4	Confident	40 Å²	40	59.7 Å²	59.7	28%	0.28	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-37.1	175.8	-166.2	0	0	0	0	112.7	G284 K285 K290 T339 K340	G284-S288 VanDerWaalsContact O-CB 3.25Å; G284-S288 WeakPolarHBondContact O-CB 3.29Å; G284-S288 PolarHBondContact O-N 2.69Å; K285-S288 PolarHBondContact O-N 3.16Å; S288-K290 PolarHBondContact O-N 3.29Å; S288-T339 VanDerWaalsContact CB-CG2 3.43Å; S288-T339 VanDerWaalsContact OG-CG2 3.24Å; S288-T339 WeakPolarHBondContact OG-CG2 3.41Å; S288-K340 VanDerWaalsContact CB-O 3.32Å; S288-K340 WeakPolarHBondContact CB-O 3.3Å; S288-K340 PolarHBondContact OG-O 3.01Å
289	N	86.4	Confident	88.5	Confident	86 Å²	86	57.5 Å²	57.5	46%	0.46	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	6.6	176.7	-72.7	-0.3	0	0	0	113.8	K285 M286 T287 L291	K285-N289 WeakPolarHBondContact O-CB 3.43Å; K285-N289 VanDerWaalsContact O-CG 3.3Å; K285-N289 PolarHBondContact O-N 3.01Å; M286-N289 PolarHBondContact O-N 3.26Å; T287-N289 VanDerWaalsContact C-N 3.25Å; T287-N289 PolarHBondContact O-N 2.8Å; N289-L291 HydrophobicContact CB-CD1 4.15Å; N289-L291 HydrophobicContact CB-CG 4.03Å; N289-L291 PolarHBondContact O-N 3.34Å
290	K	86.5	Confident	88.5	Confident	138 Å²	138	63 Å²	63	60%	0.6	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	26.4	-176.6	-52.5	-177	178.4	-176.5	0	114.1	K264 M286 T287 S288 E293	K264-K290 WeakPolarHBondContact CE-O 3.44Å; K264-K290 PolarHBondContact NZ-O 3.19Å; M286-K290 PolarHBondContact O-N 3.45Å; T287-K290 PolarHBondContact O-N 2.89Å; S288-K290 PolarHBondContact O-N 3.29Å; K290-E293 HydrophobicContact CB-CG 4.48Å
291	L	85.6	Confident	88.4	Confident	12 Å²	12	64.3 Å²	64.3	6%	0.063	32%	0.32	C	S	.	.	S	Bend	trans	-79	-31.1	172.3	-60.3	171.6	0	0	0	111	K264 W267 M286 N289	K264-L291 HydrophobicContact CG-CD2 3.95Å; W267-L291 HydrophobicContact CB-CD1 4.43Å; W267-L291 HydrophobicContact CB-CD2 4.24Å; W267-L291 HydrophobicContact CD2-CD1 3.73Å; W267-L291 HydrophobicContact CG-CD1 3.61Å; W267-L291 HydrophobicContact CG-CD2 4.02Å; W267-L291 HydrophobicContact CG-CG 4.37Å; W267-L291 HydrophobicContact CZ2-CD1 4.33Å; W267-L291 VanDerWaalsContact NE1-CD1 3.35Å; M286-L291 HydrophobicContact CB-CB 4.31Å; M286-L291 HydrophobicContact CB-CD1 4.23Å; M286-L291 HydrophobicContact CG-CD1 4.23Å; M286-L291 WeakPolarHBondContact O-CB 3.49Å; M286-L291 PolarHBondContact O-N 3.49Å; N289-L291 HydrophobicContact CB-CD1 4.15Å; N289-L291 HydrophobicContact CB-CG 4.03Å; N289-L291 PolarHBondContact O-N 3.34Å
292	L	87.9	Confident	88.6	Confident	4 Å²	4	56 Å²	56	2%	0.021	28%	0.284	C	S	.	.	S	Bend	trans	-111.1	86.9	177.1	-56.7	-178.3	0	0	0	108.7	L271 L283 M286 E298 I302 I347	L271-L292 HydrophobicContact CD1-CD2 4.35Å; L283-L292 HydrophobicContact CD2-CD1 3.64Å; M286-L292 HydrophobicContact CB-CD1 3.88Å; M286-L292 HydrophobicContact CB-CG 3.94Å; M286-L292 HydrophobicContact CE-CD1 4.07Å; L292-E298 HydrophobicContact CD2-CB 3.92Å; L292-I302 HydrophobicContact CD1-CD1 3.66Å; L292-I302 HydrophobicContact CD2-CD1 3.47Å; L292-I302 VanDerWaalsContact CD2-CD1 3.47Å; L292-I302 HydrophobicContact CG-CD1 4.2Å; L292-I347 HydrophobicContact CD1-CD1 3.98Å
293	E	87.1	Confident	88.8	Confident	82 Å²	82	55.3 Å²	55.3	38%	0.383	28%	0.281	S	S	.	.			trans	-88.5	148.7	173.5	-73.9	167.9	163.5	0	0	109.4	K264 K290 R295 S296 T299	K264-E293 IonicContact NZ-OE1 3.47Å; K264-E293 PolarHBondContact NZ-OE1 3.04Å; K264-E293 IonicContact NZ-OE2 2.63Å; K264-E293 PolarHBondContact NZ-OE2 3.28Å; K290-E293 HydrophobicContact CB-CG 4.48Å; E293-R295 PolarHBondContact O-N 2.64Å; E293-S296 VanDerWaalsContact O-CB 3.3Å; E293-S296 WeakPolarHBondContact O-CB 3.32Å; E293-S296 PolarHBondContact O-N 2.94Å; E293-S296 PolarHBondContact O-OG 3.49Å; E293-T299 PolarHBondContact O-OG1 3.32Å
294	P	86.6	Confident	89	Confident	98 Å²	98	60.1 Å²	60.1	64%	0.636	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	131.7	177.1	-25.9	34.7	0	0	0	111	S296	P294-S296 PolarHBondContact O-N 3.26Å
295	R	83.9	Confident	89	Confident	250 Å²	250	62 Å²	62	94%	0.943	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	17.3	-177.8	-49.8	176.9	177.6	173.2	-1.3	115.2	E293	E293-R295 PolarHBondContact O-N 2.64Å
296	S	88.7	Confident	89.3	Confident	19 Å²	19	56.4 Å²	56.4	13%	0.133	28%	0.284	C	S	.	.			trans	-75	158.3	171.5	91.3	0	0	0	0	111.9	E293 P294 E298 T299 Q300	E293-S296 VanDerWaalsContact O-CB 3.3Å; E293-S296 WeakPolarHBondContact O-CB 3.32Å; E293-S296 PolarHBondContact O-N 2.94Å; E293-S296 PolarHBondContact O-OG 3.49Å; P294-S296 PolarHBondContact O-N 3.26Å; S296-E298 VanDerWaalsContact C-N 3.25Å; S296-E298 WeakPolarHBondContact CB-OE2 3.32Å; S296-E298 PolarHBondContact O-N 2.76Å; S296-E298 PolarHBondContact OG-N 3.2Å; S296-E298 PolarHBondContact OG-OE2 3.06Å; S296-T299 PolarHBondContact O-N 3.12Å; S296-T299 PolarHBondContact OG-N 3.36Å; S296-T299 PolarHBondContact OG-OG1 3.06Å; S296-Q300 PolarHBondContact O-N 3.29Å; S296-Q300 VanDerWaalsContact O-N 3.09Å
297	A	87.1	Confident	89.6	Confident	65 Å²	65	60.3 Å²	60.3	54%	0.537	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-33	177.7	0	0	0	0	0	112.1	Q300 T301	A297-Q300 PolarHBondContact O-N 3.15Å; A297-T301 WeakPolarHBondContact O-CB 3.2Å; A297-T301 PolarHBondContact O-N 3.39Å; A297-T301 PolarHBondContact O-OG1 2.92Å
298	E	88.6	Confident	89.8	Confident	42 Å²	42	62.5 Å²	62.5	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-66.6	-43.8	176.7	-59.1	73.6	-159.8	0	0	111.1	L271 L292 S296 Q300 T301 I302	L271-E298 HydrophobicContact CD1-CB 3.79Å; L271-E298 HydrophobicContact CD1-CG 4.16Å; L292-E298 HydrophobicContact CD2-CB 3.92Å; S296-E298 VanDerWaalsContact C-N 3.25Å; S296-E298 WeakPolarHBondContact CB-OE2 3.32Å; S296-E298 PolarHBondContact O-N 2.76Å; S296-E298 PolarHBondContact OG-N 3.2Å; S296-E298 PolarHBondContact OG-OE2 3.06Å; E298-Q300 VanDerWaalsContact C-N 3.33Å; E298-Q300 PolarHBondContact O-N 2.55Å; E298-T301 PolarHBondContact O-N 2.85Å; E298-I302 WeakPolarHBondContact O-CG1 3.39Å; E298-I302 PolarHBondContact O-N 3.35Å
299	T	90.7	Very high	90	Very high	3 Å²	3	65 Å²	65	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-60.7	-44.7	175	-63.2	0	0	0	0	110.5	E293 S296 I302 C303 S346 I347	E293-T299 PolarHBondContact O-OG1 3.32Å; S296-T299 PolarHBondContact O-N 3.12Å; S296-T299 PolarHBondContact OG-N 3.36Å; S296-T299 PolarHBondContact OG-OG1 3.06Å; T299-I302 PolarHBondContact O-N 2.94Å; T299-C303 PolarHBondContact O-N 2.89Å; T299-C303 PolarHBondContact O-SG 3.04Å; T299-S346 WeakPolarHBondContact CG2-OG 3.39Å; T299-I347 HydrophobicContact CG2-CD1 4.08Å; T299-I347 HydrophobicContact CG2-CG1 3.9Å
300	Q	91.2	Very high	90.3	Very high	117 Å²	117	64.8 Å²	64.8	55%	0.547	33%	0.325	S	S	.	.	H	α-helix	trans	-61.6	-45	175.9	-177.4	176.2	-11	0	0	112	S296 A297 E298 I302 C303 E304	S296-Q300 PolarHBondContact O-N 3.29Å; S296-Q300 VanDerWaalsContact O-N 3.09Å; A297-Q300 PolarHBondContact O-N 3.15Å; E298-Q300 VanDerWaalsContact C-N 3.33Å; E298-Q300 PolarHBondContact O-N 2.55Å; Q300-I302 VanDerWaalsContact C-N 3.3Å; Q300-I302 PolarHBondContact O-N 3.24Å; Q300-C303 WeakPolarHBondContact O-CB 3.31Å; Q300-C303 PolarHBondContact O-N 3.48Å; Q300-C303 VanDerWaalsContact O-N 3.15Å; Q300-E304 HydrophobicContact CG-CG 4.39Å; Q300-E304 WeakPolarHBondContact CG-OE1 3.47Å; Q300-E304 PolarHBondContact NE2-OE1 2.93Å; Q300-E304 WeakPolarHBondContact O-CG 3.31Å; Q300-E304 PolarHBondContact O-N 2.92Å
301	T	90.9	Very high	90.5	Very high	43 Å²	43	59.9 Å²	59.9	26%	0.264	31%	0.309	S	S	.	.	H	α-helix	trans	-58.3	-42.6	177.8	-57.7	0	0	0	0	111.3	A297 E298 E304 R305	A297-T301 WeakPolarHBondContact O-CB 3.2Å; A297-T301 PolarHBondContact O-N 3.39Å; A297-T301 PolarHBondContact O-OG1 2.92Å; E298-T301 PolarHBondContact O-N 2.85Å; T301-E304 PolarHBondContact O-N 3.22Å; T301-R305 VanDerWaalsContact O-CG 3.29Å; T301-R305 WeakPolarHBondContact O-CG 3.45Å; T301-R305 PolarHBondContact O-N 3.27Å
302	I	91.9	Very high	90.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-45.2	176.4	-71.5	178.4	0	0	0	111.1	L271 I279 L283 M286 L292 E298 T299 Q300 E304 R305 L306	L271-I302 HydrophobicContact CD1-CD1 4.21Å; L271-I302 HydrophobicContact CD1-CG1 4.4Å; L271-I302 HydrophobicContact CD2-CD1 3.84Å; L271-I302 HydrophobicContact CD2-CG1 4.1Å; I279-I302 HydrophobicContact CG2-CG2 4.22Å; L283-I302 HydrophobicContact CD2-CD1 3.98Å; L283-I302 HydrophobicContact CD2-CG2 4.11Å; M286-I302 HydrophobicContact CE-CD1 3.96Å; L292-I302 HydrophobicContact CD1-CD1 3.66Å; L292-I302 HydrophobicContact CD2-CD1 3.47Å; L292-I302 VanDerWaalsContact CD2-CD1 3.47Å; L292-I302 HydrophobicContact CG-CD1 4.2Å; E298-I302 WeakPolarHBondContact O-CG1 3.39Å; E298-I302 PolarHBondContact O-N 3.35Å; T299-I302 PolarHBondContact O-N 2.94Å; Q300-I302 VanDerWaalsContact C-N 3.3Å; Q300-I302 PolarHBondContact O-N 3.24Å; I302-E304 VanDerWaalsContact C-N 3.33Å; I302-E304 PolarHBondContact O-N 3.38Å; I302-R305 PolarHBondContact O-N 3.09Å; I302-L306 HydrophobicContact CG2-CD1 3.79Å; I302-L306 HydrophobicContact CG2-CG 4.25Å; I302-L306 WeakPolarHBondContact O-CB 3.3Å; I302-L306 WeakPolarHBondContact O-CG 3.25Å; I302-L306 PolarHBondContact O-N 3.16Å
303	C	94.1	Very high	91	Very high	12 Å²	12	65.4 Å²	65.4	8%	0.081	33%	0.332	C	S	.	.	H	α-helix	trans	-58.6	-46.1	177.6	-70.9	0	0	0	0	111.2	T299 Q300 R305 L306 Q307 A350	T299-C303 PolarHBondContact O-N 2.89Å; T299-C303 PolarHBondContact O-SG 3.04Å; Q300-C303 WeakPolarHBondContact O-CB 3.31Å; Q300-C303 PolarHBondContact O-N 3.48Å; Q300-C303 VanDerWaalsContact O-N 3.15Å; C303-R305 PolarHBondContact O-N 3.44Å; C303-L306 PolarHBondContact O-N 3.15Å; C303-Q307 VanDerWaalsContact O-CB 3.3Å; C303-Q307 WeakPolarHBondContact O-CB 3.32Å; C303-Q307 VanDerWaalsContact O-CG 3.29Å; C303-Q307 WeakPolarHBondContact O-CG 3.48Å; C303-Q307 PolarHBondContact O-N 2.81Å; C303-A350 HydrophobicContact CB-CB 4.05Å
304	E	93.8	Very high	91.2	Very high	104 Å²	104	70.8 Å²	70.8	49%	0.486	35%	0.354	S	S	.	.	H	α-helix	trans	-60.9	-42.6	176.5	-72.5	172.6	-172.2	0	0	112.1	Q300 T301 I302 Q307 N308	Q300-E304 HydrophobicContact CG-CG 4.39Å; Q300-E304 WeakPolarHBondContact CG-OE1 3.47Å; Q300-E304 PolarHBondContact NE2-OE1 2.93Å; Q300-E304 WeakPolarHBondContact O-CG 3.31Å; Q300-E304 PolarHBondContact O-N 2.92Å; T301-E304 PolarHBondContact O-N 3.22Å; I302-E304 VanDerWaalsContact C-N 3.33Å; I302-E304 PolarHBondContact O-N 3.38Å; E304-Q307 CarbonylContact O-C 3.55Å; E304-Q307 PolarHBondContact O-N 3.42Å; E304-N308 WeakPolarHBondContact O-CB 3.36Å; E304-N308 PolarHBondContact O-N 3.41Å; E304-N308 VanDerWaalsContact O-N 3.17Å
305	R	92.5	Very high	91.3	Very high	49 Å²	49	67.6 Å²	67.6	19%	0.185	34%	0.336	C	S	.	.	H	α-helix	trans	-67.5	-38.5	177.2	-71.6	-172	73.3	-161.4	0.6	112.9	L271 I274 L276 I279 T301 I302 C303 Q307 N308	L271-R305 PolarHBondContact O-NH1 3.33Å; I274-R305 VanDerWaalsContact O-CZ 3.24Å; I274-R305 PolarHBondContact O-NH1 3.18Å; I274-R305 PolarHBondContact O-NH2 3.4Å; L276-R305 HydrophobicContact CD2-CB 4.06Å; I279-R305 VanDerWaalsContact CD1-NH1 3.28Å; T301-R305 VanDerWaalsContact O-CG 3.29Å; T301-R305 WeakPolarHBondContact O-CG 3.45Å; T301-R305 PolarHBondContact O-N 3.27Å; I302-R305 PolarHBondContact O-N 3.09Å; C303-R305 PolarHBondContact O-N 3.44Å; R305-Q307 VanDerWaalsContact C-N 3.29Å; R305-N308 PolarHBondContact O-N 3.26Å
306	L	93.6	Very high	91.6	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-69.6	-30	174.8	-71.7	174.4	0	0	0	111.7	L276 L280 I302 C303 N308 A350 M351 A354	L276-L306 HydrophobicContact CD2-CD2 4.47Å; L280-L306 HydrophobicContact CD2-CD2 4.04Å; I302-L306 HydrophobicContact CG2-CD1 3.79Å; I302-L306 HydrophobicContact CG2-CG 4.25Å; I302-L306 WeakPolarHBondContact O-CB 3.3Å; I302-L306 WeakPolarHBondContact O-CG 3.25Å; I302-L306 PolarHBondContact O-N 3.16Å; C303-L306 PolarHBondContact O-N 3.15Å; L306-N308 VanDerWaalsContact C-N 3.3Å; L306-A350 HydrophobicContact CB-CB 4.12Å; L306-A350 HydrophobicContact CD1-CB 4.27Å; L306-M351 HydrophobicContact CD1-CG 4.08Å; L306-A354 WeakPolarHBondContact O-CB 3.33Å
307	Q	94.9	Very high	91.8	Very high	84 Å²	84	59.8 Å²	59.8	39%	0.393	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	10	177.6	-68.8	177.1	-31.6	0	0	113.9	C303 E304 R305 A350 W353	C303-Q307 VanDerWaalsContact O-CB 3.3Å; C303-Q307 WeakPolarHBondContact O-CB 3.32Å; C303-Q307 VanDerWaalsContact O-CG 3.29Å; C303-Q307 WeakPolarHBondContact O-CG 3.48Å; C303-Q307 PolarHBondContact O-N 2.81Å; E304-Q307 CarbonylContact O-C 3.55Å; E304-Q307 PolarHBondContact O-N 3.42Å; R305-Q307 VanDerWaalsContact C-N 3.29Å; Q307-A350 HydrophobicContact CG-CB 4Å; Q307-W353 HydrophobicContact CB-CE3 4.11Å; Q307-W353 HydrophobicContact CB-CZ3 4.29Å; Q307-W353 HydrophobicContact CG-CD2 4.3Å; Q307-W353 HydrophobicContact CG-CE3 4.06Å; Q307-W353 WeakPolarHBondContact O-CH2 3.48Å; Q307-W353 VanDerWaalsContact O-CZ3 3.31Å; Q307-W353 WeakPolarHBondContact O-CZ3 3.3Å
308	N	94.2	Very high	92.1	Very high	63 Å²	63	58 Å²	58	34%	0.337	29%	0.292	S	S	.	.			trans	-99.7	104.8	178.6	-173.7	-43.9	0	0	0	111	E304 R305 L306 S310 S311 L312	E304-N308 WeakPolarHBondContact O-CB 3.36Å; E304-N308 PolarHBondContact O-N 3.41Å; E304-N308 VanDerWaalsContact O-N 3.17Å; R305-N308 PolarHBondContact O-N 3.26Å; L306-N308 VanDerWaalsContact C-N 3.3Å; N308-S310 VanDerWaalsContact C-N 3.34Å; N308-S310 PolarHBondContact O-N 3.01Å; N308-S310 PolarHBondContact OD1-N 2.97Å; N308-S310 VanDerWaalsContact OD1-N 3.1Å; N308-S310 PolarHBondContact OD1-OG 3.06Å; N308-S311 VanDerWaalsContact CG-OG 3.29Å; N308-S311 WeakPolarHBondContact O-CB 3.45Å; N308-S311 PolarHBondContact O-N 2.87Å; N308-S311 VanDerWaalsContact O-N 3.1Å; N308-S311 PolarHBondContact OD1-N 3.08Å; N308-S311 PolarHBondContact OD1-OG 3.05Å; N308-L312 WeakPolarHBondContact O-CG 3.49Å; N308-L312 PolarHBondContact O-N 3.1Å
309	E	94	Very high	92.4	Very high	94 Å²	94	56 Å²	56	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-54.5	-45.7	-179.9	-174.1	-178.5	159.4	0	0	113	S311 L312 K313 W353 T357 Q360	E309-S311 VanDerWaalsContact C-N 3.27Å; E309-S311 PolarHBondContact O-N 2.8Å; E309-L312 PolarHBondContact O-N 3.06Å; E309-K313 WeakPolarHBondContact O-CB 3.43Å; E309-K313 PolarHBondContact O-N 3.27Å; E309-W353 HydrophobicContact CB-CH2 4.34Å; E309-T357 HydrophobicContact CB-CG2 4.14Å; E309-T357 HydrophobicContact CG-CG2 3.82Å; E309-Q360 PolarHBondContact OE1-OE1 3.32Å
310	S	92.1	Very high	92.5	Very high	80 Å²	80	56 Å²	56	56%	0.559	28%	0.282	S	S	*	.	H	α-helix	trans	-63.3	-35	-179.8	73.5	0	0	0	0	112.4	N308 K314	N308-S310 VanDerWaalsContact C-N 3.34Å; N308-S310 PolarHBondContact O-N 3.01Å; N308-S310 PolarHBondContact OD1-N 2.97Å; N308-S310 VanDerWaalsContact OD1-N 3.1Å; N308-S310 PolarHBondContact OD1-OG 3.06Å; S310-K314 VanDerWaalsContact O-CB 3.27Å; S310-K314 WeakPolarHBondContact O-CB 3.23Å; S310-K314 PolarHBondContact O-N 2.96Å
311	S	90.4	Very high	92.6	Very high	36 Å²	36	51.5 Å²	51.5	25%	0.252	26%	0.264	S	S	.	.	H	α-helix	trans	-72.7	-41.9	177.7	-62.8	0	0	0	0	111.5	N308 E309 K313 A315	N308-S311 VanDerWaalsContact CG-OG 3.29Å; N308-S311 WeakPolarHBondContact O-CB 3.45Å; N308-S311 PolarHBondContact O-N 2.87Å; N308-S311 VanDerWaalsContact O-N 3.1Å; N308-S311 PolarHBondContact OD1-N 3.08Å; N308-S311 PolarHBondContact OD1-OG 3.05Å; E309-S311 VanDerWaalsContact C-N 3.27Å; E309-S311 PolarHBondContact O-N 2.8Å; S311-K313 VanDerWaalsContact C-N 3.34Å; S311-A315 VanDerWaalsContact O-CB 3.29Å; S311-A315 WeakPolarHBondContact O-CB 3.43Å; S311-A315 PolarHBondContact O-N 3.39Å
312	L	92.4	Very high	92.8	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-45.4	174.3	-68.1	176.2	0	0	0	111.3	L276 N308 E309 A315 N316 I317 W353 A354 T357 N361	L276-L312 HydrophobicContact CD1-CD2 4.21Å; N308-L312 WeakPolarHBondContact O-CG 3.49Å; N308-L312 PolarHBondContact O-N 3.1Å; E309-L312 PolarHBondContact O-N 3.06Å; L312-A315 PolarHBondContact O-N 3.31Å; L312-N316 PolarHBondContact O-N 3.25Å; L312-N316 VanDerWaalsContact O-N 3.09Å; L312-I317 HydrophobicContact CD2-CD1 3.76Å; L312-I317 PolarHBondContact O-N 2.87Å; L312-W353 HydrophobicContact CD1-CZ3 3.92Å; L312-A354 HydrophobicContact CD1-CB 4.01Å; L312-A354 HydrophobicContact CD2-CB 4.29Å; L312-T357 HydrophobicContact CD1-CG2 4.17Å; L312-N361 PolarHBondContact O-ND2 3.31Å
313	K	91.6	Very high	93	Very high	131 Å²	131	49.8 Å²	49.8	57%	0.57	25%	0.253	S	S	*	.	H	α-helix	trans	-66.6	-46.5	179.4	-171	172.2	-173.6	169.3	0	112.4	E309 S311 A315 N316 N361	E309-K313 WeakPolarHBondContact O-CB 3.43Å; E309-K313 PolarHBondContact O-N 3.27Å; S311-K313 VanDerWaalsContact C-N 3.34Å; K313-A315 VanDerWaalsContact C-N 3.28Å; K313-A315 PolarHBondContact O-N 2.61Å; K313-N316 PolarHBondContact O-N 3.31Å; K313-N361 VanDerWaalsContact CA-OD1 3.29Å; K313-N361 WeakPolarHBondContact CA-OD1 3.35Å
314	K	91.2	Very high	92.9	Very high	194 Å²	194	51.8 Å²	51.8	84%	0.843	26%	0.262	S	S	*	.	H	α-helix	trans	-60.8	-37.7	176.7	-177.1	179.3	177.8	-177.8	0	112.2	S310 N316	S310-K314 VanDerWaalsContact O-CB 3.27Å; S310-K314 WeakPolarHBondContact O-CB 3.23Å; S310-K314 PolarHBondContact O-N 2.96Å; K314-N316 VanDerWaalsContact C-N 3.25Å; K314-N316 PolarHBondContact O-N 3.28Å
315	A	89.8	Confident	92.9	Very high	31 Å²	31	47.3 Å²	47.3	26%	0.256	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-7.1	176.8	0	0	0	0	0	113.4	L276 H277 S311 L312 K313 I317	L276-A315 HydrophobicContact CB-CB 4.36Å; L276-A315 HydrophobicContact CD1-CB 4.13Å; H277-A315 PolarHBondContact NE2-O 3.4Å; S311-A315 VanDerWaalsContact O-CB 3.29Å; S311-A315 WeakPolarHBondContact O-CB 3.43Å; S311-A315 PolarHBondContact O-N 3.39Å; L312-A315 PolarHBondContact O-N 3.31Å; K313-A315 VanDerWaalsContact C-N 3.28Å; K313-A315 PolarHBondContact O-N 2.61Å; A315-I317 VanDerWaalsContact C-N 3.3Å; A315-I317 HydrophobicContact CB-CD1 4.11Å; A315-I317 HydrophobicContact CB-CG1 3.74Å; A315-I317 PolarHBondContact O-N 3.1Å
316	N	90.6	Very high	93	Very high	106 Å²	106	45.5 Å²	45.5	57%	0.567	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	51	-176.2	-164.6	19.8	0	0	0	112.5	L312 K313 K314 N361	L312-N316 PolarHBondContact O-N 3.25Å; L312-N316 VanDerWaalsContact O-N 3.09Å; K313-N316 PolarHBondContact O-N 3.31Å; K314-N316 VanDerWaalsContact C-N 3.25Å; K314-N316 PolarHBondContact O-N 3.28Å; N316-N361 PolarHBondContact OD1-O 3.22Å
317	I	92.1	Very high	92.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.			trans	-80.3	126.2	-178.9	-53.7	-179.3	0	0	0	109.1	L276 L280 L312 A315 I322 N361	L276-I317 HydrophobicContact CB-CD1 3.33Å; L276-I317 HydrophobicContact CB-CG1 4.44Å; L276-I317 HydrophobicContact CD1-CD1 3.7Å; L276-I317 HydrophobicContact CG-CD1 4.13Å; L280-I317 HydrophobicContact CD1-CD1 4.45Å; L280-I317 HydrophobicContact CD1-CG2 3.93Å; L312-I317 HydrophobicContact CD2-CD1 3.76Å; L312-I317 PolarHBondContact O-N 2.87Å; A315-I317 VanDerWaalsContact C-N 3.3Å; A315-I317 HydrophobicContact CB-CD1 4.11Å; A315-I317 HydrophobicContact CB-CG1 3.74Å; A315-I317 PolarHBondContact O-N 3.1Å; I317-I322 HydrophobicContact CG2-CD1 3.88Å; I317-I322 HydrophobicContact CG2-CG1 3.67Å; I317-N361 PolarHBondContact O-ND2 3.31Å
318	H	93.3	Very high	92.7	Very high	27 Å²	27	44.9 Å²	44.9	13%	0.125	24%	0.236	C	C	.	.			trans	-80.7	141	176	-168.2	-87	0	0	0	111.4	F320 S321 L523 F526	H318-F320 VanDerWaalsContact C-N 3.28Å; H318-F320 VanDerWaalsContact ND1-CB 3.32Å; H318-F320 WeakPolarHBondContact ND1-CB 3.26Å; H318-F320 PolarHBondContact ND1-N 3.16Å; H318-F320 VanDerWaalsContact ND1-N 3.16Å; H318-F320 PolarHBondContact O-N 2.96Å; H318-S321 VanDerWaalsContact O-CB 3.31Å; H318-S321 WeakPolarHBondContact O-CB 3.45Å; H318-S321 PolarHBondContact O-N 3.04Å; H318-L523 HydrophobicContact CB-CD1 3.44Å; H318-L523 VanDerWaalsContact CB-CD1 3.44Å; H318-L523 WeakPolarHBondContact ND1-CD1 3.38Å; H318-F526 AromaticContact CE1-CD2 3.39Å; H318-F526 WeakPolarHBondContact CE1-CD2 3.36Å; H318-F526 AromaticContact CE1-CE2 3.45Å; H318-F526 VanDerWaalsContact CE1-CE2 3.45Å; H318-F526 WeakPolarHBondContact CE1-CE2 3.36Å; H318-F526 AromaticContact CE1-CG 3.79Å; H318-F526 AromaticContact CE1-CZ 3.92Å; H318-F526 AromaticContact NE2-CD2 3.88Å; H318-F526 AromaticContact NE2-CG 3.85Å
319	P	94.8	Very high	92.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-54.6	-42.1	-179.6	16.9	-30.7	0	0	0	113.1	S321 I322 L323 F355 S358 F359 V362 I400	P319-S321 PolarHBondContact O-N 3.1Å; P319-I322 WeakPolarHBondContact O-CB 3.3Å; P319-I322 PolarHBondContact O-N 2.9Å; P319-L323 PolarHBondContact O-N 3.36Å; P319-F355 HydrophobicContact CB-CD2 3.85Å; P319-F355 HydrophobicContact CB-CE2 3.94Å; P319-F355 WeakPolarHBondContact O-CD2 3.32Å; P319-S358 WeakPolarHBondContact CA-OG 3.46Å; P319-S358 VanDerWaalsContact CB-OG 3.26Å; P319-S358 WeakPolarHBondContact CB-OG 3.37Å; P319-F359 HydrophobicContact CB-CD2 4.22Å; P319-F359 HydrophobicContact CB-CE2 4.06Å; P319-F359 HydrophobicContact CB-CZ 4.3Å; P319-V362 HydrophobicContact CG-CG2 3.96Å; P319-I400 HydrophobicContact CB-CD1 4.41Å; P319-I400 HydrophobicContact CB-CG1 4.43Å; P319-I400 HydrophobicContact CG-CD1 3.99Å; P319-I400 HydrophobicContact CG-CG1 3.89Å
320	F	93.4	Very high	92.6	Very high	3 Å²	3	42.5 Å²	42.5	1%	0.013	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-30.7	177.8	-162.4	-100.2	0	0	0	113.7	H318 I322 L323 L324 I388 I397 I400 F521 F526	H318-F320 VanDerWaalsContact C-N 3.28Å; H318-F320 VanDerWaalsContact ND1-CB 3.32Å; H318-F320 WeakPolarHBondContact ND1-CB 3.26Å; H318-F320 PolarHBondContact ND1-N 3.16Å; H318-F320 VanDerWaalsContact ND1-N 3.16Å; H318-F320 PolarHBondContact O-N 2.96Å; F320-I322 VanDerWaalsContact C-N 3.33Å; F320-L323 HydrophobicContact CD2-CD2 4.34Å; F320-L323 HydrophobicContact CE2-CD2 4.42Å; F320-L323 PolarHBondContact O-N 3.44Å; F320-L324 WeakPolarHBondContact O-CB 3.21Å; F320-L324 PolarHBondContact O-N 3.46Å; F320-I388 HydrophobicContact CZ-CD1 4.21Å; F320-I397 HydrophobicContact CE2-CG1 4.47Å; F320-I400 HydrophobicContact CB-CD1 4.15Å; F320-I400 HydrophobicContact CD2-CD1 4.45Å; F320-F521 HydrophobicContact CE1-CD1 4.15Å; F320-F521 HydrophobicContact CE2-CD1 4.13Å; F320-F521 HydrophobicContact CE2-CE1 4.39Å; F320-F521 AromaticContact CZ-CD1 3.75Å; F320-F521 HydrophobicContact CZ-CD1 3.75Å; F320-F521 HydrophobicContact CZ-CE1 4.36Å; F320-F526 HydrophobicContact CB-CD2 4.41Å; F320-F526 HydrophobicContact CB-CE2 3.56Å; F320-F526 HydrophobicContact CB-CZ 4.28Å; F320-F526 HydrophobicContact CD1-CE2 4.17Å; F320-F526 AromaticContact CD2-CE2 3.91Å; F320-F526 HydrophobicContact CD2-CE2 3.91Å; F320-F526 HydrophobicContact CD2-CZ 4.19Å; F320-F526 AromaticContact CG-CE2 3.63Å; F320-F526 HydrophobicContact CG-CE2 3.63Å; F320-F526 HydrophobicContact CG-CZ 4.33Å
321	S	93.3	Very high	92.5	Very high	23 Å²	23	42.3 Å²	42.3	16%	0.161	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-36.8	175.3	-56.3	0	0	0	0	111.9	H318 P319 A325	H318-S321 VanDerWaalsContact O-CB 3.31Å; H318-S321 WeakPolarHBondContact O-CB 3.45Å; H318-S321 PolarHBondContact O-N 3.04Å; P319-S321 PolarHBondContact O-N 3.1Å; S321-A325 WeakPolarHBondContact O-CB 3.31Å; S321-A325 PolarHBondContact O-N 2.88Å
322	I	95.4	Very high	92.4	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-70.3	-43.7	176.4	-60.7	170	0	0	0	109.9	L280 I317 P319 F320 L324 A325 S326 M351 A354 F355	L280-I322 HydrophobicContact CD1-CG1 4.06Å; I317-I322 HydrophobicContact CG2-CD1 3.88Å; I317-I322 HydrophobicContact CG2-CG1 3.67Å; P319-I322 WeakPolarHBondContact O-CB 3.3Å; P319-I322 PolarHBondContact O-N 2.9Å; F320-I322 VanDerWaalsContact C-N 3.33Å; I322-L324 PolarHBondContact O-N 2.89Å; I322-A325 PolarHBondContact O-N 2.88Å; I322-S326 VanDerWaalsContact O-CB 3.29Å; I322-S326 WeakPolarHBondContact O-CB 3.38Å; I322-S326 PolarHBondContact O-N 3.32Å; I322-M351 HydrophobicContact CG2-CB 4.08Å; I322-M351 HydrophobicContact CG2-CG 4.47Å; I322-M351 VanDerWaalsContact CG2-O 3.26Å; I322-M351 WeakPolarHBondContact CG2-O 3.26Å; I322-A354 HydrophobicContact CD1-CB 3.86Å; I322-A354 WeakPolarHBondContact CD1-O 3.39Å; I322-A354 HydrophobicContact CG2-CB 4.41Å; I322-F355 HydrophobicContact CB-CB 4.44Å; I322-F355 HydrophobicContact CG2-CB 3.99Å
323	L	94.6	Very high	92.2	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-48.1	175.5	177.9	62	0	0	0	111.5	P319 F320 A325 S326 E327 F355 I388 V392 A396 L429	P319-L323 PolarHBondContact O-N 3.36Å; F320-L323 HydrophobicContact CD2-CD2 4.34Å; F320-L323 HydrophobicContact CE2-CD2 4.42Å; F320-L323 PolarHBondContact O-N 3.44Å; L323-A325 VanDerWaalsContact C-N 3.32Å; L323-A325 PolarHBondContact O-N 3.15Å; L323-S326 PolarHBondContact O-N 3Å; L323-E327 HydrophobicContact CD1-CG 4.08Å; L323-E327 PolarHBondContact O-N 3.3Å; L323-F355 HydrophobicContact CB-CD2 4.2Å; L323-F355 HydrophobicContact CB-CE2 4.13Å; L323-I388 HydrophobicContact CD2-CD1 4.36Å; L323-I388 HydrophobicContact CG-CD1 4.16Å; L323-V392 HydrophobicContact CD1-CG1 4.35Å; L323-V392 HydrophobicContact CD2-CG1 4.47Å; L323-A396 HydrophobicContact CD2-CB 3.32Å; L323-L429 HydrophobicContact CD1-CD2 3.71Å; L323-L429 HydrophobicContact CD2-CD2 4.42Å
324	L	92.4	Very high	91.8	Very high	53 Å²	53	39.8 Å²	39.8	28%	0.277	20%	0.204	S	C	.	.	H	α-helix	trans	-60.9	-42	177.4	-178.6	62.3	0	0	0	112	F320 I322 N328 T386 I388	F320-L324 WeakPolarHBondContact O-CB 3.21Å; F320-L324 PolarHBondContact O-N 3.46Å; I322-L324 PolarHBondContact O-N 2.89Å; L324-N328 VanDerWaalsContact O-CB 3.26Å; L324-N328 WeakPolarHBondContact O-CB 3.35Å; L324-N328 PolarHBondContact O-N 3.46Å; L324-N328 VanDerWaalsContact O-N 3.07Å; L324-N328 PolarHBondContact O-ND2 3.29Å; L324-T386 HydrophobicContact CD1-CG2 3.71Å; L324-I388 HydrophobicContact CB-CD1 4.3Å; L324-I388 HydrophobicContact CD1-CD1 3.97Å; L324-I388 HydrophobicContact CD1-CG1 4.4Å
325	A	93.5	Very high	90.9	Very high	10 Å²	10	36.5 Å²	36.5	8%	0.083	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-43.5	176.3	0	0	0	0	0	112	L280 S321 I322 L323 N328 Y329 M351	L280-A325 HydrophobicContact CB-CB 3.82Å; L280-A325 HydrophobicContact CD2-CB 3.9Å; L280-A325 HydrophobicContact CG-CB 4.33Å; S321-A325 WeakPolarHBondContact O-CB 3.31Å; S321-A325 PolarHBondContact O-N 2.88Å; I322-A325 PolarHBondContact O-N 2.88Å; L323-A325 VanDerWaalsContact C-N 3.32Å; L323-A325 PolarHBondContact O-N 3.15Å; A325-N328 PolarHBondContact O-N 3Å; A325-Y329 VanDerWaalsContact O-CB 3.26Å; A325-Y329 WeakPolarHBondContact O-CB 3.4Å; A325-Y329 PolarHBondContact O-N 3.35Å; A325-M351 HydrophobicContact CB-CE 4.23Å
326	S	94.9	Very high	90.1	Very high	11 Å²	11	42.8 Å²	42.8	8%	0.077	21%	0.213	C	C	.	.	H	α-helix	trans	-59.4	-53.3	177.2	166.8	0	0	0	0	111.4	I322 L323 N328 Y329 K330 M351	I322-S326 VanDerWaalsContact O-CB 3.29Å; I322-S326 WeakPolarHBondContact O-CB 3.38Å; I322-S326 PolarHBondContact O-N 3.32Å; L323-S326 PolarHBondContact O-N 3Å; S326-N328 VanDerWaalsContact C-N 3.34Å; S326-N328 PolarHBondContact O-N 3.28Å; S326-Y329 PolarHBondContact O-N 2.9Å; S326-Y329 VanDerWaalsContact O-N 3.12Å; S326-K330 WeakPolarHBondContact O-CB 3.34Å; S326-K330 VanDerWaalsContact O-CG 3.31Å; S326-K330 WeakPolarHBondContact O-CG 3.29Å; S326-K330 PolarHBondContact O-N 3.34Å; S326-K330 WeakPolarHBondContact OG-CE 3.45Å; S326-M351 VanDerWaalsContact CA-SD 3.56Å
327	E	92.2	Very high	89.4	Confident	42 Å²	42	39.2 Å²	39.2	20%	0.196	20%	0.202	C	C	.	.	H	α-helix	trans	-65.1	-37.8	-179.9	-66.9	-50.4	125.6	0	0	112.3	L323 Y329 K330 R331 A387 I388	L323-E327 HydrophobicContact CD1-CG 4.08Å; L323-E327 PolarHBondContact O-N 3.3Å; E327-Y329 VanDerWaalsContact C-N 3.34Å; E327-Y329 PolarHBondContact O-N 3.41Å; E327-K330 IonicContact OE1-NZ 3.28Å; E327-K330 PolarHBondContact OE1-NZ 2.86Å; E327-R331 PolarHBondContact O-N 2.81Å; E327-R331 VanDerWaalsContact O-N 3.17Å; E327-A387 HydrophobicContact CB-CB 4.24Å; E327-I388 HydrophobicContact CB-CG1 3.97Å; E327-I388 HydrophobicContact CG-CG1 3.94Å
328	N	90.9	Very high	88.7	Confident	31 Å²	31	47.7 Å²	47.7	17%	0.166	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-39	173.1	-75.6	-32.9	0	0	0	112.2	L324 A325 S326 R331 F335 W341	L324-N328 VanDerWaalsContact O-CB 3.26Å; L324-N328 WeakPolarHBondContact O-CB 3.35Å; L324-N328 PolarHBondContact O-N 3.46Å; L324-N328 VanDerWaalsContact O-N 3.07Å; L324-N328 PolarHBondContact O-ND2 3.29Å; A325-N328 PolarHBondContact O-N 3Å; S326-N328 VanDerWaalsContact C-N 3.34Å; S326-N328 PolarHBondContact O-N 3.28Å; N328-R331 WeakPolarHBondContact O-CB 3.48Å; N328-F335 WeakPolarHBondContact OD1-CE2 3.23Å; N328-F335 WeakPolarHBondContact OD1-CZ 3.17Å; N328-W341 WeakPolarHBondContact O-CZ2 3.39Å
329	Y	93.5	Very high	88.3	Confident	4 Å²	4	49 Å²	49	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-70.1	-44.1	178.8	-172.3	-116.5	0	0	0	111.6	L283 T287 A325 S326 E327 R331 G332 W341 A343 D344 I347 L348	L283-Y329 HydrophobicContact CB-CD2 4.02Å; L283-Y329 HydrophobicContact CB-CE2 4.19Å; T287-Y329 WeakPolarHBondContact OG1-CE2 3.3Å; T287-Y329 PolarHBondContact OG1-OH 3.38Å; A325-Y329 VanDerWaalsContact O-CB 3.26Å; A325-Y329 WeakPolarHBondContact O-CB 3.4Å; A325-Y329 PolarHBondContact O-N 3.35Å; S326-Y329 PolarHBondContact O-N 2.9Å; S326-Y329 VanDerWaalsContact O-N 3.12Å; E327-Y329 VanDerWaalsContact C-N 3.34Å; E327-Y329 PolarHBondContact O-N 3.41Å; Y329-R331 PolarHBondContact O-N 3.09Å; Y329-G332 PolarHBondContact O-N 3.49Å; Y329-G332 VanDerWaalsContact O-N 3.12Å; Y329-W341 AromaticContact CD2-CD1 3.97Å; Y329-W341 AromaticContact CD2-NE1 3.4Å; Y329-W341 AromaticContact CE2-CD1 3.72Å; Y329-W341 AromaticContact CE2-NE1 3.66Å; Y329-W341 PolarHBondContact O-NE1 3.45Å; Y329-A343 HydrophobicContact CD1-CB 4.06Å; Y329-A343 HydrophobicContact CE1-CB 3.91Å; Y329-D344 PolarHBondContact OH-N 2.95Å; Y329-D344 VanDerWaalsContact OH-N 3.14Å; Y329-I347 HydrophobicContact CD1-CG2 4.33Å; Y329-I347 HydrophobicContact CE1-CB 4.1Å; Y329-I347 HydrophobicContact CE1-CG2 3.97Å; Y329-L348 HydrophobicContact CD1-CD2 3.74Å; Y329-L348 HydrophobicContact CD1-CG 4.15Å; Y329-L348 HydrophobicContact CE1-CD2 4.48Å; Y329-L348 HydrophobicContact CE1-CG 4.43Å
330	K	92.9	Very high	88.2	Confident	103 Å²	103	55.8 Å²	55.8	45%	0.448	28%	0.278	S	S	.	.	H	α-helix	trans	-55.4	-36	174.3	-73.6	177.2	-172.1	170.1	0	112.7	S326 E327 G332 L348	S326-K330 WeakPolarHBondContact O-CB 3.34Å; S326-K330 VanDerWaalsContact O-CG 3.31Å; S326-K330 WeakPolarHBondContact O-CG 3.29Å; S326-K330 PolarHBondContact O-N 3.34Å; S326-K330 WeakPolarHBondContact OG-CE 3.45Å; E327-K330 IonicContact OE1-NZ 3.28Å; E327-K330 PolarHBondContact OE1-NZ 2.86Å; K330-G332 PolarHBondContact O-N 2.93Å; K330-G332 VanDerWaalsContact O-N 3.13Å; K330-L348 HydrophobicContact CD-CD2 4.31Å; K330-L348 HydrophobicContact CG-CD1 3.91Å; K330-L348 HydrophobicContact CG-CD2 3.42Å; K330-L348 VanDerWaalsContact CG-CD2 3.42Å; K330-L348 HydrophobicContact CG-CG 4.33Å
331	R	89.1	Confident	88.2	Confident	76 Å²	76	57.5 Å²	57.5	29%	0.287	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.7	179.6	-165.9	176.9	66.2	-160.6	-7.4	113.7	E327 N328 Y329 Q333	E327-R331 PolarHBondContact O-N 2.81Å; E327-R331 VanDerWaalsContact O-N 3.17Å; N328-R331 WeakPolarHBondContact O-CB 3.48Å; Y329-R331 PolarHBondContact O-N 3.09Å; R331-Q333 HydrophobicContact CG-CG 4.06Å; R331-Q333 PolarHBondContact NE-O 2.95Å; R331-Q333 PolarHBondContact NH2-O 3.18Å; R331-Q333 PolarHBondContact O-N 2.87Å; R331-Q333 VanDerWaalsContact O-N 3.14Å
332	G	89.4	Confident	88.2	Confident	14 Å²	14	64.6 Å²	64.6	14%	0.144	32%	0.315	C	S	.	.			trans	70	7.1	177.6	0	0	0	0	0	115.2	Y329 K330 K340 W341	Y329-G332 PolarHBondContact O-N 3.49Å; Y329-G332 VanDerWaalsContact O-N 3.12Å; K330-G332 PolarHBondContact O-N 2.93Å; K330-G332 VanDerWaalsContact O-N 3.13Å; G332-K340 CarbonylContact O-C 3.57Å; G332-K340 WeakPolarHBondContact O-CA 3.34Å; G332-W341 CarbonylContact C-O 3.51Å; G332-W341 WeakPolarHBondContact CA-O 3.34Å; G332-W341 PolarHBondContact O-N 3.44Å
333	Q	87.5	Confident	88.1	Confident	82 Å²	82	66 Å²	66	38%	0.383	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-151.2	146.3	179	62.7	176.9	9	0	0	113.6	R331 T339 K340 W341	R331-Q333 HydrophobicContact CG-CG 4.06Å; R331-Q333 PolarHBondContact NE-O 2.95Å; R331-Q333 PolarHBondContact NH2-O 3.18Å; R331-Q333 PolarHBondContact O-N 2.87Å; R331-Q333 VanDerWaalsContact O-N 3.14Å; Q333-T339 CarbonylContact C-O 3.52Å; Q333-T339 WeakPolarHBondContact CA-O 3.49Å; Q333-K340 HydrophobicContact CB-CG 4.29Å; Q333-W341 VanDerWaalsContact C-CZ3 3.41Å; Q333-W341 WeakPolarHBondContact O-CH2 3.41Å
334	G	82.6	Confident	88.1	Confident	19 Å²	19	66.7 Å²	66.7	20%	0.196	33%	0.331	C	S	.	.			trans	-67.6	157.4	174.7	0	0	0	0	0	111.7	Q336 G337 T339 W341	G334-Q336 PolarHBondContact O-N 3.45Å; G334-G337 WeakPolarHBondContact O-CA 3.35Å; G334-G337 PolarHBondContact O-N 3.34Å; G334-T339 PolarHBondContact N-O 3.29Å; G334-W341 VanDerWaalsContact N-CH2 3.33Å
335	F	73.3	Confident	88.2	Confident	124 Å²	124	66.6 Å²	66.6	54%	0.544	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.8	-177.6	-77.5	-83.8	0	0	0	113.9	N328 G337 G385	N328-F335 WeakPolarHBondContact OD1-CE2 3.23Å; N328-F335 WeakPolarHBondContact OD1-CZ 3.17Å; F335-G337 VanDerWaalsContact C-N 3.3Å; F335-G385 WeakPolarHBondContact CE1-O 3.42Å; F335-G385 WeakPolarHBondContact CZ-O 3.47Å
336	Q	73.1	Confident	88.3	Confident	163 Å²	163	68.7 Å²	68.7	76%	0.762	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	2.1	175.1	-64.5	-174.3	-7	0	0	113.4	G334 K338	G334-Q336 PolarHBondContact O-N 3.45Å; Q336-K338 PolarHBondContact O-N 2.87Å
337	G	74.6	Confident	88.3	Confident	32 Å²	32	68.2 Å²	68.2	33%	0.33	35%	0.353	S	S	.	.	S	Bend	trans	71.1	-9.8	178.6	0	0	0	0	0	116.6	G334 F335	G334-G337 WeakPolarHBondContact O-CA 3.35Å; G334-G337 PolarHBondContact O-N 3.34Å; F335-G337 VanDerWaalsContact C-N 3.3Å
338	K	79.1	Confident	88.5	Confident	178 Å²	178	68 Å²	68	77%	0.774	35%	0.353	S	S	*	.	S	Bend	trans	-69.8	-38.2	-176.9	-65.9	-176.9	179.3	178.5	0	113.9	Q336	Q336-K338 PolarHBondContact O-N 2.87Å
339	T	84.7	Confident	88.7	Confident	55 Å²	55	73.9 Å²	73.9	34%	0.337	38%	0.378	S	S	.	.			trans	-100.1	123.2	-177.9	-50.7	0	0	0	0	108.8	S288 Q333 G334 W341	S288-T339 VanDerWaalsContact CB-CG2 3.43Å; S288-T339 VanDerWaalsContact OG-CG2 3.24Å; S288-T339 WeakPolarHBondContact OG-CG2 3.41Å; Q333-T339 CarbonylContact C-O 3.52Å; Q333-T339 WeakPolarHBondContact CA-O 3.49Å; G334-T339 PolarHBondContact N-O 3.29Å; T339-W341 HydrophobicContact CG2-CE3 4.07Å; T339-W341 HydrophobicContact CG2-CZ3 4.13Å
340	K	91.8	Very high	88.8	Confident	142 Å²	142	73.7 Å²	73.7	62%	0.617	38%	0.377	S	S	*	.	B	Isolated β-bridge	trans	-122.6	145	178.4	-65.2	-174.8	177.5	-176.7	0	110.3	S288 G332 Q333	S288-K340 VanDerWaalsContact CB-O 3.32Å; S288-K340 WeakPolarHBondContact CB-O 3.3Å; S288-K340 PolarHBondContact OG-O 3.01Å; G332-K340 CarbonylContact O-C 3.57Å; G332-K340 WeakPolarHBondContact O-CA 3.34Å; Q333-K340 HydrophobicContact CB-CG 4.29Å
341	W	93.9	Very high	89	Confident	39 Å²	39	68.9 Å²	68.9	15%	0.148	36%	0.356	C	S	.	.			trans	-150.9	163	178.2	62.1	89.3	0	0	0	110.4	G284 T287 N328 Y329 G332 Q333 G334 T339	G284-W341 VanDerWaalsContact CA-CD2 3.49Å; G284-W341 VanDerWaalsContact CA-CE2 3.46Å; G284-W341 VanDerWaalsContact O-CE3 3.31Å; T287-W341 HydrophobicContact CG2-CB 3.97Å; N328-W341 WeakPolarHBondContact O-CZ2 3.39Å; Y329-W341 AromaticContact CD2-CD1 3.97Å; Y329-W341 AromaticContact CD2-NE1 3.4Å; Y329-W341 AromaticContact CE2-CD1 3.72Å; Y329-W341 AromaticContact CE2-NE1 3.66Å; Y329-W341 PolarHBondContact O-NE1 3.45Å; G332-W341 CarbonylContact C-O 3.51Å; G332-W341 WeakPolarHBondContact CA-O 3.34Å; G332-W341 PolarHBondContact O-N 3.44Å; Q333-W341 VanDerWaalsContact C-CZ3 3.41Å; Q333-W341 WeakPolarHBondContact O-CH2 3.41Å; G334-W341 VanDerWaalsContact N-CH2 3.33Å; T339-W341 HydrophobicContact CG2-CE3 4.07Å; T339-W341 HydrophobicContact CG2-CZ3 4.13Å
342	E	93.3	Very high	89.3	Confident	171 Å²	171	69.3 Å²	69.3	80%	0.799	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-100	127.8	169.7	-170.7	177.2	173	0	0	108.2	T287 D344	T287-E342 VanDerWaalsContact CG2-O 3.27Å; T287-E342 WeakPolarHBondContact CG2-O 3.16Å; E342-D344 PolarHBondContact O-N 3.3Å
343	A	93.7	Very high	89.6	Confident	31 Å²	31	73.3 Å²	73.3	26%	0.256	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-74.8	126.2	-175.8	0	0	0	0	0	110.8	Y329 L348	Y329-A343 HydrophobicContact CD1-CB 4.06Å; Y329-A343 HydrophobicContact CE1-CB 3.91Å; A343-L348 HydrophobicContact CB-CD1 4.09Å
344	D	94.5	Very high	90	Very high	20 Å²	20	69.4 Å²	69.4	11%	0.107	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-76.9	127.6	176.3	-177.7	-83.8	0	0	0	111.5	Y329 E342 S346 I347 L348	Y329-D344 PolarHBondContact OH-N 2.95Å; Y329-D344 VanDerWaalsContact OH-N 3.14Å; E342-D344 PolarHBondContact O-N 3.3Å; D344-S346 VanDerWaalsContact C-N 3.32Å; D344-S346 PolarHBondContact O-N 3.42Å; D344-S346 WeakPolarHBondContact OD1-CA 3.26Å; D344-S346 VanDerWaalsContact OD1-CB 3.25Å; D344-S346 WeakPolarHBondContact OD1-CB 3.26Å; D344-S346 PolarHBondContact OD1-N 2.74Å; D344-S346 PolarHBondContact OD1-OG 2.75Å; D344-I347 HydrophobicContact CB-CB 4.44Å; D344-I347 HydrophobicContact CB-CD1 4.07Å; D344-I347 HydrophobicContact CB-CG1 4.16Å; D344-I347 PolarHBondContact O-N 2.91Å; D344-I347 PolarHBondContact OD1-N 3.43Å; D344-I347 VanDerWaalsContact OD1-N 3.11Å; D344-L348 WeakPolarHBondContact O-CG 3.22Å; D344-L348 PolarHBondContact O-N 2.66Å; D344-L348 VanDerWaalsContact O-N 3.15Å
345	G	94.3	Very high	90.6	Very high	51 Å²	51	68.8 Å²	68.8	53%	0.526	35%	0.348	S	S	.	.	H	α-helix	trans	-66.9	-28.2	-177.4	0	0	0	0	0	114.5	K349	G345-K349 WeakPolarHBondContact O-CB 3.41Å; G345-K349 PolarHBondContact O-N 2.79Å
346	S	95.2	Very high	91.6	Very high	55 Å²	55	65.7 Å²	65.7	39%	0.385	33%	0.333	S	S	.	.	H	α-helix	trans	-71.5	-40	177.5	75.9	0	0	0	0	111.3	T299 D344 K349 A350	T299-S346 WeakPolarHBondContact CG2-OG 3.39Å; D344-S346 VanDerWaalsContact C-N 3.32Å; D344-S346 PolarHBondContact O-N 3.42Å; D344-S346 WeakPolarHBondContact OD1-CA 3.26Å; D344-S346 VanDerWaalsContact OD1-CB 3.25Å; D344-S346 WeakPolarHBondContact OD1-CB 3.26Å; D344-S346 PolarHBondContact OD1-N 2.74Å; D344-S346 PolarHBondContact OD1-OG 2.75Å; S346-K349 PolarHBondContact O-N 3.26Å; S346-A350 WeakPolarHBondContact O-CB 3.1Å; S346-A350 PolarHBondContact O-N 2.57Å
347	I	95.5	Very high	92.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64	-43.3	174.2	-62.3	179.1	0	0	0	110.3	L283 L292 T299 Y329 D344 K349 A350 M351	L283-I347 HydrophobicContact CD1-CG2 4.32Å; L283-I347 HydrophobicContact CD2-CD1 4.35Å; L283-I347 HydrophobicContact CD2-CG2 4.35Å; L292-I347 HydrophobicContact CD1-CD1 3.98Å; T299-I347 HydrophobicContact CG2-CD1 4.08Å; T299-I347 HydrophobicContact CG2-CG1 3.9Å; Y329-I347 HydrophobicContact CD1-CG2 4.33Å; Y329-I347 HydrophobicContact CE1-CB 4.1Å; Y329-I347 HydrophobicContact CE1-CG2 3.97Å; D344-I347 HydrophobicContact CB-CB 4.44Å; D344-I347 HydrophobicContact CB-CD1 4.07Å; D344-I347 HydrophobicContact CB-CG1 4.16Å; D344-I347 PolarHBondContact O-N 2.91Å; D344-I347 PolarHBondContact OD1-N 3.43Å; D344-I347 VanDerWaalsContact OD1-N 3.11Å; I347-K349 VanDerWaalsContact C-N 3.33Å; I347-K349 PolarHBondContact O-N 3.29Å; I347-A350 PolarHBondContact O-N 3.47Å; I347-M351 HydrophobicContact CG2-CE 4.23Å; I347-M351 HydrophobicContact CG2-SD 4.44Å; I347-M351 WeakPolarHBondContact O-CG 3.07Å; I347-M351 PolarHBondContact O-N 2.92Å
348	L	95.4	Very high	93.6	Very high	37 Å²	37	57.3 Å²	57.3	19%	0.194	29%	0.287	C	S	.	.	H	α-helix	trans	-61.4	-41.4	176.8	-70.4	175.7	0	0	0	112.3	Y329 K330 A343 D344 M351 D352	Y329-L348 HydrophobicContact CD1-CD2 3.74Å; Y329-L348 HydrophobicContact CD1-CG 4.15Å; Y329-L348 HydrophobicContact CE1-CD2 4.48Å; Y329-L348 HydrophobicContact CE1-CG 4.43Å; K330-L348 HydrophobicContact CD-CD2 4.31Å; K330-L348 HydrophobicContact CG-CD1 3.91Å; K330-L348 HydrophobicContact CG-CD2 3.42Å; K330-L348 VanDerWaalsContact CG-CD2 3.42Å; K330-L348 HydrophobicContact CG-CG 4.33Å; A343-L348 HydrophobicContact CB-CD1 4.09Å; D344-L348 WeakPolarHBondContact O-CG 3.22Å; D344-L348 PolarHBondContact O-N 2.66Å; D344-L348 VanDerWaalsContact O-N 3.15Å; L348-M351 PolarHBondContact O-N 3.16Å; L348-D352 PolarHBondContact O-N 3.16Å
349	K	95.6	Very high	94.2	Very high	156 Å²	156	49.6 Å²	49.6	68%	0.678	25%	0.254	S	S	*	.	H	α-helix	trans	-65.1	-39.4	174.8	-172	179	-179.8	-178.5	0	112.1	G345 S346 I347 D352 W353	G345-K349 WeakPolarHBondContact O-CB 3.41Å; G345-K349 PolarHBondContact O-N 2.79Å; S346-K349 PolarHBondContact O-N 3.26Å; I347-K349 VanDerWaalsContact C-N 3.33Å; I347-K349 PolarHBondContact O-N 3.29Å; K349-D352 PolarHBondContact O-N 2.93Å; K349-W353 PolarHBondContact O-N 2.95Å; K349-W353 VanDerWaalsContact O-N 3.12Å
350	A	96.3	Very high	94.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-40.3	175.3	0	0	0	0	0	111.8	C303 L306 Q307 S346 I347 W353 A354	C303-A350 HydrophobicContact CB-CB 4.05Å; L306-A350 HydrophobicContact CB-CB 4.12Å; L306-A350 HydrophobicContact CD1-CB 4.27Å; Q307-A350 HydrophobicContact CG-CB 4Å; S346-A350 WeakPolarHBondContact O-CB 3.1Å; S346-A350 PolarHBondContact O-N 2.57Å; I347-A350 PolarHBondContact O-N 3.47Å; A350-W353 PolarHBondContact O-N 3.23Å; A350-A354 VanDerWaalsContact O-CB 3.3Å; A350-A354 WeakPolarHBondContact O-CB 3.41Å; A350-A354 PolarHBondContact O-N 3.04Å
351	M	96.1	Very high	94.4	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-40.6	173.9	-74.8	-178.7	165.2	0	0	113	L280 L283 L306 I322 A325 S326 I347 L348 A354 F355	L280-M351 HydrophobicContact CD2-CE 3.84Å; L283-M351 HydrophobicContact CD1-CE 2.99Å; L283-M351 HydrophobicContact CG-CE 4.46Å; L306-M351 HydrophobicContact CD1-CG 4.08Å; I322-M351 HydrophobicContact CG2-CB 4.08Å; I322-M351 HydrophobicContact CG2-CG 4.47Å; I322-M351 VanDerWaalsContact CG2-O 3.26Å; I322-M351 WeakPolarHBondContact CG2-O 3.26Å; A325-M351 HydrophobicContact CB-CE 4.23Å; S326-M351 VanDerWaalsContact CA-SD 3.56Å; I347-M351 HydrophobicContact CG2-CE 4.23Å; I347-M351 HydrophobicContact CG2-SD 4.44Å; I347-M351 WeakPolarHBondContact O-CG 3.07Å; I347-M351 PolarHBondContact O-N 2.92Å; L348-M351 PolarHBondContact O-N 3.16Å; M351-A354 PolarHBondContact O-N 3.04Å; M351-F355 WeakPolarHBondContact O-CB 3.39Å; M351-F355 PolarHBondContact O-N 2.95Å
352	D	95.4	Very high	94.3	Very high	85 Å²	85	46.4 Å²	46.4	46%	0.455	24%	0.241	S	C	.	.	H	α-helix	trans	-60.4	-46.3	176.5	-175.3	71.8	0	0	0	110.9	L348 K349 A354 F355 Y356	L348-D352 PolarHBondContact O-N 3.16Å; K349-D352 PolarHBondContact O-N 2.93Å; D352-A354 PolarHBondContact O-N 3.47Å; D352-F355 WeakPolarHBondContact O-CB 3.2Å; D352-F355 PolarHBondContact O-N 3.22Å; D352-Y356 WeakPolarHBondContact O-CD2 3.37Å; D352-Y356 PolarHBondContact O-N 2.98Å
353	W	95.6	Very high	94.2	Very high	98 Å²	98	44.3 Å²	44.3	37%	0.371	23%	0.232	S	C	.	.	H	α-helix	trans	-61.3	-44.5	172.9	-175.6	92.4	0	0	0	112.6	Q307 E309 L312 K349 A350 F355 Y356 T357	Q307-W353 HydrophobicContact CB-CE3 4.11Å; Q307-W353 HydrophobicContact CB-CZ3 4.29Å; Q307-W353 HydrophobicContact CG-CD2 4.3Å; Q307-W353 HydrophobicContact CG-CE3 4.06Å; Q307-W353 WeakPolarHBondContact O-CH2 3.48Å; Q307-W353 VanDerWaalsContact O-CZ3 3.31Å; Q307-W353 WeakPolarHBondContact O-CZ3 3.3Å; E309-W353 HydrophobicContact CB-CH2 4.34Å; L312-W353 HydrophobicContact CD1-CZ3 3.92Å; K349-W353 PolarHBondContact O-N 2.95Å; K349-W353 VanDerWaalsContact O-N 3.12Å; A350-W353 PolarHBondContact O-N 3.23Å; W353-F355 VanDerWaalsContact C-N 3.28Å; W353-F355 PolarHBondContact O-N 2.99Å; W353-Y356 PolarHBondContact O-N 2.81Å; W353-T357 HydrophobicContact CH2-CG2 3.68Å; W353-T357 WeakPolarHBondContact CH2-OG1 3.47Å; W353-T357 HydrophobicContact CZ2-CG2 4.27Å; W353-T357 WeakPolarHBondContact CZ2-OG1 3.41Å; W353-T357 HydrophobicContact CZ3-CG2 3.91Å; W353-T357 WeakPolarHBondContact CZ3-OG1 3.29Å; W353-T357 PolarHBondContact O-N 3.04Å; W353-T357 PolarHBondContact O-OG1 3.26Å
354	A	96.3	Very high	94.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-35.9	-179.6	0	0	0	0	0	111.6	L306 L312 I322 A350 M351 D352 T357 S358	L306-A354 WeakPolarHBondContact O-CB 3.33Å; L312-A354 HydrophobicContact CD1-CB 4.01Å; L312-A354 HydrophobicContact CD2-CB 4.29Å; I322-A354 HydrophobicContact CD1-CB 3.86Å; I322-A354 WeakPolarHBondContact CD1-O 3.39Å; I322-A354 HydrophobicContact CG2-CB 4.41Å; A350-A354 VanDerWaalsContact O-CB 3.3Å; A350-A354 WeakPolarHBondContact O-CB 3.41Å; A350-A354 PolarHBondContact O-N 3.04Å; M351-A354 PolarHBondContact O-N 3.04Å; D352-A354 PolarHBondContact O-N 3.47Å; A354-T357 PolarHBondContact O-N 3.4Å; A354-S358 WeakPolarHBondContact O-CB 3.45Å; A354-S358 PolarHBondContact O-N 2.87Å; A354-S358 PolarHBondContact O-OG 3.05Å; A354-S358 VanDerWaalsContact O-OG 3.1Å
355	F	95.7	Very high	94.1	Very high	7 Å²	7	47.1 Å²	47.1	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-57.6	-54	175.3	167.8	-106.3	0	0	0	110.8	P319 I322 L323 M351 D352 W353 T357 S358 F359 M399 L429	P319-F355 HydrophobicContact CB-CD2 3.85Å; P319-F355 HydrophobicContact CB-CE2 3.94Å; P319-F355 WeakPolarHBondContact O-CD2 3.32Å; I322-F355 HydrophobicContact CB-CB 4.44Å; I322-F355 HydrophobicContact CG2-CB 3.99Å; L323-F355 HydrophobicContact CB-CD2 4.2Å; L323-F355 HydrophobicContact CB-CE2 4.13Å; M351-F355 WeakPolarHBondContact O-CB 3.39Å; M351-F355 PolarHBondContact O-N 2.95Å; D352-F355 WeakPolarHBondContact O-CB 3.2Å; D352-F355 PolarHBondContact O-N 3.22Å; W353-F355 VanDerWaalsContact C-N 3.28Å; W353-F355 PolarHBondContact O-N 2.99Å; F355-T357 PolarHBondContact O-N 3Å; F355-S358 PolarHBondContact O-N 3.36Å; F355-S358 PolarHBondContact O-OG 2.9Å; F355-F359 HydrophobicContact CD1-CE2 4.17Å; F355-F359 HydrophobicContact CD2-CE2 4.38Å; F355-F359 AromaticContact CE1-CE2 3.96Å; F355-F359 HydrophobicContact CE1-CE2 3.96Å; F355-F359 HydrophobicContact CE1-CZ 4.07Å; F355-F359 HydrophobicContact CE2-CE2 4.18Å; F355-F359 HydrophobicContact CE2-CZ 4.11Å; F355-F359 HydrophobicContact CG-CE2 4.39Å; F355-F359 AromaticContact CZ-CE2 3.97Å; F355-F359 HydrophobicContact CZ-CE2 3.97Å; F355-F359 AromaticContact CZ-CZ 3.74Å; F355-F359 HydrophobicContact CZ-CZ 3.74Å; F355-F359 WeakPolarHBondContact O-CD2 3.08Å; F355-F359 WeakPolarHBondContact O-CE2 3.4Å; F355-M399 HydrophobicContact CD1-CE 4.49Å; F355-M399 HydrophobicContact CE1-CE 3.23Å; F355-M399 HydrophobicContact CZ-CE 3.31Å; F355-L429 HydrophobicContact CE1-CB 4.28Å; F355-L429 HydrophobicContact CE1-CD2 4.29Å; F355-L429 HydrophobicContact CZ-CD2 4.24Å
356	Y	94.4	Very high	94.1	Very high	58 Å²	58	47.4 Å²	47.4	23%	0.227	25%	0.251	C	S	.	.	H	α-helix	trans	-67.7	-33.4	179.3	-62.8	-69.7	0	0	0	114	D352 W353 F359 M399 S428 L429	D352-Y356 WeakPolarHBondContact O-CD2 3.37Å; D352-Y356 PolarHBondContact O-N 2.98Å; W353-Y356 PolarHBondContact O-N 2.81Å; Y356-F359 HydrophobicContact CD1-CE2 4.17Å; Y356-F359 VanDerWaalsContact O-CD2 3.23Å; Y356-F359 WeakPolarHBondContact O-CD2 3.31Å; Y356-M399 HydrophobicContact CD1-CE 4.45Å; Y356-M399 HydrophobicContact CE1-CE 3.85Å; Y356-M399 HydrophobicContact CE1-SD 4.29Å; Y356-S428 WeakPolarHBondContact OH-CA 3.32Å; Y356-L429 PolarHBondContact OH-N 2.97Å
357	T	94.1	Very high	94.1	Very high	19 Å²	19	48.1 Å²	48.1	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-71.1	-35.4	177.7	-55.6	0	0	0	0	111.7	E309 L312 W353 A354 F355 F359 Q360	E309-T357 HydrophobicContact CB-CG2 4.14Å; E309-T357 HydrophobicContact CG-CG2 3.82Å; L312-T357 HydrophobicContact CD1-CG2 4.17Å; W353-T357 HydrophobicContact CH2-CG2 3.68Å; W353-T357 WeakPolarHBondContact CH2-OG1 3.47Å; W353-T357 HydrophobicContact CZ2-CG2 4.27Å; W353-T357 WeakPolarHBondContact CZ2-OG1 3.41Å; W353-T357 HydrophobicContact CZ3-CG2 3.91Å; W353-T357 WeakPolarHBondContact CZ3-OG1 3.29Å; W353-T357 PolarHBondContact O-N 3.04Å; W353-T357 PolarHBondContact O-OG1 3.26Å; A354-T357 PolarHBondContact O-N 3.4Å; F355-T357 PolarHBondContact O-N 3Å; T357-F359 PolarHBondContact O-N 2.91Å; T357-F359 VanDerWaalsContact O-N 3.16Å; T357-Q360 PolarHBondContact O-N 3.22Å
358	S	94.7	Very high	94.2	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-70.2	-8.5	-176.3	67.9	0	0	0	0	115.3	P319 A354 F355 Q360 N361	P319-S358 WeakPolarHBondContact CA-OG 3.46Å; P319-S358 VanDerWaalsContact CB-OG 3.26Å; P319-S358 WeakPolarHBondContact CB-OG 3.37Å; A354-S358 WeakPolarHBondContact O-CB 3.45Å; A354-S358 PolarHBondContact O-N 2.87Å; A354-S358 PolarHBondContact O-OG 3.05Å; A354-S358 VanDerWaalsContact O-OG 3.1Å; F355-S358 PolarHBondContact O-N 3.36Å; F355-S358 PolarHBondContact O-OG 2.9Å; S358-Q360 PolarHBondContact O-N 2.83Å; S358-N361 VanDerWaalsContact O-CB 3.29Å; S358-N361 WeakPolarHBondContact O-CB 3.39Å; S358-N361 PolarHBondContact O-N 3.29Å
359	F	92.1	Very high	94.3	Very high	17 Å²	17	50.4 Å²	50.4	8%	0.075	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-58.8	-31.7	172.9	-74.7	-101.3	0	0	0	111.8	P319 F355 Y356 T357 N361 V362 M399 I400 R403	P319-F359 HydrophobicContact CB-CD2 4.22Å; P319-F359 HydrophobicContact CB-CE2 4.06Å; P319-F359 HydrophobicContact CB-CZ 4.3Å; F355-F359 HydrophobicContact CD1-CE2 4.17Å; F355-F359 HydrophobicContact CD2-CE2 4.38Å; F355-F359 AromaticContact CE1-CE2 3.96Å; F355-F359 HydrophobicContact CE1-CE2 3.96Å; F355-F359 HydrophobicContact CE1-CZ 4.07Å; F355-F359 HydrophobicContact CE2-CE2 4.18Å; F355-F359 HydrophobicContact CE2-CZ 4.11Å; F355-F359 HydrophobicContact CG-CE2 4.39Å; F355-F359 AromaticContact CZ-CE2 3.97Å; F355-F359 HydrophobicContact CZ-CE2 3.97Å; F355-F359 AromaticContact CZ-CZ 3.74Å; F355-F359 HydrophobicContact CZ-CZ 3.74Å; F355-F359 WeakPolarHBondContact O-CD2 3.08Å; F355-F359 WeakPolarHBondContact O-CE2 3.4Å; Y356-F359 HydrophobicContact CD1-CE2 4.17Å; Y356-F359 VanDerWaalsContact O-CD2 3.23Å; Y356-F359 WeakPolarHBondContact O-CD2 3.31Å; T357-F359 PolarHBondContact O-N 2.91Å; T357-F359 VanDerWaalsContact O-N 3.16Å; F359-N361 PolarHBondContact O-N 3.28Å; F359-V362 PolarHBondContact O-N 3Å; F359-V362 VanDerWaalsContact O-N 3.16Å; F359-M399 HydrophobicContact CE1-CE 4.47Å; F359-M399 HydrophobicContact CE1-CG 4.09Å; F359-M399 HydrophobicContact CE2-CE 4.33Å; F359-M399 HydrophobicContact CZ-CE 3.61Å; F359-M399 HydrophobicContact CZ-CG 4.12Å; F359-I400 HydrophobicContact CD1-CG1 4.31Å; F359-I400 HydrophobicContact CE1-CB 4.24Å; F359-I400 HydrophobicContact CE1-CG1 3.63Å; F359-I400 HydrophobicContact CZ-CG1 4.15Å; F359-R403 HydrophobicContact CD1-CB 3.86Å; F359-R403 HydrophobicContact CD1-CG 4.49Å; F359-R403 HydrophobicContact CE1-CB 4.32Å
360	Q	90.1	Very high	94.3	Very high	122 Å²	122	43 Å²	43	57%	0.57	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-67.3	-16.3	176.5	-58.4	-176.7	18.4	0	0	113.7	E309 T357 S358 V362	E309-Q360 PolarHBondContact OE1-OE1 3.32Å; T357-Q360 PolarHBondContact O-N 3.22Å; S358-Q360 PolarHBondContact O-N 2.83Å; Q360-V362 VanDerWaalsContact C-N 3.29Å
361	N	91.5	Very high	94.4	Very high	17 Å²	17	43 Å²	43	9%	0.091	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-82.5	-11.1	177.9	-57.2	-23.3	0	0	0	112	L312 K313 N316 I317 S358 F359	L312-N361 PolarHBondContact O-ND2 3.31Å; K313-N361 VanDerWaalsContact CA-OD1 3.29Å; K313-N361 WeakPolarHBondContact CA-OD1 3.35Å; N316-N361 PolarHBondContact OD1-O 3.22Å; I317-N361 PolarHBondContact O-ND2 3.31Å; S358-N361 VanDerWaalsContact O-CB 3.29Å; S358-N361 WeakPolarHBondContact O-CB 3.39Å; S358-N361 PolarHBondContact O-N 3.29Å; F359-N361 PolarHBondContact O-N 3.28Å
362	V	91.1	Very high	94.3	Very high	30 Å²	30	43 Å²	43	18%	0.182	22%	0.22	C	C	.	.	S	Bend	trans	-87.7	116.5	179.9	-174.3	0	0	0	0	108.8	P319 F359 Q360 P364 T404	P319-V362 HydrophobicContact CG-CG2 3.96Å; F359-V362 PolarHBondContact O-N 3Å; F359-V362 VanDerWaalsContact O-N 3.16Å; Q360-V362 VanDerWaalsContact C-N 3.29Å; V362-P364 WeakPolarHBondContact O-CD 3.43Å; V362-T404 HydrophobicContact CB-CG2 3.66Å; V362-T404 HydrophobicContact CG1-CG2 3.8Å; V362-T404 HydrophobicContact CG2-CG2 4.33Å
363	E	89.9	Confident	94.2	Very high	127 Å²	127	38.9 Å²	38.9	59%	0.593	20%	0.199	S	C	*	.	P	Polyproline II helix	trans	-71.2	121.4	177.1	-68.1	-178.4	171	0	0	110.7	R530	E363-R530 IonicContact OE2-CZ 3.46Å; E363-R530 IonicContact OE2-NH2 3.63Å; E363-R530 PolarHBondContact OE2-NH2 2.92Å
364	P	93.6	Very high	93.9	Very high	82 Å²	82	34.2 Å²	34.2	53%	0.532	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-67.9	148.3	175.8	29	-34.4	0	0	0	111.3	V362	V362-P364 WeakPolarHBondContact O-CD 3.43Å
365	V	93.9	Very high	93.3	Very high	28 Å²	28	34.7 Å²	34.7	17%	0.17	18%	0.184	C	C	.	.			trans	-87.6	-27.7	173.8	-168.1	0	0	0	0	110.7	K367 F369 E405 R530 A533 L534	V365-K367 HydrophobicContact CB-CG 4.42Å; V365-K367 HydrophobicContact CG1-CG 3.72Å; V365-F369 HydrophobicContact CB-CE2 4.46Å; V365-F369 HydrophobicContact CB-CZ 4.4Å; V365-E405 WeakPolarHBondContact CA-OE1 3.41Å; V365-E405 VanDerWaalsContact CB-OE1 3.28Å; V365-E405 WeakPolarHBondContact CB-OE1 3.29Å; V365-E405 WeakPolarHBondContact CG2-OE1 3.26Å; V365-E405 PolarHBondContact N-OE1 3.18Å; V365-R530 HydrophobicContact CG2-CB 4.39Å; V365-R530 HydrophobicContact CG2-CG 3.85Å; V365-A533 HydrophobicContact CG1-CB 3.96Å; V365-L534 HydrophobicContact CG1-CD2 3.57Å; V365-L534 HydrophobicContact CG1-CG 3.77Å
366	G	94.6	Very high	92	Very high	57 Å²	57	34.8 Å²	34.8	59%	0.588	19%	0.186	S	C	*	.			trans	75.9	28.7	178.3	0	0	0	0	0	113.2	E405	G366-E405 WeakPolarHBondContact CA-OE2 3.39Å; G366-E405 PolarHBondContact N-OE2 3.1Å
367	K	95.4	Very high	90.7	Very high	70 Å²	70	34.1 Å²	34.1	30%	0.304	19%	0.189	S	C	.	.			trans	-105.3	168.2	178.2	-63	-71.6	-174.7	173.1	0	110.4	V365 F369 D461	V365-K367 HydrophobicContact CB-CG 4.42Å; V365-K367 HydrophobicContact CG1-CG 3.72Å; K367-F369 HydrophobicContact CB-CD2 4.23Å; K367-F369 HydrophobicContact CB-CE2 3.62Å; K367-F369 HydrophobicContact CB-CZ 4.23Å; K367-F369 VanDerWaalsContact O-CD2 3.26Å; K367-F369 WeakPolarHBondContact O-CD2 3.27Å; K367-D461 HydrophobicContact CB-CB 4.02Å; K367-D461 HydrophobicContact CD-CB 4.21Å
368	R	96.4	Very high	89.4	Confident	82 Å²	82	36.7 Å²	36.7	31%	0.309	21%	0.208	S	C	.	.			trans	-92.5	114.7	176.1	-59.9	165.8	-63.6	180	8.1	109.4	N407 S459 D461 M462	R368-N407 CarbonylContact C-O 3.56Å; R368-N407 WeakPolarHBondContact CA-O 3.39Å; R368-N407 HydrophobicContact CB-CB 4.36Å; R368-N407 HydrophobicContact CG-CB 3.93Å; R368-S459 WeakPolarHBondContact CD-O 3.4Å; R368-S459 PolarHBondContact NE-O 3.46Å; R368-D461 WeakPolarHBondContact CB-OD2 3.4Å; R368-D461 WeakPolarHBondContact CG-OD2 3.47Å; R368-D461 IonicContact CZ-OD1 2.7Å; R368-D461 IonicContact CZ-OD2 2.78Å; R368-D461 PolarHBondContact N-OD2 2.69Å; R368-D461 IonicContact NE-OD1 3.41Å; R368-D461 IonicContact NE-OD2 3.85Å; R368-D461 PolarHBondContact NE-OD2 3.47Å; R368-D461 IonicContact NH2-OD1 2.75Å; R368-D461 PolarHBondContact NH2-OD1 3.42Å; R368-D461 IonicContact NH2-OD2 2.97Å; R368-D461 PolarHBondContact O-N 2.9Å; R368-M462 PolarHBondContact O-N 3.08Å; R368-M462 VanDerWaalsContact O-N 3.16Å
369	F	97	Very high	88.3	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.009	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.6	-174.9	-73.6	-100.9	0	0	0	111.1	V365 K367 F401 E405 N407 T408 Q409 M462 I464 I529 A533	V365-F369 HydrophobicContact CB-CE2 4.46Å; V365-F369 HydrophobicContact CB-CZ 4.4Å; K367-F369 HydrophobicContact CB-CD2 4.23Å; K367-F369 HydrophobicContact CB-CE2 3.62Å; K367-F369 HydrophobicContact CB-CZ 4.23Å; K367-F369 VanDerWaalsContact O-CD2 3.26Å; K367-F369 WeakPolarHBondContact O-CD2 3.27Å; F369-F401 AromaticContact CD1-CD1 3.95Å; F369-F401 HydrophobicContact CD1-CD1 3.95Å; F369-F401 HydrophobicContact CD1-CE1 4.2Å; F369-F401 HydrophobicContact CE1-CD1 4.01Å; F369-F401 AromaticContact CE1-CE1 3.86Å; F369-F401 HydrophobicContact CE1-CE1 3.86Å; F369-F401 HydrophobicContact CZ-CE1 4.48Å; F369-E405 HydrophobicContact CD2-CB 3.9Å; F369-E405 HydrophobicContact CD2-CG 3.65Å; F369-E405 HydrophobicContact CE2-CB 4.28Å; F369-E405 VanDerWaalsContact CE2-CD 3.47Å; F369-E405 HydrophobicContact CE2-CG 3.56Å; F369-E405 HydrophobicContact CG-CG 4.44Å; F369-E405 HydrophobicContact CZ-CG 4.32Å; F369-N407 PolarHBondContact N-O 3.25Å; F369-T408 HydrophobicContact CB-CG2 4.19Å; F369-T408 WeakPolarHBondContact O-CA 3.27Å; F369-Q409 PolarHBondContact O-N 2.92Å; F369-M462 WeakPolarHBondContact CA-O 3.3Å; F369-M462 HydrophobicContact CD1-CB 4.15Å; F369-M462 HydrophobicContact CD1-CE 3.14Å; F369-M462 HydrophobicContact CD1-CG 4.44Å; F369-M462 HydrophobicContact CE1-CB 4.03Å; F369-M462 HydrophobicContact CE1-CE 3.5Å; F369-M462 VanDerWaalsContact CE1-CE 3.5Å; F369-M462 HydrophobicContact CE1-CG 4.08Å; F369-M462 HydrophobicContact CG-CE 4.2Å; F369-I464 HydrophobicContact CD1-CD1 4.05Å; F369-I464 HydrophobicContact CE1-CD1 4.39Å; F369-I529 HydrophobicContact CE1-CG2 4.44Å; F369-A533 HydrophobicContact CZ-CB 4.26Å
370	V	97.4	Very high	87.6	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	121	157.7	169.6	0	0	0	0	107.4	Q409 L411 V460 M462 F463 I464	V370-Q409 CarbonylContact C-O 3.59Å; V370-Q409 WeakPolarHBondContact CA-O 3.36Å; V370-Q409 HydrophobicContact CG2-CB 4.26Å; V370-L411 HydrophobicContact CG1-CD1 3.51Å; V370-L411 HydrophobicContact CG1-CG 4.09Å; V370-V460 HydrophobicContact CB-CG1 4.09Å; V370-V460 HydrophobicContact CG2-CB 4.31Å; V370-V460 HydrophobicContact CG2-CG1 3.7Å; V370-V460 HydrophobicContact CG2-CG2 3.58Å; V370-M462 PolarHBondContact N-O 3Å; V370-F463 HydrophobicContact CB-CD1 3.69Å; V370-F463 HydrophobicContact CB-CE1 4.04Å; V370-F463 HydrophobicContact CG1-CD1 3.9Å; V370-F463 HydrophobicContact CG1-CE1 4.28Å; V370-F463 HydrophobicContact CG2-CD1 4.24Å; V370-F463 HydrophobicContact CG2-CE1 4.07Å; V370-F463 CarbonylContact O-C 3.58Å; V370-F463 WeakPolarHBondContact O-CA 3.4Å; V370-I464 PolarHBondContact O-N 3.4Å
371	V	96.7	Very high	87.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.6	171.7	-175.7	0	0	0	0	107.8	T398 F401 T408 Q409 V410 L411 I464 L466	V371-T398 HydrophobicContact CG1-CG2 4.37Å; V371-F401 HydrophobicContact CG2-CB 3.83Å; V371-F401 HydrophobicContact CG2-CD2 4.29Å; V371-F401 HydrophobicContact CG2-CG 4.19Å; V371-T408 HydrophobicContact CG2-CG2 4Å; V371-Q409 PolarHBondContact N-O 3.47Å; V371-V410 CarbonylContact O-C 3.45Å; V371-V410 WeakPolarHBondContact O-CA 3.42Å; V371-L411 PolarHBondContact O-N 3.48Å; V371-I464 CarbonylContact C-O 3.59Å; V371-I464 WeakPolarHBondContact CA-O 3.3Å; V371-I464 HydrophobicContact CG1-CG2 4.24Å; V371-I464 HydrophobicContact CG2-CB 4.42Å; V371-I464 HydrophobicContact CG2-CD1 4.15Å; V371-L466 HydrophobicContact CG1-CD1 4.14Å; V371-L466 HydrophobicContact CG1-CG 4.37Å
372	A	94.6	Very high	87.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.8	-178.1	0	0	0	0	0	110.6	L411 F413 P449 I464 I465 L466	A372-L411 CarbonylContact C-O 3.57Å; A372-L411 VanDerWaalsContact CA-O 3.32Å; A372-L411 WeakPolarHBondContact CA-O 3.47Å; A372-L411 HydrophobicContact CB-CB 4.16Å; A372-F413 HydrophobicContact CB-CD1 3.94Å; A372-F413 HydrophobicContact CB-CE1 3.86Å; A372-P449 HydrophobicContact CB-CB 3.62Å; A372-P449 HydrophobicContact CB-CG 3.37Å; A372-I464 PolarHBondContact N-O 3.1Å; A372-I465 HydrophobicContact CB-CG1 4.47Å; A372-I465 CarbonylContact O-C 3.59Å; A372-I465 WeakPolarHBondContact O-CA 3.39Å; A372-L466 PolarHBondContact O-N 3.35Å
373	V	92.8	Very high	87	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.4	-179.8	-172.8	0	0	0	0	109.5	V375 L379 A394 L411 A412 F413 L436 L466	V373-V375 HydrophobicContact CG1-CG1 4.28Å; V373-V375 PolarHBondContact O-N 3.49Å; V373-L379 HydrophobicContact CG1-CD1 4.08Å; V373-A394 HydrophobicContact CG1-CB 3.92Å; V373-L411 PolarHBondContact N-O 2.97Å; V373-A412 WeakPolarHBondContact O-CA 3.32Å; V373-F413 VanDerWaalsContact C-CE1 3.44Å; V373-F413 VanDerWaalsContact O-CD1 3.27Å; V373-F413 WeakPolarHBondContact O-CD1 3.26Å; V373-F413 PolarHBondContact O-N 3.46Å; V373-L436 HydrophobicContact CB-CD2 4.29Å; V373-L436 HydrophobicContact CG2-CD1 4.21Å; V373-L436 HydrophobicContact CG2-CD2 3.96Å; V373-L466 HydrophobicContact CG2-CD1 4.22Å
374	D	89.3	Confident	86.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	116.1	171.4	176.4	13.9	0	0	0	109.2	G376 F413 T444 L466 T467	D374-G376 WeakPolarHBondContact OD1-CA 3.27Å; D374-G376 PolarHBondContact OD1-N 2.85Å; D374-F413 HydrophobicContact CB-CE1 3.95Å; D374-F413 HydrophobicContact CB-CE2 4.14Å; D374-F413 HydrophobicContact CB-CZ 3.59Å; D374-F413 VanDerWaalsContact N-CE1 3.31Å; D374-T444 HydrophobicContact CB-CG2 4.29Å; D374-T444 WeakPolarHBondContact OD1-CG2 3.25Å; D374-T444 PolarHBondContact OD1-OG1 3.2Å; D374-T444 WeakPolarHBondContact OD2-CG2 3.34Å; D374-L466 VanDerWaalsContact CB-O 3.29Å; D374-L466 WeakPolarHBondContact CB-O 3.49Å; D374-L466 PolarHBondContact N-O 2.87Å; D374-T467 WeakPolarHBondContact OD2-CB 3.47Å; D374-T467 PolarHBondContact OD2-OG1 2.7Å
375	V	83.4	Confident	85.7	Confident	10 Å²	10	33.9 Å²	33.9	6%	0.061	21%	0.211	C	C	.	.			trans	-110.3	5.4	176.6	-58.9	0	0	0	0	111.2	V373 T377 L379 A412 F413 L436 F439 S441	V373-V375 HydrophobicContact CG1-CG1 4.28Å; V373-V375 PolarHBondContact O-N 3.49Å; V375-T377 VanDerWaalsContact C-N 3.31Å; V375-T377 PolarHBondContact O-N 2.82Å; V375-L379 HydrophobicContact CG1-CD1 4.43Å; V375-A412 HydrophobicContact CG1-CB 4.23Å; V375-A412 HydrophobicContact CG2-CB 4.47Å; V375-F413 WeakPolarHBondContact CG2-O 3.49Å; V375-F413 PolarHBondContact N-O 2.98Å; V375-F413 VanDerWaalsContact N-O 3.15Å; V375-L436 WeakPolarHBondContact CG1-O 2.91Å; V375-F439 HydrophobicContact CG2-CB 3.77Å; V375-S441 WeakPolarHBondContact O-CA 3.43Å
376	G	69.1	Low	85.2	Confident	8 Å²	8	33.3 Å²	33.3	8%	0.082	21%	0.208	C	C	.	.	S	Bend	trans	-68.2	-28.8	179.5	0	0	0	0	0	113.2	D374 S441 G442 T444	D374-G376 WeakPolarHBondContact OD1-CA 3.27Å; D374-G376 PolarHBondContact OD1-N 2.85Å; G376-S441 WeakPolarHBondContact O-CB 3.29Å; G376-G442 CarbonylContact C-O 3.6Å; G376-G442 WeakPolarHBondContact CA-O 3.21Å; G376-G442 PolarHBondContact O-N 2.98Å; G376-T444 WeakPolarHBondContact CA-OG1 3.34Å
377	T	66.6	Low	84.8	Confident	45 Å²	45	31.7 Å²	31.7	28%	0.276	19%	0.189	S	C	.	.	S	Bend	trans	-113.1	143.3	170.4	72.5	0	0	0	0	111.7	V375 L379 N468 N469	V375-T377 VanDerWaalsContact C-N 3.31Å; V375-T377 PolarHBondContact O-N 2.82Å; T377-L379 PolarHBondContact O-N 2.83Å; T377-N468 PolarHBondContact O-ND2 2.92Å; T377-N468 PolarHBondContact OG1-ND2 3.45Å; T377-N468 PolarHBondContact OG1-OD1 3.12Å; T377-N469 HydrophobicContact CG2-CB 4.09Å
378	S	67.3	Low	84.5	Confident	73 Å²	73	28.4 Å²	28.4	51%	0.51	18%	0.175	S	C	.	.			trans	-56.1	114.4	-176.7	-176.3	0	0	0	0	111.6	T380 N468	S378-T380 PolarHBondContact O-N 3.11Å; S378-T380 PolarHBondContact O-OG1 2.63Å; S378-T380 WeakPolarHBondContact OG-CG2 3.37Å; S378-T380 PolarHBondContact OG-OG1 2.98Å; S378-N468 PolarHBondContact O-ND2 2.75Å
379	L	72.5	Confident	84.2	Confident	14 Å²	14	26 Å²	26	7%	0.073	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	38.2	177.4	-70.5	167.5	0	0	0	113	V373 V375 T377 T390 A391 V437 N468	V373-L379 HydrophobicContact CG1-CD1 4.08Å; V375-L379 HydrophobicContact CG1-CD1 4.43Å; T377-L379 PolarHBondContact O-N 2.83Å; L379-T390 VanDerWaalsContact CA-OG1 3.27Å; L379-T390 WeakPolarHBondContact CA-OG1 3.25Å; L379-T390 PolarHBondContact O-OG1 2.94Å; L379-A391 HydrophobicContact CB-CB 3.7Å; L379-A391 VanDerWaalsContact O-CB 3.31Å; L379-A391 WeakPolarHBondContact O-CB 3.27Å; L379-A391 PolarHBondContact O-N 3.47Å; L379-A391 VanDerWaalsContact O-N 3.09Å; L379-V437 HydrophobicContact CD1-CG2 4.42Å; L379-N468 WeakPolarHBondContact CA-ND2 3.38Å; L379-N468 HydrophobicContact CD2-CB 3.96Å; L379-N468 VanDerWaalsContact CD2-CG 3.49Å; L379-N468 PolarHBondContact N-ND2 2.83Å
380	T	77.6	Confident	83.9	Confident	107 Å²	107	26 Å²	26	66%	0.656	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-11.2	-176.8	47	0	0	0	0	113.2	S378	S378-T380 PolarHBondContact O-N 3.11Å; S378-T380 PolarHBondContact O-OG1 2.63Å; S378-T380 WeakPolarHBondContact OG-CG2 3.37Å; S378-T380 PolarHBondContact OG-OG1 2.98Å
381	S	85.1	Confident	83.6	Confident	60 Å²	60	26.5 Å²	26.5	42%	0.42	18%	0.175	S	C	.	.	S	Bend	trans	-71	157.3	179	-69.4	0	0	0	0	111.8	S389 T390	S381-S389 CarbonylContact O-C 3.37Å; S381-S389 WeakPolarHBondContact O-CA 3.49Å; S381-T390 PolarHBondContact N-OG1 3.35Å; S381-T390 VanDerWaalsContact O-CG2 3.3Å; S381-T390 WeakPolarHBondContact O-CG2 3.27Å; S381-T390 PolarHBondContact O-N 2.96Å; S381-T390 PolarHBondContact O-OG1 3.36Å
382	I	87.1	Confident	83.3	Confident	93 Å²	93	28 Å²	28	48%	0.477	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-92	136.4	174.5	-60.5	-59.9	0	0	0	109.7	P384 T386	I382-P384 WeakPolarHBondContact O-CD 3.49Å; I382-T386 WeakPolarHBondContact CG2-O 3.4Å
383	V	86.6	Confident	83.2	Confident	2 Å²	2	28 Å²	28	1%	0.012	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-64.7	122.5	174.2	176.1	0	0	0	0	109	G385 T386 I388 T390 A393 L500 F521	V383-G385 PolarHBondContact O-N 2.77Å; V383-G385 VanDerWaalsContact O-N 3.12Å; V383-T386 HydrophobicContact CB-CG2 4.39Å; V383-T386 WeakPolarHBondContact CB-OG1 3.4Å; V383-T386 HydrophobicContact CG1-CG2 4.14Å; V383-T386 PolarHBondContact O-N 2.82Å; V383-T386 PolarHBondContact O-OG1 3.01Å; V383-I388 PolarHBondContact N-O 2.95Å; V383-T390 HydrophobicContact CG2-CG2 4.04Å; V383-A393 HydrophobicContact CG2-CB 3.7Å; V383-L500 HydrophobicContact CG2-CB 4.38Å; V383-F521 HydrophobicContact CG1-CB 4.41Å
384	P	81.4	Confident	83.3	Confident	32 Å²	32	28 Å²	28	21%	0.208	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	119.6	-177	-26.1	34.1	0	0	0	111.8	R46 I382 L500	R46-P384 WeakPolarHBondContact CD-O 3.34Å; R46-P384 VanDerWaalsContact CZ-C 3.43Å; R46-P384 PolarHBondContact NE-O 2.81Å; I382-P384 WeakPolarHBondContact O-CD 3.49Å; P384-L500 WeakPolarHBondContact CD-O 3.28Å
385	G	75.3	Confident	83.5	Confident	27 Å²	27	28 Å²	28	28%	0.278	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.7	-10.4	-179.9	0	0	0	0	0	115	R46 F335 V383	R46-G385 VanDerWaalsContact NH2-N 3.13Å; F335-G385 WeakPolarHBondContact CE1-O 3.42Å; F335-G385 WeakPolarHBondContact CZ-O 3.47Å; V383-G385 PolarHBondContact O-N 2.77Å; V383-G385 VanDerWaalsContact O-N 3.12Å
386	T	83.5	Confident	84	Confident	17 Å²	17	27.6 Å²	27.6	10%	0.104	18%	0.182	C	C	.	.	S	Bend	trans	-126.5	175.9	-171.9	79.1	0	0	0	0	110.2	L324 I382 V383 I388	L324-T386 HydrophobicContact CD1-CG2 3.71Å; I382-T386 WeakPolarHBondContact CG2-O 3.4Å; V383-T386 HydrophobicContact CB-CG2 4.39Å; V383-T386 WeakPolarHBondContact CB-OG1 3.4Å; V383-T386 HydrophobicContact CG1-CG2 4.14Å; V383-T386 PolarHBondContact O-N 2.82Å; V383-T386 PolarHBondContact O-OG1 3.01Å; T386-I388 PolarHBondContact OG1-N 3.26Å
387	A	84.8	Confident	85.3	Confident	22 Å²	22	27.2 Å²	27.2	18%	0.182	18%	0.178	C	C	.	.	S	Bend	trans	-99.2	8.3	165	0	0	0	0	0	112	E327	E327-A387 HydrophobicContact CB-CB 4.24Å
388	I	90	Very high	86.6	Confident	2 Å²	2	25 Å²	25	1%	0.01	17%	0.165	C	C	.	.			trans	-91.7	132.5	-170.6	-50.3	171.7	0	0	0	109.2	F320 L323 L324 E327 V383 T386 V392 A393	F320-I388 HydrophobicContact CZ-CD1 4.21Å; L323-I388 HydrophobicContact CD2-CD1 4.36Å; L323-I388 HydrophobicContact CG-CD1 4.16Å; L324-I388 HydrophobicContact CB-CD1 4.3Å; L324-I388 HydrophobicContact CD1-CD1 3.97Å; L324-I388 HydrophobicContact CD1-CG1 4.4Å; E327-I388 HydrophobicContact CB-CG1 3.97Å; E327-I388 HydrophobicContact CG-CG1 3.94Å; V383-I388 PolarHBondContact N-O 2.95Å; T386-I388 PolarHBondContact OG1-N 3.26Å; I388-V392 HydrophobicContact CG2-CB 3.93Å; I388-V392 HydrophobicContact CG2-CG1 3.81Å; I388-A393 HydrophobicContact CG2-CB 4.02Å
389	S	90.1	Very high	87.9	Confident	32 Å²	32	21.7 Å²	21.7	22%	0.224	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-71.1	152.3	170.3	68.7	0	0	0	0	111.4	S381 A391 V392 A393	S381-S389 CarbonylContact O-C 3.37Å; S381-S389 WeakPolarHBondContact O-CA 3.49Å; S389-A391 PolarHBondContact O-N 3.25Å; S389-V392 PolarHBondContact O-N 3.48Å; S389-V392 WeakPolarHBondContact OG-CB 3.09Å; S389-V392 VanDerWaalsContact OG-CG2 3.27Å; S389-V392 WeakPolarHBondContact OG-CG2 3.41Å; S389-V392 PolarHBondContact OG-N 3.12Å; S389-A393 WeakPolarHBondContact O-CB 3.49Å; S389-A393 PolarHBondContact O-N 3.33Å
390	T	90.3	Very high	89	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-35.5	178.4	44.9	0	0	0	0	112	L379 S381 V383 A393 A394 N468 L500 T501	L379-T390 VanDerWaalsContact CA-OG1 3.27Å; L379-T390 WeakPolarHBondContact CA-OG1 3.25Å; L379-T390 PolarHBondContact O-OG1 2.94Å; S381-T390 PolarHBondContact N-OG1 3.35Å; S381-T390 VanDerWaalsContact O-CG2 3.3Å; S381-T390 WeakPolarHBondContact O-CG2 3.27Å; S381-T390 PolarHBondContact O-N 2.96Å; S381-T390 PolarHBondContact O-OG1 3.36Å; V383-T390 HydrophobicContact CG2-CG2 4.04Å; T390-A393 PolarHBondContact O-N 3.21Å; T390-A394 VanDerWaalsContact O-CB 3.3Å; T390-A394 WeakPolarHBondContact O-CB 3.48Å; T390-A394 PolarHBondContact O-N 2.92Å; T390-N468 HydrophobicContact CG2-CB 4.18Å; T390-L500 HydrophobicContact CG2-CB 3.89Å; T390-T501 HydrophobicContact CG2-CG2 3.47Å; T390-T501 VanDerWaalsContact CG2-CG2 3.47Å
391	A	90.9	Very high	89.8	Confident	12 Å²	12	16.7 Å²	16.7	10%	0.099	11%	0.109	C	C	.	.	H	α-helix	trans	-62.3	-49.3	173.2	0	0	0	0	0	112.4	L379 S389 A393 A394 A395 T433 V437	L379-A391 HydrophobicContact CB-CB 3.7Å; L379-A391 VanDerWaalsContact O-CB 3.31Å; L379-A391 WeakPolarHBondContact O-CB 3.27Å; L379-A391 PolarHBondContact O-N 3.47Å; L379-A391 VanDerWaalsContact O-N 3.09Å; S389-A391 PolarHBondContact O-N 3.25Å; A391-A393 VanDerWaalsContact C-N 3.33Å; A391-A393 PolarHBondContact O-N 2.92Å; A391-A394 PolarHBondContact O-N 3.39Å; A391-A395 WeakPolarHBondContact O-CB 3.3Å; A391-A395 PolarHBondContact O-N 3.42Å; A391-T433 HydrophobicContact CB-CG2 3.83Å; A391-V437 HydrophobicContact CB-CG2 4Å
392	V	92.1	Very high	90.2	Very high	32 Å²	32	15.5 Å²	15.5	19%	0.194	10%	0.104	C	C	.	.	H	α-helix	trans	-67	-37.8	179.7	173.6	0	0	0	0	110.7	L323 I388 S389 A396 L429 T433	L323-V392 HydrophobicContact CD1-CG1 4.35Å; L323-V392 HydrophobicContact CD2-CG1 4.47Å; I388-V392 HydrophobicContact CG2-CB 3.93Å; I388-V392 HydrophobicContact CG2-CG1 3.81Å; S389-V392 PolarHBondContact O-N 3.48Å; S389-V392 WeakPolarHBondContact OG-CB 3.09Å; S389-V392 VanDerWaalsContact OG-CG2 3.27Å; S389-V392 WeakPolarHBondContact OG-CG2 3.41Å; S389-V392 PolarHBondContact OG-N 3.12Å; V392-A396 VanDerWaalsContact O-CB 3.25Å; V392-A396 WeakPolarHBondContact O-CB 3.39Å; V392-A396 PolarHBondContact O-N 3.31Å; V392-L429 HydrophobicContact CG1-CD2 4.01Å; V392-L429 HydrophobicContact CG1-CG 4.48Å; V392-T433 HydrophobicContact CG2-CG2 4.31Å
393	A	92.6	Very high	90.4	Very high	1 Å²	1	15 Å²	15	1%	0.008	10%	0.096	C	C	.	.	H	α-helix	trans	-63	-48.5	174.5	0	0	0	0	0	111.2	V383 I388 S389 T390 A391 A395 A396 I397	V383-A393 HydrophobicContact CG2-CB 3.7Å; I388-A393 HydrophobicContact CG2-CB 4.02Å; S389-A393 WeakPolarHBondContact O-CB 3.49Å; S389-A393 PolarHBondContact O-N 3.33Å; T390-A393 PolarHBondContact O-N 3.21Å; A391-A393 VanDerWaalsContact C-N 3.33Å; A391-A393 PolarHBondContact O-N 2.92Å; A393-A395 PolarHBondContact O-N 2.53Å; A393-A396 PolarHBondContact O-N 3.28Å; A393-I397 WeakPolarHBondContact O-CB 3.23Å; A393-I397 VanDerWaalsContact O-CD1 3.32Å; A393-I397 WeakPolarHBondContact O-CD1 3.4Å; A393-I397 WeakPolarHBondContact O-CG1 3.2Å; A393-I397 PolarHBondContact O-N 3.31Å
394	A	93.2	Very high	90.7	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-59.7	-45.2	177.6	0	0	0	0	0	111.8	V373 T390 A391 I397 T398 L466 L500	V373-A394 HydrophobicContact CG1-CB 3.92Å; T390-A394 VanDerWaalsContact O-CB 3.3Å; T390-A394 WeakPolarHBondContact O-CB 3.48Å; T390-A394 PolarHBondContact O-N 2.92Å; A391-A394 PolarHBondContact O-N 3.39Å; A394-I397 PolarHBondContact O-N 3.06Å; A394-T398 VanDerWaalsContact O-CB 3.22Å; A394-T398 WeakPolarHBondContact O-CB 3.35Å; A394-T398 PolarHBondContact O-N 2.88Å; A394-T398 PolarHBondContact O-OG1 2.87Å; A394-L466 HydrophobicContact CB-CD1 4.07Å; A394-L500 HydrophobicContact CB-CD1 4.03Å
395	A	94.1	Very high	91.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.2	-45.3	175.8	0	0	0	0	0	112.2	A391 A393 T398 M399 L429 V432 T433 L436	A391-A395 WeakPolarHBondContact O-CB 3.3Å; A391-A395 PolarHBondContact O-N 3.42Å; A393-A395 PolarHBondContact O-N 2.53Å; A395-T398 PolarHBondContact O-N 3.03Å; A395-M399 WeakPolarHBondContact O-CB 3.26Å; A395-M399 PolarHBondContact O-N 3.4Å; A395-L429 HydrophobicContact CB-CD1 3.93Å; A395-V432 HydrophobicContact CB-CB 4.35Å; A395-V432 HydrophobicContact CB-CG1 3.88Å; A395-T433 WeakPolarHBondContact CB-OG1 3.2Å; A395-L436 HydrophobicContact CB-CD1 3.97Å
396	A	94.8	Very high	91.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.8	-45.4	179.2	0	0	0	0	0	112.1	L323 V392 A393 M399 I400 L429	L323-A396 HydrophobicContact CD2-CB 3.32Å; V392-A396 VanDerWaalsContact O-CB 3.25Å; V392-A396 WeakPolarHBondContact O-CB 3.39Å; V392-A396 PolarHBondContact O-N 3.31Å; A393-A396 PolarHBondContact O-N 3.28Å; A396-M399 PolarHBondContact O-N 3.12Å; A396-I400 WeakPolarHBondContact O-CB 3.4Å; A396-I400 WeakPolarHBondContact O-CD1 3.35Å; A396-I400 WeakPolarHBondContact O-CG1 3.44Å; A396-I400 PolarHBondContact O-N 3.2Å; A396-L429 HydrophobicContact CB-CD1 3.89Å
397	I	94.8	Very high	92.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-48.5	177.5	-64.7	159.3	0	0	0	109.9	F320 A393 A394 M399 I400 F401 L466 L500 F521 F526	F320-I397 HydrophobicContact CE2-CG1 4.47Å; A393-I397 WeakPolarHBondContact O-CB 3.23Å; A393-I397 VanDerWaalsContact O-CD1 3.32Å; A393-I397 WeakPolarHBondContact O-CD1 3.4Å; A393-I397 WeakPolarHBondContact O-CG1 3.2Å; A393-I397 PolarHBondContact O-N 3.31Å; A394-I397 PolarHBondContact O-N 3.06Å; I397-M399 VanDerWaalsContact C-N 3.34Å; I397-M399 PolarHBondContact O-N 3.43Å; I397-I400 PolarHBondContact O-N 2.91Å; I397-F401 HydrophobicContact CG2-CD2 3.94Å; I397-F401 HydrophobicContact CG2-CE2 3.85Å; I397-F401 VanDerWaalsContact O-CD2 3.32Å; I397-F401 WeakPolarHBondContact O-CD2 3.45Å; I397-F401 PolarHBondContact O-N 2.82Å; I397-F401 VanDerWaalsContact O-N 3.12Å; I397-L466 HydrophobicContact CB-CD1 3.95Å; I397-L466 HydrophobicContact CD1-CD1 4.33Å; I397-L466 HydrophobicContact CD1-CD2 4.35Å; I397-L466 HydrophobicContact CG2-CD1 3.92Å; I397-L466 HydrophobicContact CG2-CD2 4.11Å; I397-L500 HydrophobicContact CD1-CD2 3.87Å; I397-F521 HydrophobicContact CD1-CD1 3.72Å; I397-F521 HydrophobicContact CD1-CD2 3.58Å; I397-F521 HydrophobicContact CD1-CE1 3.67Å; I397-F521 HydrophobicContact CD1-CE2 3.52Å; I397-F521 HydrophobicContact CD1-CG 3.68Å; I397-F521 HydrophobicContact CD1-CZ 3.56Å; I397-F521 HydrophobicContact CG1-CD1 4.09Å; I397-F521 HydrophobicContact CG1-CE1 3.61Å; I397-F521 HydrophobicContact CG1-CE2 4.09Å; I397-F521 HydrophobicContact CG1-CZ 3.61Å; I397-F521 HydrophobicContact CG2-CE2 4.39Å; I397-F521 HydrophobicContact CG2-CZ 4.07Å; I397-F526 HydrophobicContact CG1-CZ 4.11Å; I397-F526 HydrophobicContact CG2-CE1 4.34Å
398	T	94.6	Very high	92.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.4	-47.8	177.6	-60.2	0	0	0	0	111.3	V371 A394 A395 I400 F401 A402 V410 L423	V371-T398 HydrophobicContact CG1-CG2 4.37Å; A394-T398 VanDerWaalsContact O-CB 3.22Å; A394-T398 WeakPolarHBondContact O-CB 3.35Å; A394-T398 PolarHBondContact O-N 2.88Å; A394-T398 PolarHBondContact O-OG1 2.87Å; A395-T398 PolarHBondContact O-N 3.03Å; T398-I400 VanDerWaalsContact C-N 3.32Å; T398-I400 PolarHBondContact O-N 3.43Å; T398-F401 PolarHBondContact O-N 2.94Å; T398-A402 VanDerWaalsContact O-CB 3.23Å; T398-A402 WeakPolarHBondContact O-CB 3.43Å; T398-A402 PolarHBondContact O-N 3.38Å; T398-V410 HydrophobicContact CG2-CB 4.1Å; T398-V410 HydrophobicContact CG2-CG1 3.34Å; T398-V410 HydrophobicContact CG2-CG2 3.54Å; T398-L423 HydrophobicContact CG2-CD1 3.64Å
399	M	95	Very high	93.2	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.015	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-34.6	179.6	-172	166.6	70.2	0	0	112.4	F355 Y356 F359 A395 A396 I397 R403 L429 V432	F355-M399 HydrophobicContact CD1-CE 4.49Å; F355-M399 HydrophobicContact CE1-CE 3.23Å; F355-M399 HydrophobicContact CZ-CE 3.31Å; Y356-M399 HydrophobicContact CD1-CE 4.45Å; Y356-M399 HydrophobicContact CE1-CE 3.85Å; Y356-M399 HydrophobicContact CE1-SD 4.29Å; F359-M399 HydrophobicContact CE1-CE 4.47Å; F359-M399 HydrophobicContact CE1-CG 4.09Å; F359-M399 HydrophobicContact CE2-CE 4.33Å; F359-M399 HydrophobicContact CZ-CE 3.61Å; F359-M399 HydrophobicContact CZ-CG 4.12Å; A395-M399 WeakPolarHBondContact O-CB 3.26Å; A395-M399 PolarHBondContact O-N 3.4Å; A396-M399 PolarHBondContact O-N 3.12Å; I397-M399 VanDerWaalsContact C-N 3.34Å; I397-M399 PolarHBondContact O-N 3.43Å; M399-R403 HydrophobicContact CG-CG 4.18Å; M399-R403 VanDerWaalsContact O-CB 3.27Å; M399-R403 WeakPolarHBondContact O-CB 3.32Å; M399-R403 VanDerWaalsContact O-CG 3.27Å; M399-R403 WeakPolarHBondContact O-CG 3.48Å; M399-R403 PolarHBondContact O-N 3.32Å; M399-L429 HydrophobicContact CE-CB 4.11Å; M399-L429 HydrophobicContact CE-CD1 4.01Å; M399-V432 HydrophobicContact SD-CG2 4.07Å
400	I	94.4	Very high	93.4	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-60	-57.9	173.9	-71.6	161.3	0	0	0	109.5	P319 F320 F359 A396 I397 T398 A402 R403 T404 F526	P319-I400 HydrophobicContact CB-CD1 4.41Å; P319-I400 HydrophobicContact CB-CG1 4.43Å; P319-I400 HydrophobicContact CG-CD1 3.99Å; P319-I400 HydrophobicContact CG-CG1 3.89Å; F320-I400 HydrophobicContact CB-CD1 4.15Å; F320-I400 HydrophobicContact CD2-CD1 4.45Å; F359-I400 HydrophobicContact CD1-CG1 4.31Å; F359-I400 HydrophobicContact CE1-CB 4.24Å; F359-I400 HydrophobicContact CE1-CG1 3.63Å; F359-I400 HydrophobicContact CZ-CG1 4.15Å; A396-I400 WeakPolarHBondContact O-CB 3.4Å; A396-I400 WeakPolarHBondContact O-CD1 3.35Å; A396-I400 WeakPolarHBondContact O-CG1 3.44Å; A396-I400 PolarHBondContact O-N 3.2Å; I397-I400 PolarHBondContact O-N 2.91Å; T398-I400 VanDerWaalsContact C-N 3.32Å; T398-I400 PolarHBondContact O-N 3.43Å; I400-A402 PolarHBondContact O-N 2.85Å; I400-R403 PolarHBondContact O-N 3.39Å; I400-T404 HydrophobicContact CG2-CG2 4.41Å; I400-T404 WeakPolarHBondContact O-CB 3.38Å; I400-T404 VanDerWaalsContact O-CG2 3.22Å; I400-T404 WeakPolarHBondContact O-CG2 3.18Å; I400-T404 PolarHBondContact O-N 2.9Å; I400-T404 PolarHBondContact O-OG1 3.32Å; I400-F526 HydrophobicContact CB-CE1 4.23Å; I400-F526 HydrophobicContact CD1-CE1 4.06Å; I400-F526 HydrophobicContact CD1-CE2 4.21Å; I400-F526 HydrophobicContact CD1-CZ 3.5Å; I400-F526 HydrophobicContact CG2-CD1 4.37Å; I400-F526 HydrophobicContact CG2-CE1 3.83Å; I400-F526 HydrophobicContact CG2-CZ 4.39Å
401	F	94.5	Very high	93.6	Very high	14 Å²	14	24.8 Å²	24.8	6%	0.061	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-44.1	179.6	-74.8	-73.6	0	0	0	112.8	F369 V371 I397 T398 R403 T404 E405 T408 I464 F526 I529	F369-F401 AromaticContact CD1-CD1 3.95Å; F369-F401 HydrophobicContact CD1-CD1 3.95Å; F369-F401 HydrophobicContact CD1-CE1 4.2Å; F369-F401 HydrophobicContact CE1-CD1 4.01Å; F369-F401 AromaticContact CE1-CE1 3.86Å; F369-F401 HydrophobicContact CE1-CE1 3.86Å; F369-F401 HydrophobicContact CZ-CE1 4.48Å; V371-F401 HydrophobicContact CG2-CB 3.83Å; V371-F401 HydrophobicContact CG2-CD2 4.29Å; V371-F401 HydrophobicContact CG2-CG 4.19Å; I397-F401 HydrophobicContact CG2-CD2 3.94Å; I397-F401 HydrophobicContact CG2-CE2 3.85Å; I397-F401 VanDerWaalsContact O-CD2 3.32Å; I397-F401 WeakPolarHBondContact O-CD2 3.45Å; I397-F401 PolarHBondContact O-N 2.82Å; I397-F401 VanDerWaalsContact O-N 3.12Å; T398-F401 PolarHBondContact O-N 2.94Å; F401-R403 VanDerWaalsContact C-N 3.27Å; F401-R403 PolarHBondContact O-N 2.87Å; F401-T404 PolarHBondContact O-N 3.35Å; F401-T404 PolarHBondContact O-OG1 3.11Å; F401-E405 HydrophobicContact CD1-CG 4.44Å; F401-E405 WeakPolarHBondContact O-CB 3.49Å; F401-E405 PolarHBondContact O-N 2.83Å; F401-T408 HydrophobicContact CB-CG2 4.33Å; F401-T408 PolarHBondContact O-OG1 2.88Å; F401-I464 HydrophobicContact CD1-CD1 4.11Å; F401-I464 HydrophobicContact CD2-CD1 3.74Å; F401-I464 HydrophobicContact CE1-CD1 3.84Å; F401-I464 HydrophobicContact CE2-CD1 3.45Å; F401-I464 VanDerWaalsContact CE2-CD1 3.45Å; F401-I464 HydrophobicContact CG-CD1 4.08Å; F401-I464 HydrophobicContact CZ-CD1 3.51Å; F401-F526 HydrophobicContact CE2-CD1 4.03Å; F401-F526 AromaticContact CE2-CE1 3.86Å; F401-F526 HydrophobicContact CE2-CE1 3.86Å; F401-F526 HydrophobicContact CZ-CD1 4.02Å; F401-F526 HydrophobicContact CZ-CE1 4.32Å; F401-I529 HydrophobicContact CE1-CG2 4.06Å; F401-I529 HydrophobicContact CE2-CD1 4.26Å; F401-I529 HydrophobicContact CZ-CB 4.35Å; F401-I529 HydrophobicContact CZ-CD1 3.99Å; F401-I529 HydrophobicContact CZ-CG2 3.75Å
402	A	93.8	Very high	93.6	Very high	36 Å²	36	24.2 Å²	24.2	30%	0.298	14%	0.138	S	C	.	.	H	α-helix	trans	-62.9	-31.7	-179.2	0	0	0	0	0	113.6	T398 I400 T408 V410	T398-A402 VanDerWaalsContact O-CB 3.23Å; T398-A402 WeakPolarHBondContact O-CB 3.43Å; T398-A402 PolarHBondContact O-N 3.38Å; I400-A402 PolarHBondContact O-N 2.85Å; A402-T408 HydrophobicContact CB-CG2 4.36Å; A402-V410 HydrophobicContact CB-CG2 4.23Å
403	R	92.6	Very high	93.4	Very high	82 Å²	82	22.8 Å²	22.8	31%	0.309	13%	0.129	S	C	.	.	H	α-helix	trans	-91.2	-23.3	179.2	-67.4	-176	-178.4	-153.3	4.6	113.5	F359 M399 I400 F401 A425 M427	F359-R403 HydrophobicContact CD1-CB 3.86Å; F359-R403 HydrophobicContact CD1-CG 4.49Å; F359-R403 HydrophobicContact CE1-CB 4.32Å; M399-R403 HydrophobicContact CG-CG 4.18Å; M399-R403 VanDerWaalsContact O-CB 3.27Å; M399-R403 WeakPolarHBondContact O-CB 3.32Å; M399-R403 VanDerWaalsContact O-CG 3.27Å; M399-R403 WeakPolarHBondContact O-CG 3.48Å; M399-R403 PolarHBondContact O-N 3.32Å; I400-R403 PolarHBondContact O-N 3.39Å; F401-R403 VanDerWaalsContact C-N 3.27Å; F401-R403 PolarHBondContact O-N 2.87Å; R403-A425 PolarHBondContact NH2-O 3.18Å; R403-M427 PolarHBondContact NH2-O 3.33Å
404	T	92.1	Very high	93	Very high	24 Å²	24	23.2 Å²	23.2	15%	0.147	13%	0.131	C	C	.	.	H	α-helix	trans	-91.1	-39	179.6	58.9	0	0	0	0	112.3	V362 I400 F401	V362-T404 HydrophobicContact CB-CG2 3.66Å; V362-T404 HydrophobicContact CG1-CG2 3.8Å; V362-T404 HydrophobicContact CG2-CG2 4.33Å; I400-T404 HydrophobicContact CG2-CG2 4.41Å; I400-T404 WeakPolarHBondContact O-CB 3.38Å; I400-T404 VanDerWaalsContact O-CG2 3.22Å; I400-T404 WeakPolarHBondContact O-CG2 3.18Å; I400-T404 PolarHBondContact O-N 2.9Å; I400-T404 PolarHBondContact O-OG1 3.32Å; F401-T404 PolarHBondContact O-N 3.35Å; F401-T404 PolarHBondContact O-OG1 3.11Å
405	E	93.2	Very high	92.1	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.028	16%	0.161	C	C	.	.			trans	-105.1	113.2	-175.1	-62.5	-69.7	173.7	0	0	110.3	V365 G366 F369 F401 N407 T408	V365-E405 WeakPolarHBondContact CA-OE1 3.41Å; V365-E405 VanDerWaalsContact CB-OE1 3.28Å; V365-E405 WeakPolarHBondContact CB-OE1 3.29Å; V365-E405 WeakPolarHBondContact CG2-OE1 3.26Å; V365-E405 PolarHBondContact N-OE1 3.18Å; G366-E405 WeakPolarHBondContact CA-OE2 3.39Å; G366-E405 PolarHBondContact N-OE2 3.1Å; F369-E405 HydrophobicContact CD2-CB 3.9Å; F369-E405 HydrophobicContact CD2-CG 3.65Å; F369-E405 HydrophobicContact CE2-CB 4.28Å; F369-E405 VanDerWaalsContact CE2-CD 3.47Å; F369-E405 HydrophobicContact CE2-CG 3.56Å; F369-E405 HydrophobicContact CG-CG 4.44Å; F369-E405 HydrophobicContact CZ-CG 4.32Å; F401-E405 HydrophobicContact CD1-CG 4.44Å; F401-E405 WeakPolarHBondContact O-CB 3.49Å; F401-E405 PolarHBondContact O-N 2.83Å; E405-N407 PolarHBondContact O-N 2.85Å; E405-N407 VanDerWaalsContact O-N 3.1Å; E405-T408 VanDerWaalsContact CB-OG1 3.26Å; E405-T408 WeakPolarHBondContact CB-OG1 3.38Å; E405-T408 PolarHBondContact O-N 2.97Å; E405-T408 PolarHBondContact O-OG1 2.81Å
406	S	89.6	Confident	90.9	Very high	108 Å²	108	32.1 Å²	32.1	76%	0.755	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.3	-178.7	55	0	0	0	0	114.3
407	N	93.3	Very high	90.2	Very high	94 Å²	94	34.4 Å²	34.4	50%	0.503	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	58.9	-177.7	-66.1	-47.2	0	0	0	111.6	R368 F369 E405	R368-N407 CarbonylContact C-O 3.56Å; R368-N407 WeakPolarHBondContact CA-O 3.39Å; R368-N407 HydrophobicContact CB-CB 4.36Å; R368-N407 HydrophobicContact CG-CB 3.93Å; F369-N407 PolarHBondContact N-O 3.25Å; E405-N407 PolarHBondContact O-N 2.85Å; E405-N407 VanDerWaalsContact O-N 3.1Å
408	T	95.2	Very high	89.8	Confident	29 Å²	29	35.7 Å²	35.7	18%	0.178	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.8	176.4	-58.2	0	0	0	0	111.5	F369 V371 F401 A402 E405 V410	F369-T408 HydrophobicContact CB-CG2 4.19Å; F369-T408 WeakPolarHBondContact O-CA 3.27Å; V371-T408 HydrophobicContact CG2-CG2 4Å; F401-T408 HydrophobicContact CB-CG2 4.33Å; F401-T408 PolarHBondContact O-OG1 2.88Å; A402-T408 HydrophobicContact CB-CG2 4.36Å; E405-T408 VanDerWaalsContact CB-OG1 3.26Å; E405-T408 WeakPolarHBondContact CB-OG1 3.38Å; E405-T408 PolarHBondContact O-N 2.97Å; E405-T408 PolarHBondContact O-OG1 2.81Å; T408-V410 HydrophobicContact CG2-CG2 4.27Å
409	Q	95.3	Very high	89.6	Confident	67 Å²	67	38.3 Å²	38.3	31%	0.313	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.2	167.9	-73.3	174.3	86.7	0	0	109.4	F369 V370 V371	F369-Q409 PolarHBondContact O-N 2.92Å; V370-Q409 CarbonylContact C-O 3.59Å; V370-Q409 WeakPolarHBondContact CA-O 3.36Å; V370-Q409 HydrophobicContact CG2-CB 4.26Å; V371-Q409 PolarHBondContact N-O 3.47Å
410	V	95.3	Very high	89.4	Confident	10 Å²	10	41.7 Å²	41.7	6%	0.061	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.5	178.1	-179.2	0	0	0	0	109.1	V371 T398 A402 T408 C421 L423 L436	V371-V410 CarbonylContact O-C 3.45Å; V371-V410 WeakPolarHBondContact O-CA 3.42Å; T398-V410 HydrophobicContact CG2-CB 4.1Å; T398-V410 HydrophobicContact CG2-CG1 3.34Å; T398-V410 HydrophobicContact CG2-CG2 3.54Å; A402-V410 HydrophobicContact CB-CG2 4.23Å; T408-V410 HydrophobicContact CG2-CG2 4.27Å; V410-C421 HydrophobicContact CB-CB 4.35Å; V410-C421 HydrophobicContact CG1-CB 3.93Å; V410-C421 PolarHBondContact O-N 2.9Å; V410-L423 HydrophobicContact CB-CD1 4.39Å; V410-L423 HydrophobicContact CG1-CD1 4.2Å; V410-L423 HydrophobicContact CG2-CD1 3.94Å; V410-L423 HydrophobicContact CG2-CG 4.42Å; V410-L436 HydrophobicContact CG1-CD2 4.34Å
411	L	93.8	Very high	89.1	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.8	179.7	-53.2	176.5	0	0	0	109.4	V370 V371 A372 V373 V418 V419 P420 P449 W452	V370-L411 HydrophobicContact CG1-CD1 3.51Å; V370-L411 HydrophobicContact CG1-CG 4.09Å; V371-L411 PolarHBondContact O-N 3.48Å; A372-L411 CarbonylContact C-O 3.57Å; A372-L411 VanDerWaalsContact CA-O 3.32Å; A372-L411 WeakPolarHBondContact CA-O 3.47Å; A372-L411 HydrophobicContact CB-CB 4.16Å; V373-L411 PolarHBondContact N-O 2.97Å; L411-V418 HydrophobicContact CB-CG1 4.13Å; L411-V418 HydrophobicContact CD1-CG1 3.89Å; L411-V418 HydrophobicContact CD2-CG1 4.28Å; L411-V418 HydrophobicContact CG-CG1 4.32Å; L411-V419 WeakPolarHBondContact CA-O 3.49Å; L411-P420 HydrophobicContact CD2-CB 4.11Å; L411-P420 HydrophobicContact CD2-CG 4.13Å; L411-P449 HydrophobicContact CD1-CB 4.2Å; L411-W452 HydrophobicContact CD1-CD2 4.21Å; L411-W452 HydrophobicContact CD1-CE3 3.64Å; L411-W452 HydrophobicContact CD1-CZ3 3.91Å; L411-W452 HydrophobicContact CD2-CD2 4.5Å; L411-W452 HydrophobicContact CD2-CE3 4.26Å; L411-W452 HydrophobicContact CD2-CH2 3.95Å; L411-W452 HydrophobicContact CD2-CZ2 4.18Å; L411-W452 HydrophobicContact CD2-CZ3 4Å
412	A	91.4	Very high	88.6	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.008	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.6	160.4	0	0	0	0	0	108.4	V373 V375 V419 C421 F439	V373-A412 WeakPolarHBondContact O-CA 3.32Å; V375-A412 HydrophobicContact CG1-CB 4.23Å; V375-A412 HydrophobicContact CG2-CB 4.47Å; A412-V419 PolarHBondContact N-O 2.84Å; A412-V419 PolarHBondContact O-N 2.92Å; A412-C421 VanDerWaalsContact CB-SG 3.57Å; A412-F439 HydrophobicContact CB-CD2 3.62Å; A412-F439 HydrophobicContact CB-CE2 3.73Å; A412-F439 HydrophobicContact CB-CG 4.43Å
413	F	88.6	Confident	88.2	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	135.5	-179.4	69.2	-80.6	0	0	0	113.1	A372 V373 D374 V375 A417 V418 T444 D445 L448 P449 I465	A372-F413 HydrophobicContact CB-CD1 3.94Å; A372-F413 HydrophobicContact CB-CE1 3.86Å; V373-F413 VanDerWaalsContact C-CE1 3.44Å; V373-F413 VanDerWaalsContact O-CD1 3.27Å; V373-F413 WeakPolarHBondContact O-CD1 3.26Å; V373-F413 PolarHBondContact O-N 3.46Å; D374-F413 HydrophobicContact CB-CE1 3.95Å; D374-F413 HydrophobicContact CB-CE2 4.14Å; D374-F413 HydrophobicContact CB-CZ 3.59Å; D374-F413 VanDerWaalsContact N-CE1 3.31Å; V375-F413 WeakPolarHBondContact CG2-O 3.49Å; V375-F413 PolarHBondContact N-O 2.98Å; V375-F413 VanDerWaalsContact N-O 3.15Å; F413-A417 VanDerWaalsContact CA-O 3.3Å; F413-A417 WeakPolarHBondContact CA-O 3.16Å; F413-A417 WeakPolarHBondContact CB-O 3.15Å; F413-V418 HydrophobicContact CB-CG2 4.07Å; F413-T444 HydrophobicContact CD2-CG2 4.19Å; F413-T444 HydrophobicContact CE2-CG2 3.48Å; F413-T444 VanDerWaalsContact CE2-CG2 3.48Å; F413-T444 HydrophobicContact CZ-CG2 4.29Å; F413-D445 WeakPolarHBondContact CE2-O 3.44Å; F413-L448 HydrophobicContact CD2-CD1 4.33Å; F413-P449 HydrophobicContact CD1-CG 3.9Å; F413-P449 HydrophobicContact CE1-CG 3.99Å; F413-P449 HydrophobicContact CG-CG 4.25Å; F413-P449 HydrophobicContact CZ-CG 4.39Å; F413-I465 HydrophobicContact CE1-CG2 3.96Å; F413-I465 HydrophobicContact CZ-CG2 3.68Å
414	S	83.8	Confident	87.7	Confident	10 Å²	10	45.5 Å²	45.5	7%	0.07	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	152.4	173.4	58.6	0	0	0	0	110.2	G416 A417 P440	S414-G416 VanDerWaalsContact C-N 3.31Å; S414-G416 PolarHBondContact O-N 3.27Å; S414-G416 VanDerWaalsContact O-N 3.15Å; S414-A417 PolarHBondContact N-O 3.45Å; S414-A417 VanDerWaalsContact N-O 3.13Å; S414-A417 WeakPolarHBondContact O-CA 3.24Å; S414-A417 WeakPolarHBondContact O-CB 3.25Å; S414-A417 PolarHBondContact O-N 3.42Å; S414-P440 WeakPolarHBondContact CB-O 3.42Å; S414-P440 PolarHBondContact OG-O 2.78Å
415	E	73.4	Confident	87	Confident	132 Å²	132	47.7 Å²	47.7	62%	0.617	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	44	170.4	-153.9	177.1	178.2	0	0	114.2	A417 S443	E415-A417 PolarHBondContact O-N 3.22Å; E415-A417 VanDerWaalsContact O-N 3.12Å; E415-S443 WeakPolarHBondContact CA-O 3.46Å; E415-S443 PolarHBondContact N-O 2.99Å
416	G	70.2	Confident	86.5	Confident	56 Å²	56	54.5 Å²	54.5	58%	0.577	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	-4.9	-178.7	0	0	0	0	0	115.2	S414	S414-G416 VanDerWaalsContact C-N 3.31Å; S414-G416 PolarHBondContact O-N 3.27Å; S414-G416 VanDerWaalsContact O-N 3.15Å
417	A	79.5	Confident	86.6	Confident	48 Å²	48	51.4 Å²	51.4	40%	0.397	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	139.8	175.5	0	0	0	0	0	111.2	F413 S414 E415	F413-A417 VanDerWaalsContact CA-O 3.3Å; F413-A417 WeakPolarHBondContact CA-O 3.16Å; F413-A417 WeakPolarHBondContact CB-O 3.15Å; S414-A417 PolarHBondContact N-O 3.45Å; S414-A417 VanDerWaalsContact N-O 3.13Å; S414-A417 WeakPolarHBondContact O-CA 3.24Å; S414-A417 WeakPolarHBondContact O-CB 3.25Å; S414-A417 PolarHBondContact O-N 3.42Å; E415-A417 PolarHBondContact O-N 3.22Å; E415-A417 VanDerWaalsContact O-N 3.12Å
418	V	86.5	Confident	86.6	Confident	27 Å²	27	48.7 Å²	48.7	16%	0.164	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	118.7	170.8	-179	0	0	0	0	107.5	L411 F413 L448 W452	L411-V418 HydrophobicContact CB-CG1 4.13Å; L411-V418 HydrophobicContact CD1-CG1 3.89Å; L411-V418 HydrophobicContact CD2-CG1 4.28Å; L411-V418 HydrophobicContact CG-CG1 4.32Å; F413-V418 HydrophobicContact CB-CG2 4.07Å; V418-L448 HydrophobicContact CG2-CB 3.59Å; V418-W452 HydrophobicContact CB-CB 4.26Å; V418-W452 HydrophobicContact CB-CG 4.17Å; V418-W452 HydrophobicContact CG1-CB 4.09Å; V418-W452 HydrophobicContact CG1-CD2 4.27Å; V418-W452 HydrophobicContact CG1-CG 3.82Å; V418-W452 HydrophobicContact CG2-CB 4.25Å
419	V	89.3	Confident	86.6	Confident	55 Å²	55	48.3 Å²	48.3	33%	0.333	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.9	-177	-173.9	0	0	0	0	109.4	L411 A412 C421 F439	L411-V419 WeakPolarHBondContact CA-O 3.49Å; A412-V419 PolarHBondContact N-O 2.84Å; A412-V419 PolarHBondContact O-N 2.92Å; V419-C421 PolarHBondContact O-N 3.44Å; V419-F439 HydrophobicContact CB-CE1 3.95Å; V419-F439 HydrophobicContact CB-CZ 4.17Å; V419-F439 HydrophobicContact CG1-CE1 3.66Å; V419-F439 HydrophobicContact CG1-CZ 3.78Å; V419-F439 HydrophobicContact CG2-CD1 4.3Å; V419-F439 HydrophobicContact CG2-CE1 4.08Å
420	P	90.9	Very high	86.4	Confident	74 Å²	74	48.6 Å²	48.6	48%	0.481	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	127.4	169.7	-21.8	33.9	0	0	0	111.5	L411 W452	L411-P420 HydrophobicContact CD2-CB 4.11Å; L411-P420 HydrophobicContact CD2-CG 4.13Å; P420-W452 HydrophobicContact CG-CZ2 3.97Å
421	C	88.9	Confident	86.3	Confident	9 Å²	9	53.2 Å²	53.2	6%	0.061	34%	0.339	C	S	.	.			trans	-98.1	118.2	175.6	-59.5	0	0	0	0	109.4	V410 A412 V419 L423	V410-C421 HydrophobicContact CB-CB 4.35Å; V410-C421 HydrophobicContact CG1-CB 3.93Å; V410-C421 PolarHBondContact O-N 2.9Å; A412-C421 VanDerWaalsContact CB-SG 3.57Å; V419-C421 PolarHBondContact O-N 3.44Å; C421-L423 PolarHBondContact O-N 2.92Å
422	S	84.1	Confident	86.3	Confident	105 Å²	105	53.3 Å²	53.3	73%	0.734	34%	0.34	S	S	*	.			trans	-86	98.3	175.5	-64.4	0	0	0	0	109.7
423	L	85.9	Confident	86.3	Confident	41 Å²	41	54.3 Å²	54.3	22%	0.215	35%	0.346	C	S	.	.			trans	-87.6	125.7	174.4	-57.2	-173.6	0	0	0	110.1	T398 V410 C421 M427 V432 E435	T398-L423 HydrophobicContact CG2-CD1 3.64Å; V410-L423 HydrophobicContact CB-CD1 4.39Å; V410-L423 HydrophobicContact CG1-CD1 4.2Å; V410-L423 HydrophobicContact CG2-CD1 3.94Å; V410-L423 HydrophobicContact CG2-CG 4.42Å; C421-L423 PolarHBondContact O-N 2.92Å; L423-M427 HydrophobicContact CB-SD 4.38Å; L423-M427 HydrophobicContact CD2-SD 4.05Å; L423-V432 HydrophobicContact CD1-CG1 4Å; L423-V432 HydrophobicContact CD2-CG1 4.13Å; L423-V432 HydrophobicContact CD2-CG2 4.39Å; L423-E435 HydrophobicContact CD2-CG 4.35Å
424	S	82.3	Confident	86.4	Confident	58 Å²	58	56.8 Å²	56.8	41%	0.406	37%	0.367	S	S	.	.			trans	-81.1	147.4	168.8	169.5	0	0	0	0	110.3	D426 M427	S424-D426 PolarHBondContact O-N 2.88Å; S424-D426 VanDerWaalsContact O-N 3.15Å; S424-D426 PolarHBondContact OG-N 3.31Å; S424-M427 PolarHBondContact N-SD 3.25Å; S424-M427 VanDerWaalsContact N-SD 3.41Å; S424-M427 PolarHBondContact O-N 3.05Å
425	A	76.5	Confident	86.6	Confident	70 Å²	70	58.4 Å²	58.4	58%	0.579	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-25	176	0	0	0	0	0	113	R403	R403-A425 PolarHBondContact NH2-O 3.18Å
426	D	83.4	Confident	87.2	Confident	148 Å²	148	52.2 Å²	52.2	79%	0.791	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-9.1	-177.1	-59.5	-43	0	0	0	113.8	S424 S428	S424-D426 PolarHBondContact O-N 2.88Å; S424-D426 VanDerWaalsContact O-N 3.15Å; S424-D426 PolarHBondContact OG-N 3.31Å; D426-S428 PolarHBondContact O-N 2.98Å
427	M	91.4	Very high	87.7	Confident	44 Å²	44	53.1 Å²	53.1	22%	0.217	34%	0.339	C	S	.	.			trans	-63.5	128.9	-178.1	-73.6	177.1	177.2	0	0	111.5	R403 L423 S424 E431 V432	R403-M427 PolarHBondContact NH2-O 3.33Å; L423-M427 HydrophobicContact CB-SD 4.38Å; L423-M427 HydrophobicContact CD2-SD 4.05Å; S424-M427 PolarHBondContact N-SD 3.25Å; S424-M427 VanDerWaalsContact N-SD 3.41Å; S424-M427 PolarHBondContact O-N 3.05Å; M427-E431 HydrophobicContact CB-CB 4.35Å; M427-V432 HydrophobicContact CB-CG2 3.74Å; M427-V432 HydrophobicContact SD-CG2 4.48Å
428	S	93.8	Very high	87.8	Confident	37 Å²	37	57.3 Å²	57.3	26%	0.259	35%	0.348	S	S	.	.			trans	-66.6	159.8	171.1	66	0	0	0	0	111.9	Y356 D426 A430 E431 V432	Y356-S428 WeakPolarHBondContact OH-CA 3.32Å; D426-S428 PolarHBondContact O-N 2.98Å; S428-A430 PolarHBondContact O-N 3.4Å; S428-E431 WeakPolarHBondContact CB-OE2 3.37Å; S428-E431 PolarHBondContact N-OE2 3Å; S428-E431 PolarHBondContact O-N 3.22Å; S428-E431 VanDerWaalsContact O-N 3.08Å; S428-E431 VanDerWaalsContact OG-CD 3.27Å; S428-E431 VanDerWaalsContact OG-CG 3.29Å; S428-E431 WeakPolarHBondContact OG-CG 3.49Å; S428-E431 PolarHBondContact OG-N 2.85Å; S428-E431 PolarHBondContact OG-OE2 2.97Å; S428-V432 WeakPolarHBondContact O-CG2 3.27Å; S428-V432 PolarHBondContact O-N 3.29Å
429	L	93.8	Very high	87.2	Confident	21 Å²	21	58.4 Å²	58.4	11%	0.11	35%	0.35	C	S	.	.	H	α-helix	trans	-54.3	-37.5	175.3	-178.1	59.9	0	0	0	112.3	L323 F355 Y356 V392 A395 A396 M399 T433	L323-L429 HydrophobicContact CD1-CD2 3.71Å; L323-L429 HydrophobicContact CD2-CD2 4.42Å; F355-L429 HydrophobicContact CE1-CB 4.28Å; F355-L429 HydrophobicContact CE1-CD2 4.29Å; F355-L429 HydrophobicContact CZ-CD2 4.24Å; Y356-L429 PolarHBondContact OH-N 2.97Å; V392-L429 HydrophobicContact CG1-CD2 4.01Å; V392-L429 HydrophobicContact CG1-CG 4.48Å; A395-L429 HydrophobicContact CB-CD1 3.93Å; A396-L429 HydrophobicContact CB-CD1 3.89Å; M399-L429 HydrophobicContact CE-CB 4.11Å; M399-L429 HydrophobicContact CE-CD1 4.01Å; L429-T433 WeakPolarHBondContact O-CB 3.44Å; L429-T433 PolarHBondContact O-N 3.43Å; L429-T433 PolarHBondContact O-OG1 2.75Å
430	A	92.3	Very high	86	Confident	72 Å²	72	60.1 Å²	60.1	60%	0.595	36%	0.363	S	S	*	.	H	α-helix	trans	-67.6	-42	178	0	0	0	0	0	112	S428 T433 A434	S428-A430 PolarHBondContact O-N 3.4Å; A430-T433 PolarHBondContact O-N 2.94Å; A430-A434 WeakPolarHBondContact O-CB 3.4Å; A430-A434 PolarHBondContact O-N 2.78Å
431	E	93.3	Very high	84.7	Confident	108 Å²	108	60.7 Å²	60.7	51%	0.505	37%	0.368	S	S	.	.	H	α-helix	trans	-66.6	-43.2	176.3	-71.5	161.9	143.7	0	0	111.7	M427 S428 T433 A434 E435	M427-E431 HydrophobicContact CB-CB 4.35Å; S428-E431 WeakPolarHBondContact CB-OE2 3.37Å; S428-E431 PolarHBondContact N-OE2 3Å; S428-E431 PolarHBondContact O-N 3.22Å; S428-E431 VanDerWaalsContact O-N 3.08Å; S428-E431 VanDerWaalsContact OG-CD 3.27Å; S428-E431 VanDerWaalsContact OG-CG 3.29Å; S428-E431 WeakPolarHBondContact OG-CG 3.49Å; S428-E431 PolarHBondContact OG-N 2.85Å; S428-E431 PolarHBondContact OG-OE2 2.97Å; E431-T433 VanDerWaalsContact C-N 3.31Å; E431-T433 PolarHBondContact O-N 3.01Å; E431-A434 PolarHBondContact O-N 2.88Å; E431-E435 WeakPolarHBondContact O-CB 3.31Å; E431-E435 PolarHBondContact O-N 2.81Å
432	V	92.8	Very high	83.7	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.012	38%	0.378	C	S	.	.	H	α-helix	trans	-61	-42.7	174.3	177.5	0	0	0	0	110.6	A395 M399 L423 M427 S428 A434 E435 L436	A395-V432 HydrophobicContact CB-CB 4.35Å; A395-V432 HydrophobicContact CB-CG1 3.88Å; M399-V432 HydrophobicContact SD-CG2 4.07Å; L423-V432 HydrophobicContact CD1-CG1 4Å; L423-V432 HydrophobicContact CD2-CG1 4.13Å; L423-V432 HydrophobicContact CD2-CG2 4.39Å; M427-V432 HydrophobicContact CB-CG2 3.74Å; M427-V432 HydrophobicContact SD-CG2 4.48Å; S428-V432 WeakPolarHBondContact O-CG2 3.27Å; S428-V432 PolarHBondContact O-N 3.29Å; V432-A434 PolarHBondContact O-N 3.07Å; V432-E435 PolarHBondContact O-N 2.69Å; V432-L436 HydrophobicContact CG1-CD1 4.11Å; V432-L436 HydrophobicContact CG1-CG 4.48Å; V432-L436 WeakPolarHBondContact O-CG 3.46Å; V432-L436 PolarHBondContact O-N 2.95Å
433	T	91.6	Very high	83.1	Confident	22 Å²	22	60.8 Å²	60.8	14%	0.135	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-45.3	176.6	-55.4	0	0	0	0	111	A391 V392 A395 L429 A430 E431 L436 V437	A391-T433 HydrophobicContact CB-CG2 3.83Å; V392-T433 HydrophobicContact CG2-CG2 4.31Å; A395-T433 WeakPolarHBondContact CB-OG1 3.2Å; L429-T433 WeakPolarHBondContact O-CB 3.44Å; L429-T433 PolarHBondContact O-N 3.43Å; L429-T433 PolarHBondContact O-OG1 2.75Å; A430-T433 PolarHBondContact O-N 2.94Å; E431-T433 VanDerWaalsContact C-N 3.31Å; E431-T433 PolarHBondContact O-N 3.01Å; T433-L436 PolarHBondContact O-N 2.76Å; T433-V437 VanDerWaalsContact O-CG2 3.31Å; T433-V437 WeakPolarHBondContact O-CG2 3.44Å; T433-V437 PolarHBondContact O-N 2.92Å; T433-V437 VanDerWaalsContact O-N 3.16Å
434	A	90.1	Very high	82.5	Confident	54 Å²	54	59.5 Å²	59.5	45%	0.446	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-43.6	177.3	0	0	0	0	0	111.4	A430 E431 V432 L436 V437 K438	A430-A434 WeakPolarHBondContact O-CB 3.4Å; A430-A434 PolarHBondContact O-N 2.78Å; E431-A434 PolarHBondContact O-N 2.88Å; V432-A434 PolarHBondContact O-N 3.07Å; A434-L436 PolarHBondContact O-N 2.76Å; A434-V437 PolarHBondContact O-N 3.01Å; A434-K438 WeakPolarHBondContact O-CG 3.49Å; A434-K438 PolarHBondContact O-N 3.48Å
435	E	89.2	Confident	82.6	Confident	44 Å²	44	57.3 Å²	57.3	21%	0.206	35%	0.351	C	S	.	.	H	α-helix	trans	-58	-46.4	177.6	-169.2	63.2	-153.3	0	0	112	L423 E431 V432 V437 K438	L423-E435 HydrophobicContact CD2-CG 4.35Å; E431-E435 WeakPolarHBondContact O-CB 3.31Å; E431-E435 PolarHBondContact O-N 2.81Å; V432-E435 PolarHBondContact O-N 2.69Å; E435-V437 VanDerWaalsContact C-N 3.33Å; E435-V437 PolarHBondContact O-N 2.91Å; E435-K438 PolarHBondContact O-N 3.27Å; E435-K438 WeakPolarHBondContact OE2-CE 3.21Å; E435-K438 IonicContact OE2-NZ 3.5Å; E435-K438 PolarHBondContact OE2-NZ 2.8Å
436	L	84.9	Confident	83	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-67	-32.8	-179.8	-68.7	173.9	0	0	0	112.6	V373 V375 A395 V410 V432 T433 A434	V373-L436 HydrophobicContact CB-CD2 4.29Å; V373-L436 HydrophobicContact CG2-CD1 4.21Å; V373-L436 HydrophobicContact CG2-CD2 3.96Å; V375-L436 WeakPolarHBondContact CG1-O 2.91Å; A395-L436 HydrophobicContact CB-CD1 3.97Å; V410-L436 HydrophobicContact CG1-CD2 4.34Å; V432-L436 HydrophobicContact CG1-CD1 4.11Å; V432-L436 HydrophobicContact CG1-CG 4.48Å; V432-L436 WeakPolarHBondContact O-CG 3.46Å; V432-L436 PolarHBondContact O-N 2.95Å; T433-L436 PolarHBondContact O-N 2.76Å; A434-L436 PolarHBondContact O-N 2.76Å
437	V	81.7	Confident	83.2	Confident	76 Å²	76	47.2 Å²	47.2	46%	0.461	29%	0.287	S	S	.	.	H	α-helix	trans	-90.8	-0.2	-175.7	-177.1	0	0	0	0	112.8	L379 A391 T433 A434 E435 F439	L379-V437 HydrophobicContact CD1-CG2 4.42Å; A391-V437 HydrophobicContact CB-CG2 4Å; T433-V437 VanDerWaalsContact O-CG2 3.31Å; T433-V437 WeakPolarHBondContact O-CG2 3.44Å; T433-V437 PolarHBondContact O-N 2.92Å; T433-V437 VanDerWaalsContact O-N 3.16Å; A434-V437 PolarHBondContact O-N 3.01Å; E435-V437 VanDerWaalsContact C-N 3.33Å; E435-V437 PolarHBondContact O-N 2.91Å; V437-F439 PolarHBondContact O-N 3.46Å
438	K	81.5	Confident	83.2	Confident	136 Å²	136	46.5 Å²	46.5	59%	0.591	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.5	178.3	-84	169	-169.3	-176.5	0	114.2	A434 E435	A434-K438 WeakPolarHBondContact O-CG 3.49Å; A434-K438 PolarHBondContact O-N 3.48Å; E435-K438 PolarHBondContact O-N 3.27Å; E435-K438 WeakPolarHBondContact OE2-CE 3.21Å; E435-K438 IonicContact OE2-NZ 3.5Å; E435-K438 PolarHBondContact OE2-NZ 2.8Å
439	F	72.9	Confident	83.2	Confident	50 Å²	50	44.8 Å²	44.8	22%	0.219	27%	0.272	C	S	.	.	S	Bend	trans	-84.2	141.9	-170.4	-59.1	-75.1	0	0	0	111.9	V375 A412 V419 V437	V375-F439 HydrophobicContact CG2-CB 3.77Å; A412-F439 HydrophobicContact CB-CD2 3.62Å; A412-F439 HydrophobicContact CB-CE2 3.73Å; A412-F439 HydrophobicContact CB-CG 4.43Å; V419-F439 HydrophobicContact CB-CE1 3.95Å; V419-F439 HydrophobicContact CB-CZ 4.17Å; V419-F439 HydrophobicContact CG1-CE1 3.66Å; V419-F439 HydrophobicContact CG1-CZ 3.78Å; V419-F439 HydrophobicContact CG2-CD1 4.3Å; V419-F439 HydrophobicContact CG2-CE1 4.08Å; V437-F439 PolarHBondContact O-N 3.46Å
440	P	64	Low	83.2	Confident	91 Å²	91	43.9 Å²	43.9	59%	0.591	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-64.2	140.6	-179.9	25.2	-32	0	0	0	111.6	S414	S414-P440 WeakPolarHBondContact CB-O 3.42Å; S414-P440 PolarHBondContact OG-O 2.78Å
441	S	65.1	Low	83.3	Confident	86 Å²	86	42.7 Å²	42.7	60%	0.601	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-77.1	135.8	175.7	55.9	0	0	0	0	111.1	V375 G376	V375-S441 WeakPolarHBondContact O-CA 3.43Å; G376-S441 WeakPolarHBondContact O-CB 3.29Å
442	G	67.7	Low	83.4	Confident	25 Å²	25	39.3 Å²	39.3	26%	0.258	24%	0.235	S	C	.	.			trans	-159.4	-167	-177.6	0	0	0	0	0	111.7	G376	G376-G442 CarbonylContact C-O 3.6Å; G376-G442 WeakPolarHBondContact CA-O 3.21Å; G376-G442 PolarHBondContact O-N 2.98Å
443	S	71.3	Confident	83.5	Confident	90 Å²	90	39.2 Å²	39.2	63%	0.629	24%	0.235	S	C	*	.			trans	-63.7	142.3	175.5	57.4	0	0	0	0	111	E415	E415-S443 WeakPolarHBondContact CA-O 3.46Å; E415-S443 PolarHBondContact N-O 2.99Å
444	T	74.3	Confident	83.6	Confident	15 Å²	15	40 Å²	40	9%	0.092	24%	0.24	C	C	.	.			trans	-105.7	142.8	-178.1	-55.7	0	0	0	0	110.3	D374 G376 F413 T473	D374-T444 HydrophobicContact CB-CG2 4.29Å; D374-T444 WeakPolarHBondContact OD1-CG2 3.25Å; D374-T444 PolarHBondContact OD1-OG1 3.2Å; D374-T444 WeakPolarHBondContact OD2-CG2 3.34Å; G376-T444 WeakPolarHBondContact CA-OG1 3.34Å; F413-T444 HydrophobicContact CD2-CG2 4.19Å; F413-T444 HydrophobicContact CE2-CG2 3.48Å; F413-T444 VanDerWaalsContact CE2-CG2 3.48Å; F413-T444 HydrophobicContact CZ-CG2 4.29Å; T444-T473 VanDerWaalsContact C-OG1 3.3Å; T444-T473 WeakPolarHBondContact CB-OG1 3.47Å; T444-T473 WeakPolarHBondContact O-CB 3.48Å; T444-T473 PolarHBondContact O-OG1 3.26Å
445	D	83.9	Confident	83.8	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.064	25%	0.252	C	S	.	.			trans	-132	114.9	161.5	175.1	6.6	0	0	0	109.2	F413 T447 L448 T473 T475	F413-D445 WeakPolarHBondContact CE2-O 3.44Å; D445-T447 VanDerWaalsContact CG-OG1 3.24Å; D445-T447 PolarHBondContact O-N 3.35Å; D445-T447 WeakPolarHBondContact OD1-CB 3.22Å; D445-T447 PolarHBondContact OD1-N 3.43Å; D445-T447 PolarHBondContact OD1-OG1 3.13Å; D445-T447 PolarHBondContact OD2-OG1 3.27Å; D445-T447 VanDerWaalsContact OD2-OG1 3.07Å; D445-L448 HydrophobicContact CB-CD1 3.92Å; D445-L448 HydrophobicContact CB-CG 3.82Å; D445-L448 WeakPolarHBondContact O-CB 3.25Å; D445-L448 WeakPolarHBondContact O-CD1 3.37Å; D445-L448 VanDerWaalsContact O-CG 3.28Å; D445-L448 WeakPolarHBondContact O-CG 3.18Å; D445-L448 PolarHBondContact O-N 3.22Å; D445-T473 WeakPolarHBondContact CA-O 3.35Å; D445-T475 HydrophobicContact CB-CG2 4.04Å; D445-T475 PolarHBondContact OD1-N 3.45Å; D445-T475 WeakPolarHBondContact OD2-CB 3.28Å; D445-T475 VanDerWaalsContact OD2-CG2 3.24Å; D445-T475 WeakPolarHBondContact OD2-CG2 3.46Å; D445-T475 PolarHBondContact OD2-OG1 3.23Å
446	C	84.4	Confident	84	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.014	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.6	-175.2	-60.1	0	0	0	0	113	I465 T473 F474 M497	C446-I465 HydrophobicContact CB-CG2 4.44Å; C446-I465 WeakPolarHBondContact O-CD1 3.18Å; C446-T473 PolarHBondContact N-O 3.31Å; C446-F474 HydrophobicContact CB-CD1 3.74Å; C446-F474 HydrophobicContact CB-CE1 3.49Å; C446-F474 VanDerWaalsContact CB-CE1 3.49Å; C446-M497 HydrophobicContact CB-CE 3.55Å; C446-M497 HydrophobicContact CB-SD 4.11Å
447	T	88.3	Confident	84.5	Confident	4 Å²	4	49.6 Å²	49.6	3%	0.025	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-17.4	173.5	67.4	0	0	0	0	113.3	D445 P449 V450 T451 F474 A476 P478	D445-T447 VanDerWaalsContact CG-OG1 3.24Å; D445-T447 PolarHBondContact O-N 3.35Å; D445-T447 WeakPolarHBondContact OD1-CB 3.22Å; D445-T447 PolarHBondContact OD1-N 3.43Å; D445-T447 PolarHBondContact OD1-OG1 3.13Å; D445-T447 PolarHBondContact OD2-OG1 3.27Å; D445-T447 VanDerWaalsContact OD2-OG1 3.07Å; T447-P449 VanDerWaalsContact C-CD 3.49Å; T447-V450 PolarHBondContact O-N 2.82Å; T447-T451 PolarHBondContact O-N 3.39Å; T447-T451 VanDerWaalsContact O-N 3.09Å; T447-T451 PolarHBondContact O-OG1 3.15Å; T447-F474 HydrophobicContact CG2-CD1 4.13Å; T447-A476 VanDerWaalsContact CG2-O 3.26Å; T447-A476 WeakPolarHBondContact CG2-O 3.41Å; T447-P478 HydrophobicContact CG2-CG 4.2Å
448	L	91	Very high	85.1	Confident	29 Å²	29	49.7 Å²	49.7	15%	0.152	29%	0.29	C	S	.	.	H	α-helix	trans	-54.5	-42.6	-174.7	-66.4	170.7	0	0	0	114.5	F413 V418 D445 V450 T451 W452	F413-L448 HydrophobicContact CD2-CD1 4.33Å; V418-L448 HydrophobicContact CG2-CB 3.59Å; D445-L448 HydrophobicContact CB-CD1 3.92Å; D445-L448 HydrophobicContact CB-CG 3.82Å; D445-L448 WeakPolarHBondContact O-CB 3.25Å; D445-L448 WeakPolarHBondContact O-CD1 3.37Å; D445-L448 VanDerWaalsContact O-CG 3.28Å; D445-L448 WeakPolarHBondContact O-CG 3.18Å; D445-L448 PolarHBondContact O-N 3.22Å; L448-V450 VanDerWaalsContact C-N 3.27Å; L448-V450 PolarHBondContact O-N 3.47Å; L448-T451 PolarHBondContact O-N 3.32Å; L448-W452 VanDerWaalsContact O-CB 3.28Å; L448-W452 WeakPolarHBondContact O-CB 3.31Å; L448-W452 PolarHBondContact O-N 3.35Å
449	P	93.7	Very high	85.7	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-34.7	179.1	-25.7	37.3	0	0	0	113.5	A372 L411 F413 T447 A453 I465	A372-P449 HydrophobicContact CB-CB 3.62Å; A372-P449 HydrophobicContact CB-CG 3.37Å; L411-P449 HydrophobicContact CD1-CB 4.2Å; F413-P449 HydrophobicContact CD1-CG 3.9Å; F413-P449 HydrophobicContact CE1-CG 3.99Å; F413-P449 HydrophobicContact CG-CG 4.25Å; F413-P449 HydrophobicContact CZ-CG 4.39Å; T447-P449 VanDerWaalsContact C-CD 3.49Å; P449-A453 WeakPolarHBondContact O-CB 3.5Å; P449-A453 PolarHBondContact O-N 3.18Å; P449-A453 VanDerWaalsContact O-N 3.1Å; P449-I465 HydrophobicContact CB-CD1 4.48Å; P449-I465 HydrophobicContact CG-CD1 4.13Å
450	V	94.4	Very high	86.9	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.012	27%	0.268	C	S	.	.	H	α-helix	trans	-73.9	-43.6	179	-178.2	0	0	0	0	110.1	T447 L448 A453 T454 F463 H485	T447-V450 PolarHBondContact O-N 2.82Å; L448-V450 VanDerWaalsContact C-N 3.27Å; L448-V450 PolarHBondContact O-N 3.47Å; V450-A453 PolarHBondContact O-N 3.41Å; V450-T454 PolarHBondContact O-N 2.91Å; V450-T454 PolarHBondContact O-OG1 3.3Å; V450-F463 HydrophobicContact CG1-CZ 4.44Å; V450-F463 HydrophobicContact CG2-CD1 4.06Å; V450-F463 HydrophobicContact CG2-CD2 4.32Å; V450-F463 HydrophobicContact CG2-CE1 4.26Å; V450-F463 HydrophobicContact CG2-CG 4.1Å; V450-F463 HydrophobicContact CG2-CZ 4.47Å; V450-H485 HydrophobicContact CG1-CB 3.82Å
451	T	93.1	Very high	88.4	Confident	48 Å²	48	40.5 Å²	40.5	29%	0.294	25%	0.248	S	C	.	.	H	α-helix	trans	-60.8	-48.1	175.2	-56.2	0	0	0	0	110.9	T447 L448 A453 T454 E455	T447-T451 PolarHBondContact O-N 3.39Å; T447-T451 VanDerWaalsContact O-N 3.09Å; T447-T451 PolarHBondContact O-OG1 3.15Å; L448-T451 PolarHBondContact O-N 3.32Å; T451-A453 VanDerWaalsContact C-N 3.33Å; T451-A453 PolarHBondContact O-N 2.74Å; T451-T454 WeakPolarHBondContact O-CB 3.38Å; T451-T454 PolarHBondContact O-N 3.45Å; T451-T454 VanDerWaalsContact O-N 3.08Å; T451-E455 HydrophobicContact CG2-CG 4.33Å; T451-E455 WeakPolarHBondContact CG2-OE1 3.42Å; T451-E455 WeakPolarHBondContact O-CG 3.33Å; T451-E455 PolarHBondContact O-N 3.17Å
452	W	94.8	Very high	90	Very high	36 Å²	36	36.5 Å²	36.5	14%	0.136	22%	0.22	C	C	.	.	H	α-helix	trans	-55.1	-47	175.9	174.7	89.2	0	0	0	112	L411 V418 P420 L448 T454 E455 N456 K458	L411-W452 HydrophobicContact CD1-CD2 4.21Å; L411-W452 HydrophobicContact CD1-CE3 3.64Å; L411-W452 HydrophobicContact CD1-CZ3 3.91Å; L411-W452 HydrophobicContact CD2-CD2 4.5Å; L411-W452 HydrophobicContact CD2-CE3 4.26Å; L411-W452 HydrophobicContact CD2-CH2 3.95Å; L411-W452 HydrophobicContact CD2-CZ2 4.18Å; L411-W452 HydrophobicContact CD2-CZ3 4Å; V418-W452 HydrophobicContact CB-CB 4.26Å; V418-W452 HydrophobicContact CB-CG 4.17Å; V418-W452 HydrophobicContact CG1-CB 4.09Å; V418-W452 HydrophobicContact CG1-CD2 4.27Å; V418-W452 HydrophobicContact CG1-CG 3.82Å; V418-W452 HydrophobicContact CG2-CB 4.25Å; P420-W452 HydrophobicContact CG-CZ2 3.97Å; L448-W452 VanDerWaalsContact O-CB 3.28Å; L448-W452 WeakPolarHBondContact O-CB 3.31Å; L448-W452 PolarHBondContact O-N 3.35Å; W452-T454 VanDerWaalsContact C-N 3.3Å; W452-T454 PolarHBondContact O-N 3.02Å; W452-E455 PolarHBondContact O-N 2.86Å; W452-N456 PolarHBondContact NE1-ND2 3.49Å; W452-N456 WeakPolarHBondContact O-CB 3.29Å; W452-N456 PolarHBondContact O-N 3.14Å; W452-N456 PolarHBondContact O-ND2 3.3Å; W452-K458 HydrophobicContact CH2-CG 4.25Å; W452-K458 HydrophobicContact CZ3-CG 4.08Å
453	A	95.5	Very high	91.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-37.8	178.8	0	0	0	0	0	111.9	P449 V450 T451 G457 K458 V460 F463	P449-A453 WeakPolarHBondContact O-CB 3.5Å; P449-A453 PolarHBondContact O-N 3.18Å; P449-A453 VanDerWaalsContact O-N 3.1Å; V450-A453 PolarHBondContact O-N 3.41Å; T451-A453 VanDerWaalsContact C-N 3.33Å; T451-A453 PolarHBondContact O-N 2.74Å; A453-G457 PolarHBondContact O-N 2.67Å; A453-K458 HydrophobicContact CB-CB 4.14Å; A453-K458 PolarHBondContact O-N 3.13Å; A453-V460 HydrophobicContact CB-CG2 4.13Å; A453-F463 HydrophobicContact CB-CE1 3.64Å; A453-F463 HydrophobicContact CB-CZ 3.72Å
454	T	94.3	Very high	92.6	Very high	40 Å²	40	31 Å²	31	25%	0.245	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-50.3	177.5	-53	0	0	0	0	111.6	V450 T451 W452 N456 G457 H485 A488	V450-T454 PolarHBondContact O-N 2.91Å; V450-T454 PolarHBondContact O-OG1 3.3Å; T451-T454 WeakPolarHBondContact O-CB 3.38Å; T451-T454 PolarHBondContact O-N 3.45Å; T451-T454 VanDerWaalsContact O-N 3.08Å; W452-T454 VanDerWaalsContact C-N 3.3Å; W452-T454 PolarHBondContact O-N 3.02Å; T454-N456 VanDerWaalsContact C-N 3.28Å; T454-N456 PolarHBondContact O-N 2.8Å; T454-G457 PolarHBondContact O-N 3.39Å; T454-G457 VanDerWaalsContact O-N 3.13Å; T454-H485 WeakPolarHBondContact OG1-CB 3.44Å; T454-H485 PolarHBondContact OG1-ND1 2.76Å; T454-A488 HydrophobicContact CG2-CB 3.83Å
455	E	93.9	Very high	93.5	Very high	149 Å²	149	30.3 Å²	30.3	70%	0.696	17%	0.173	S	C	*	.	H	α-helix	trans	-64.1	-33.6	-179.5	-69.9	174.3	170.9	0	0	112.4	T451 W452 G457	T451-E455 HydrophobicContact CG2-CG 4.33Å; T451-E455 WeakPolarHBondContact CG2-OE1 3.42Å; T451-E455 WeakPolarHBondContact O-CG 3.33Å; T451-E455 PolarHBondContact O-N 3.17Å; W452-E455 PolarHBondContact O-N 2.86Å; E455-G457 VanDerWaalsContact C-N 3.3Å; E455-G457 PolarHBondContact O-N 3.15Å
456	N	94.3	Very high	93.9	Very high	88 Å²	88	29.8 Å²	29.8	47%	0.471	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	8.1	178.3	-72.4	-90.8	0	0	0	113.5	W452 T454 K458	W452-N456 PolarHBondContact NE1-ND2 3.49Å; W452-N456 WeakPolarHBondContact O-CB 3.29Å; W452-N456 PolarHBondContact O-N 3.14Å; W452-N456 PolarHBondContact O-ND2 3.3Å; T454-N456 VanDerWaalsContact C-N 3.28Å; T454-N456 PolarHBondContact O-N 2.8Å; N456-K458 HydrophobicContact CB-CG 4.02Å; N456-K458 PolarHBondContact O-N 3.47Å
457	G	93.9	Very high	94.1	Very high	63 Å²	63	29.7 Å²	29.7	65%	0.649	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	29.2	179	0	0	0	0	0	113.8	A453 T454 E455	A453-G457 PolarHBondContact O-N 2.67Å; T454-G457 PolarHBondContact O-N 3.39Å; T454-G457 VanDerWaalsContact O-N 3.13Å; E455-G457 VanDerWaalsContact C-N 3.3Å; E455-G457 PolarHBondContact O-N 3.15Å
458	K	95.3	Very high	93.8	Very high	78 Å²	78	29.9 Å²	29.9	34%	0.339	17%	0.17	S	C	.	.			trans	-79.8	124.4	179.6	-60.4	-58.3	-172.5	-178.4	0	109.4	W452 A453 N456 V460 H485	W452-K458 HydrophobicContact CH2-CG 4.25Å; W452-K458 HydrophobicContact CZ3-CG 4.08Å; A453-K458 HydrophobicContact CB-CB 4.14Å; A453-K458 PolarHBondContact O-N 3.13Å; N456-K458 HydrophobicContact CB-CG 4.02Å; N456-K458 PolarHBondContact O-N 3.47Å; K458-V460 HydrophobicContact CB-CG2 4.08Å; K458-V460 PolarHBondContact O-N 3.03Å; K458-H485 PolarHBondContact O-CE1 3.37Å
459	S	94.8	Very high	93.1	Very high	50 Å²	50	29.3 Å²	29.3	35%	0.35	17%	0.168	S	C	.	.			trans	-84.3	112.9	171.3	-55.6	0	0	0	0	110	R368	R368-S459 WeakPolarHBondContact CD-O 3.4Å; R368-S459 PolarHBondContact NE-O 3.46Å
460	V	96.8	Very high	91.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	19%	0.186	C	C	.	.			trans	-123.8	131.5	-173.2	-179.4	0	0	0	0	109.6	V370 A453 K458 M462 F463 T491 S493	V370-V460 HydrophobicContact CB-CG1 4.09Å; V370-V460 HydrophobicContact CG2-CB 4.31Å; V370-V460 HydrophobicContact CG2-CG1 3.7Å; V370-V460 HydrophobicContact CG2-CG2 3.58Å; A453-V460 HydrophobicContact CB-CG2 4.13Å; K458-V460 HydrophobicContact CB-CG2 4.08Å; K458-V460 PolarHBondContact O-N 3.03Å; V460-M462 WeakPolarHBondContact CG1-O 3.41Å; V460-F463 HydrophobicContact CB-CE1 4.12Å; V460-F463 HydrophobicContact CB-CE2 3.76Å; V460-F463 HydrophobicContact CB-CZ 3.53Å; V460-F463 HydrophobicContact CG1-CD1 4.09Å; V460-F463 HydrophobicContact CG1-CD2 3.91Å; V460-F463 HydrophobicContact CG1-CE1 3.85Å; V460-F463 HydrophobicContact CG1-CE2 3.66Å; V460-F463 HydrophobicContact CG1-CG 4.12Å; V460-F463 HydrophobicContact CG1-CZ 3.63Å; V460-F463 HydrophobicContact CG2-CE1 4.13Å; V460-F463 HydrophobicContact CG2-CZ 3.85Å; V460-T491 PolarHBondContact O-OG1 2.93Å; V460-S493 WeakPolarHBondContact O-CB 3.39Å; V460-S493 PolarHBondContact O-OG 3.46Å
461	D	96.8	Very high	90.4	Very high	32 Å²	32	38.6 Å²	38.6	17%	0.171	22%	0.22	C	C	.	.	S	Bend	trans	-89	-31.6	178.4	-57.9	-53.4	0	0	0	111.6	K367 R368 S493 K494	K367-D461 HydrophobicContact CB-CB 4.02Å; K367-D461 HydrophobicContact CD-CB 4.21Å; R368-D461 WeakPolarHBondContact CB-OD2 3.4Å; R368-D461 WeakPolarHBondContact CG-OD2 3.47Å; R368-D461 IonicContact CZ-OD1 2.7Å; R368-D461 IonicContact CZ-OD2 2.78Å; R368-D461 PolarHBondContact N-OD2 2.69Å; R368-D461 IonicContact NE-OD1 3.41Å; R368-D461 IonicContact NE-OD2 3.85Å; R368-D461 PolarHBondContact NE-OD2 3.47Å; R368-D461 IonicContact NH2-OD1 2.75Å; R368-D461 PolarHBondContact NH2-OD1 3.42Å; R368-D461 IonicContact NH2-OD2 2.97Å; R368-D461 PolarHBondContact O-N 2.9Å; D461-S493 WeakPolarHBondContact O-CA 3.46Å; D461-K494 PolarHBondContact O-N 3.46Å
462	M	97	Very high	89.3	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	128	-174.7	-161.1	-52.8	-54.5	0	0	110.7	R368 F369 V370 V460 I464 K494 V496	R368-M462 PolarHBondContact O-N 3.08Å; R368-M462 VanDerWaalsContact O-N 3.16Å; F369-M462 WeakPolarHBondContact CA-O 3.3Å; F369-M462 HydrophobicContact CD1-CB 4.15Å; F369-M462 HydrophobicContact CD1-CE 3.14Å; F369-M462 HydrophobicContact CD1-CG 4.44Å; F369-M462 HydrophobicContact CE1-CB 4.03Å; F369-M462 HydrophobicContact CE1-CE 3.5Å; F369-M462 VanDerWaalsContact CE1-CE 3.5Å; F369-M462 HydrophobicContact CE1-CG 4.08Å; F369-M462 HydrophobicContact CG-CE 4.2Å; V370-M462 PolarHBondContact N-O 3Å; V460-M462 WeakPolarHBondContact CG1-O 3.41Å; M462-I464 HydrophobicContact CE-CB 3.85Å; M462-I464 HydrophobicContact CE-CD1 3.16Å; M462-I464 HydrophobicContact CE-CG1 3.14Å; M462-I464 HydrophobicContact SD-CD1 4.33Å; M462-I464 HydrophobicContact SD-CG1 3.78Å; M462-K494 CarbonylContact C-O 3.53Å; M462-K494 WeakPolarHBondContact CA-O 3.48Å; M462-V496 HydrophobicContact SD-CB 4.45Å; M462-V496 HydrophobicContact SD-CG2 3.97Å
463	F	97.4	Very high	88	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.3	170.3	-65.1	-89.6	0	0	0	111	V370 V450 A453 V460 L482 H485 K494 L495 V496	V370-F463 HydrophobicContact CB-CD1 3.69Å; V370-F463 HydrophobicContact CB-CE1 4.04Å; V370-F463 HydrophobicContact CG1-CD1 3.9Å; V370-F463 HydrophobicContact CG1-CE1 4.28Å; V370-F463 HydrophobicContact CG2-CD1 4.24Å; V370-F463 HydrophobicContact CG2-CE1 4.07Å; V370-F463 CarbonylContact O-C 3.58Å; V370-F463 WeakPolarHBondContact O-CA 3.4Å; V450-F463 HydrophobicContact CG1-CZ 4.44Å; V450-F463 HydrophobicContact CG2-CD1 4.06Å; V450-F463 HydrophobicContact CG2-CD2 4.32Å; V450-F463 HydrophobicContact CG2-CE1 4.26Å; V450-F463 HydrophobicContact CG2-CG 4.1Å; V450-F463 HydrophobicContact CG2-CZ 4.47Å; A453-F463 HydrophobicContact CB-CE1 3.64Å; A453-F463 HydrophobicContact CB-CZ 3.72Å; V460-F463 HydrophobicContact CB-CE1 4.12Å; V460-F463 HydrophobicContact CB-CE2 3.76Å; V460-F463 HydrophobicContact CB-CZ 3.53Å; V460-F463 HydrophobicContact CG1-CD1 4.09Å; V460-F463 HydrophobicContact CG1-CD2 3.91Å; V460-F463 HydrophobicContact CG1-CE1 3.85Å; V460-F463 HydrophobicContact CG1-CE2 3.66Å; V460-F463 HydrophobicContact CG1-CG 4.12Å; V460-F463 HydrophobicContact CG1-CZ 3.63Å; V460-F463 HydrophobicContact CG2-CE1 4.13Å; V460-F463 HydrophobicContact CG2-CZ 3.85Å; F463-L482 HydrophobicContact CD2-CD1 4.06Å; F463-L482 HydrophobicContact CE2-CD1 4.18Å; F463-H485 AromaticContact CE2-CD2 3.76Å; F463-H485 AromaticContact CE2-NE2 3.84Å; F463-H485 AromaticContact CZ-CD2 3.95Å; F463-H485 AromaticContact CZ-CE1 3.9Å; F463-H485 AromaticContact CZ-NE2 3.69Å; F463-K494 PolarHBondContact N-O 3.43Å; F463-L495 HydrophobicContact CB-CD1 3.63Å; F463-L495 CarbonylContact O-C 3.51Å; F463-L495 WeakPolarHBondContact O-CA 3.49Å; F463-V496 PolarHBondContact O-N 2.82Å
464	I	96.4	Very high	87	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	121.4	168.9	-77.9	143.1	0	0	0	106.7	F369 V370 V371 A372 F401 M462 L466 V496 I529	F369-I464 HydrophobicContact CD1-CD1 4.05Å; F369-I464 HydrophobicContact CE1-CD1 4.39Å; V370-I464 PolarHBondContact O-N 3.4Å; V371-I464 CarbonylContact C-O 3.59Å; V371-I464 WeakPolarHBondContact CA-O 3.3Å; V371-I464 HydrophobicContact CG1-CG2 4.24Å; V371-I464 HydrophobicContact CG2-CB 4.42Å; V371-I464 HydrophobicContact CG2-CD1 4.15Å; A372-I464 PolarHBondContact N-O 3.1Å; F401-I464 HydrophobicContact CD1-CD1 4.11Å; F401-I464 HydrophobicContact CD2-CD1 3.74Å; F401-I464 HydrophobicContact CE1-CD1 3.84Å; F401-I464 HydrophobicContact CE2-CD1 3.45Å; F401-I464 VanDerWaalsContact CE2-CD1 3.45Å; F401-I464 HydrophobicContact CG-CD1 4.08Å; F401-I464 HydrophobicContact CZ-CD1 3.51Å; M462-I464 HydrophobicContact CE-CB 3.85Å; M462-I464 HydrophobicContact CE-CD1 3.16Å; M462-I464 HydrophobicContact CE-CG1 3.14Å; M462-I464 HydrophobicContact SD-CD1 4.33Å; M462-I464 HydrophobicContact SD-CG1 3.78Å; I464-L466 HydrophobicContact CG2-CD2 3.35Å; I464-L466 HydrophobicContact CG2-CG 3.94Å; I464-V496 WeakPolarHBondContact CA-O 3.42Å; I464-V496 HydrophobicContact CG1-CB 4.47Å; I464-I529 HydrophobicContact CD1-CD1 4.37Å; I464-I529 HydrophobicContact CD1-CG2 4.03Å; I464-I529 HydrophobicContact CG1-CD1 4.25Å; I464-I529 HydrophobicContact CG1-CG2 4.3Å
465	I	93.9	Very high	86	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	115.1	175.7	-55.8	-168.5	0	0	0	108.1	A372 F413 C446 P449 L495 V496 M497 C498	A372-I465 HydrophobicContact CB-CG1 4.47Å; A372-I465 CarbonylContact O-C 3.59Å; A372-I465 WeakPolarHBondContact O-CA 3.39Å; F413-I465 HydrophobicContact CE1-CG2 3.96Å; F413-I465 HydrophobicContact CZ-CG2 3.68Å; C446-I465 HydrophobicContact CB-CG2 4.44Å; C446-I465 WeakPolarHBondContact O-CD1 3.18Å; P449-I465 HydrophobicContact CB-CD1 4.48Å; P449-I465 HydrophobicContact CG-CD1 4.13Å; I465-L495 HydrophobicContact CD1-CD1 3.62Å; I465-L495 HydrophobicContact CG1-CD1 3.79Å; I465-V496 PolarHBondContact N-O 3.35Å; I465-M497 HydrophobicContact CB-CE 4.25Å; I465-M497 HydrophobicContact CB-SD 3.47Å; I465-M497 WeakPolarHBondContact CB-SD 3.41Å; I465-M497 HydrophobicContact CD1-SD 3.7Å; I465-M497 HydrophobicContact CG1-SD 3.95Å; I465-M497 HydrophobicContact CG2-CE 3.89Å; I465-M497 HydrophobicContact CG2-SD 3.72Å; I465-C498 WeakPolarHBondContact O-CB 3.44Å; I465-C498 PolarHBondContact O-N 3.37Å
466	L	92.7	Very high	85.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.1	178.8	-53	-173.9	0	0	0	108.7	V371 A372 V373 D374 A394 I397 I464 C498	V371-L466 HydrophobicContact CG1-CD1 4.14Å; V371-L466 HydrophobicContact CG1-CG 4.37Å; A372-L466 PolarHBondContact O-N 3.35Å; V373-L466 HydrophobicContact CG2-CD1 4.22Å; D374-L466 VanDerWaalsContact CB-O 3.29Å; D374-L466 WeakPolarHBondContact CB-O 3.49Å; D374-L466 PolarHBondContact N-O 2.87Å; A394-L466 HydrophobicContact CB-CD1 4.07Å; I397-L466 HydrophobicContact CB-CD1 3.95Å; I397-L466 HydrophobicContact CD1-CD1 4.33Å; I397-L466 HydrophobicContact CD1-CD2 4.35Å; I397-L466 HydrophobicContact CG2-CD1 3.92Å; I397-L466 HydrophobicContact CG2-CD2 4.11Å; I464-L466 HydrophobicContact CG2-CD2 3.35Å; I464-L466 HydrophobicContact CG2-CG 3.94Å; L466-C498 HydrophobicContact CD2-CB 3.51Å
467	T	88.1	Confident	84.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	143.7	178.8	179.3	0	0	0	0	112.1	D374 N469 M497 C498 G499 L500	D374-T467 WeakPolarHBondContact OD2-CB 3.47Å; D374-T467 PolarHBondContact OD2-OG1 2.7Å; T467-N469 WeakPolarHBondContact OG1-CB 3.43Å; T467-N469 PolarHBondContact OG1-N 2.89Å; T467-M497 HydrophobicContact CG2-CE 4.11Å; T467-C498 PolarHBondContact N-O 2.94Å; T467-G499 CarbonylContact O-C 3.58Å; T467-G499 VanDerWaalsContact O-CA 3.31Å; T467-G499 WeakPolarHBondContact O-CA 2.99Å; T467-L500 PolarHBondContact O-N 2.67Å
468	N	82.2	Confident	84.4	Confident	8 Å²	8	34.9 Å²	34.9	4%	0.043	20%	0.202	C	C	.	.			trans	-100.9	-0.2	169	58.3	-29.8	0	0	0	112.2	T377 S378 L379 T390 P470 T501	T377-N468 PolarHBondContact O-ND2 2.92Å; T377-N468 PolarHBondContact OG1-ND2 3.45Å; T377-N468 PolarHBondContact OG1-OD1 3.12Å; S378-N468 PolarHBondContact O-ND2 2.75Å; L379-N468 WeakPolarHBondContact CA-ND2 3.38Å; L379-N468 HydrophobicContact CD2-CB 3.96Å; L379-N468 VanDerWaalsContact CD2-CG 3.49Å; L379-N468 PolarHBondContact N-ND2 2.83Å; T390-N468 HydrophobicContact CG2-CB 4.18Å; N468-P470 WeakPolarHBondContact O-CD 3.21Å; N468-T501 WeakPolarHBondContact CA-OG1 3.31Å; N468-T501 HydrophobicContact CB-CG2 4.1Å; N468-T501 PolarHBondContact O-OG1 3.26Å
469	N	75.5	Confident	84.1	Confident	17 Å²	17	32.4 Å²	32.4	9%	0.091	19%	0.192	C	C	.	.			trans	-76.7	117.5	172.8	-175.5	-9.2	0	0	0	109	T377 T467 L471 W472 T473	T377-N469 HydrophobicContact CG2-CB 4.09Å; T467-N469 WeakPolarHBondContact OG1-CB 3.43Å; T467-N469 PolarHBondContact OG1-N 2.89Å; N469-L471 VanDerWaalsContact C-N 3.25Å; N469-L471 PolarHBondContact O-N 3.4Å; N469-L471 PolarHBondContact OD1-N 2.87Å; N469-W472 PolarHBondContact O-NE1 3.12Å; N469-T473 PolarHBondContact ND2-OG1 2.83Å
470	P	64.6	Low	83.8	Confident	60 Å²	60	33.9 Å²	33.9	39%	0.39	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-20	-178.6	28.6	-34.3	0	0	0	113.3	N468 H505	N468-P470 WeakPolarHBondContact O-CD 3.21Å; P470-H505 PolarHBondContact O-CD2 2.87Å
471	L	66.8	Low	83.6	Confident	137 Å²	137	34.3 Å²	34.3	72%	0.717	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-9.2	-172.3	-64.7	176.5	0	0	0	114.4	N469	N469-L471 VanDerWaalsContact C-N 3.25Å; N469-L471 PolarHBondContact O-N 3.4Å; N469-L471 PolarHBondContact OD1-N 2.87Å
472	W	71.1	Confident	83.3	Confident	8 Å²	8	32.8 Å²	32.8	3%	0.03	19%	0.191	C	C	.	.			trans	42.4	82.3	-176.8	-57.2	-16	0	0	0	112.5	N469 F474 M497 H505 A506 I507	N469-W472 PolarHBondContact O-NE1 3.12Å; W472-F474 HydrophobicContact CB-CD2 4.47Å; W472-F474 HydrophobicContact CB-CE1 4.29Å; W472-F474 HydrophobicContact CB-CE2 3.56Å; W472-F474 HydrophobicContact CB-CZ 3.47Å; W472-F474 VanDerWaalsContact CB-CZ 3.47Å; W472-F474 HydrophobicContact CE3-CZ 4.42Å; W472-F474 HydrophobicContact CG-CZ 4.37Å; W472-F474 WeakPolarHBondContact O-CD2 3.35Å; W472-F474 WeakPolarHBondContact O-CE2 3.37Å; W472-F474 PolarHBondContact O-N 3.31Å; W472-M497 HydrophobicContact CD2-CE 4.5Å; W472-M497 HydrophobicContact CG-CE 4.32Å; W472-M497 HydrophobicContact CH2-CB 4.37Å; W472-M497 HydrophobicContact CZ3-CB 4.43Å; W472-H505 HydrophobicContact CE3-CB 4.38Å; W472-H505 HydrophobicContact CH2-CB 4.26Å; W472-H505 WeakPolarHBondContact CH2-O 3.46Å; W472-H505 HydrophobicContact CZ2-CB 4.4Å; W472-H505 HydrophobicContact CZ3-CB 4.24Å; W472-H505 WeakPolarHBondContact CZ3-O 3.35Å; W472-A506 VanDerWaalsContact CZ3-C 3.44Å; W472-I507 HydrophobicContact CE3-CG1 3.96Å; W472-I507 HydrophobicContact CH2-CG1 4.47Å; W472-I507 HydrophobicContact CZ3-CB 4.32Å; W472-I507 HydrophobicContact CZ3-CG1 3.59Å
473	T	67.5	Low	83.1	Confident	53 Å²	53	37.9 Å²	37.9	33%	0.325	21%	0.213	S	C	.	.			trans	-73.8	130	-177.6	43	0	0	0	0	110.5	T444 D445 C446 N469	T444-T473 VanDerWaalsContact C-OG1 3.3Å; T444-T473 WeakPolarHBondContact CB-OG1 3.47Å; T444-T473 WeakPolarHBondContact O-CB 3.48Å; T444-T473 PolarHBondContact O-OG1 3.26Å; D445-T473 WeakPolarHBondContact CA-O 3.35Å; C446-T473 PolarHBondContact N-O 3.31Å; N469-T473 PolarHBondContact ND2-OG1 2.83Å
474	F	74.7	Confident	82.9	Confident	66 Å²	66	44.6 Å²	44.6	29%	0.289	24%	0.242	S	C	.	.			trans	-133	130.4	-178.9	-52.8	-68.5	0	0	0	109.6	C446 T447 W472 A476 P478 M497 I507	C446-F474 HydrophobicContact CB-CD1 3.74Å; C446-F474 HydrophobicContact CB-CE1 3.49Å; C446-F474 VanDerWaalsContact CB-CE1 3.49Å; T447-F474 HydrophobicContact CG2-CD1 4.13Å; W472-F474 HydrophobicContact CB-CD2 4.47Å; W472-F474 HydrophobicContact CB-CE1 4.29Å; W472-F474 HydrophobicContact CB-CE2 3.56Å; W472-F474 HydrophobicContact CB-CZ 3.47Å; W472-F474 VanDerWaalsContact CB-CZ 3.47Å; W472-F474 HydrophobicContact CE3-CZ 4.42Å; W472-F474 HydrophobicContact CG-CZ 4.37Å; W472-F474 WeakPolarHBondContact O-CD2 3.35Å; W472-F474 WeakPolarHBondContact O-CE2 3.37Å; W472-F474 PolarHBondContact O-N 3.31Å; F474-A476 WeakPolarHBondContact CB-O 3.26Å; F474-P478 HydrophobicContact CD1-CG 3.35Å; F474-P478 HydrophobicContact CD2-CG 4.17Å; F474-P478 HydrophobicContact CE1-CB 4.34Å; F474-P478 HydrophobicContact CE1-CG 3.28Å; F474-P478 HydrophobicContact CE2-CG 4.14Å; F474-P478 HydrophobicContact CG-CG 3.8Å; F474-P478 HydrophobicContact CZ-CG 3.71Å; F474-M497 HydrophobicContact CE1-CE 4.26Å; F474-M497 HydrophobicContact CZ-CE 4.44Å; F474-I507 HydrophobicContact CZ-CG2 4.18Å
475	T	73.1	Confident	82.8	Confident	119 Å²	119	44.6 Å²	44.6	73%	0.73	24%	0.243	S	C	*	.	S	Bend	trans	-88	-22.8	170.9	68.8	0	0	0	0	112.2	D445	D445-T475 HydrophobicContact CB-CG2 4.04Å; D445-T475 PolarHBondContact OD1-N 3.45Å; D445-T475 WeakPolarHBondContact OD2-CB 3.28Å; D445-T475 VanDerWaalsContact OD2-CG2 3.24Å; D445-T475 WeakPolarHBondContact OD2-CG2 3.46Å; D445-T475 PolarHBondContact OD2-OG1 3.23Å
476	A	77.1	Confident	82.9	Confident	41 Å²	41	45.7 Å²	45.7	34%	0.339	25%	0.247	S	C	.	.	S	Bend	trans	-134.2	162.1	175.4	0	0	0	0	0	110.1	T447 F474 P478	T447-A476 VanDerWaalsContact CG2-O 3.26Å; T447-A476 WeakPolarHBondContact CG2-O 3.41Å; F474-A476 WeakPolarHBondContact CB-O 3.26Å; A476-P478 WeakPolarHBondContact O-CD 3.06Å
477	S	85.3	Confident	82.9	Confident	48 Å²	48	54 Å²	54	34%	0.336	29%	0.285	S	S	.	.			trans	-59.2	126	173.1	169.4	0	0	0	0	110.5	L479 D480 S481	S477-L479 PolarHBondContact O-N 3.09Å; S477-L479 PolarHBondContact OG-N 3.31Å; S477-D480 WeakPolarHBondContact CB-OD2 2.96Å; S477-D480 PolarHBondContact O-N 3.07Å; S477-D480 PolarHBondContact OG-N 2.83Å; S477-S481 PolarHBondContact O-N 2.79Å; S477-S481 PolarHBondContact O-OG 2.85Å
478	P	86	Confident	83.2	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.071	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-36.4	174.3	-27.8	37.7	0	0	0	112.5	T447 F474 A476 S481 L482 L495 I507	T447-P478 HydrophobicContact CG2-CG 4.2Å; F474-P478 HydrophobicContact CD1-CG 3.35Å; F474-P478 HydrophobicContact CD2-CG 4.17Å; F474-P478 HydrophobicContact CE1-CB 4.34Å; F474-P478 HydrophobicContact CE1-CG 3.28Å; F474-P478 HydrophobicContact CE2-CG 4.14Å; F474-P478 HydrophobicContact CG-CG 3.8Å; F474-P478 HydrophobicContact CZ-CG 3.71Å; A476-P478 WeakPolarHBondContact O-CD 3.06Å; P478-S481 PolarHBondContact O-N 2.86Å; P478-L482 WeakPolarHBondContact O-CB 3.35Å; P478-L482 PolarHBondContact O-N 3.02Å; P478-L495 HydrophobicContact CB-CD2 4.06Å; P478-I507 HydrophobicContact CB-CG2 3.82Å; P478-I507 HydrophobicContact CG-CG2 3.79Å
479	L	87.9	Confident	83.7	Confident	26 Å²	26	58.3 Å²	58.3	14%	0.136	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-46.6	176.4	178.5	60.6	0	0	0	111.2	S477 S481 L482 K483 T510 D512 L515	S477-L479 PolarHBondContact O-N 3.09Å; S477-L479 PolarHBondContact OG-N 3.31Å; L479-S481 VanDerWaalsContact C-N 3.31Å; L479-S481 PolarHBondContact O-N 3.48Å; L479-L482 PolarHBondContact O-N 3.17Å; L479-K483 HydrophobicContact CD1-CD 4.42Å; L479-K483 HydrophobicContact CD1-CG 4.36Å; L479-K483 HydrophobicContact CG-CD 4.28Å; L479-K483 WeakPolarHBondContact O-CB 3.29Å; L479-K483 WeakPolarHBondContact O-CG 3.43Å; L479-K483 PolarHBondContact O-N 2.85Å; L479-T510 HydrophobicContact CD2-CG2 4.18Å; L479-D512 HydrophobicContact CD1-CB 3.52Å; L479-D512 WeakPolarHBondContact CD1-OD2 3.41Å; L479-L515 HydrophobicContact CB-CD2 4.09Å; L479-L515 HydrophobicContact CD1-CD1 3.71Å; L479-L515 HydrophobicContact CD1-CD2 4.23Å
480	D	89.7	Confident	84.4	Confident	82 Å²	82	60.9 Å²	60.9	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-66.8	-37.7	-179.8	-64.9	-23.1	0	0	0	111.3	S477 L482 K483 K484	S477-D480 WeakPolarHBondContact CB-OD2 2.96Å; S477-D480 PolarHBondContact O-N 3.07Å; S477-D480 PolarHBondContact OG-N 2.83Å; D480-L482 VanDerWaalsContact C-N 3.35Å; D480-K483 PolarHBondContact O-N 2.92Å; D480-K484 WeakPolarHBondContact O-CB 3.44Å; D480-K484 VanDerWaalsContact O-CG 3.27Å; D480-K484 WeakPolarHBondContact O-CG 3.34Å; D480-K484 PolarHBondContact O-N 2.91Å
481	S	91	Very high	85.6	Confident	9 Å²	9	58.8 Å²	58.8	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-62.6	-43.1	175.3	-55.5	0	0	0	0	111.1	S477 P478 L479 K484 H485	S477-S481 PolarHBondContact O-N 2.79Å; S477-S481 PolarHBondContact O-OG 2.85Å; P478-S481 PolarHBondContact O-N 2.86Å; L479-S481 VanDerWaalsContact C-N 3.31Å; L479-S481 PolarHBondContact O-N 3.48Å; S481-K484 PolarHBondContact O-N 3.23Å; S481-H485 PolarHBondContact O-N 3.25Å
482	L	92.3	Very high	86.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-68	-41.6	176.3	-169.2	66.3	0	0	0	112.2	F463 P478 L479 D480 K484 H485 R486 L495 L515	F463-L482 HydrophobicContact CD2-CD1 4.06Å; F463-L482 HydrophobicContact CE2-CD1 4.18Å; P478-L482 WeakPolarHBondContact O-CB 3.35Å; P478-L482 PolarHBondContact O-N 3.02Å; L479-L482 PolarHBondContact O-N 3.17Å; D480-L482 VanDerWaalsContact C-N 3.35Å; L482-K484 PolarHBondContact O-N 3.48Å; L482-H485 WeakPolarHBondContact O-CB 3.36Å; L482-H485 PolarHBondContact O-N 3.14Å; L482-R486 VanDerWaalsContact O-CG 3.3Å; L482-R486 WeakPolarHBondContact O-CG 3.41Å; L482-R486 PolarHBondContact O-N 2.94Å; L482-L495 HydrophobicContact CD1-CB 4.33Å; L482-L495 HydrophobicContact CD2-CB 3.86Å; L482-L515 HydrophobicContact CD2-CD1 3.41Å; L482-L515 VanDerWaalsContact CD2-CD1 3.41Å; L482-L515 HydrophobicContact CD2-CG 4.29Å
483	K	92.5	Very high	88	Confident	109 Å²	109	56.8 Å²	56.8	47%	0.474	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-43.7	174.9	-75.8	179.4	177.5	-178.8	0	111.8	L479 D480 H485 R486 H487	L479-K483 HydrophobicContact CD1-CD 4.42Å; L479-K483 HydrophobicContact CD1-CG 4.36Å; L479-K483 HydrophobicContact CG-CD 4.28Å; L479-K483 WeakPolarHBondContact O-CB 3.29Å; L479-K483 WeakPolarHBondContact O-CG 3.43Å; L479-K483 PolarHBondContact O-N 2.85Å; D480-K483 PolarHBondContact O-N 2.92Å; K483-H485 VanDerWaalsContact C-N 3.33Å; K483-H485 PolarHBondContact O-N 3.32Å; K483-R486 PolarHBondContact O-N 2.91Å; K483-H487 PolarHBondContact O-N 2.92Å
484	K	93	Very high	89.3	Confident	142 Å²	142	54.8 Å²	54.8	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-58.9	-44.8	173.6	-75.4	172.7	-177.1	176.8	0	111.4	D480 S481 L482 H487 A488	D480-K484 WeakPolarHBondContact O-CB 3.44Å; D480-K484 VanDerWaalsContact O-CG 3.27Å; D480-K484 WeakPolarHBondContact O-CG 3.34Å; D480-K484 PolarHBondContact O-N 2.91Å; S481-K484 PolarHBondContact O-N 3.23Å; L482-K484 PolarHBondContact O-N 3.48Å; K484-H487 PolarHBondContact O-N 3.01Å; K484-A488 WeakPolarHBondContact O-CB 3.32Å; K484-A488 PolarHBondContact O-N 3.19Å
485	H	94.6	Very high	90.2	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-52.8	176.2	-174.6	74.9	0	0	0	111.4	V450 T454 K458 F463 S481 L482 K483 H487 A488 S489 S493	V450-H485 HydrophobicContact CG1-CB 3.82Å; T454-H485 WeakPolarHBondContact OG1-CB 3.44Å; T454-H485 PolarHBondContact OG1-ND1 2.76Å; K458-H485 PolarHBondContact O-CE1 3.37Å; F463-H485 AromaticContact CE2-CD2 3.76Å; F463-H485 AromaticContact CE2-NE2 3.84Å; F463-H485 AromaticContact CZ-CD2 3.95Å; F463-H485 AromaticContact CZ-CE1 3.9Å; F463-H485 AromaticContact CZ-NE2 3.69Å; S481-H485 PolarHBondContact O-N 3.25Å; L482-H485 WeakPolarHBondContact O-CB 3.36Å; L482-H485 PolarHBondContact O-N 3.14Å; K483-H485 VanDerWaalsContact C-N 3.33Å; K483-H485 PolarHBondContact O-N 3.32Å; H485-H487 VanDerWaalsContact C-N 3.27Å; H485-H487 PolarHBondContact O-N 2.87Å; H485-A488 PolarHBondContact O-N 2.85Å; H485-S489 WeakPolarHBondContact O-CB 3.27Å; H485-S489 PolarHBondContact O-N 3.37Å; H485-S489 PolarHBondContact O-OG 3.21Å; H485-S493 PolarHBondContact CD2-OG 3.02Å; H485-S493 VanDerWaalsContact CD2-OG 3.22Å
486	R	95.3	Very high	91.2	Very high	23 Å²	23	46 Å²	46	9%	0.087	27%	0.266	C	S	.	.	H	α-helix	trans	-53.8	-43.4	178.5	-67.4	171.3	-178.9	160.7	-2.3	112.1	L482 K483 G490 T491 S493 D512	L482-R486 VanDerWaalsContact O-CG 3.3Å; L482-R486 WeakPolarHBondContact O-CG 3.41Å; L482-R486 PolarHBondContact O-N 2.94Å; K483-R486 PolarHBondContact O-N 2.91Å; R486-G490 VanDerWaalsContact O-CA 3.3Å; R486-G490 WeakPolarHBondContact O-CA 3.49Å; R486-G490 PolarHBondContact O-N 3.01Å; R486-T491 WeakPolarHBondContact CG-O 3.44Å; R486-S493 VanDerWaalsContact CZ-O 3.31Å; R486-S493 PolarHBondContact NE-O 3.27Å; R486-S493 PolarHBondContact NH2-O 3.41Å; R486-D512 IonicContact CZ-OD1 3.63Å; R486-D512 IonicContact CZ-OD2 3.96Å; R486-D512 IonicContact NH1-OD1 3Å; R486-D512 PolarHBondContact NH1-OD1 2.9Å; R486-D512 IonicContact NH1-OD2 3.93Å; R486-D512 PolarHBondContact NH1-OD2 3.12Å; R486-D512 IonicContact NH2-OD1 2.78Å; R486-D512 PolarHBondContact NH2-OD1 3.06Å; R486-D512 IonicContact NH2-OD2 3.7Å
487	H	93.8	Very high	91.9	Very high	173 Å²	173	44.1 Å²	44.1	80%	0.801	25%	0.25	S	C	*	.	H	α-helix	trans	-66.1	-41.9	177.2	-176.9	-75.2	0	0	0	112.3	K483 K484 H485	K483-H487 PolarHBondContact O-N 2.92Å; K484-H487 PolarHBondContact O-N 3.01Å; H485-H487 VanDerWaalsContact C-N 3.27Å; H485-H487 PolarHBondContact O-N 2.87Å
488	A	93.4	Very high	92.2	Very high	69 Å²	69	41.8 Å²	41.8	57%	0.57	23%	0.234	S	C	*	.	H	α-helix	trans	-73.9	-38.5	-178.6	0	0	0	0	0	113.1	T454 K484 H485	T454-A488 HydrophobicContact CG2-CB 3.83Å; K484-A488 WeakPolarHBondContact O-CB 3.32Å; K484-A488 PolarHBondContact O-N 3.19Å; H485-A488 PolarHBondContact O-N 2.85Å
489	S	91.8	Very high	92.3	Very high	31 Å²	31	41.3 Å²	41.3	22%	0.217	23%	0.231	C	C	.	.	H	α-helix	trans	-92.1	-19.9	-175.4	66.4	0	0	0	0	113.8	H485 T491	H485-S489 WeakPolarHBondContact O-CB 3.27Å; H485-S489 PolarHBondContact O-N 3.37Å; H485-S489 PolarHBondContact O-OG 3.21Å; S489-T491 PolarHBondContact O-N 3.36Å; S489-T491 PolarHBondContact OG-N 3.41Å; S489-T491 PolarHBondContact OG-OG1 3.08Å
490	G	90.8	Very high	92.3	Very high	71 Å²	71	40 Å²	40	73%	0.732	22%	0.224	S	C	*	.			trans	68	19.3	-171.3	0	0	0	0	0	113.9	R486	R486-G490 VanDerWaalsContact O-CA 3.3Å; R486-G490 WeakPolarHBondContact O-CA 3.49Å; R486-G490 PolarHBondContact O-N 3.01Å
491	T	89.7	Confident	91.9	Very high	15 Å²	15	37.6 Å²	37.6	9%	0.092	21%	0.212	C	C	.	.			trans	-108.6	143.6	-176.8	56.4	0	0	0	0	112.5	V460 R486 S489 S493	V460-T491 PolarHBondContact O-OG1 2.93Å; R486-T491 WeakPolarHBondContact CG-O 3.44Å; S489-T491 PolarHBondContact O-N 3.36Å; S489-T491 PolarHBondContact OG-N 3.41Å; S489-T491 PolarHBondContact OG-OG1 3.08Å; T491-S493 PolarHBondContact O-N 3.15Å; T491-S493 PolarHBondContact O-OG 2.75Å; T491-S493 PolarHBondContact OG1-OG 3.18Å
492	D	92.6	Very high	91	Very high	104 Å²	104	37.3 Å²	37.3	56%	0.556	21%	0.21	S	C	*	.			trans	-77.2	58.2	175.6	-71.6	-25.7	0	0	0	112.3	W22	W22-D492 HydrophobicContact CH2-CB 3.88Å; W22-D492 HydrophobicContact CZ2-CB 3.68Å
493	S	95.4	Very high	89.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.237	C	C	.	.			trans	-67.5	139.3	-172.1	-51.4	0	0	0	0	112.5	V460 D461 H485 R486 T491	V460-S493 WeakPolarHBondContact O-CB 3.39Å; V460-S493 PolarHBondContact O-OG 3.46Å; D461-S493 WeakPolarHBondContact O-CA 3.46Å; H485-S493 PolarHBondContact CD2-OG 3.02Å; H485-S493 VanDerWaalsContact CD2-OG 3.22Å; R486-S493 VanDerWaalsContact CZ-O 3.31Å; R486-S493 PolarHBondContact NE-O 3.27Å; R486-S493 PolarHBondContact NH2-O 3.41Å; T491-S493 PolarHBondContact O-N 3.15Å; T491-S493 PolarHBondContact O-OG 2.75Å; T491-S493 PolarHBondContact OG1-OG 3.18Å
494	K	95.4	Very high	88	Confident	10 Å²	10	39.4 Å²	39.4	4%	0.043	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	155	176.9	-56.2	-173.9	-178.7	71.4	0	110.8	W22 D461 M462 F463 G514 L532 D535	W22-K494 HydrophobicContact CH2-CG 4.48Å; W22-K494 HydrophobicContact CZ3-CG 4.42Å; D461-K494 PolarHBondContact O-N 3.46Å; M462-K494 CarbonylContact C-O 3.53Å; M462-K494 WeakPolarHBondContact CA-O 3.48Å; F463-K494 PolarHBondContact N-O 3.43Å; K494-G514 CarbonylContact C-O 3.58Å; K494-G514 VanDerWaalsContact CA-O 3.27Å; K494-G514 WeakPolarHBondContact CA-O 3.15Å; K494-G514 WeakPolarHBondContact CB-O 3.27Å; K494-L532 HydrophobicContact CB-CD2 4.49Å; K494-L532 HydrophobicContact CD-CD1 3.98Å; K494-L532 HydrophobicContact CD-CG 3.78Å; K494-L532 VanDerWaalsContact CD-O 3.25Å; K494-L532 WeakPolarHBondContact CD-O 3.08Å; K494-L532 WeakPolarHBondContact CE-O 3.27Å; K494-D535 WeakPolarHBondContact CE-OD1 3.44Å; K494-D535 VanDerWaalsContact NZ-CG 3.29Å; K494-D535 IonicContact NZ-OD1 3.66Å; K494-D535 PolarHBondContact NZ-OD1 2.91Å; K494-D535 IonicContact NZ-OD2 3.69Å; K494-D535 PolarHBondContact NZ-OD2 3.42Å
495	L	94.6	Very high	86.4	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.2	-178.8	174.7	63.3	0	0	0	110.4	F463 I465 P478 L482 G514 L515 L516	F463-L495 HydrophobicContact CB-CD1 3.63Å; F463-L495 CarbonylContact O-C 3.51Å; F463-L495 WeakPolarHBondContact O-CA 3.49Å; I465-L495 HydrophobicContact CD1-CD1 3.62Å; I465-L495 HydrophobicContact CG1-CD1 3.79Å; P478-L495 HydrophobicContact CB-CD2 4.06Å; L482-L495 HydrophobicContact CD1-CB 4.33Å; L482-L495 HydrophobicContact CD2-CB 3.86Å; L495-G514 PolarHBondContact N-O 2.75Å; L495-L515 HydrophobicContact CB-CG 4.49Å; L495-L515 WeakPolarHBondContact O-CA 3.3Å; L495-L516 PolarHBondContact O-N 3.33Å
496	V	93.6	Very high	84.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.2	172.1	-173.6	0	0	0	0	109.7	M462 F463 I464 I465 L516 I518 I529 L532	M462-V496 HydrophobicContact SD-CB 4.45Å; M462-V496 HydrophobicContact SD-CG2 3.97Å; F463-V496 PolarHBondContact O-N 2.82Å; I464-V496 WeakPolarHBondContact CA-O 3.42Å; I464-V496 HydrophobicContact CG1-CB 4.47Å; I465-V496 PolarHBondContact N-O 3.35Å; V496-L516 CarbonylContact C-O 3.59Å; V496-L516 VanDerWaalsContact CA-O 3.29Å; V496-L516 WeakPolarHBondContact CA-O 3.31Å; V496-L516 HydrophobicContact CG2-CB 4.39Å; V496-I518 HydrophobicContact CG1-CD1 3.59Å; V496-I518 HydrophobicContact CG1-CG1 3.85Å; V496-I529 HydrophobicContact CG1-CG1 4.18Å; V496-I529 HydrophobicContact CG2-CG1 4.46Å; V496-L532 HydrophobicContact CG2-CD2 3.44Å; V496-L532 VanDerWaalsContact CG2-CD2 3.44Å
497	M	91.1	Very high	83	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	114.4	170.5	-68	-70.2	-57.7	0	0	109.7	C446 I465 T467 W472 F474 I507 L516 I518	C446-M497 HydrophobicContact CB-CE 3.55Å; C446-M497 HydrophobicContact CB-SD 4.11Å; I465-M497 HydrophobicContact CB-CE 4.25Å; I465-M497 HydrophobicContact CB-SD 3.47Å; I465-M497 WeakPolarHBondContact CB-SD 3.41Å; I465-M497 HydrophobicContact CD1-SD 3.7Å; I465-M497 HydrophobicContact CG1-SD 3.95Å; I465-M497 HydrophobicContact CG2-CE 3.89Å; I465-M497 HydrophobicContact CG2-SD 3.72Å; T467-M497 HydrophobicContact CG2-CE 4.11Å; W472-M497 HydrophobicContact CD2-CE 4.5Å; W472-M497 HydrophobicContact CG-CE 4.32Å; W472-M497 HydrophobicContact CH2-CB 4.37Å; W472-M497 HydrophobicContact CZ3-CB 4.43Å; F474-M497 HydrophobicContact CE1-CE 4.26Å; F474-M497 HydrophobicContact CZ-CE 4.44Å; M497-I507 HydrophobicContact CB-CD1 3.53Å; M497-I507 HydrophobicContact CB-CG1 3.71Å; M497-I507 HydrophobicContact CG-CD1 3.19Å; M497-I507 HydrophobicContact CG-CG1 3.47Å; M497-I507 VanDerWaalsContact CG-CG1 3.47Å; M497-L516 PolarHBondContact N-O 3.49Å; M497-I518 PolarHBondContact O-N 3.44Å
498	C	91.3	Very high	81.1	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	95.6	178.8	-64.1	0	0	0	0	110.2	I465 L466 T467 L500 F521	I465-C498 WeakPolarHBondContact O-CB 3.44Å; I465-C498 PolarHBondContact O-N 3.37Å; L466-C498 HydrophobicContact CD2-CB 3.51Å; T467-C498 PolarHBondContact N-O 2.94Å; C498-L500 PolarHBondContact O-N 3.46Å; C498-F521 HydrophobicContact CB-CD2 4.47Å
499	G	89.4	Confident	79.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	97.9	170.4	0	0	0	0	0	111.2	T467 T501 S502 I518 G520	T467-G499 CarbonylContact O-C 3.58Å; T467-G499 VanDerWaalsContact O-CA 3.31Å; T467-G499 WeakPolarHBondContact O-CA 2.99Å; G499-T501 PolarHBondContact O-N 2.84Å; G499-S502 PolarHBondContact O-N 2.9Å; G499-I518 PolarHBondContact N-O 3.24Å; G499-G520 WeakPolarHBondContact O-CA 3.44Å; G499-G520 PolarHBondContact O-N 2.53Å
500	L	87.7	Confident	78.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	-64.4	-23.4	-177.3	-60.3	-179.9	0	0	0	113.6	V383 P384 T390 A394 I397 T467 C498 F521	V383-L500 HydrophobicContact CG2-CB 4.38Å; P384-L500 WeakPolarHBondContact CD-O 3.28Å; T390-L500 HydrophobicContact CG2-CB 3.89Å; A394-L500 HydrophobicContact CB-CD1 4.03Å; I397-L500 HydrophobicContact CD1-CD2 3.87Å; T467-L500 PolarHBondContact O-N 2.67Å; C498-L500 PolarHBondContact O-N 3.46Å; L500-F521 HydrophobicContact CD2-CB 4.04Å; L500-F521 HydrophobicContact CD2-CD2 4.11Å; L500-F521 HydrophobicContact CD2-CG 4.31Å
501	T	81.2	Confident	77.6	Confident	30 Å²	30	39.5 Å²	39.5	18%	0.184	23%	0.225	C	C	.	.	S	Bend	trans	-117.7	-12.3	178.2	52.9	0	0	0	0	113	T390 N468 G499	T390-T501 HydrophobicContact CG2-CG2 3.47Å; T390-T501 VanDerWaalsContact CG2-CG2 3.47Å; N468-T501 WeakPolarHBondContact CA-OG1 3.31Å; N468-T501 HydrophobicContact CB-CG2 4.1Å; N468-T501 PolarHBondContact O-OG1 3.26Å; G499-T501 PolarHBondContact O-N 2.84Å
502	S	70.9	Confident	77.5	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.021	22%	0.223	C	C	.	.			trans	-69.1	143.2	-174	-178.7	0	0	0	0	111.5	G499 H505 C519 G520	G499-S502 PolarHBondContact O-N 2.9Å; S502-H505 PolarHBondContact OG-CD2 2.82Å; S502-C519 CarbonylContact O-C 3.48Å; S502-G520 PolarHBondContact O-N 3.34Å
503	I	64.3	Low	77.3	Confident	112 Å²	112	37.8 Å²	37.8	57%	0.574	21%	0.21	S	C	*	.	S	Bend	trans	-121.9	96.2	172.4	-53.6	174.5	0	0	0	107
504	G	58.4	Low	77.1	Confident	41 Å²	41	37.8 Å²	37.8	42%	0.423	21%	0.21	S	C	.	.	S	Bend	trans	82.8	26.2	163.2	0	0	0	0	0	117.1	C519	G504-C519 PolarHBondContact N-SG 2.79Å
505	H	59.4	Low	76.9	Confident	87 Å²	87	37.4 Å²	37.4	40%	0.403	21%	0.209	S	C	.	.			trans	-89.3	132.4	169	-66.6	-69.3	0	0	0	110.7	P470 W472 S502	P470-H505 PolarHBondContact O-CD2 2.87Å; W472-H505 HydrophobicContact CE3-CB 4.38Å; W472-H505 HydrophobicContact CH2-CB 4.26Å; W472-H505 WeakPolarHBondContact CH2-O 3.46Å; W472-H505 HydrophobicContact CZ2-CB 4.4Å; W472-H505 HydrophobicContact CZ3-CB 4.24Å; W472-H505 WeakPolarHBondContact CZ3-O 3.35Å; S502-H505 PolarHBondContact OG-CD2 2.82Å
506	A	59.5	Low	76.7	Confident	36 Å²	36	37.3 Å²	37.3	30%	0.298	21%	0.208	S	C	.	.			trans	-92.7	149.3	165.8	0	0	0	0	0	110	E41 I42 W472 A508	E41-A506 HydrophobicContact CG-CB 4.42Å; E41-A506 WeakPolarHBondContact OE1-CB 3.48Å; I42-A506 HydrophobicContact CD1-CB 3.57Å; I42-A506 HydrophobicContact CG1-CB 3.75Å; W472-A506 VanDerWaalsContact CZ3-C 3.44Å; A506-A508 PolarHBondContact O-N 2.79Å
507	I	58.8	Low	76.5	Confident	16 Å²	16	37.3 Å²	37.3	8%	0.082	21%	0.208	C	C	.	.	S	Bend	trans	-62.6	-38.3	178.7	-64.8	164.7	0	0	0	109.2	W472 F474 P478 M497 L515 L516 S517	W472-I507 HydrophobicContact CE3-CG1 3.96Å; W472-I507 HydrophobicContact CH2-CG1 4.47Å; W472-I507 HydrophobicContact CZ3-CB 4.32Å; W472-I507 HydrophobicContact CZ3-CG1 3.59Å; F474-I507 HydrophobicContact CZ-CG2 4.18Å; P478-I507 HydrophobicContact CB-CG2 3.82Å; P478-I507 HydrophobicContact CG-CG2 3.79Å; M497-I507 HydrophobicContact CB-CD1 3.53Å; M497-I507 HydrophobicContact CB-CG1 3.71Å; M497-I507 HydrophobicContact CG-CD1 3.19Å; M497-I507 HydrophobicContact CG-CG1 3.47Å; M497-I507 VanDerWaalsContact CG-CG1 3.47Å; I507-L515 HydrophobicContact CG2-CD2 4.29Å; I507-L516 WeakPolarHBondContact CD1-O 3.36Å; I507-S517 VanDerWaalsContact CG1-OG 3.31Å; I507-S517 WeakPolarHBondContact CG1-OG 3.24Å; I507-S517 PolarHBondContact N-OG 3.07Å; I507-S517 VanDerWaalsContact N-OG 3.13Å
508	A	54.8	Low	76.4	Confident	47 Å²	47	37.3 Å²	37.3	39%	0.388	21%	0.208	S	C	.	.			trans	-177.7	160.7	165.9	0	0	0	0	0	107.7	A506 T510	A506-A508 PolarHBondContact O-N 2.79Å; A508-T510 VanDerWaalsContact C-N 3.29Å; A508-T510 HydrophobicContact CB-CG2 3.45Å; A508-T510 VanDerWaalsContact CB-CG2 3.45Å; A508-T510 PolarHBondContact O-N 3.34Å
509	D	59.5	Low	76	Confident	161 Å²	161	37.4 Å²	37.4	86%	0.861	21%	0.209	S	C	*	.	S	Bend	trans	-69.6	87.5	166.4	-170.6	8.5	0	0	0	107.6
510	T	67.1	Low	75.6	Confident	18 Å²	18	37.7 Å²	37.7	11%	0.11	21%	0.211	C	C	.	.			trans	-120.9	140.3	-174.6	75.4	0	0	0	0	111.5	L479 A508 D512	L479-T510 HydrophobicContact CD2-CG2 4.18Å; A508-T510 VanDerWaalsContact C-N 3.29Å; A508-T510 HydrophobicContact CB-CG2 3.45Å; A508-T510 VanDerWaalsContact CB-CG2 3.45Å; A508-T510 PolarHBondContact O-N 3.34Å; T510-D512 PolarHBondContact O-N 3.48Å
511	E	75.9	Confident	75.4	Confident	147 Å²	147	37.8 Å²	37.8	69%	0.687	21%	0.212	S	C	*	.			trans	-79.3	6.4	175.5	-61.1	-175	159.6	0	0	114	E23 I24	E23-E511 WeakPolarHBondContact CA-O 3.28Å; I24-E511 WeakPolarHBondContact CG1-O 3.33Å; I24-E511 PolarHBondContact N-O 2.9Å
512	D	87.2	Confident	75.8	Confident	7 Å²	7	38.3 Å²	38.3	4%	0.037	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-86.1	114.3	-178.2	-167.5	-60.8	0	0	0	111.6	W22 L479 R486 T510 G514 L515	W22-D512 WeakPolarHBondContact O-CA 3.37Å; L479-D512 HydrophobicContact CD1-CB 3.52Å; L479-D512 WeakPolarHBondContact CD1-OD2 3.41Å; R486-D512 IonicContact CZ-OD1 3.63Å; R486-D512 IonicContact CZ-OD2 3.96Å; R486-D512 IonicContact NH1-OD1 3Å; R486-D512 PolarHBondContact NH1-OD1 2.9Å; R486-D512 IonicContact NH1-OD2 3.93Å; R486-D512 PolarHBondContact NH1-OD2 3.12Å; R486-D512 IonicContact NH2-OD1 2.78Å; R486-D512 PolarHBondContact NH2-OD1 3.06Å; R486-D512 IonicContact NH2-OD2 3.7Å; T510-D512 PolarHBondContact O-N 3.48Å; D512-G514 PolarHBondContact O-N 3.31Å; D512-G514 VanDerWaalsContact O-N 3.1Å; D512-G514 VanDerWaalsContact OD1-CA 3.3Å; D512-G514 WeakPolarHBondContact OD1-CA 3.38Å; D512-G514 PolarHBondContact OD1-N 3.03Å; D512-L515 HydrophobicContact CB-CD1 3.97Å; D512-L515 PolarHBondContact O-N 3.13Å
513	R	88.4	Confident	76.6	Confident	76 Å²	76	41.5 Å²	41.5	29%	0.287	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.9	-179.8	71.3	-178.2	-171.4	177.4	2.4	114.3	S21 W22 I24 T28 R32	S21-R513 PolarHBondContact O-NE 3.34Å; S21-R513 VanDerWaalsContact O-NE 3.1Å; S21-R513 PolarHBondContact O-NH1 3.17Å; S21-R513 PolarHBondContact O-NH2 3.09Å; W22-R513 HydrophobicContact CE3-CG 3.66Å; W22-R513 HydrophobicContact CZ3-CG 4.15Å; W22-R513 PolarHBondContact O-N 3.37Å; I24-R513 HydrophobicContact CG1-CB 3.9Å; T28-R513 HydrophobicContact CG2-CB 4.31Å; R32-R513 PolarHBondContact NH2-O 3.15Å
514	G	90.7	Very high	77.8	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-1.9	-178.1	0	0	0	0	0	114.5	K494 L495 D512	K494-G514 CarbonylContact C-O 3.58Å; K494-G514 VanDerWaalsContact CA-O 3.27Å; K494-G514 WeakPolarHBondContact CA-O 3.15Å; K494-G514 WeakPolarHBondContact CB-O 3.27Å; L495-G514 PolarHBondContact N-O 2.75Å; D512-G514 PolarHBondContact O-N 3.31Å; D512-G514 VanDerWaalsContact O-N 3.1Å; D512-G514 VanDerWaalsContact OD1-CA 3.3Å; D512-G514 WeakPolarHBondContact OD1-CA 3.38Å; D512-G514 PolarHBondContact OD1-N 3.03Å
515	L	90.3	Very high	79.4	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.3	174.5	-81	72.7	0	0	0	110.6	L479 L482 L495 I507 D512	L479-L515 HydrophobicContact CB-CD2 4.09Å; L479-L515 HydrophobicContact CD1-CD1 3.71Å; L479-L515 HydrophobicContact CD1-CD2 4.23Å; L482-L515 HydrophobicContact CD2-CD1 3.41Å; L482-L515 VanDerWaalsContact CD2-CD1 3.41Å; L482-L515 HydrophobicContact CD2-CG 4.29Å; L495-L515 HydrophobicContact CB-CG 4.49Å; L495-L515 WeakPolarHBondContact O-CA 3.3Å; I507-L515 HydrophobicContact CG2-CD2 4.29Å; D512-L515 HydrophobicContact CB-CD1 3.97Å; D512-L515 PolarHBondContact O-N 3.13Å
516	L	90.7	Very high	81	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	142.4	175.9	-163.3	79.7	0	0	0	112.1	E41 L495 V496 M497 I507 I518 V528 L532	E41-L516 VanDerWaalsContact O-CD1 3.23Å; E41-L516 WeakPolarHBondContact O-CD1 3.46Å; L495-L516 PolarHBondContact O-N 3.33Å; V496-L516 CarbonylContact C-O 3.59Å; V496-L516 VanDerWaalsContact CA-O 3.29Å; V496-L516 WeakPolarHBondContact CA-O 3.31Å; V496-L516 HydrophobicContact CG2-CB 4.39Å; M497-L516 PolarHBondContact N-O 3.49Å; I507-L516 WeakPolarHBondContact CD1-O 3.36Å; L516-I518 HydrophobicContact CD2-CG1 4.47Å; L516-V528 HydrophobicContact CD2-CG1 3.17Å; L516-L532 HydrophobicContact CB-CD2 3.81Å; L516-L532 HydrophobicContact CD2-CD2 4.27Å
517	S	89.8	Confident	82.5	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.2	177.6	-57.4	0	0	0	0	109.9	E41 I42 Y43 I507	E41-S517 WeakPolarHBondContact O-CB 3.23Å; E41-S517 PolarHBondContact O-N 2.97Å; I42-S517 CarbonylContact C-O 3.12Å; I42-S517 WeakPolarHBondContact CA-O 3.47Å; Y43-S517 PolarHBondContact N-O 3.3Å; I507-S517 VanDerWaalsContact CG1-OG 3.31Å; I507-S517 WeakPolarHBondContact CG1-OG 3.24Å; I507-S517 PolarHBondContact N-OG 3.07Å; I507-S517 VanDerWaalsContact N-OG 3.13Å
518	I	88.8	Confident	84.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.8	173.1	-66.7	-177.7	0	0	0	108.2	Y43 V496 M497 G499 L516 G520 F521 A525 V528 I529	Y43-I518 HydrophobicContact CD1-CG1 4.17Å; Y43-I518 HydrophobicContact CD1-CG2 4Å; Y43-I518 CarbonylContact O-C 3.5Å; Y43-I518 WeakPolarHBondContact O-CA 3.47Å; V496-I518 HydrophobicContact CG1-CD1 3.59Å; V496-I518 HydrophobicContact CG1-CG1 3.85Å; M497-I518 PolarHBondContact O-N 3.44Å; G499-I518 PolarHBondContact N-O 3.24Å; L516-I518 HydrophobicContact CD2-CG1 4.47Å; I518-G520 VanDerWaalsContact CG2-O 3.25Å; I518-G520 WeakPolarHBondContact CG2-O 3.3Å; I518-F521 HydrophobicContact CG2-CD2 4.38Å; I518-A525 HydrophobicContact CD1-CB 4.1Å; I518-A525 HydrophobicContact CG2-CB 4.07Å; I518-V528 HydrophobicContact CD1-CG1 4.32Å; I518-I529 HydrophobicContact CD1-CD1 4.03Å; I518-I529 HydrophobicContact CD1-CG1 3.74Å
519	C	83.6	Confident	86	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.014	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.9	179.2	-69.9	0	0	0	0	111	Y43 T44 A45 S502 G504	Y43-C519 PolarHBondContact O-N 2.95Å; T44-C519 HydrophobicContact CG2-CB 4.25Å; A45-C519 PolarHBondContact N-O 3.34Å; S502-C519 CarbonylContact O-C 3.48Å; G504-C519 PolarHBondContact N-SG 2.79Å
520	G	81.6	Confident	87.7	Confident	5 Å²	5	24.2 Å²	24.2	5%	0.052	12%	0.118	C	C	.	.	S	Bend	trans	69.4	-174.4	-163.1	0	0	0	0	0	111.4	G499 S502 I518	G499-G520 WeakPolarHBondContact O-CA 3.44Å; G499-G520 PolarHBondContact O-N 2.53Å; S502-G520 PolarHBondContact O-N 3.34Å; I518-G520 VanDerWaalsContact CG2-O 3.25Å; I518-G520 WeakPolarHBondContact CG2-O 3.3Å
521	F	83.5	Confident	89	Confident	3 Å²	3	23.4 Å²	23.4	1%	0.013	11%	0.113	C	C	.	.			trans	-147.1	128.1	177.2	-152.5	-80.7	0	0	0	111.3	F320 V383 I397 C498 L500 I518 A525 F526	F320-F521 HydrophobicContact CE1-CD1 4.15Å; F320-F521 HydrophobicContact CE2-CD1 4.13Å; F320-F521 HydrophobicContact CE2-CE1 4.39Å; F320-F521 AromaticContact CZ-CD1 3.75Å; F320-F521 HydrophobicContact CZ-CD1 3.75Å; F320-F521 HydrophobicContact CZ-CE1 4.36Å; V383-F521 HydrophobicContact CG1-CB 4.41Å; I397-F521 HydrophobicContact CD1-CD1 3.72Å; I397-F521 HydrophobicContact CD1-CD2 3.58Å; I397-F521 HydrophobicContact CD1-CE1 3.67Å; I397-F521 HydrophobicContact CD1-CE2 3.52Å; I397-F521 HydrophobicContact CD1-CG 3.68Å; I397-F521 HydrophobicContact CD1-CZ 3.56Å; I397-F521 HydrophobicContact CG1-CD1 4.09Å; I397-F521 HydrophobicContact CG1-CE1 3.61Å; I397-F521 HydrophobicContact CG1-CE2 4.09Å; I397-F521 HydrophobicContact CG1-CZ 3.61Å; I397-F521 HydrophobicContact CG2-CE2 4.39Å; I397-F521 HydrophobicContact CG2-CZ 4.07Å; C498-F521 HydrophobicContact CB-CD2 4.47Å; L500-F521 HydrophobicContact CD2-CB 4.04Å; L500-F521 HydrophobicContact CD2-CD2 4.11Å; L500-F521 HydrophobicContact CD2-CG 4.31Å; I518-F521 HydrophobicContact CG2-CD2 4.38Å; F521-A525 HydrophobicContact CD1-CB 4.19Å; F521-A525 HydrophobicContact CD2-CB 3.98Å; F521-A525 HydrophobicContact CE1-CB 3.92Å; F521-A525 HydrophobicContact CE2-CB 3.72Å; F521-A525 HydrophobicContact CG-CB 4.21Å; F521-A525 HydrophobicContact CZ-CB 3.69Å; F521-F526 HydrophobicContact CD1-CE2 4.49Å; F521-F526 AromaticContact CE1-CD2 3.96Å; F521-F526 HydrophobicContact CE1-CD2 3.96Å; F521-F526 HydrophobicContact CE1-CE1 4.26Å; F521-F526 AromaticContact CE1-CE2 3.42Å; F521-F526 HydrophobicContact CE1-CE2 3.42Å; F521-F526 VanDerWaalsContact CE1-CE2 3.42Å; F521-F526 AromaticContact CE1-CZ 3.58Å; F521-F526 HydrophobicContact CE1-CZ 3.58Å; F521-F526 HydrophobicContact CZ-CD1 4.45Å; F521-F526 HydrophobicContact CZ-CD2 4.39Å; F521-F526 HydrophobicContact CZ-CE1 4.09Å; F521-F526 HydrophobicContact CZ-CE2 4.05Å; F521-F526 AromaticContact CZ-CZ 3.87Å; F521-F526 HydrophobicContact CZ-CZ 3.87Å
522	D	87.8	Confident	89.8	Confident	40 Å²	40	16.4 Å²	16.4	21%	0.214	8%	0.08	C	C	.	.			trans	-141	-174.3	176	73.8	-15.8	0	0	0	110.9	Y43 A45 G524 A525	Y43-D522 WeakPolarHBondContact CE1-OD1 3.4Å; Y43-D522 PolarHBondContact OH-OD1 2.97Å; Y43-D522 PolarHBondContact OH-OD2 3.38Å; A45-D522 HydrophobicContact CB-CB 3.84Å; D522-G524 PolarHBondContact O-N 2.98Å; D522-G524 WeakPolarHBondContact OD1-CA 3.34Å; D522-G524 PolarHBondContact OD1-N 2.68Å; D522-A525 WeakPolarHBondContact O-CB 3.15Å; D522-A525 PolarHBondContact O-N 2.6Å; D522-A525 PolarHBondContact OD1-N 3.01Å; D522-A525 VanDerWaalsContact OD1-N 3.11Å
523	L	88.4	Confident	90.2	Very high	71 Å²	71	16.2 Å²	16.2	37%	0.372	8%	0.08	S	C	.	.	H	α-helix	trans	-61.7	-32	177.4	-174.9	64.6	0	0	0	112.4	H318 A525 F526	H318-L523 HydrophobicContact CB-CD1 3.44Å; H318-L523 VanDerWaalsContact CB-CD1 3.44Å; H318-L523 WeakPolarHBondContact ND1-CD1 3.38Å; L523-A525 VanDerWaalsContact C-N 3.28Å; L523-A525 PolarHBondContact O-N 2.8Å; L523-F526 HydrophobicContact CD1-CD2 4.43Å; L523-F526 PolarHBondContact O-N 2.86Å
524	G	89.5	Confident	90.4	Very high	5 Å²	5	15.7 Å²	15.7	5%	0.052	8%	0.082	C	C	.	.	H	α-helix	trans	-64.2	-31.5	179.3	0	0	0	0	0	113.6	Y43 D522 F526 S527 V528	Y43-G524 WeakPolarHBondContact OH-CA 3.38Å; D522-G524 PolarHBondContact O-N 2.98Å; D522-G524 WeakPolarHBondContact OD1-CA 3.34Å; D522-G524 PolarHBondContact OD1-N 2.68Å; G524-F526 VanDerWaalsContact C-N 3.26Å; G524-F526 PolarHBondContact O-N 3.4Å; G524-S527 WeakPolarHBondContact O-CB 3.31Å; G524-S527 PolarHBondContact O-N 3.43Å; G524-S527 VanDerWaalsContact O-N 3.09Å; G524-V528 WeakPolarHBondContact O-CG2 3.46Å; G524-V528 PolarHBondContact O-N 3.44Å
525	A	91.6	Very high	90.4	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-55.9	-39.4	176.3	0	0	0	0	0	112.5	Y43 I518 F521 D522 L523 V528 I529	Y43-A525 HydrophobicContact CD1-CB 4.43Å; Y43-A525 HydrophobicContact CE1-CB 4.02Å; I518-A525 HydrophobicContact CD1-CB 4.1Å; I518-A525 HydrophobicContact CG2-CB 4.07Å; F521-A525 HydrophobicContact CD1-CB 4.19Å; F521-A525 HydrophobicContact CD2-CB 3.98Å; F521-A525 HydrophobicContact CE1-CB 3.92Å; F521-A525 HydrophobicContact CE2-CB 3.72Å; F521-A525 HydrophobicContact CG-CB 4.21Å; F521-A525 HydrophobicContact CZ-CB 3.69Å; D522-A525 WeakPolarHBondContact O-CB 3.15Å; D522-A525 PolarHBondContact O-N 2.6Å; D522-A525 PolarHBondContact OD1-N 3.01Å; D522-A525 VanDerWaalsContact OD1-N 3.11Å; L523-A525 VanDerWaalsContact C-N 3.28Å; L523-A525 PolarHBondContact O-N 2.8Å; A525-V528 PolarHBondContact O-N 3.04Å; A525-I529 VanDerWaalsContact O-CG1 3.27Å; A525-I529 WeakPolarHBondContact O-CG1 3.48Å; A525-I529 PolarHBondContact O-N 2.57Å
526	F	92.9	Very high	90.4	Very high	18 Å²	18	20.8 Å²	20.8	8%	0.079	11%	0.11	C	C	.	.	H	α-helix	trans	-64.5	-42.9	176	-69.1	-73.4	0	0	0	112.3	H318 F320 I397 I400 F401 F521 L523 G524 V528 I529 R530	H318-F526 AromaticContact CE1-CD2 3.39Å; H318-F526 WeakPolarHBondContact CE1-CD2 3.36Å; H318-F526 AromaticContact CE1-CE2 3.45Å; H318-F526 VanDerWaalsContact CE1-CE2 3.45Å; H318-F526 WeakPolarHBondContact CE1-CE2 3.36Å; H318-F526 AromaticContact CE1-CG 3.79Å; H318-F526 AromaticContact CE1-CZ 3.92Å; H318-F526 AromaticContact NE2-CD2 3.88Å; H318-F526 AromaticContact NE2-CG 3.85Å; F320-F526 HydrophobicContact CB-CD2 4.41Å; F320-F526 HydrophobicContact CB-CE2 3.56Å; F320-F526 HydrophobicContact CB-CZ 4.28Å; F320-F526 HydrophobicContact CD1-CE2 4.17Å; F320-F526 AromaticContact CD2-CE2 3.91Å; F320-F526 HydrophobicContact CD2-CE2 3.91Å; F320-F526 HydrophobicContact CD2-CZ 4.19Å; F320-F526 AromaticContact CG-CE2 3.63Å; F320-F526 HydrophobicContact CG-CE2 3.63Å; F320-F526 HydrophobicContact CG-CZ 4.33Å; I397-F526 HydrophobicContact CG1-CZ 4.11Å; I397-F526 HydrophobicContact CG2-CE1 4.34Å; I400-F526 HydrophobicContact CB-CE1 4.23Å; I400-F526 HydrophobicContact CD1-CE1 4.06Å; I400-F526 HydrophobicContact CD1-CE2 4.21Å; I400-F526 HydrophobicContact CD1-CZ 3.5Å; I400-F526 HydrophobicContact CG2-CD1 4.37Å; I400-F526 HydrophobicContact CG2-CE1 3.83Å; I400-F526 HydrophobicContact CG2-CZ 4.39Å; F401-F526 HydrophobicContact CE2-CD1 4.03Å; F401-F526 AromaticContact CE2-CE1 3.86Å; F401-F526 HydrophobicContact CE2-CE1 3.86Å; F401-F526 HydrophobicContact CZ-CD1 4.02Å; F401-F526 HydrophobicContact CZ-CE1 4.32Å; F521-F526 HydrophobicContact CD1-CE2 4.49Å; F521-F526 AromaticContact CE1-CD2 3.96Å; F521-F526 HydrophobicContact CE1-CD2 3.96Å; F521-F526 HydrophobicContact CE1-CE1 4.26Å; F521-F526 AromaticContact CE1-CE2 3.42Å; F521-F526 HydrophobicContact CE1-CE2 3.42Å; F521-F526 VanDerWaalsContact CE1-CE2 3.42Å; F521-F526 AromaticContact CE1-CZ 3.58Å; F521-F526 HydrophobicContact CE1-CZ 3.58Å; F521-F526 HydrophobicContact CZ-CD1 4.45Å; F521-F526 HydrophobicContact CZ-CD2 4.39Å; F521-F526 HydrophobicContact CZ-CE1 4.09Å; F521-F526 HydrophobicContact CZ-CE2 4.05Å; F521-F526 AromaticContact CZ-CZ 3.87Å; F521-F526 HydrophobicContact CZ-CZ 3.87Å; L523-F526 HydrophobicContact CD1-CD2 4.43Å; L523-F526 PolarHBondContact O-N 2.86Å; G524-F526 VanDerWaalsContact C-N 3.26Å; G524-F526 PolarHBondContact O-N 3.4Å; F526-V528 VanDerWaalsContact C-N 3.29Å; F526-V528 PolarHBondContact O-N 2.85Å; F526-I529 PolarHBondContact O-N 3.45Å; F526-R530 VanDerWaalsContact O-CB 3.31Å; F526-R530 WeakPolarHBondContact O-CB 3.39Å; F526-R530 PolarHBondContact O-N 3.02Å
527	S	91.8	Very high	90.3	Very high	38 Å²	38	21.2 Å²	21.2	27%	0.266	11%	0.112	S	C	.	.	H	α-helix	trans	-62.3	-39.8	176.1	-59.9	0	0	0	0	111.6	G524 R530 N531	G524-S527 WeakPolarHBondContact O-CB 3.31Å; G524-S527 PolarHBondContact O-N 3.43Å; G524-S527 VanDerWaalsContact O-N 3.09Å; S527-R530 PolarHBondContact O-N 3.37Å; S527-N531 VanDerWaalsContact O-CB 3.31Å; S527-N531 WeakPolarHBondContact O-CB 3.2Å; S527-N531 PolarHBondContact O-N 3.43Å; S527-N531 PolarHBondContact O-ND2 3.01Å
528	V	93.1	Very high	90.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.8	-50.8	176.9	170.7	0	0	0	0	111	Y36 Y43 V85 L516 I518 G524 A525 F526 R530 N531 L532 I537	Y36-V528 HydrophobicContact CD1-CG2 3.91Å; Y43-V528 HydrophobicContact CD1-CG2 4.27Å; Y43-V528 HydrophobicContact CD2-CG2 4.03Å; Y43-V528 HydrophobicContact CE2-CG2 4.32Å; Y43-V528 HydrophobicContact CG-CG2 3.99Å; V85-V528 HydrophobicContact CG2-CG2 3.7Å; L516-V528 HydrophobicContact CD2-CG1 3.17Å; I518-V528 HydrophobicContact CD1-CG1 4.32Å; G524-V528 WeakPolarHBondContact O-CG2 3.46Å; G524-V528 PolarHBondContact O-N 3.44Å; A525-V528 PolarHBondContact O-N 3.04Å; F526-V528 VanDerWaalsContact C-N 3.29Å; F526-V528 PolarHBondContact O-N 2.85Å; V528-R530 VanDerWaalsContact C-N 3.31Å; V528-R530 PolarHBondContact O-N 2.76Å; V528-N531 PolarHBondContact O-N 3.22Å; V528-L532 WeakPolarHBondContact O-CB 3.49Å; V528-L532 PolarHBondContact O-N 3.12Å; V528-I537 HydrophobicContact CG1-CD1 3.98Å
529	I	94.8	Very high	90.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.1	-45.5	177.1	-67.1	163.3	0	0	0	110.6	F369 F401 I464 V496 I518 A525 F526 L532 A533	F369-I529 HydrophobicContact CE1-CG2 4.44Å; F401-I529 HydrophobicContact CE1-CG2 4.06Å; F401-I529 HydrophobicContact CE2-CD1 4.26Å; F401-I529 HydrophobicContact CZ-CB 4.35Å; F401-I529 HydrophobicContact CZ-CD1 3.99Å; F401-I529 HydrophobicContact CZ-CG2 3.75Å; I464-I529 HydrophobicContact CD1-CD1 4.37Å; I464-I529 HydrophobicContact CD1-CG2 4.03Å; I464-I529 HydrophobicContact CG1-CD1 4.25Å; I464-I529 HydrophobicContact CG1-CG2 4.3Å; V496-I529 HydrophobicContact CG1-CG1 4.18Å; V496-I529 HydrophobicContact CG2-CG1 4.46Å; I518-I529 HydrophobicContact CD1-CD1 4.03Å; I518-I529 HydrophobicContact CD1-CG1 3.74Å; A525-I529 VanDerWaalsContact O-CG1 3.27Å; A525-I529 WeakPolarHBondContact O-CG1 3.48Å; A525-I529 PolarHBondContact O-N 2.57Å; F526-I529 PolarHBondContact O-N 3.45Å; I529-L532 PolarHBondContact O-N 2.86Å; I529-A533 WeakPolarHBondContact O-CB 3.43Å; I529-A533 PolarHBondContact O-N 3.13Å
530	R	93.9	Very high	90.8	Very high	75 Å²	75	24.7 Å²	24.7	28%	0.283	13%	0.13	S	C	.	.	H	α-helix	trans	-60.6	-47	177.8	175.9	169.6	-170.5	-110.5	10.2	111.9	E363 V365 F526 S527 V528 L532 A533 L534	E363-R530 IonicContact OE2-CZ 3.46Å; E363-R530 IonicContact OE2-NH2 3.63Å; E363-R530 PolarHBondContact OE2-NH2 2.92Å; V365-R530 HydrophobicContact CG2-CB 4.39Å; V365-R530 HydrophobicContact CG2-CG 3.85Å; F526-R530 VanDerWaalsContact O-CB 3.31Å; F526-R530 WeakPolarHBondContact O-CB 3.39Å; F526-R530 PolarHBondContact O-N 3.02Å; S527-R530 PolarHBondContact O-N 3.37Å; V528-R530 VanDerWaalsContact C-N 3.31Å; V528-R530 PolarHBondContact O-N 2.76Å; R530-L532 VanDerWaalsContact C-N 3.32Å; R530-L532 PolarHBondContact O-N 2.63Å; R530-A533 PolarHBondContact O-N 3.46Å; R530-L534 HydrophobicContact CG-CD1 3.98Å; R530-L534 WeakPolarHBondContact O-CB 3.44Å; R530-L534 WeakPolarHBondContact O-CG 3.35Å; R530-L534 PolarHBondContact O-N 2.81Å
531	N	93.9	Very high	91.4	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-63.5	-39.9	179.8	-72.5	-18.2	0	0	0	111.4	C35 R83 S527 V528 L534 D535 L536 I537	C35-N531 PolarHBondContact SG-ND2 3.25Å; R83-N531 PolarHBondContact O-ND2 3.16Å; S527-N531 VanDerWaalsContact O-CB 3.31Å; S527-N531 WeakPolarHBondContact O-CB 3.2Å; S527-N531 PolarHBondContact O-N 3.43Å; S527-N531 PolarHBondContact O-ND2 3.01Å; V528-N531 PolarHBondContact O-N 3.22Å; N531-L534 CarbonylContact O-C 3.59Å; N531-L534 PolarHBondContact O-N 3.15Å; N531-D535 PolarHBondContact O-N 3.25Å; N531-L536 HydrophobicContact CB-CB 4.08Å; N531-L536 HydrophobicContact CB-CD1 4.45Å; N531-L536 WeakPolarHBondContact O-CB 3.42Å; N531-L536 PolarHBondContact O-N 3.28Å; N531-I537 HydrophobicContact CB-CD1 3.95Å; N531-I537 HydrophobicContact CB-CG1 3.88Å; N531-I537 HydrophobicContact CB-CG2 4.18Å
532	L	94.6	Very high	91.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-43.5	175.7	-176.8	67.4	0	0	0	111.5	K494 V496 L516 V528 I529 R530 L534 D535 I537	K494-L532 HydrophobicContact CB-CD2 4.49Å; K494-L532 HydrophobicContact CD-CD1 3.98Å; K494-L532 HydrophobicContact CD-CG 3.78Å; K494-L532 VanDerWaalsContact CD-O 3.25Å; K494-L532 WeakPolarHBondContact CD-O 3.08Å; K494-L532 WeakPolarHBondContact CE-O 3.27Å; V496-L532 HydrophobicContact CG2-CD2 3.44Å; V496-L532 VanDerWaalsContact CG2-CD2 3.44Å; L516-L532 HydrophobicContact CB-CD2 3.81Å; L516-L532 HydrophobicContact CD2-CD2 4.27Å; V528-L532 WeakPolarHBondContact O-CB 3.49Å; V528-L532 PolarHBondContact O-N 3.12Å; I529-L532 PolarHBondContact O-N 2.86Å; R530-L532 VanDerWaalsContact C-N 3.32Å; R530-L532 PolarHBondContact O-N 2.63Å; L532-L534 PolarHBondContact O-N 3.45Å; L532-D535 PolarHBondContact O-N 3.04Å; L532-D535 VanDerWaalsContact O-N 3.1Å; L532-I537 HydrophobicContact CB-CD1 4.26Å; L532-I537 HydrophobicContact CB-CG1 4.06Å; L532-I537 HydrophobicContact CD1-CG1 4.43Å
533	A	94	Very high	92.1	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.033	14%	0.137	C	C	.	.	H	α-helix	trans	-64	-24.9	177.6	0	0	0	0	0	113.4	V365 F369 I529 R530	V365-A533 HydrophobicContact CG1-CB 3.96Å; F369-A533 HydrophobicContact CZ-CB 4.26Å; I529-A533 WeakPolarHBondContact O-CB 3.43Å; I529-A533 PolarHBondContact O-N 3.13Å; R530-A533 PolarHBondContact O-N 3.46Å
534	L	92.9	Very high	92.4	Very high	64 Å²	64	23.2 Å²	23.2	34%	0.335	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	7	175.9	-69.5	174.1	0	0	0	114	V365 R530 N531 L532 L536	V365-L534 HydrophobicContact CG1-CD2 3.57Å; V365-L534 HydrophobicContact CG1-CG 3.77Å; R530-L534 HydrophobicContact CG-CD1 3.98Å; R530-L534 WeakPolarHBondContact O-CB 3.44Å; R530-L534 WeakPolarHBondContact O-CG 3.35Å; R530-L534 PolarHBondContact O-N 2.81Å; N531-L534 CarbonylContact O-C 3.59Å; N531-L534 PolarHBondContact O-N 3.15Å; L532-L534 PolarHBondContact O-N 3.45Å; L534-L536 HydrophobicContact CB-CD1 4.07Å; L534-L536 HydrophobicContact CB-CG 3.87Å; L534-L536 HydrophobicContact CD1-CD1 4.23Å; L534-L536 PolarHBondContact O-N 2.81Å
535	D	91.4	Very high	92.6	Very high	85 Å²	85	24.6 Å²	24.6	46%	0.455	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	32.5	-177.9	-61	-74.6	0	0	0	113.2	K494 N531 L532	K494-D535 WeakPolarHBondContact CE-OD1 3.44Å; K494-D535 VanDerWaalsContact NZ-CG 3.29Å; K494-D535 IonicContact NZ-OD1 3.66Å; K494-D535 PolarHBondContact NZ-OD1 2.91Å; K494-D535 IonicContact NZ-OD2 3.69Å; K494-D535 PolarHBondContact NZ-OD2 3.42Å; N531-D535 PolarHBondContact O-N 3.25Å; L532-D535 PolarHBondContact O-N 3.04Å; L532-D535 VanDerWaalsContact O-N 3.1Å
536	L	90.1	Very high	92.7	Very high	26 Å²	26	26.7 Å²	26.7	14%	0.136	14%	0.137	C	C	.	.			trans	-89.9	-21.3	178.3	-61.9	178.9	0	0	0	113.5	C31 R83 N531 L534	C31-L536 WeakPolarHBondContact CB-O 3.22Å; R83-L536 HydrophobicContact CG-CD1 4.4Å; N531-L536 HydrophobicContact CB-CB 4.08Å; N531-L536 HydrophobicContact CB-CD1 4.45Å; N531-L536 WeakPolarHBondContact O-CB 3.42Å; N531-L536 PolarHBondContact O-N 3.28Å; L534-L536 HydrophobicContact CB-CD1 4.07Å; L534-L536 HydrophobicContact CB-CG 3.87Å; L534-L536 HydrophobicContact CD1-CD1 4.23Å; L534-L536 PolarHBondContact O-N 2.81Å
537	I	88.9	Confident	92.7	Very high	9 Å²	9	27.5 Å²	27.5	5%	0.046	14%	0.142	C	C	.	.			trans	-140.7	0	-178.1	61.6	168.8	0	0	0	111.7	T28 C31 R32 C35 Y36 F78 V528 N531 L532	T28-I537 WeakPolarHBondContact CG2-OXT 2.79Å; C31-I537 HydrophobicContact CB-CG2 4.1Å; R32-I537 HydrophobicContact CG-CB 3.95Å; R32-I537 VanDerWaalsContact CG-OXT 3.22Å; R32-I537 WeakPolarHBondContact CG-OXT 3.41Å; R32-I537 PolarHBondContact NE-OXT 2.81Å; C35-I537 HydrophobicContact CB-CG2 3.75Å; Y36-I537 HydrophobicContact CE1-CD1 4.14Å; F78-I537 HydrophobicContact CE1-CG2 4.21Å; F78-I537 HydrophobicContact CZ-CG2 3.9Å; V528-I537 HydrophobicContact CG1-CD1 3.98Å; N531-I537 HydrophobicContact CB-CD1 3.95Å; N531-I537 HydrophobicContact CB-CG1 3.88Å; N531-I537 HydrophobicContact CB-CG2 4.18Å; L532-I537 HydrophobicContact CB-CD1 4.26Å; L532-I537 HydrophobicContact CB-CG1 4.06Å; L532-I537 HydrophobicContact CD1-CG1 4.43Å

Retrieved 537 of 537 residues in 260.1 ms (Link to these results)

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