A0A096MR45_PAPAN Loading...

Jrk helix-turn-helix protein

May bind DNA.

AlphaFold DB , UniProt , Accession A0A096MR45, Species PAPAN (Papio anubis, Olive baboon), Gene JRK, Length 558 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37	Very low	39.2	Very low	250 Å²	250	137.1 Å²	137.1	100%	1.232	89%	0.89	S	S	*	*				0	109.4	0	-64.9	-162.5	-152.8	0	0	107.6
2	A	34.8	Very low	39.7	Very low	107 Å²	107	131.6 Å²	131.6	88%	0.884	88%	0.877	S	S	*	*	P	Polyproline II helix	trans	-99.4	126	-179.3	0	0	0	0	0	109.8
3	S	38.8	Very low	41	Very low	121 Å²	121	136.5 Å²	136.5	85%	0.846	88%	0.879	S	S	*	*	P	Polyproline II helix	trans	-70.4	134.3	-180	19.2	0	0	0	0	111.9
4	K	35.9	Very low	42.3	Very low	206 Å²	206	140.9 Å²	140.9	90%	0.896	88%	0.878	S	S	*	*	P	Polyproline II helix	trans	-86.3	141.9	168.8	-92.9	179.6	173	176.4	0	110.6
5	P	39.6	Very low	43.9	Very low	130 Å²	130	142.1 Å²	142.1	84%	0.844	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-91.7	167.5	170.4	35.6	-30.2	0	0	0	113.2
6	A	46	Very low	45.7	Very low	103 Å²	103	144.6 Å²	144.6	85%	0.851	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-76.3	167.7	-162.2	0	0	0	0	0	116.9
7	A	37.8	Very low	47.3	Very low	102 Å²	102	149.8 Å²	149.8	84%	0.843	86%	0.857	S	S	*	*			trans	-142.7	98.2	150.9	0	0	0	0	0	110
8	G	36.7	Very low	49	Very low	79 Å²	79	145.1 Å²	145.1	81%	0.814	83%	0.831	S	S	*	*			trans	-74.2	126.7	169.4	0	0	0	0	0	110.7	S10	G8-S10 PolarHBondContact O-N 3.08Å
9	K	39.8	Very low	50.8	Low	211 Å²	211	141.2 Å²	141.2	92%	0.917	81%	0.81	S	S	*	*			trans	-79	108	169.3	-80	176.3	175.2	173.8	0	109.1	G11	K9-G11 PolarHBondContact O-N 3.49Å
10	S	40.8	Very low	52.4	Low	118 Å²	118	134.6 Å²	134.6	83%	0.825	77%	0.772	S	S	*	*			trans	-73.8	116.5	164.8	56.8	0	0	0	0	109.5	G8 G12	G8-S10 PolarHBondContact O-N 3.08Å; S10-G12 PolarHBondContact O-N 2.85Å
11	G	44.2	Very low	53.9	Low	81 Å²	81	128.6 Å²	128.6	84%	0.835	74%	0.738	S	S	*	*			trans	-65.1	114.2	173.9	0	0	0	0	0	111.1	K9	K9-G11 PolarHBondContact O-N 3.49Å
12	G	45.7	Very low	56	Low	71 Å²	71	117 Å²	117	73%	0.732	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-68.7	132.5	176.4	0	0	0	0	0	112	S10 K14	S10-G12 PolarHBondContact O-N 2.85Å; G12-K14 PolarHBondContact O-N 3.41Å
13	E	55.5	Low	58.3	Low	195 Å²	195	115.5 Å²	115.5	91%	0.911	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-53.6	124.8	172	-118.7	178.5	159.9	0	0	110.7	R15	E13-R15 PolarHBondContact O-N 3.43Å
14	K	59.6	Low	60.6	Low	199 Å²	199	113.1 Å²	113.1	87%	0.865	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-68.4	119.8	179	-71.5	-179.4	179.9	176.3	0	109.4	G12 K16	G12-K14 PolarHBondContact O-N 3.41Å; K14-K16 PolarHBondContact O-N 3.39Å
15	R	67.1	Low	63.1	Low	159 Å²	159	105.5 Å²	105.5	60%	0.6	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-55.5	133.8	173.3	-84.1	177.3	-100.9	169.5	-4.9	110.8	E13 V47	E13-R15 PolarHBondContact O-N 3.43Å; R15-V47 PolarHBondContact NH1-O 3.41Å
16	K	71.8	Confident	65.3	Low	182 Å²	182	99.7 Å²	99.7	79%	0.791	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-65	137.7	174.7	-68.4	-179.2	-179.2	175.6	0	109.7	K14 V18	K14-K16 PolarHBondContact O-N 3.39Å; K16-V18 PolarHBondContact O-N 3.01Å
17	R	73.3	Confident	67.3	Low	233 Å²	233	97 Å²	97	88%	0.879	53%	0.53	S	S	*	.			trans	-67.1	114.8	179	-175.3	178.3	-178.4	173.1	1.3	110.1
18	V	78.7	Confident	69.8	Low	65 Å²	65	92.1 Å²	92.1	39%	0.394	49%	0.489	S	S	.	.			trans	-99.1	140.3	172.6	-179.2	0	0	0	0	109.3	K16 L20 N46	K16-V18 PolarHBondContact O-N 3.01Å; V18-L20 HydrophobicContact CG1-CD2 4.04Å; V18-N46 HydrophobicContact CG2-CB 4.13Å; V18-N46 WeakPolarHBondContact CG2-ND2 3.28Å
19	V	81.5	Confident	72.2	Confident	70 Å²	70	88.6 Å²	88.6	42%	0.424	45%	0.452	S	S	.	.			trans	-115.1	102.5	175.4	-170.6	0	0	0	0	108.8	R79	V19-R79 HydrophobicContact CG1-CB 3.98Å; V19-R79 HydrophobicContact CG1-CG 4.24Å; V19-R79 PolarHBondContact O-NE 2.91Å
20	L	82.9	Confident	74.5	Confident	9 Å²	9	79.2 Å²	79.2	5%	0.047	41%	0.412	C	S	.	.			trans	-72.1	143	-179.3	-60.6	177	0	0	0	112.5	V18 E24 K25 I28 Y45 V47 I55	V18-L20 HydrophobicContact CG1-CD2 4.04Å; L20-E24 WeakPolarHBondContact CA-OE2 3.46Å; L20-E24 HydrophobicContact CB-CB 4.29Å; L20-E24 HydrophobicContact CD2-CB 4.28Å; L20-K25 HydrophobicContact CB-CG 4.04Å; L20-K25 HydrophobicContact CD1-CG 4.48Å; L20-K25 WeakPolarHBondContact O-CE 3.35Å; L20-I28 HydrophobicContact CD1-CD1 3.51Å; L20-Y45 HydrophobicContact CD2-CD1 4.27Å; L20-V47 HydrophobicContact CD1-CG1 3.65Å; L20-V47 HydrophobicContact CD2-CG1 4.2Å; L20-V47 HydrophobicContact CG-CG1 4Å; L20-I55 HydrophobicContact CD1-CD1 3.64Å
21	T	84	Confident	76.8	Confident	10 Å²	10	75.3 Å²	75.3	6%	0.061	38%	0.38	C	S	.	.			trans	-69.8	160.6	168.1	62.9	0	0	0	0	111.3	K23 E24 K25 E76 R78 R79	T21-K23 PolarHBondContact O-N 3.4Å; T21-E24 WeakPolarHBondContact CB-OE2 3.49Å; T21-E24 PolarHBondContact N-OE2 3.14Å; T21-E24 PolarHBondContact O-N 3.12Å; T21-E24 WeakPolarHBondContact OG1-CB 3.31Å; T21-E24 VanDerWaalsContact OG1-CD 3.23Å; T21-E24 WeakPolarHBondContact OG1-CG 3.41Å; T21-E24 PolarHBondContact OG1-N 3.47Å; T21-E24 VanDerWaalsContact OG1-N 3.09Å; T21-E24 PolarHBondContact OG1-OE2 3.47Å; T21-K25 VanDerWaalsContact O-CG 3.26Å; T21-K25 WeakPolarHBondContact O-CG 3.33Å; T21-K25 PolarHBondContact O-N 3.18Å; T21-E76 WeakPolarHBondContact CB-O 3.46Å; T21-R78 CarbonylContact C-O 3.42Å; T21-R78 VanDerWaalsContact CA-O 3.22Å; T21-R78 WeakPolarHBondContact CA-O 3.42Å; T21-R79 HydrophobicContact CG2-CG 4.13Å
22	L	80.8	Confident	78.9	Confident	5 Å²	5	72.2 Å²	72.2	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-34.8	174.4	-61.4	-175.2	0	0	0	110.7	K25 I26 L62 F65 R78 L81	L22-K25 HydrophobicContact CD2-CD 4.33Å; L22-K25 PolarHBondContact O-N 3.46Å; L22-I26 WeakPolarHBondContact O-CG1 3.45Å; L22-I26 PolarHBondContact O-N 3.23Å; L22-L62 HydrophobicContact CD2-CD2 3.71Å; L22-F65 HydrophobicContact CD1-CD1 4.06Å; L22-F65 HydrophobicContact CD1-CE1 4.1Å; L22-R78 HydrophobicContact CD1-CB 4.15Å; L22-R78 HydrophobicContact CD1-CG 3.9Å; L22-R78 HydrophobicContact CG-CB 4.39Å; L22-R78 HydrophobicContact CG-CG 4.39Å; L22-R78 WeakPolarHBondContact CG-O 3.34Å; L22-R78 PolarHBondContact N-O 3.09Å; L22-L81 HydrophobicContact CD1-CD2 4.17Å; L22-L81 HydrophobicContact CD2-CD2 4.06Å; L22-L81 HydrophobicContact CD2-CG 4.1Å
23	K	83.3	Confident	80.9	Confident	76 Å²	76	74.2 Å²	74.2	33%	0.33	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-51.2	173.7	-174.2	175.2	-176.6	172.6	0	111.6	T21 K25 I26 D27 E76	T21-K23 PolarHBondContact O-N 3.4Å; K23-K25 VanDerWaalsContact C-N 3.29Å; K23-K25 PolarHBondContact O-N 3.06Å; K23-I26 PolarHBondContact O-N 2.94Å; K23-D27 WeakPolarHBondContact O-CB 3.43Å; K23-D27 PolarHBondContact O-N 3.47Å; K23-E76 HydrophobicContact CD-CB 4.19Å; K23-E76 HydrophobicContact CD-CG 4.23Å; K23-E76 IonicContact NZ-OE1 2.74Å; K23-E76 PolarHBondContact NZ-OE1 3.48Å
24	E	87.1	Confident	82.4	Confident	72 Å²	72	71 Å²	71	34%	0.336	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-37	176.7	-71.3	160.8	149.9	0	0	111.9	L20 T21 D27 I28 Y45	L20-E24 WeakPolarHBondContact CA-OE2 3.46Å; L20-E24 HydrophobicContact CB-CB 4.29Å; L20-E24 HydrophobicContact CD2-CB 4.28Å; T21-E24 WeakPolarHBondContact CB-OE2 3.49Å; T21-E24 PolarHBondContact N-OE2 3.14Å; T21-E24 PolarHBondContact O-N 3.12Å; T21-E24 WeakPolarHBondContact OG1-CB 3.31Å; T21-E24 VanDerWaalsContact OG1-CD 3.23Å; T21-E24 WeakPolarHBondContact OG1-CG 3.41Å; T21-E24 PolarHBondContact OG1-N 3.47Å; T21-E24 VanDerWaalsContact OG1-N 3.09Å; T21-E24 PolarHBondContact OG1-OE2 3.47Å; E24-D27 PolarHBondContact O-N 3.14Å; E24-I28 WeakPolarHBondContact O-CB 3.49Å; E24-I28 WeakPolarHBondContact O-CD1 3.42Å; E24-I28 WeakPolarHBondContact O-CG1 3.37Å; E24-I28 PolarHBondContact O-N 3.45Å; E24-Y45 HydrophobicContact CB-CD1 4.28Å; E24-Y45 HydrophobicContact CB-CE1 4.17Å; E24-Y45 HydrophobicContact CG-CD1 4.42Å; E24-Y45 HydrophobicContact CG-CE1 4.24Å
25	K	88.4	Confident	83.7	Confident	45 Å²	45	64.6 Å²	64.6	20%	0.196	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-40.3	176	-68.8	171.5	-171.5	173.8	0	112.5	L20 T21 L22 K23 C29 I55 L62 R79	L20-K25 HydrophobicContact CB-CG 4.04Å; L20-K25 HydrophobicContact CD1-CG 4.48Å; L20-K25 WeakPolarHBondContact O-CE 3.35Å; T21-K25 VanDerWaalsContact O-CG 3.26Å; T21-K25 WeakPolarHBondContact O-CG 3.33Å; T21-K25 PolarHBondContact O-N 3.18Å; L22-K25 HydrophobicContact CD2-CD 4.33Å; L22-K25 PolarHBondContact O-N 3.46Å; K23-K25 VanDerWaalsContact C-N 3.29Å; K23-K25 PolarHBondContact O-N 3.06Å; K25-C29 PolarHBondContact O-N 3.14Å; K25-C29 VanDerWaalsContact O-N 3.09Å; K25-C29 PolarHBondContact O-SG 3.41Å; K25-C29 VanDerWaalsContact O-SG 3.38Å; K25-I55 HydrophobicContact CB-CG2 4.04Å; K25-I55 HydrophobicContact CG-CD1 4.03Å; K25-I55 HydrophobicContact CG-CG1 4.06Å; K25-I55 HydrophobicContact CG-CG2 4.43Å; K25-I55 WeakPolarHBondContact O-CG2 3.39Å; K25-L62 HydrophobicContact CB-CD1 3.93Å; K25-L62 HydrophobicContact CB-CD2 4.37Å; K25-L62 HydrophobicContact CD-CD2 4.26Å; K25-R79 PolarHBondContact NZ-O 3.3Å
26	I	85.8	Confident	84.8	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.046	29%	0.294	C	S	.	.	H	α-helix	trans	-68.8	-40.2	176.2	-69.4	168.2	0	0	0	110.8	L22 K23 C29 T30 L62 L63 F66 I418	L22-I26 WeakPolarHBondContact O-CG1 3.45Å; L22-I26 PolarHBondContact O-N 3.23Å; K23-I26 PolarHBondContact O-N 2.94Å; I26-C29 WeakPolarHBondContact O-CB 3.4Å; I26-C29 PolarHBondContact O-N 3.04Å; I26-T30 PolarHBondContact O-N 2.91Å; I26-T30 PolarHBondContact O-OG1 2.87Å; I26-L62 HydrophobicContact CG1-CB 4.24Å; I26-L63 HydrophobicContact CG2-CD2 4.48Å; I26-F66 HydrophobicContact CD1-CB 4.05Å; I26-F66 HydrophobicContact CD1-CD2 3.6Å; I26-F66 HydrophobicContact CD1-CE2 4.39Å; I26-F66 HydrophobicContact CD1-CG 3.9Å; I26-I418 HydrophobicContact CG2-CD1 4.16Å
27	D	88.7	Confident	85.7	Confident	46 Å²	46	54.9 Å²	54.9	25%	0.246	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-46.4	176	-172.9	37.7	0	0	0	111.2	K23 E24 C29 T30 R31 Y45	K23-D27 WeakPolarHBondContact O-CB 3.43Å; K23-D27 PolarHBondContact O-N 3.47Å; E24-D27 PolarHBondContact O-N 3.14Å; D27-C29 VanDerWaalsContact C-N 3.34Å; D27-C29 PolarHBondContact O-N 3.37Å; D27-T30 PolarHBondContact O-N 3.39Å; D27-T30 VanDerWaalsContact O-N 3.14Å; D27-R31 WeakPolarHBondContact O-CB 3.21Å; D27-R31 VanDerWaalsContact O-CG 3.3Å; D27-R31 WeakPolarHBondContact O-CG 3.39Å; D27-R31 PolarHBondContact O-N 3.32Å; D27-Y45 PolarHBondContact OD2-OH 3.12Å
28	I	89.8	Confident	86.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.2	-47.4	171.2	-73.2	165.7	0	0	0	111.4	L20 E24 T30 R31 L32 Y45 L52 I55	L20-I28 HydrophobicContact CD1-CD1 3.51Å; E24-I28 WeakPolarHBondContact O-CB 3.49Å; E24-I28 WeakPolarHBondContact O-CD1 3.42Å; E24-I28 WeakPolarHBondContact O-CG1 3.37Å; E24-I28 PolarHBondContact O-N 3.45Å; I28-T30 VanDerWaalsContact C-N 3.33Å; I28-T30 PolarHBondContact O-N 3Å; I28-R31 PolarHBondContact O-N 3Å; I28-L32 HydrophobicContact CG2-CD1 3.8Å; I28-L32 HydrophobicContact CG2-CG 4.32Å; I28-L32 WeakPolarHBondContact O-CB 3.43Å; I28-L32 WeakPolarHBondContact O-CG 3.45Å; I28-L32 PolarHBondContact O-N 3.34Å; I28-Y45 HydrophobicContact CD1-CD1 3.94Å; I28-Y45 HydrophobicContact CD1-CD2 4.02Å; I28-Y45 HydrophobicContact CD1-CE1 4.34Å; I28-Y45 HydrophobicContact CD1-CE2 4.43Å; I28-Y45 HydrophobicContact CD1-CG 3.77Å; I28-Y45 HydrophobicContact CG1-CD1 4.13Å; I28-Y45 HydrophobicContact CG1-CD2 3.76Å; I28-Y45 HydrophobicContact CG1-CE1 4.06Å; I28-Y45 HydrophobicContact CG1-CE2 3.72Å; I28-Y45 HydrophobicContact CG1-CG 3.97Å; I28-L52 HydrophobicContact CD1-CD2 4.24Å; I28-L52 HydrophobicContact CG2-CD2 3.5Å; I28-L52 VanDerWaalsContact CG2-CD2 3.5Å; I28-I55 HydrophobicContact CB-CG2 4.38Å; I28-I55 HydrophobicContact CD1-CD1 4.03Å; I28-I55 HydrophobicContact CG2-CG2 4.01Å
29	C	87.9	Confident	86.9	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.034	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-44.1	177.2	-74.7	0	0	0	0	112	K25 I26 D27 L32 E33 K59	K25-C29 PolarHBondContact O-N 3.14Å; K25-C29 VanDerWaalsContact O-N 3.09Å; K25-C29 PolarHBondContact O-SG 3.41Å; K25-C29 VanDerWaalsContact O-SG 3.38Å; I26-C29 WeakPolarHBondContact O-CB 3.4Å; I26-C29 PolarHBondContact O-N 3.04Å; D27-C29 VanDerWaalsContact C-N 3.34Å; D27-C29 PolarHBondContact O-N 3.37Å; C29-L32 PolarHBondContact O-N 2.93Å; C29-E33 WeakPolarHBondContact O-CG 3.37Å; C29-E33 PolarHBondContact O-N 3Å; C29-E33 VanDerWaalsContact O-N 3.13Å; C29-K59 HydrophobicContact CB-CD 4.31Å; C29-K59 HydrophobicContact CB-CG 3.99Å
30	T	87.8	Confident	87.2	Confident	13 Å²	13	51.1 Å²	51.1	8%	0.08	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-43.3	-179.1	-53.6	0	0	0	0	111.1	I26 D27 I28 E33 K34	I26-T30 PolarHBondContact O-N 2.91Å; I26-T30 PolarHBondContact O-OG1 2.87Å; D27-T30 PolarHBondContact O-N 3.39Å; D27-T30 VanDerWaalsContact O-N 3.14Å; I28-T30 VanDerWaalsContact C-N 3.33Å; I28-T30 PolarHBondContact O-N 3Å; T30-E33 PolarHBondContact O-N 3.43Å; T30-K34 WeakPolarHBondContact O-CG 3.39Å; T30-K34 PolarHBondContact O-N 3.26Å
31	R	89.4	Confident	87.5	Confident	37 Å²	37	50.7 Å²	50.7	14%	0.14	26%	0.262	C	S	.	.	H	α-helix	trans	-70.6	-35.5	179.1	-68	177.9	67.1	-176.9	-3.2	112.5	D27 I28 E33 K34 G35 E36 L41 E44 Y45	D27-R31 WeakPolarHBondContact O-CB 3.21Å; D27-R31 VanDerWaalsContact O-CG 3.3Å; D27-R31 WeakPolarHBondContact O-CG 3.39Å; D27-R31 PolarHBondContact O-N 3.32Å; I28-R31 PolarHBondContact O-N 3Å; R31-E33 VanDerWaalsContact C-N 3.26Å; R31-E33 PolarHBondContact O-N 3.12Å; R31-K34 PolarHBondContact O-N 3.43Å; R31-G35 PolarHBondContact O-N 3.09Å; R31-E36 HydrophobicContact CB-CG 4.41Å; R31-E36 WeakPolarHBondContact CB-OE1 3.48Å; R31-E36 WeakPolarHBondContact CG-OE1 3.44Å; R31-E36 IonicContact CZ-OE1 2.76Å; R31-E36 IonicContact CZ-OE2 2.72Å; R31-E36 VanDerWaalsContact NE-CD 3.27Å; R31-E36 IonicContact NE-OE1 2.56Å; R31-E36 PolarHBondContact NE-OE1 3.18Å; R31-E36 IonicContact NE-OE2 3.7Å; R31-E36 PolarHBondContact NE-OE2 3.01Å; R31-E36 IonicContact NH2-OE1 2.71Å; R31-E36 IonicContact NH2-OE2 3.24Å; R31-E36 PolarHBondContact NH2-OE2 3.33Å; R31-E36 WeakPolarHBondContact O-CB 3.49Å; R31-E36 PolarHBondContact O-N 2.78Å; R31-E36 VanDerWaalsContact O-N 3.12Å; R31-L41 HydrophobicContact CB-CD1 4.39Å; R31-L41 HydrophobicContact CB-CD2 4.03Å; R31-E44 IonicContact CZ-OE1 3.92Å; R31-E44 IonicContact CZ-OE2 3.87Å; R31-E44 VanDerWaalsContact CZ-OE2 3.24Å; R31-E44 IonicContact NH1-OE1 3.78Å; R31-E44 PolarHBondContact NH1-OE1 3.43Å; R31-E44 IonicContact NH1-OE2 3.39Å; R31-E44 PolarHBondContact NH1-OE2 2.86Å; R31-E44 IonicContact NH2-OE1 3.52Å; R31-E44 IonicContact NH2-OE2 3.7Å; R31-E44 PolarHBondContact NH2-OE2 2.89Å; R31-Y45 PolarHBondContact NH1-OH 3.3Å
32	L	88.6	Confident	87.7	Confident	16 Å²	16	51.9 Å²	51.9	8%	0.084	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-32.1	171	-75.7	172.3	0	0	0	112.7	I28 C29 G35 R38 L41 R56	I28-L32 HydrophobicContact CG2-CD1 3.8Å; I28-L32 HydrophobicContact CG2-CG 4.32Å; I28-L32 WeakPolarHBondContact O-CB 3.43Å; I28-L32 WeakPolarHBondContact O-CG 3.45Å; I28-L32 PolarHBondContact O-N 3.34Å; C29-L32 PolarHBondContact O-N 2.93Å; L32-G35 PolarHBondContact O-N 3.37Å; L32-R38 HydrophobicContact CD2-CG 3.73Å; L32-L41 HydrophobicContact CD2-CD1 3.52Å; L32-L41 HydrophobicContact CG-CD1 3.65Å; L32-R56 HydrophobicContact CD1-CB 4.37Å
33	E	86.5	Confident	88	Confident	113 Å²	113	58.7 Å²	58.7	53%	0.528	30%	0.299	S	S	.	.	H	α-helix	trans	-78	-32.4	177.1	-73.9	179.2	161.7	0	0	112.9	C29 T30 R31 G35 K59	C29-E33 WeakPolarHBondContact O-CG 3.37Å; C29-E33 PolarHBondContact O-N 3Å; C29-E33 VanDerWaalsContact O-N 3.13Å; T30-E33 PolarHBondContact O-N 3.43Å; R31-E33 VanDerWaalsContact C-N 3.26Å; R31-E33 PolarHBondContact O-N 3.12Å; E33-G35 PolarHBondContact O-N 3.04Å; E33-G35 VanDerWaalsContact O-N 3.12Å; E33-K59 WeakPolarHBondContact OE1-CD 3.37Å; E33-K59 WeakPolarHBondContact OE1-CE 3.49Å; E33-K59 IonicContact OE1-NZ 3.09Å; E33-K59 PolarHBondContact OE1-NZ 3.46Å; E33-K59 WeakPolarHBondContact OE2-CE 3.36Å; E33-K59 IonicContact OE2-NZ 2.72Å; E33-K59 PolarHBondContact OE2-NZ 3.38Å
34	K	87.8	Confident	88.2	Confident	126 Å²	126	60.5 Å²	60.5	55%	0.548	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	0.7	169.6	-68.7	175.7	178.8	-178.6	0	113.6	T30 R31	T30-K34 WeakPolarHBondContact O-CG 3.39Å; T30-K34 PolarHBondContact O-N 3.26Å; R31-K34 PolarHBondContact O-N 3.43Å
35	G	86.7	Confident	88.2	Confident	66 Å²	66	58.2 Å²	58.2	68%	0.68	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	14.5	175.9	0	0	0	0	0	114.5	R31 L32 E33	R31-G35 PolarHBondContact O-N 3.09Å; L32-G35 PolarHBondContact O-N 3.37Å; E33-G35 PolarHBondContact O-N 3.04Å; E33-G35 VanDerWaalsContact O-N 3.12Å
36	E	89.9	Confident	88.1	Confident	64 Å²	64	59.6 Å²	59.6	30%	0.299	31%	0.307	S	S	.	.			trans	-63.9	150.9	178.8	-71.2	-172.9	-140	0	0	112.9	R31 R38	R31-E36 HydrophobicContact CB-CG 4.41Å; R31-E36 WeakPolarHBondContact CB-OE1 3.48Å; R31-E36 WeakPolarHBondContact CG-OE1 3.44Å; R31-E36 IonicContact CZ-OE1 2.76Å; R31-E36 IonicContact CZ-OE2 2.72Å; R31-E36 VanDerWaalsContact NE-CD 3.27Å; R31-E36 IonicContact NE-OE1 2.56Å; R31-E36 PolarHBondContact NE-OE1 3.18Å; R31-E36 IonicContact NE-OE2 3.7Å; R31-E36 PolarHBondContact NE-OE2 3.01Å; R31-E36 IonicContact NH2-OE1 2.71Å; R31-E36 IonicContact NH2-OE2 3.24Å; R31-E36 PolarHBondContact NH2-OE2 3.33Å; R31-E36 WeakPolarHBondContact O-CB 3.49Å; R31-E36 PolarHBondContact O-N 2.78Å; R31-E36 VanDerWaalsContact O-N 3.12Å; E36-R38 PolarHBondContact O-N 2.93Å
37	S	90.4	Very high	88.2	Confident	73 Å²	73	59.6 Å²	59.6	51%	0.51	31%	0.307	S	S	.	.			trans	-65.2	123.1	-179.6	178	0	0	0	0	111.5	K39 A40 L41	S37-K39 PolarHBondContact O-N 3.15Å; S37-K39 VanDerWaalsContact O-N 3.14Å; S37-K39 PolarHBondContact OG-N 2.88Å; S37-A40 WeakPolarHBondContact O-CB 3.24Å; S37-A40 PolarHBondContact O-N 3.36Å; S37-L41 PolarHBondContact O-N 3.11Å; S37-L41 VanDerWaalsContact O-N 3.16Å
38	R	88.8	Confident	88.2	Confident	100 Å²	100	58.2 Å²	58.2	38%	0.377	30%	0.304	S	S	.	.	H	α-helix	trans	-53.3	-35.3	173.4	-67	175.5	-179	79.1	-4	112	L32 E36 L41 M42 M49 L52	L32-R38 HydrophobicContact CD2-CG 3.73Å; E36-R38 PolarHBondContact O-N 2.93Å; R38-L41 PolarHBondContact O-N 2.95Å; R38-M42 VanDerWaalsContact O-CG 3.26Å; R38-M42 WeakPolarHBondContact O-CG 3.48Å; R38-M42 PolarHBondContact O-N 3.46Å; R38-M49 HydrophobicContact CB-CE 4.43Å; R38-M49 HydrophobicContact CB-SD 4.26Å; R38-L52 HydrophobicContact CB-CD1 4.32Å; R38-L52 WeakPolarHBondContact O-CD1 3.47Å
39	K	88.3	Confident	87.9	Confident	146 Å²	146	61.6 Å²	61.6	64%	0.635	32%	0.32	S	S	*	.	H	α-helix	trans	-67.2	-36.6	179	-168	-179.6	178.8	-175.4	0	112	S37 Q43	S37-K39 PolarHBondContact O-N 3.15Å; S37-K39 VanDerWaalsContact O-N 3.14Å; S37-K39 PolarHBondContact OG-N 2.88Å; K39-Q43 WeakPolarHBondContact O-CG 3.24Å; K39-Q43 PolarHBondContact O-N 3.36Å
40	A	87.9	Confident	87.8	Confident	43 Å²	43	65 Å²	65	36%	0.355	35%	0.345	S	S	.	.	H	α-helix	trans	-67.4	-46.7	175.6	0	0	0	0	0	110.8	S37 M42 Q43 E44	S37-A40 WeakPolarHBondContact O-CB 3.24Å; S37-A40 PolarHBondContact O-N 3.36Å; A40-M42 VanDerWaalsContact C-N 3.31Å; A40-M42 PolarHBondContact O-N 3.29Å; A40-Q43 PolarHBondContact O-N 3.39Å; A40-Q43 VanDerWaalsContact O-N 3.07Å; A40-E44 WeakPolarHBondContact O-CB 3.48Å; A40-E44 PolarHBondContact O-N 2.96Å
41	L	89.1	Confident	87.7	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.6	-36.1	177.4	-62.6	174.5	0	0	0	112.5	R31 L32 S37 R38 Q43 Y45 L52	R31-L41 HydrophobicContact CB-CD1 4.39Å; R31-L41 HydrophobicContact CB-CD2 4.03Å; L32-L41 HydrophobicContact CD2-CD1 3.52Å; L32-L41 HydrophobicContact CG-CD1 3.65Å; S37-L41 PolarHBondContact O-N 3.11Å; S37-L41 VanDerWaalsContact O-N 3.16Å; R38-L41 PolarHBondContact O-N 2.95Å; L41-Q43 VanDerWaalsContact C-N 3.32Å; L41-Q43 PolarHBondContact O-N 2.98Å; L41-Y45 HydrophobicContact CB-CD2 4.43Å; L41-Y45 HydrophobicContact CD2-CD2 4.33Å; L41-Y45 HydrophobicContact CD2-CE2 3.78Å; L41-Y45 WeakPolarHBondContact O-CD2 3.49Å; L41-Y45 PolarHBondContact O-N 2.9Å; L41-L52 HydrophobicContact CB-CD1 4.21Å; L41-L52 HydrophobicContact CB-CD2 4.43Å
42	M	89	Confident	87.7	Confident	34 Å²	34	65.3 Å²	65.3	17%	0.167	35%	0.351	C	S	.	.	H	α-helix	trans	-61.3	-40.1	173.2	-73.9	173.3	72.4	0	0	113	R38 A40 N46 V47 M49 L52	R38-M42 VanDerWaalsContact O-CG 3.26Å; R38-M42 WeakPolarHBondContact O-CG 3.48Å; R38-M42 PolarHBondContact O-N 3.46Å; A40-M42 VanDerWaalsContact C-N 3.31Å; A40-M42 PolarHBondContact O-N 3.29Å; M42-N46 CarbonylContact O-C 3.59Å; M42-N46 WeakPolarHBondContact O-CA 3.39Å; M42-N46 PolarHBondContact O-N 2.9Å; M42-V47 PolarHBondContact O-N 3.29Å; M42-V47 VanDerWaalsContact O-N 3.08Å; M42-M49 HydrophobicContact CE-CB 4.48Å; M42-M49 HydrophobicContact CE-CG 3.74Å; M42-M49 HydrophobicContact CE-SD 4.34Å; M42-M49 HydrophobicContact CG-SD 4.13Å; M42-M49 HydrophobicContact SD-CB 4.4Å; M42-M49 HydrophobicContact SD-CG 3.37Å; M42-M49 WeakPolarHBondContact SD-CG 3.4Å; M42-M49 HydrophobicContact SD-SD 3.18Å; M42-L52 HydrophobicContact CG-CD1 3.61Å; M42-L52 HydrophobicContact CG-CG 4.46Å
43	Q	85.9	Confident	87.6	Confident	148 Å²	148	70.7 Å²	70.7	69%	0.692	37%	0.37	S	S	*	.	H	α-helix	trans	-72.7	-43.7	-179.3	-73.1	179.6	-31.5	0	0	110.8	K39 A40 L41 N46	K39-Q43 WeakPolarHBondContact O-CG 3.24Å; K39-Q43 PolarHBondContact O-N 3.36Å; A40-Q43 PolarHBondContact O-N 3.39Å; A40-Q43 VanDerWaalsContact O-N 3.07Å; L41-Q43 VanDerWaalsContact C-N 3.32Å; L41-Q43 PolarHBondContact O-N 2.98Å; Q43-N46 PolarHBondContact O-N 3.24Å
44	E	88.5	Confident	87.6	Confident	115 Å²	115	69.6 Å²	69.6	54%	0.537	37%	0.368	S	S	.	.	H	α-helix	trans	-67	-50.1	-177.6	-172.8	176.5	163.2	0	0	112.8	R31 A40 N46	R31-E44 IonicContact CZ-OE1 3.92Å; R31-E44 IonicContact CZ-OE2 3.87Å; R31-E44 VanDerWaalsContact CZ-OE2 3.24Å; R31-E44 IonicContact NH1-OE1 3.78Å; R31-E44 PolarHBondContact NH1-OE1 3.43Å; R31-E44 IonicContact NH1-OE2 3.39Å; R31-E44 PolarHBondContact NH1-OE2 2.86Å; R31-E44 IonicContact NH2-OE1 3.52Å; R31-E44 IonicContact NH2-OE2 3.7Å; R31-E44 PolarHBondContact NH2-OE2 2.89Å; A40-E44 WeakPolarHBondContact O-CB 3.48Å; A40-E44 PolarHBondContact O-N 2.96Å; E44-N46 VanDerWaalsContact C-N 3.3Å
45	Y	86.3	Confident	87.6	Confident	24 Å²	24	64.1 Å²	64.1	9%	0.094	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-0.5	179.9	-62	-90.2	0	0	0	112.8	L20 E24 D27 I28 R31 L41 V47	L20-Y45 HydrophobicContact CD2-CD1 4.27Å; E24-Y45 HydrophobicContact CB-CD1 4.28Å; E24-Y45 HydrophobicContact CB-CE1 4.17Å; E24-Y45 HydrophobicContact CG-CD1 4.42Å; E24-Y45 HydrophobicContact CG-CE1 4.24Å; D27-Y45 PolarHBondContact OD2-OH 3.12Å; I28-Y45 HydrophobicContact CD1-CD1 3.94Å; I28-Y45 HydrophobicContact CD1-CD2 4.02Å; I28-Y45 HydrophobicContact CD1-CE1 4.34Å; I28-Y45 HydrophobicContact CD1-CE2 4.43Å; I28-Y45 HydrophobicContact CD1-CG 3.77Å; I28-Y45 HydrophobicContact CG1-CD1 4.13Å; I28-Y45 HydrophobicContact CG1-CD2 3.76Å; I28-Y45 HydrophobicContact CG1-CE1 4.06Å; I28-Y45 HydrophobicContact CG1-CE2 3.72Å; I28-Y45 HydrophobicContact CG1-CG 3.97Å; R31-Y45 PolarHBondContact NH1-OH 3.3Å; L41-Y45 HydrophobicContact CB-CD2 4.43Å; L41-Y45 HydrophobicContact CD2-CD2 4.33Å; L41-Y45 HydrophobicContact CD2-CE2 3.78Å; L41-Y45 WeakPolarHBondContact O-CD2 3.49Å; L41-Y45 PolarHBondContact O-N 2.9Å; Y45-V47 WeakPolarHBondContact O-CG1 3.34Å; Y45-V47 PolarHBondContact O-N 2.88Å
46	N	87.5	Confident	87.5	Confident	74 Å²	74	67 Å²	67	40%	0.396	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	51.2	-177.5	-173.3	30.7	0	0	0	112.9	V18 M42 Q43 E44	V18-N46 HydrophobicContact CG2-CB 4.13Å; V18-N46 WeakPolarHBondContact CG2-ND2 3.28Å; M42-N46 CarbonylContact O-C 3.59Å; M42-N46 WeakPolarHBondContact O-CA 3.39Å; M42-N46 PolarHBondContact O-N 2.9Å; Q43-N46 PolarHBondContact O-N 3.24Å; E44-N46 VanDerWaalsContact C-N 3.3Å
47	V	87.4	Confident	87.3	Confident	8 Å²	8	67.7 Å²	67.7	5%	0.048	35%	0.352	C	S	.	.			trans	-120.7	161.5	-177.7	-66.4	0	0	0	0	113.7	R15 L20 M42 Y45 T51 L52	R15-V47 PolarHBondContact NH1-O 3.41Å; L20-V47 HydrophobicContact CD1-CG1 3.65Å; L20-V47 HydrophobicContact CD2-CG1 4.2Å; L20-V47 HydrophobicContact CG-CG1 4Å; M42-V47 PolarHBondContact O-N 3.29Å; M42-V47 VanDerWaalsContact O-N 3.08Å; Y45-V47 WeakPolarHBondContact O-CG1 3.34Å; Y45-V47 PolarHBondContact O-N 2.88Å; V47-T51 HydrophobicContact CB-CG2 4.16Å; V47-T51 HydrophobicContact CG1-CG2 4.24Å; V47-L52 HydrophobicContact CG2-CD2 3.76Å; V47-L52 HydrophobicContact CG2-CG 4.01Å
48	G	87.8	Confident	87.1	Confident	17 Å²	17	69.1 Å²	69.1	18%	0.175	35%	0.35	C	S	.	.			trans	-75	157	174.9	0	0	0	0	0	113.1	S50 T51 L52	G48-S50 VanDerWaalsContact C-N 3.26Å; G48-S50 PolarHBondContact O-N 3.4Å; G48-T51 WeakPolarHBondContact O-CB 3.49Å; G48-T51 PolarHBondContact O-N 3.08Å; G48-L52 PolarHBondContact O-N 2.93Å
49	M	85.1	Confident	86.8	Confident	71 Å²	71	67 Å²	67	35%	0.35	34%	0.344	S	S	.	.	H	α-helix	trans	-56.7	-43.4	170.5	-83.6	-61.1	-72.3	0	0	111.2	R38 M42 T51 L52 Y53	R38-M49 HydrophobicContact CB-CE 4.43Å; R38-M49 HydrophobicContact CB-SD 4.26Å; M42-M49 HydrophobicContact CE-CB 4.48Å; M42-M49 HydrophobicContact CE-CG 3.74Å; M42-M49 HydrophobicContact CE-SD 4.34Å; M42-M49 HydrophobicContact CG-SD 4.13Å; M42-M49 HydrophobicContact SD-CB 4.4Å; M42-M49 HydrophobicContact SD-CG 3.37Å; M42-M49 WeakPolarHBondContact SD-CG 3.4Å; M42-M49 HydrophobicContact SD-SD 3.18Å; M49-T51 VanDerWaalsContact C-N 3.31Å; M49-T51 PolarHBondContact O-N 3.3Å; M49-L52 PolarHBondContact O-N 3.1Å; M49-Y53 HydrophobicContact CE-CE2 3.7Å; M49-Y53 WeakPolarHBondContact O-CD2 3.49Å; M49-Y53 PolarHBondContact O-N 3.5Å; M49-Y53 VanDerWaalsContact O-N 3.15Å
50	S	84.6	Confident	86.4	Confident	77 Å²	77	63.7 Å²	63.7	54%	0.538	34%	0.344	S	S	.	.	H	α-helix	trans	-57.5	-43.9	176.6	49.3	0	0	0	0	111.8	G48 L52 Y53 D54	G48-S50 VanDerWaalsContact C-N 3.26Å; G48-S50 PolarHBondContact O-N 3.4Å; S50-L52 VanDerWaalsContact C-N 3.33Å; S50-L52 PolarHBondContact O-N 2.88Å; S50-Y53 WeakPolarHBondContact O-CB 3.47Å; S50-Y53 PolarHBondContact O-N 3.31Å; S50-Y53 VanDerWaalsContact O-N 3.11Å; S50-D54 VanDerWaalsContact O-CG 3.25Å; S50-D54 PolarHBondContact O-N 2.99Å
51	T	86.8	Confident	86	Confident	52 Å²	52	66.7 Å²	66.7	32%	0.319	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-38.9	178	-49.2	0	0	0	0	112.5	V47 G48 M49 D54 I55	V47-T51 HydrophobicContact CB-CG2 4.16Å; V47-T51 HydrophobicContact CG1-CG2 4.24Å; G48-T51 WeakPolarHBondContact O-CB 3.49Å; G48-T51 PolarHBondContact O-N 3.08Å; M49-T51 VanDerWaalsContact C-N 3.31Å; M49-T51 PolarHBondContact O-N 3.3Å; T51-D54 PolarHBondContact O-N 3.24Å; T51-I55 HydrophobicContact CG2-CD1 3.9Å; T51-I55 HydrophobicContact CG2-CG1 4.49Å; T51-I55 WeakPolarHBondContact O-CB 3.3Å; T51-I55 WeakPolarHBondContact O-CD1 3.44Å; T51-I55 WeakPolarHBondContact O-CG1 3.28Å; T51-I55 PolarHBondContact O-N 3.35Å
52	L	88.4	Confident	85.5	Confident	5 Å²	5	67 Å²	67	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-65.7	-39.5	174.8	-68.9	-177.8	0	0	0	112.1	I28 R38 L41 M42 V47 G48 M49 S50 R56	I28-L52 HydrophobicContact CD1-CD2 4.24Å; I28-L52 HydrophobicContact CG2-CD2 3.5Å; I28-L52 VanDerWaalsContact CG2-CD2 3.5Å; R38-L52 HydrophobicContact CB-CD1 4.32Å; R38-L52 WeakPolarHBondContact O-CD1 3.47Å; L41-L52 HydrophobicContact CB-CD1 4.21Å; L41-L52 HydrophobicContact CB-CD2 4.43Å; M42-L52 HydrophobicContact CG-CD1 3.61Å; M42-L52 HydrophobicContact CG-CG 4.46Å; V47-L52 HydrophobicContact CG2-CD2 3.76Å; V47-L52 HydrophobicContact CG2-CG 4.01Å; G48-L52 PolarHBondContact O-N 2.93Å; M49-L52 PolarHBondContact O-N 3.1Å; S50-L52 VanDerWaalsContact C-N 3.33Å; S50-L52 PolarHBondContact O-N 2.88Å; L52-R56 WeakPolarHBondContact O-CB 3.41Å; L52-R56 PolarHBondContact O-N 2.87Å
53	Y	87.4	Confident	84.9	Confident	128 Å²	128	67.7 Å²	67.7	50%	0.502	36%	0.356	S	S	.	.	H	α-helix	trans	-64	-44.8	175	-77.2	-67	0	0	0	111.8	M49 S50 I55 R56 A57	M49-Y53 HydrophobicContact CE-CE2 3.7Å; M49-Y53 WeakPolarHBondContact O-CD2 3.49Å; M49-Y53 PolarHBondContact O-N 3.5Å; M49-Y53 VanDerWaalsContact O-N 3.15Å; S50-Y53 WeakPolarHBondContact O-CB 3.47Å; S50-Y53 PolarHBondContact O-N 3.31Å; S50-Y53 VanDerWaalsContact O-N 3.11Å; Y53-I55 PolarHBondContact O-N 3.48Å; Y53-R56 PolarHBondContact O-N 3.09Å; Y53-A57 WeakPolarHBondContact O-CB 3.22Å; Y53-A57 PolarHBondContact O-N 2.89Å
54	D	85.4	Confident	84.5	Confident	91 Å²	91	70.4 Å²	70.4	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-63.3	-41.7	178	-62.4	-25.2	0	0	0	111.8	S50 T51 A57 H58	S50-D54 VanDerWaalsContact O-CG 3.25Å; S50-D54 PolarHBondContact O-N 2.99Å; T51-D54 PolarHBondContact O-N 3.24Å; D54-A57 PolarHBondContact O-N 3.17Å; D54-H58 PolarHBondContact O-N 3.23Å; D54-H58 PolarHBondContact O-ND1 3Å
55	I	87.6	Confident	83.6	Confident	11 Å²	11	66.4 Å²	66.4	6%	0.056	34%	0.341	C	S	.	.	H	α-helix	trans	-61.8	-45.7	176.6	-72.5	165.9	0	0	0	110.5	L20 K25 I28 T51 Y53 H58 K59	L20-I55 HydrophobicContact CD1-CD1 3.64Å; K25-I55 HydrophobicContact CB-CG2 4.04Å; K25-I55 HydrophobicContact CG-CD1 4.03Å; K25-I55 HydrophobicContact CG-CG1 4.06Å; K25-I55 HydrophobicContact CG-CG2 4.43Å; K25-I55 WeakPolarHBondContact O-CG2 3.39Å; I28-I55 HydrophobicContact CB-CG2 4.38Å; I28-I55 HydrophobicContact CD1-CD1 4.03Å; I28-I55 HydrophobicContact CG2-CG2 4.01Å; T51-I55 HydrophobicContact CG2-CD1 3.9Å; T51-I55 HydrophobicContact CG2-CG1 4.49Å; T51-I55 WeakPolarHBondContact O-CB 3.3Å; T51-I55 WeakPolarHBondContact O-CD1 3.44Å; T51-I55 WeakPolarHBondContact O-CG1 3.28Å; T51-I55 PolarHBondContact O-N 3.35Å; Y53-I55 PolarHBondContact O-N 3.48Å; I55-H58 CarbonylContact O-C 3.56Å; I55-H58 PolarHBondContact O-N 2.86Å; I55-K59 PolarHBondContact O-N 3.42Å
56	R	86.3	Confident	82.7	Confident	127 Å²	127	66.7 Å²	66.7	48%	0.479	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-42.4	176.8	-178.5	177.7	174.6	145.4	-1.5	111.7	L32 L52 Y53 H58 K59	L32-R56 HydrophobicContact CD1-CB 4.37Å; L52-R56 WeakPolarHBondContact O-CB 3.41Å; L52-R56 PolarHBondContact O-N 2.87Å; Y53-R56 PolarHBondContact O-N 3.09Å; R56-H58 VanDerWaalsContact C-N 3.28Å; R56-H58 PolarHBondContact O-N 3.45Å; R56-K59 VanDerWaalsContact O-CB 3.3Å; R56-K59 WeakPolarHBondContact O-CB 3.1Å; R56-K59 PolarHBondContact O-N 3.35Å
57	A	86.1	Confident	81.7	Confident	78 Å²	78	67.1 Å²	67.1	65%	0.645	36%	0.357	S	S	*	.	H	α-helix	trans	-62.2	-36.7	178	0	0	0	0	0	112	Y53 D54 K59	Y53-A57 WeakPolarHBondContact O-CB 3.22Å; Y53-A57 PolarHBondContact O-N 2.89Å; D54-A57 PolarHBondContact O-N 3.17Å; A57-K59 VanDerWaalsContact C-N 3.34Å; A57-K59 PolarHBondContact O-N 3.41Å
58	H	84.3	Confident	80.4	Confident	102 Å²	102	70.8 Å²	70.8	47%	0.472	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	11	178.5	-61.9	149.1	0	0	0	114.5	D54 I55 R56 A60 Q61 L62	D54-H58 PolarHBondContact O-N 3.23Å; D54-H58 PolarHBondContact O-ND1 3Å; I55-H58 CarbonylContact O-C 3.56Å; I55-H58 PolarHBondContact O-N 2.86Å; R56-H58 VanDerWaalsContact C-N 3.28Å; R56-H58 PolarHBondContact O-N 3.45Å; H58-A60 PolarHBondContact O-N 2.71Å; H58-Q61 PolarHBondContact O-N 3.22Å; H58-L62 WeakPolarHBondContact O-CG 3.47Å; H58-L62 PolarHBondContact O-N 3.27Å
59	K	84.3	Confident	79.1	Confident	55 Å²	55	71.3 Å²	71.3	24%	0.239	38%	0.384	C	S	.	.	H	α-helix	trans	-52.4	-50.3	-177.6	-174.2	-165.7	-173.4	-150.1	0	112.8	C29 E33 I55 R56 A57 Q61 L62 L63	C29-K59 HydrophobicContact CB-CD 4.31Å; C29-K59 HydrophobicContact CB-CG 3.99Å; E33-K59 WeakPolarHBondContact OE1-CD 3.37Å; E33-K59 WeakPolarHBondContact OE1-CE 3.49Å; E33-K59 IonicContact OE1-NZ 3.09Å; E33-K59 PolarHBondContact OE1-NZ 3.46Å; E33-K59 WeakPolarHBondContact OE2-CE 3.36Å; E33-K59 IonicContact OE2-NZ 2.72Å; E33-K59 PolarHBondContact OE2-NZ 3.38Å; I55-K59 PolarHBondContact O-N 3.42Å; R56-K59 VanDerWaalsContact O-CB 3.3Å; R56-K59 WeakPolarHBondContact O-CB 3.1Å; R56-K59 PolarHBondContact O-N 3.35Å; A57-K59 VanDerWaalsContact C-N 3.34Å; A57-K59 PolarHBondContact O-N 3.41Å; K59-Q61 VanDerWaalsContact C-N 3.28Å; K59-Q61 PolarHBondContact O-N 2.88Å; K59-L62 WeakPolarHBondContact O-CB 3.35Å; K59-L62 PolarHBondContact O-N 3.01Å; K59-L63 HydrophobicContact CD-CD1 4.35Å; K59-L63 HydrophobicContact CG-CD1 4.09Å; K59-L63 HydrophobicContact CG-CG 4.41Å; K59-L63 WeakPolarHBondContact O-CG 3.22Å; K59-L63 PolarHBondContact O-N 3.44Å
60	A	78.8	Confident	77.4	Confident	77 Å²	77	75.6 Å²	75.6	64%	0.636	41%	0.408	S	S	*	.	H	α-helix	trans	-61.3	-38.8	-176.8	0	0	0	0	0	112	H58 R64	H58-A60 PolarHBondContact O-N 2.71Å; A60-R64 WeakPolarHBondContact O-CB 3.38Å; A60-R64 PolarHBondContact O-N 2.69Å
61	Q	78.8	Confident	76	Confident	107 Å²	107	73.7 Å²	73.7	50%	0.5	40%	0.395	S	S	.	.	H	α-helix	trans	-68.8	-40.7	176.8	-169.3	-177.8	4.1	0	0	111.8	H58 K59 F65 L81	H58-Q61 PolarHBondContact O-N 3.22Å; K59-Q61 VanDerWaalsContact C-N 3.28Å; K59-Q61 PolarHBondContact O-N 2.88Å; Q61-F65 VanDerWaalsContact O-CB 3.26Å; Q61-F65 WeakPolarHBondContact O-CB 3.47Å; Q61-F65 PolarHBondContact O-N 3.44Å; Q61-L81 HydrophobicContact CG-CD1 4.09Å
62	L	80.1	Confident	74.6	Confident	6 Å²	6	75.8 Å²	75.8	3%	0.031	40%	0.404	C	S	.	.	H	α-helix	trans	-61.3	-46.5	175.5	-70.9	164.3	0	0	0	111.4	L22 K25 I26 H58 K59 F65 F66 L81	L22-L62 HydrophobicContact CD2-CD2 3.71Å; K25-L62 HydrophobicContact CB-CD1 3.93Å; K25-L62 HydrophobicContact CB-CD2 4.37Å; K25-L62 HydrophobicContact CD-CD2 4.26Å; I26-L62 HydrophobicContact CG1-CB 4.24Å; H58-L62 WeakPolarHBondContact O-CG 3.47Å; H58-L62 PolarHBondContact O-N 3.27Å; K59-L62 WeakPolarHBondContact O-CB 3.35Å; K59-L62 PolarHBondContact O-N 3.01Å; L62-F65 PolarHBondContact O-N 3.48Å; L62-F66 WeakPolarHBondContact O-CB 3.41Å; L62-F66 PolarHBondContact O-N 2.98Å; L62-L81 HydrophobicContact CD2-CD1 4.02Å; L62-L81 HydrophobicContact CD2-CD2 4.1Å; L62-L81 HydrophobicContact CD2-CG 4.26Å; L62-L81 HydrophobicContact CG-CD1 4.48Å
63	L	76.8	Confident	73	Confident	49 Å²	49	84.1 Å²	84.1	26%	0.257	44%	0.44	S	S	.	.	H	α-helix	trans	-66.6	-43.5	179	-71.1	177.9	0	0	0	112.3	I26 K59 F65 F66 A67	I26-L63 HydrophobicContact CG2-CD2 4.48Å; K59-L63 HydrophobicContact CD-CD1 4.35Å; K59-L63 HydrophobicContact CG-CD1 4.09Å; K59-L63 HydrophobicContact CG-CG 4.41Å; K59-L63 WeakPolarHBondContact O-CG 3.22Å; K59-L63 PolarHBondContact O-N 3.44Å; L63-F65 VanDerWaalsContact C-N 3.33Å; L63-F65 PolarHBondContact O-N 3.41Å; L63-F66 WeakPolarHBondContact O-CB 3.04Å; L63-F66 PolarHBondContact O-N 3.08Å; L63-A67 WeakPolarHBondContact O-CB 3.46Å; L63-A67 PolarHBondContact O-N 3.44Å
64	R	75.9	Confident	71.5	Confident	205 Å²	205	79.1 Å²	79.1	77%	0.774	43%	0.425	S	S	*	.	H	α-helix	trans	-60.6	-43.4	176.7	-175.7	176.6	-179.5	171.6	0.6	111.7	A60 F66 A67 S68	A60-R64 WeakPolarHBondContact O-CB 3.38Å; A60-R64 PolarHBondContact O-N 2.69Å; R64-F66 VanDerWaalsContact C-N 3.3Å; R64-F66 PolarHBondContact O-N 2.96Å; R64-A67 PolarHBondContact O-N 2.97Å; R64-S68 WeakPolarHBondContact O-CB 3.49Å; R64-S68 PolarHBondContact O-N 2.93Å; R64-S68 VanDerWaalsContact O-N 3.15Å; R64-S68 PolarHBondContact O-OG 3Å
65	F	70.4	Confident	70.4	Confident	31 Å²	31	75.1 Å²	75.1	14%	0.136	40%	0.403	C	S	.	.	H	α-helix	trans	-65.3	-35.7	177.1	-167.9	-88.8	0	0	0	112.4	L22 Q61 L62 L63 S68 S69 L75 R78 L81 T83	L22-F65 HydrophobicContact CD1-CD1 4.06Å; L22-F65 HydrophobicContact CD1-CE1 4.1Å; Q61-F65 VanDerWaalsContact O-CB 3.26Å; Q61-F65 WeakPolarHBondContact O-CB 3.47Å; Q61-F65 PolarHBondContact O-N 3.44Å; L62-F65 PolarHBondContact O-N 3.48Å; L63-F65 VanDerWaalsContact C-N 3.33Å; L63-F65 PolarHBondContact O-N 3.41Å; F65-S68 PolarHBondContact O-OG 2.63Å; F65-S69 PolarHBondContact O-OG 3.49Å; F65-L75 HydrophobicContact CE1-CD2 4.21Å; F65-R78 VanDerWaalsContact CZ-CZ 3.41Å; F65-L81 HydrophobicContact CB-CD2 3.71Å; F65-L81 HydrophobicContact CD1-CD2 3.8Å; F65-L81 HydrophobicContact CD2-CD2 3.95Å; F65-L81 HydrophobicContact CE1-CD2 4.47Å; F65-L81 HydrophobicContact CG-CD2 3.52Å; F65-T83 HydrophobicContact CE2-CG2 3.73Å; F65-T83 HydrophobicContact CZ-CG2 4.49Å
66	F	68	Low	69.1	Low	30 Å²	30	77.7 Å²	77.7	13%	0.132	42%	0.415	C	S	.	.	H	α-helix	trans	-68.9	-43.5	176.7	-162.9	-88.2	0	0	0	111.6	I26 L62 L63 R64 S68 S69 L75 F415	I26-F66 HydrophobicContact CD1-CB 4.05Å; I26-F66 HydrophobicContact CD1-CD2 3.6Å; I26-F66 HydrophobicContact CD1-CE2 4.39Å; I26-F66 HydrophobicContact CD1-CG 3.9Å; L62-F66 WeakPolarHBondContact O-CB 3.41Å; L62-F66 PolarHBondContact O-N 2.98Å; L63-F66 WeakPolarHBondContact O-CB 3.04Å; L63-F66 PolarHBondContact O-N 3.08Å; R64-F66 VanDerWaalsContact C-N 3.3Å; R64-F66 PolarHBondContact O-N 2.96Å; F66-S68 VanDerWaalsContact C-N 3.29Å; F66-S68 PolarHBondContact O-N 3.3Å; F66-S69 PolarHBondContact O-N 2.74Å; F66-L75 HydrophobicContact CD2-CD1 4.11Å; F66-L75 HydrophobicContact CE2-CB 4.08Å; F66-L75 HydrophobicContact CE2-CD1 3.84Å; F66-L75 HydrophobicContact CZ-CD1 4.23Å; F66-F415 HydrophobicContact CE1-CE1 4.11Å; F66-F415 HydrophobicContact CE1-CZ 4.15Å; F66-F415 HydrophobicContact CE2-CZ 4.05Å; F66-F415 AromaticContact CZ-CE1 3.65Å; F66-F415 HydrophobicContact CZ-CE1 3.65Å; F66-F415 HydrophobicContact CZ-CE2 4.35Å; F66-F415 AromaticContact CZ-CZ 3.33Å; F66-F415 HydrophobicContact CZ-CZ 3.33Å
67	A	65.4	Low	67.9	Low	83 Å²	83	78.4 Å²	78.4	69%	0.686	42%	0.424	S	S	*	.	H	α-helix	trans	-67.8	-25	178.5	0	0	0	0	0	113.8	L63 R64	L63-A67 WeakPolarHBondContact O-CB 3.46Å; L63-A67 PolarHBondContact O-N 3.44Å; R64-A67 PolarHBondContact O-N 2.97Å
68	S	60.9	Low	67.1	Low	84 Å²	84	76.8 Å²	76.8	59%	0.587	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	8	-178.5	70	0	0	0	0	114.6	R64 F65 F66	R64-S68 WeakPolarHBondContact O-CB 3.49Å; R64-S68 PolarHBondContact O-N 2.93Å; R64-S68 VanDerWaalsContact O-N 3.15Å; R64-S68 PolarHBondContact O-OG 3Å; F65-S68 PolarHBondContact O-OG 2.63Å; F66-S68 VanDerWaalsContact C-N 3.29Å; F66-S68 PolarHBondContact O-N 3.3Å
69	S	60.8	Low	66.5	Low	29 Å²	29	78.1 Å²	78.1	20%	0.203	40%	0.402	C	S	.	.			trans	-115.2	121.1	-172.1	-66.9	0	0	0	0	111.8	F65 F66 S71	F65-S69 PolarHBondContact O-OG 3.49Å; F66-S69 PolarHBondContact O-N 2.74Å; S69-S71 PolarHBondContact O-N 2.9Å
70	D	49.3	Very low	65.8	Low	161 Å²	161	79.2 Å²	79.2	86%	0.861	41%	0.413	S	S	*	.	S	Bend	trans	-77.6	-8.8	-172.5	-62.3	-46.2	0	0	0	115.5
71	S	54.8	Low	65.2	Low	37 Å²	37	77.7 Å²	77.7	26%	0.259	39%	0.394	S	S	.	.			trans	-122.3	101	-173.6	-173.8	0	0	0	0	113.5	S69 K73 L75	S69-S71 PolarHBondContact O-N 2.9Å; S71-K73 PolarHBondContact O-N 3.38Å; S71-L75 WeakPolarHBondContact O-CG 3.45Å
72	N	56.5	Low	64.7	Low	95 Å²	95	79.7 Å²	79.7	51%	0.508	40%	0.403	S	S	.	.	H	α-helix	trans	-61.3	-35.2	-177.4	-84	-38.3	0	0	0	114.2	E76	N72-E76 WeakPolarHBondContact O-CG 3.39Å
73	K	56.3	Low	64	Low	181 Å²	181	82.7 Å²	82.7	79%	0.787	42%	0.422	S	S	*	.	H	α-helix	trans	-76	-31.1	-174.8	-79.1	-178.3	177.4	174.9	0	114.2	S71	S71-K73 PolarHBondContact O-N 3.38Å
74	A	55.4	Low	63.9	Low	22 Å²	22	81.7 Å²	81.7	18%	0.182	42%	0.418	C	S	.	.	H	α-helix	trans	-75.8	-28.2	178.2	0	0	0	0	0	112	R78	A74-R78 PolarHBondContact O-N 3.25Å
75	L	60.8	Low	63.9	Low	8 Å²	8	80.9 Å²	80.9	4%	0.042	42%	0.421	C	S	.	.	H	α-helix	trans	-70.2	-29.8	178.9	-66.7	168.5	0	0	0	113.3	F65 F66 S71 Q77 R78	F65-L75 HydrophobicContact CE1-CD2 4.21Å; F66-L75 HydrophobicContact CD2-CD1 4.11Å; F66-L75 HydrophobicContact CE2-CB 4.08Å; F66-L75 HydrophobicContact CE2-CD1 3.84Å; F66-L75 HydrophobicContact CZ-CD1 4.23Å; S71-L75 WeakPolarHBondContact O-CG 3.45Å; L75-Q77 VanDerWaalsContact C-N 3.26Å; L75-Q77 PolarHBondContact O-N 3Å; L75-R78 PolarHBondContact O-N 3.35Å
76	E	61.3	Low	64.5	Low	65 Å²	65	80.5 Å²	80.5	30%	0.304	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-32.7	-178.2	-56.3	-163.8	121.2	0	0	113	T21 K23 N72	T21-E76 WeakPolarHBondContact CB-O 3.46Å; K23-E76 HydrophobicContact CD-CB 4.19Å; K23-E76 HydrophobicContact CD-CG 4.23Å; K23-E76 IonicContact NZ-OE1 2.74Å; K23-E76 PolarHBondContact NZ-OE1 3.48Å; N72-E76 WeakPolarHBondContact O-CG 3.39Å
77	Q	61.3	Low	65.1	Low	142 Å²	142	84.2 Å²	84.2	66%	0.664	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-9.5	-176.6	-62	-63.9	-23.2	0	0	113	L75	L75-Q77 VanDerWaalsContact C-N 3.26Å; L75-Q77 PolarHBondContact O-N 3Å
78	R	69.6	Low	65.8	Low	44 Å²	44	85 Å²	85	17%	0.166	43%	0.427	C	S	.	.			trans	-70.2	138.9	-178.3	-171	171.8	-173.9	161.4	3.5	110.2	T21 L22 F65 A74 L75 T80 H82	T21-R78 CarbonylContact C-O 3.42Å; T21-R78 VanDerWaalsContact CA-O 3.22Å; T21-R78 WeakPolarHBondContact CA-O 3.42Å; L22-R78 HydrophobicContact CD1-CB 4.15Å; L22-R78 HydrophobicContact CD1-CG 3.9Å; L22-R78 HydrophobicContact CG-CB 4.39Å; L22-R78 HydrophobicContact CG-CG 4.39Å; L22-R78 WeakPolarHBondContact CG-O 3.34Å; L22-R78 PolarHBondContact N-O 3.09Å; F65-R78 VanDerWaalsContact CZ-CZ 3.41Å; A74-R78 PolarHBondContact O-N 3.25Å; L75-R78 PolarHBondContact O-N 3.35Å; R78-T80 WeakPolarHBondContact CG-O 3.49Å; R78-T80 PolarHBondContact NE-O 3.13Å; R78-H82 PolarHBondContact NH2-O 2.94Å
79	R	71.8	Confident	67	Low	129 Å²	129	81.2 Å²	81.2	49%	0.487	40%	0.4	S	S	.	.			trans	-114	-16.5	-177.6	-64.5	175.8	177.7	-172.5	-2.9	114	V19 T21 K25	V19-R79 HydrophobicContact CG1-CB 3.98Å; V19-R79 HydrophobicContact CG1-CG 4.24Å; V19-R79 PolarHBondContact O-NE 2.91Å; T21-R79 HydrophobicContact CG2-CG 4.13Å; K25-R79 PolarHBondContact NZ-O 3.3Å
80	T	68.8	Low	68.2	Low	78 Å²	78	80.5 Å²	80.5	48%	0.479	39%	0.394	S	S	.	.			trans	-122.2	147.3	-173.9	63.6	0	0	0	0	112.1	R78 H82	R78-T80 WeakPolarHBondContact CG-O 3.49Å; R78-T80 PolarHBondContact NE-O 3.13Å; T80-H82 VanDerWaalsContact C-N 3.3Å
81	L	67.2	Low	69.7	Low	45 Å²	45	79 Å²	79	24%	0.236	38%	0.376	C	S	.	.			trans	-87	3.4	173.5	-72.1	171.4	0	0	0	113.1	L22 Q61 L62 F65 T83	L22-L81 HydrophobicContact CD1-CD2 4.17Å; L22-L81 HydrophobicContact CD2-CD2 4.06Å; L22-L81 HydrophobicContact CD2-CG 4.1Å; Q61-L81 HydrophobicContact CG-CD1 4.09Å; L62-L81 HydrophobicContact CD2-CD1 4.02Å; L62-L81 HydrophobicContact CD2-CD2 4.1Å; L62-L81 HydrophobicContact CD2-CG 4.26Å; L62-L81 HydrophobicContact CG-CD1 4.48Å; F65-L81 HydrophobicContact CB-CD2 3.71Å; F65-L81 HydrophobicContact CD1-CD2 3.8Å; F65-L81 HydrophobicContact CD2-CD2 3.95Å; F65-L81 HydrophobicContact CE1-CD2 4.47Å; F65-L81 HydrophobicContact CG-CD2 3.52Å; L81-T83 PolarHBondContact O-N 3.29Å
82	H	66.9	Low	71	Confident	150 Å²	150	78.6 Å²	78.6	69%	0.694	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-65.3	122.4	-178.9	-90.6	-65.8	0	0	0	111.3	R78 T80	R78-H82 PolarHBondContact NH2-O 2.94Å; T80-H82 VanDerWaalsContact C-N 3.3Å
83	T	66.5	Low	72.5	Confident	69 Å²	69	74 Å²	74	42%	0.423	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-85.1	154.5	168	53.2	0	0	0	0	110.9	F65 L81 E87	F65-T83 HydrophobicContact CE2-CG2 3.73Å; F65-T83 HydrophobicContact CZ-CG2 4.49Å; L81-T83 PolarHBondContact O-N 3.29Å; T83-E87 WeakPolarHBondContact CB-OE1 3.41Å; T83-E87 WeakPolarHBondContact CG2-OE1 3.38Å; T83-E87 PolarHBondContact OG1-OE1 3.19Å
84	P	73.7	Confident	73.9	Confident	27 Å²	27	67.3 Å²	67.3	18%	0.175	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-62.8	150.5	169.7	29.5	-36.2	0	0	0	110.2	L86 E87 D90	P84-L86 PolarHBondContact O-N 2.81Å; P84-E87 HydrophobicContact CG-CG 4.11Å; P84-E87 VanDerWaalsContact O-CG 3.24Å; P84-E87 WeakPolarHBondContact O-CG 3.45Å; P84-D90 HydrophobicContact CB-CB 4.29Å; P84-D90 HydrophobicContact CG-CB 3.76Å
85	K	75.8	Confident	75.1	Confident	189 Å²	189	71.1 Å²	71.1	82%	0.822	33%	0.332	S	S	*	.	S	Bend	trans	-58.8	-40.1	174.2	-66.3	-175	175.4	-172.4	0	111.8
86	L	83.1	Confident	76.4	Confident	23 Å²	23	73.5 Å²	73.5	12%	0.12	34%	0.34	C	S	.	.	S	Bend	trans	-103.3	74.7	178.6	-60.2	177.8	0	0	0	110.8	P84 H88 L89 D90 Y120 L125 E127 C129	P84-L86 PolarHBondContact O-N 2.81Å; L86-H88 PolarHBondContact O-N 3.17Å; L86-L89 HydrophobicContact CB-CB 3.97Å; L86-L89 HydrophobicContact CB-CD2 4.29Å; L86-L89 HydrophobicContact CD1-CD2 3.72Å; L86-D90 VanDerWaalsContact O-CB 3.31Å; L86-D90 WeakPolarHBondContact O-CB 3.46Å; L86-D90 PolarHBondContact O-N 3.13Å; L86-Y120 HydrophobicContact CD1-CD2 3.78Å; L86-Y120 HydrophobicContact CD1-CE2 3.74Å; L86-L125 HydrophobicContact CD1-CD1 4.3Å; L86-L125 HydrophobicContact CD2-CD1 4.24Å; L86-E127 HydrophobicContact CD2-CB 3.98Å; L86-E127 HydrophobicContact CD2-CG 4.43Å; L86-E127 WeakPolarHBondContact CD2-OE2 3.47Å; L86-C129 HydrophobicContact CD1-CB 3.67Å
87	E	81.8	Confident	77.6	Confident	108 Å²	108	71 Å²	71	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-60.6	-40.8	-176.2	-63.4	-171.8	-179.5	0	0	113.3	T83 P84 D90 R91	T83-E87 WeakPolarHBondContact CB-OE1 3.41Å; T83-E87 WeakPolarHBondContact CG2-OE1 3.38Å; T83-E87 PolarHBondContact OG1-OE1 3.19Å; P84-E87 HydrophobicContact CG-CG 4.11Å; P84-E87 VanDerWaalsContact O-CG 3.24Å; P84-E87 WeakPolarHBondContact O-CG 3.45Å; E87-D90 WeakPolarHBondContact O-CB 3.26Å; E87-D90 PolarHBondContact O-N 3.16Å; E87-R91 PolarHBondContact O-N 2.82Å; E87-R91 VanDerWaalsContact O-N 3.08Å
88	H	79.5	Confident	78.4	Confident	100 Å²	100	67.9 Å²	67.9	46%	0.463	32%	0.316	S	S	.	.	H	α-helix	trans	-67.1	-47.6	-178.2	-169.9	64.5	0	0	0	112.3	L86 D90 R91 V92 M123	L86-H88 PolarHBondContact O-N 3.17Å; H88-D90 VanDerWaalsContact C-N 3.26Å; H88-D90 PolarHBondContact O-N 2.67Å; H88-R91 PolarHBondContact O-N 2.69Å; H88-V92 WeakPolarHBondContact O-CG2 3.07Å; H88-V92 PolarHBondContact O-N 2.67Å; H88-V92 VanDerWaalsContact O-N 3.1Å; H88-M123 VanDerWaalsContact CD2-SD 3.59Å
89	L	86.3	Confident	78.5	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-57.1	-43.2	174.5	176.1	61.2	0	0	0	111.4	L86 R91 L93 F119 Y120 M123 L125 F131	L86-L89 HydrophobicContact CB-CB 3.97Å; L86-L89 HydrophobicContact CB-CD2 4.29Å; L86-L89 HydrophobicContact CD1-CD2 3.72Å; L89-R91 PolarHBondContact O-N 3.47Å; L89-L93 WeakPolarHBondContact O-CB 3.28Å; L89-L93 PolarHBondContact O-N 2.79Å; L89-F119 HydrophobicContact CD1-CB 3.37Å; L89-F119 HydrophobicContact CD1-CG 4.48Å; L89-Y120 HydrophobicContact CD2-CD2 4Å; L89-M123 HydrophobicContact CB-SD 4.36Å; L89-M123 HydrophobicContact CD1-SD 4.28Å; L89-L125 HydrophobicContact CB-CD1 3.97Å; L89-L125 HydrophobicContact CD2-CD1 4.27Å; L89-F131 HydrophobicContact CD2-CE1 3.88Å; L89-F131 HydrophobicContact CD2-CZ 3.9Å
90	D	85.4	Confident	79	Confident	15 Å²	15	63.8 Å²	63.8	8%	0.08	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-42.7	-179.2	-169.1	80.1	0	0	0	113.3	P84 L86 E87 H88 Y94 F139 R142 H143	P84-D90 HydrophobicContact CB-CB 4.29Å; P84-D90 HydrophobicContact CG-CB 3.76Å; L86-D90 VanDerWaalsContact O-CB 3.31Å; L86-D90 WeakPolarHBondContact O-CB 3.46Å; L86-D90 PolarHBondContact O-N 3.13Å; E87-D90 WeakPolarHBondContact O-CB 3.26Å; E87-D90 PolarHBondContact O-N 3.16Å; H88-D90 VanDerWaalsContact C-N 3.26Å; H88-D90 PolarHBondContact O-N 2.67Å; D90-Y94 WeakPolarHBondContact O-CB 3.34Å; D90-Y94 PolarHBondContact O-N 3.25Å; D90-Y94 VanDerWaalsContact O-N 3.16Å; D90-F139 WeakPolarHBondContact OD1-CD2 3.37Å; D90-R142 IonicContact OD1-CZ 3.65Å; D90-R142 IonicContact OD1-NH1 3.79Å; D90-R142 PolarHBondContact OD1-NH1 3.19Å; D90-R142 IonicContact OD1-NH2 2.76Å; D90-R142 PolarHBondContact OD1-NH2 2.86Å; D90-R142 IonicContact OD2-CZ 3.23Å; D90-R142 IonicContact OD2-NH1 2.75Å; D90-R142 PolarHBondContact OD2-NH1 3.36Å; D90-H143 IonicContact OD1-NE2 2.94Å; D90-H143 IonicContact OD2-CD2 2.85Å; D90-H143 IonicContact OD2-CE1 3.81Å; D90-H143 PolarHBondContact OD2-CE1 3.07Å; D90-H143 IonicContact OD2-NE2 2.72Å; D90-H143 PolarHBondContact OD2-NE2 2.91Å
91	R	80.8	Confident	79.1	Confident	129 Å²	129	66.3 Å²	66.3	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-66.8	-50.9	178.2	-175.3	-178.8	65.7	173.6	2.8	111.4	E87 H88 L89 L93 Y94 E95	E87-R91 PolarHBondContact O-N 2.82Å; E87-R91 VanDerWaalsContact O-N 3.08Å; H88-R91 PolarHBondContact O-N 2.69Å; L89-R91 PolarHBondContact O-N 3.47Å; R91-L93 VanDerWaalsContact C-N 3.32Å; R91-L93 PolarHBondContact O-N 2.89Å; R91-Y94 WeakPolarHBondContact O-CB 3.49Å; R91-Y94 PolarHBondContact O-N 3.46Å; R91-E95 PolarHBondContact O-N 3.06Å
92	V	83.1	Confident	78.9	Confident	28 Å²	28	69 Å²	69	17%	0.17	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-38.5	-177.5	174	0	0	0	0	111.3	H88 Y94 E95 W96 F119 M123	H88-V92 WeakPolarHBondContact O-CG2 3.07Å; H88-V92 PolarHBondContact O-N 2.67Å; H88-V92 VanDerWaalsContact O-N 3.1Å; V92-Y94 VanDerWaalsContact C-N 3.29Å; V92-Y94 PolarHBondContact O-N 2.86Å; V92-E95 PolarHBondContact O-N 3.09Å; V92-W96 WeakPolarHBondContact O-CB 3.44Å; V92-W96 PolarHBondContact O-N 3.07Å; V92-F119 HydrophobicContact CG1-CD1 4.4Å; V92-F119 HydrophobicContact CG1-CD2 4.03Å; V92-F119 HydrophobicContact CG1-CE1 4.19Å; V92-F119 HydrophobicContact CG1-CE2 3.8Å; V92-F119 HydrophobicContact CG1-CG 4.32Å; V92-F119 HydrophobicContact CG1-CZ 3.87Å; V92-M123 HydrophobicContact CB-CE 3.6Å; V92-M123 HydrophobicContact CG1-CE 3.6Å; V92-M123 HydrophobicContact CG2-CE 3.64Å
93	L	88.2	Confident	79.3	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.3	-36.9	174	-175.3	64.8	0	0	0	112.2	L89 R91 W96 F97 L112 K115 A116 F119 W135 F139	L89-L93 WeakPolarHBondContact O-CB 3.28Å; L89-L93 PolarHBondContact O-N 2.79Å; R91-L93 VanDerWaalsContact C-N 3.32Å; R91-L93 PolarHBondContact O-N 2.89Å; L93-W96 HydrophobicContact CD1-CE3 4.21Å; L93-F97 WeakPolarHBondContact O-CB 3.36Å; L93-F97 PolarHBondContact O-N 3.16Å; L93-L112 HydrophobicContact CD1-CD2 4.29Å; L93-L112 HydrophobicContact CG-CD2 4.31Å; L93-K115 HydrophobicContact CD1-CB 3.92Å; L93-K115 HydrophobicContact CD1-CG 3.86Å; L93-A116 HydrophobicContact CD1-CB 4.35Å; L93-A116 HydrophobicContact CD2-CB 3.65Å; L93-F119 HydrophobicContact CB-CD2 4.29Å; L93-F119 HydrophobicContact CD1-CD2 4.08Å; L93-F119 HydrophobicContact CD1-CE2 4.24Å; L93-W135 HydrophobicContact CD2-CH2 3.57Å; L93-W135 HydrophobicContact CD2-CZ2 4.17Å; L93-F139 HydrophobicContact CB-CE2 4.06Å; L93-F139 HydrophobicContact CB-CZ 4.2Å; L93-F139 HydrophobicContact CD2-CD2 4.04Å; L93-F139 HydrophobicContact CD2-CE1 4.27Å; L93-F139 HydrophobicContact CD2-CE2 3.63Å; L93-F139 HydrophobicContact CD2-CZ 3.75Å; L93-F139 HydrophobicContact CG-CE1 4.48Å; L93-F139 HydrophobicContact CG-CE2 3.94Å; L93-F139 HydrophobicContact CG-CZ 3.75Å
94	Y	84.9	Confident	79	Confident	39 Å²	39	67.4 Å²	67.4	15%	0.153	34%	0.339	C	S	.	.	H	α-helix	trans	-70.7	-42	176.4	-175.7	-122.9	0	0	0	112.8	D90 R91 V92 W96 F97 L98 H143 I145	D90-Y94 WeakPolarHBondContact O-CB 3.34Å; D90-Y94 PolarHBondContact O-N 3.25Å; D90-Y94 VanDerWaalsContact O-N 3.16Å; R91-Y94 WeakPolarHBondContact O-CB 3.49Å; R91-Y94 PolarHBondContact O-N 3.46Å; V92-Y94 VanDerWaalsContact C-N 3.29Å; V92-Y94 PolarHBondContact O-N 2.86Å; Y94-W96 VanDerWaalsContact C-N 3.33Å; Y94-W96 PolarHBondContact O-N 3.27Å; Y94-F97 HydrophobicContact CD2-CD1 4.03Å; Y94-F97 HydrophobicContact CE2-CD1 4.01Å; Y94-F97 HydrophobicContact CE2-CE1 4.41Å; Y94-F97 WeakPolarHBondContact O-CB 3.44Å; Y94-F97 PolarHBondContact O-N 3.34Å; Y94-L98 HydrophobicContact CD1-CD1 4.12Å; Y94-L98 HydrophobicContact CE1-CD1 3.74Å; Y94-L98 HydrophobicContact CE1-CG 4.26Å; Y94-L98 HydrophobicContact CE2-CD2 4.21Å; Y94-L98 HydrophobicContact CE2-CG 4.23Å; Y94-L98 WeakPolarHBondContact O-CG 3.13Å; Y94-L98 PolarHBondContact O-N 3.32Å; Y94-H143 AromaticContact CD1-CE1 3.8Å; Y94-H143 AromaticContact CD1-ND1 3.53Å; Y94-H143 HydrophobicContact CD2-CB 3.62Å; Y94-H143 AromaticContact CD2-CG 3.46Å; Y94-H143 VanDerWaalsContact CD2-CG 3.46Å; Y94-H143 AromaticContact CD2-ND1 3.63Å; Y94-H143 AromaticContact CE1-ND1 3.79Å; Y94-H143 HydrophobicContact CE2-CB 3.5Å; Y94-H143 AromaticContact CE2-CG 3.8Å; Y94-H143 AromaticContact CE2-ND1 3.92Å; Y94-H143 HydrophobicContact CG-CB 4.32Å; Y94-H143 AromaticContact CG-CE1 3.61Å; Y94-H143 AromaticContact CG-CG 3.69Å; Y94-H143 AromaticContact CG-ND1 3.42Å; Y94-H143 AromaticContact CZ-ND1 3.96Å; Y94-I145 HydrophobicContact CD2-CD1 4.25Å; Y94-I145 HydrophobicContact CE2-CD1 4.31Å; Y94-I145 HydrophobicContact CE2-CG1 4.37Å
95	E	80.5	Confident	78.8	Confident	103 Å²	103	68.9 Å²	68.9	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-45.2	173.5	-73.8	171.6	-170.9	0	0	111.4	R91 V92 F97 L98 G99	R91-E95 PolarHBondContact O-N 3.06Å; V92-E95 PolarHBondContact O-N 3.09Å; E95-F97 VanDerWaalsContact C-N 3.33Å; E95-F97 PolarHBondContact O-N 3.05Å; E95-L98 PolarHBondContact O-N 3.2Å; E95-G99 PolarHBondContact O-N 2.98Å
96	W	89.1	Confident	78.5	Confident	58 Å²	58	64.2 Å²	64.2	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-59.7	-43.4	174.1	174.6	84.7	0	0	0	112.3	V92 L93 Y94 L98 G99 K100 V107 L112 K115 F119	V92-W96 WeakPolarHBondContact O-CB 3.44Å; V92-W96 PolarHBondContact O-N 3.07Å; L93-W96 HydrophobicContact CD1-CE3 4.21Å; Y94-W96 VanDerWaalsContact C-N 3.33Å; Y94-W96 PolarHBondContact O-N 3.27Å; W96-L98 VanDerWaalsContact C-N 3.33Å; W96-L98 PolarHBondContact O-N 3.14Å; W96-G99 PolarHBondContact O-N 3.4Å; W96-K100 HydrophobicContact CD2-CG 4.28Å; W96-K100 HydrophobicContact CH2-CG 4.37Å; W96-K100 HydrophobicContact CZ2-CD 4.46Å; W96-K100 HydrophobicContact CZ2-CG 3.85Å; W96-K100 PolarHBondContact O-N 2.88Å; W96-V107 HydrophobicContact CH2-CG1 3.94Å; W96-V107 HydrophobicContact CZ3-CG1 3.74Å; W96-L112 HydrophobicContact CZ3-CD2 4.08Å; W96-K115 HydrophobicContact CD2-CD 4.15Å; W96-K115 HydrophobicContact CD2-CG 3.65Å; W96-K115 HydrophobicContact CE3-CB 4.3Å; W96-K115 HydrophobicContact CE3-CG 3.77Å; W96-K115 HydrophobicContact CG-CG 4.23Å; W96-K115 HydrophobicContact CH2-CB 3.99Å; W96-K115 HydrophobicContact CH2-CD 4.44Å; W96-K115 HydrophobicContact CH2-CG 3.99Å; W96-K115 HydrophobicContact CZ2-CB 4.3Å; W96-K115 HydrophobicContact CZ2-CD 3.9Å; W96-K115 HydrophobicContact CZ2-CG 3.88Å; W96-K115 HydrophobicContact CZ3-CB 3.99Å; W96-K115 HydrophobicContact CZ3-CG 3.93Å; W96-F119 HydrophobicContact CB-CE2 3.78Å; W96-F119 HydrophobicContact CB-CZ 3.95Å; W96-F119 HydrophobicContact CG-CE2 4.09Å; W96-F119 HydrophobicContact CG-CZ 4.09Å
97	F	84.8	Confident	78.2	Confident	13 Å²	13	64.5 Å²	64.5	6%	0.057	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-41.6	176	167.8	-96.6	0	0	0	112	L93 Y94 E95 K100 R101 V107 L112 I145	L93-F97 WeakPolarHBondContact O-CB 3.36Å; L93-F97 PolarHBondContact O-N 3.16Å; Y94-F97 HydrophobicContact CD2-CD1 4.03Å; Y94-F97 HydrophobicContact CE2-CD1 4.01Å; Y94-F97 HydrophobicContact CE2-CE1 4.41Å; Y94-F97 WeakPolarHBondContact O-CB 3.44Å; Y94-F97 PolarHBondContact O-N 3.34Å; E95-F97 VanDerWaalsContact C-N 3.33Å; E95-F97 PolarHBondContact O-N 3.05Å; F97-K100 PolarHBondContact O-N 3.39Å; F97-R101 WeakPolarHBondContact O-CB 3.37Å; F97-R101 PolarHBondContact O-N 3.17Å; F97-V107 HydrophobicContact CD2-CB 4.04Å; F97-V107 HydrophobicContact CD2-CG1 4.12Å; F97-V107 HydrophobicContact CD2-CG2 4.32Å; F97-V107 HydrophobicContact CE2-CB 4.17Å; F97-L112 HydrophobicContact CB-CD2 4.24Å; F97-L112 HydrophobicContact CD2-CD2 4.13Å; F97-I145 HydrophobicContact CD1-CD1 3.81Å; F97-I145 HydrophobicContact CD1-CG1 4.3Å; F97-I145 HydrophobicContact CD2-CD1 4.43Å; F97-I145 HydrophobicContact CE1-CD1 3.71Å; F97-I145 HydrophobicContact CE1-CG1 3.74Å; F97-I145 HydrophobicContact CE1-CG2 4.4Å; F97-I145 HydrophobicContact CE2-CD1 4.34Å; F97-I145 HydrophobicContact CE2-CG2 4.24Å; F97-I145 HydrophobicContact CG-CD1 4.17Å; F97-I145 HydrophobicContact CZ-CD1 4Å; F97-I145 HydrophobicContact CZ-CG1 4.01Å; F97-I145 HydrophobicContact CZ-CG2 3.78Å
98	L	78.4	Confident	78.1	Confident	76 Å²	76	61.7 Å²	61.7	40%	0.398	33%	0.332	S	S	.	.	H	α-helix	trans	-64	-44.2	176	-70.5	177.3	0	0	0	111.6	Y94 E95 W96 K100 R101 S102	Y94-L98 HydrophobicContact CD1-CD1 4.12Å; Y94-L98 HydrophobicContact CE1-CD1 3.74Å; Y94-L98 HydrophobicContact CE1-CG 4.26Å; Y94-L98 HydrophobicContact CE2-CD2 4.21Å; Y94-L98 HydrophobicContact CE2-CG 4.23Å; Y94-L98 WeakPolarHBondContact O-CG 3.13Å; Y94-L98 PolarHBondContact O-N 3.32Å; E95-L98 PolarHBondContact O-N 3.2Å; W96-L98 VanDerWaalsContact C-N 3.33Å; W96-L98 PolarHBondContact O-N 3.14Å; L98-K100 PolarHBondContact O-N 3.1Å; L98-R101 WeakPolarHBondContact O-CB 3.15Å; L98-R101 PolarHBondContact O-N 3.35Å; L98-S102 PolarHBondContact O-N 3.31Å; L98-S102 PolarHBondContact O-OG 3.49Å
99	G	71.3	Confident	78	Confident	27 Å²	27	57.3 Å²	57.3	28%	0.278	31%	0.313	S	S	.	.	H	α-helix	trans	-58	-47.2	176.1	0	0	0	0	0	112.4	E95 W96 R101 S102 E103	E95-G99 PolarHBondContact O-N 2.98Å; W96-G99 PolarHBondContact O-N 3.4Å; G99-R101 VanDerWaalsContact C-N 3.29Å; G99-R101 PolarHBondContact O-N 3.05Å; G99-S102 PolarHBondContact O-N 3.39Å; G99-S102 PolarHBondContact O-OG 2.87Å; G99-E103 WeakPolarHBondContact O-CG 3.36Å; G99-E103 PolarHBondContact O-N 2.96Å
100	K	82.3	Confident	77.9	Confident	59 Å²	59	61.6 Å²	61.6	26%	0.257	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-34.5	176.8	-71.6	-70.3	151.4	-151.3	0	113	W96 F97 L98 E103 G104 V105 V107	W96-K100 HydrophobicContact CD2-CG 4.28Å; W96-K100 HydrophobicContact CH2-CG 4.37Å; W96-K100 HydrophobicContact CZ2-CD 4.46Å; W96-K100 HydrophobicContact CZ2-CG 3.85Å; W96-K100 PolarHBondContact O-N 2.88Å; F97-K100 PolarHBondContact O-N 3.39Å; L98-K100 PolarHBondContact O-N 3.1Å; K100-E103 IonicContact NZ-OE1 3.95Å; K100-E103 IonicContact NZ-OE2 2.63Å; K100-E103 PolarHBondContact NZ-OE2 3.39Å; K100-E103 PolarHBondContact O-N 3.49Å; K100-G104 PolarHBondContact O-N 3.4Å; K100-V105 HydrophobicContact CD-CB 4.37Å; K100-V105 HydrophobicContact CD-CG1 4.48Å; K100-V105 PolarHBondContact O-N 3.1Å; K100-V107 HydrophobicContact CB-CG2 3.56Å; K100-V107 HydrophobicContact CG-CG2 4.32Å
101	R	72.4	Confident	77.8	Confident	131 Å²	131	64.7 Å²	64.7	49%	0.494	36%	0.356	S	S	.	.	H	α-helix	trans	-67.9	-39.4	175.9	-163.7	-170	-162.3	128.8	5	112.4	F97 L98 G99 E103 G104	F97-R101 WeakPolarHBondContact O-CB 3.37Å; F97-R101 PolarHBondContact O-N 3.17Å; L98-R101 WeakPolarHBondContact O-CB 3.15Å; L98-R101 PolarHBondContact O-N 3.35Å; G99-R101 VanDerWaalsContact C-N 3.29Å; G99-R101 PolarHBondContact O-N 3.05Å; R101-E103 PolarHBondContact O-N 3.46Å; R101-G104 PolarHBondContact O-N 2.97Å; R101-G104 VanDerWaalsContact O-N 3.08Å
102	S	63	Low	78.1	Confident	101 Å²	101	58.6 Å²	58.6	71%	0.706	33%	0.333	S	S	*	.	H	α-helix	trans	-66.7	-26	176.2	48.1	0	0	0	0	113.1	L98 G99 G104	L98-S102 PolarHBondContact O-N 3.31Å; L98-S102 PolarHBondContact O-OG 3.49Å; G99-S102 PolarHBondContact O-N 3.39Å; G99-S102 PolarHBondContact O-OG 2.87Å; S102-G104 PolarHBondContact O-N 3.3Å
103	E	74.5	Confident	78.3	Confident	121 Å²	121	58.6 Å²	58.6	57%	0.565	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-3.5	173.1	-66.2	167.4	-160.5	0	0	113.1	G99 K100 R101 V105	G99-E103 WeakPolarHBondContact O-CG 3.36Å; G99-E103 PolarHBondContact O-N 2.96Å; K100-E103 IonicContact NZ-OE1 3.95Å; K100-E103 IonicContact NZ-OE2 2.63Å; K100-E103 PolarHBondContact NZ-OE2 3.39Å; K100-E103 PolarHBondContact O-N 3.49Å; R101-E103 PolarHBondContact O-N 3.46Å; E103-V105 VanDerWaalsContact C-N 3.26Å; E103-V105 HydrophobicContact CB-CG2 4.05Å; E103-V105 PolarHBondContact O-N 3.03Å
104	G	60.4	Low	78.2	Confident	65 Å²	65	63.2 Å²	63.2	67%	0.67	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	9.6	-176	0	0	0	0	0	114.6	K100 R101 S102	K100-G104 PolarHBondContact O-N 3.4Å; R101-G104 PolarHBondContact O-N 2.97Å; R101-G104 VanDerWaalsContact O-N 3.08Å; S102-G104 PolarHBondContact O-N 3.3Å
105	V	69.3	Low	78.5	Confident	58 Å²	58	63.3 Å²	63.3	35%	0.352	36%	0.355	S	S	.	.			trans	-80.7	123.5	-178.8	-178.9	0	0	0	0	110	K100 E103 V107	K100-V105 HydrophobicContact CD-CB 4.37Å; K100-V105 HydrophobicContact CD-CG1 4.48Å; K100-V105 PolarHBondContact O-N 3.1Å; E103-V105 VanDerWaalsContact C-N 3.26Å; E103-V105 HydrophobicContact CB-CG2 4.05Å; E103-V105 PolarHBondContact O-N 3.03Å; V105-V107 PolarHBondContact O-N 3Å
106	P	69	Low	78.9	Confident	92 Å²	92	58.4 Å²	58.4	60%	0.597	33%	0.332	S	S	*	.			trans	-69.4	126.3	175.6	27.7	-32.7	0	0	0	110.6
107	V	77.6	Confident	78.9	Confident	29 Å²	29	59.2 Å²	59.2	18%	0.176	34%	0.337	C	S	.	.			trans	-108	111.6	179.1	-175.2	0	0	0	0	110.2	W96 F97 K100 V105 M111 L112	W96-V107 HydrophobicContact CH2-CG1 3.94Å; W96-V107 HydrophobicContact CZ3-CG1 3.74Å; F97-V107 HydrophobicContact CD2-CB 4.04Å; F97-V107 HydrophobicContact CD2-CG1 4.12Å; F97-V107 HydrophobicContact CD2-CG2 4.32Å; F97-V107 HydrophobicContact CE2-CB 4.17Å; K100-V107 HydrophobicContact CB-CG2 3.56Å; K100-V107 HydrophobicContact CG-CG2 4.32Å; V105-V107 PolarHBondContact O-N 3Å; V107-M111 HydrophobicContact CG1-CB 4.14Å; V107-L112 HydrophobicContact CG1-CD2 4.17Å; V107-L112 HydrophobicContact CG1-CG 3.88Å
108	S	79.1	Confident	79.1	Confident	49 Å²	49	61.7 Å²	61.7	34%	0.343	35%	0.351	S	S	.	.			trans	-80.2	165.8	179.5	75.8	0	0	0	0	113	M111 L112	S108-M111 PolarHBondContact N-SD 3.23Å; S108-M111 PolarHBondContact O-N 3.46Å; S108-M111 VanDerWaalsContact OG-CG 3.22Å; S108-M111 WeakPolarHBondContact OG-CG 3.38Å; S108-M111 PolarHBondContact OG-N 3.36Å; S108-M111 PolarHBondContact OG-SD 3.49Å; S108-L112 PolarHBondContact O-N 3.01Å; S108-L112 VanDerWaalsContact O-N 3.14Å
109	G	77.6	Confident	79.6	Confident	7 Å²	7	59.1 Å²	59.1	7%	0.072	34%	0.336	C	S	.	.	H	α-helix	trans	-57.3	-48.7	174	0	0	0	0	0	114.1	M111 L112 I113	G109-M111 VanDerWaalsContact C-N 3.33Å; G109-M111 PolarHBondContact O-N 2.72Å; G109-L112 WeakPolarHBondContact O-CB 3.33Å; G109-L112 PolarHBondContact O-N 3.44Å; G109-I113 PolarHBondContact O-N 3.37Å
110	P	83.7	Confident	80.5	Confident	93 Å²	93	59.9 Å²	59.9	60%	0.604	33%	0.331	S	S	*	.	H	α-helix	trans	-58.2	-40.2	173.2	-28.1	36.6	0	0	0	113.6	L112 I113 E114	P110-L112 VanDerWaalsContact C-N 3.31Å; P110-L112 PolarHBondContact O-N 2.89Å; P110-I113 PolarHBondContact O-N 3.2Å; P110-I113 VanDerWaalsContact O-N 3.08Å; P110-E114 PolarHBondContact O-N 3.4Å
111	M	84.6	Confident	80.9	Confident	81 Å²	81	64 Å²	64	40%	0.399	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-39	176.6	-70.2	167	75.8	0	0	112.4	V107 S108 G109 I113 K115	V107-M111 HydrophobicContact CG1-CB 4.14Å; S108-M111 PolarHBondContact N-SD 3.23Å; S108-M111 PolarHBondContact O-N 3.46Å; S108-M111 VanDerWaalsContact OG-CG 3.22Å; S108-M111 WeakPolarHBondContact OG-CG 3.38Å; S108-M111 PolarHBondContact OG-N 3.36Å; S108-M111 PolarHBondContact OG-SD 3.49Å; G109-M111 VanDerWaalsContact C-N 3.33Å; G109-M111 PolarHBondContact O-N 2.72Å; M111-I113 VanDerWaalsContact C-N 3.33Å; M111-K115 VanDerWaalsContact O-CB 3.25Å; M111-K115 WeakPolarHBondContact O-CB 3.45Å; M111-K115 PolarHBondContact O-N 2.96Å
112	L	87.2	Confident	81.6	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-37	174	-78.3	166.9	0	0	0	112.4	L93 W96 F97 V107 S108 G109 P110 A116 L136 F139	L93-L112 HydrophobicContact CD1-CD2 4.29Å; L93-L112 HydrophobicContact CG-CD2 4.31Å; W96-L112 HydrophobicContact CZ3-CD2 4.08Å; F97-L112 HydrophobicContact CB-CD2 4.24Å; F97-L112 HydrophobicContact CD2-CD2 4.13Å; V107-L112 HydrophobicContact CG1-CD2 4.17Å; V107-L112 HydrophobicContact CG1-CG 3.88Å; S108-L112 PolarHBondContact O-N 3.01Å; S108-L112 VanDerWaalsContact O-N 3.14Å; G109-L112 WeakPolarHBondContact O-CB 3.33Å; G109-L112 PolarHBondContact O-N 3.44Å; P110-L112 VanDerWaalsContact C-N 3.31Å; P110-L112 PolarHBondContact O-N 2.89Å; L112-A116 VanDerWaalsContact O-CB 3.23Å; L112-A116 WeakPolarHBondContact O-CB 3.34Å; L112-A116 PolarHBondContact O-N 2.84Å; L112-L136 HydrophobicContact CB-CD1 3.81Å; L112-L136 HydrophobicContact CD1-CD1 3.97Å; L112-F139 HydrophobicContact CD1-CD1 4.45Å; L112-F139 HydrophobicContact CD1-CE1 4.22Å; L112-F139 HydrophobicContact CD2-CE1 3.88Å; L112-F139 HydrophobicContact CD2-CZ 4.45Å
113	I	86.3	Confident	82.8	Confident	27 Å²	27	61.3 Å²	61.3	14%	0.138	33%	0.334	C	S	.	.	H	α-helix	trans	-67.9	-49.5	178.1	-72.7	171.2	0	0	0	110.5	G109 P110 M111 K115 A116 K117 F131 W135 L136	G109-I113 PolarHBondContact O-N 3.37Å; P110-I113 PolarHBondContact O-N 3.2Å; P110-I113 VanDerWaalsContact O-N 3.08Å; M111-I113 VanDerWaalsContact C-N 3.33Å; I113-K115 VanDerWaalsContact C-N 3.34Å; I113-K115 PolarHBondContact O-N 2.86Å; I113-A116 WeakPolarHBondContact O-CB 3.16Å; I113-A116 PolarHBondContact O-N 3.05Å; I113-K117 WeakPolarHBondContact O-CG 3.25Å; I113-K117 PolarHBondContact O-N 3.06Å; I113-K117 VanDerWaalsContact O-N 3.08Å; I113-F131 HydrophobicContact CG2-CB 4.02Å; I113-W135 HydrophobicContact CG1-CE3 4.47Å; I113-W135 HydrophobicContact CG1-CZ3 4.22Å; I113-L136 HydrophobicContact CD1-CB 4.17Å; I113-L136 HydrophobicContact CD1-CD2 3.86Å; I113-L136 HydrophobicContact CG1-CB 4.21Å; I113-L136 HydrophobicContact CG1-CD1 4.38Å; I113-L136 HydrophobicContact CG1-CD2 4.17Å; I113-L136 HydrophobicContact CG1-CG 4.48Å
114	E	87	Confident	83.4	Confident	98 Å²	98	63.5 Å²	63.5	46%	0.458	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-45.5	178.8	-67.7	-53.2	118.3	0	0	110.6	P110 A116 K117 D118	P110-E114 PolarHBondContact O-N 3.4Å; E114-A116 VanDerWaalsContact C-N 3.26Å; E114-A116 PolarHBondContact O-N 3.17Å; E114-K117 WeakPolarHBondContact O-CB 3.35Å; E114-K117 PolarHBondContact O-N 3.23Å; E114-K117 IonicContact OE1-NZ 2.94Å; E114-K117 PolarHBondContact OE1-NZ 3.41Å; E114-K117 IonicContact OE2-NZ 2.73Å; E114-D118 PolarHBondContact O-N 3.12Å
115	K	91	Very high	84.7	Confident	40 Å²	40	62.7 Å²	62.7	17%	0.174	32%	0.324	C	S	.	.	H	α-helix	trans	-63.2	-33	177.4	-168	69.3	-166.7	161.1	0	113.4	L93 W96 M111 I113 D118 F119	L93-K115 HydrophobicContact CD1-CB 3.92Å; L93-K115 HydrophobicContact CD1-CG 3.86Å; W96-K115 HydrophobicContact CD2-CD 4.15Å; W96-K115 HydrophobicContact CD2-CG 3.65Å; W96-K115 HydrophobicContact CE3-CB 4.3Å; W96-K115 HydrophobicContact CE3-CG 3.77Å; W96-K115 HydrophobicContact CG-CG 4.23Å; W96-K115 HydrophobicContact CH2-CB 3.99Å; W96-K115 HydrophobicContact CH2-CD 4.44Å; W96-K115 HydrophobicContact CH2-CG 3.99Å; W96-K115 HydrophobicContact CZ2-CB 4.3Å; W96-K115 HydrophobicContact CZ2-CD 3.9Å; W96-K115 HydrophobicContact CZ2-CG 3.88Å; W96-K115 HydrophobicContact CZ3-CB 3.99Å; W96-K115 HydrophobicContact CZ3-CG 3.93Å; M111-K115 VanDerWaalsContact O-CB 3.25Å; M111-K115 WeakPolarHBondContact O-CB 3.45Å; M111-K115 PolarHBondContact O-N 2.96Å; I113-K115 VanDerWaalsContact C-N 3.34Å; I113-K115 PolarHBondContact O-N 2.86Å; K115-D118 IonicContact NZ-OD2 3.92Å; K115-D118 PolarHBondContact O-N 3.26Å; K115-F119 HydrophobicContact CD-CE2 4.38Å; K115-F119 HydrophobicContact CD-CZ 4.38Å; K115-F119 VanDerWaalsContact CE-CE1 3.47Å; K115-F119 HydrophobicContact CG-CD2 4.15Å; K115-F119 HydrophobicContact CG-CE2 3.86Å; K115-F119 HydrophobicContact CG-CZ 4.34Å; K115-F119 PolarHBondContact O-N 2.75Å
116	A	88.9	Confident	85.4	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67.4	-37.1	175.1	0	0	0	0	0	112.4	L93 L112 I113 E114 Y120 F131 W135	L93-A116 HydrophobicContact CD1-CB 4.35Å; L93-A116 HydrophobicContact CD2-CB 3.65Å; L112-A116 VanDerWaalsContact O-CB 3.23Å; L112-A116 WeakPolarHBondContact O-CB 3.34Å; L112-A116 PolarHBondContact O-N 2.84Å; I113-A116 WeakPolarHBondContact O-CB 3.16Å; I113-A116 PolarHBondContact O-N 3.05Å; E114-A116 VanDerWaalsContact C-N 3.26Å; E114-A116 PolarHBondContact O-N 3.17Å; A116-Y120 WeakPolarHBondContact O-CB 3.44Å; A116-Y120 PolarHBondContact O-N 2.84Å; A116-F131 HydrophobicContact CB-CD1 3.73Å; A116-F131 HydrophobicContact CB-CE1 3.56Å; A116-F131 HydrophobicContact CB-CZ 4.4Å; A116-W135 HydrophobicContact CB-CH2 3.33Å; A116-W135 HydrophobicContact CB-CZ2 3.94Å; A116-W135 HydrophobicContact CB-CZ3 4.02Å
117	K	89.1	Confident	86.2	Confident	75 Å²	75	66.7 Å²	66.7	33%	0.326	34%	0.34	S	S	.	.	H	α-helix	trans	-65.6	-45.7	173.8	-66.8	170.7	-176.5	169.3	0	110.9	I113 E114 F119 Y120 E121 F131	I113-K117 WeakPolarHBondContact O-CG 3.25Å; I113-K117 PolarHBondContact O-N 3.06Å; I113-K117 VanDerWaalsContact O-N 3.08Å; E114-K117 WeakPolarHBondContact O-CB 3.35Å; E114-K117 PolarHBondContact O-N 3.23Å; E114-K117 IonicContact OE1-NZ 2.94Å; E114-K117 PolarHBondContact OE1-NZ 3.41Å; E114-K117 IonicContact OE2-NZ 2.73Å; K117-F119 VanDerWaalsContact C-N 3.32Å; K117-F119 PolarHBondContact O-N 2.83Å; K117-Y120 WeakPolarHBondContact O-CB 3.36Å; K117-Y120 PolarHBondContact O-N 2.96Å; K117-Y120 VanDerWaalsContact O-N 3.09Å; K117-E121 PolarHBondContact O-N 3.05Å; K117-F131 HydrophobicContact CG-CD2 3.6Å; K117-F131 HydrophobicContact CG-CE2 3.98Å; K117-F131 HydrophobicContact CG-CG 4.1Å
118	D	88.5	Confident	86.4	Confident	65 Å²	65	71.6 Å²	71.6	35%	0.348	37%	0.372	S	S	.	.	H	α-helix	trans	-54.8	-49.4	176	-65.7	-9.7	0	0	0	111.3	E114 K115 Y120 E121 Q122	E114-D118 PolarHBondContact O-N 3.12Å; K115-D118 IonicContact NZ-OD2 3.92Å; K115-D118 PolarHBondContact O-N 3.26Å; D118-Y120 VanDerWaalsContact C-N 3.33Å; D118-Y120 PolarHBondContact O-N 3.41Å; D118-E121 PolarHBondContact O-N 3.13Å; D118-Q122 WeakPolarHBondContact O-CB 3.33Å; D118-Q122 WeakPolarHBondContact O-CG 3.44Å; D118-Q122 PolarHBondContact O-N 3.23Å
119	F	89.4	Confident	86.5	Confident	23 Å²	23	70.9 Å²	70.9	10%	0.101	37%	0.367	C	S	.	.	H	α-helix	trans	-67.3	-34.8	179	-74.7	-30.6	0	0	0	112.6	L89 V92 L93 W96 K115 K117 E121 Q122 M123	L89-F119 HydrophobicContact CD1-CB 3.37Å; L89-F119 HydrophobicContact CD1-CG 4.48Å; V92-F119 HydrophobicContact CG1-CD1 4.4Å; V92-F119 HydrophobicContact CG1-CD2 4.03Å; V92-F119 HydrophobicContact CG1-CE1 4.19Å; V92-F119 HydrophobicContact CG1-CE2 3.8Å; V92-F119 HydrophobicContact CG1-CG 4.32Å; V92-F119 HydrophobicContact CG1-CZ 3.87Å; L93-F119 HydrophobicContact CB-CD2 4.29Å; L93-F119 HydrophobicContact CD1-CD2 4.08Å; L93-F119 HydrophobicContact CD1-CE2 4.24Å; W96-F119 HydrophobicContact CB-CE2 3.78Å; W96-F119 HydrophobicContact CB-CZ 3.95Å; W96-F119 HydrophobicContact CG-CE2 4.09Å; W96-F119 HydrophobicContact CG-CZ 4.09Å; K115-F119 HydrophobicContact CD-CE2 4.38Å; K115-F119 HydrophobicContact CD-CZ 4.38Å; K115-F119 VanDerWaalsContact CE-CE1 3.47Å; K115-F119 HydrophobicContact CG-CD2 4.15Å; K115-F119 HydrophobicContact CG-CE2 3.86Å; K115-F119 HydrophobicContact CG-CZ 4.34Å; K115-F119 PolarHBondContact O-N 2.75Å; K117-F119 VanDerWaalsContact C-N 3.32Å; K117-F119 PolarHBondContact O-N 2.83Å; F119-E121 VanDerWaalsContact C-N 3.34Å; F119-Q122 PolarHBondContact O-N 3.22Å; F119-M123 HydrophobicContact CB-CE 4.09Å; F119-M123 HydrophobicContact CG-CE 4.38Å; F119-M123 VanDerWaalsContact O-CB 3.23Å; F119-M123 WeakPolarHBondContact O-CB 3.41Å; F119-M123 WeakPolarHBondContact O-CG 3.27Å; F119-M123 PolarHBondContact O-N 3.08Å
120	Y	89.9	Confident	86.9	Confident	42 Å²	42	76 Å²	76	17%	0.165	40%	0.397	C	S	.	.	H	α-helix	trans	-62.3	-42.4	176	-178.9	-80.8	0	0	0	111.7	L86 L89 A116 K117 D118 Q124 L125 E127 C129 F131	L86-Y120 HydrophobicContact CD1-CD2 3.78Å; L86-Y120 HydrophobicContact CD1-CE2 3.74Å; L89-Y120 HydrophobicContact CD2-CD2 4Å; A116-Y120 WeakPolarHBondContact O-CB 3.44Å; A116-Y120 PolarHBondContact O-N 2.84Å; K117-Y120 WeakPolarHBondContact O-CB 3.36Å; K117-Y120 PolarHBondContact O-N 2.96Å; K117-Y120 VanDerWaalsContact O-N 3.09Å; D118-Y120 VanDerWaalsContact C-N 3.33Å; D118-Y120 PolarHBondContact O-N 3.41Å; Y120-Q124 PolarHBondContact O-N 3.17Å; Y120-L125 HydrophobicContact CD1-CB 4.48Å; Y120-L125 HydrophobicContact CD2-CB 3.78Å; Y120-L125 HydrophobicContact CD2-CD1 3.84Å; Y120-L125 HydrophobicContact CD2-CG 4.42Å; Y120-L125 HydrophobicContact CE1-CB 4.28Å; Y120-L125 WeakPolarHBondContact CE1-O 3.08Å; Y120-L125 HydrophobicContact CE2-CB 3.57Å; Y120-L125 HydrophobicContact CE2-CD1 4.3Å; Y120-L125 HydrophobicContact CG-CB 4.22Å; Y120-L125 HydrophobicContact CG-CD1 4.44Å; Y120-L125 PolarHBondContact O-N 3.24Å; Y120-L125 PolarHBondContact OH-O 3.49Å; Y120-E127 WeakPolarHBondContact CE2-O 3.09Å; Y120-E127 PolarHBondContact OH-O 3.09Å; Y120-C129 HydrophobicContact CD2-CB 4.3Å; Y120-C129 HydrophobicContact CE2-CB 3.81Å; Y120-F131 HydrophobicContact CD2-CE2 4.18Å; Y120-F131 AromaticContact CD2-CZ 3.74Å; Y120-F131 HydrophobicContact CD2-CZ 3.74Å; Y120-F131 HydrophobicContact CG-CE2 4.06Å; Y120-F131 AromaticContact CG-CZ 3.85Å; Y120-F131 HydrophobicContact CG-CZ 3.85Å
121	E	89.8	Confident	87.1	Confident	145 Å²	145	73.1 Å²	73.1	68%	0.678	38%	0.375	S	S	*	.	H	α-helix	trans	-68.5	-46.7	174.8	-69.4	177.2	-172.5	0	0	112	K117 D118 F119 M123 Q124	K117-E121 PolarHBondContact O-N 3.05Å; D118-E121 PolarHBondContact O-N 3.13Å; F119-E121 VanDerWaalsContact C-N 3.34Å; E121-M123 VanDerWaalsContact C-N 3.28Å; E121-M123 PolarHBondContact O-N 2.98Å; E121-Q124 PolarHBondContact O-N 3.43Å
122	Q	87.8	Confident	87.2	Confident	128 Å²	128	71.8 Å²	71.8	60%	0.598	37%	0.374	S	S	*	.	H	α-helix	trans	-61.9	-34.9	180	-73.6	172	14.6	0	0	112.9	D118 F119 Q124	D118-Q122 WeakPolarHBondContact O-CB 3.33Å; D118-Q122 WeakPolarHBondContact O-CG 3.44Å; D118-Q122 PolarHBondContact O-N 3.23Å; F119-Q122 PolarHBondContact O-N 3.22Å; Q122-Q124 VanDerWaalsContact C-N 3.26Å
123	M	87.5	Confident	86.8	Confident	49 Å²	49	74.4 Å²	74.4	24%	0.241	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-0.4	177.2	-66.2	171.8	-172.6	0	0	113.2	H88 L89 V92 F119 E121 L125	H88-M123 VanDerWaalsContact CD2-SD 3.59Å; L89-M123 HydrophobicContact CB-SD 4.36Å; L89-M123 HydrophobicContact CD1-SD 4.28Å; V92-M123 HydrophobicContact CB-CE 3.6Å; V92-M123 HydrophobicContact CG1-CE 3.6Å; V92-M123 HydrophobicContact CG2-CE 3.64Å; F119-M123 HydrophobicContact CB-CE 4.09Å; F119-M123 HydrophobicContact CG-CE 4.38Å; F119-M123 VanDerWaalsContact O-CB 3.23Å; F119-M123 WeakPolarHBondContact O-CB 3.41Å; F119-M123 WeakPolarHBondContact O-CG 3.27Å; F119-M123 PolarHBondContact O-N 3.08Å; E121-M123 VanDerWaalsContact C-N 3.28Å; E121-M123 PolarHBondContact O-N 2.98Å; M123-L125 HydrophobicContact CB-CD1 4.18Å; M123-L125 HydrophobicContact CB-CD2 4.29Å; M123-L125 HydrophobicContact CB-CG 3.81Å; M123-L125 PolarHBondContact O-N 3.19Å; M123-L125 HydrophobicContact SD-CD1 4.39Å
124	Q	88.5	Confident	86.6	Confident	166 Å²	166	75.2 Å²	75.2	78%	0.776	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	39.5	-179.9	-58.2	175.5	14.8	0	0	112.8	Y120 E121 Q122	Y120-Q124 PolarHBondContact O-N 3.17Å; E121-Q124 PolarHBondContact O-N 3.43Å; Q122-Q124 VanDerWaalsContact C-N 3.26Å
125	L	86.5	Confident	86.8	Confident	49 Å²	49	72.5 Å²	72.5	26%	0.257	40%	0.401	S	S	.	.			trans	-73	133.1	-179.3	-62.5	174.9	0	0	0	110.2	L86 L89 Y120 M123	L86-L125 HydrophobicContact CD1-CD1 4.3Å; L86-L125 HydrophobicContact CD2-CD1 4.24Å; L89-L125 HydrophobicContact CB-CD1 3.97Å; L89-L125 HydrophobicContact CD2-CD1 4.27Å; Y120-L125 HydrophobicContact CD1-CB 4.48Å; Y120-L125 HydrophobicContact CD2-CB 3.78Å; Y120-L125 HydrophobicContact CD2-CD1 3.84Å; Y120-L125 HydrophobicContact CD2-CG 4.42Å; Y120-L125 HydrophobicContact CE1-CB 4.28Å; Y120-L125 WeakPolarHBondContact CE1-O 3.08Å; Y120-L125 HydrophobicContact CE2-CB 3.57Å; Y120-L125 HydrophobicContact CE2-CD1 4.3Å; Y120-L125 HydrophobicContact CG-CB 4.22Å; Y120-L125 HydrophobicContact CG-CD1 4.44Å; Y120-L125 PolarHBondContact O-N 3.24Å; Y120-L125 PolarHBondContact OH-O 3.49Å; M123-L125 HydrophobicContact CB-CD1 4.18Å; M123-L125 HydrophobicContact CB-CD2 4.29Å; M123-L125 HydrophobicContact CB-CG 3.81Å; M123-L125 PolarHBondContact O-N 3.19Å; M123-L125 HydrophobicContact SD-CD1 4.39Å
126	T	84.9	Confident	86.6	Confident	133 Å²	133	71.5 Å²	71.5	82%	0.816	40%	0.398	S	S	*	.			trans	-107.1	-9.4	-177.6	54.4	0	0	0	0	113.1
127	E	84.8	Confident	86.3	Confident	101 Å²	101	80.2 Å²	80.2	47%	0.472	43%	0.431	S	S	.	.	S	Bend	trans	-72.6	126.7	-179.8	-70.1	-168.8	-173.8	0	0	112.2	L86 Y120 C129	L86-E127 HydrophobicContact CD2-CB 3.98Å; L86-E127 HydrophobicContact CD2-CG 4.43Å; L86-E127 WeakPolarHBondContact CD2-OE2 3.47Å; Y120-E127 WeakPolarHBondContact CE2-O 3.09Å; Y120-E127 PolarHBondContact OH-O 3.09Å; E127-C129 PolarHBondContact O-N 3.21Å
128	P	81.4	Confident	86	Confident	131 Å²	131	84.9 Å²	84.9	85%	0.851	45%	0.446	S	S	*	.			trans	-59.7	114.7	-174.7	23.8	-33.4	0	0	0	112
129	C	81.9	Confident	85.8	Confident	35 Å²	35	81.8 Å²	81.8	24%	0.236	43%	0.43	C	S	.	.			trans	-127.8	124.5	179.6	-175.1	0	0	0	0	111.3	L86 Y120 E127 F131	L86-C129 HydrophobicContact CD1-CB 3.67Å; Y120-C129 HydrophobicContact CD2-CB 4.3Å; Y120-C129 HydrophobicContact CE2-CB 3.81Å; E127-C129 PolarHBondContact O-N 3.21Å; C129-F131 HydrophobicContact CB-CE2 4.47Å; C129-F131 HydrophobicContact CB-CZ 4.37Å
130	V	86.7	Confident	85.4	Confident	115 Å²	115	82.2 Å²	82.2	70%	0.697	43%	0.432	S	S	*	.			trans	-102.2	108.3	174.6	-175.6	0	0	0	0	108.8	S132 W135	V130-S132 PolarHBondContact O-N 3.11Å; V130-W135 WeakPolarHBondContact O-CB 3.21Å
131	F	88.1	Confident	84.8	Confident	31 Å²	31	83.1 Å²	83.1	14%	0.136	45%	0.447	C	S	.	.			trans	-73.6	55.2	175.7	-59.8	-77.5	0	0	0	112.5	L89 I113 A116 K117 Y120 C129 W135	L89-F131 HydrophobicContact CD2-CE1 3.88Å; L89-F131 HydrophobicContact CD2-CZ 3.9Å; I113-F131 HydrophobicContact CG2-CB 4.02Å; A116-F131 HydrophobicContact CB-CD1 3.73Å; A116-F131 HydrophobicContact CB-CE1 3.56Å; A116-F131 HydrophobicContact CB-CZ 4.4Å; K117-F131 HydrophobicContact CG-CD2 3.6Å; K117-F131 HydrophobicContact CG-CE2 3.98Å; K117-F131 HydrophobicContact CG-CG 4.1Å; Y120-F131 HydrophobicContact CD2-CE2 4.18Å; Y120-F131 AromaticContact CD2-CZ 3.74Å; Y120-F131 HydrophobicContact CD2-CZ 3.74Å; Y120-F131 HydrophobicContact CG-CE2 4.06Å; Y120-F131 AromaticContact CG-CZ 3.85Å; Y120-F131 HydrophobicContact CG-CZ 3.85Å; C129-F131 HydrophobicContact CB-CE2 4.47Å; C129-F131 HydrophobicContact CB-CZ 4.37Å; F131-W135 HydrophobicContact CB-CE3 4.39Å; F131-W135 AromaticContact CD1-CD2 3.84Å; F131-W135 HydrophobicContact CD1-CD2 3.84Å; F131-W135 AromaticContact CD1-CE2 3.7Å; F131-W135 AromaticContact CD1-CE3 3.9Å; F131-W135 HydrophobicContact CD1-CE3 3.9Å; F131-W135 AromaticContact CD1-CH2 3.86Å; F131-W135 HydrophobicContact CD1-CH2 3.86Å; F131-W135 AromaticContact CD1-CZ2 3.73Å; F131-W135 HydrophobicContact CD1-CZ2 3.73Å; F131-W135 AromaticContact CD1-CZ3 3.92Å; F131-W135 HydrophobicContact CD1-CZ3 3.92Å; F131-W135 AromaticContact CE1-CE2 3.97Å; F131-W135 HydrophobicContact CE1-CH2 4.19Å; F131-W135 AromaticContact CE1-CZ2 3.78Å; F131-W135 HydrophobicContact CE1-CZ2 3.78Å
132	S	86.6	Confident	84.2	Confident	54 Å²	54	78.4 Å²	78.4	38%	0.378	42%	0.424	S	S	.	.			trans	-75.5	168.6	178.9	63.2	0	0	0	0	112.4	V130 G134 W135 L136	V130-S132 PolarHBondContact O-N 3.11Å; S132-G134 PolarHBondContact O-N 2.71Å; S132-G134 PolarHBondContact OG-N 2.82Å; S132-W135 WeakPolarHBondContact O-CB 3.22Å; S132-W135 PolarHBondContact O-N 2.79Å; S132-W135 PolarHBondContact OG-N 2.83Å; S132-L136 PolarHBondContact O-N 2.84Å
133	G	78.2	Confident	83.7	Confident	56 Å²	56	73.7 Å²	73.7	58%	0.577	40%	0.401	S	S	*	.	H	α-helix	trans	-56.4	-32.1	169.2	0	0	0	0	0	113.3	L136 W137	G133-L136 PolarHBondContact O-N 2.89Å; G133-W137 WeakPolarHBondContact O-CB 3.36Å; G133-W137 PolarHBondContact O-N 3.32Å
134	G	82.4	Confident	82.8	Confident	43 Å²	43	73.4 Å²	73.4	44%	0.443	41%	0.411	S	S	.	.	H	α-helix	trans	-68.6	-37.4	174.2	0	0	0	0	0	113.3	S132 R138	S132-G134 PolarHBondContact O-N 2.71Å; S132-G134 PolarHBondContact OG-N 2.82Å; G134-R138 WeakPolarHBondContact O-CG 3.49Å; G134-R138 PolarHBondContact O-N 3.34Å; G134-R138 VanDerWaalsContact O-N 3.15Å
135	W	90.3	Very high	82.1	Confident	41 Å²	41	66.4 Å²	66.4	16%	0.155	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-47.9	172.4	172	94.8	0	0	0	110.8	L93 I113 A116 V130 F131 S132 W137 R138 F139	L93-W135 HydrophobicContact CD2-CH2 3.57Å; L93-W135 HydrophobicContact CD2-CZ2 4.17Å; I113-W135 HydrophobicContact CG1-CE3 4.47Å; I113-W135 HydrophobicContact CG1-CZ3 4.22Å; A116-W135 HydrophobicContact CB-CH2 3.33Å; A116-W135 HydrophobicContact CB-CZ2 3.94Å; A116-W135 HydrophobicContact CB-CZ3 4.02Å; V130-W135 WeakPolarHBondContact O-CB 3.21Å; F131-W135 HydrophobicContact CB-CE3 4.39Å; F131-W135 AromaticContact CD1-CD2 3.84Å; F131-W135 HydrophobicContact CD1-CD2 3.84Å; F131-W135 AromaticContact CD1-CE2 3.7Å; F131-W135 AromaticContact CD1-CE3 3.9Å; F131-W135 HydrophobicContact CD1-CE3 3.9Å; F131-W135 AromaticContact CD1-CH2 3.86Å; F131-W135 HydrophobicContact CD1-CH2 3.86Å; F131-W135 AromaticContact CD1-CZ2 3.73Å; F131-W135 HydrophobicContact CD1-CZ2 3.73Å; F131-W135 AromaticContact CD1-CZ3 3.92Å; F131-W135 HydrophobicContact CD1-CZ3 3.92Å; F131-W135 AromaticContact CE1-CE2 3.97Å; F131-W135 HydrophobicContact CE1-CH2 4.19Å; F131-W135 AromaticContact CE1-CZ2 3.78Å; F131-W135 HydrophobicContact CE1-CZ2 3.78Å; S132-W135 WeakPolarHBondContact O-CB 3.22Å; S132-W135 PolarHBondContact O-N 2.79Å; S132-W135 PolarHBondContact OG-N 2.83Å; W135-W137 VanDerWaalsContact C-N 3.34Å; W135-W137 PolarHBondContact O-N 2.95Å; W135-R138 PolarHBondContact O-N 2.7Å; W135-R138 VanDerWaalsContact O-N 3.15Å; W135-F139 PolarHBondContact O-N 3.43Å
136	L	86.9	Confident	81.2	Confident	19 Å²	19	72.7 Å²	72.7	10%	0.099	40%	0.404	C	S	.	.	H	α-helix	trans	-60.8	-43.1	178.7	176.6	64.7	0	0	0	111.7	L112 I113 S132 G133 R138 F139 K140	L112-L136 HydrophobicContact CB-CD1 3.81Å; L112-L136 HydrophobicContact CD1-CD1 3.97Å; I113-L136 HydrophobicContact CD1-CB 4.17Å; I113-L136 HydrophobicContact CD1-CD2 3.86Å; I113-L136 HydrophobicContact CG1-CB 4.21Å; I113-L136 HydrophobicContact CG1-CD1 4.38Å; I113-L136 HydrophobicContact CG1-CD2 4.17Å; I113-L136 HydrophobicContact CG1-CG 4.48Å; S132-L136 PolarHBondContact O-N 2.84Å; G133-L136 PolarHBondContact O-N 2.89Å; L136-R138 VanDerWaalsContact C-N 3.31Å; L136-R138 PolarHBondContact O-N 2.69Å; L136-F139 WeakPolarHBondContact O-CB 3.48Å; L136-F139 PolarHBondContact O-N 3.43Å; L136-K140 HydrophobicContact CD1-CD 4.45Å; L136-K140 HydrophobicContact CD1-CG 4.26Å; L136-K140 HydrophobicContact CG-CD 4.41Å; L136-K140 WeakPolarHBondContact O-CG 3.43Å; L136-K140 PolarHBondContact O-N 3.27Å
137	W	82.4	Confident	79.7	Confident	184 Å²	184	74.4 Å²	74.4	70%	0.697	40%	0.4	S	S	*	.	H	α-helix	trans	-59.2	-43.8	176.7	-177.1	88.8	0	0	0	111.5	G133 W135 K140 A141	G133-W137 WeakPolarHBondContact O-CB 3.36Å; G133-W137 PolarHBondContact O-N 3.32Å; W135-W137 VanDerWaalsContact C-N 3.34Å; W135-W137 PolarHBondContact O-N 2.95Å; W137-K140 PolarHBondContact O-N 3.02Å; W137-A141 VanDerWaalsContact O-CB 3.27Å; W137-A141 WeakPolarHBondContact O-CB 3.2Å; W137-A141 PolarHBondContact O-N 3.11Å
138	R	83.4	Confident	78.3	Confident	173 Å²	173	74.1 Å²	74.1	65%	0.653	40%	0.401	S	S	*	.	H	α-helix	trans	-67.5	-37.4	176.9	-71.3	179.3	174.8	-169.8	-0.8	112.7	G134 W135 L136 R142	G134-R138 WeakPolarHBondContact O-CG 3.49Å; G134-R138 PolarHBondContact O-N 3.34Å; G134-R138 VanDerWaalsContact O-N 3.15Å; W135-R138 PolarHBondContact O-N 2.7Å; W135-R138 VanDerWaalsContact O-N 3.15Å; L136-R138 VanDerWaalsContact C-N 3.31Å; L136-R138 PolarHBondContact O-N 2.69Å; R138-R142 WeakPolarHBondContact O-CB 3.2Å; R138-R142 VanDerWaalsContact O-CG 3.27Å; R138-R142 WeakPolarHBondContact O-CG 3.14Å; R138-R142 PolarHBondContact O-N 3.49Å; R138-R142 PolarHBondContact O-NE 2.93Å; R138-R142 VanDerWaalsContact O-NE 3.13Å
139	F	84.4	Confident	76.2	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-60	-54.5	172.9	174.7	-93.5	0	0	0	110.8	D90 L93 L112 W135 L136 A141 R142 H143 I145	D90-F139 WeakPolarHBondContact OD1-CD2 3.37Å; L93-F139 HydrophobicContact CB-CE2 4.06Å; L93-F139 HydrophobicContact CB-CZ 4.2Å; L93-F139 HydrophobicContact CD2-CD2 4.04Å; L93-F139 HydrophobicContact CD2-CE1 4.27Å; L93-F139 HydrophobicContact CD2-CE2 3.63Å; L93-F139 HydrophobicContact CD2-CZ 3.75Å; L93-F139 HydrophobicContact CG-CE1 4.48Å; L93-F139 HydrophobicContact CG-CE2 3.94Å; L93-F139 HydrophobicContact CG-CZ 3.75Å; L112-F139 HydrophobicContact CD1-CD1 4.45Å; L112-F139 HydrophobicContact CD1-CE1 4.22Å; L112-F139 HydrophobicContact CD2-CE1 3.88Å; L112-F139 HydrophobicContact CD2-CZ 4.45Å; W135-F139 PolarHBondContact O-N 3.43Å; L136-F139 WeakPolarHBondContact O-CB 3.48Å; L136-F139 PolarHBondContact O-N 3.43Å; F139-A141 VanDerWaalsContact C-N 3.32Å; F139-A141 PolarHBondContact O-N 2.92Å; F139-R142 PolarHBondContact O-N 3.31Å; F139-H143 AromaticContact CD2-CD2 3.71Å; F139-H143 AromaticContact CE2-CD2 3.4Å; F139-H143 VanDerWaalsContact CE2-CD2 3.4Å; F139-H143 WeakPolarHBondContact CE2-CD2 3.42Å; F139-H143 AromaticContact CE2-NE2 3.65Å; F139-H143 AromaticContact CZ-CD2 3.69Å; F139-H143 PolarHBondContact O-CD2 3.15Å; F139-H143 PolarHBondContact O-N 2.85Å; F139-I145 HydrophobicContact CD1-CD1 4.19Å; F139-I145 HydrophobicContact CE1-CD1 3.59Å; F139-I145 HydrophobicContact CZ-CD1 4.36Å
140	K	81.7	Confident	74.3	Confident	32 Å²	32	73.9 Å²	73.9	14%	0.139	40%	0.402	C	S	.	.	H	α-helix	trans	-57.1	-44.8	178.7	-73.7	-173.7	177.4	-170.9	0	112	L136 W137 R142 H143 G144 I145 D149	L136-K140 HydrophobicContact CD1-CD 4.45Å; L136-K140 HydrophobicContact CD1-CG 4.26Å; L136-K140 HydrophobicContact CG-CD 4.41Å; L136-K140 WeakPolarHBondContact O-CG 3.43Å; L136-K140 PolarHBondContact O-N 3.27Å; W137-K140 PolarHBondContact O-N 3.02Å; K140-R142 PolarHBondContact O-N 2.69Å; K140-H143 PolarHBondContact O-N 3.29Å; K140-G144 PolarHBondContact O-N 3.28Å; K140-G144 VanDerWaalsContact O-N 3.14Å; K140-I145 HydrophobicContact CB-CB 4.1Å; K140-I145 HydrophobicContact CG-CB 4.16Å; K140-I145 HydrophobicContact CG-CG2 4.17Å; K140-I145 PolarHBondContact O-N 2.82Å; K140-D149 IonicContact NZ-OD1 3.9Å
141	A	76.4	Confident	72.5	Confident	60 Å²	60	70.8 Å²	70.8	50%	0.496	39%	0.385	S	S	.	.	H	α-helix	trans	-63.4	-40	179	0	0	0	0	0	113	W137 F139 H143 G144	W137-A141 VanDerWaalsContact O-CB 3.27Å; W137-A141 WeakPolarHBondContact O-CB 3.2Å; W137-A141 PolarHBondContact O-N 3.11Å; F139-A141 VanDerWaalsContact C-N 3.32Å; F139-A141 PolarHBondContact O-N 2.92Å; A141-H143 VanDerWaalsContact C-N 3.35Å; A141-G144 PolarHBondContact O-N 3.07Å
142	R	78.4	Confident	70.9	Confident	47 Å²	47	72.2 Å²	72.2	18%	0.177	40%	0.399	C	S	.	.	H	α-helix	trans	-67.9	-35.6	-180	-77.8	178.9	-61.5	113.8	-4.6	112.7	D90 R138 F139 K140	D90-R142 IonicContact OD1-CZ 3.65Å; D90-R142 IonicContact OD1-NH1 3.79Å; D90-R142 PolarHBondContact OD1-NH1 3.19Å; D90-R142 IonicContact OD1-NH2 2.76Å; D90-R142 PolarHBondContact OD1-NH2 2.86Å; D90-R142 IonicContact OD2-CZ 3.23Å; D90-R142 IonicContact OD2-NH1 2.75Å; D90-R142 PolarHBondContact OD2-NH1 3.36Å; R138-R142 WeakPolarHBondContact O-CB 3.2Å; R138-R142 VanDerWaalsContact O-CG 3.27Å; R138-R142 WeakPolarHBondContact O-CG 3.14Å; R138-R142 PolarHBondContact O-N 3.49Å; R138-R142 PolarHBondContact O-NE 2.93Å; R138-R142 VanDerWaalsContact O-NE 3.13Å; F139-R142 PolarHBondContact O-N 3.31Å; K140-R142 PolarHBondContact O-N 2.69Å
143	H	76.3	Confident	69.3	Low	29 Å²	29	77.1 Å²	77.1	13%	0.134	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	7	-177.9	-72.1	-55.6	0	0	0	114.3	D90 Y94 F139 K140 A141 I145	D90-H143 IonicContact OD1-NE2 2.94Å; D90-H143 IonicContact OD2-CD2 2.85Å; D90-H143 IonicContact OD2-CE1 3.81Å; D90-H143 PolarHBondContact OD2-CE1 3.07Å; D90-H143 IonicContact OD2-NE2 2.72Å; D90-H143 PolarHBondContact OD2-NE2 2.91Å; Y94-H143 AromaticContact CD1-CE1 3.8Å; Y94-H143 AromaticContact CD1-ND1 3.53Å; Y94-H143 HydrophobicContact CD2-CB 3.62Å; Y94-H143 AromaticContact CD2-CG 3.46Å; Y94-H143 VanDerWaalsContact CD2-CG 3.46Å; Y94-H143 AromaticContact CD2-ND1 3.63Å; Y94-H143 AromaticContact CE1-ND1 3.79Å; Y94-H143 HydrophobicContact CE2-CB 3.5Å; Y94-H143 AromaticContact CE2-CG 3.8Å; Y94-H143 AromaticContact CE2-ND1 3.92Å; Y94-H143 HydrophobicContact CG-CB 4.32Å; Y94-H143 AromaticContact CG-CE1 3.61Å; Y94-H143 AromaticContact CG-CG 3.69Å; Y94-H143 AromaticContact CG-ND1 3.42Å; Y94-H143 AromaticContact CZ-ND1 3.96Å; F139-H143 AromaticContact CD2-CD2 3.71Å; F139-H143 AromaticContact CE2-CD2 3.4Å; F139-H143 VanDerWaalsContact CE2-CD2 3.4Å; F139-H143 WeakPolarHBondContact CE2-CD2 3.42Å; F139-H143 AromaticContact CE2-NE2 3.65Å; F139-H143 AromaticContact CZ-CD2 3.69Å; F139-H143 PolarHBondContact O-CD2 3.15Å; F139-H143 PolarHBondContact O-N 2.85Å; K140-H143 PolarHBondContact O-N 3.29Å; A141-H143 VanDerWaalsContact C-N 3.35Å; H143-I145 HydrophobicContact CB-CD1 3.87Å; H143-I145 HydrophobicContact CB-CG1 3.81Å; H143-I145 PolarHBondContact O-N 3.02Å; H143-I145 VanDerWaalsContact O-N 3.16Å
144	G	68.2	Low	68.6	Low	42 Å²	42	81 Å²	81	43%	0.433	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	21.7	-178.1	0	0	0	0	0	113.5	K140 A141 K146	K140-G144 PolarHBondContact O-N 3.28Å; K140-G144 VanDerWaalsContact O-N 3.14Å; A141-G144 PolarHBondContact O-N 3.07Å; G144-K146 VanDerWaalsContact C-N 3.35Å; G144-K146 PolarHBondContact O-N 3.46Å
145	I	74.5	Confident	67.9	Low	20 Å²	20	83.4 Å²	83.4	10%	0.103	42%	0.417	C	S	.	.			trans	-75.3	92.3	177.5	-55.4	172.3	0	0	0	106.8	Y94 F97 F139 K140 H143	Y94-I145 HydrophobicContact CD2-CD1 4.25Å; Y94-I145 HydrophobicContact CE2-CD1 4.31Å; Y94-I145 HydrophobicContact CE2-CG1 4.37Å; F97-I145 HydrophobicContact CD1-CD1 3.81Å; F97-I145 HydrophobicContact CD1-CG1 4.3Å; F97-I145 HydrophobicContact CD2-CD1 4.43Å; F97-I145 HydrophobicContact CE1-CD1 3.71Å; F97-I145 HydrophobicContact CE1-CG1 3.74Å; F97-I145 HydrophobicContact CE1-CG2 4.4Å; F97-I145 HydrophobicContact CE2-CD1 4.34Å; F97-I145 HydrophobicContact CE2-CG2 4.24Å; F97-I145 HydrophobicContact CG-CD1 4.17Å; F97-I145 HydrophobicContact CZ-CD1 4Å; F97-I145 HydrophobicContact CZ-CG1 4.01Å; F97-I145 HydrophobicContact CZ-CG2 3.78Å; F139-I145 HydrophobicContact CD1-CD1 4.19Å; F139-I145 HydrophobicContact CE1-CD1 3.59Å; F139-I145 HydrophobicContact CZ-CD1 4.36Å; K140-I145 HydrophobicContact CB-CB 4.1Å; K140-I145 HydrophobicContact CG-CB 4.16Å; K140-I145 HydrophobicContact CG-CG2 4.17Å; K140-I145 PolarHBondContact O-N 2.82Å; H143-I145 HydrophobicContact CB-CD1 3.87Å; H143-I145 HydrophobicContact CB-CG1 3.81Å; H143-I145 PolarHBondContact O-N 3.02Å; H143-I145 VanDerWaalsContact O-N 3.16Å
146	K	67.4	Low	67.3	Low	181 Å²	181	84.3 Å²	84.3	79%	0.787	43%	0.433	S	S	*	.			trans	-65.1	147.6	172.2	-65.4	-177.6	-178.4	179.2	0	109.1	G144 L148	G144-K146 VanDerWaalsContact C-N 3.35Å; G144-K146 PolarHBondContact O-N 3.46Å; K146-L148 PolarHBondContact O-N 3.41Å
147	K	53.9	Low	66.8	Low	168 Å²	168	85.8 Å²	85.8	73%	0.73	45%	0.448	S	S	*	.			trans	-53.8	99.2	174.5	-158.9	-176.6	-174.1	-171.2	0	108.8	D149	K147-D149 HydrophobicContact CD-CB 4.1Å; K147-D149 WeakPolarHBondContact CD-OD2 3.32Å; K147-D149 VanDerWaalsContact CE-CG 3.5Å; K147-D149 WeakPolarHBondContact CE-OD2 3.3Å; K147-D149 HydrophobicContact CG-CB 3.59Å; K147-D149 WeakPolarHBondContact CG-OD2 3.5Å; K147-D149 PolarHBondContact O-N 2.92Å
148	L	53.9	Low	66.9	Low	96 Å²	96	78.6 Å²	78.6	50%	0.503	42%	0.423	S	S	.	.			trans	-92.8	49.8	167.5	-117.7	156.2	0	0	0	106.5	K146	K146-L148 PolarHBondContact O-N 3.41Å
149	D	37.8	Very low	67.1	Low	76 Å²	76	75.2 Å²	75.2	41%	0.406	42%	0.415	S	S	.	.	S	Bend	trans	-99.2	126.9	-174.2	-60.6	1.3	0	0	0	107.7	K140 K147 S151	K140-D149 IonicContact NZ-OD1 3.9Å; K147-D149 HydrophobicContact CD-CB 4.1Å; K147-D149 WeakPolarHBondContact CD-OD2 3.32Å; K147-D149 VanDerWaalsContact CE-CG 3.5Å; K147-D149 WeakPolarHBondContact CE-OD2 3.3Å; K147-D149 HydrophobicContact CG-CB 3.59Å; K147-D149 WeakPolarHBondContact CG-OD2 3.5Å; K147-D149 PolarHBondContact O-N 2.92Å; D149-S151 PolarHBondContact O-N 3.11Å
150	A	42.4	Very low	67.3	Low	84 Å²	84	80.8 Å²	80.8	69%	0.694	44%	0.44	S	S	*	.	S	Bend	trans	62.6	-16.6	-179.6	0	0	0	0	0	117.5	K154	A150-K154 WeakPolarHBondContact O-CB 3.36Å; A150-K154 PolarHBondContact O-N 3.16Å
151	S	49.7	Very low	67.6	Low	50 Å²	50	80.4 Å²	80.4	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-73.7	-30.3	-176.7	-166.7	0	0	0	0	113.7	D149 Q155	D149-S151 PolarHBondContact O-N 3.11Å; S151-Q155 WeakPolarHBondContact O-CA 3.43Å; S151-Q155 WeakPolarHBondContact O-CB 3.43Å; S151-Q155 WeakPolarHBondContact O-CG 3.33Å; S151-Q155 PolarHBondContact O-N 2.93Å; S151-Q155 PolarHBondContact O-OE1 3.25Å; S151-Q155 VanDerWaalsContact OG-CD 3.29Å; S151-Q155 PolarHBondContact OG-NE2 3.46Å
152	S	53.5	Low	68.3	Low	61 Å²	61	77.8 Å²	77.8	43%	0.427	42%	0.422	S	S	.	.	H	α-helix	trans	-77	-43.4	-174.6	-164.7	0	0	0	0	112.8	Q155 A156	S152-Q155 PolarHBondContact O-N 2.89Å; S152-A156 VanDerWaalsContact O-CB 3.28Å; S152-A156 WeakPolarHBondContact O-CB 3.35Å; S152-A156 PolarHBondContact O-N 3.18Å
153	E	53.2	Low	69	Low	157 Å²	157	82.2 Å²	82.2	73%	0.734	45%	0.445	S	S	*	.	H	α-helix	trans	-69.5	-42.4	175.3	-73	172.9	-173.3	0	0	110.8	A156 A157	E153-A156 PolarHBondContact O-N 3.49Å; E153-A157 VanDerWaalsContact O-CB 3.31Å; E153-A157 WeakPolarHBondContact O-CB 3.26Å; E153-A157 PolarHBondContact O-N 3.4Å
154	K	64.4	Low	69.8	Low	137 Å²	137	86.6 Å²	86.6	60%	0.596	47%	0.465	S	S	*	.	H	α-helix	trans	-62.2	-44	173	-175.4	176.7	175.9	-177.8	0	111.4	A150 A157 D158	A150-K154 WeakPolarHBondContact O-CB 3.36Å; A150-K154 PolarHBondContact O-N 3.16Å; K154-A157 PolarHBondContact O-N 2.97Å; K154-D158 VanDerWaalsContact O-CB 3.25Å; K154-D158 WeakPolarHBondContact O-CB 3.45Å; K154-D158 PolarHBondContact O-N 3.32Å
155	Q	67.8	Low	71.1	Confident	95 Å²	95	85.4 Å²	85.4	44%	0.444	45%	0.448	S	S	.	.	H	α-helix	trans	-62.6	-43	174.4	-80.2	164.8	-9.1	0	0	111.4	S151 S152 A157 D158 H159	S151-Q155 WeakPolarHBondContact O-CA 3.43Å; S151-Q155 WeakPolarHBondContact O-CB 3.43Å; S151-Q155 WeakPolarHBondContact O-CG 3.33Å; S151-Q155 PolarHBondContact O-N 2.93Å; S151-Q155 PolarHBondContact O-OE1 3.25Å; S151-Q155 VanDerWaalsContact OG-CD 3.29Å; S151-Q155 PolarHBondContact OG-NE2 3.46Å; S152-Q155 PolarHBondContact O-N 2.89Å; Q155-A157 VanDerWaalsContact C-N 3.35Å; Q155-A157 PolarHBondContact O-N 2.95Å; Q155-D158 PolarHBondContact O-N 3.48Å; Q155-H159 VanDerWaalsContact O-CB 3.32Å; Q155-H159 WeakPolarHBondContact O-CB 3.41Å; Q155-H159 PolarHBondContact O-CD2 2.92Å; Q155-H159 PolarHBondContact O-N 2.88Å
156	A	76.5	Confident	72	Confident	59 Å²	59	84.9 Å²	84.9	49%	0.488	45%	0.446	S	S	.	.	H	α-helix	trans	-61.6	-44	176.4	0	0	0	0	0	111.4	S152 E153 H159 Q160	S152-A156 VanDerWaalsContact O-CB 3.28Å; S152-A156 WeakPolarHBondContact O-CB 3.35Å; S152-A156 PolarHBondContact O-N 3.18Å; E153-A156 PolarHBondContact O-N 3.49Å; A156-H159 PolarHBondContact O-N 2.92Å; A156-Q160 WeakPolarHBondContact O-CB 2.97Å; A156-Q160 PolarHBondContact O-N 3.11Å
157	A	76.8	Confident	73.3	Confident	50 Å²	50	77.2 Å²	77.2	41%	0.413	42%	0.419	S	S	.	.	H	α-helix	trans	-65	-41.1	174.7	0	0	0	0	0	112.2	E153 K154 Q155 Q160 A161	E153-A157 VanDerWaalsContact O-CB 3.31Å; E153-A157 WeakPolarHBondContact O-CB 3.26Å; E153-A157 PolarHBondContact O-N 3.4Å; K154-A157 PolarHBondContact O-N 2.97Å; Q155-A157 VanDerWaalsContact C-N 3.35Å; Q155-A157 PolarHBondContact O-N 2.95Å; A157-Q160 PolarHBondContact O-N 2.67Å; A157-A161 VanDerWaalsContact O-CB 3.28Å; A157-A161 WeakPolarHBondContact O-CB 3.43Å; A157-A161 PolarHBondContact O-N 3.43Å
158	D	84.4	Confident	75.3	Confident	33 Å²	33	74.2 Å²	74.2	18%	0.176	41%	0.406	C	S	.	.	H	α-helix	trans	-65.8	-39.5	176.7	-67.3	-16	0	0	0	110.5	K154 Q155 A161 A162 S323 L327	K154-D158 VanDerWaalsContact O-CB 3.25Å; K154-D158 WeakPolarHBondContact O-CB 3.45Å; K154-D158 PolarHBondContact O-N 3.32Å; Q155-D158 PolarHBondContact O-N 3.48Å; D158-A161 PolarHBondContact O-N 2.97Å; D158-A162 VanDerWaalsContact O-CB 3.29Å; D158-A162 WeakPolarHBondContact O-CB 3.45Å; D158-A162 PolarHBondContact O-N 2.78Å; D158-S323 WeakPolarHBondContact OD1-CB 3.35Å; D158-L327 HydrophobicContact CB-CD1 4.06Å
159	H	87.1	Confident	77.2	Confident	103 Å²	103	69.6 Å²	69.6	48%	0.477	38%	0.382	S	S	.	.	H	α-helix	trans	-65.9	-43.7	173.5	-84.7	-71.6	0	0	0	111.9	Q155 A156 A162 E163	Q155-H159 VanDerWaalsContact O-CB 3.32Å; Q155-H159 WeakPolarHBondContact O-CB 3.41Å; Q155-H159 PolarHBondContact O-CD2 2.92Å; Q155-H159 PolarHBondContact O-N 2.88Å; A156-H159 PolarHBondContact O-N 2.92Å; H159-A162 WeakPolarHBondContact O-CB 3.49Å; H159-A162 PolarHBondContact O-N 3.47Å; H159-E163 PolarHBondContact O-N 3.04Å
160	Q	89	Confident	79.9	Confident	116 Å²	116	70.9 Å²	70.9	54%	0.542	38%	0.381	S	S	.	.	H	α-helix	trans	-63.1	-44.5	174.9	-175.2	-178.4	10.2	0	0	111.3	A156 A157 A162 E163 Q164	A156-Q160 WeakPolarHBondContact O-CB 2.97Å; A156-Q160 PolarHBondContact O-N 3.11Å; A157-Q160 PolarHBondContact O-N 2.67Å; Q160-A162 VanDerWaalsContact C-N 3.27Å; Q160-A162 PolarHBondContact O-N 3.26Å; Q160-E163 PolarHBondContact O-N 2.94Å; Q160-Q164 WeakPolarHBondContact O-CB 3.34Å; Q160-Q164 VanDerWaalsContact O-CG 3.3Å; Q160-Q164 WeakPolarHBondContact O-CG 3.39Å; Q160-Q164 PolarHBondContact O-N 2.78Å
161	A	88.5	Confident	82.4	Confident	25 Å²	25	70.7 Å²	70.7	21%	0.207	37%	0.374	C	S	.	.	H	α-helix	trans	-61.9	-37.5	174.7	0	0	0	0	0	111.3	A157 D158 Q164 F165 V324	A157-A161 VanDerWaalsContact O-CB 3.28Å; A157-A161 WeakPolarHBondContact O-CB 3.43Å; A157-A161 PolarHBondContact O-N 3.43Å; D158-A161 PolarHBondContact O-N 2.97Å; A161-Q164 PolarHBondContact O-N 3.12Å; A161-F165 WeakPolarHBondContact O-CB 3.33Å; A161-F165 PolarHBondContact O-N 2.71Å; A161-V324 HydrophobicContact CB-CG2 3.72Å
162	A	91.1	Very high	84.5	Confident	5 Å²	5	69.7 Å²	69.7	4%	0.041	37%	0.365	C	S	.	.	H	α-helix	trans	-65.2	-45.5	175.5	0	0	0	0	0	111.4	D158 H159 Q160 Q164 F165 C166 V324 L327 V328	D158-A162 VanDerWaalsContact O-CB 3.29Å; D158-A162 WeakPolarHBondContact O-CB 3.45Å; D158-A162 PolarHBondContact O-N 2.78Å; H159-A162 WeakPolarHBondContact O-CB 3.49Å; H159-A162 PolarHBondContact O-N 3.47Å; Q160-A162 VanDerWaalsContact C-N 3.27Å; Q160-A162 PolarHBondContact O-N 3.26Å; A162-Q164 PolarHBondContact O-N 3.46Å; A162-F165 PolarHBondContact O-N 3.01Å; A162-C166 WeakPolarHBondContact O-CB 3.47Å; A162-C166 PolarHBondContact O-N 3.24Å; A162-C166 PolarHBondContact O-SG 3.4Å; A162-V324 HydrophobicContact CB-CB 4.46Å; A162-V324 HydrophobicContact CB-CG1 3.83Å; A162-V324 HydrophobicContact CB-CG2 4.16Å; A162-L327 HydrophobicContact CB-CB 4.34Å; A162-L327 HydrophobicContact CB-CD1 3.97Å; A162-V328 HydrophobicContact CB-CG1 3.99Å
163	E	92.4	Very high	86.4	Confident	140 Å²	140	67 Å²	67	65%	0.654	35%	0.346	S	S	*	.	H	α-helix	trans	-61.5	-43.1	175.6	-75.6	-179.4	178.8	0	0	112.3	H159 Q160 C166 G167	H159-E163 PolarHBondContact O-N 3.04Å; Q160-E163 PolarHBondContact O-N 2.94Å; E163-C166 PolarHBondContact O-N 2.92Å; E163-G167 PolarHBondContact O-N 3.12Å
164	Q	93.4	Very high	88.3	Confident	121 Å²	121	63.3 Å²	63.3	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-60.2	-47	174.7	-73.6	173.6	2.6	0	0	111.4	Q160 A161 A162 G167 F168	Q160-Q164 WeakPolarHBondContact O-CB 3.34Å; Q160-Q164 VanDerWaalsContact O-CG 3.3Å; Q160-Q164 WeakPolarHBondContact O-CG 3.39Å; Q160-Q164 PolarHBondContact O-N 2.78Å; A161-Q164 PolarHBondContact O-N 3.12Å; A162-Q164 PolarHBondContact O-N 3.46Å; Q164-G167 PolarHBondContact O-N 3.16Å; Q164-F168 PolarHBondContact O-N 3.17Å
165	F	94.7	Very high	89.7	Confident	16 Å²	16	63.9 Å²	63.9	7%	0.07	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-42.2	177.1	-174.7	-94.2	0	0	0	111.8	A161 A162 G167 F168 F169 L297 I318 L320 P321 V324 L385	A161-F165 WeakPolarHBondContact O-CB 3.33Å; A161-F165 PolarHBondContact O-N 2.71Å; A162-F165 PolarHBondContact O-N 3.01Å; F165-G167 VanDerWaalsContact C-N 3.26Å; F165-G167 PolarHBondContact O-N 3.48Å; F165-F168 HydrophobicContact CD2-CD1 4.27Å; F165-F168 HydrophobicContact CE2-CD1 4.17Å; F165-F168 HydrophobicContact CE2-CE1 4.43Å; F165-F168 PolarHBondContact O-N 2.79Å; F165-F169 HydrophobicContact CE1-CB 4.39Å; F165-F169 WeakPolarHBondContact O-CB 3.47Å; F165-F169 PolarHBondContact O-N 2.97Å; F165-L297 HydrophobicContact CE1-CD1 4.19Å; F165-L297 HydrophobicContact CZ-CD1 3.88Å; F165-I318 HydrophobicContact CE2-CG2 4.41Å; F165-I318 HydrophobicContact CZ-CG2 4.2Å; F165-L320 HydrophobicContact CD1-CD2 3.95Å; F165-L320 HydrophobicContact CE1-CD2 3.43Å; F165-L320 VanDerWaalsContact CE1-CD2 3.43Å; F165-L320 HydrophobicContact CE1-CG 4.26Å; F165-L320 HydrophobicContact CZ-CD2 3.96Å; F165-L320 HydrophobicContact CZ-CG 4.33Å; F165-P321 HydrophobicContact CD2-CG 3.8Å; F165-P321 HydrophobicContact CE2-CG 4.37Å; F165-P321 HydrophobicContact CG-CG 4.4Å; F165-V324 HydrophobicContact CB-CG1 4.21Å; F165-V324 HydrophobicContact CD1-CG1 4.38Å; F165-V324 HydrophobicContact CG-CG1 4.42Å; F165-L385 HydrophobicContact CD1-CD1 3.69Å; F165-L385 HydrophobicContact CE1-CD1 3.7Å
166	C	94.6	Very high	90.9	Very high	10 Å²	10	63 Å²	63	7%	0.068	34%	0.343	C	S	.	.	H	α-helix	trans	-61.5	-37.5	174.8	-65.1	0	0	0	0	111.4	A162 E163 R170 K384	A162-C166 WeakPolarHBondContact O-CB 3.47Å; A162-C166 PolarHBondContact O-N 3.24Å; A162-C166 PolarHBondContact O-SG 3.4Å; E163-C166 PolarHBondContact O-N 2.92Å; C166-R170 WeakPolarHBondContact O-CB 3.37Å; C166-R170 VanDerWaalsContact O-CG 3.27Å; C166-R170 WeakPolarHBondContact O-CG 3.46Å; C166-R170 PolarHBondContact O-N 3.17Å; C166-R170 PolarHBondContact O-NE 3.42Å; C166-K384 PolarHBondContact SG-O 2.96Å
167	G	94.1	Very high	91.6	Very high	20 Å²	20	62.9 Å²	62.9	21%	0.206	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-50.8	173.5	0	0	0	0	0	112.2	E163 Q164 F165 F169 R170 S171	E163-G167 PolarHBondContact O-N 3.12Å; Q164-G167 PolarHBondContact O-N 3.16Å; F165-G167 VanDerWaalsContact C-N 3.26Å; F165-G167 PolarHBondContact O-N 3.48Å; G167-F169 PolarHBondContact O-N 3.4Å; G167-R170 PolarHBondContact O-N 2.92Å; G167-S171 PolarHBondContact O-N 2.92Å; G167-S171 PolarHBondContact O-OG 3.32Å
168	F	95	Very high	92.5	Very high	104 Å²	104	61 Å²	61	46%	0.456	33%	0.331	S	S	.	.	H	α-helix	trans	-54.9	-50.6	174.7	164	-101.5	0	0	0	111.9	Q164 F165 R170 S171 L172 I318	Q164-F168 PolarHBondContact O-N 3.17Å; F165-F168 HydrophobicContact CD2-CD1 4.27Å; F165-F168 HydrophobicContact CE2-CD1 4.17Å; F165-F168 HydrophobicContact CE2-CE1 4.43Å; F165-F168 PolarHBondContact O-N 2.79Å; F168-R170 VanDerWaalsContact C-N 3.33Å; F168-R170 PolarHBondContact O-N 3.34Å; F168-S171 PolarHBondContact O-N 3.39Å; F168-L172 HydrophobicContact CE2-CD1 4.48Å; F168-L172 HydrophobicContact CZ-CD1 4.04Å; F168-L172 WeakPolarHBondContact O-CB 3.47Å; F168-L172 PolarHBondContact O-N 2.87Å; F168-I318 HydrophobicContact CE1-CG2 4.49Å
169	F	95.3	Very high	92.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.6	-41.3	-179.1	-176	-94.6	0	0	0	111.7	F165 G167 L172 A173 V183 W382 L385 W386	F165-F169 HydrophobicContact CE1-CB 4.39Å; F165-F169 WeakPolarHBondContact O-CB 3.47Å; F165-F169 PolarHBondContact O-N 2.97Å; G167-F169 PolarHBondContact O-N 3.4Å; F169-L172 PolarHBondContact O-N 3.22Å; F169-A173 WeakPolarHBondContact O-CB 3.41Å; F169-A173 PolarHBondContact O-N 3.21Å; F169-V183 HydrophobicContact CE2-CG1 4.29Å; F169-V183 HydrophobicContact CZ-CG1 3.62Å; F169-V183 HydrophobicContact CZ-CG2 4.32Å; F169-W382 HydrophobicContact CZ-CZ3 4.34Å; F169-L385 HydrophobicContact CB-CD1 4.22Å; F169-L385 HydrophobicContact CD1-CD1 4.35Å; F169-L385 HydrophobicContact CD1-CD2 4.4Å; F169-L385 HydrophobicContact CD1-CG 4.02Å; F169-L385 HydrophobicContact CE1-CG 4.47Å; F169-L385 HydrophobicContact CG-CD1 4.25Å; F169-L385 HydrophobicContact CG-CG 4.34Å; F169-W386 HydrophobicContact CD1-CB 4.26Å; F169-W386 HydrophobicContact CD1-CG 4.35Å; F169-W386 HydrophobicContact CE1-CB 4.04Å; F169-W386 AromaticContact CE1-CD2 3.94Å; F169-W386 HydrophobicContact CE1-CD2 3.94Å; F169-W386 AromaticContact CE1-CE3 3.99Å; F169-W386 HydrophobicContact CE1-CE3 3.99Å; F169-W386 AromaticContact CE1-CG 3.98Å; F169-W386 HydrophobicContact CE1-CG 3.98Å
170	R	93.7	Very high	93.3	Very high	102 Å²	102	57.7 Å²	57.7	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-44.1	174.9	-81.7	-180	-83.9	127.7	-8.3	112.4	C166 G167 F168 A173 A174	C166-R170 WeakPolarHBondContact O-CB 3.37Å; C166-R170 VanDerWaalsContact O-CG 3.27Å; C166-R170 WeakPolarHBondContact O-CG 3.46Å; C166-R170 PolarHBondContact O-N 3.17Å; C166-R170 PolarHBondContact O-NE 3.42Å; G167-R170 PolarHBondContact O-N 2.92Å; F168-R170 VanDerWaalsContact C-N 3.33Å; F168-R170 PolarHBondContact O-N 3.34Å; R170-A173 PolarHBondContact O-N 3.3Å; R170-A174 WeakPolarHBondContact O-CB 3.16Å; R170-A174 PolarHBondContact O-N 2.86Å
171	S	94.5	Very high	93.6	Very high	80 Å²	80	54.1 Å²	54.1	56%	0.559	30%	0.304	S	S	*	.	H	α-helix	trans	-62.6	-45.2	176.4	-62.6	0	0	0	0	111.5	G167 F168 A174 E175	G167-S171 PolarHBondContact O-N 2.92Å; G167-S171 PolarHBondContact O-OG 3.32Å; F168-S171 PolarHBondContact O-N 3.39Å; S171-A174 PolarHBondContact O-N 2.89Å; S171-E175 VanDerWaalsContact O-CB 3.3Å; S171-E175 WeakPolarHBondContact O-CB 3.35Å; S171-E175 PolarHBondContact O-N 3.43Å
172	L	94.2	Very high	94	Very high	30 Å²	30	53.7 Å²	53.7	16%	0.157	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-43.9	177.5	-178.3	121.9	0	0	0	112	F168 F169 A174 E175 H176 L178 I318	F168-L172 HydrophobicContact CE2-CD1 4.48Å; F168-L172 HydrophobicContact CZ-CD1 4.04Å; F168-L172 WeakPolarHBondContact O-CB 3.47Å; F168-L172 PolarHBondContact O-N 2.87Å; F169-L172 PolarHBondContact O-N 3.22Å; L172-A174 VanDerWaalsContact C-N 3.35Å; L172-A174 PolarHBondContact O-N 3.09Å; L172-E175 PolarHBondContact O-N 2.84Å; L172-H176 PolarHBondContact O-N 2.89Å; L172-H176 VanDerWaalsContact O-N 3.11Å; L172-L178 HydrophobicContact CD2-CD1 4.24Å; L172-I318 HydrophobicContact CD1-CD1 4.31Å; L172-I318 HydrophobicContact CD2-CD1 3.51Å
173	A	93.6	Very high	94.3	Very high	4 Å²	4	53.4 Å²	53.4	3%	0.033	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-42.1	176.1	0	0	0	0	0	111.9	F169 R170 G177 L178 W386	F169-A173 WeakPolarHBondContact O-CB 3.41Å; F169-A173 PolarHBondContact O-N 3.21Å; R170-A173 PolarHBondContact O-N 3.3Å; A173-G177 CarbonylContact O-C 3.52Å; A173-G177 PolarHBondContact O-N 3Å; A173-L178 HydrophobicContact CB-CB 4.28Å; A173-L178 HydrophobicContact CB-CD1 4.48Å; A173-L178 PolarHBondContact O-N 3.28Å; A173-W386 HydrophobicContact CB-CH2 4.48Å; A173-W386 HydrophobicContact CB-CZ2 3.86Å
174	A	93.1	Very high	94.6	Very high	79 Å²	79	46.8 Å²	46.8	65%	0.653	27%	0.265	S	S	*	.	H	α-helix	trans	-68.5	-45.1	177.5	0	0	0	0	0	112.5	R170 S171 L172 H176 G177	R170-A174 WeakPolarHBondContact O-CB 3.16Å; R170-A174 PolarHBondContact O-N 2.86Å; S171-A174 PolarHBondContact O-N 2.89Å; L172-A174 VanDerWaalsContact C-N 3.35Å; L172-A174 PolarHBondContact O-N 3.09Å; A174-H176 VanDerWaalsContact C-N 3.27Å; A174-H176 PolarHBondContact O-N 3.3Å; A174-G177 PolarHBondContact O-N 2.93Å
175	E	94.4	Very high	94.8	Very high	150 Å²	150	41 Å²	41	70%	0.701	24%	0.238	S	C	*	.	H	α-helix	trans	-59.8	-37.4	179.7	-177.2	-176.7	160.2	0	0	112.3	S171 L172	S171-E175 VanDerWaalsContact O-CB 3.3Å; S171-E175 WeakPolarHBondContact O-CB 3.35Å; S171-E175 PolarHBondContact O-N 3.43Å; L172-E175 PolarHBondContact O-N 2.84Å
176	H	92.5	Very high	94.9	Very high	75 Å²	75	40.3 Å²	40.3	35%	0.347	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	5.1	179.7	-67.4	-30.1	0	0	0	114.2	L172 A174 L178 K293	L172-H176 PolarHBondContact O-N 2.89Å; L172-H176 VanDerWaalsContact O-N 3.11Å; A174-H176 VanDerWaalsContact C-N 3.27Å; A174-H176 PolarHBondContact O-N 3.3Å; H176-L178 HydrophobicContact CB-CD2 4.06Å; H176-L178 HydrophobicContact CB-CG 3.96Å; H176-L178 PolarHBondContact O-N 2.9Å; H176-K293 HydrophobicContact CB-CD 4.32Å; H176-K293 PolarHBondContact CE1-NZ 3.43Å; H176-K293 PolarHBondContact ND1-NZ 3.12Å
177	G	92.3	Very high	94.9	Very high	58 Å²	58	40.2 Å²	40.2	60%	0.598	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	34.6	-179	0	0	0	0	0	113.3	A173 A174 S179	A173-G177 CarbonylContact O-C 3.52Å; A173-G177 PolarHBondContact O-N 3Å; A174-G177 PolarHBondContact O-N 2.93Å; G177-S179 PolarHBondContact O-N 2.72Å
178	L	93.9	Very high	94.8	Very high	11 Å²	11	41.1 Å²	41.1	6%	0.058	23%	0.233	C	C	.	.			trans	-68.1	128.1	-176.3	-60.9	-178.6	0	0	0	110.3	L172 A173 H176 V183 K293 V295 W386	L172-L178 HydrophobicContact CD2-CD1 4.24Å; A173-L178 HydrophobicContact CB-CB 4.28Å; A173-L178 HydrophobicContact CB-CD1 4.48Å; A173-L178 PolarHBondContact O-N 3.28Å; H176-L178 HydrophobicContact CB-CD2 4.06Å; H176-L178 HydrophobicContact CB-CG 3.96Å; H176-L178 PolarHBondContact O-N 2.9Å; L178-V183 HydrophobicContact CB-CG2 4.23Å; L178-V183 HydrophobicContact CD1-CG2 4.31Å; L178-K293 HydrophobicContact CD2-CB 4.01Å; L178-V295 HydrophobicContact CD1-CB 4.43Å; L178-V295 HydrophobicContact CD1-CG2 3.59Å; L178-W386 VanDerWaalsContact O-CH2 3.28Å; L178-W386 WeakPolarHBondContact O-CH2 3.45Å; L178-W386 WeakPolarHBondContact O-CZ2 3.47Å
179	S	94.3	Very high	94.4	Very high	35 Å²	35	36.9 Å²	36.9	25%	0.245	22%	0.215	C	C	.	.			trans	-88.2	160.7	169.2	70.7	0	0	0	0	111.5	G177 E181 Q182	G177-S179 PolarHBondContact O-N 2.72Å; S179-E181 PolarHBondContact O-N 2.87Å; S179-E181 VanDerWaalsContact O-N 3.12Å; S179-Q182 WeakPolarHBondContact O-CB 3.46Å; S179-Q182 PolarHBondContact O-N 3.11Å; S179-Q182 PolarHBondContact OG-OE1 2.97Å
180	P	94.6	Very high	93.9	Very high	30 Å²	30	38.3 Å²	38.3	20%	0.195	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.5	174	-26	36.4	0	0	0	114.6	Q182 A224 T225 W386 V389 F391	P180-Q182 VanDerWaalsContact C-N 3.26Å; P180-Q182 PolarHBondContact O-N 3.05Å; P180-A224 HydrophobicContact CB-CB 4.05Å; P180-A224 WeakPolarHBondContact O-CB 3.34Å; P180-A224 PolarHBondContact O-N 3.04Å; P180-A224 VanDerWaalsContact O-N 3.16Å; P180-T225 HydrophobicContact CB-CG2 3.54Å; P180-W386 HydrophobicContact CB-CZ3 4.43Å; P180-W386 HydrophobicContact CG-CH2 4.22Å; P180-W386 HydrophobicContact CG-CZ3 4.27Å; P180-V389 HydrophobicContact CB-CG1 3.89Å; P180-V389 HydrophobicContact CG-CB 4.23Å; P180-V389 HydrophobicContact CG-CG1 3.2Å; P180-V389 HydrophobicContact CG-CG2 3.97Å; P180-F391 HydrophobicContact CB-CE1 3.99Å; P180-F391 HydrophobicContact CG-CE1 4.43Å
181	E	95.2	Very high	93.3	Very high	41 Å²	41	33.5 Å²	33.5	19%	0.192	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-23.8	174.9	-70.7	-64.5	145.9	0	0	112.6	S179 Y184 N223 T225 S227 H282 I286	S179-E181 PolarHBondContact O-N 2.87Å; S179-E181 VanDerWaalsContact O-N 3.12Å; E181-Y184 WeakPolarHBondContact O-CE2 3.34Å; E181-Y184 PolarHBondContact O-OH 2.95Å; E181-N223 PolarHBondContact OE2-ND2 3.46Å; E181-T225 HydrophobicContact CG-CG2 4.27Å; E181-T225 WeakPolarHBondContact OE1-CB 3.33Å; E181-T225 WeakPolarHBondContact OE1-CG2 3.48Å; E181-T225 PolarHBondContact OE1-OG1 3.18Å; E181-S227 PolarHBondContact OE1-OG 2.88Å; E181-S227 PolarHBondContact OE2-OG 3.12Å; E181-H282 IonicContact OE2-CD2 3.97Å; E181-H282 IonicContact OE2-CE1 3.49Å; E181-H282 IonicContact OE2-NE2 3.33Å; E181-H282 PolarHBondContact OE2-NE2 2.86Å; E181-I286 HydrophobicContact CB-CD1 3.91Å; E181-I286 HydrophobicContact CG-CD1 3.99Å
182	Q	96.9	Very high	92.5	Very high	16 Å²	16	34.6 Å²	34.6	8%	0.075	21%	0.207	C	C	.	.	S	Bend	trans	-96.5	-8.2	-173.2	-67.9	169.1	-84.7	0	0	114.1	S179 P180 F283 L288 K293 A294 V295	S179-Q182 WeakPolarHBondContact O-CB 3.46Å; S179-Q182 PolarHBondContact O-N 3.11Å; S179-Q182 PolarHBondContact OG-OE1 2.97Å; P180-Q182 VanDerWaalsContact C-N 3.26Å; P180-Q182 PolarHBondContact O-N 3.05Å; Q182-F283 HydrophobicContact CB-CZ 4.04Å; Q182-F283 HydrophobicContact CG-CE1 4.12Å; Q182-F283 HydrophobicContact CG-CE2 4.28Å; Q182-F283 HydrophobicContact CG-CZ 3.67Å; Q182-L288 HydrophobicContact CG-CD1 3.93Å; Q182-K293 WeakPolarHBondContact CB-O 3.5Å; Q182-K293 WeakPolarHBondContact CG-O 3.27Å; Q182-K293 PolarHBondContact NE2-O 3.23Å; Q182-A294 CarbonylContact O-C 3.56Å; Q182-A294 WeakPolarHBondContact O-CA 3.25Å; Q182-V295 PolarHBondContact O-N 2.9Å
183	V	97.6	Very high	91.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.4	-175.9	-172.8	0	0	0	0	109.9	F169 L178 N223 A224 W382 W386	F169-V183 HydrophobicContact CE2-CG1 4.29Å; F169-V183 HydrophobicContact CZ-CG1 3.62Å; F169-V183 HydrophobicContact CZ-CG2 4.32Å; L178-V183 HydrophobicContact CB-CG2 4.23Å; L178-V183 HydrophobicContact CD1-CG2 4.31Å; V183-N223 CarbonylContact O-C 3.58Å; V183-N223 WeakPolarHBondContact O-CA 3.33Å; V183-A224 PolarHBondContact O-N 3.25Å; V183-W382 HydrophobicContact CB-CH2 4.37Å; V183-W382 HydrophobicContact CG1-CH2 3.37Å; V183-W382 HydrophobicContact CG1-CZ2 4.29Å; V183-W382 HydrophobicContact CG1-CZ3 3.5Å; V183-W386 HydrophobicContact CB-CZ3 4.24Å; V183-W386 HydrophobicContact CG2-CE3 4.5Å; V183-W386 HydrophobicContact CG2-CH2 4.21Å; V183-W386 HydrophobicContact CG2-CZ3 3.7Å
184	Y	98.4	Very high	90	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	150.3	-178.6	-68	-102.4	0	0	0	110.6	E181 A222 N223 H228 L230 F275 V279 H282 F283 V295 L297	E181-Y184 WeakPolarHBondContact O-CE2 3.34Å; E181-Y184 PolarHBondContact O-OH 2.95Å; Y184-A222 WeakPolarHBondContact CA-O 3.43Å; Y184-N223 HydrophobicContact CD1-CB 3.93Å; Y184-N223 HydrophobicContact CD2-CB 4.35Å; Y184-N223 HydrophobicContact CE1-CB 3.59Å; Y184-N223 HydrophobicContact CE2-CB 4.02Å; Y184-N223 HydrophobicContact CG-CB 4.28Å; Y184-H228 HydrophobicContact CE1-CB 4.44Å; Y184-H228 AromaticContact CE1-ND1 3.37Å; Y184-H228 WeakPolarHBondContact CE1-ND1 3.33Å; Y184-H228 AromaticContact CZ-ND1 3.49Å; Y184-H228 PolarHBondContact OH-ND1 2.79Å; Y184-L230 HydrophobicContact CD1-CD1 3.87Å; Y184-L230 HydrophobicContact CE1-CD1 3.82Å; Y184-F275 AromaticContact CD1-CE2 3.96Å; Y184-F275 HydrophobicContact CD1-CE2 3.96Å; Y184-F275 HydrophobicContact CD2-CE2 4.31Å; Y184-F275 HydrophobicContact CD2-CZ 4.3Å; Y184-F275 AromaticContact CG-CE2 3.77Å; Y184-F275 HydrophobicContact CG-CE2 3.77Å; Y184-F275 HydrophobicContact CG-CZ 4.13Å; Y184-V279 HydrophobicContact CD1-CG2 4.44Å; Y184-V279 HydrophobicContact CD2-CG2 4.36Å; Y184-V279 HydrophobicContact CE1-CG2 4.01Å; Y184-V279 HydrophobicContact CE2-CG1 4.02Å; Y184-V279 HydrophobicContact CE2-CG2 3.96Å; Y184-H282 PolarHBondContact OH-CD2 2.77Å; Y184-F283 HydrophobicContact CE2-CE1 4.38Å; Y184-V295 PolarHBondContact N-O 2.98Å; Y184-L297 WeakPolarHBondContact O-CB 3.42Å; Y184-L297 PolarHBondContact O-N 3.25Å
185	N	97.9	Very high	88.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138.9	164.9	176.5	-125.6	0	0	0	108.7	C221 A222 L297 P330 M331 W382	N185-C221 WeakPolarHBondContact O-CA 3.33Å; N185-A222 PolarHBondContact N-O 3.16Å; N185-A222 VanDerWaalsContact N-O 3.09Å; N185-A222 PolarHBondContact O-N 3Å; N185-L297 WeakPolarHBondContact CA-O 3.42Å; N185-L297 HydrophobicContact CB-CB 4.37Å; N185-L297 PolarHBondContact ND2-O 3.03Å; N185-P330 HydrophobicContact CB-CB 4.1Å; N185-P330 HydrophobicContact CB-CG 4.02Å; N185-P330 WeakPolarHBondContact OD1-CD 3.08Å; N185-M331 WeakPolarHBondContact O-CE 3.28Å; N185-M331 WeakPolarHBondContact OD1-CB 3.28Å; N185-M331 WeakPolarHBondContact OD1-CG 3.41Å; N185-M331 PolarHBondContact OD1-N 3.35Å; N185-W382 HydrophobicContact CB-CH2 3.85Å; N185-W382 HydrophobicContact CB-CZ2 3.58Å
186	A	97.1	Very high	86.6	Confident	1 Å²	1	31 Å²	31	1%	0.008	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	153.7	173.2	0	0	0	0	0	111.1	L219 M220 C221 W270 L296 L297 L298	A186-L219 HydrophobicContact CB-CD1 3.94Å; A186-M220 WeakPolarHBondContact CA-O 3.32Å; A186-M220 WeakPolarHBondContact CB-O 3.33Å; A186-C221 HydrophobicContact CB-CB 3.68Å; A186-W270 HydrophobicContact CB-CH2 3.91Å; A186-L296 HydrophobicContact CB-CD1 4.03Å; A186-L297 PolarHBondContact N-O 3.02Å; A186-L298 HydrophobicContact CB-CD2 3.75Å
187	D	94.3	Very high	84.3	Confident	9 Å²	9	31.8 Å²	31.8	5%	0.048	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	147.6	178.5	-165.5	39	0	0	0	111.9	M220 Q329 M331	D187-M220 PolarHBondContact N-O 2.95Å; D187-M220 PolarHBondContact O-N 3.48Å; D187-Q329 PolarHBondContact OD1-NE2 3.07Å; D187-M331 HydrophobicContact CB-CB 3.42Å; D187-M331 VanDerWaalsContact CB-CB 3.42Å; D187-M331 HydrophobicContact CB-CG 3.71Å
188	E	91.9	Very high	81.9	Confident	38 Å²	38	35.1 Å²	35.1	18%	0.178	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	136.2	176.7	-64.4	81.2	-173.8	0	0	113	T217 V218 L219 V262 H304	E188-T217 HydrophobicContact CB-CG2 4.06Å; E188-T217 HydrophobicContact CG-CG2 4.37Å; E188-V218 CarbonylContact C-O 3.57Å; E188-V218 WeakPolarHBondContact CA-O 3.41Å; E188-L219 HydrophobicContact CG-CB 4.24Å; E188-L219 HydrophobicContact CG-CD1 4.07Å; E188-L219 WeakPolarHBondContact OE1-CD1 3.41Å; E188-V262 HydrophobicContact CG-CB 4.24Å; E188-V262 HydrophobicContact CG-CG2 3.66Å; E188-H304 IonicContact OE1-NE2 3.76Å; E188-H304 PolarHBondContact OE1-NE2 3.22Å; E188-H304 IonicContact OE2-CE1 2.77Å; E188-H304 IonicContact OE2-NE2 3.7Å; E188-H304 PolarHBondContact OE2-NE2 3.31Å
189	T	86.6	Confident	79.3	Confident	15 Å²	15	38.8 Å²	38.8	9%	0.092	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.2	171.3	-156.8	0	0	0	0	113.3	T217 V218 M220 F339	T189-T217 CarbonylContact O-C 3.4Å; T189-T217 WeakPolarHBondContact O-CA 3.24Å; T189-V218 HydrophobicContact CG2-CB 4.33Å; T189-V218 PolarHBondContact N-O 3.47Å; T189-V218 PolarHBondContact O-N 2.93Å; T189-M220 HydrophobicContact CG2-CE 3.81Å; T189-F339 HydrophobicContact CG2-CD1 4.12Å; T189-F339 HydrophobicContact CG2-CE1 3.71Å
190	G	84.3	Confident	76.4	Confident	31 Å²	31	41.9 Å²	41.9	32%	0.32	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	125.1	178.5	0	0	0	0	0	112.4
191	L	81.2	Confident	73.7	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116	175.3	-64.1	-175.1	0	0	0	111.7	W193 R215 L216 V218 F339 M340 F343 M366	L191-W193 PolarHBondContact O-N 2.92Å; L191-R215 WeakPolarHBondContact O-CA 3.25Å; L191-L216 HydrophobicContact CB-CB 4.43Å; L191-L216 PolarHBondContact N-O 3.01Å; L191-L216 PolarHBondContact O-N 2.77Å; L191-V218 HydrophobicContact CD1-CG2 3.48Å; L191-V218 VanDerWaalsContact CD1-CG2 3.48Å; L191-V218 HydrophobicContact CG-CG2 3.8Å; L191-F339 HydrophobicContact CD1-CE1 4.25Å; L191-F339 HydrophobicContact CD1-CZ 4.06Å; L191-F339 HydrophobicContact CD2-CE1 3.97Å; L191-F339 HydrophobicContact CG-CE1 4.44Å; L191-M340 HydrophobicContact CD2-CE 3.91Å; L191-M340 HydrophobicContact CD2-SD 3.33Å; L191-M340 WeakPolarHBondContact CD2-SD 3.34Å; L191-F343 HydrophobicContact CD1-CD1 4.48Å; L191-F343 HydrophobicContact CD1-CD2 4.17Å; L191-F343 HydrophobicContact CD1-CE1 4.26Å; L191-F343 HydrophobicContact CD1-CE2 3.93Å; L191-F343 HydrophobicContact CD1-CG 4.43Å; L191-F343 HydrophobicContact CD1-CZ 3.98Å; L191-F343 HydrophobicContact CD2-CD1 4.05Å; L191-F343 HydrophobicContact CD2-CE1 4.22Å; L191-F343 HydrophobicContact CD2-CG 4.43Å; L191-M366 HydrophobicContact CD1-CB 4.32Å; L191-M366 HydrophobicContact CD1-CG 4.26Å; L191-M366 HydrophobicContact CD1-SD 4.09Å
192	F	77.4	Confident	71	Confident	102 Å²	102	53.2 Å²	53.2	45%	0.447	30%	0.296	S	S	.	.			trans	-91.6	73.9	169.1	-64.1	-79.9	0	0	0	110.1	R194 C195 R215	F192-R194 VanDerWaalsContact C-N 3.26Å; F192-R194 PolarHBondContact O-N 3Å; F192-C195 HydrophobicContact CB-CB 4.16Å; F192-C195 WeakPolarHBondContact O-CB 3.36Å; F192-C195 PolarHBondContact O-N 3.2Å; F192-R215 HydrophobicContact CD1-CB 4.13Å; F192-R215 HydrophobicContact CD1-CG 4.32Å; F192-R215 HydrophobicContact CE1-CB 3.96Å; F192-R215 HydrophobicContact CE1-CG 4.04Å; F192-R215 HydrophobicContact CZ-CG 4.3Å
193	W	70.4	Confident	68.4	Low	2 Å²	2	56.6 Å²	56.6	1%	0.008	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-68.2	-19.8	-167.6	61.1	-91.2	0	0	0	114.7	L191 C195 L196 D214 L216 F343 Y357 M359 A362	L191-W193 PolarHBondContact O-N 2.92Å; W193-C195 VanDerWaalsContact C-N 3.35Å; W193-L196 WeakPolarHBondContact O-CG 3.47Å; W193-D214 HydrophobicContact CZ2-CB 3.88Å; W193-D214 PolarHBondContact NE1-O 2.89Å; W193-L216 HydrophobicContact CG-CD1 4.37Å; W193-F343 HydrophobicContact CB-CE1 4.37Å; W193-F343 HydrophobicContact CB-CZ 3.88Å; W193-Y357 HydrophobicContact CB-CE1 4.36Å; W193-Y357 AromaticContact CE3-CD1 3.63Å; W193-Y357 HydrophobicContact CE3-CD1 3.63Å; W193-Y357 AromaticContact CE3-CE1 3.73Å; W193-Y357 HydrophobicContact CE3-CE1 3.73Å; W193-Y357 AromaticContact CZ3-CD1 3.97Å; W193-Y357 HydrophobicContact CZ3-CD1 3.97Å; W193-Y357 HydrophobicContact CZ3-CE1 4.45Å; W193-M359 HydrophobicContact CH2-CB 4.27Å; W193-M359 HydrophobicContact CZ2-CB 4.15Å; W193-M359 HydrophobicContact CZ2-CE 4.31Å; W193-A362 HydrophobicContact CB-CB 3.77Å; W193-A362 HydrophobicContact CD2-CB 3.86Å; W193-A362 HydrophobicContact CE3-CB 4.01Å; W193-A362 HydrophobicContact CG-CB 3.78Å
194	R	66.9	Low	65.4	Low	106 Å²	106	58.9 Å²	58.9	40%	0.4	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-85.6	-5	172.9	-70.4	-167.6	-175.6	-81.2	6.4	114.3	F192 S212 D214 Y357	F192-R194 VanDerWaalsContact C-N 3.26Å; F192-R194 PolarHBondContact O-N 3Å; R194-S212 WeakPolarHBondContact CB-O 3.45Å; R194-D214 WeakPolarHBondContact CD-OD2 3.46Å; R194-D214 HydrophobicContact CG-CB 4.19Å; R194-D214 IonicContact CZ-OD2 2.84Å; R194-D214 IonicContact NE-OD2 3.95Å; R194-D214 PolarHBondContact NE-OD2 3.47Å; R194-D214 IonicContact NH2-OD2 3.71Å; R194-Y357 PolarHBondContact NH1-O 3.21Å
195	C	58.8	Low	62.2	Low	49 Å²	49	63.7 Å²	63.7	33%	0.331	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-94.3	5.6	176.1	-59.5	0	0	0	0	112.5	F192 W193	F192-C195 HydrophobicContact CB-CB 4.16Å; F192-C195 WeakPolarHBondContact O-CB 3.36Å; F192-C195 PolarHBondContact O-N 3.2Å; W193-C195 VanDerWaalsContact C-N 3.35Å
196	L	55.8	Low	59.3	Low	31 Å²	31	69.5 Å²	69.5	16%	0.162	43%	0.433	C	S	.	.	S	Bend	trans	-63.5	138.5	174.4	-65.6	175.8	0	0	0	109.6	W193 N198 F343 I344 Y357	W193-L196 WeakPolarHBondContact O-CG 3.47Å; L196-N198 PolarHBondContact O-N 2.83Å; L196-N198 VanDerWaalsContact O-N 3.11Å; L196-F343 HydrophobicContact CD1-CE1 3.95Å; L196-F343 HydrophobicContact CD1-CZ 4.25Å; L196-F343 HydrophobicContact CD2-CD1 4.31Å; L196-F343 HydrophobicContact CD2-CE1 4.1Å; L196-F343 HydrophobicContact CG-CE1 4.36Å; L196-I344 HydrophobicContact CD2-CB 4.32Å; L196-I344 HydrophobicContact CD2-CG1 3.87Å; L196-I344 HydrophobicContact CD2-CG2 4.45Å; L196-Y357 HydrophobicContact CD1-CE1 3.98Å
197	P	43.7	Very low	56.3	Low	92 Å²	92	75.6 Å²	75.6	60%	0.597	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-62.6	116.1	179.6	23.6	-30.2	0	0	0	109.4
198	N	43.6	Very low	53.6	Low	128 Å²	128	78.8 Å²	78.8	68%	0.684	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-70.6	130.1	164.6	-82.3	-7.9	0	0	0	107.7	L196 T200	L196-N198 PolarHBondContact O-N 2.83Å; L196-N198 VanDerWaalsContact O-N 3.11Å; N198-T200 VanDerWaalsContact C-N 3.34Å; N198-T200 PolarHBondContact O-N 3.33Å
199	P	37.4	Very low	51	Low	88 Å²	88	84.1 Å²	84.1	57%	0.571	54%	0.536	S	S	*	.			trans	-65.6	101.6	158.9	27.8	-29.8	0	0	0	106.6	P201	P199-P201 WeakPolarHBondContact O-CD 3.37Å
200	T	35.2	Very low	48.6	Very low	99 Å²	99	93.2 Å²	93.2	61%	0.607	58%	0.575	S	S	*	*			trans	-67	121.5	162	40.9	0	0	0	0	106.8	N198 E202	N198-T200 VanDerWaalsContact C-N 3.34Å; N198-T200 PolarHBondContact O-N 3.33Å; T200-E202 PolarHBondContact O-N 3.06Å; T200-E202 VanDerWaalsContact O-N 3.16Å
201	P	37.4	Very low	46.8	Very low	124 Å²	124	97.5 Å²	97.5	81%	0.805	59%	0.586	S	S	*	*	S	Bend	trans	-63.7	117.5	163.3	6.6	7	0	0	0	106	P199	P199-P201 WeakPolarHBondContact O-CD 3.37Å
202	E	38.5	Very low	45.3	Very low	186 Å²	186	99.9 Å²	99.9	87%	0.869	60%	0.603	S	S	*	*	S	Bend	trans	55.3	106.9	168.3	-56.3	-170.6	165.5	0	0	117.5	T200	T200-E202 PolarHBondContact O-N 3.06Å; T200-E202 VanDerWaalsContact O-N 3.16Å
203	G	42	Very low	44.3	Very low	87 Å²	87	102.8 Å²	102.8	90%	0.897	62%	0.616	S	S	*	*	S	Bend	trans	52.4	73.8	143.1	0	0	0	0	0	118.2
204	G	33.6	Very low	44.3	Very low	47 Å²	47	104.9 Å²	104.9	49%	0.485	63%	0.627	S	S	.	*			trans	-179.7	96.4	163.7	0	0	0	0	0	113.7	V206	G204-V206 PolarHBondContact O-N 2.68Å
205	A	33.2	Very low	45	Very low	101 Å²	101	101.7 Å²	101.7	84%	0.835	62%	0.615	S	S	*	*			trans	-67.9	99.5	165.4	0	0	0	0	0	108.6	P207	A205-P207 WeakPolarHBondContact O-CD 3.32Å
206	V	36.5	Very low	46.4	Very low	122 Å²	122	99.4 Å²	99.4	74%	0.739	60%	0.599	S	S	*	*			trans	-69.5	113.8	171.1	-175.1	0	0	0	0	108.1	G204 G208	G204-V206 PolarHBondContact O-N 2.68Å; V206-G208 PolarHBondContact O-N 3.48Å
207	P	34.2	Very low	48	Very low	129 Å²	129	98 Å²	98	84%	0.838	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	120.8	177.9	-9	26.6	0	0	0	109.1	A205	A205-P207 WeakPolarHBondContact O-CD 3.32Å
208	G	36.3	Very low	50.4	Low	76 Å²	76	93.7 Å²	93.7	78%	0.784	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	117.8	5.8	159.8	0	0	0	0	0	118.2	V206 K210	V206-G208 PolarHBondContact O-N 3.48Å; G208-K210 PolarHBondContact O-N 2.98Å
209	L	38.6	Very low	53	Low	150 Å²	150	87.7 Å²	87.7	79%	0.785	53%	0.532	S	S	*	.			trans	-72.6	100.4	170.3	-139.2	80.7	0	0	0	109.2	Q211	L209-Q211 VanDerWaalsContact C-N 3.29Å; L209-Q211 PolarHBondContact O-N 3.05Å
210	K	36.1	Very low	55.8	Low	206 Å²	206	83.5 Å²	83.5	90%	0.896	51%	0.505	S	S	*	.			trans	-57.9	93	171.4	-156.9	177.4	-169.8	179.8	0	107.1	G208 S212	G208-K210 PolarHBondContact O-N 2.98Å; K210-S212 PolarHBondContact O-N 3.46Å
211	Q	45	Very low	58.8	Low	121 Å²	121	78.9 Å²	78.9	57%	0.565	48%	0.477	S	S	*	.			trans	-51.8	118.7	179.3	-80.2	-179.9	-14.4	0	0	107.9	L209 K213	L209-Q211 VanDerWaalsContact C-N 3.29Å; L209-Q211 PolarHBondContact O-N 3.05Å; Q211-K213 PolarHBondContact O-N 3.41Å; Q211-K213 VanDerWaalsContact O-N 3.14Å
212	S	50.1	Low	61.7	Low	52 Å²	52	73 Å²	73	36%	0.364	44%	0.438	S	S	.	.			trans	-60.2	119.1	177.5	170.8	0	0	0	0	107.9	R194 K210 D214	R194-S212 WeakPolarHBondContact CB-O 3.45Å; K210-S212 PolarHBondContact O-N 3.46Å; S212-D214 PolarHBondContact O-N 2.99Å; S212-D214 PolarHBondContact OG-OD1 3.2Å; S212-D214 PolarHBondContact OG-OD2 2.85Å; S212-D214 VanDerWaalsContact OG-OD2 3.06Å
213	K	56.1	Low	64.5	Low	162 Å²	162	64.1 Å²	64.1	70%	0.704	40%	0.397	S	S	*	.			trans	-79.6	54.2	176	-64.9	-175.6	178.8	-176.8	0	110.4	Q211 R215	Q211-K213 PolarHBondContact O-N 3.41Å; Q211-K213 VanDerWaalsContact O-N 3.14Å; K213-R215 PolarHBondContact O-N 2.9Å
214	D	71.6	Confident	67.1	Low	47 Å²	47	60 Å²	60	25%	0.251	35%	0.354	S	S	.	.			trans	-74	118.3	173	-74.6	-25.1	0	0	0	108.4	W193 R194 S212	W193-D214 HydrophobicContact CZ2-CB 3.88Å; W193-D214 PolarHBondContact NE1-O 2.89Å; R194-D214 WeakPolarHBondContact CD-OD2 3.46Å; R194-D214 HydrophobicContact CG-CB 4.19Å; R194-D214 IonicContact CZ-OD2 2.84Å; R194-D214 IonicContact NE-OD2 3.95Å; R194-D214 PolarHBondContact NE-OD2 3.47Å; R194-D214 IonicContact NH2-OD2 3.71Å; S212-D214 PolarHBondContact O-N 2.99Å; S212-D214 PolarHBondContact OG-OD1 3.2Å; S212-D214 PolarHBondContact OG-OD2 2.85Å; S212-D214 VanDerWaalsContact OG-OD2 3.06Å
215	R	81.6	Confident	70	Confident	38 Å²	38	58.8 Å²	58.8	14%	0.143	34%	0.337	C	S	.	.			trans	-109.5	134.9	-177.3	-169.9	-176.5	68.4	176.1	0.2	109.8	L191 F192 K213 S259 A260 W261	L191-R215 WeakPolarHBondContact O-CA 3.25Å; F192-R215 HydrophobicContact CD1-CB 4.13Å; F192-R215 HydrophobicContact CD1-CG 4.32Å; F192-R215 HydrophobicContact CE1-CB 3.96Å; F192-R215 HydrophobicContact CE1-CG 4.04Å; F192-R215 HydrophobicContact CZ-CG 4.3Å; K213-R215 PolarHBondContact O-N 2.9Å; R215-S259 PolarHBondContact NH2-O 3.43Å; R215-A260 PolarHBondContact NH2-O 3.46Å; R215-W261 VanDerWaalsContact CZ-CE2 3.47Å
216	L	87.4	Confident	72.9	Confident	1 Å²	1	54 Å²	54	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	139.6	159.4	-69.1	169.2	0	0	0	107.7	L191 W193 I235 Y254 M359 A362	L191-L216 HydrophobicContact CB-CB 4.43Å; L191-L216 PolarHBondContact N-O 3.01Å; L191-L216 PolarHBondContact O-N 2.77Å; W193-L216 HydrophobicContact CG-CD1 4.37Å; L216-I235 WeakPolarHBondContact CA-O 3.42Å; L216-Y254 HydrophobicContact CD2-CE2 4.49Å; L216-M359 HydrophobicContact CD1-CG 4.47Å; L216-M359 HydrophobicContact CD2-CE 4.31Å; L216-M359 HydrophobicContact CD2-SD 4.36Å; L216-A362 HydrophobicContact CD1-CB 4.1Å
217	T	90.5	Very high	75.6	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	139.1	165.3	-62.9	0	0	0	0	107.9	E188 T189 A234 I235 A260 V262	E188-T217 HydrophobicContact CB-CG2 4.06Å; E188-T217 HydrophobicContact CG-CG2 4.37Å; T189-T217 CarbonylContact O-C 3.4Å; T189-T217 WeakPolarHBondContact O-CA 3.24Å; T217-A234 CarbonylContact O-C 3.58Å; T217-I235 HydrophobicContact CG2-CD1 4.43Å; T217-I235 PolarHBondContact N-O 3.21Å; T217-I235 WeakPolarHBondContact O-CD1 3.47Å; T217-I235 PolarHBondContact O-N 3.44Å; T217-A260 WeakPolarHBondContact CB-O 3.35Å; T217-A260 PolarHBondContact OG1-O 3.49Å; T217-V262 HydrophobicContact CG2-CG2 4.07Å
218	V	94.2	Very high	78.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	120	-175.8	-169.4	0	0	0	0	108.2	E188 T189 L191 M220 P232 L233 F339 M366	E188-V218 CarbonylContact C-O 3.57Å; E188-V218 WeakPolarHBondContact CA-O 3.41Å; T189-V218 HydrophobicContact CG2-CB 4.33Å; T189-V218 PolarHBondContact N-O 3.47Å; T189-V218 PolarHBondContact O-N 2.93Å; L191-V218 HydrophobicContact CD1-CG2 3.48Å; L191-V218 VanDerWaalsContact CD1-CG2 3.48Å; L191-V218 HydrophobicContact CG-CG2 3.8Å; V218-M220 HydrophobicContact CG1-CG 3.97Å; V218-P232 HydrophobicContact CG1-CB 4.04Å; V218-L233 CarbonylContact C-O 3.46Å; V218-L233 VanDerWaalsContact CA-O 3.32Å; V218-L233 WeakPolarHBondContact CA-O 3.32Å; V218-F339 HydrophobicContact CG1-CZ 4.39Å; V218-M366 HydrophobicContact CB-SD 4.01Å; V218-M366 HydrophobicContact CG1-CG 4.15Å; V218-M366 HydrophobicContact CG1-SD 3.56Å; V218-M366 VanDerWaalsContact CG1-SD 3.56Å; V218-M366 HydrophobicContact CG2-CG 4.29Å; V218-M366 HydrophobicContact CG2-SD 3.2Å; V218-M366 WeakPolarHBondContact CG2-SD 3.41Å
219	L	96.8	Very high	81.4	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120.2	169.4	172.4	60.4	0	0	0	108.4	A186 E188 L233 F267 W270	A186-L219 HydrophobicContact CB-CD1 3.94Å; E188-L219 HydrophobicContact CG-CB 4.24Å; E188-L219 HydrophobicContact CG-CD1 4.07Å; E188-L219 WeakPolarHBondContact OE1-CD1 3.41Å; L219-L233 HydrophobicContact CB-CB 4.18Å; L219-L233 HydrophobicContact CD2-CD2 4.21Å; L219-L233 PolarHBondContact N-O 3.06Å; L219-L233 PolarHBondContact O-N 3.27Å; L219-F267 HydrophobicContact CD1-CE2 4.31Å; L219-F267 HydrophobicContact CD2-CD2 4.06Å; L219-F267 HydrophobicContact CD2-CE2 3.94Å; L219-W270 HydrophobicContact CD2-CD2 3.48Å; L219-W270 VanDerWaalsContact CD2-CD2 3.48Å; L219-W270 HydrophobicContact CD2-CE3 3.76Å; L219-W270 HydrophobicContact CD2-CG 3.85Å; L219-W270 HydrophobicContact CD2-CH2 4.33Å; L219-W270 HydrophobicContact CD2-CZ2 4.1Å; L219-W270 HydrophobicContact CD2-CZ3 4.17Å; L219-W270 HydrophobicContact CG-CZ2 4.37Å
220	M	97.3	Very high	84.1	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.3	178.8	-62.7	177.7	-64.7	0	0	109.4	A186 D187 T189 V218 F339 W370	A186-M220 WeakPolarHBondContact CA-O 3.32Å; A186-M220 WeakPolarHBondContact CB-O 3.33Å; D187-M220 PolarHBondContact N-O 2.95Å; D187-M220 PolarHBondContact O-N 3.48Å; T189-M220 HydrophobicContact CG2-CE 3.81Å; V218-M220 HydrophobicContact CG1-CG 3.97Å; M220-F339 HydrophobicContact CE-CD1 3.83Å; M220-F339 HydrophobicContact CE-CE1 4.17Å; M220-F339 HydrophobicContact CE-CG 4.16Å; M220-F339 HydrophobicContact SD-CB 4.22Å; M220-F339 HydrophobicContact SD-CD1 3.65Å; M220-F339 HydrophobicContact SD-CD2 3.66Å; M220-F339 HydrophobicContact SD-CE1 3.8Å; M220-F339 HydrophobicContact SD-CE2 3.82Å; M220-F339 HydrophobicContact SD-CG 3.55Å; M220-F339 VanDerWaalsContact SD-CG 3.55Å; M220-F339 HydrophobicContact SD-CZ 3.87Å; M220-W370 HydrophobicContact CB-CE3 4.2Å; M220-W370 HydrophobicContact CB-CH2 3.84Å; M220-W370 HydrophobicContact CB-CZ2 4.27Å; M220-W370 HydrophobicContact CB-CZ3 3.81Å; M220-W370 HydrophobicContact CG-CD2 4.41Å; M220-W370 HydrophobicContact CG-CE3 4.02Å; M220-W370 HydrophobicContact CG-CZ3 4.1Å; M220-W370 HydrophobicContact SD-CD2 4.36Å; M220-W370 HydrophobicContact SD-CE3 3.51Å; M220-W370 VanDerWaalsContact SD-CE3 3.51Å; M220-W370 HydrophobicContact SD-CZ3 3.71Å
221	C	98.2	Very high	86.8	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.014	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	135	179.4	-177.5	0	0	0	0	110.5	N185 A186 L230 W270	N185-C221 WeakPolarHBondContact O-CA 3.33Å; A186-C221 HydrophobicContact CB-CB 3.68Å; C221-L230 HydrophobicContact CB-CB 4.25Å; C221-L230 HydrophobicContact CB-CD1 4.09Å; C221-L230 HydrophobicContact CB-CD2 4.39Å; C221-L230 HydrophobicContact CB-CG 4.47Å; C221-L230 PolarHBondContact O-N 2.81Å; C221-W270 HydrophobicContact CB-CH2 4.04Å; C221-W270 HydrophobicContact CB-CZ2 3.68Å
222	A	98.3	Very high	89.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	158.6	176	0	0	0	0	0	111.2	Y184 N185 H228 R229 M331 W370 F378	Y184-A222 WeakPolarHBondContact CA-O 3.43Å; N185-A222 PolarHBondContact N-O 3.16Å; N185-A222 VanDerWaalsContact N-O 3.09Å; N185-A222 PolarHBondContact O-N 3Å; A222-H228 WeakPolarHBondContact CA-O 3.4Å; A222-R229 HydrophobicContact CB-CB 4.41Å; A222-R229 HydrophobicContact CB-CG 4.03Å; A222-M331 HydrophobicContact CB-CE 3.97Å; A222-W370 HydrophobicContact CB-CH2 4.11Å; A222-W370 HydrophobicContact CB-CZ2 4.06Å; A222-F378 HydrophobicContact CB-CD1 3.65Å; A222-F378 HydrophobicContact CB-CE1 3.43Å; A222-F378 VanDerWaalsContact CB-CE1 3.43Å; A222-F378 HydrophobicContact CB-CZ 4.41Å
223	N	97.6	Very high	91.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	172.9	173.1	70.3	-7	0	0	0	112.8	E181 V183 Y184 T225 G226 S227 H228	E181-N223 PolarHBondContact OE2-ND2 3.46Å; V183-N223 CarbonylContact O-C 3.58Å; V183-N223 WeakPolarHBondContact O-CA 3.33Å; Y184-N223 HydrophobicContact CD1-CB 3.93Å; Y184-N223 HydrophobicContact CD2-CB 4.35Å; Y184-N223 HydrophobicContact CE1-CB 3.59Å; Y184-N223 HydrophobicContact CE2-CB 4.02Å; Y184-N223 HydrophobicContact CG-CB 4.28Å; N223-T225 VanDerWaalsContact C-N 3.33Å; N223-T225 PolarHBondContact ND2-OG1 3.04Å; N223-T225 VanDerWaalsContact ND2-OG1 3.11Å; N223-T225 PolarHBondContact O-N 2.86Å; N223-T225 PolarHBondContact OD1-OG1 2.98Å; N223-G226 PolarHBondContact O-N 3.31Å; N223-G226 WeakPolarHBondContact OD1-CA 3.32Å; N223-G226 PolarHBondContact OD1-N 2.94Å; N223-S227 PolarHBondContact ND2-OG 2.78Å; N223-S227 PolarHBondContact OD1-N 3.18Å; N223-S227 VanDerWaalsContact OD1-N 3.09Å; N223-H228 PolarHBondContact N-O 3.1Å; N223-H228 PolarHBondContact OD1-N 3.44Å; N223-H228 VanDerWaalsContact OD1-N 3.11Å; N223-H228 PolarHBondContact OD1-O 3.31Å
224	A	96.1	Very high	93.2	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-26.4	-175	0	0	0	0	0	114.7	P180 V183 W382 F391	P180-A224 HydrophobicContact CB-CB 4.05Å; P180-A224 WeakPolarHBondContact O-CB 3.34Å; P180-A224 PolarHBondContact O-N 3.04Å; P180-A224 VanDerWaalsContact O-N 3.16Å; V183-A224 PolarHBondContact O-N 3.25Å; A224-W382 VanDerWaalsContact CA-NE1 3.31Å; A224-W382 HydrophobicContact CB-CD2 3.69Å; A224-W382 HydrophobicContact CB-CE3 4.31Å; A224-W382 HydrophobicContact CB-CG 3.8Å; A224-W382 HydrophobicContact CB-CZ2 4.11Å; A224-F391 WeakPolarHBondContact O-CZ 3.42Å
225	T	93.9	Very high	94.2	Very high	21 Å²	21	15.4 Å²	15.4	13%	0.129	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-23.1	173	59.4	0	0	0	0	112.9	P180 E181 N223 S227 R379 F391	P180-T225 HydrophobicContact CB-CG2 3.54Å; E181-T225 HydrophobicContact CG-CG2 4.27Å; E181-T225 WeakPolarHBondContact OE1-CB 3.33Å; E181-T225 WeakPolarHBondContact OE1-CG2 3.48Å; E181-T225 PolarHBondContact OE1-OG1 3.18Å; N223-T225 VanDerWaalsContact C-N 3.33Å; N223-T225 PolarHBondContact ND2-OG1 3.04Å; N223-T225 VanDerWaalsContact ND2-OG1 3.11Å; N223-T225 PolarHBondContact O-N 2.86Å; N223-T225 PolarHBondContact OD1-OG1 2.98Å; T225-S227 PolarHBondContact O-N 3.32Å; T225-S227 WeakPolarHBondContact OG1-CB 3.31Å; T225-S227 PolarHBondContact OG1-N 2.84Å; T225-S227 PolarHBondContact OG1-OG 3.36Å; T225-R379 WeakPolarHBondContact O-CG 3.34Å; T225-F391 HydrophobicContact CG2-CD1 4.06Å; T225-F391 HydrophobicContact CG2-CE1 3.84Å
226	G	94.1	Very high	94.6	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.01	7%	0.07	C	C	.	.	S	Bend	trans	73.5	8.9	-169.2	0	0	0	0	0	113.9	N223 R229 S375	N223-G226 PolarHBondContact O-N 3.31Å; N223-G226 WeakPolarHBondContact OD1-CA 3.32Å; N223-G226 PolarHBondContact OD1-N 2.94Å; G226-R229 PolarHBondContact O-NE 2.83Å; G226-R229 VanDerWaalsContact O-NE 3.15Å; G226-S375 PolarHBondContact O-OG 3.31Å
227	S	93.8	Very high	94.6	Very high	66 Å²	66	18.4 Å²	18.4	46%	0.462	9%	0.09	S	C	.	.	S	Bend	trans	-71.4	-32.7	176.7	67	0	0	0	0	111.7	E181 N223 T225	E181-S227 PolarHBondContact OE1-OG 2.88Å; E181-S227 PolarHBondContact OE2-OG 3.12Å; N223-S227 PolarHBondContact ND2-OG 2.78Å; N223-S227 PolarHBondContact OD1-N 3.18Å; N223-S227 VanDerWaalsContact OD1-N 3.09Å; T225-S227 PolarHBondContact O-N 3.32Å; T225-S227 WeakPolarHBondContact OG1-CB 3.31Å; T225-S227 PolarHBondContact OG1-N 2.84Å; T225-S227 PolarHBondContact OG1-OG 3.36Å
228	H	96.8	Very high	94.2	Very high	21 Å²	21	21.8 Å²	21.8	10%	0.097	11%	0.114	C	C	.	.			trans	-118.4	118	175.7	-176.8	-141.7	0	0	0	110.5	Y184 A222 N223 S278 H282	Y184-H228 HydrophobicContact CE1-CB 4.44Å; Y184-H228 AromaticContact CE1-ND1 3.37Å; Y184-H228 WeakPolarHBondContact CE1-ND1 3.33Å; Y184-H228 AromaticContact CZ-ND1 3.49Å; Y184-H228 PolarHBondContact OH-ND1 2.79Å; A222-H228 WeakPolarHBondContact CA-O 3.4Å; N223-H228 PolarHBondContact N-O 3.1Å; N223-H228 PolarHBondContact OD1-N 3.44Å; N223-H228 VanDerWaalsContact OD1-N 3.11Å; N223-H228 PolarHBondContact OD1-O 3.31Å; H228-S278 PolarHBondContact CE1-O 3.28Å; H228-S278 VanDerWaalsContact CE1-O 3.28Å; H228-S278 PolarHBondContact CE1-OG 2.79Å; H228-S278 PolarHBondContact NE2-OG 2.86Å; H228-S278 VanDerWaalsContact NE2-OG 3.07Å; H228-H282 HydrophobicContact CB-CB 4.42Å; H228-H282 AromaticContact CG-CD2 3.83Å; H228-H282 AromaticContact CG-CG 3.49Å; H228-H282 VanDerWaalsContact CG-CG 3.49Å; H228-H282 AromaticContact CG-ND1 3.79Å; H228-H282 WeakPolarHBondContact ND1-CB 3.45Å; H228-H282 AromaticContact ND1-CD2 3.81Å; H228-H282 AromaticContact ND1-CG 3.59Å
229	R	95.4	Very high	93.3	Very high	55 Å²	55	26.9 Å²	26.9	21%	0.208	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-122.5	125.9	178.2	-55.4	178.9	-161.5	178.1	3.4	107.7	A222 G226 W370 N371 I373 S375 F378	A222-R229 HydrophobicContact CB-CB 4.41Å; A222-R229 HydrophobicContact CB-CG 4.03Å; G226-R229 PolarHBondContact O-NE 2.83Å; G226-R229 VanDerWaalsContact O-NE 3.15Å; R229-W370 HydrophobicContact CB-CZ2 3.95Å; R229-W370 HydrophobicContact CG-CZ2 4.32Å; R229-W370 PolarHBondContact NH1-O 3.23Å; R229-N371 PolarHBondContact NH1-O 3.02Å; R229-N371 VanDerWaalsContact NH1-O 3.14Å; R229-I373 PolarHBondContact NH1-O 3.01Å; R229-I373 PolarHBondContact NH2-O 3.43Å; R229-S375 PolarHBondContact NH2-OG 3.05Å; R229-S375 VanDerWaalsContact NH2-OG 3.17Å; R229-F378 HydrophobicContact CG-CZ 4.32Å
230	L	95.8	Very high	92.1	Very high	2 Å²	2	30 Å²	30	1%	0.01	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-72.7	151.1	179	-75.7	80.1	0	0	0	109.9	Y184 C221 P232 W270 F275 W370	Y184-L230 HydrophobicContact CD1-CD1 3.87Å; Y184-L230 HydrophobicContact CE1-CD1 3.82Å; C221-L230 HydrophobicContact CB-CB 4.25Å; C221-L230 HydrophobicContact CB-CD1 4.09Å; C221-L230 HydrophobicContact CB-CD2 4.39Å; C221-L230 HydrophobicContact CB-CG 4.47Å; C221-L230 PolarHBondContact O-N 2.81Å; L230-P232 WeakPolarHBondContact O-CD 3.28Å; L230-W270 HydrophobicContact CD2-CZ2 4.14Å; L230-F275 HydrophobicContact CD1-CD2 4.4Å; L230-F275 HydrophobicContact CD2-CB 4.01Å; L230-F275 HydrophobicContact CD2-CD2 3.57Å; L230-F275 HydrophobicContact CD2-CG 4.25Å; L230-W370 PolarHBondContact O-NE1 3.29Å
231	K	91.6	Very high	91.2	Very high	105 Å²	105	30.6 Å²	30.6	46%	0.457	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-55.2	120.6	166.7	-171.6	174	-167.2	175	0	108.6	L250 P251 V252	K231-L250 WeakPolarHBondContact CE-O 3.41Å; K231-L250 PolarHBondContact NZ-O 3.23Å; K231-P251 VanDerWaalsContact CE-O 3.26Å; K231-P251 WeakPolarHBondContact CE-O 3.29Å; K231-V252 VanDerWaalsContact CE-C 3.44Å; K231-V252 VanDerWaalsContact CE-N 3.34Å
232	P	95.1	Very high	90.1	Very high	5 Å²	5	42 Å²	42	3%	0.032	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-58.9	146.8	-178.4	-25.4	34.3	0	0	0	111.5	V218 L230 V252 A253 W370	V218-P232 HydrophobicContact CG1-CB 4.04Å; L230-P232 WeakPolarHBondContact O-CD 3.28Å; P232-V252 HydrophobicContact CB-CG1 4.22Å; P232-V252 HydrophobicContact CG-CG1 4.44Å; P232-V252 WeakPolarHBondContact O-CA 3.17Å; P232-V252 VanDerWaalsContact O-CB 3.32Å; P232-V252 WeakPolarHBondContact O-CB 3.2Å; P232-A253 PolarHBondContact O-N 3.39Å; P232-W370 HydrophobicContact CG-CB 4.06Å; P232-W370 HydrophobicContact CG-CD2 4.43Å; P232-W370 HydrophobicContact CG-CG 3.68Å
233	L	96.3	Very high	89	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	118.6	170.3	171.3	69.4	0	0	0	109.2	V218 L219 I235 A253 K255 I266 W270	V218-L233 CarbonylContact C-O 3.46Å; V218-L233 VanDerWaalsContact CA-O 3.32Å; V218-L233 WeakPolarHBondContact CA-O 3.32Å; L219-L233 HydrophobicContact CB-CB 4.18Å; L219-L233 HydrophobicContact CD2-CD2 4.21Å; L219-L233 PolarHBondContact N-O 3.06Å; L219-L233 PolarHBondContact O-N 3.27Å; L233-I235 HydrophobicContact CD2-CD1 4.1Å; L233-I235 HydrophobicContact CG-CD1 3.85Å; L233-I235 HydrophobicContact CG-CG1 4.34Å; L233-A253 HydrophobicContact CB-CB 4.42Å; L233-A253 HydrophobicContact CD1-CB 3.71Å; L233-K255 HydrophobicContact CD1-CB 4.3Å; L233-K255 HydrophobicContact CD1-CG 3.78Å; L233-I266 HydrophobicContact CD2-CG2 3.91Å; L233-W270 HydrophobicContact CD2-CB 3.92Å; L233-W270 HydrophobicContact CD2-CG 4.05Å
234	A	94.4	Very high	88.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.6	174.7	0	0	0	0	0	110.8	T217 V252 A253 Y254 K255 M366	T217-A234 CarbonylContact O-C 3.58Å; A234-V252 HydrophobicContact CB-CG2 3.86Å; A234-A253 PolarHBondContact N-O 3.47Å; A234-Y254 HydrophobicContact CB-CD2 4.1Å; A234-Y254 WeakPolarHBondContact O-CA 3.42Å; A234-K255 PolarHBondContact O-N 2.79Å; A234-M366 HydrophobicContact CB-CE 3.55Å; A234-M366 HydrophobicContact CB-SD 4.36Å
235	I	92.9	Very high	87.3	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	114.3	176.9	-52.7	85.6	0	0	0	108.7	L216 T217 L233 K255 Q257 V262 I266	L216-I235 WeakPolarHBondContact CA-O 3.42Å; T217-I235 HydrophobicContact CG2-CD1 4.43Å; T217-I235 PolarHBondContact N-O 3.21Å; T217-I235 WeakPolarHBondContact O-CD1 3.47Å; T217-I235 PolarHBondContact O-N 3.44Å; L233-I235 HydrophobicContact CD2-CD1 4.1Å; L233-I235 HydrophobicContact CG-CD1 3.85Å; L233-I235 HydrophobicContact CG-CG1 4.34Å; I235-K255 WeakPolarHBondContact CA-O 3.43Å; I235-Q257 HydrophobicContact CG2-CB 3.69Å; I235-V262 HydrophobicContact CD1-CG2 3.5Å; I235-V262 HydrophobicContact CG1-CG2 4.05Å; I235-I266 HydrophobicContact CG1-CG2 4.33Å; I235-I266 HydrophobicContact CG2-CD1 4.4Å
236	G	90.4	Very high	86.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	175.5	175.6	0	0	0	0	0	112.6	Y254 K255 A256 Q257	G236-Y254 WeakPolarHBondContact CA-OH 3.41Å; G236-K255 PolarHBondContact N-O 3.03Å; G236-A256 CarbonylContact O-C 3.55Å; G236-A256 VanDerWaalsContact O-CA 3.31Å; G236-A256 WeakPolarHBondContact O-CA 3.37Å; G236-Q257 PolarHBondContact O-N 3.31Å; G236-Q257 VanDerWaalsContact O-O 3.09Å
237	K	86.3	Confident	85.3	Confident	101 Å²	101	56.2 Å²	56.2	44%	0.439	31%	0.307	S	S	.	.	S	Bend	trans	-75.8	-34.5	-177.7	-68.3	-174.8	-179.7	172	0	114.4	Q257 A260	K237-Q257 WeakPolarHBondContact CA-O 3.39Å; K237-A260 HydrophobicContact CG-CB 3.86Å
238	C	82.2	Confident	84.3	Confident	75 Å²	75	59.9 Å²	59.9	51%	0.507	32%	0.317	S	S	.	.	S	Bend	trans	-110.9	136.4	-169.4	-58.1	0	0	0	0	110.6	P241 Y254 A256	C238-P241 WeakPolarHBondContact O-CD 3.33Å; C238-Y254 WeakPolarHBondContact O-CE1 3.16Å; C238-Y254 PolarHBondContact O-OH 2.96Å; C238-A256 WeakPolarHBondContact O-CB 3.28Å
239	S	75.6	Confident	83.4	Confident	106 Å²	106	63.4 Å²	63.4	74%	0.741	33%	0.333	S	S	*	.	S	Bend	trans	-70	130.4	163.5	48.5	0	0	0	0	108.5	A256	S239-A256 VanDerWaalsContact CA-CB 3.48Å; S239-A256 VanDerWaalsContact N-CB 3.26Å
240	G	72.6	Confident	82.9	Confident	67 Å²	67	62.4 Å²	62.4	69%	0.691	33%	0.332	S	S	*	.	S	Bend	trans	54.8	62.7	-179.3	0	0	0	0	0	115.7	R242	G240-R242 PolarHBondContact O-N 3.04Å
241	P	77.4	Confident	82.5	Confident	15 Å²	15	63.5 Å²	63.5	10%	0.097	34%	0.339	C	S	.	.			trans	-48.1	137.5	170.7	-26.5	34.4	0	0	0	111.7	C238 A243 F244 Y254 M359	C238-P241 WeakPolarHBondContact O-CD 3.33Å; P241-A243 PolarHBondContact O-N 2.76Å; P241-F244 HydrophobicContact CB-CD2 4.15Å; P241-F244 HydrophobicContact CB-CE1 4.44Å; P241-F244 HydrophobicContact CB-CE2 4.04Å; P241-F244 HydrophobicContact CB-CG 4.37Å; P241-F244 HydrophobicContact CB-CZ 4.13Å; P241-F244 VanDerWaalsContact CD-CD2 3.5Å; P241-F244 VanDerWaalsContact CD-CE2 3.48Å; P241-F244 HydrophobicContact CG-CD2 3.86Å; P241-F244 HydrophobicContact CG-CE2 3.43Å; P241-F244 VanDerWaalsContact CG-CE2 3.43Å; P241-F244 HydrophobicContact CG-CZ 3.78Å; P241-F244 PolarHBondContact O-N 2.92Å; P241-Y254 HydrophobicContact CG-CE1 4.21Å; P241-Y254 WeakPolarHBondContact CG-OH 3.49Å; P241-M359 HydrophobicContact CB-SD 3.77Å; P241-M359 HydrophobicContact CG-CE 4.49Å; P241-M359 HydrophobicContact CG-SD 3.43Å; P241-M359 WeakPolarHBondContact CG-SD 3.19Å
242	R	74.9	Confident	82.4	Confident	240 Å²	240	58.7 Å²	58.7	91%	0.906	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-51.2	-29.5	175.5	-72.8	-171.6	-70.8	-177.2	-3.8	112.8	G240 F244 K245	G240-R242 PolarHBondContact O-N 3.04Å; R242-F244 PolarHBondContact O-N 3.33Å; R242-K245 WeakPolarHBondContact O-CB 3.33Å; R242-K245 PolarHBondContact O-N 2.74Å
243	A	75.1	Confident	82.3	Confident	34 Å²	34	59.5 Å²	59.5	28%	0.281	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-61.7	-18.8	176.4	0	0	0	0	0	114.1	P241 M359 N360	P241-A243 PolarHBondContact O-N 2.76Å; A243-M359 HydrophobicContact CB-CB 4.17Å; A243-N360 HydrophobicContact CB-CB 4.19Å
244	F	80.3	Confident	82.1	Confident	23 Å²	23	61.5 Å²	61.5	10%	0.101	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-99.6	2.5	179.6	-52.5	-18.6	0	0	0	113.1	P241 R242 G246 I247 L250 Y254 M359 N360 I363	P241-F244 HydrophobicContact CB-CD2 4.15Å; P241-F244 HydrophobicContact CB-CE1 4.44Å; P241-F244 HydrophobicContact CB-CE2 4.04Å; P241-F244 HydrophobicContact CB-CG 4.37Å; P241-F244 HydrophobicContact CB-CZ 4.13Å; P241-F244 VanDerWaalsContact CD-CD2 3.5Å; P241-F244 VanDerWaalsContact CD-CE2 3.48Å; P241-F244 HydrophobicContact CG-CD2 3.86Å; P241-F244 HydrophobicContact CG-CE2 3.43Å; P241-F244 VanDerWaalsContact CG-CE2 3.43Å; P241-F244 HydrophobicContact CG-CZ 3.78Å; P241-F244 PolarHBondContact O-N 2.92Å; R242-F244 PolarHBondContact O-N 3.33Å; F244-G246 PolarHBondContact O-N 2.6Å; F244-I247 PolarHBondContact O-N 2.97Å; F244-I247 VanDerWaalsContact O-N 3.09Å; F244-L250 HydrophobicContact CD1-CD2 4.28Å; F244-L250 HydrophobicContact CD2-CD1 4.01Å; F244-L250 HydrophobicContact CE2-CD1 4.19Å; F244-L250 HydrophobicContact CG-CD1 4.4Å; F244-L250 HydrophobicContact CG-CD2 4.45Å; F244-Y254 AromaticContact CE2-CD1 3.97Å; F244-Y254 HydrophobicContact CE2-CD1 3.97Å; F244-Y254 AromaticContact CE2-CD2 3.79Å; F244-Y254 HydrophobicContact CE2-CD2 3.79Å; F244-Y254 AromaticContact CE2-CE1 3.97Å; F244-Y254 HydrophobicContact CE2-CE1 3.97Å; F244-Y254 AromaticContact CE2-CE2 3.78Å; F244-Y254 HydrophobicContact CE2-CE2 3.78Å; F244-Y254 AromaticContact CE2-CG 3.88Å; F244-Y254 HydrophobicContact CE2-CG 3.88Å; F244-Y254 AromaticContact CE2-CZ 3.88Å; F244-Y254 HydrophobicContact CZ-CD2 4.13Å; F244-Y254 HydrophobicContact CZ-CE2 4.01Å; F244-M359 HydrophobicContact CE1-CB 4.37Å; F244-M359 HydrophobicContact CE1-CG 4Å; F244-M359 HydrophobicContact CE1-SD 4.33Å; F244-M359 HydrophobicContact CE2-SD 4.45Å; F244-M359 HydrophobicContact CZ-CG 3.81Å; F244-M359 HydrophobicContact CZ-SD 3.69Å; F244-N360 HydrophobicContact CD1-CB 4.46Å; F244-I363 HydrophobicContact CE1-CD1 3.61Å; F244-I363 HydrophobicContact CE1-CG1 4.49Å; F244-I363 HydrophobicContact CE2-CD1 3.98Å; F244-I363 HydrophobicContact CZ-CD1 3.19Å; F244-I363 HydrophobicContact CZ-CG1 4.31Å
245	K	77.6	Confident	81.9	Confident	195 Å²	195	65 Å²	65	85%	0.848	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	115.9	-178	-172.2	179.2	179.8	-177.6	0	109.9	R242	R242-K245 WeakPolarHBondContact O-CB 3.33Å; R242-K245 PolarHBondContact O-N 2.74Å
246	G	73.4	Confident	81.7	Confident	40 Å²	40	66.9 Å²	66.9	41%	0.412	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	7.8	178.3	0	0	0	0	0	115.6	F244 R503	F244-G246 PolarHBondContact O-N 2.6Å; G246-R503 PolarHBondContact O-NE 3.06Å
247	I	74.4	Confident	81.6	Confident	29 Å²	29	68.9 Å²	68.9	15%	0.149	37%	0.374	C	S	.	.			trans	-96	125.2	170.6	-53.9	176.6	0	0	0	108.3	F244 L250 N360	F244-I247 PolarHBondContact O-N 2.97Å; F244-I247 VanDerWaalsContact O-N 3.09Å; I247-L250 HydrophobicContact CD1-CD2 4.39Å; I247-L250 HydrophobicContact CG2-CD2 3.95Å; I247-L250 HydrophobicContact CG2-CG 4.38Å; I247-N360 WeakPolarHBondContact CD1-ND2 3.49Å
248	Q	72	Confident	81.2	Confident	144 Å²	144	67.2 Å²	67.2	67%	0.673	39%	0.385	S	S	*	.	S	Bend	trans	-94.5	-36.1	179.9	-63.7	-172.8	10.2	0	0	112
249	H	77.9	Confident	81.1	Confident	94 Å²	94	66.9 Å²	66.9	44%	0.435	38%	0.384	S	S	.	.			trans	-121.7	105.4	-177.5	-61.4	-70.3	0	0	0	110.5	R503	H249-R503 PolarHBondContact CD2-O 3.4Å
250	L	85	Confident	81.2	Confident	34 Å²	34	61.9 Å²	61.9	18%	0.178	35%	0.348	C	S	.	.			trans	-80	143.1	170.2	-71.5	171.6	0	0	0	109.9	K231 F244 I247 V252 I363	K231-L250 WeakPolarHBondContact CE-O 3.41Å; K231-L250 PolarHBondContact NZ-O 3.23Å; F244-L250 HydrophobicContact CD1-CD2 4.28Å; F244-L250 HydrophobicContact CD2-CD1 4.01Å; F244-L250 HydrophobicContact CE2-CD1 4.19Å; F244-L250 HydrophobicContact CG-CD1 4.4Å; F244-L250 HydrophobicContact CG-CD2 4.45Å; I247-L250 HydrophobicContact CD1-CD2 4.39Å; I247-L250 HydrophobicContact CG2-CD2 3.95Å; I247-L250 HydrophobicContact CG2-CG 4.38Å; L250-V252 WeakPolarHBondContact CB-O 3.18Å; L250-V252 PolarHBondContact O-N 3.29Å; L250-V252 VanDerWaalsContact O-N 3.12Å; L250-I363 HydrophobicContact CD2-CG2 4.4Å
251	P	87.2	Confident	81.8	Confident	26 Å²	26	65.6 Å²	65.6	17%	0.169	34%	0.341	C	S	.	.	S	Bend	trans	-71.3	-3.8	176.8	32.2	-37.6	0	0	0	112.7	K231 I363 F364 A367 A509	K231-P251 VanDerWaalsContact CE-O 3.26Å; K231-P251 WeakPolarHBondContact CE-O 3.29Å; P251-I363 HydrophobicContact CG-CG2 3.83Å; P251-F364 HydrophobicContact CG-CD1 3.99Å; P251-F364 HydrophobicContact CG-CD2 3.97Å; P251-F364 HydrophobicContact CG-CE1 3.96Å; P251-F364 HydrophobicContact CG-CE2 3.98Å; P251-F364 HydrophobicContact CG-CG 4.02Å; P251-F364 HydrophobicContact CG-CZ 3.99Å; P251-A367 HydrophobicContact CB-CB 3.7Å; P251-A367 HydrophobicContact CG-CB 3.89Å; P251-A509 HydrophobicContact CB-CB 3.54Å; P251-A509 HydrophobicContact CG-CB 4.45Å
252	V	90.4	Very high	82.3	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.018	34%	0.341	C	S	.	.	S	Bend	trans	-132.1	156.4	177.7	-55.5	0	0	0	0	109.9	K231 P232 A234 L250 I363 M366 A367	K231-V252 VanDerWaalsContact CE-C 3.44Å; K231-V252 VanDerWaalsContact CE-N 3.34Å; P232-V252 HydrophobicContact CB-CG1 4.22Å; P232-V252 HydrophobicContact CG-CG1 4.44Å; P232-V252 WeakPolarHBondContact O-CA 3.17Å; P232-V252 VanDerWaalsContact O-CB 3.32Å; P232-V252 WeakPolarHBondContact O-CB 3.2Å; A234-V252 HydrophobicContact CB-CG2 3.86Å; L250-V252 WeakPolarHBondContact CB-O 3.18Å; L250-V252 PolarHBondContact O-N 3.29Å; L250-V252 VanDerWaalsContact O-N 3.12Å; V252-I363 HydrophobicContact CG1-CG2 4.33Å; V252-I363 HydrophobicContact CG2-CB 4.43Å; V252-I363 HydrophobicContact CG2-CD1 4.03Å; V252-I363 HydrophobicContact CG2-CG1 4.25Å; V252-I363 HydrophobicContact CG2-CG2 3.49Å; V252-I363 VanDerWaalsContact CG2-CG2 3.49Å; V252-M366 HydrophobicContact CB-CE 3.87Å; V252-M366 HydrophobicContact CG1-CE 3.44Å; V252-M366 VanDerWaalsContact CG1-CE 3.44Å; V252-M366 HydrophobicContact CG2-CE 3.69Å; V252-A367 HydrophobicContact CG1-CB 3.93Å
253	A	91.6	Very high	83	Confident	22 Å²	22	56.2 Å²	56.2	18%	0.182	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	141.8	163.5	0	0	0	0	0	108.3	P232 L233 A234 I274	P232-A253 PolarHBondContact O-N 3.39Å; L233-A253 HydrophobicContact CB-CB 4.42Å; L233-A253 HydrophobicContact CD1-CB 3.71Å; A234-A253 PolarHBondContact N-O 3.47Å; A253-I274 HydrophobicContact CB-CD1 3.7Å
254	Y	91.8	Very high	83.9	Confident	44 Å²	44	59.1 Å²	59.1	17%	0.173	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.1	179.6	-177	-91.6	0	0	0	111.2	L216 A234 G236 C238 P241 F244 A256 M359 I363	L216-Y254 HydrophobicContact CD2-CE2 4.49Å; A234-Y254 HydrophobicContact CB-CD2 4.1Å; A234-Y254 WeakPolarHBondContact O-CA 3.42Å; G236-Y254 WeakPolarHBondContact CA-OH 3.41Å; C238-Y254 WeakPolarHBondContact O-CE1 3.16Å; C238-Y254 PolarHBondContact O-OH 2.96Å; P241-Y254 HydrophobicContact CG-CE1 4.21Å; P241-Y254 WeakPolarHBondContact CG-OH 3.49Å; F244-Y254 AromaticContact CE2-CD1 3.97Å; F244-Y254 HydrophobicContact CE2-CD1 3.97Å; F244-Y254 AromaticContact CE2-CD2 3.79Å; F244-Y254 HydrophobicContact CE2-CD2 3.79Å; F244-Y254 AromaticContact CE2-CE1 3.97Å; F244-Y254 HydrophobicContact CE2-CE1 3.97Å; F244-Y254 AromaticContact CE2-CE2 3.78Å; F244-Y254 HydrophobicContact CE2-CE2 3.78Å; F244-Y254 AromaticContact CE2-CG 3.88Å; F244-Y254 HydrophobicContact CE2-CG 3.88Å; F244-Y254 AromaticContact CE2-CZ 3.88Å; F244-Y254 HydrophobicContact CZ-CD2 4.13Å; F244-Y254 HydrophobicContact CZ-CE2 4.01Å; Y254-A256 HydrophobicContact CE1-CB 4.32Å; Y254-M359 HydrophobicContact CE2-SD 4.3Å; Y254-I363 HydrophobicContact CD2-CD1 3.94Å; Y254-I363 HydrophobicContact CE2-CD1 4.47Å
255	K	91.4	Very high	84.5	Confident	72 Å²	72	64.5 Å²	64.5	31%	0.313	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	153.7	170.9	-67.8	-77.7	-174.4	165.2	0	109.6	L233 A234 I235 G236 I266 D269	L233-K255 HydrophobicContact CD1-CB 4.3Å; L233-K255 HydrophobicContact CD1-CG 3.78Å; A234-K255 PolarHBondContact O-N 2.79Å; I235-K255 WeakPolarHBondContact CA-O 3.43Å; G236-K255 PolarHBondContact N-O 3.03Å; K255-I266 HydrophobicContact CB-CG2 4.44Å; K255-I266 HydrophobicContact CG-CG2 4.44Å; K255-D269 WeakPolarHBondContact CE-OD2 3.36Å; K255-D269 IonicContact NZ-OD1 3.62Å; K255-D269 PolarHBondContact NZ-OD1 3.14Å; K255-D269 IonicContact NZ-OD2 3.9Å; K255-D269 PolarHBondContact NZ-OD2 2.93Å
256	A	88.1	Confident	85.3	Confident	41 Å²	41	56 Å²	56	34%	0.339	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.3	178.4	0	0	0	0	0	110.6	G236 C238 S239 Y254	G236-A256 CarbonylContact O-C 3.55Å; G236-A256 VanDerWaalsContact O-CA 3.31Å; G236-A256 WeakPolarHBondContact O-CA 3.37Å; C238-A256 WeakPolarHBondContact O-CB 3.28Å; S239-A256 VanDerWaalsContact CA-CB 3.48Å; S239-A256 VanDerWaalsContact N-CB 3.26Å; Y254-A256 HydrophobicContact CE1-CB 4.32Å
257	Q	88.3	Confident	86.4	Confident	42 Å²	42	54 Å²	54	20%	0.196	29%	0.285	C	S	.	.			trans	-144.4	131.2	179.1	-162.1	-88.9	-1.7	0	0	107.7	I235 G236 K237 S259 A260 W261 D263 I266	I235-Q257 HydrophobicContact CG2-CB 3.69Å; G236-Q257 PolarHBondContact O-N 3.31Å; G236-Q257 VanDerWaalsContact O-O 3.09Å; K237-Q257 WeakPolarHBondContact CA-O 3.39Å; Q257-S259 PolarHBondContact O-N 2.74Å; Q257-S259 VanDerWaalsContact OE1-C 3.28Å; Q257-S259 VanDerWaalsContact OE1-CA 3.24Å; Q257-S259 VanDerWaalsContact OE1-CB 3.31Å; Q257-A260 WeakPolarHBondContact O-CA 3.46Å; Q257-A260 PolarHBondContact O-N 3.48Å; Q257-W261 WeakPolarHBondContact CG-O 3.28Å; Q257-D263 WeakPolarHBondContact CG-OD2 3.34Å; Q257-I266 HydrophobicContact CB-CD1 3.77Å; Q257-I266 HydrophobicContact CG-CD1 3.82Å
258	G	78.4	Confident	87.4	Confident	65 Å²	65	54.3 Å²	54.3	67%	0.67	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.9	-167.2	0	0	0	0	0	115.4
259	S	78.9	Confident	88.5	Confident	69 Å²	69	49.8 Å²	49.8	48%	0.483	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-2.1	174.5	-60.1	0	0	0	0	113.5	R215 Q257 W261	R215-S259 PolarHBondContact NH2-O 3.43Å; Q257-S259 PolarHBondContact O-N 2.74Å; Q257-S259 VanDerWaalsContact OE1-C 3.28Å; Q257-S259 VanDerWaalsContact OE1-CA 3.24Å; Q257-S259 VanDerWaalsContact OE1-CB 3.31Å; S259-W261 VanDerWaalsContact C-N 3.27Å; S259-W261 VanDerWaalsContact CB-CD1 3.48Å; S259-W261 PolarHBondContact O-N 3.01Å
260	A	79.3	Confident	89.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.249	C	C	.	.	S	Bend	trans	51.8	44.6	-171.1	0	0	0	0	0	112.1	R215 T217 K237 Q257	R215-A260 PolarHBondContact NH2-O 3.46Å; T217-A260 WeakPolarHBondContact CB-O 3.35Å; T217-A260 PolarHBondContact OG1-O 3.49Å; K237-A260 HydrophobicContact CG-CB 3.86Å; Q257-A260 WeakPolarHBondContact O-CA 3.46Å; Q257-A260 PolarHBondContact O-N 3.48Å
261	W	84.6	Confident	90	Very high	145 Å²	145	43.8 Å²	43.8	55%	0.549	24%	0.241	S	C	.	.			trans	-112.6	158.4	169.4	-71.3	112.5	0	0	0	109.5	R215 Q257 S259	R215-W261 VanDerWaalsContact CZ-CE2 3.47Å; Q257-W261 WeakPolarHBondContact CG-O 3.28Å; S259-W261 VanDerWaalsContact C-N 3.27Å; S259-W261 VanDerWaalsContact CB-CD1 3.48Å; S259-W261 PolarHBondContact O-N 3.01Å
262	V	87.1	Confident	90.4	Very high	15 Å²	15	45.7 Å²	45.7	9%	0.091	25%	0.247	C	C	.	.			trans	-76.4	136.7	166	-179.3	0	0	0	0	108.8	E188 T217 I235 I266 F267 A303	E188-V262 HydrophobicContact CG-CB 4.24Å; E188-V262 HydrophobicContact CG-CG2 3.66Å; T217-V262 HydrophobicContact CG2-CG2 4.07Å; I235-V262 HydrophobicContact CD1-CG2 3.5Å; I235-V262 HydrophobicContact CG1-CG2 4.05Å; V262-I266 HydrophobicContact CG1-CG2 4.37Å; V262-F267 HydrophobicContact CG1-CB 3.95Å; V262-F267 HydrophobicContact CG1-CD2 4.06Å; V262-A303 HydrophobicContact CB-CB 4.38Å; V262-A303 HydrophobicContact CG1-CB 4.28Å; V262-A303 WeakPolarHBondContact O-CB 3.3Å
263	D	90.8	Very high	90.7	Very high	43 Å²	43	51.9 Å²	51.9	23%	0.23	28%	0.276	C	S	.	.			trans	-120.8	175.5	169.4	54.7	34	0	0	0	110	Q257 E265 I266 F267 A303	Q257-D263 WeakPolarHBondContact CG-OD2 3.34Å; D263-E265 VanDerWaalsContact C-N 3.27Å; D263-E265 PolarHBondContact O-N 3.35Å; D263-I266 PolarHBondContact O-N 3.49Å; D263-I266 VanDerWaalsContact OD1-CB 3.24Å; D263-I266 WeakPolarHBondContact OD1-CB 3.43Å; D263-I266 WeakPolarHBondContact OD1-CD1 3.5Å; D263-I266 WeakPolarHBondContact OD1-CG1 3.47Å; D263-I266 PolarHBondContact OD1-N 3.37Å; D263-F267 WeakPolarHBondContact O-CB 3.27Å; D263-F267 PolarHBondContact O-N 2.85Å; D263-A303 CarbonylContact C-O 3.57Å
264	K	93.1	Very high	90.9	Very high	95 Å²	95	52.6 Å²	52.6	41%	0.413	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-37.7	-173.4	-71.5	-176	174.2	-170	0	112	F267 S268 R302 A303 P305	K264-F267 PolarHBondContact O-N 2.75Å; K264-S268 VanDerWaalsContact O-CB 3.23Å; K264-S268 WeakPolarHBondContact O-CB 3.46Å; K264-S268 PolarHBondContact O-N 2.93Å; K264-R302 WeakPolarHBondContact CE-O 3.04Å; K264-A303 VanDerWaalsContact CA-O 3.24Å; K264-A303 WeakPolarHBondContact CA-O 3.34Å; K264-A303 WeakPolarHBondContact CG-O 3.38Å; K264-A303 PolarHBondContact N-O 3.44Å; K264-P305 HydrophobicContact CB-CG 4.14Å; K264-P305 HydrophobicContact CG-CG 4.46Å
265	E	93.2	Very high	91.2	Very high	136 Å²	136	50.5 Å²	50.5	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-67.5	-47.2	179.9	-62.9	73.9	-164.7	0	0	110.7	D263 F267 S268 D269	D263-E265 VanDerWaalsContact C-N 3.27Å; D263-E265 PolarHBondContact O-N 3.35Å; E265-F267 VanDerWaalsContact C-N 3.33Å; E265-F267 PolarHBondContact O-N 2.99Å; E265-S268 PolarHBondContact O-N 2.89Å; E265-D269 WeakPolarHBondContact O-CB 3.38Å; E265-D269 PolarHBondContact O-N 3.37Å
266	I	94.3	Very high	91.4	Very high	16 Å²	16	47.3 Å²	47.3	8%	0.082	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-42.1	175.4	-71.1	168.7	0	0	0	110.9	L233 I235 K255 Q257 V262 D263 W270	L233-I266 HydrophobicContact CD2-CG2 3.91Å; I235-I266 HydrophobicContact CG1-CG2 4.33Å; I235-I266 HydrophobicContact CG2-CD1 4.4Å; K255-I266 HydrophobicContact CB-CG2 4.44Å; K255-I266 HydrophobicContact CG-CG2 4.44Å; Q257-I266 HydrophobicContact CB-CD1 3.77Å; Q257-I266 HydrophobicContact CG-CD1 3.82Å; V262-I266 HydrophobicContact CG1-CG2 4.37Å; D263-I266 PolarHBondContact O-N 3.49Å; D263-I266 VanDerWaalsContact OD1-CB 3.24Å; D263-I266 WeakPolarHBondContact OD1-CB 3.43Å; D263-I266 WeakPolarHBondContact OD1-CD1 3.5Å; D263-I266 WeakPolarHBondContact OD1-CG1 3.47Å; D263-I266 PolarHBondContact OD1-N 3.37Å; I266-W270 WeakPolarHBondContact O-CB 3.43Å; I266-W270 PolarHBondContact O-N 2.86Å
267	F	96.1	Very high	91.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-68.6	-43	-179.5	-164.7	-80.5	0	0	0	111.9	L219 V262 D263 K264 E265 W270 F271 L298 H304 L310	L219-F267 HydrophobicContact CD1-CE2 4.31Å; L219-F267 HydrophobicContact CD2-CD2 4.06Å; L219-F267 HydrophobicContact CD2-CE2 3.94Å; V262-F267 HydrophobicContact CG1-CB 3.95Å; V262-F267 HydrophobicContact CG1-CD2 4.06Å; D263-F267 WeakPolarHBondContact O-CB 3.27Å; D263-F267 PolarHBondContact O-N 2.85Å; K264-F267 PolarHBondContact O-N 2.75Å; E265-F267 VanDerWaalsContact C-N 3.33Å; E265-F267 PolarHBondContact O-N 2.99Å; F267-W270 HydrophobicContact CD1-CE3 4.42Å; F267-W270 HydrophobicContact CD2-CE3 4.47Å; F267-W270 HydrophobicContact CE1-CE3 4.06Å; F267-W270 AromaticContact CE1-CZ3 3.94Å; F267-W270 HydrophobicContact CE1-CZ3 3.94Å; F267-W270 HydrophobicContact CE2-CE3 4.14Å; F267-W270 HydrophobicContact CE2-CZ3 4.04Å; F267-W270 AromaticContact CZ-CE3 3.9Å; F267-W270 HydrophobicContact CZ-CE3 3.9Å; F267-W270 AromaticContact CZ-CZ3 3.54Å; F267-W270 HydrophobicContact CZ-CZ3 3.54Å; F267-W270 PolarHBondContact O-N 2.82Å; F267-F271 WeakPolarHBondContact O-CB 3.43Å; F267-F271 PolarHBondContact O-N 2.98Å; F267-L298 HydrophobicContact CE1-CD1 3.63Å; F267-L298 HydrophobicContact CE2-CD1 4.44Å; F267-L298 HydrophobicContact CE2-CD2 4.36Å; F267-L298 HydrophobicContact CZ-CD1 3.38Å; F267-L298 HydrophobicContact CZ-CD2 3.71Å; F267-L298 HydrophobicContact CZ-CG 4.21Å; F267-H304 AromaticContact CD2-CD2 3.45Å; F267-H304 VanDerWaalsContact CD2-CD2 3.45Å; F267-H304 WeakPolarHBondContact CD2-CD2 3.13Å; F267-H304 AromaticContact CD2-NE2 3.8Å; F267-H304 AromaticContact CE2-CD2 3.41Å; F267-H304 VanDerWaalsContact CE2-CD2 3.41Å; F267-H304 WeakPolarHBondContact CE2-CD2 3.39Å; F267-H304 AromaticContact CE2-NE2 3.43Å; F267-H304 WeakPolarHBondContact CE2-NE2 3.18Å; F267-H304 AromaticContact CG-CD2 3.94Å; F267-H304 AromaticContact CZ-CD2 3.88Å; F267-L310 HydrophobicContact CD1-CD1 4.23Å; F267-L310 HydrophobicContact CD1-CD2 4.01Å; F267-L310 HydrophobicContact CE1-CD1 3.86Å; F267-L310 HydrophobicContact CE1-CD2 4.11Å
268	S	95.6	Very high	92.2	Very high	35 Å²	35	48.1 Å²	48.1	25%	0.245	26%	0.261	C	S	.	.	H	α-helix	trans	-61.8	-45	176.2	179.2	0	0	0	0	111.5	K264 E265 W270 F271 H272	K264-S268 VanDerWaalsContact O-CB 3.23Å; K264-S268 WeakPolarHBondContact O-CB 3.46Å; K264-S268 PolarHBondContact O-N 2.93Å; E265-S268 PolarHBondContact O-N 2.89Å; S268-W270 PolarHBondContact O-N 2.72Å; S268-F271 PolarHBondContact O-N 3.08Å; S268-H272 PolarHBondContact O-CD2 2.96Å; S268-H272 PolarHBondContact O-N 3.04Å
269	D	95.4	Very high	93.1	Very high	49 Å²	49	45 Å²	45	26%	0.262	23%	0.229	S	C	.	.	H	α-helix	trans	-58.9	-46.1	174.2	175.4	99	0	0	0	111.5	K255 E265 F271 H273	K255-D269 WeakPolarHBondContact CE-OD2 3.36Å; K255-D269 IonicContact NZ-OD1 3.62Å; K255-D269 PolarHBondContact NZ-OD1 3.14Å; K255-D269 IonicContact NZ-OD2 3.9Å; K255-D269 PolarHBondContact NZ-OD2 2.93Å; E265-D269 WeakPolarHBondContact O-CB 3.38Å; E265-D269 PolarHBondContact O-N 3.37Å; D269-F271 PolarHBondContact O-N 2.81Å; D269-H273 VanDerWaalsContact O-CB 3.26Å; D269-H273 WeakPolarHBondContact O-CB 3.41Å; D269-H273 PolarHBondContact O-CD2 2.88Å; D269-H273 PolarHBondContact O-N 3.46Å; D269-H273 IonicContact OD1-CD2 3.7Å
270	W	97	Very high	94	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.008	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-44	174.7	171.3	84	0	0	0	112.2	A186 L219 C221 L230 L233 I266 F267 S268 I274 F275 L296	A186-W270 HydrophobicContact CB-CH2 3.91Å; L219-W270 HydrophobicContact CD2-CD2 3.48Å; L219-W270 VanDerWaalsContact CD2-CD2 3.48Å; L219-W270 HydrophobicContact CD2-CE3 3.76Å; L219-W270 HydrophobicContact CD2-CG 3.85Å; L219-W270 HydrophobicContact CD2-CH2 4.33Å; L219-W270 HydrophobicContact CD2-CZ2 4.1Å; L219-W270 HydrophobicContact CD2-CZ3 4.17Å; L219-W270 HydrophobicContact CG-CZ2 4.37Å; C221-W270 HydrophobicContact CB-CH2 4.04Å; C221-W270 HydrophobicContact CB-CZ2 3.68Å; L230-W270 HydrophobicContact CD2-CZ2 4.14Å; L233-W270 HydrophobicContact CD2-CB 3.92Å; L233-W270 HydrophobicContact CD2-CG 4.05Å; I266-W270 WeakPolarHBondContact O-CB 3.43Å; I266-W270 PolarHBondContact O-N 2.86Å; F267-W270 HydrophobicContact CD1-CE3 4.42Å; F267-W270 HydrophobicContact CD2-CE3 4.47Å; F267-W270 HydrophobicContact CE1-CE3 4.06Å; F267-W270 AromaticContact CE1-CZ3 3.94Å; F267-W270 HydrophobicContact CE1-CZ3 3.94Å; F267-W270 HydrophobicContact CE2-CE3 4.14Å; F267-W270 HydrophobicContact CE2-CZ3 4.04Å; F267-W270 AromaticContact CZ-CE3 3.9Å; F267-W270 HydrophobicContact CZ-CE3 3.9Å; F267-W270 AromaticContact CZ-CZ3 3.54Å; F267-W270 HydrophobicContact CZ-CZ3 3.54Å; F267-W270 PolarHBondContact O-N 2.82Å; S268-W270 PolarHBondContact O-N 2.72Å; W270-I274 HydrophobicContact CG-CB 4.41Å; W270-I274 CarbonylContact O-C 3.55Å; W270-I274 WeakPolarHBondContact O-CA 3.45Å; W270-I274 VanDerWaalsContact O-CB 3.3Å; W270-I274 WeakPolarHBondContact O-CB 3.42Å; W270-I274 PolarHBondContact O-N 2.99Å; W270-F275 HydrophobicContact CD2-CB 4.47Å; W270-F275 HydrophobicContact CE3-CB 4.41Å; W270-F275 HydrophobicContact CH2-CB 4Å; W270-F275 AromaticContact CH2-CD2 4Å; W270-F275 HydrophobicContact CH2-CD2 4Å; W270-F275 HydrophobicContact CH2-CG 4.14Å; W270-F275 HydrophobicContact CZ2-CB 4.05Å; W270-F275 HydrophobicContact CZ2-CD2 4.27Å; W270-F275 HydrophobicContact CZ3-CB 4.18Å; W270-F275 HydrophobicContact CZ3-CG 4.47Å; W270-F275 PolarHBondContact O-N 3.39Å; W270-L296 HydrophobicContact CH2-CD2 4.17Å; W270-L296 HydrophobicContact CZ3-CD2 3.93Å
271	F	97.5	Very high	94.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-60.3	-52.2	-179.6	177.9	-95.6	0	0	0	111.4	F267 S268 D269 F275 V276 L296 L310 V315 T317	F267-F271 WeakPolarHBondContact O-CB 3.43Å; F267-F271 PolarHBondContact O-N 2.98Å; S268-F271 PolarHBondContact O-N 3.08Å; D269-F271 PolarHBondContact O-N 2.81Å; F271-F275 AromaticContact CD2-CD1 3.67Å; F271-F275 HydrophobicContact CD2-CD1 3.67Å; F271-F275 HydrophobicContact CD2-CE1 4.28Å; F271-F275 HydrophobicContact CD2-CG 4.46Å; F271-F275 AromaticContact CE2-CD1 3.65Å; F271-F275 HydrophobicContact CE2-CD1 3.65Å; F271-F275 AromaticContact CE2-CE1 3.86Å; F271-F275 HydrophobicContact CE2-CE1 3.86Å; F271-F275 WeakPolarHBondContact O-CB 3.43Å; F271-F275 PolarHBondContact O-N 3.34Å; F271-V276 HydrophobicContact CD1-CG2 4.27Å; F271-V276 HydrophobicContact CE1-CG2 3.87Å; F271-V276 HydrophobicContact CE2-CG2 4.48Å; F271-V276 HydrophobicContact CZ-CG2 3.98Å; F271-V276 WeakPolarHBondContact O-CG2 3.34Å; F271-V276 PolarHBondContact O-N 3.11Å; F271-L296 HydrophobicContact CD2-CD2 3.78Å; F271-L296 HydrophobicContact CE2-CD2 3.96Å; F271-L310 HydrophobicContact CB-CD2 3.88Å; F271-L310 HydrophobicContact CD1-CD2 4.05Å; F271-L310 HydrophobicContact CD2-CB 4.43Å; F271-L310 HydrophobicContact CD2-CD2 4.2Å; F271-L310 VanDerWaalsContact CE1-C 3.47Å; F271-L310 HydrophobicContact CE1-CB 4.4Å; F271-L310 HydrophobicContact CE2-CB 4.26Å; F271-L310 HydrophobicContact CG-CD2 3.78Å; F271-L310 HydrophobicContact CZ-CB 4.26Å; F271-L310 WeakPolarHBondContact CZ-O 3.44Å; F271-V315 HydrophobicContact CE2-CG1 4.32Å; F271-V315 HydrophobicContact CZ-CG1 4.11Å; F271-T317 WeakPolarHBondContact CE2-OG1 3.24Å
272	H	96.3	Very high	95.3	Very high	65 Å²	65	45.3 Å²	45.3	30%	0.301	22%	0.224	S	C	.	.	I	π-helix	trans	-78.1	-33	-174.9	-67.5	-65.7	0	0	0	114	S268 P277 E309	S268-H272 PolarHBondContact O-CD2 2.96Å; S268-H272 PolarHBondContact O-N 3.04Å; H272-P277 WeakPolarHBondContact O-CD 3.41Å; H272-E309 PolarHBondContact NE2-O 2.84Å
273	H	95.6	Very high	95.8	Very high	133 Å²	133	45 Å²	45	62%	0.616	22%	0.221	S	C	*	.	I	π-helix	trans	-105	-15.8	-172.1	-60.6	-59.4	0	0	0	114.4	D269	D269-H273 VanDerWaalsContact O-CB 3.26Å; D269-H273 WeakPolarHBondContact O-CB 3.41Å; D269-H273 PolarHBondContact O-CD2 2.88Å; D269-H273 PolarHBondContact O-N 3.46Å; D269-H273 IonicContact OD1-CD2 3.7Å
274	I	95.6	Very high	96	Very high	38 Å²	38	50.9 Å²	50.9	20%	0.195	24%	0.24	C	C	.	.	I	π-helix	trans	-119	-55.2	178.9	-59.9	172.1	0	0	0	110.2	A253 W270 S278	A253-I274 HydrophobicContact CB-CD1 3.7Å; W270-I274 HydrophobicContact CG-CB 4.41Å; W270-I274 CarbonylContact O-C 3.55Å; W270-I274 WeakPolarHBondContact O-CA 3.45Å; W270-I274 VanDerWaalsContact O-CB 3.3Å; W270-I274 WeakPolarHBondContact O-CB 3.42Å; W270-I274 PolarHBondContact O-N 2.99Å; I274-S278 WeakPolarHBondContact O-CB 3.41Å; I274-S278 PolarHBondContact O-N 3.49Å
275	F	97.8	Very high	96.2	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-66.9	-58.7	-173.9	174.9	-103.1	0	0	0	112.7	Y184 L230 W270 F271 S278 V279 L296 V315	Y184-F275 AromaticContact CD1-CE2 3.96Å; Y184-F275 HydrophobicContact CD1-CE2 3.96Å; Y184-F275 HydrophobicContact CD2-CE2 4.31Å; Y184-F275 HydrophobicContact CD2-CZ 4.3Å; Y184-F275 AromaticContact CG-CE2 3.77Å; Y184-F275 HydrophobicContact CG-CE2 3.77Å; Y184-F275 HydrophobicContact CG-CZ 4.13Å; L230-F275 HydrophobicContact CD1-CD2 4.4Å; L230-F275 HydrophobicContact CD2-CB 4.01Å; L230-F275 HydrophobicContact CD2-CD2 3.57Å; L230-F275 HydrophobicContact CD2-CG 4.25Å; W270-F275 HydrophobicContact CD2-CB 4.47Å; W270-F275 HydrophobicContact CE3-CB 4.41Å; W270-F275 HydrophobicContact CH2-CB 4Å; W270-F275 AromaticContact CH2-CD2 4Å; W270-F275 HydrophobicContact CH2-CD2 4Å; W270-F275 HydrophobicContact CH2-CG 4.14Å; W270-F275 HydrophobicContact CZ2-CB 4.05Å; W270-F275 HydrophobicContact CZ2-CD2 4.27Å; W270-F275 HydrophobicContact CZ3-CB 4.18Å; W270-F275 HydrophobicContact CZ3-CG 4.47Å; W270-F275 PolarHBondContact O-N 3.39Å; F271-F275 AromaticContact CD2-CD1 3.67Å; F271-F275 HydrophobicContact CD2-CD1 3.67Å; F271-F275 HydrophobicContact CD2-CE1 4.28Å; F271-F275 HydrophobicContact CD2-CG 4.46Å; F271-F275 AromaticContact CE2-CD1 3.65Å; F271-F275 HydrophobicContact CE2-CD1 3.65Å; F271-F275 AromaticContact CE2-CE1 3.86Å; F271-F275 HydrophobicContact CE2-CE1 3.86Å; F271-F275 WeakPolarHBondContact O-CB 3.43Å; F271-F275 PolarHBondContact O-N 3.34Å; F275-S278 PolarHBondContact O-N 2.84Å; F275-V279 HydrophobicContact CD2-CG2 3.91Å; F275-V279 HydrophobicContact CE1-CG2 4.33Å; F275-V279 HydrophobicContact CE2-CG2 3.54Å; F275-V279 HydrophobicContact CG-CG2 4.4Å; F275-V279 HydrophobicContact CZ-CG2 3.77Å; F275-V279 WeakPolarHBondContact O-CG2 3.13Å; F275-V279 PolarHBondContact O-N 3.38Å; F275-L296 HydrophobicContact CD1-CD2 4.12Å; F275-L296 HydrophobicContact CD2-CD1 4.44Å; F275-L296 HydrophobicContact CE1-CB 3.81Å; F275-L296 HydrophobicContact CE1-CD2 3.94Å; F275-L296 HydrophobicContact CE1-CG 4.3Å; F275-L296 HydrophobicContact CE2-CB 4.46Å; F275-L296 HydrophobicContact CE2-CD1 3.86Å; F275-L296 HydrophobicContact CE2-CD2 4.46Å; F275-L296 HydrophobicContact CE2-CG 4.47Å; F275-L296 HydrophobicContact CG-CD2 4.45Å; F275-L296 HydrophobicContact CZ-CB 3.66Å; F275-L296 HydrophobicContact CZ-CD1 3.93Å; F275-L296 HydrophobicContact CZ-CD2 4.16Å; F275-L296 HydrophobicContact CZ-CG 4.11Å; F275-V315 HydrophobicContact CD1-CG1 4.21Å; F275-V315 HydrophobicContact CE1-CG1 3.49Å; F275-V315 VanDerWaalsContact CE1-CG1 3.49Å; F275-V315 HydrophobicContact CZ-CG1 4.4Å
276	V	97.4	Very high	96.3	Very high	5 Å²	5	48 Å²	48	3%	0.03	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-48.8	-176.9	170	0	0	0	0	112.4	F271 S278 V279 R280 V315	F271-V276 HydrophobicContact CD1-CG2 4.27Å; F271-V276 HydrophobicContact CE1-CG2 3.87Å; F271-V276 HydrophobicContact CE2-CG2 4.48Å; F271-V276 HydrophobicContact CZ-CG2 3.98Å; F271-V276 WeakPolarHBondContact O-CG2 3.34Å; F271-V276 PolarHBondContact O-N 3.11Å; V276-S278 PolarHBondContact O-N 3.49Å; V276-V279 PolarHBondContact O-N 2.72Å; V276-R280 WeakPolarHBondContact O-CG 3.24Å; V276-R280 PolarHBondContact O-N 3.33Å; V276-R280 VanDerWaalsContact O-N 3.11Å; V276-V315 HydrophobicContact CG1-CG2 4.41Å; V276-V315 HydrophobicContact CG2-CB 4.28Å; V276-V315 HydrophobicContact CG2-CG1 4.09Å; V276-V315 HydrophobicContact CG2-CG2 4.4Å
277	P	96.5	Very high	96.3	Very high	62 Å²	62	50.2 Å²	50.2	40%	0.403	26%	0.263	S	S	.	.	H	α-helix	trans	-63.5	-41.7	178.4	-23.8	36.1	0	0	0	112.9	H272 V279 R280 E281	H272-P277 WeakPolarHBondContact O-CD 3.41Å; P277-V279 PolarHBondContact O-N 2.94Å; P277-R280 PolarHBondContact O-N 3.04Å; P277-E281 WeakPolarHBondContact O-CB 3.23Å; P277-E281 PolarHBondContact O-N 2.84Å
278	S	96.8	Very high	96.2	Very high	38 Å²	38	52.3 Å²	52.3	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-64.7	-40.6	-179.8	-164.2	0	0	0	0	111.8	H228 I274 F275 V276 H282	H228-S278 PolarHBondContact CE1-O 3.28Å; H228-S278 VanDerWaalsContact CE1-O 3.28Å; H228-S278 PolarHBondContact CE1-OG 2.79Å; H228-S278 PolarHBondContact NE2-OG 2.86Å; H228-S278 VanDerWaalsContact NE2-OG 3.07Å; I274-S278 WeakPolarHBondContact O-CB 3.41Å; I274-S278 PolarHBondContact O-N 3.49Å; F275-S278 PolarHBondContact O-N 2.84Å; V276-S278 PolarHBondContact O-N 3.49Å; S278-H282 WeakPolarHBondContact O-CB 3.39Å; S278-H282 PolarHBondContact O-N 2.85Å
279	V	97.1	Very high	96.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67	-43.5	178.3	172.1	0	0	0	0	111.3	Y184 F275 V276 P277 E281 H282 F283 A294	Y184-V279 HydrophobicContact CD1-CG2 4.44Å; Y184-V279 HydrophobicContact CD2-CG2 4.36Å; Y184-V279 HydrophobicContact CE1-CG2 4.01Å; Y184-V279 HydrophobicContact CE2-CG1 4.02Å; Y184-V279 HydrophobicContact CE2-CG2 3.96Å; F275-V279 HydrophobicContact CD2-CG2 3.91Å; F275-V279 HydrophobicContact CE1-CG2 4.33Å; F275-V279 HydrophobicContact CE2-CG2 3.54Å; F275-V279 HydrophobicContact CG-CG2 4.4Å; F275-V279 HydrophobicContact CZ-CG2 3.77Å; F275-V279 WeakPolarHBondContact O-CG2 3.13Å; F275-V279 PolarHBondContact O-N 3.38Å; V276-V279 PolarHBondContact O-N 2.72Å; P277-V279 PolarHBondContact O-N 2.94Å; V279-E281 VanDerWaalsContact C-N 3.33Å; V279-E281 PolarHBondContact O-N 2.75Å; V279-H282 PolarHBondContact O-N 2.76Å; V279-F283 HydrophobicContact CG1-CD1 4.25Å; V279-F283 HydrophobicContact CG1-CD2 4.4Å; V279-F283 HydrophobicContact CG1-CE1 3.85Å; V279-F283 HydrophobicContact CG1-CE2 4Å; V279-F283 HydrophobicContact CG1-CZ 3.7Å; V279-F283 WeakPolarHBondContact O-CD1 3.49Å; V279-F283 WeakPolarHBondContact O-CG 3.25Å; V279-F283 PolarHBondContact O-N 3.01Å; V279-A294 HydrophobicContact CG1-CB 3.66Å
280	R	96.1	Very high	95.8	Very high	107 Å²	107	60.8 Å²	60.8	40%	0.404	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-42.3	176.8	-74.8	-178.9	174.3	162.4	4.9	112.1	V276 P277 F283 R284	V276-R280 WeakPolarHBondContact O-CG 3.24Å; V276-R280 PolarHBondContact O-N 3.33Å; V276-R280 VanDerWaalsContact O-N 3.11Å; P277-R280 PolarHBondContact O-N 3.04Å; R280-F283 PolarHBondContact O-N 3.46Å; R280-R284 WeakPolarHBondContact O-CB 3.42Å; R280-R284 PolarHBondContact O-N 2.86Å
281	E	96.1	Very high	95.5	Very high	90 Å²	90	66.8 Å²	66.8	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-40	177.4	-179.3	57.8	-168.9	0	0	112.2	P277 V279 R284 T285	P277-E281 WeakPolarHBondContact O-CB 3.23Å; P277-E281 PolarHBondContact O-N 2.84Å; V279-E281 VanDerWaalsContact C-N 3.33Å; V279-E281 PolarHBondContact O-N 2.75Å; E281-R284 PolarHBondContact O-N 3.11Å; E281-R284 IonicContact OE1-CZ 3.55Å; E281-R284 IonicContact OE1-NE 3.65Å; E281-R284 IonicContact OE1-NH2 2.67Å; E281-R284 PolarHBondContact OE1-NH2 3.33Å; E281-R284 IonicContact OE2-CZ 3.45Å; E281-R284 IonicContact OE2-NE 2.82Å; E281-R284 PolarHBondContact OE2-NE 2.94Å; E281-R284 IonicContact OE2-NH2 3.25Å; E281-R284 PolarHBondContact OE2-NH2 3.49Å; E281-T285 WeakPolarHBondContact O-CB 3.33Å; E281-T285 PolarHBondContact O-N 2.9Å; E281-T285 PolarHBondContact O-OG1 3.11Å
282	H	96.4	Very high	95.4	Very high	23 Å²	23	67.4 Å²	67.4	11%	0.106	35%	0.352	C	S	.	.	H	α-helix	trans	-61	-47.2	173.1	-179.8	62.2	0	0	0	111.6	E181 Y184 H228 S278 V279 R284 T285 I286	E181-H282 IonicContact OE2-CD2 3.97Å; E181-H282 IonicContact OE2-CE1 3.49Å; E181-H282 IonicContact OE2-NE2 3.33Å; E181-H282 PolarHBondContact OE2-NE2 2.86Å; Y184-H282 PolarHBondContact OH-CD2 2.77Å; H228-H282 HydrophobicContact CB-CB 4.42Å; H228-H282 AromaticContact CG-CD2 3.83Å; H228-H282 AromaticContact CG-CG 3.49Å; H228-H282 VanDerWaalsContact CG-CG 3.49Å; H228-H282 AromaticContact CG-ND1 3.79Å; H228-H282 WeakPolarHBondContact ND1-CB 3.45Å; H228-H282 AromaticContact ND1-CD2 3.81Å; H228-H282 AromaticContact ND1-CG 3.59Å; S278-H282 WeakPolarHBondContact O-CB 3.39Å; S278-H282 PolarHBondContact O-N 2.85Å; V279-H282 PolarHBondContact O-N 2.76Å; H282-R284 VanDerWaalsContact C-N 3.33Å; H282-R284 PolarHBondContact O-N 2.96Å; H282-T285 WeakPolarHBondContact O-CB 3.46Å; H282-T285 PolarHBondContact O-N 3.27Å; H282-I286 VanDerWaalsContact CE1-CG2 3.49Å; H282-I286 WeakPolarHBondContact CE1-CG2 3.39Å; H282-I286 WeakPolarHBondContact O-CG1 3.44Å; H282-I286 PolarHBondContact O-N 3.01Å
283	F	96.4	Very high	95.4	Very high	7 Å²	7	67.7 Å²	67.7	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-58.2	-44.9	177.8	-75.5	7.2	0	0	0	111.9	Q182 Y184 V279 R280 T285 I286 G287 L288 A294	Q182-F283 HydrophobicContact CB-CZ 4.04Å; Q182-F283 HydrophobicContact CG-CE1 4.12Å; Q182-F283 HydrophobicContact CG-CE2 4.28Å; Q182-F283 HydrophobicContact CG-CZ 3.67Å; Y184-F283 HydrophobicContact CE2-CE1 4.38Å; V279-F283 HydrophobicContact CG1-CD1 4.25Å; V279-F283 HydrophobicContact CG1-CD2 4.4Å; V279-F283 HydrophobicContact CG1-CE1 3.85Å; V279-F283 HydrophobicContact CG1-CE2 4Å; V279-F283 HydrophobicContact CG1-CZ 3.7Å; V279-F283 WeakPolarHBondContact O-CD1 3.49Å; V279-F283 WeakPolarHBondContact O-CG 3.25Å; V279-F283 PolarHBondContact O-N 3.01Å; R280-F283 PolarHBondContact O-N 3.46Å; F283-T285 VanDerWaalsContact C-N 3.3Å; F283-T285 PolarHBondContact O-N 3.13Å; F283-I286 PolarHBondContact O-N 3.26Å; F283-G287 PolarHBondContact O-N 3.18Å; F283-G287 VanDerWaalsContact O-N 3.1Å; F283-L288 HydrophobicContact CB-CB 3.95Å; F283-L288 HydrophobicContact CB-CD1 4.38Å; F283-L288 HydrophobicContact CD1-CD1 3.68Å; F283-L288 HydrophobicContact CD2-CD1 4.29Å; F283-L288 HydrophobicContact CE1-CD1 3.96Å; F283-L288 HydrophobicContact CG-CB 4.24Å; F283-L288 HydrophobicContact CG-CD1 3.87Å; F283-L288 HydrophobicContact CZ-CD1 4.4Å; F283-L288 PolarHBondContact O-N 2.79Å; F283-A294 HydrophobicContact CE2-CB 3.83Å; F283-A294 HydrophobicContact CZ-CB 3.69Å
284	R	96.2	Very high	95.5	Very high	167 Å²	167	61.3 Å²	61.3	63%	0.63	32%	0.323	S	S	*	.	H	α-helix	trans	-58.6	-42.2	174	-169	-177.3	73.6	87.7	0.9	111.8	R280 E281 H282 G287	R280-R284 WeakPolarHBondContact O-CB 3.42Å; R280-R284 PolarHBondContact O-N 2.86Å; E281-R284 PolarHBondContact O-N 3.11Å; E281-R284 IonicContact OE1-CZ 3.55Å; E281-R284 IonicContact OE1-NE 3.65Å; E281-R284 IonicContact OE1-NH2 2.67Å; E281-R284 PolarHBondContact OE1-NH2 3.33Å; E281-R284 IonicContact OE2-CZ 3.45Å; E281-R284 IonicContact OE2-NE 2.82Å; E281-R284 PolarHBondContact OE2-NE 2.94Å; E281-R284 IonicContact OE2-NH2 3.25Å; E281-R284 PolarHBondContact OE2-NH2 3.49Å; H282-R284 VanDerWaalsContact C-N 3.33Å; H282-R284 PolarHBondContact O-N 2.96Å; R284-G287 PolarHBondContact O-N 2.91Å
285	T	96.4	Very high	95.6	Very high	97 Å²	97	59.9 Å²	59.9	60%	0.595	32%	0.315	S	S	*	.	H	α-helix	trans	-65.9	-38.6	-179	-58	0	0	0	0	112.4	E281 H282 F283 G287	E281-T285 WeakPolarHBondContact O-CB 3.33Å; E281-T285 PolarHBondContact O-N 2.9Å; E281-T285 PolarHBondContact O-OG1 3.11Å; H282-T285 WeakPolarHBondContact O-CB 3.46Å; H282-T285 PolarHBondContact O-N 3.27Å; F283-T285 VanDerWaalsContact C-N 3.3Å; F283-T285 PolarHBondContact O-N 3.13Å; T285-G287 VanDerWaalsContact C-N 3.32Å
286	I	95.4	Very high	95.6	Very high	74 Å²	74	59.9 Å²	59.9	38%	0.379	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	5.1	179.1	69.8	173	0	0	0	113.4	E181 H282 F283 L288	E181-I286 HydrophobicContact CB-CD1 3.91Å; E181-I286 HydrophobicContact CG-CD1 3.99Å; H282-I286 VanDerWaalsContact CE1-CG2 3.49Å; H282-I286 WeakPolarHBondContact CE1-CG2 3.39Å; H282-I286 WeakPolarHBondContact O-CG1 3.44Å; H282-I286 PolarHBondContact O-N 3.01Å; F283-I286 PolarHBondContact O-N 3.26Å; I286-L288 HydrophobicContact CD1-CD1 3.69Å; I286-L288 HydrophobicContact CD1-CG 3.91Å; I286-L288 HydrophobicContact CG1-CB 4.44Å; I286-L288 HydrophobicContact CG1-CD1 4.19Å; I286-L288 HydrophobicContact CG1-CG 3.95Å
287	G	95.3	Very high	95.6	Very high	62 Å²	62	59.6 Å²	59.6	64%	0.639	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	23.8	176.4	0	0	0	0	0	115	F283 R284 T285	F283-G287 PolarHBondContact O-N 3.18Å; F283-G287 VanDerWaalsContact O-N 3.1Å; R284-G287 PolarHBondContact O-N 2.91Å; T285-G287 VanDerWaalsContact C-N 3.32Å
288	L	94.5	Very high	95.6	Very high	44 Å²	44	56.7 Å²	56.7	23%	0.23	30%	0.295	C	S	.	.			trans	-74.9	142.1	171	-79	-179.2	0	0	0	110.8	Q182 F283 I286	Q182-L288 HydrophobicContact CG-CD1 3.93Å; F283-L288 HydrophobicContact CB-CB 3.95Å; F283-L288 HydrophobicContact CB-CD1 4.38Å; F283-L288 HydrophobicContact CD1-CD1 3.68Å; F283-L288 HydrophobicContact CD2-CD1 4.29Å; F283-L288 HydrophobicContact CE1-CD1 3.96Å; F283-L288 HydrophobicContact CG-CB 4.24Å; F283-L288 HydrophobicContact CG-CD1 3.87Å; F283-L288 HydrophobicContact CZ-CD1 4.4Å; F283-L288 PolarHBondContact O-N 2.79Å; I286-L288 HydrophobicContact CD1-CD1 3.69Å; I286-L288 HydrophobicContact CD1-CG 3.91Å; I286-L288 HydrophobicContact CG1-CB 4.44Å; I286-L288 HydrophobicContact CG1-CD1 4.19Å; I286-L288 HydrophobicContact CG1-CG 3.95Å
289	P	93.1	Very high	95.3	Very high	75 Å²	75	56.7 Å²	56.7	49%	0.487	29%	0.292	S	S	.	.			trans	-52.9	147	173.5	-28.5	35	0	0	0	113.4	D291 S292	P289-D291 WeakPolarHBondContact CB-OD1 3.3Å; P289-D291 PolarHBondContact O-N 3.16Å; P289-S292 VanDerWaalsContact CD-OG 3.27Å; P289-S292 WeakPolarHBondContact CD-OG 3.4Å; P289-S292 WeakPolarHBondContact O-CB 3.35Å; P289-S292 PolarHBondContact O-N 3.37Å; P289-S292 PolarHBondContact O-OG 3.21Å
290	E	88.2	Confident	94.9	Very high	188 Å²	188	59.6 Å²	59.6	88%	0.879	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.4	-178.4	-69	-170.1	167.7	0	0	113.6	S292 N314	E290-S292 VanDerWaalsContact C-N 3.29Å; E290-N314 PolarHBondContact O-ND2 3.45Å
291	D	91.6	Very high	94.4	Very high	128 Å²	128	56.4 Å²	56.4	68%	0.684	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	1.5	176.3	67.2	-30.5	0	0	0	113.3	P289 K293	P289-D291 WeakPolarHBondContact CB-OD1 3.3Å; P289-D291 PolarHBondContact O-N 3.16Å; D291-K293 PolarHBondContact O-N 3.35Å
292	S	95.1	Very high	94	Very high	13 Å²	13	63.3 Å²	63.3	9%	0.091	33%	0.329	C	S	.	.			trans	-56.7	127.7	178.2	-66.2	0	0	0	0	111.2	P289 E290 N314	P289-S292 VanDerWaalsContact CD-OG 3.27Å; P289-S292 WeakPolarHBondContact CD-OG 3.4Å; P289-S292 WeakPolarHBondContact O-CB 3.35Å; P289-S292 PolarHBondContact O-N 3.37Å; P289-S292 PolarHBondContact O-OG 3.21Å; E290-S292 VanDerWaalsContact C-N 3.29Å; S292-N314 PolarHBondContact O-ND2 3.4Å
293	K	96.4	Very high	93.5	Very high	70 Å²	70	63 Å²	63	30%	0.304	33%	0.33	S	S	.	.			trans	-69.1	145.9	-180	-61.1	-179.6	-178.4	175.5	0	111.2	H176 L178 Q182 D291 N314 F316	H176-K293 HydrophobicContact CB-CD 4.32Å; H176-K293 PolarHBondContact CE1-NZ 3.43Å; H176-K293 PolarHBondContact ND1-NZ 3.12Å; L178-K293 HydrophobicContact CD2-CB 4.01Å; Q182-K293 WeakPolarHBondContact CB-O 3.5Å; Q182-K293 WeakPolarHBondContact CG-O 3.27Å; Q182-K293 PolarHBondContact NE2-O 3.23Å; D291-K293 PolarHBondContact O-N 3.35Å; K293-N314 CarbonylContact C-O 3.46Å; K293-N314 VanDerWaalsContact CA-O 3.24Å; K293-N314 WeakPolarHBondContact CA-O 3.29Å; K293-F316 HydrophobicContact CB-CE2 4.41Å; K293-F316 HydrophobicContact CD-CE2 4.24Å; K293-F316 HydrophobicContact CG-CE2 4.11Å
294	A	97.3	Very high	93.1	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.9	165.6	0	0	0	0	0	109.9	Q182 V279 F283 N314 V315 F316	Q182-A294 CarbonylContact O-C 3.56Å; Q182-A294 WeakPolarHBondContact O-CA 3.25Å; V279-A294 HydrophobicContact CG1-CB 3.66Å; F283-A294 HydrophobicContact CE2-CB 3.83Å; F283-A294 HydrophobicContact CZ-CB 3.69Å; A294-N314 PolarHBondContact N-O 3.45Å; A294-V315 HydrophobicContact CB-CB 4.5Å; A294-V315 HydrophobicContact CB-CG1 4.22Å; A294-V315 HydrophobicContact CB-CG2 4.15Å; A294-V315 WeakPolarHBondContact O-CA 3.4Å; A294-F316 PolarHBondContact O-N 3.34Å
295	V	97.9	Very high	92.9	Very high	7 Å²	7	55.3 Å²	55.3	4%	0.042	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.6	178.3	175.2	0	0	0	0	109.5	L178 Q182 Y184 F316 I318	L178-V295 HydrophobicContact CD1-CB 4.43Å; L178-V295 HydrophobicContact CD1-CG2 3.59Å; Q182-V295 PolarHBondContact O-N 2.9Å; Y184-V295 PolarHBondContact N-O 2.98Å; V295-F316 CarbonylContact C-O 3.57Å; V295-F316 WeakPolarHBondContact CA-O 3.3Å; V295-I318 HydrophobicContact CG1-CB 4.48Å; V295-I318 HydrophobicContact CG1-CD1 3.61Å; V295-I318 HydrophobicContact CG1-CG1 3.94Å
296	L	98.3	Very high	92.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	116.2	170.5	-179.2	59.6	0	0	0	109.8	A186 W270 F271 F275 L298 F316 T317 I318	A186-L296 HydrophobicContact CB-CD1 4.03Å; W270-L296 HydrophobicContact CH2-CD2 4.17Å; W270-L296 HydrophobicContact CZ3-CD2 3.93Å; F271-L296 HydrophobicContact CD2-CD2 3.78Å; F271-L296 HydrophobicContact CE2-CD2 3.96Å; F275-L296 HydrophobicContact CD1-CD2 4.12Å; F275-L296 HydrophobicContact CD2-CD1 4.44Å; F275-L296 HydrophobicContact CE1-CB 3.81Å; F275-L296 HydrophobicContact CE1-CD2 3.94Å; F275-L296 HydrophobicContact CE1-CG 4.3Å; F275-L296 HydrophobicContact CE2-CB 4.46Å; F275-L296 HydrophobicContact CE2-CD1 3.86Å; F275-L296 HydrophobicContact CE2-CD2 4.46Å; F275-L296 HydrophobicContact CE2-CG 4.47Å; F275-L296 HydrophobicContact CG-CD2 4.45Å; F275-L296 HydrophobicContact CZ-CB 3.66Å; F275-L296 HydrophobicContact CZ-CD1 3.93Å; F275-L296 HydrophobicContact CZ-CD2 4.16Å; F275-L296 HydrophobicContact CZ-CG 4.11Å; L296-L298 HydrophobicContact CD1-CD2 4.13Å; L296-L298 HydrophobicContact CD2-CD1 4.15Å; L296-L298 HydrophobicContact CD2-CD2 4.12Å; L296-L298 HydrophobicContact CD2-CG 4.22Å; L296-L298 HydrophobicContact CG-CD1 4.41Å; L296-L298 HydrophobicContact CG-CD2 3.95Å; L296-L298 HydrophobicContact CG-CG 3.98Å; L296-F316 PolarHBondContact N-O 3.07Å; L296-T317 CarbonylContact O-C 3.53Å; L296-T317 VanDerWaalsContact O-CA 3.29Å; L296-T317 WeakPolarHBondContact O-CA 3.46Å; L296-I318 PolarHBondContact O-N 3.14Å
297	L	96.9	Very high	92.2	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.8	175.5	-170.6	73.3	0	0	0	110.3	F165 Y184 N185 A186 I318 L320 W382 L385	F165-L297 HydrophobicContact CE1-CD1 4.19Å; F165-L297 HydrophobicContact CZ-CD1 3.88Å; Y184-L297 WeakPolarHBondContact O-CB 3.42Å; Y184-L297 PolarHBondContact O-N 3.25Å; N185-L297 WeakPolarHBondContact CA-O 3.42Å; N185-L297 HydrophobicContact CB-CB 4.37Å; N185-L297 PolarHBondContact ND2-O 3.03Å; A186-L297 PolarHBondContact N-O 3.02Å; L297-I318 WeakPolarHBondContact CA-O 3.43Å; L297-I318 HydrophobicContact CD1-CB 4.27Å; L297-I318 HydrophobicContact CD1-CG2 4.18Å; L297-L320 HydrophobicContact CD1-CD1 4.37Å; L297-L320 HydrophobicContact CD1-CD2 4.3Å; L297-L320 HydrophobicContact CD1-CG 3.86Å; L297-L320 HydrophobicContact CD2-CD1 3.91Å; L297-L320 HydrophobicContact CD2-CD2 4.13Å; L297-L320 HydrophobicContact CD2-CG 4.07Å; L297-L320 HydrophobicContact CG-CD1 3.79Å; L297-L320 HydrophobicContact CG-CD2 4.38Å; L297-L320 HydrophobicContact CG-CG 3.84Å; L297-W382 HydrophobicContact CD2-CH2 4.26Å; L297-W382 HydrophobicContact CD2-CZ3 4.21Å; L297-L385 HydrophobicContact CD2-CD2 3.31Å
298	L	95.8	Very high	92	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	157.1	-178.6	-62.3	177.7	0	0	0	112.1	A186 F267 L296 L310 T317 I318 F319 L320	A186-L298 HydrophobicContact CB-CD2 3.75Å; F267-L298 HydrophobicContact CE1-CD1 3.63Å; F267-L298 HydrophobicContact CE2-CD1 4.44Å; F267-L298 HydrophobicContact CE2-CD2 4.36Å; F267-L298 HydrophobicContact CZ-CD1 3.38Å; F267-L298 HydrophobicContact CZ-CD2 3.71Å; F267-L298 HydrophobicContact CZ-CG 4.21Å; L296-L298 HydrophobicContact CD1-CD2 4.13Å; L296-L298 HydrophobicContact CD2-CD1 4.15Å; L296-L298 HydrophobicContact CD2-CD2 4.12Å; L296-L298 HydrophobicContact CD2-CG 4.22Å; L296-L298 HydrophobicContact CG-CD1 4.41Å; L296-L298 HydrophobicContact CG-CD2 3.95Å; L296-L298 HydrophobicContact CG-CG 3.98Å; L298-L310 HydrophobicContact CD1-CD1 3.94Å; L298-T317 HydrophobicContact CD1-CG2 3.6Å; L298-T317 HydrophobicContact CG-CG2 4.07Å; L298-I318 PolarHBondContact N-O 3.27Å; L298-F319 HydrophobicContact CB-CD1 3.69Å; L298-F319 HydrophobicContact CB-CE1 3.58Å; L298-F319 HydrophobicContact CD1-CE1 3.87Å; L298-F319 HydrophobicContact CD1-CZ 4.24Å; L298-F319 HydrophobicContact CG-CE1 4.37Å; L298-F319 CarbonylContact O-C 3.58Å; L298-F319 WeakPolarHBondContact O-CA 3.43Å; L298-L320 WeakPolarHBondContact O-CB 3.43Å; L298-L320 PolarHBondContact O-N 3.12Å
299	D	92	Very high	91.8	Very high	38 Å²	38	61.7 Å²	61.7	20%	0.203	32%	0.321	C	S	.	.			trans	-76.1	164.5	167.4	86.8	-20.6	0	0	0	111.4	S301 H304 F319 A325	D299-S301 PolarHBondContact O-N 2.51Å; D299-S301 WeakPolarHBondContact OD1-CB 3.29Å; D299-S301 PolarHBondContact OD1-N 2.91Å; D299-S301 VanDerWaalsContact OD1-N 3.11Å; D299-H304 PolarHBondContact O-ND1 3.18Å; D299-H304 IonicContact OD1-CE1 3.76Å; D299-H304 PolarHBondContact OD1-CE1 2.88Å; D299-H304 IonicContact OD1-ND1 2.71Å; D299-H304 PolarHBondContact OD1-ND1 3.42Å; D299-F319 WeakPolarHBondContact O-CD1 3.4Å; D299-F319 WeakPolarHBondContact O-CE1 3.34Å; D299-A325 HydrophobicContact CB-CB 4.07Å
300	S	87.6	Confident	91.8	Very high	61 Å²	61	58.1 Å²	58.1	43%	0.427	30%	0.298	S	S	.	.			trans	-76.8	34.3	178.5	-65.5	0	0	0	0	113.5	L320	S300-L320 PolarHBondContact OG-O 3.16Å
301	S	86.7	Confident	92.1	Very high	41 Å²	41	52 Å²	52	29%	0.287	27%	0.273	S	S	.	.			trans	-62.5	143.8	178.2	175.3	0	0	0	0	112.2	D299 A303 H304	D299-S301 PolarHBondContact O-N 2.51Å; D299-S301 WeakPolarHBondContact OD1-CB 3.29Å; D299-S301 PolarHBondContact OD1-N 2.91Å; D299-S301 VanDerWaalsContact OD1-N 3.11Å; S301-A303 PolarHBondContact O-N 3.23Å; S301-A303 PolarHBondContact OG-N 3.45Å; S301-H304 PolarHBondContact O-N 3.05Å; S301-H304 VanDerWaalsContact O-N 3.13Å
302	R	86.2	Confident	92.1	Very high	235 Å²	235	47.3 Å²	47.3	89%	0.887	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.8	176.4	-66.1	-177	180	178.8	-0.8	113.4	K264	K264-R302 WeakPolarHBondContact CE-O 3.04Å
303	A	86.1	Confident	92	Very high	16 Å²	16	51.3 Å²	51.3	13%	0.132	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-19	175.2	0	0	0	0	0	111.9	V262 D263 K264 S301	V262-A303 HydrophobicContact CB-CB 4.38Å; V262-A303 HydrophobicContact CG1-CB 4.28Å; V262-A303 WeakPolarHBondContact O-CB 3.3Å; D263-A303 CarbonylContact C-O 3.57Å; K264-A303 VanDerWaalsContact CA-O 3.24Å; K264-A303 WeakPolarHBondContact CA-O 3.34Å; K264-A303 WeakPolarHBondContact CG-O 3.38Å; K264-A303 PolarHBondContact N-O 3.44Å; S301-A303 PolarHBondContact O-N 3.23Å; S301-A303 PolarHBondContact OG-N 3.45Å
304	H	89.4	Confident	91.9	Very high	9 Å²	9	48.7 Å²	48.7	4%	0.042	27%	0.267	C	S	.	.	S	Bend	trans	-84.4	132.1	-179.4	-56.1	157	0	0	0	110.7	E188 F267 D299 S301 F319	E188-H304 IonicContact OE1-NE2 3.76Å; E188-H304 PolarHBondContact OE1-NE2 3.22Å; E188-H304 IonicContact OE2-CE1 2.77Å; E188-H304 IonicContact OE2-NE2 3.7Å; E188-H304 PolarHBondContact OE2-NE2 3.31Å; F267-H304 AromaticContact CD2-CD2 3.45Å; F267-H304 VanDerWaalsContact CD2-CD2 3.45Å; F267-H304 WeakPolarHBondContact CD2-CD2 3.13Å; F267-H304 AromaticContact CD2-NE2 3.8Å; F267-H304 AromaticContact CE2-CD2 3.41Å; F267-H304 VanDerWaalsContact CE2-CD2 3.41Å; F267-H304 WeakPolarHBondContact CE2-CD2 3.39Å; F267-H304 AromaticContact CE2-NE2 3.43Å; F267-H304 WeakPolarHBondContact CE2-NE2 3.18Å; F267-H304 AromaticContact CG-CD2 3.94Å; F267-H304 AromaticContact CZ-CD2 3.88Å; D299-H304 PolarHBondContact O-ND1 3.18Å; D299-H304 IonicContact OD1-CE1 3.76Å; D299-H304 PolarHBondContact OD1-CE1 2.88Å; D299-H304 IonicContact OD1-ND1 2.71Å; D299-H304 PolarHBondContact OD1-ND1 3.42Å; S301-H304 PolarHBondContact O-N 3.05Å; S301-H304 VanDerWaalsContact O-N 3.13Å; H304-F319 HydrophobicContact CB-CE1 3.58Å; H304-F319 HydrophobicContact CB-CZ 3.69Å; H304-F319 AromaticContact CG-CE1 3.95Å; H304-F319 AromaticContact ND1-CE1 3.68Å
305	P	91.7	Very high	91.8	Very high	4 Å²	4	48.7 Å²	48.7	3%	0.026	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-59.7	169.3	165.3	-22.3	32.5	0	0	0	112.2	K264 E309 L310 F319	K264-P305 HydrophobicContact CB-CG 4.14Å; K264-P305 HydrophobicContact CG-CG 4.46Å; P305-E309 HydrophobicContact CB-CB 4Å; P305-L310 HydrophobicContact CB-CD1 4.42Å; P305-L310 HydrophobicContact CB-CD2 4.18Å; P305-L310 HydrophobicContact CB-CG 4.07Å; P305-L310 HydrophobicContact CG-CD2 4.01Å; P305-L310 HydrophobicContact CG-CG 4.38Å; P305-F319 VanDerWaalsContact O-CZ 3.3Å; P305-F319 WeakPolarHBondContact O-CZ 3.01Å
306	Q	89.6	Confident	91.7	Very high	134 Å²	134	52 Å²	52	63%	0.626	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-68.6	156.3	177.4	-62.5	-173.6	-19.2	0	0	111.3	A308 E309 L310	Q306-A308 PolarHBondContact O-N 3.38Å; Q306-A308 VanDerWaalsContact O-N 3.16Å; Q306-E309 WeakPolarHBondContact CB-OE1 3.36Å; Q306-E309 PolarHBondContact N-OE1 2.88Å; Q306-E309 VanDerWaalsContact N-OE1 3.11Å; Q306-E309 WeakPolarHBondContact O-CB 3.42Å; Q306-E309 PolarHBondContact O-N 3.04Å; Q306-L310 PolarHBondContact O-N 2.92Å
307	E	87.8	Confident	91.6	Very high	86 Å²	86	52.3 Å²	52.3	40%	0.402	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-54.5	-39.5	-179.4	-64.4	-176.4	163.6	0	0	111.9	E309 L310 V311 F319	E307-E309 PolarHBondContact O-N 3.34Å; E307-L310 CarbonylContact O-C 3.59Å; E307-L310 PolarHBondContact O-N 3.22Å; E307-V311 WeakPolarHBondContact O-CG2 3.47Å; E307-F319 HydrophobicContact CB-CE2 4.34Å; E307-F319 HydrophobicContact CG-CD2 3.17Å; E307-F319 HydrophobicContact CG-CE2 3.32Å; E307-F319 HydrophobicContact CG-CG 4.37Å; E307-F319 VanDerWaalsContact OE1-CD2 3.28Å; E307-F319 WeakPolarHBondContact OE1-CD2 3.47Å; E307-F319 PolarHBondContact OE1-N 2.98Å
308	A	89.3	Confident	91.5	Very high	91 Å²	91	53.3 Å²	53.3	75%	0.752	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-61.4	-24.1	178.6	0	0	0	0	0	113.9	Q306	Q306-A308 PolarHBondContact O-N 3.38Å; Q306-A308 VanDerWaalsContact O-N 3.16Å
309	E	90.7	Very high	91.4	Very high	100 Å²	100	55 Å²	55	47%	0.467	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-88	-24.8	176.1	-58.9	173.5	-103.1	0	0	111.6	H272 P305 Q306 E307 V311	H272-E309 PolarHBondContact NE2-O 2.84Å; P305-E309 HydrophobicContact CB-CB 4Å; Q306-E309 WeakPolarHBondContact CB-OE1 3.36Å; Q306-E309 PolarHBondContact N-OE1 2.88Å; Q306-E309 VanDerWaalsContact N-OE1 3.11Å; Q306-E309 WeakPolarHBondContact O-CB 3.42Å; Q306-E309 PolarHBondContact O-N 3.04Å; E307-E309 PolarHBondContact O-N 3.34Å; E309-V311 PolarHBondContact O-N 3.2Å
310	L	93.4	Very high	91.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-99.4	50.6	-178.6	-60.2	176.1	0	0	0	111.8	F267 F271 L298 P305 Q306 E307 T317 F319	F267-L310 HydrophobicContact CD1-CD1 4.23Å; F267-L310 HydrophobicContact CD1-CD2 4.01Å; F267-L310 HydrophobicContact CE1-CD1 3.86Å; F267-L310 HydrophobicContact CE1-CD2 4.11Å; F271-L310 HydrophobicContact CB-CD2 3.88Å; F271-L310 HydrophobicContact CD1-CD2 4.05Å; F271-L310 HydrophobicContact CD2-CB 4.43Å; F271-L310 HydrophobicContact CD2-CD2 4.2Å; F271-L310 VanDerWaalsContact CE1-C 3.47Å; F271-L310 HydrophobicContact CE1-CB 4.4Å; F271-L310 HydrophobicContact CE2-CB 4.26Å; F271-L310 HydrophobicContact CG-CD2 3.78Å; F271-L310 HydrophobicContact CZ-CB 4.26Å; F271-L310 WeakPolarHBondContact CZ-O 3.44Å; L298-L310 HydrophobicContact CD1-CD1 3.94Å; P305-L310 HydrophobicContact CB-CD1 4.42Å; P305-L310 HydrophobicContact CB-CD2 4.18Å; P305-L310 HydrophobicContact CB-CG 4.07Å; P305-L310 HydrophobicContact CG-CD2 4.01Å; P305-L310 HydrophobicContact CG-CG 4.38Å; Q306-L310 PolarHBondContact O-N 2.92Å; E307-L310 CarbonylContact O-C 3.59Å; E307-L310 PolarHBondContact O-N 3.22Å; L310-T317 HydrophobicContact CB-CG2 4.17Å; L310-T317 VanDerWaalsContact CB-OG1 3.27Å; L310-T317 WeakPolarHBondContact CB-OG1 3.35Å; L310-T317 HydrophobicContact CD1-CG2 3.98Å; L310-T317 WeakPolarHBondContact O-CB 3.24Å; L310-T317 PolarHBondContact O-OG1 2.82Å; L310-F319 HydrophobicContact CD1-CZ 4.07Å
311	V	93.9	Very high	91.5	Very high	60 Å²	60	52.7 Å²	52.7	36%	0.364	28%	0.281	S	S	.	.			trans	-127.8	139.3	176.1	171.1	0	0	0	0	109.8	E307 E309 V315 F316	E307-V311 WeakPolarHBondContact O-CG2 3.47Å; E309-V311 PolarHBondContact O-N 3.2Å; V311-V315 WeakPolarHBondContact CA-O 3.35Å; V311-F316 HydrophobicContact CG1-CD1 4.21Å; V311-F316 HydrophobicContact CG1-CE1 4.31Å; V311-F316 HydrophobicContact CG2-CD1 4.34Å
312	S	93.2	Very high	91.3	Very high	29 Å²	29	54.5 Å²	54.5	20%	0.203	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-143.2	97	171.3	-169.1	0	0	0	0	110.8	N314 V315	S312-N314 PolarHBondContact O-N 3Å; S312-V315 PolarHBondContact N-O 3.47Å; S312-V315 WeakPolarHBondContact O-CB 3.27Å; S312-V315 PolarHBondContact O-N 3.3Å
313	S	92.6	Very high	91	Very high	96 Å²	96	45.4 Å²	45.4	67%	0.671	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	-104	-178.7	-176	0	0	0	0	112	F316	S313-F316 VanDerWaalsContact O-CZ 3.28Å; S313-F316 WeakPolarHBondContact O-CZ 3.44Å
314	N	93.2	Very high	91	Very high	15 Å²	15	44.7 Å²	44.7	8%	0.08	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	0.6	178.2	54.9	-31.1	0	0	0	114.7	E290 S292 K293 A294 S312 F316	E290-N314 PolarHBondContact O-ND2 3.45Å; S292-N314 PolarHBondContact O-ND2 3.4Å; K293-N314 CarbonylContact C-O 3.46Å; K293-N314 VanDerWaalsContact CA-O 3.24Å; K293-N314 WeakPolarHBondContact CA-O 3.29Å; A294-N314 PolarHBondContact N-O 3.45Å; S312-N314 PolarHBondContact O-N 3Å; N314-F316 VanDerWaalsContact C-CE2 3.48Å; N314-F316 WeakPolarHBondContact O-CD2 3.42Å; N314-F316 VanDerWaalsContact O-CE2 3.25Å; N314-F316 WeakPolarHBondContact O-CE2 3.41Å
315	V	96.4	Very high	90.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.4	178.2	-174.4	0	0	0	0	109.7	F271 F275 V276 A294 V311 S312	F271-V315 HydrophobicContact CE2-CG1 4.32Å; F271-V315 HydrophobicContact CZ-CG1 4.11Å; F275-V315 HydrophobicContact CD1-CG1 4.21Å; F275-V315 HydrophobicContact CE1-CG1 3.49Å; F275-V315 VanDerWaalsContact CE1-CG1 3.49Å; F275-V315 HydrophobicContact CZ-CG1 4.4Å; V276-V315 HydrophobicContact CG1-CG2 4.41Å; V276-V315 HydrophobicContact CG2-CB 4.28Å; V276-V315 HydrophobicContact CG2-CG1 4.09Å; V276-V315 HydrophobicContact CG2-CG2 4.4Å; A294-V315 HydrophobicContact CB-CB 4.5Å; A294-V315 HydrophobicContact CB-CG1 4.22Å; A294-V315 HydrophobicContact CB-CG2 4.15Å; A294-V315 WeakPolarHBondContact O-CA 3.4Å; V311-V315 WeakPolarHBondContact CA-O 3.35Å; S312-V315 PolarHBondContact N-O 3.47Å; S312-V315 WeakPolarHBondContact O-CB 3.27Å; S312-V315 PolarHBondContact O-N 3.3Å
316	F	95.3	Very high	90.2	Very high	75 Å²	75	48.8 Å²	48.8	33%	0.329	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	153	-174.6	-54.3	-80.5	0	0	0	111.3	K293 A294 V295 L296 V311 S313 N314	K293-F316 HydrophobicContact CB-CE2 4.41Å; K293-F316 HydrophobicContact CD-CE2 4.24Å; K293-F316 HydrophobicContact CG-CE2 4.11Å; A294-F316 PolarHBondContact O-N 3.34Å; V295-F316 CarbonylContact C-O 3.57Å; V295-F316 WeakPolarHBondContact CA-O 3.3Å; L296-F316 PolarHBondContact N-O 3.07Å; V311-F316 HydrophobicContact CG1-CD1 4.21Å; V311-F316 HydrophobicContact CG1-CE1 4.31Å; V311-F316 HydrophobicContact CG2-CD1 4.34Å; S313-F316 VanDerWaalsContact O-CZ 3.28Å; S313-F316 WeakPolarHBondContact O-CZ 3.44Å; N314-F316 VanDerWaalsContact C-CE2 3.48Å; N314-F316 WeakPolarHBondContact O-CD2 3.42Å; N314-F316 VanDerWaalsContact O-CE2 3.25Å; N314-F316 WeakPolarHBondContact O-CE2 3.41Å
317	T	96.6	Very high	90	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.043	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140.3	174.8	-59.9	0	0	0	0	110.1	F271 L296 L298 L310 F319	F271-T317 WeakPolarHBondContact CE2-OG1 3.24Å; L296-T317 CarbonylContact O-C 3.53Å; L296-T317 VanDerWaalsContact O-CA 3.29Å; L296-T317 WeakPolarHBondContact O-CA 3.46Å; L298-T317 HydrophobicContact CD1-CG2 3.6Å; L298-T317 HydrophobicContact CG-CG2 4.07Å; L310-T317 HydrophobicContact CB-CG2 4.17Å; L310-T317 VanDerWaalsContact CB-OG1 3.27Å; L310-T317 WeakPolarHBondContact CB-OG1 3.35Å; L310-T317 HydrophobicContact CD1-CG2 3.98Å; L310-T317 WeakPolarHBondContact O-CB 3.24Å; L310-T317 PolarHBondContact O-OG1 2.82Å; T317-F319 HydrophobicContact CG2-CE2 4.47Å; T317-F319 HydrophobicContact CG2-CZ 4.34Å
318	I	94.7	Very high	90.2	Very high	21 Å²	21	40.6 Å²	40.6	11%	0.108	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.5	175.2	-59.6	179.6	0	0	0	108.4	F165 F168 L172 V295 L296 L297 L298	F165-I318 HydrophobicContact CE2-CG2 4.41Å; F165-I318 HydrophobicContact CZ-CG2 4.2Å; F168-I318 HydrophobicContact CE1-CG2 4.49Å; L172-I318 HydrophobicContact CD1-CD1 4.31Å; L172-I318 HydrophobicContact CD2-CD1 3.51Å; V295-I318 HydrophobicContact CG1-CB 4.48Å; V295-I318 HydrophobicContact CG1-CD1 3.61Å; V295-I318 HydrophobicContact CG1-CG1 3.94Å; L296-I318 PolarHBondContact O-N 3.14Å; L297-I318 WeakPolarHBondContact CA-O 3.43Å; L297-I318 HydrophobicContact CD1-CB 4.27Å; L297-I318 HydrophobicContact CD1-CG2 4.18Å; L298-I318 PolarHBondContact N-O 3.27Å
319	F	94	Very high	90.4	Very high	37 Å²	37	36.6 Å²	36.6	16%	0.162	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	132.9	172.8	-71.5	-68.5	0	0	0	113.2	L298 D299 H304 P305 E307 L310 T317	L298-F319 HydrophobicContact CB-CD1 3.69Å; L298-F319 HydrophobicContact CB-CE1 3.58Å; L298-F319 HydrophobicContact CD1-CE1 3.87Å; L298-F319 HydrophobicContact CD1-CZ 4.24Å; L298-F319 HydrophobicContact CG-CE1 4.37Å; L298-F319 CarbonylContact O-C 3.58Å; L298-F319 WeakPolarHBondContact O-CA 3.43Å; D299-F319 WeakPolarHBondContact O-CD1 3.4Å; D299-F319 WeakPolarHBondContact O-CE1 3.34Å; H304-F319 HydrophobicContact CB-CE1 3.58Å; H304-F319 HydrophobicContact CB-CZ 3.69Å; H304-F319 AromaticContact CG-CE1 3.95Å; H304-F319 AromaticContact ND1-CE1 3.68Å; P305-F319 VanDerWaalsContact O-CZ 3.3Å; P305-F319 WeakPolarHBondContact O-CZ 3.01Å; E307-F319 HydrophobicContact CB-CE2 4.34Å; E307-F319 HydrophobicContact CG-CD2 3.17Å; E307-F319 HydrophobicContact CG-CE2 3.32Å; E307-F319 HydrophobicContact CG-CG 4.37Å; E307-F319 VanDerWaalsContact OE1-CD2 3.28Å; E307-F319 WeakPolarHBondContact OE1-CD2 3.47Å; E307-F319 PolarHBondContact OE1-N 2.98Å; L310-F319 HydrophobicContact CD1-CZ 4.07Å; T317-F319 HydrophobicContact CG2-CE2 4.47Å; T317-F319 HydrophobicContact CG2-CZ 4.34Å
320	L	91.4	Very high	90.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-67.6	131.9	162	-71.4	148.7	0	0	0	108.7	F165 L297 L298 S300 A322 V324 A325 V328 Q329	F165-L320 HydrophobicContact CD1-CD2 3.95Å; F165-L320 HydrophobicContact CE1-CD2 3.43Å; F165-L320 VanDerWaalsContact CE1-CD2 3.43Å; F165-L320 HydrophobicContact CE1-CG 4.26Å; F165-L320 HydrophobicContact CZ-CD2 3.96Å; F165-L320 HydrophobicContact CZ-CG 4.33Å; L297-L320 HydrophobicContact CD1-CD1 4.37Å; L297-L320 HydrophobicContact CD1-CD2 4.3Å; L297-L320 HydrophobicContact CD1-CG 3.86Å; L297-L320 HydrophobicContact CD2-CD1 3.91Å; L297-L320 HydrophobicContact CD2-CD2 4.13Å; L297-L320 HydrophobicContact CD2-CG 4.07Å; L297-L320 HydrophobicContact CG-CD1 3.79Å; L297-L320 HydrophobicContact CG-CD2 4.38Å; L297-L320 HydrophobicContact CG-CG 3.84Å; L298-L320 WeakPolarHBondContact O-CB 3.43Å; L298-L320 PolarHBondContact O-N 3.12Å; S300-L320 PolarHBondContact OG-O 3.16Å; L320-A322 PolarHBondContact O-N 3.45Å; L320-V324 HydrophobicContact CD2-CG1 4.45Å; L320-A325 HydrophobicContact CB-CB 4.29Å; L320-V328 HydrophobicContact CD2-CG2 3.76Å; L320-Q329 HydrophobicContact CD1-CB 3.81Å; L320-Q329 HydrophobicContact CD1-CG 3.73Å
321	P	88.5	Confident	90.7	Very high	49 Å²	49	31.9 Å²	31.9	32%	0.318	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-54.3	138.8	169	-24.3	32.5	0	0	0	110.8	F165 S323 V324 A325	F165-P321 HydrophobicContact CD2-CG 3.8Å; F165-P321 HydrophobicContact CE2-CG 4.37Å; F165-P321 HydrophobicContact CG-CG 4.4Å; P321-S323 PolarHBondContact O-N 2.95Å; P321-S323 VanDerWaalsContact O-N 3.11Å; P321-V324 HydrophobicContact CB-CB 4.14Å; P321-V324 HydrophobicContact CB-CG2 3.95Å; P321-V324 HydrophobicContact CG-CB 4.43Å; P321-V324 HydrophobicContact CG-CG2 4.25Å; P321-V324 WeakPolarHBondContact O-CA 3.43Å; P321-V324 WeakPolarHBondContact O-CB 3.33Å; P321-V324 PolarHBondContact O-N 2.72Å; P321-A325 PolarHBondContact O-N 3.05Å
322	A	83.3	Confident	90.5	Very high	80 Å²	80	32 Å²	32	66%	0.661	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.9	-175.2	0	0	0	0	0	114	L320 V324	L320-A322 PolarHBondContact O-N 3.45Å; A322-V324 VanDerWaalsContact C-N 3.29Å; A322-V324 PolarHBondContact O-N 3.28Å
323	S	80.2	Confident	90.3	Very high	44 Å²	44	32.3 Å²	32.3	31%	0.308	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-24	175.1	41.7	0	0	0	0	113.7	D158 P321	D158-S323 WeakPolarHBondContact OD1-CB 3.35Å; P321-S323 PolarHBondContact O-N 2.95Å; P321-S323 VanDerWaalsContact O-N 3.11Å
324	V	85.1	Confident	90	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-30.1	-167.4	171.7	0	0	0	0	112.3	A161 A162 F165 L320 P321 A322 S326 L327 V328	A161-V324 HydrophobicContact CB-CG2 3.72Å; A162-V324 HydrophobicContact CB-CB 4.46Å; A162-V324 HydrophobicContact CB-CG1 3.83Å; A162-V324 HydrophobicContact CB-CG2 4.16Å; F165-V324 HydrophobicContact CB-CG1 4.21Å; F165-V324 HydrophobicContact CD1-CG1 4.38Å; F165-V324 HydrophobicContact CG-CG1 4.42Å; L320-V324 HydrophobicContact CD2-CG1 4.45Å; P321-V324 HydrophobicContact CB-CB 4.14Å; P321-V324 HydrophobicContact CB-CG2 3.95Å; P321-V324 HydrophobicContact CG-CB 4.43Å; P321-V324 HydrophobicContact CG-CG2 4.25Å; P321-V324 WeakPolarHBondContact O-CA 3.43Å; P321-V324 WeakPolarHBondContact O-CB 3.33Å; P321-V324 PolarHBondContact O-N 2.72Å; A322-V324 VanDerWaalsContact C-N 3.29Å; A322-V324 PolarHBondContact O-N 3.28Å; V324-S326 PolarHBondContact O-N 3.22Å; V324-L327 WeakPolarHBondContact O-CB 3.37Å; V324-L327 PolarHBondContact O-N 2.9Å; V324-V328 HydrophobicContact CG1-CG1 4.48Å; V324-V328 HydrophobicContact CG1-CG2 3.35Å; V324-V328 PolarHBondContact O-N 2.99Å
325	A	82.9	Confident	90	Very high	8 Å²	8	27.5 Å²	27.5	7%	0.066	17%	0.167	C	C	.	.	H	α-helix	trans	-49.1	-51.4	-174.5	0	0	0	0	0	112.9	D299 L320 P321 L327 V328 Q329	D299-A325 HydrophobicContact CB-CB 4.07Å; L320-A325 HydrophobicContact CB-CB 4.29Å; P321-A325 PolarHBondContact O-N 3.05Å; A325-L327 PolarHBondContact O-N 3.22Å; A325-V328 PolarHBondContact O-N 2.93Å; A325-Q329 HydrophobicContact CB-CB 4.46Å; A325-Q329 WeakPolarHBondContact O-CA 3.49Å; A325-Q329 WeakPolarHBondContact O-CB 3.26Å; A325-Q329 PolarHBondContact O-N 3.44Å
326	S	82	Confident	89.6	Confident	91 Å²	91	31.5 Å²	31.5	64%	0.636	18%	0.182	S	C	*	.	H	α-helix	trans	-60.2	-23.6	179.8	69.1	0	0	0	0	114.9	V324	V324-S326 PolarHBondContact O-N 3.22Å
327	L	86.4	Confident	89.3	Confident	41 Å²	41	35 Å²	35	22%	0.215	19%	0.193	C	C	.	.	H	α-helix	trans	-87.8	-36.1	-177.3	-63.3	177.1	0	0	0	112.6	D158 A162 V324 A325 Q333 K384	D158-L327 HydrophobicContact CB-CD1 4.06Å; A162-L327 HydrophobicContact CB-CB 4.34Å; A162-L327 HydrophobicContact CB-CD1 3.97Å; V324-L327 WeakPolarHBondContact O-CB 3.37Å; V324-L327 PolarHBondContact O-N 2.9Å; A325-L327 PolarHBondContact O-N 3.22Å; L327-Q333 PolarHBondContact O-NE2 3.3Å; L327-K384 VanDerWaalsContact O-CD 3.24Å; L327-K384 WeakPolarHBondContact O-CD 3.28Å; L327-K384 PolarHBondContact O-NZ 2.74Å
328	V	91.6	Very high	88.8	Confident	8 Å²	8	35 Å²	35	5%	0.048	19%	0.193	C	C	.	.	H	α-helix	trans	-132.8	-11	-167.2	-52.2	0	0	0	0	115.6	A162 L320 V324 A325 P330 K384 L385	A162-V328 HydrophobicContact CB-CG1 3.99Å; L320-V328 HydrophobicContact CD2-CG2 3.76Å; V324-V328 HydrophobicContact CG1-CG1 4.48Å; V324-V328 HydrophobicContact CG1-CG2 3.35Å; V324-V328 PolarHBondContact O-N 2.99Å; A325-V328 PolarHBondContact O-N 2.93Å; V328-P330 VanDerWaalsContact O-CD 3.27Å; V328-P330 WeakPolarHBondContact O-CD 3.15Å; V328-K384 HydrophobicContact CG1-CB 4.46Å; V328-L385 HydrophobicContact CB-CB 4.41Å; V328-L385 HydrophobicContact CG2-CD1 4.21Å
329	Q	93.7	Very high	88.6	Confident	6 Å²	6	34 Å²	34	3%	0.028	19%	0.187	C	C	.	.			trans	-60	119.4	180	-175.7	179.9	1.7	0	0	110.1	D187 L320 A325 M331 E332 Q333	D187-Q329 PolarHBondContact OD1-NE2 3.07Å; L320-Q329 HydrophobicContact CD1-CB 3.81Å; L320-Q329 HydrophobicContact CD1-CG 3.73Å; A325-Q329 HydrophobicContact CB-CB 4.46Å; A325-Q329 WeakPolarHBondContact O-CA 3.49Å; A325-Q329 WeakPolarHBondContact O-CB 3.26Å; A325-Q329 PolarHBondContact O-N 3.44Å; Q329-M331 PolarHBondContact O-N 3.04Å; Q329-E332 HydrophobicContact CB-CB 4.44Å; Q329-E332 PolarHBondContact O-N 3.5Å; Q329-Q333 WeakPolarHBondContact O-CG 3.13Å; Q329-Q333 PolarHBondContact O-N 3.19Å; Q329-Q333 PolarHBondContact O-NE2 3.43Å
330	P	95	Very high	88.1	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-56.5	-42.9	-172.7	-29.7	35.3	0	0	0	114.9	N185 V328 E332 Q333 A381 W382 L385	N185-P330 HydrophobicContact CB-CB 4.1Å; N185-P330 HydrophobicContact CB-CG 4.02Å; N185-P330 WeakPolarHBondContact OD1-CD 3.08Å; V328-P330 VanDerWaalsContact O-CD 3.27Å; V328-P330 WeakPolarHBondContact O-CD 3.15Å; P330-E332 PolarHBondContact O-N 3.08Å; P330-E332 VanDerWaalsContact O-N 3.12Å; P330-Q333 PolarHBondContact O-N 3.06Å; P330-A381 HydrophobicContact CB-CB 4.29Å; P330-A381 WeakPolarHBondContact O-CB 3.22Å; P330-W382 HydrophobicContact CB-CD2 3.96Å; P330-W382 HydrophobicContact CB-CG 4.25Å; P330-W382 HydrophobicContact CB-CZ2 4.04Å; P330-W382 HydrophobicContact CG-CD2 3.5Å; P330-W382 VanDerWaalsContact CG-CE2 3.48Å; P330-W382 HydrophobicContact CG-CE3 3.67Å; P330-W382 HydrophobicContact CG-CG 4.16Å; P330-W382 HydrophobicContact CG-CH2 3.82Å; P330-W382 HydrophobicContact CG-CZ2 3.69Å; P330-W382 HydrophobicContact CG-CZ3 3.81Å; P330-L385 HydrophobicContact CG-CD2 4.33Å
331	M	94.6	Very high	87.6	Confident	2 Å²	2	40 Å²	40	1%	0.01	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-58	-29.2	178.2	-75.9	-61.4	154.1	0	0	112.9	N185 D187 A222 Q329 I335 R336 W370 F378	N185-M331 WeakPolarHBondContact O-CE 3.28Å; N185-M331 WeakPolarHBondContact OD1-CB 3.28Å; N185-M331 WeakPolarHBondContact OD1-CG 3.41Å; N185-M331 PolarHBondContact OD1-N 3.35Å; D187-M331 HydrophobicContact CB-CB 3.42Å; D187-M331 VanDerWaalsContact CB-CB 3.42Å; D187-M331 HydrophobicContact CB-CG 3.71Å; A222-M331 HydrophobicContact CB-CE 3.97Å; Q329-M331 PolarHBondContact O-N 3.04Å; M331-I335 HydrophobicContact CE-CD1 4.14Å; M331-I335 HydrophobicContact SD-CB 4.13Å; M331-I335 HydrophobicContact SD-CD1 3.96Å; M331-I335 HydrophobicContact SD-CG2 3.66Å; M331-R336 WeakPolarHBondContact O-CB 3.5Å; M331-R336 PolarHBondContact O-N 3.23Å; M331-W370 HydrophobicContact CE-CH2 4.01Å; M331-W370 HydrophobicContact SD-CH2 4.27Å; M331-W370 HydrophobicContact SD-CZ3 4.5Å; M331-F378 HydrophobicContact CE-CE1 4.44Å
332	E	89.6	Confident	87.4	Confident	62 Å²	62	38.4 Å²	38.4	29%	0.29	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-86.7	-8.1	176	-71.1	-64.7	162.4	0	0	113.8	Q329 P330 G334 R336	Q329-E332 HydrophobicContact CB-CB 4.44Å; Q329-E332 PolarHBondContact O-N 3.5Å; P330-E332 PolarHBondContact O-N 3.08Å; P330-E332 VanDerWaalsContact O-N 3.12Å; E332-G334 PolarHBondContact O-N 2.71Å; E332-R336 VanDerWaalsContact OE1-CD 3.29Å; E332-R336 WeakPolarHBondContact OE1-CD 3.38Å; E332-R336 IonicContact OE1-CZ 3.23Å; E332-R336 IonicContact OE1-NE 2.98Å; E332-R336 PolarHBondContact OE1-NE 3.43Å; E332-R336 IonicContact OE1-NH2 2.72Å; E332-R336 IonicContact OE2-CZ 2.68Å; E332-R336 VanDerWaalsContact OE2-CZ 3.23Å; E332-R336 IonicContact OE2-NE 3.19Å; E332-R336 PolarHBondContact OE2-NE 3.45Å; E332-R336 IonicContact OE2-NH2 2.86Å; E332-R336 PolarHBondContact OE2-NH2 3.29Å
333	Q	90.1	Very high	87.3	Confident	35 Å²	35	34.9 Å²	34.9	16%	0.164	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	42.1	177.3	-56.4	-44.7	-54.2	0	0	113.2	L327 Q329 P330 A381 K384	L327-Q333 PolarHBondContact O-NE2 3.3Å; Q329-Q333 WeakPolarHBondContact O-CG 3.13Å; Q329-Q333 PolarHBondContact O-N 3.19Å; Q329-Q333 PolarHBondContact O-NE2 3.43Å; P330-Q333 PolarHBondContact O-N 3.06Å; Q333-A381 HydrophobicContact CB-CB 3.96Å; Q333-A381 WeakPolarHBondContact CB-O 3.44Å; Q333-K384 HydrophobicContact CG-CD 4.41Å
334	G	86.5	Confident	87	Confident	11 Å²	11	36.2 Å²	36.2	11%	0.113	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	106.7	-19.1	171.7	0	0	0	0	0	115.5	E332 R337 D338	E332-G334 PolarHBondContact O-N 2.71Å; G334-R337 PolarHBondContact O-N 3.14Å; G334-D338 PolarHBondContact O-N 2.96Å
335	I	92.9	Very high	86.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-52.1	176.7	-61.3	166.9	0	0	0	110.1	M331 R337 D338 F339 W370 I373 V377 F378 A381	M331-I335 HydrophobicContact CE-CD1 4.14Å; M331-I335 HydrophobicContact SD-CB 4.13Å; M331-I335 HydrophobicContact SD-CD1 3.96Å; M331-I335 HydrophobicContact SD-CG2 3.66Å; I335-R337 VanDerWaalsContact C-N 3.28Å; I335-R337 PolarHBondContact O-N 2.88Å; I335-D338 PolarHBondContact O-N 2.94Å; I335-F339 WeakPolarHBondContact O-CB 3.42Å; I335-F339 PolarHBondContact O-N 3.13Å; I335-W370 HydrophobicContact CG2-CH2 4.39Å; I335-W370 HydrophobicContact CG2-CZ3 3.8Å; I335-I373 HydrophobicContact CG2-CD1 3.95Å; I335-V377 HydrophobicContact CG1-CG1 4.14Å; I335-F378 HydrophobicContact CD1-CD1 3.54Å; I335-F378 HydrophobicContact CD1-CE1 3.97Å; I335-F378 HydrophobicContact CD1-CG 4.21Å; I335-F378 HydrophobicContact CG1-CD1 4.16Å; I335-F378 HydrophobicContact CG1-CE1 4.35Å; I335-F378 HydrophobicContact CG2-CE1 3.92Å; I335-F378 HydrophobicContact CG2-CZ 4.22Å; I335-A381 HydrophobicContact CD1-CB 3.74Å; I335-A381 HydrophobicContact CG1-CB 3.94Å
336	R	88.3	Confident	85.5	Confident	85 Å²	85	42.6 Å²	42.6	32%	0.321	21%	0.208	S	C	.	.	H	α-helix	trans	-58.1	-39.7	177	-174.9	180	61.9	78.1	0.7	112.3	M331 E332 M340	M331-R336 WeakPolarHBondContact O-CB 3.5Å; M331-R336 PolarHBondContact O-N 3.23Å; E332-R336 VanDerWaalsContact OE1-CD 3.29Å; E332-R336 WeakPolarHBondContact OE1-CD 3.38Å; E332-R336 IonicContact OE1-CZ 3.23Å; E332-R336 IonicContact OE1-NE 2.98Å; E332-R336 PolarHBondContact OE1-NE 3.43Å; E332-R336 IonicContact OE1-NH2 2.72Å; E332-R336 IonicContact OE2-CZ 2.68Å; E332-R336 VanDerWaalsContact OE2-CZ 3.23Å; E332-R336 IonicContact OE2-NE 3.19Å; E332-R336 PolarHBondContact OE2-NE 3.45Å; E332-R336 IonicContact OE2-NH2 2.86Å; E332-R336 PolarHBondContact OE2-NH2 3.29Å; R336-M340 HydrophobicContact CG-CG 4.37Å; R336-M340 WeakPolarHBondContact O-CB 3.33Å; R336-M340 WeakPolarHBondContact O-CG 3.19Å; R336-M340 PolarHBondContact O-N 3.43Å
337	R	87.3	Confident	84.2	Confident	148 Å²	148	42.7 Å²	42.7	56%	0.558	21%	0.206	S	C	*	.	H	α-helix	trans	-62.2	-48.3	178	-179.5	-165.1	65.7	-179.6	-1.9	111.2	G334 I335 M340 R341	G334-R337 PolarHBondContact O-N 3.14Å; I335-R337 VanDerWaalsContact C-N 3.28Å; I335-R337 PolarHBondContact O-N 2.88Å; R337-M340 PolarHBondContact O-N 3.05Å; R337-R341 WeakPolarHBondContact O-CB 3.35Å; R337-R341 PolarHBondContact O-N 3.16Å
338	D	87.8	Confident	82.7	Confident	7 Å²	7	43.7 Å²	43.7	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-39.4	-178.8	-81	42.5	0	0	0	111.2	G334 I335 R341 N342	G334-D338 PolarHBondContact O-N 2.96Å; I335-D338 PolarHBondContact O-N 2.94Å; D338-R341 VanDerWaalsContact CG-NH2 3.27Å; D338-R341 PolarHBondContact O-N 3.24Å; D338-R341 IonicContact OD1-NH1 2.78Å; D338-R341 IonicContact OD1-NH2 3.52Å; D338-R341 IonicContact OD2-CZ 2.67Å; D338-R341 IonicContact OD2-NH1 3.51Å; D338-R341 IonicContact OD2-NH2 3.26Å; D338-R341 PolarHBondContact OD2-NH2 3.4Å; D338-N342 WeakPolarHBondContact O-CB 3.44Å; D338-N342 PolarHBondContact O-N 3.13Å; D338-N342 PolarHBondContact O-OD1 3.14Å
339	F	89.8	Confident	80.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-54.5	-53	168.9	171.9	-109.2	0	0	0	112.1	T189 L191 V218 M220 I335 R341 N342 F343 M366 A369 W370 I373	T189-F339 HydrophobicContact CG2-CD1 4.12Å; T189-F339 HydrophobicContact CG2-CE1 3.71Å; L191-F339 HydrophobicContact CD1-CE1 4.25Å; L191-F339 HydrophobicContact CD1-CZ 4.06Å; L191-F339 HydrophobicContact CD2-CE1 3.97Å; L191-F339 HydrophobicContact CG-CE1 4.44Å; V218-F339 HydrophobicContact CG1-CZ 4.39Å; M220-F339 HydrophobicContact CE-CD1 3.83Å; M220-F339 HydrophobicContact CE-CE1 4.17Å; M220-F339 HydrophobicContact CE-CG 4.16Å; M220-F339 HydrophobicContact SD-CB 4.22Å; M220-F339 HydrophobicContact SD-CD1 3.65Å; M220-F339 HydrophobicContact SD-CD2 3.66Å; M220-F339 HydrophobicContact SD-CE1 3.8Å; M220-F339 HydrophobicContact SD-CE2 3.82Å; M220-F339 HydrophobicContact SD-CG 3.55Å; M220-F339 VanDerWaalsContact SD-CG 3.55Å; M220-F339 HydrophobicContact SD-CZ 3.87Å; I335-F339 WeakPolarHBondContact O-CB 3.42Å; I335-F339 PolarHBondContact O-N 3.13Å; F339-R341 VanDerWaalsContact C-N 3.31Å; F339-R341 PolarHBondContact O-N 3.38Å; F339-N342 PolarHBondContact O-N 2.71Å; F339-F343 WeakPolarHBondContact O-CB 3.47Å; F339-F343 PolarHBondContact O-N 2.9Å; F339-M366 HydrophobicContact CE2-CG 4.18Å; F339-M366 HydrophobicContact CZ-CG 3.95Å; F339-A369 HydrophobicContact CD2-CB 3.97Å; F339-A369 HydrophobicContact CE2-CB 3.99Å; F339-W370 HydrophobicContact CD2-CB 4.23Å; F339-W370 HydrophobicContact CD2-CE3 4.37Å; F339-W370 HydrophobicContact CE2-CB 4.16Å; F339-I373 HydrophobicContact CB-CD1 3.81Å
340	M	83.3	Confident	78.9	Confident	48 Å²	48	48.4 Å²	48.4	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-39.1	179.9	-70.7	-62.8	-66.3	0	0	111.9	L191 R336 R337 F343 I344	L191-M340 HydrophobicContact CD2-CE 3.91Å; L191-M340 HydrophobicContact CD2-SD 3.33Å; L191-M340 WeakPolarHBondContact CD2-SD 3.34Å; R336-M340 HydrophobicContact CG-CG 4.37Å; R336-M340 WeakPolarHBondContact O-CB 3.33Å; R336-M340 WeakPolarHBondContact O-CG 3.19Å; R336-M340 PolarHBondContact O-N 3.43Å; R337-M340 PolarHBondContact O-N 3.05Å; M340-F343 PolarHBondContact O-N 3.42Å; M340-I344 WeakPolarHBondContact O-CD1 3.44Å; M340-I344 VanDerWaalsContact O-CG1 3.25Å; M340-I344 WeakPolarHBondContact O-CG1 3.42Å; M340-I344 PolarHBondContact O-N 2.82Å
341	R	81.4	Confident	76.7	Confident	116 Å²	116	53.8 Å²	53.8	44%	0.438	27%	0.269	S	S	.	.	H	α-helix	trans	-60.6	-49.2	174.9	-178.6	-172.9	65.8	-145.8	-9.9	110.8	R337 D338 F339 F343 I344 N345	R337-R341 WeakPolarHBondContact O-CB 3.35Å; R337-R341 PolarHBondContact O-N 3.16Å; D338-R341 VanDerWaalsContact CG-NH2 3.27Å; D338-R341 PolarHBondContact O-N 3.24Å; D338-R341 IonicContact OD1-NH1 2.78Å; D338-R341 IonicContact OD1-NH2 3.52Å; D338-R341 IonicContact OD2-CZ 2.67Å; D338-R341 IonicContact OD2-NH1 3.51Å; D338-R341 IonicContact OD2-NH2 3.26Å; D338-R341 PolarHBondContact OD2-NH2 3.4Å; F339-R341 VanDerWaalsContact C-N 3.31Å; F339-R341 PolarHBondContact O-N 3.38Å; R341-F343 VanDerWaalsContact C-N 3.27Å; R341-F343 PolarHBondContact O-N 3.46Å; R341-I344 PolarHBondContact O-N 3.35Å; R341-N345 PolarHBondContact O-N 2.56Å
342	N	83.6	Confident	74.5	Confident	15 Å²	15	54.5 Å²	54.5	8%	0.08	28%	0.277	C	S	.	.	H	α-helix	trans	-68	-28.2	-179.6	-64.1	-6.9	0	0	0	112	D338 F339 N345 P346 A369	D338-N342 WeakPolarHBondContact O-CB 3.44Å; D338-N342 PolarHBondContact O-N 3.13Å; D338-N342 PolarHBondContact O-OD1 3.14Å; F339-N342 PolarHBondContact O-N 2.71Å; N342-N345 CarbonylContact O-C 3.53Å; N342-P346 WeakPolarHBondContact O-CA 3.29Å; N342-A369 HydrophobicContact CB-CB 3.8Å; N342-A369 PolarHBondContact ND2-O 3.44Å
343	F	81.4	Confident	72.1	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-73.2	-40.2	174.9	-179.2	-101.6	0	0	0	112.3	L191 W193 L196 F339 M340 R341 M366 A369	L191-F343 HydrophobicContact CD1-CD1 4.48Å; L191-F343 HydrophobicContact CD1-CD2 4.17Å; L191-F343 HydrophobicContact CD1-CE1 4.26Å; L191-F343 HydrophobicContact CD1-CE2 3.93Å; L191-F343 HydrophobicContact CD1-CG 4.43Å; L191-F343 HydrophobicContact CD1-CZ 3.98Å; L191-F343 HydrophobicContact CD2-CD1 4.05Å; L191-F343 HydrophobicContact CD2-CE1 4.22Å; L191-F343 HydrophobicContact CD2-CG 4.43Å; W193-F343 HydrophobicContact CB-CE1 4.37Å; W193-F343 HydrophobicContact CB-CZ 3.88Å; L196-F343 HydrophobicContact CD1-CE1 3.95Å; L196-F343 HydrophobicContact CD1-CZ 4.25Å; L196-F343 HydrophobicContact CD2-CD1 4.31Å; L196-F343 HydrophobicContact CD2-CE1 4.1Å; L196-F343 HydrophobicContact CG-CE1 4.36Å; F339-F343 WeakPolarHBondContact O-CB 3.47Å; F339-F343 PolarHBondContact O-N 2.9Å; M340-F343 PolarHBondContact O-N 3.42Å; R341-F343 VanDerWaalsContact C-N 3.27Å; R341-F343 PolarHBondContact O-N 3.46Å; F343-M366 HydrophobicContact CD2-CB 4.17Å; F343-M366 HydrophobicContact CE2-CB 4.07Å; F343-A369 HydrophobicContact CB-CB 3.88Å
344	I	74.2	Confident	70	Confident	72 Å²	72	56.1 Å²	56.1	37%	0.369	29%	0.29	S	S	.	.	H	α-helix	trans	-75.3	-41.6	179.2	-65.7	165.2	0	0	0	111	L196 M340 R341 P346	L196-I344 HydrophobicContact CD2-CB 4.32Å; L196-I344 HydrophobicContact CD2-CG1 3.87Å; L196-I344 HydrophobicContact CD2-CG2 4.45Å; M340-I344 WeakPolarHBondContact O-CD1 3.44Å; M340-I344 VanDerWaalsContact O-CG1 3.25Å; M340-I344 WeakPolarHBondContact O-CG1 3.42Å; M340-I344 PolarHBondContact O-N 2.82Å; R341-I344 PolarHBondContact O-N 3.35Å; I344-P346 WeakPolarHBondContact O-CD 3.21Å
345	N	70.3	Confident	68.3	Low	110 Å²	110	62.4 Å²	62.4	59%	0.588	33%	0.326	S	S	*	.	S	Bend	trans	-122.1	80.2	-179	-57.2	-56.8	0	0	0	108.8	R341 N342	R341-N345 PolarHBondContact O-N 2.56Å; N342-N345 CarbonylContact O-C 3.53Å
346	P	66.4	Low	66.7	Low	32 Å²	32	72.9 Å²	72.9	21%	0.208	37%	0.365	C	S	.	.			trans	-62.4	138.6	-179	26	-33.7	0	0	0	110.4	N342 I344 T348	N342-P346 WeakPolarHBondContact O-CA 3.29Å; I344-P346 WeakPolarHBondContact O-CD 3.21Å; P346-T348 PolarHBondContact O-N 2.76Å
347	P	53.8	Low	65.9	Low	93 Å²	93	71.9 Å²	71.9	60%	0.604	36%	0.362	S	S	*	.	S	Bend	trans	-55.8	-26.7	178.2	-23.9	31.8	0	0	0	113.1	A372	P347-A372 HydrophobicContact CG-CB 4.19Å
348	T	55.9	Low	65.5	Low	62 Å²	62	67.6 Å²	67.6	38%	0.38	35%	0.35	S	S	.	.	S	Bend	trans	-117.6	111.9	171.2	-39.4	0	0	0	0	107.9	P346 L350 A517	P346-T348 PolarHBondContact O-N 2.76Å; T348-L350 PolarHBondContact O-N 3.09Å; T348-L350 VanDerWaalsContact O-N 3.1Å; T348-A517 HydrophobicContact CG2-CB 3.6Å
349	P	51.2	Low	65.2	Low	86 Å²	86	68.8 Å²	68.8	56%	0.558	36%	0.356	S	S	*	.			trans	-62.4	114.8	178.9	-19.6	30.5	0	0	0	110.3	Q351 A517	P349-Q351 PolarHBondContact O-N 3.38Å; P349-Q351 VanDerWaalsContact O-N 3.13Å; P349-A517 WeakPolarHBondContact O-CB 3.46Å
350	L	53.1	Low	64.9	Low	27 Å²	27	69.5 Å²	69.5	14%	0.141	36%	0.36	C	S	.	.			trans	-73.4	10.1	167.7	-66.4	175.4	0	0	0	112.3	T348 G352 S365 G513 R516 A517	T348-L350 PolarHBondContact O-N 3.09Å; T348-L350 VanDerWaalsContact O-N 3.1Å; L350-G352 PolarHBondContact O-N 3.21Å; L350-S365 WeakPolarHBondContact CD1-OG 3.33Å; L350-G513 WeakPolarHBondContact CD2-O 3.25Å; L350-R516 HydrophobicContact CD2-CB 3.51Å; L350-A517 HydrophobicContact CD2-CB 4.26Å
351	Q	49.3	Very low	64.8	Low	112 Å²	112	68.9 Å²	68.9	52%	0.523	36%	0.357	S	S	.	.			trans	-101.1	88.2	-168	-64.5	-170.4	-2.6	0	0	111.2	P349	P349-Q351 PolarHBondContact O-N 3.38Å; P349-Q351 VanDerWaalsContact O-N 3.13Å
352	G	47.4	Very low	64.9	Low	18 Å²	18	63.3 Å²	63.3	19%	0.186	34%	0.336	C	S	.	.	S	Bend	trans	-95.9	179.9	145.3	0	0	0	0	0	108.9	L350 H354	L350-G352 PolarHBondContact O-N 3.21Å; G352-H354 PolarHBondContact O-N 2.9Å
353	P	39.9	Very low	65.1	Low	57 Å²	57	62.6 Å²	62.6	37%	0.37	33%	0.333	S	S	.	.	S	Bend	trans	-70.4	65	178.2	29.1	-31.4	0	0	0	110.6	T355	P353-T355 PolarHBondContact O-N 2.89Å
354	H	45.2	Very low	65.4	Low	74 Å²	74	62.5 Å²	62.5	34%	0.343	33%	0.332	S	S	.	.			trans	-84.1	111.4	171.2	-76.5	-51.8	0	0	0	108.9	G352 R356	G352-H354 PolarHBondContact O-N 2.9Å; H354-R356 VanDerWaalsContact C-N 3.32Å; H354-R356 PolarHBondContact O-N 3.44Å
355	T	50.8	Low	65.9	Low	142 Å²	142	59.3 Å²	59.3	87%	0.871	32%	0.316	S	S	*	.	S	Bend	trans	-62.5	92.3	167.3	12.5	0	0	0	0	109.2	P353	P353-T355 PolarHBondContact O-N 2.89Å
356	R	61	Low	66.8	Low	221 Å²	221	54.1 Å²	54.1	83%	0.834	29%	0.288	S	S	*	.			trans	94.5	92.4	169.3	-56	176.7	178.2	-179.3	0.7	116.7	H354 N358	H354-R356 VanDerWaalsContact C-N 3.32Å; H354-R356 PolarHBondContact O-N 3.44Å; R356-N358 PolarHBondContact O-N 3.37Å
357	Y	70.5	Confident	68	Low	64 Å²	64	52.7 Å²	52.7	25%	0.251	28%	0.279	S	S	.	.			trans	-50.6	121.3	157.4	-168	-103.4	0	0	0	110.4	W193 R194 L196 D361 A362 S365	W193-Y357 HydrophobicContact CB-CE1 4.36Å; W193-Y357 AromaticContact CE3-CD1 3.63Å; W193-Y357 HydrophobicContact CE3-CD1 3.63Å; W193-Y357 AromaticContact CE3-CE1 3.73Å; W193-Y357 HydrophobicContact CE3-CE1 3.73Å; W193-Y357 AromaticContact CZ3-CD1 3.97Å; W193-Y357 HydrophobicContact CZ3-CD1 3.97Å; W193-Y357 HydrophobicContact CZ3-CE1 4.45Å; R194-Y357 PolarHBondContact NH1-O 3.21Å; L196-Y357 HydrophobicContact CD1-CE1 3.98Å; Y357-D361 HydrophobicContact CD2-CB 3.6Å; Y357-D361 HydrophobicContact CE2-CB 3.5Å; Y357-D361 HydrophobicContact CG-CB 4.25Å; Y357-A362 HydrophobicContact CE1-CB 4.04Å; Y357-A362 WeakPolarHBondContact OH-CA 3.45Å; Y357-S365 PolarHBondContact OH-OG 3.4Å
358	N	78.5	Confident	69.7	Low	58 Å²	58	49.6 Å²	49.6	31%	0.31	26%	0.259	S	S	.	.			trans	-120.8	178.8	-174.3	74.4	63.1	0	0	0	111.7	R356 N360 D361 A362	R356-N358 PolarHBondContact O-N 3.37Å; N358-N360 VanDerWaalsContact C-N 3.27Å; N358-N360 PolarHBondContact O-N 3.37Å; N358-N360 WeakPolarHBondContact OD1-CA 3.41Å; N358-N360 WeakPolarHBondContact OD1-CB 3.38Å; N358-N360 PolarHBondContact OD1-N 2.89Å; N358-D361 VanDerWaalsContact CG-OD2 3.24Å; N358-D361 PolarHBondContact N-OD2 3.09Å; N358-D361 PolarHBondContact ND2-OD2 3.48Å; N358-D361 WeakPolarHBondContact O-CB 3.45Å; N358-D361 PolarHBondContact O-N 3.49Å; N358-D361 VanDerWaalsContact O-N 3.17Å; N358-A362 PolarHBondContact O-N 3.3Å; N358-A362 VanDerWaalsContact O-N 3.11Å
359	M	82.4	Confident	71.3	Confident	32 Å²	32	46.7 Å²	46.7	16%	0.158	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-29.7	-174.6	-173.4	176.6	-72.4	0	0	113.2	W193 L216 P241 A243 F244 Y254 A362 I363	W193-M359 HydrophobicContact CH2-CB 4.27Å; W193-M359 HydrophobicContact CZ2-CB 4.15Å; W193-M359 HydrophobicContact CZ2-CE 4.31Å; L216-M359 HydrophobicContact CD1-CG 4.47Å; L216-M359 HydrophobicContact CD2-CE 4.31Å; L216-M359 HydrophobicContact CD2-SD 4.36Å; P241-M359 HydrophobicContact CB-SD 3.77Å; P241-M359 HydrophobicContact CG-CE 4.49Å; P241-M359 HydrophobicContact CG-SD 3.43Å; P241-M359 WeakPolarHBondContact CG-SD 3.19Å; A243-M359 HydrophobicContact CB-CB 4.17Å; F244-M359 HydrophobicContact CE1-CB 4.37Å; F244-M359 HydrophobicContact CE1-CG 4Å; F244-M359 HydrophobicContact CE1-SD 4.33Å; F244-M359 HydrophobicContact CE2-SD 4.45Å; F244-M359 HydrophobicContact CZ-CG 3.81Å; F244-M359 HydrophobicContact CZ-SD 3.69Å; Y254-M359 HydrophobicContact CE2-SD 4.3Å; M359-A362 PolarHBondContact O-N 2.82Å; M359-I363 WeakPolarHBondContact O-CG1 3.44Å; M359-I363 PolarHBondContact O-N 2.72Å
360	N	83	Confident	73.4	Confident	14 Å²	14	42.6 Å²	42.6	8%	0.075	22%	0.215	C	C	.	.	H	α-helix	trans	-65	-43.5	174.2	-175.4	8.6	0	0	0	110.4	A243 F244 I247 N358 A362 I363 F364 R516	A243-N360 HydrophobicContact CB-CB 4.19Å; F244-N360 HydrophobicContact CD1-CB 4.46Å; I247-N360 WeakPolarHBondContact CD1-ND2 3.49Å; N358-N360 VanDerWaalsContact C-N 3.27Å; N358-N360 PolarHBondContact O-N 3.37Å; N358-N360 WeakPolarHBondContact OD1-CA 3.41Å; N358-N360 WeakPolarHBondContact OD1-CB 3.38Å; N358-N360 PolarHBondContact OD1-N 2.89Å; N360-A362 VanDerWaalsContact C-N 3.31Å; N360-A362 PolarHBondContact O-N 3.29Å; N360-I363 PolarHBondContact O-N 3.31Å; N360-F364 WeakPolarHBondContact O-CD2 3.48Å; N360-F364 PolarHBondContact O-N 2.9Å; N360-F364 WeakPolarHBondContact OD1-CD2 3.48Å; N360-F364 WeakPolarHBondContact OD1-CE2 3.3Å; N360-R516 VanDerWaalsContact CG-NH2 3.27Å; N360-R516 PolarHBondContact ND2-NH2 3.3Å; N360-R516 VanDerWaalsContact ND2-NH2 3.16Å; N360-R516 PolarHBondContact O-NH1 3.14Å; N360-R516 PolarHBondContact OD1-NH2 3.46Å
361	D	80.7	Confident	75.2	Confident	35 Å²	35	45.2 Å²	45.2	19%	0.187	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-41.9	175.6	-51.9	-46.8	0	0	0	111.4	Y357 N358 I363 F364 S365 R516	Y357-D361 HydrophobicContact CD2-CB 3.6Å; Y357-D361 HydrophobicContact CE2-CB 3.5Å; Y357-D361 HydrophobicContact CG-CB 4.25Å; N358-D361 VanDerWaalsContact CG-OD2 3.24Å; N358-D361 PolarHBondContact N-OD2 3.09Å; N358-D361 PolarHBondContact ND2-OD2 3.48Å; N358-D361 WeakPolarHBondContact O-CB 3.45Å; N358-D361 PolarHBondContact O-N 3.49Å; N358-D361 VanDerWaalsContact O-N 3.17Å; D361-I363 PolarHBondContact O-N 3.22Å; D361-F364 PolarHBondContact O-N 2.87Å; D361-S365 VanDerWaalsContact O-CB 3.28Å; D361-S365 WeakPolarHBondContact O-CB 3.38Å; D361-S365 PolarHBondContact O-N 2.92Å; D361-S365 PolarHBondContact O-OG 3.26Å; D361-R516 IonicContact OD1-NH1 3.7Å
362	A	84.5	Confident	77.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-42	175.6	0	0	0	0	0	112.7	W193 L216 Y357 N358 M359 N360 M366	W193-A362 HydrophobicContact CB-CB 3.77Å; W193-A362 HydrophobicContact CD2-CB 3.86Å; W193-A362 HydrophobicContact CE3-CB 4.01Å; W193-A362 HydrophobicContact CG-CB 3.78Å; L216-A362 HydrophobicContact CD1-CB 4.1Å; Y357-A362 HydrophobicContact CE1-CB 4.04Å; Y357-A362 WeakPolarHBondContact OH-CA 3.45Å; N358-A362 PolarHBondContact O-N 3.3Å; N358-A362 VanDerWaalsContact O-N 3.11Å; M359-A362 PolarHBondContact O-N 2.82Å; N360-A362 VanDerWaalsContact C-N 3.31Å; N360-A362 PolarHBondContact O-N 3.29Å; A362-M366 WeakPolarHBondContact O-CB 3.39Å; A362-M366 PolarHBondContact O-N 3.4Å
363	I	88.4	Confident	79.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-45.4	178.1	-80.2	-171.2	0	0	0	111.9	F244 L250 P251 V252 Y254 M359 N360 D361 M366 A367	F244-I363 HydrophobicContact CE1-CD1 3.61Å; F244-I363 HydrophobicContact CE1-CG1 4.49Å; F244-I363 HydrophobicContact CE2-CD1 3.98Å; F244-I363 HydrophobicContact CZ-CD1 3.19Å; F244-I363 HydrophobicContact CZ-CG1 4.31Å; L250-I363 HydrophobicContact CD2-CG2 4.4Å; P251-I363 HydrophobicContact CG-CG2 3.83Å; V252-I363 HydrophobicContact CG1-CG2 4.33Å; V252-I363 HydrophobicContact CG2-CB 4.43Å; V252-I363 HydrophobicContact CG2-CD1 4.03Å; V252-I363 HydrophobicContact CG2-CG1 4.25Å; V252-I363 HydrophobicContact CG2-CG2 3.49Å; V252-I363 VanDerWaalsContact CG2-CG2 3.49Å; Y254-I363 HydrophobicContact CD2-CD1 3.94Å; Y254-I363 HydrophobicContact CE2-CD1 4.47Å; M359-I363 WeakPolarHBondContact O-CG1 3.44Å; M359-I363 PolarHBondContact O-N 2.72Å; N360-I363 PolarHBondContact O-N 3.31Å; D361-I363 PolarHBondContact O-N 3.22Å; I363-M366 HydrophobicContact CB-CE 4.44Å; I363-M366 HydrophobicContact CG1-CE 4.16Å; I363-M366 WeakPolarHBondContact O-CB 3.42Å; I363-M366 PolarHBondContact O-N 3.49Å; I363-A367 PolarHBondContact O-N 2.84Å
364	F	86.2	Confident	81.8	Confident	4 Å²	4	41 Å²	41	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-69.4	-40.7	179.3	-84.2	-102.1	0	0	0	111.5	P251 N360 D361 M366 A367 C368 E502 V512 R516	P251-F364 HydrophobicContact CG-CD1 3.99Å; P251-F364 HydrophobicContact CG-CD2 3.97Å; P251-F364 HydrophobicContact CG-CE1 3.96Å; P251-F364 HydrophobicContact CG-CE2 3.98Å; P251-F364 HydrophobicContact CG-CG 4.02Å; P251-F364 HydrophobicContact CG-CZ 3.99Å; N360-F364 WeakPolarHBondContact O-CD2 3.48Å; N360-F364 PolarHBondContact O-N 2.9Å; N360-F364 WeakPolarHBondContact OD1-CD2 3.48Å; N360-F364 WeakPolarHBondContact OD1-CE2 3.3Å; D361-F364 PolarHBondContact O-N 2.87Å; F364-M366 VanDerWaalsContact C-N 3.26Å; F364-M366 PolarHBondContact O-N 3.2Å; F364-A367 PolarHBondContact O-N 3.18Å; F364-C368 WeakPolarHBondContact O-CB 3.38Å; F364-C368 PolarHBondContact O-N 3.11Å; F364-C368 PolarHBondContact O-SG 3.24Å; F364-E502 HydrophobicContact CZ-CG 4.47Å; F364-V512 HydrophobicContact CD1-CB 4.18Å; F364-V512 HydrophobicContact CD1-CG1 3.88Å; F364-V512 HydrophobicContact CE1-CB 3.71Å; F364-V512 HydrophobicContact CE1-CG1 3.35Å; F364-V512 HydrophobicContact CE1-CG2 4.32Å; F364-V512 HydrophobicContact CZ-CG1 4.06Å; F364-R516 VanDerWaalsContact CB-NH1 3.26Å; F364-R516 VanDerWaalsContact CD2-CZ 3.48Å
365	S	85.5	Confident	84	Confident	5 Å²	5	39.7 Å²	39.7	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-40.7	174.9	-57.4	0	0	0	0	111.3	L350 Y357 D361 C368 A369	L350-S365 WeakPolarHBondContact CD1-OG 3.33Å; Y357-S365 PolarHBondContact OH-OG 3.4Å; D361-S365 VanDerWaalsContact O-CB 3.28Å; D361-S365 WeakPolarHBondContact O-CB 3.38Å; D361-S365 PolarHBondContact O-N 2.92Å; D361-S365 PolarHBondContact O-OG 3.26Å; S365-C368 PolarHBondContact O-N 3.21Å; S365-A369 WeakPolarHBondContact O-CB 3.49Å; S365-A369 PolarHBondContact O-N 3.35Å
366	M	89.4	Confident	86	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-47	174.2	167.1	-179.3	78.1	0	0	112.4	L191 V218 A234 V252 F339 F343 A362 I363 F364 C368 A369 W370	L191-M366 HydrophobicContact CD1-CB 4.32Å; L191-M366 HydrophobicContact CD1-CG 4.26Å; L191-M366 HydrophobicContact CD1-SD 4.09Å; V218-M366 HydrophobicContact CB-SD 4.01Å; V218-M366 HydrophobicContact CG1-CG 4.15Å; V218-M366 HydrophobicContact CG1-SD 3.56Å; V218-M366 VanDerWaalsContact CG1-SD 3.56Å; V218-M366 HydrophobicContact CG2-CG 4.29Å; V218-M366 HydrophobicContact CG2-SD 3.2Å; V218-M366 WeakPolarHBondContact CG2-SD 3.41Å; A234-M366 HydrophobicContact CB-CE 3.55Å; A234-M366 HydrophobicContact CB-SD 4.36Å; V252-M366 HydrophobicContact CB-CE 3.87Å; V252-M366 HydrophobicContact CG1-CE 3.44Å; V252-M366 VanDerWaalsContact CG1-CE 3.44Å; V252-M366 HydrophobicContact CG2-CE 3.69Å; F339-M366 HydrophobicContact CE2-CG 4.18Å; F339-M366 HydrophobicContact CZ-CG 3.95Å; F343-M366 HydrophobicContact CD2-CB 4.17Å; F343-M366 HydrophobicContact CE2-CB 4.07Å; A362-M366 WeakPolarHBondContact O-CB 3.39Å; A362-M366 PolarHBondContact O-N 3.4Å; I363-M366 HydrophobicContact CB-CE 4.44Å; I363-M366 HydrophobicContact CG1-CE 4.16Å; I363-M366 WeakPolarHBondContact O-CB 3.42Å; I363-M366 PolarHBondContact O-N 3.49Å; F364-M366 VanDerWaalsContact C-N 3.26Å; F364-M366 PolarHBondContact O-N 3.2Å; M366-C368 VanDerWaalsContact C-N 3.35Å; M366-C368 PolarHBondContact O-N 3.26Å; M366-A369 PolarHBondContact O-N 3.35Å; M366-W370 PolarHBondContact O-N 3.41Å
367	A	91.1	Very high	87.5	Confident	2 Å²	2	26.4 Å²	26.4	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-61.8	-43.7	177.1	0	0	0	0	0	111.8	P251 V252 I363 F364 W370 N371 A509	P251-A367 HydrophobicContact CB-CB 3.7Å; P251-A367 HydrophobicContact CG-CB 3.89Å; V252-A367 HydrophobicContact CG1-CB 3.93Å; I363-A367 PolarHBondContact O-N 2.84Å; F364-A367 PolarHBondContact O-N 3.18Å; A367-W370 PolarHBondContact O-N 3.49Å; A367-N371 VanDerWaalsContact O-CG 3.3Å; A367-N371 PolarHBondContact O-N 2.83Å; A367-N371 PolarHBondContact O-ND2 3.3Å; A367-A509 HydrophobicContact CB-CB 4.04Å
368	C	89	Confident	88.7	Confident	28 Å²	28	23.4 Å²	23.4	19%	0.189	14%	0.137	C	C	.	.	H	α-helix	trans	-61.9	-44.4	175.4	-65.2	0	0	0	0	111.3	F364 S365 M366 W370 N371 A372	F364-C368 WeakPolarHBondContact O-CB 3.38Å; F364-C368 PolarHBondContact O-N 3.11Å; F364-C368 PolarHBondContact O-SG 3.24Å; S365-C368 PolarHBondContact O-N 3.21Å; M366-C368 VanDerWaalsContact C-N 3.35Å; M366-C368 PolarHBondContact O-N 3.26Å; C368-W370 VanDerWaalsContact C-N 3.31Å; C368-W370 PolarHBondContact O-N 3.43Å; C368-N371 PolarHBondContact O-N 3.34Å; C368-A372 VanDerWaalsContact O-CB 3.25Å; C368-A372 WeakPolarHBondContact O-CB 3.32Å; C368-A372 PolarHBondContact O-N 3.38Å
369	A	89.8	Confident	89.4	Confident	1 Å²	1	25 Å²	25	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-60.6	-40.2	179.4	0	0	0	0	0	112.6	F339 N342 F343 S365 M366 I373	F339-A369 HydrophobicContact CD2-CB 3.97Å; F339-A369 HydrophobicContact CE2-CB 3.99Å; N342-A369 HydrophobicContact CB-CB 3.8Å; N342-A369 PolarHBondContact ND2-O 3.44Å; F343-A369 HydrophobicContact CB-CB 3.88Å; S365-A369 WeakPolarHBondContact O-CB 3.49Å; S365-A369 PolarHBondContact O-N 3.35Å; M366-A369 PolarHBondContact O-N 3.35Å; A369-I373 WeakPolarHBondContact O-CG1 3.4Å
370	W	94.8	Very high	89.9	Confident	1 Å²	1	27.9 Å²	27.9	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-67.1	-45.4	176.2	179	-120	0	0	0	112.6	M220 A222 R229 L230 P232 M331 I335 F339 M366 A367 C368 A372 I373 F378	M220-W370 HydrophobicContact CB-CE3 4.2Å; M220-W370 HydrophobicContact CB-CH2 3.84Å; M220-W370 HydrophobicContact CB-CZ2 4.27Å; M220-W370 HydrophobicContact CB-CZ3 3.81Å; M220-W370 HydrophobicContact CG-CD2 4.41Å; M220-W370 HydrophobicContact CG-CE3 4.02Å; M220-W370 HydrophobicContact CG-CZ3 4.1Å; M220-W370 HydrophobicContact SD-CD2 4.36Å; M220-W370 HydrophobicContact SD-CE3 3.51Å; M220-W370 VanDerWaalsContact SD-CE3 3.51Å; M220-W370 HydrophobicContact SD-CZ3 3.71Å; A222-W370 HydrophobicContact CB-CH2 4.11Å; A222-W370 HydrophobicContact CB-CZ2 4.06Å; R229-W370 HydrophobicContact CB-CZ2 3.95Å; R229-W370 HydrophobicContact CG-CZ2 4.32Å; R229-W370 PolarHBondContact NH1-O 3.23Å; L230-W370 PolarHBondContact O-NE1 3.29Å; P232-W370 HydrophobicContact CG-CB 4.06Å; P232-W370 HydrophobicContact CG-CD2 4.43Å; P232-W370 HydrophobicContact CG-CG 3.68Å; M331-W370 HydrophobicContact CE-CH2 4.01Å; M331-W370 HydrophobicContact SD-CH2 4.27Å; M331-W370 HydrophobicContact SD-CZ3 4.5Å; I335-W370 HydrophobicContact CG2-CH2 4.39Å; I335-W370 HydrophobicContact CG2-CZ3 3.8Å; F339-W370 HydrophobicContact CD2-CB 4.23Å; F339-W370 HydrophobicContact CD2-CE3 4.37Å; F339-W370 HydrophobicContact CE2-CB 4.16Å; M366-W370 PolarHBondContact O-N 3.41Å; A367-W370 PolarHBondContact O-N 3.49Å; C368-W370 VanDerWaalsContact C-N 3.31Å; C368-W370 PolarHBondContact O-N 3.43Å; W370-A372 VanDerWaalsContact C-N 3.31Å; W370-A372 PolarHBondContact O-N 2.97Å; W370-I373 HydrophobicContact CE3-CD1 3.58Å; W370-I373 HydrophobicContact CZ3-CD1 3.8Å; W370-I373 PolarHBondContact O-N 3.33Å; W370-F378 AromaticContact CH2-CE1 3.63Å; W370-F378 HydrophobicContact CH2-CE1 3.63Å; W370-F378 AromaticContact CH2-CZ 3.87Å; W370-F378 HydrophobicContact CH2-CZ 3.87Å; W370-F378 HydrophobicContact CZ2-CE1 4.32Å; W370-F378 HydrophobicContact CZ2-CZ 4.4Å; W370-F378 HydrophobicContact CZ3-CE1 4.12Å; W370-F378 HydrophobicContact CZ3-CZ 4.05Å
371	N	91.6	Very high	90.4	Very high	82 Å²	82	27.3 Å²	27.3	44%	0.439	14%	0.144	S	C	.	.	H	α-helix	trans	-68.7	-31	179.9	-68.6	-14.3	0	0	0	112.3	R229 A367 C368 I373	R229-N371 PolarHBondContact NH1-O 3.02Å; R229-N371 VanDerWaalsContact NH1-O 3.14Å; A367-N371 VanDerWaalsContact O-CG 3.3Å; A367-N371 PolarHBondContact O-N 2.83Å; A367-N371 PolarHBondContact O-ND2 3.3Å; C368-N371 PolarHBondContact O-N 3.34Å; N371-I373 PolarHBondContact O-N 3.24Å
372	A	91	Very high	91.1	Very high	43 Å²	43	25.7 Å²	25.7	36%	0.355	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-8.3	-179.4	0	0	0	0	0	114.8	P347 C368 W370 P374	P347-A372 HydrophobicContact CG-CB 4.19Å; C368-A372 VanDerWaalsContact O-CB 3.25Å; C368-A372 WeakPolarHBondContact O-CB 3.32Å; C368-A372 PolarHBondContact O-N 3.38Å; W370-A372 VanDerWaalsContact C-N 3.31Å; W370-A372 PolarHBondContact O-N 2.97Å; A372-P374 WeakPolarHBondContact O-CD 3.17Å
373	I	92.6	Very high	91.4	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.165	C	C	.	.	S	Bend	trans	-69.9	128.8	178.2	-54	175.6	0	0	0	108.7	R229 I335 F339 A369 W370 N371 V377 F378	R229-I373 PolarHBondContact NH1-O 3.01Å; R229-I373 PolarHBondContact NH2-O 3.43Å; I335-I373 HydrophobicContact CG2-CD1 3.95Å; F339-I373 HydrophobicContact CB-CD1 3.81Å; A369-I373 WeakPolarHBondContact O-CG1 3.4Å; W370-I373 HydrophobicContact CE3-CD1 3.58Å; W370-I373 HydrophobicContact CZ3-CD1 3.8Å; W370-I373 PolarHBondContact O-N 3.33Å; N371-I373 PolarHBondContact O-N 3.24Å; I373-V377 HydrophobicContact CG2-CB 3.9Å; I373-V377 HydrophobicContact CG2-CG1 4.05Å; I373-V377 HydrophobicContact CG2-CG2 4.3Å; I373-F378 HydrophobicContact CB-CE2 3.78Å; I373-F378 HydrophobicContact CB-CZ 4.1Å; I373-F378 HydrophobicContact CD1-CZ 4.34Å; I373-F378 HydrophobicContact CG2-CD2 4.16Å; I373-F378 HydrophobicContact CG2-CE2 3.43Å; I373-F378 VanDerWaalsContact CG2-CE2 3.43Å; I373-F378 HydrophobicContact CG2-CZ 3.93Å
374	P	91.9	Very high	91.5	Very high	52 Å²	52	39.1 Å²	39.1	34%	0.338	19%	0.19	S	C	.	.			trans	-71.7	146.1	177.2	-22.6	34.8	0	0	0	112.9	A372 H376 V377 F378	A372-P374 WeakPolarHBondContact O-CD 3.17Å; P374-H376 WeakPolarHBondContact CB-CE1 3.16Å; P374-H376 WeakPolarHBondContact CB-ND1 3.38Å; P374-H376 PolarHBondContact O-N 3.3Å; P374-V377 HydrophobicContact CB-CG2 4.31Å; P374-V377 HydrophobicContact CG-CG2 4.38Å; P374-V377 WeakPolarHBondContact O-CB 3.3Å; P374-V377 PolarHBondContact O-N 3.38Å; P374-F378 WeakPolarHBondContact O-CD2 3.49Å
375	S	91.7	Very high	91.8	Very high	48 Å²	48	38.9 Å²	38.9	34%	0.336	19%	0.189	S	C	.	.	H	α-helix	trans	-60.6	-29.5	-179.4	-57.7	0	0	0	0	113.4	G226 R229 V377 F378 R379	G226-S375 PolarHBondContact O-OG 3.31Å; R229-S375 PolarHBondContact NH2-OG 3.05Å; R229-S375 VanDerWaalsContact NH2-OG 3.17Å; S375-V377 PolarHBondContact O-N 2.78Å; S375-F378 WeakPolarHBondContact O-CB 3.41Å; S375-F378 PolarHBondContact O-N 2.87Å; S375-R379 WeakPolarHBondContact O-CG 3.26Å; S375-R379 PolarHBondContact O-N 3.29Å; S375-R379 VanDerWaalsContact O-N 3.12Å
376	H	91.5	Very high	92.2	Very high	83 Å²	83	39.8 Å²	39.8	38%	0.384	19%	0.191	S	C	.	.	H	α-helix	trans	-62.7	-25.9	174.9	75.2	-106.3	0	0	0	113.1	P374 R380	P374-H376 WeakPolarHBondContact CB-CE1 3.16Å; P374-H376 WeakPolarHBondContact CB-ND1 3.38Å; P374-H376 PolarHBondContact O-N 3.3Å; H376-R380 WeakPolarHBondContact O-CB 3.48Å; H376-R380 PolarHBondContact O-N 3.39Å
377	V	94.3	Very high	91.8	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-42.3	176.4	178.6	0	0	0	0	110	I335 I373 P374 S375 R380 A381	I335-V377 HydrophobicContact CG1-CG1 4.14Å; I373-V377 HydrophobicContact CG2-CB 3.9Å; I373-V377 HydrophobicContact CG2-CG1 4.05Å; I373-V377 HydrophobicContact CG2-CG2 4.3Å; P374-V377 HydrophobicContact CB-CG2 4.31Å; P374-V377 HydrophobicContact CG-CG2 4.38Å; P374-V377 WeakPolarHBondContact O-CB 3.3Å; P374-V377 PolarHBondContact O-N 3.38Å; S375-V377 PolarHBondContact O-N 2.78Å; V377-R380 PolarHBondContact O-N 3.3Å; V377-A381 WeakPolarHBondContact O-CB 2.95Å; V377-A381 PolarHBondContact O-N 2.91Å
378	F	94.8	Very high	90.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-53	174.1	-63.5	-93.5	0	0	0	110	A222 R229 M331 I335 W370 I373 P374 S375 R380 A381 W382	A222-F378 HydrophobicContact CB-CD1 3.65Å; A222-F378 HydrophobicContact CB-CE1 3.43Å; A222-F378 VanDerWaalsContact CB-CE1 3.43Å; A222-F378 HydrophobicContact CB-CZ 4.41Å; R229-F378 HydrophobicContact CG-CZ 4.32Å; M331-F378 HydrophobicContact CE-CE1 4.44Å; I335-F378 HydrophobicContact CD1-CD1 3.54Å; I335-F378 HydrophobicContact CD1-CE1 3.97Å; I335-F378 HydrophobicContact CD1-CG 4.21Å; I335-F378 HydrophobicContact CG1-CD1 4.16Å; I335-F378 HydrophobicContact CG1-CE1 4.35Å; I335-F378 HydrophobicContact CG2-CE1 3.92Å; I335-F378 HydrophobicContact CG2-CZ 4.22Å; W370-F378 AromaticContact CH2-CE1 3.63Å; W370-F378 HydrophobicContact CH2-CE1 3.63Å; W370-F378 AromaticContact CH2-CZ 3.87Å; W370-F378 HydrophobicContact CH2-CZ 3.87Å; W370-F378 HydrophobicContact CZ2-CE1 4.32Å; W370-F378 HydrophobicContact CZ2-CZ 4.4Å; W370-F378 HydrophobicContact CZ3-CE1 4.12Å; W370-F378 HydrophobicContact CZ3-CZ 4.05Å; I373-F378 HydrophobicContact CB-CE2 3.78Å; I373-F378 HydrophobicContact CB-CZ 4.1Å; I373-F378 HydrophobicContact CD1-CZ 4.34Å; I373-F378 HydrophobicContact CG2-CD2 4.16Å; I373-F378 HydrophobicContact CG2-CE2 3.43Å; I373-F378 VanDerWaalsContact CG2-CE2 3.43Å; I373-F378 HydrophobicContact CG2-CZ 3.93Å; P374-F378 WeakPolarHBondContact O-CD2 3.49Å; S375-F378 WeakPolarHBondContact O-CB 3.41Å; S375-F378 PolarHBondContact O-N 2.87Å; F378-R380 VanDerWaalsContact C-N 3.29Å; F378-R380 PolarHBondContact O-N 3.42Å; F378-A381 VanDerWaalsContact O-CB 3.28Å; F378-A381 WeakPolarHBondContact O-CB 3Å; F378-A381 PolarHBondContact O-N 3.45Å; F378-W382 VanDerWaalsContact O-CD1 3.22Å; F378-W382 PolarHBondContact O-N 3.48Å
379	R	92.6	Very high	89.2	Confident	93 Å²	93	47.1 Å²	47.1	35%	0.351	24%	0.24	S	C	.	.	H	α-helix	trans	-51.1	-46.9	176.9	-67.2	-164.7	-79.7	159.2	-1.3	113.2	T225 S375 A381 W382 F391	T225-R379 WeakPolarHBondContact O-CG 3.34Å; S375-R379 WeakPolarHBondContact O-CG 3.26Å; S375-R379 PolarHBondContact O-N 3.29Å; S375-R379 VanDerWaalsContact O-N 3.12Å; R379-A381 VanDerWaalsContact C-N 3.35Å; R379-A381 PolarHBondContact O-N 2.83Å; R379-W382 PolarHBondContact O-N 3.5Å; R379-F391 VanDerWaalsContact CA-CZ 3.47Å; R379-F391 HydrophobicContact CB-CD1 4.37Å; R379-F391 HydrophobicContact CB-CD2 3.66Å; R379-F391 HydrophobicContact CB-CE1 4.09Å; R379-F391 HydrophobicContact CB-CE2 3.32Å; R379-F391 HydrophobicContact CB-CG 4.17Å; R379-F391 HydrophobicContact CB-CZ 3.56Å; R379-F391 HydrophobicContact CG-CD1 3.62Å; R379-F391 HydrophobicContact CG-CD2 3.81Å; R379-F391 HydrophobicContact CG-CE1 3.49Å; R379-F391 VanDerWaalsContact CG-CE1 3.49Å; R379-F391 HydrophobicContact CG-CE2 3.69Å; R379-F391 HydrophobicContact CG-CG 3.79Å; R379-F391 HydrophobicContact CG-CZ 3.51Å; R379-F391 WeakPolarHBondContact O-CE2 3.41Å
380	R	93.1	Very high	87.2	Confident	92 Å²	92	52.7 Å²	52.7	35%	0.347	27%	0.274	S	S	.	.	H	α-helix	trans	-64.9	-36.2	177.7	178.5	172.3	66.5	-164.8	-6	112.9	H376 V377 F378 W382 R383	H376-R380 WeakPolarHBondContact O-CB 3.48Å; H376-R380 PolarHBondContact O-N 3.39Å; V377-R380 PolarHBondContact O-N 3.3Å; F378-R380 VanDerWaalsContact C-N 3.29Å; F378-R380 PolarHBondContact O-N 3.42Å; R380-W382 PolarHBondContact O-N 3.11Å; R380-R383 WeakPolarHBondContact O-CB 3.09Å; R380-R383 WeakPolarHBondContact O-CG 3.25Å; R380-R383 PolarHBondContact O-N 3.37Å; R380-R383 VanDerWaalsContact O-N 3.16Å
381	A	94.1	Very high	85.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-29.8	-177.2	0	0	0	0	0	112.9	P330 Q333 I335 V377 F378 R379	P330-A381 HydrophobicContact CB-CB 4.29Å; P330-A381 WeakPolarHBondContact O-CB 3.22Å; Q333-A381 HydrophobicContact CB-CB 3.96Å; Q333-A381 WeakPolarHBondContact CB-O 3.44Å; I335-A381 HydrophobicContact CD1-CB 3.74Å; I335-A381 HydrophobicContact CG1-CB 3.94Å; V377-A381 WeakPolarHBondContact O-CB 2.95Å; V377-A381 PolarHBondContact O-N 2.91Å; F378-A381 VanDerWaalsContact O-CB 3.28Å; F378-A381 WeakPolarHBondContact O-CB 3Å; F378-A381 PolarHBondContact O-N 3.45Å; R379-A381 VanDerWaalsContact C-N 3.35Å; R379-A381 PolarHBondContact O-N 2.83Å
382	W	95.1	Very high	83.1	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.008	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-79.9	-12.5	179	-71.9	87.4	0	0	0	114.4	F169 V183 N185 A224 L297 P330 F378 R379 R380 K384 L385 W386	F169-W382 HydrophobicContact CZ-CZ3 4.34Å; V183-W382 HydrophobicContact CB-CH2 4.37Å; V183-W382 HydrophobicContact CG1-CH2 3.37Å; V183-W382 HydrophobicContact CG1-CZ2 4.29Å; V183-W382 HydrophobicContact CG1-CZ3 3.5Å; N185-W382 HydrophobicContact CB-CH2 3.85Å; N185-W382 HydrophobicContact CB-CZ2 3.58Å; A224-W382 VanDerWaalsContact CA-NE1 3.31Å; A224-W382 HydrophobicContact CB-CD2 3.69Å; A224-W382 HydrophobicContact CB-CE3 4.31Å; A224-W382 HydrophobicContact CB-CG 3.8Å; A224-W382 HydrophobicContact CB-CZ2 4.11Å; L297-W382 HydrophobicContact CD2-CH2 4.26Å; L297-W382 HydrophobicContact CD2-CZ3 4.21Å; P330-W382 HydrophobicContact CB-CD2 3.96Å; P330-W382 HydrophobicContact CB-CG 4.25Å; P330-W382 HydrophobicContact CB-CZ2 4.04Å; P330-W382 HydrophobicContact CG-CD2 3.5Å; P330-W382 VanDerWaalsContact CG-CE2 3.48Å; P330-W382 HydrophobicContact CG-CE3 3.67Å; P330-W382 HydrophobicContact CG-CG 4.16Å; P330-W382 HydrophobicContact CG-CH2 3.82Å; P330-W382 HydrophobicContact CG-CZ2 3.69Å; P330-W382 HydrophobicContact CG-CZ3 3.81Å; F378-W382 VanDerWaalsContact O-CD1 3.22Å; F378-W382 PolarHBondContact O-N 3.48Å; R379-W382 PolarHBondContact O-N 3.5Å; R380-W382 PolarHBondContact O-N 3.11Å; W382-K384 PolarHBondContact O-N 3.15Å; W382-K384 VanDerWaalsContact O-N 3.08Å; W382-L385 HydrophobicContact CE3-CD2 3.97Å; W382-L385 HydrophobicContact CZ3-CD2 3.72Å; W382-L385 PolarHBondContact O-N 2.97Å; W382-W386 PolarHBondContact O-N 2.78Å
383	R	91.4	Very high	80.7	Confident	160 Å²	160	61.9 Å²	61.9	60%	0.604	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-56.1	-32.6	-173.5	-71.1	-179.5	-164.6	167.7	2.5	114.4	R380 P387	R380-R383 WeakPolarHBondContact O-CB 3.09Å; R380-R383 WeakPolarHBondContact O-CG 3.25Å; R380-R383 PolarHBondContact O-N 3.37Å; R380-R383 VanDerWaalsContact O-N 3.16Å; R383-P387 WeakPolarHBondContact O-CB 3.47Å; R383-P387 VanDerWaalsContact O-CG 3.25Å; R383-P387 WeakPolarHBondContact O-CG 3.34Å
384	K	91	Very high	77.9	Confident	121 Å²	121	65.3 Å²	65.3	53%	0.526	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-73.4	-38.5	179	-71.6	-173	179.5	173.1	0	112.6	C166 L327 V328 Q333 W382	C166-K384 PolarHBondContact SG-O 2.96Å; L327-K384 VanDerWaalsContact O-CD 3.24Å; L327-K384 WeakPolarHBondContact O-CD 3.28Å; L327-K384 PolarHBondContact O-NZ 2.74Å; V328-K384 HydrophobicContact CG1-CB 4.46Å; Q333-K384 HydrophobicContact CG-CD 4.41Å; W382-K384 PolarHBondContact O-N 3.15Å; W382-K384 VanDerWaalsContact O-N 3.08Å
385	L	92.6	Very high	75	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-42.5	-176.8	179.7	61.8	0	0	0	111.9	F165 F169 L297 V328 P330 W382	F165-L385 HydrophobicContact CD1-CD1 3.69Å; F165-L385 HydrophobicContact CE1-CD1 3.7Å; F169-L385 HydrophobicContact CB-CD1 4.22Å; F169-L385 HydrophobicContact CD1-CD1 4.35Å; F169-L385 HydrophobicContact CD1-CD2 4.4Å; F169-L385 HydrophobicContact CD1-CG 4.02Å; F169-L385 HydrophobicContact CE1-CG 4.47Å; F169-L385 HydrophobicContact CG-CD1 4.25Å; F169-L385 HydrophobicContact CG-CG 4.34Å; L297-L385 HydrophobicContact CD2-CD2 3.31Å; V328-L385 HydrophobicContact CB-CB 4.41Å; V328-L385 HydrophobicContact CG2-CD1 4.21Å; P330-L385 HydrophobicContact CG-CD2 4.33Å; W382-L385 HydrophobicContact CE3-CD2 3.97Å; W382-L385 HydrophobicContact CZ3-CD2 3.72Å; W382-L385 PolarHBondContact O-N 2.97Å
386	W	92.4	Very high	72.8	Confident	24 Å²	24	71.9 Å²	71.9	9%	0.091	41%	0.405	C	S	.	.			trans	-140.4	76.4	-173	-165.5	20	0	0	0	111.4	F169 A173 L178 P180 V183 W382 S388 V389	F169-W386 HydrophobicContact CD1-CB 4.26Å; F169-W386 HydrophobicContact CD1-CG 4.35Å; F169-W386 HydrophobicContact CE1-CB 4.04Å; F169-W386 AromaticContact CE1-CD2 3.94Å; F169-W386 HydrophobicContact CE1-CD2 3.94Å; F169-W386 AromaticContact CE1-CE3 3.99Å; F169-W386 HydrophobicContact CE1-CE3 3.99Å; F169-W386 AromaticContact CE1-CG 3.98Å; F169-W386 HydrophobicContact CE1-CG 3.98Å; A173-W386 HydrophobicContact CB-CH2 4.48Å; A173-W386 HydrophobicContact CB-CZ2 3.86Å; L178-W386 VanDerWaalsContact O-CH2 3.28Å; L178-W386 WeakPolarHBondContact O-CH2 3.45Å; L178-W386 WeakPolarHBondContact O-CZ2 3.47Å; P180-W386 HydrophobicContact CB-CZ3 4.43Å; P180-W386 HydrophobicContact CG-CH2 4.22Å; P180-W386 HydrophobicContact CG-CZ3 4.27Å; V183-W386 HydrophobicContact CB-CZ3 4.24Å; V183-W386 HydrophobicContact CG2-CE3 4.5Å; V183-W386 HydrophobicContact CG2-CH2 4.21Å; V183-W386 HydrophobicContact CG2-CZ3 3.7Å; W382-W386 PolarHBondContact O-N 2.78Å; W386-S388 VanDerWaalsContact C-N 3.31Å; W386-S388 PolarHBondContact O-N 2.75Å; W386-V389 HydrophobicContact CB-CG2 4.34Å; W386-V389 HydrophobicContact CD2-CG2 3.23Å; W386-V389 HydrophobicContact CE3-CG2 3.35Å; W386-V389 HydrophobicContact CG-CG2 3.7Å; W386-V389 HydrophobicContact CH2-CG2 4.05Å; W386-V389 HydrophobicContact CZ2-CG2 3.97Å; W386-V389 HydrophobicContact CZ3-CG2 3.76Å
387	P	81	Confident	70.1	Confident	78 Å²	78	72.5 Å²	72.5	51%	0.506	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-27.7	-175.2	-10.7	20.6	0	0	0	114.1	R383 V389	R383-P387 WeakPolarHBondContact O-CB 3.47Å; R383-P387 VanDerWaalsContact O-CG 3.25Å; R383-P387 WeakPolarHBondContact O-CG 3.34Å; P387-V389 PolarHBondContact O-N 3.34Å
388	S	64.9	Low	67.3	Low	89 Å²	89	81.1 Å²	81.1	62%	0.622	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-3.4	-175.9	-48.2	0	0	0	0	114	W386 V390	W386-S388 VanDerWaalsContact C-N 3.31Å; W386-S388 PolarHBondContact O-N 2.75Å; S388-V390 PolarHBondContact O-N 2.82Å
389	V	60.2	Low	64.7	Low	17 Å²	17	89.8 Å²	89.8	10%	0.103	50%	0.499	C	S	.	.			trans	-75.3	80.2	171.2	-172.6	0	0	0	0	109	P180 W386 P387 F391	P180-V389 HydrophobicContact CB-CG1 3.89Å; P180-V389 HydrophobicContact CG-CB 4.23Å; P180-V389 HydrophobicContact CG-CG1 3.2Å; P180-V389 HydrophobicContact CG-CG2 3.97Å; W386-V389 HydrophobicContact CB-CG2 4.34Å; W386-V389 HydrophobicContact CD2-CG2 3.23Å; W386-V389 HydrophobicContact CE3-CG2 3.35Å; W386-V389 HydrophobicContact CG-CG2 3.7Å; W386-V389 HydrophobicContact CH2-CG2 4.05Å; W386-V389 HydrophobicContact CZ2-CG2 3.97Å; W386-V389 HydrophobicContact CZ3-CG2 3.76Å; P387-V389 PolarHBondContact O-N 3.34Å; V389-F391 HydrophobicContact CB-CE2 4.03Å; V389-F391 HydrophobicContact CB-CZ 4.07Å; V389-F391 HydrophobicContact CG1-CD1 3.65Å; V389-F391 HydrophobicContact CG1-CD2 3.8Å; V389-F391 HydrophobicContact CG1-CE1 3.35Å; V389-F391 HydrophobicContact CG1-CE2 3.51Å; V389-F391 HydrophobicContact CG1-CG 3.86Å; V389-F391 HydrophobicContact CG1-CZ 3.29Å; V389-F391 WeakPolarHBondContact O-CD2 3.26Å; V389-F391 PolarHBondContact O-N 3.36Å
390	V	49.7	Very low	61.8	Low	118 Å²	118	94.2 Å²	94.2	72%	0.715	52%	0.524	S	S	*	.			trans	-70.5	92.4	158.3	-176.4	0	0	0	0	105.4	S388 A392	S388-V390 PolarHBondContact O-N 2.82Å; V390-A392 PolarHBondContact O-N 3.21Å
391	F	58.6	Low	58.8	Low	44 Å²	44	95.9 Å²	95.9	19%	0.193	54%	0.544	C	S	.	.			trans	-58.9	111.2	164.8	-57.7	-84.6	0	0	0	105.8	P180 A224 T225 R379 V389 E393	P180-F391 HydrophobicContact CB-CE1 3.99Å; P180-F391 HydrophobicContact CG-CE1 4.43Å; A224-F391 WeakPolarHBondContact O-CZ 3.42Å; T225-F391 HydrophobicContact CG2-CD1 4.06Å; T225-F391 HydrophobicContact CG2-CE1 3.84Å; R379-F391 VanDerWaalsContact CA-CZ 3.47Å; R379-F391 HydrophobicContact CB-CD1 4.37Å; R379-F391 HydrophobicContact CB-CD2 3.66Å; R379-F391 HydrophobicContact CB-CE1 4.09Å; R379-F391 HydrophobicContact CB-CE2 3.32Å; R379-F391 HydrophobicContact CB-CG 4.17Å; R379-F391 HydrophobicContact CB-CZ 3.56Å; R379-F391 HydrophobicContact CG-CD1 3.62Å; R379-F391 HydrophobicContact CG-CD2 3.81Å; R379-F391 HydrophobicContact CG-CE1 3.49Å; R379-F391 VanDerWaalsContact CG-CE1 3.49Å; R379-F391 HydrophobicContact CG-CE2 3.69Å; R379-F391 HydrophobicContact CG-CG 3.79Å; R379-F391 HydrophobicContact CG-CZ 3.51Å; R379-F391 WeakPolarHBondContact O-CE2 3.41Å; V389-F391 HydrophobicContact CB-CE2 4.03Å; V389-F391 HydrophobicContact CB-CZ 4.07Å; V389-F391 HydrophobicContact CG1-CD1 3.65Å; V389-F391 HydrophobicContact CG1-CD2 3.8Å; V389-F391 HydrophobicContact CG1-CE1 3.35Å; V389-F391 HydrophobicContact CG1-CE2 3.51Å; V389-F391 HydrophobicContact CG1-CG 3.86Å; V389-F391 HydrophobicContact CG1-CZ 3.29Å; V389-F391 WeakPolarHBondContact O-CD2 3.26Å; V389-F391 PolarHBondContact O-N 3.36Å; F391-E393 PolarHBondContact O-N 3.41Å; F391-E393 VanDerWaalsContact O-N 3.08Å
392	A	40.4	Very low	55.8	Low	92 Å²	92	104.3 Å²	104.3	76%	0.76	58%	0.583	S	S	*	*			trans	-43.2	120.2	-174.6	0	0	0	0	0	110.8	V390 G394	V390-A392 PolarHBondContact O-N 3.21Å; A392-G394 PolarHBondContact O-N 3.42Å
393	E	41.4	Very low	52.7	Low	183 Å²	183	108.8 Å²	108.8	86%	0.855	62%	0.621	S	S	*	*			trans	-63.8	115.7	176.3	-74.9	177.8	171.1	0	0	109	F391	F391-E393 PolarHBondContact O-N 3.41Å; F391-E393 VanDerWaalsContact O-N 3.08Å
394	G	33.8	Very low	49.8	Very low	73 Å²	73	109.4 Å²	109.4	75%	0.753	63%	0.631	S	S	*	*			trans	-125	115.4	165.1	0	0	0	0	0	107.9	A392	A392-G394 PolarHBondContact O-N 3.42Å
395	S	30.5	Very low	46.9	Very low	111 Å²	111	112.3 Å²	112.3	78%	0.776	65%	0.646	S	S	*	*			trans	78.6	84.3	177.7	-152.3	0	0	0	0	116.5	S397	S395-S397 PolarHBondContact O-N 3.44Å; S395-S397 VanDerWaalsContact O-N 3.13Å
396	S	45.5	Very low	43.9	Very low	127 Å²	127	122 Å²	122	89%	0.888	69%	0.688	S	S	*	*			trans	-48.9	106	147.7	173	0	0	0	0	109.9
397	S	34.3	Very low	40.7	Very low	97 Å²	97	129.6 Å²	129.6	68%	0.678	73%	0.725	S	S	*	*			trans	173.4	41.2	147	65.6	0	0	0	0	113.5	S395	S395-S397 PolarHBondContact O-N 3.44Å; S395-S397 VanDerWaalsContact O-N 3.13Å
398	E	36.5	Very low	38.2	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	73%	0.731	S	S	*	*			trans	-141.1	4.1	167.9	-69.5	-167	171.8	0	0	114.2	E400	E398-E400 VanDerWaalsContact C-N 3.27Å; E398-E400 PolarHBondContact O-N 3.19Å
399	E	40.1	Very low	36.4	Very low	183 Å²	183	133.8 Å²	133.8	86%	0.855	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	66.1	173.4	-66.7	-162.9	153.9	0	0	111
400	E	30.6	Very low	34.9	Very low	186 Å²	186	137.8 Å²	137.8	87%	0.869	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.2	-4.2	159.4	-113.9	167	-156.1	0	0	116.2	E398	E398-E400 VanDerWaalsContact C-N 3.27Å; E398-E400 PolarHBondContact O-N 3.19Å
401	V	30.7	Very low	34.1	Very low	126 Å²	126	140.1 Å²	140.1	76%	0.764	77%	0.767	S	S	*	*	S	Bend	trans	-97.7	-12.1	-169.6	-170.1	0	0	0	0	115.6
402	E	30.8	Very low	33	Very low	178 Å²	178	143.2 Å²	143.2	83%	0.832	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-96.5	1.7	-176.7	-76.3	-164.5	156.9	0	0	116	E404	E402-E404 VanDerWaalsContact C-N 3.31Å; E402-E404 PolarHBondContact O-N 2.89Å
403	A	30.6	Very low	32.7	Very low	97 Å²	97	144 Å²	144	80%	0.802	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-78	-8.8	175.7	0	0	0	0	0	114.2
404	E	31.4	Very low	32.7	Very low	173 Å²	173	138 Å²	138	81%	0.808	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-114	11.2	-172.6	-71.9	-148.4	149.5	0	0	117.1	E402	E402-E404 VanDerWaalsContact C-N 3.31Å; E402-E404 PolarHBondContact O-N 2.89Å
405	H	29	Very low	32.9	Very low	182 Å²	182	136.6 Å²	136.6	84%	0.843	73%	0.733	S	S	*	*			trans	-113.9	12.4	177	-115.4	70.1	0	0	0	116.9	Q407	H405-Q407 VanDerWaalsContact C-N 3.34Å; H405-Q407 PolarHBondContact O-N 3.48Å
406	F	29.1	Very low	33.4	Very low	204 Å²	204	134.3 Å²	134.3	90%	0.895	72%	0.721	S	S	*	*			trans	-95	60.7	162.2	-114.4	-90.2	0	0	0	111	A408	F406-A408 PolarHBondContact O-N 3.41Å
407	Q	26.6	Very low	33.2	Very low	183 Å²	183	132.4 Å²	132.4	86%	0.855	70%	0.697	S	S	*	*			trans	-68.9	88.1	153.5	-80.7	-166.3	2.6	0	0	107.9	H405 K409	H405-Q407 VanDerWaalsContact C-N 3.34Å; H405-Q407 PolarHBondContact O-N 3.48Å; Q407-K409 PolarHBondContact O-N 3.39Å
408	A	28	Very low	33.7	Very low	78 Å²	78	128.8 Å²	128.8	65%	0.645	67%	0.67	S	S	*	*			trans	-51.9	111	154.8	0	0	0	0	0	107	F406 P410	F406-A408 PolarHBondContact O-N 3.41Å; A408-P410 WeakPolarHBondContact O-CD 3.4Å; A408-P410 VanDerWaalsContact O-N 3.08Å
409	K	25.8	Very low	33.8	Very low	176 Å²	176	125.2 Å²	125.2	77%	0.765	66%	0.657	S	S	*	*			trans	-46.4	120.9	167.9	-78.5	-179.5	176.3	178.1	0	107.7	Q407 H411	Q407-K409 PolarHBondContact O-N 3.39Å; K409-H411 VanDerWaalsContact C-N 3.26Å; K409-H411 PolarHBondContact O-N 3.18Å
410	P	28.8	Very low	33.9	Very low	102 Å²	102	121.5 Å²	121.5	66%	0.662	64%	0.639	S	S	*	*			trans	-74.8	85.4	-179.8	29.9	-32.1	0	0	0	108.3	A408 N412	A408-P410 WeakPolarHBondContact O-CD 3.4Å; A408-P410 VanDerWaalsContact O-N 3.08Å; P410-N412 PolarHBondContact O-N 3.35Å
411	H	34.7	Very low	34.3	Very low	166 Å²	166	116.5 Å²	116.5	77%	0.769	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	74.2	158.2	-76.1	-73.9	0	0	0	108.2	K409	K409-H411 VanDerWaalsContact C-N 3.26Å; K409-H411 PolarHBondContact O-N 3.18Å
412	N	34.5	Very low	34.8	Very low	109 Å²	109	114.8 Å²	114.8	58%	0.583	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.2	11.7	166.2	-103.8	-12.3	0	0	0	114.8	P410 S414 F415	P410-N412 PolarHBondContact O-N 3.35Å; N412-S414 PolarHBondContact O-N 2.99Å; N412-F415 PolarHBondContact O-N 3.18Å
413	T	34.8	Very low	35.1	Very low	110 Å²	110	114.5 Å²	114.5	68%	0.675	60%	0.604	S	S	*	*	H	α-helix	trans	-63.4	-21.7	173.1	36	0	0	0	0	113.4	F415 H417	T413-F415 VanDerWaalsContact C-N 3.33Å; T413-F415 PolarHBondContact O-N 2.97Å; T413-H417 WeakPolarHBondContact O-CB 3.28Å
414	S	41.4	Very low	35.3	Very low	55 Å²	55	116.7 Å²	116.7	39%	0.385	60%	0.597	S	S	.	*	H	α-helix	trans	-67.1	-31.6	175.6	-170.5	0	0	0	0	113	N412 I418	N412-S414 PolarHBondContact O-N 2.99Å; S414-I418 WeakPolarHBondContact O-CD1 3.46Å; S414-I418 VanDerWaalsContact O-CG1 3.29Å; S414-I418 WeakPolarHBondContact O-CG1 3.45Å; S414-I418 PolarHBondContact O-N 3.34Å
415	F	37.9	Very low	35.4	Very low	45 Å²	45	111.7 Å²	111.7	20%	0.197	59%	0.592	C	S	.	*	H	α-helix	trans	-85	-36.7	-171.5	-135.7	-101.6	0	0	0	113.5	F66 N412 T413 H417 I418 L419	F66-F415 HydrophobicContact CE1-CE1 4.11Å; F66-F415 HydrophobicContact CE1-CZ 4.15Å; F66-F415 HydrophobicContact CE2-CZ 4.05Å; F66-F415 AromaticContact CZ-CE1 3.65Å; F66-F415 HydrophobicContact CZ-CE1 3.65Å; F66-F415 HydrophobicContact CZ-CE2 4.35Å; F66-F415 AromaticContact CZ-CZ 3.33Å; F66-F415 HydrophobicContact CZ-CZ 3.33Å; N412-F415 PolarHBondContact O-N 3.18Å; T413-F415 VanDerWaalsContact C-N 3.33Å; T413-F415 PolarHBondContact O-N 2.97Å; F415-H417 VanDerWaalsContact C-N 3.29Å; F415-I418 PolarHBondContact O-N 3.48Å; F415-L419 PolarHBondContact O-N 2.99Å
416	A	41.3	Very low	35.7	Very low	63 Å²	63	108 Å²	108	52%	0.521	59%	0.587	S	S	.	*	H	α-helix	trans	-62.4	-40.4	172.1	0	0	0	0	0	110.9	I418 L419 E420	A416-I418 VanDerWaalsContact C-N 3.32Å; A416-I418 PolarHBondContact O-N 3.32Å; A416-L419 PolarHBondContact O-N 2.94Å; A416-E420 PolarHBondContact O-N 3.01Å; A416-E420 VanDerWaalsContact O-N 3.16Å
417	H	41.1	Very low	35.5	Very low	86 Å²	86	103.9 Å²	103.9	40%	0.398	58%	0.584	S	S	.	*	H	α-helix	trans	-66.8	-28.8	178.9	-151.5	-125.7	0	0	0	113.1	T413 F415 E420 L421	T413-H417 WeakPolarHBondContact O-CB 3.28Å; F415-H417 VanDerWaalsContact C-N 3.29Å; H417-E420 IonicContact CD2-OE2 3.64Å; H417-E420 PolarHBondContact O-N 2.78Å; H417-L421 VanDerWaalsContact O-CG 3.28Å; H417-L421 WeakPolarHBondContact O-CG 3.17Å; H417-L421 PolarHBondContact O-N 3.34Å
418	I	43.3	Very low	35.5	Very low	21 Å²	21	100.9 Å²	100.9	11%	0.108	58%	0.581	C	S	.	*	H	α-helix	trans	-70.8	-36.4	175.1	-70.6	163.5	0	0	0	111.7	I26 S414 F415 A416 E420	I26-I418 HydrophobicContact CG2-CD1 4.16Å; S414-I418 WeakPolarHBondContact O-CD1 3.46Å; S414-I418 VanDerWaalsContact O-CG1 3.29Å; S414-I418 WeakPolarHBondContact O-CG1 3.45Å; S414-I418 PolarHBondContact O-N 3.34Å; F415-I418 PolarHBondContact O-N 3.48Å; A416-I418 VanDerWaalsContact C-N 3.32Å; A416-I418 PolarHBondContact O-N 3.32Å; I418-E420 VanDerWaalsContact C-N 3.31Å
419	L	38.7	Very low	35.7	Very low	107 Å²	107	103.4 Å²	103.4	56%	0.56	59%	0.591	S	S	*	*	H	α-helix	trans	-72	-29.1	174.7	-71.7	169.7	0	0	0	112.1	F415 A416	F415-L419 PolarHBondContact O-N 2.99Å; A416-L419 PolarHBondContact O-N 2.94Å
420	E	42.6	Very low	35.6	Very low	105 Å²	105	98.8 Å²	98.8	49%	0.491	59%	0.594	S	S	.	*	H	α-helix	trans	-71.5	-43.5	176.4	-147.7	165.2	-156.3	0	0	111.6	A416 H417 I418 V422 K423 E424	A416-E420 PolarHBondContact O-N 3.01Å; A416-E420 VanDerWaalsContact O-N 3.16Å; H417-E420 IonicContact CD2-OE2 3.64Å; H417-E420 PolarHBondContact O-N 2.78Å; I418-E420 VanDerWaalsContact C-N 3.31Å; E420-V422 PolarHBondContact O-N 3.02Å; E420-V422 VanDerWaalsContact O-N 3.13Å; E420-K423 PolarHBondContact O-N 3.48Å; E420-E424 PolarHBondContact O-N 3.42Å; E420-E424 VanDerWaalsContact O-N 3.14Å
421	L	39.9	Very low	35.5	Very low	80 Å²	80	102.5 Å²	102.5	42%	0.419	60%	0.602	S	S	.	*	H	α-helix	trans	-60.6	-22.8	175.8	-75.1	166.6	0	0	0	114.4	H417	H417-L421 VanDerWaalsContact O-CG 3.28Å; H417-L421 WeakPolarHBondContact O-CG 3.17Å; H417-L421 PolarHBondContact O-N 3.34Å
422	V	41.1	Very low	35	Very low	91 Å²	91	101.8 Å²	101.8	55%	0.552	60%	0.603	S	S	*	*	H	α-helix	trans	-83.9	-25.6	175.4	175.3	0	0	0	0	111.8	E420	E420-V422 PolarHBondContact O-N 3.02Å; E420-V422 VanDerWaalsContact O-N 3.13Å
423	K	37.1	Very low	34.5	Very low	171 Å²	171	106.4 Å²	106.4	74%	0.743	61%	0.612	S	S	*	*	H	α-helix	trans	-79.6	-30.5	175.3	-74.4	179.5	175.3	179.8	0	112.4	E420 G425	E420-K423 PolarHBondContact O-N 3.48Å; K423-G425 VanDerWaalsContact C-N 3.28Å; K423-G425 PolarHBondContact O-N 2.88Å
424	E	34.7	Very low	34.1	Very low	143 Å²	143	107.5 Å²	107.5	67%	0.668	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-8.9	-178.3	-70	-177.1	162.3	0	0	114.7	E420 S426	E420-E424 PolarHBondContact O-N 3.42Å; E420-E424 VanDerWaalsContact O-N 3.14Å; E424-S426 PolarHBondContact O-N 3.5Å
425	G	33.4	Very low	33.3	Very low	68 Å²	68	113.7 Å²	113.7	70%	0.701	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-1.2	176.4	0	0	0	0	0	115.6	K423	K423-G425 VanDerWaalsContact C-N 3.28Å; K423-G425 PolarHBondContact O-N 2.88Å
426	S	34.1	Very low	32.7	Very low	105 Å²	105	119.2 Å²	119.2	73%	0.734	65%	0.651	S	S	*	*	S	Bend	trans	-138.2	74.3	-172	-59.9	0	0	0	0	112.1	E424	E424-S426 PolarHBondContact O-N 3.5Å
427	S	26.5	Very low	31.9	Very low	118 Å²	118	120.2 Å²	120.2	83%	0.825	66%	0.66	S	S	*	*			trans	-176	128.6	144.8	-166.2	0	0	0	0	112.4
428	C	25.1	Very low	31.2	Very low	119 Å²	119	121.4 Å²	121.4	80%	0.804	68%	0.684	S	S	*	*			trans	-78.2	167	162.6	-86.8	0	0	0	0	111.5
429	P	33	Very low	30.3	Very low	132 Å²	132	123.3 Å²	123.3	86%	0.857	71%	0.709	S	S	*	*			trans	-102.2	153.9	-152.4	37.2	-32.2	0	0	0	115.5
430	G	24.2	Very low	29.6	Very low	79 Å²	79	130.6 Å²	130.6	81%	0.814	73%	0.729	S	S	*	*			trans	-148.6	130.6	168.5	0	0	0	0	0	111.5
431	Q	26.1	Very low	28.7	Very low	179 Å²	179	128.7 Å²	128.7	84%	0.836	74%	0.737	S	S	*	*			trans	-66.4	152.7	-166.5	-67.5	157.4	-47.4	0	0	116.4
432	L	23.2	Very low	28.1	Very low	151 Å²	151	131.6 Å²	131.6	79%	0.791	76%	0.758	S	S	*	*				157.6	116.7	109.6	-100.8	117.6	0	0	0	113.3
433	R	25.3	Very low	27.4	Very low	206 Å²	206	132 Å²	132	78%	0.777	77%	0.771	S	S	*	*				29.7	142.4	126.9	-98.4	-172.9	-177.2	-157.7	5.4	118.8
434	Q	26.1	Very low	26.7	Very low	134 Å²	134	127 Å²	127	63%	0.626	77%	0.768	S	S	*	*			cis	-177.4	136.6	39.7	-146	165.9	-32	0	0	111.8
435	R	24.5	Very low	26.4	Very low	185 Å²	185	131.7 Å²	131.7	70%	0.698	78%	0.78	S	S	*	*			trans	51.9	135.5	134.2	-72.2	-174.8	173	-144	1.3	125.6
436	Q	25.4	Very low	26	Very low	161 Å²	161	137.8 Å²	137.8	75%	0.752	79%	0.79	S	S	*	*				67.6	156.8	128.5	-69.8	177.2	-31.4	0	0	119.4
437	A	24.2	Very low	25.7	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	79%	0.789	S	S	*	*			cis	175.1	160.1	-21	0	0	0	0	0	106.7
438	A	26.6	Very low	25.7	Very low	111 Å²	111	140.9 Å²	140.9	92%	0.917	80%	0.795	S	S	*	*			trans	67.5	149.2	162.5	0	0	0	0	0	117.2
439	G	24	Very low	25.6	Very low	61 Å²	61	139.1 Å²	139.1	63%	0.629	80%	0.797	S	S	*	*			cis	140.9	138.9	10.6	0	0	0	0	0	108.9
440	W	25	Very low	25.1	Very low	260 Å²	260	137 Å²	137	99%	0.985	80%	0.798	S	S	*	*			trans	162.7	129.4	157.7	-94.7	-42.8	0	0	0	107.4
441	G	22.9	Very low	25.2	Very low	64 Å²	64	142.2 Å²	142.2	66%	0.66	80%	0.802	S	S	*	*			cis	79.5	126.3	40.1	0	0	0	0	0	109.2
442	V	26.6	Very low	25.8	Very low	141 Å²	141	138.8 Å²	138.8	86%	0.855	80%	0.795	S	S	*	*			cis	-175.6	153.5	33.3	155.9	0	0	0	0	109.3
443	A	26.3	Very low	26.3	Very low	100 Å²	100	137.6 Å²	137.6	83%	0.826	80%	0.797	S	S	*	*			trans	22.5	158.7	148.4	0	0	0	0	0	122.9
444	G	24.1	Very low	26.4	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	80%	0.8	S	S	*	*			cis	146.9	151.4	10.6	0	0	0	0	0	110.6
445	R	27.5	Very low	26.4	Very low	242 Å²	242	131.2 Å²	131.2	91%	0.913	81%	0.811	S	S	*	*			trans	159.8	115.1	158.6	-93.8	174.9	-164.8	-130.9	2.5	109.4
446	E	25.9	Very low	26.4	Very low	195 Å²	195	128.7 Å²	128.7	91%	0.911	82%	0.816	S	S	*	*				54.9	136.8	78.7	-70.9	-171.5	173	0	0	115.2
447	A	26.9	Very low	26.3	Very low	87 Å²	87	129.1 Å²	129.1	72%	0.719	82%	0.822	S	S	*	*			cis	-174.3	177.1	-7.9	0	0	0	0	0	110.2
448	E	26	Very low	26.5	Very low	201 Å²	201	130.5 Å²	130.5	94%	0.939	83%	0.825	S	S	*	*			trans	72.4	143.1	166.7	-54.7	-155.5	148.5	0	0	120.1
449	G	24	Very low	26.5	Very low	83 Å²	83	130 Å²	130	86%	0.856	82%	0.82	S	S	*	*			cis	156.5	138	0.6	0	0	0	0	0	109.9
450	G	23.2	Very low	26.6	Very low	86 Å²	86	136.6 Å²	136.6	89%	0.887	83%	0.834	S	S	*	*			trans	149.2	123.8	166.2	0	0	0	0	0	118.3
451	Q	25.3	Very low	26.7	Very low	189 Å²	189	130.5 Å²	130.5	88%	0.883	83%	0.826	S	S	*	*			trans	-141.1	174.3	169.2	-132.9	-175.3	-21.3	0	0	106.8
452	P	39.3	Very low	26.8	Very low	107 Å²	107	133.8 Å²	133.8	70%	0.695	83%	0.833	S	S	*	*			cis	-133	-150.6	-11	44.5	-23.2	0	0	0	110.7
453	P	34	Very low	26.7	Very low	127 Å²	127	138.3 Å²	138.3	83%	0.825	84%	0.835	S	S	*	*			cis	-141.7	176.4	49.1	35	-10.4	0	0	0	117.5
454	A	26.9	Very low	26.6	Very low	103 Å²	103	136.6 Å²	136.6	85%	0.851	83%	0.827	S	S	*	*			trans	-97.1	165.9	-172.6	0	0	0	0	0	114.9
455	A	25.6	Very low	26.8	Very low	103 Å²	103	139.3 Å²	139.3	85%	0.851	84%	0.835	S	S	*	*			trans	-133.9	145.3	167.2	0	0	0	0	0	111.9
456	T	25.5	Very low	26.7	Very low	131 Å²	131	137 Å²	137	80%	0.804	84%	0.835	S	S	*	*			trans	-98	151.5	-162.1	-42.5	0	0	0	0	113.3
457	L	23.4	Very low	27	Very low	170 Å²	170	137.1 Å²	137.1	89%	0.89	83%	0.832	S	S	*	*			trans	-141.1	157.7	155.7	-77.5	-178.9	0	0	0	111.4
458	P	28.4	Very low	26.9	Very low	114 Å²	114	139.4 Å²	139.4	74%	0.74	84%	0.837	S	S	*	*			trans	-112.4	154.7	-148.4	37.5	-26.8	0	0	0	117.3
459	A	25.8	Very low	27.1	Very low	99 Å²	99	135.8 Å²	135.8	82%	0.818	83%	0.831	S	S	*	*			trans	52.7	103.4	143.9	0	0	0	0	0	120.8
460	E	26.3	Very low	27.7	Very low	200 Å²	200	141.6 Å²	141.6	94%	0.935	83%	0.833	S	S	*	*			trans	-78.7	133.6	155.2	-77.6	-170.1	149	0	0	111.5
461	V	26.5	Very low	28.1	Very low	132 Å²	132	142.2 Å²	142.2	80%	0.8	83%	0.829	S	S	*	*			trans	-107.9	135.1	154.4	171.8	0	0	0	0	105.1
462	V	26.4	Very low	28.4	Very low	133 Å²	133	140.6 Å²	140.6	81%	0.806	83%	0.827	S	S	*	*			trans	170.7	118.2	138.9	153.7	0	0	0	0	112.4
463	W	24.1	Very low	28.6	Very low	237 Å²	237	144.6 Å²	144.6	90%	0.898	84%	0.836	S	S	*	*			trans	58.8	97.8	130	-136.7	-92.5	0	0	0	122.5
464	G	23.9	Very low	28.6	Very low	64 Å²	64	146.9 Å²	146.9	66%	0.66	84%	0.842	S	S	*	*				49.8	95.1	111.6	0	0	0	0	0	119.2
465	S	27.4	Very low	28.9	Very low	122 Å²	122	145.3 Å²	145.3	85%	0.853	84%	0.835	S	S	*	*			trans	-70.3	119.9	163	-176.4	0	0	0	0	110.8
466	E	27.1	Very low	29.6	Very low	194 Å²	194	145 Å²	145	91%	0.907	84%	0.842	S	S	*	*			trans	-104.5	136.1	160.2	-91.6	-173.2	145.8	0	0	111
467	K	31	Very low	30.1	Very low	198 Å²	198	141.4 Å²	141.4	86%	0.861	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-75.7	136.6	-166.4	-67.5	168.7	174.6	172.8	0	112.2
468	T	25.4	Very low	31	Very low	135 Å²	135	138.8 Å²	138.8	83%	0.828	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-69.8	140.9	156.1	16.4	0	0	0	0	110.7
469	P	30.3	Very low	31.9	Very low	124 Å²	124	138.9 Å²	138.9	81%	0.805	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-77.2	138	173.5	30.6	-29.6	0	0	0	110.4
470	K	35.3	Very low	33.1	Very low	206 Å²	206	135.9 Å²	135.9	90%	0.896	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-60.9	129.4	169.4	-90.5	177.8	167.7	-179.1	0	109.9
471	A	32.6	Very low	34.2	Very low	98 Å²	98	132.7 Å²	132.7	81%	0.81	78%	0.782	S	S	*	*			trans	-113	128.3	156.4	0	0	0	0	0	107.9
472	D	31.6	Very low	35.4	Very low	155 Å²	155	129 Å²	129	83%	0.829	77%	0.771	S	S	*	*			trans	-62.6	143.4	-175.8	-70	-49.9	0	0	0	112.5	D474	D472-D474 PolarHBondContact O-N 3.14Å
473	Q	42.4	Very low	36.9	Very low	192 Å²	192	128.2 Å²	128.2	90%	0.897	76%	0.759	S	S	*	*			trans	-71.2	120.6	166.1	-71.7	175.9	15.8	0	0	108.9
474	D	35.3	Very low	38.7	Very low	175 Å²	175	122.6 Å²	122.6	94%	0.936	74%	0.742	S	S	*	*			trans	-159.9	126.7	134.5	-126.1	-9.8	0	0	0	110.5	D472	D472-D474 PolarHBondContact O-N 3.14Å
475	G	33.9	Very low	40.4	Very low	70 Å²	70	122.4 Å²	122.4	72%	0.722	73%	0.734	S	S	*	*			trans	140.9	96	178.5	0	0	0	0	0	112.1	G477	G475-G477 PolarHBondContact O-N 3.16Å; G475-G477 VanDerWaalsContact O-N 3.08Å
476	G	39.9	Very low	42.5	Very low	96 Å²	96	119.1 Å²	119.1	99%	0.99	72%	0.715	S	S	*	*			trans	-57.6	109.7	176.7	0	0	0	0	0	112.2
477	G	35.6	Very low	44.8	Very low	56 Å²	56	112.4 Å²	112.4	58%	0.577	68%	0.681	S	S	*	*			trans	-115.2	140.5	164.1	0	0	0	0	0	108.9	G475	G475-G477 PolarHBondContact O-N 3.16Å; G475-G477 VanDerWaalsContact O-N 3.08Å
478	D	42.3	Very low	46.8	Very low	115 Å²	115	107 Å²	107	62%	0.615	66%	0.659	S	S	*	*			trans	-52.9	131.1	175.9	-172.6	33.3	0	0	0	110.1	G480 E481	D478-G480 PolarHBondContact O-N 2.96Å; D478-E481 HydrophobicContact CB-CG 4.47Å; D478-E481 PolarHBondContact O-N 2.86Å; D478-E481 VanDerWaalsContact O-N 3.12Å
479	P	47.1	Very low	49	Very low	116 Å²	116	107.7 Å²	107.7	75%	0.753	65%	0.653	S	S	*	*	H	α-helix	trans	-57.7	-16.8	-177	-23.5	32.8	0	0	0	114.3
480	G	50.8	Low	50.9	Low	35 Å²	35	103.8 Å²	103.8	36%	0.361	63%	0.631	S	S	.	*	H	α-helix	trans	-77.4	-30.8	177.8	0	0	0	0	0	115.1	D478 G482 E483 E484	D478-G480 PolarHBondContact O-N 2.96Å; G480-G482 PolarHBondContact O-N 3.37Å; G480-E483 PolarHBondContact O-N 2.98Å; G480-E484 WeakPolarHBondContact O-CB 3.49Å; G480-E484 PolarHBondContact O-N 3.49Å; G480-E484 VanDerWaalsContact O-N 3.12Å
481	E	49.6	Very low	52.6	Low	133 Å²	133	94 Å²	94	62%	0.621	59%	0.588	S	S	*	*	H	α-helix	trans	-70.8	-34.6	-173.8	-73.5	-171.5	157.5	0	0	112.6	D478 A485	D478-E481 HydrophobicContact CB-CG 4.47Å; D478-E481 PolarHBondContact O-N 2.86Å; D478-E481 VanDerWaalsContact O-N 3.12Å; E481-A485 WeakPolarHBondContact O-CB 3.31Å; E481-A485 PolarHBondContact O-N 3.31Å; E481-A485 VanDerWaalsContact O-N 3.14Å
482	G	51.1	Low	54.5	Low	55 Å²	55	93.5 Å²	93.5	57%	0.567	58%	0.575	S	S	*	*	H	α-helix	trans	-72.1	-34	178.9	0	0	0	0	0	113.4	G480 A486	G480-G482 PolarHBondContact O-N 3.37Å; G482-A486 WeakPolarHBondContact O-CB 3.33Å; G482-A486 PolarHBondContact O-N 3.49Å; G482-A486 VanDerWaalsContact O-N 3.14Å
483	E	57.8	Low	56.3	Low	117 Å²	117	88.7 Å²	88.7	55%	0.547	56%	0.557	S	S	.	*	H	α-helix	trans	-75.9	-42.4	178.9	-158.9	174.3	-179.8	0	0	110.7	G480 A485 A486 W487	G480-E483 PolarHBondContact O-N 2.98Å; E483-A485 PolarHBondContact O-N 2.81Å; E483-A486 PolarHBondContact O-N 3.26Å; E483-W487 PolarHBondContact O-N 2.85Å
484	E	61.6	Low	57.9	Low	118 Å²	118	81 Å²	81	55%	0.551	52%	0.521	S	S	*	.	H	α-helix	trans	-60.5	-43.2	174.6	-169.6	176.6	-178.9	0	0	112	G480 A486 W487 E488	G480-E484 WeakPolarHBondContact O-CB 3.49Å; G480-E484 PolarHBondContact O-N 3.49Å; G480-E484 VanDerWaalsContact O-N 3.12Å; E484-A486 PolarHBondContact O-N 3.15Å; E484-W487 PolarHBondContact O-N 3.39Å; E484-E488 PolarHBondContact O-N 2.88Å
485	A	61.3	Low	59.8	Low	60 Å²	60	73.8 Å²	73.8	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-63.1	-38.8	174.7	0	0	0	0	0	112.6	E481 E483 E488 Q489	E481-A485 WeakPolarHBondContact O-CB 3.31Å; E481-A485 PolarHBondContact O-N 3.31Å; E481-A485 VanDerWaalsContact O-N 3.14Å; E483-A485 PolarHBondContact O-N 2.81Å; A485-E488 PolarHBondContact O-N 2.73Å; A485-Q489 WeakPolarHBondContact O-CB 3.44Å; A485-Q489 PolarHBondContact O-N 3.33Å
486	A	70.3	Confident	61.6	Low	53 Å²	53	73 Å²	73	44%	0.438	47%	0.469	S	S	.	.	H	α-helix	trans	-67.2	-41	176.7	0	0	0	0	0	112.2	G482 E483 E484 E488 Q489 A490	G482-A486 WeakPolarHBondContact O-CB 3.33Å; G482-A486 PolarHBondContact O-N 3.49Å; G482-A486 VanDerWaalsContact O-N 3.14Å; E483-A486 PolarHBondContact O-N 3.26Å; E484-A486 PolarHBondContact O-N 3.15Å; A486-E488 VanDerWaalsContact C-N 3.35Å; A486-Q489 PolarHBondContact O-N 3.23Å; A486-A490 WeakPolarHBondContact O-CB 3.45Å; A486-A490 PolarHBondContact O-N 3.35Å
487	W	75.7	Confident	63.2	Low	53 Å²	53	72.2 Å²	72.2	20%	0.201	44%	0.444	C	S	.	.	H	α-helix	trans	-61.9	-41.7	174.3	-83.7	106.2	0	0	0	112.2	E483 E484 A490 A491 F522 Q525 Q526	E483-W487 PolarHBondContact O-N 2.85Å; E484-W487 PolarHBondContact O-N 3.39Å; W487-A490 PolarHBondContact O-N 3.23Å; W487-A491 WeakPolarHBondContact O-CB 3.43Å; W487-A491 PolarHBondContact O-N 3.22Å; W487-F522 HydrophobicContact CE3-CD2 4.38Å; W487-F522 HydrophobicContact CE3-CE1 4.1Å; W487-F522 AromaticContact CE3-CE2 3.59Å; W487-F522 HydrophobicContact CE3-CE2 3.59Å; W487-F522 AromaticContact CE3-CZ 3.41Å; W487-F522 HydrophobicContact CE3-CZ 3.41Å; W487-F522 VanDerWaalsContact CE3-CZ 3.41Å; W487-F522 HydrophobicContact CH2-CE2 4.44Å; W487-F522 AromaticContact CZ3-CD2 3.77Å; W487-F522 HydrophobicContact CZ3-CD2 3.77Å; W487-F522 HydrophobicContact CZ3-CE1 4.36Å; W487-F522 AromaticContact CZ3-CE2 3.33Å; W487-F522 HydrophobicContact CZ3-CE2 3.33Å; W487-F522 HydrophobicContact CZ3-CG 4.46Å; W487-F522 AromaticContact CZ3-CZ 3.67Å; W487-F522 HydrophobicContact CZ3-CZ 3.67Å; W487-Q525 HydrophobicContact CH2-CB 4.47Å; W487-Q526 HydrophobicContact CB-CG 3.87Å; W487-Q526 HydrophobicContact CD2-CB 4.2Å; W487-Q526 HydrophobicContact CD2-CG 4.02Å; W487-Q526 HydrophobicContact CE3-CB 3.73Å; W487-Q526 HydrophobicContact CE3-CG 3.94Å; W487-Q526 HydrophobicContact CG-CG 4Å; W487-Q526 HydrophobicContact CZ3-CB 4.13Å
488	E	73.8	Confident	65	Low	84 Å²	84	70 Å²	70	39%	0.393	42%	0.42	S	S	.	.	H	α-helix	trans	-70.9	-35.7	179.4	-157.2	57.2	-153.6	0	0	111.8	E484 A485 A486 A491 V492 R523 Q526	E484-E488 PolarHBondContact O-N 2.88Å; A485-E488 PolarHBondContact O-N 2.73Å; A486-E488 VanDerWaalsContact C-N 3.35Å; E488-A491 WeakPolarHBondContact O-CB 3.44Å; E488-A491 PolarHBondContact O-N 2.95Å; E488-V492 WeakPolarHBondContact O-CG2 3.45Å; E488-V492 PolarHBondContact O-N 3.18Å; E488-R523 IonicContact OE1-CZ 3.79Å; E488-R523 IonicContact OE1-NH1 3.46Å; E488-R523 PolarHBondContact OE1-NH1 3.49Å; E488-R523 IonicContact OE1-NH2 3.1Å; E488-R523 PolarHBondContact OE1-NH2 3.19Å; E488-R523 VanDerWaalsContact OE1-NH2 3.1Å; E488-R523 IonicContact OE2-CZ 3.82Å; E488-R523 IonicContact OE2-NH1 2.88Å; E488-R523 PolarHBondContact OE2-NH1 3.08Å; E488-R523 IonicContact OE2-NH2 3.85Å; E488-Q526 PolarHBondContact OE2-NE2 3.21Å; E488-Q526 VanDerWaalsContact OE2-NE2 3.11Å
489	Q	70.8	Confident	66.6	Low	151 Å²	151	70.8 Å²	70.8	71%	0.706	41%	0.414	S	S	*	.	H	α-helix	trans	-66	-40.9	173.6	-161.9	169.2	18	0	0	112.1	A485 A486 A491 V492 A493	A485-Q489 WeakPolarHBondContact O-CB 3.44Å; A485-Q489 PolarHBondContact O-N 3.33Å; A486-Q489 PolarHBondContact O-N 3.23Å; Q489-A491 VanDerWaalsContact C-N 3.35Å; Q489-V492 PolarHBondContact O-N 2.98Å; Q489-A493 PolarHBondContact O-N 3.46Å
490	A	70.7	Confident	67.9	Low	41 Å²	41	70.6 Å²	70.6	34%	0.339	40%	0.401	S	S	.	.	H	α-helix	trans	-64.7	-37.5	172.7	0	0	0	0	0	112	A486 W487 A493 F494 F522	A486-A490 WeakPolarHBondContact O-CB 3.45Å; A486-A490 PolarHBondContact O-N 3.35Å; W487-A490 PolarHBondContact O-N 3.23Å; A490-A493 PolarHBondContact O-N 3.08Å; A490-F494 WeakPolarHBondContact O-CB 3.27Å; A490-F494 PolarHBondContact O-N 3.31Å; A490-F522 HydrophobicContact CB-CE2 4.09Å; A490-F522 HydrophobicContact CB-CZ 3.64Å
491	A	71.3	Confident	68.9	Low	1 Å²	1	69 Å²	69	1%	0.008	39%	0.385	C	S	.	.	H	α-helix	trans	-63.3	-42.3	174.2	0	0	0	0	0	112.2	W487 E488 Q489 F494 D495 F522 R523	W487-A491 WeakPolarHBondContact O-CB 3.43Å; W487-A491 PolarHBondContact O-N 3.22Å; E488-A491 WeakPolarHBondContact O-CB 3.44Å; E488-A491 PolarHBondContact O-N 2.95Å; Q489-A491 VanDerWaalsContact C-N 3.35Å; A491-F494 PolarHBondContact O-N 3.05Å; A491-D495 WeakPolarHBondContact O-CB 3.27Å; A491-D495 PolarHBondContact O-N 3.48Å; A491-F522 HydrophobicContact CB-CE1 3.75Å; A491-R523 VanDerWaalsContact CB-CZ 3.41Å; A491-R523 VanDerWaalsContact CB-NH2 3.35Å
492	V	72.6	Confident	70	Confident	87 Å²	87	63.8 Å²	63.8	53%	0.527	36%	0.36	S	S	.	.	H	α-helix	trans	-63.9	-40.9	175.8	170.2	0	0	0	0	111.2	E488 Q489 D495 A496	E488-V492 WeakPolarHBondContact O-CG2 3.45Å; E488-V492 PolarHBondContact O-N 3.18Å; Q489-V492 PolarHBondContact O-N 2.98Å; V492-D495 PolarHBondContact O-N 3.42Å; V492-A496 PolarHBondContact O-N 3.05Å
493	A	67.8	Low	71.2	Confident	55 Å²	55	66.6 Å²	66.6	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-64.6	-43.1	175.1	0	0	0	0	0	111.8	Q489 A490 D495 A496 V497	Q489-A493 PolarHBondContact O-N 3.46Å; A490-A493 PolarHBondContact O-N 3.08Å; A493-D495 VanDerWaalsContact C-N 3.34Å; A493-D495 PolarHBondContact O-N 3.46Å; A493-A496 WeakPolarHBondContact O-CB 3.45Å; A493-A496 PolarHBondContact O-N 3.41Å; A493-A496 VanDerWaalsContact O-N 3.12Å; A493-V497 WeakPolarHBondContact O-CG2 3.43Å; A493-V497 PolarHBondContact O-N 3.37Å
494	F	77.5	Confident	71.6	Confident	31 Å²	31	64.4 Å²	64.4	14%	0.136	34%	0.344	C	S	.	.	H	α-helix	trans	-61.8	-43.3	176	-150	-66.3	0	0	0	111.3	A490 A491 A496 V497 L498 L515 L518 R519	A490-F494 WeakPolarHBondContact O-CB 3.27Å; A490-F494 PolarHBondContact O-N 3.31Å; A491-F494 PolarHBondContact O-N 3.05Å; F494-A496 VanDerWaalsContact C-N 3.27Å; F494-A496 PolarHBondContact O-N 2.9Å; F494-V497 PolarHBondContact O-N 3.25Å; F494-L498 WeakPolarHBondContact O-CB 2.76Å; F494-L498 PolarHBondContact O-N 2.73Å; F494-L515 WeakPolarHBondContact CE1-O 3.48Å; F494-L518 HydrophobicContact CE1-CB 4.48Å; F494-L518 HydrophobicContact CZ-CB 3.69Å; F494-R519 HydrophobicContact CD1-CB 3.69Å; F494-R519 HydrophobicContact CD1-CG 3.92Å; F494-R519 HydrophobicContact CE1-CB 3.56Å; F494-R519 HydrophobicContact CE1-CG 4.31Å; F494-R519 HydrophobicContact CZ-CB 4.37Å
495	D	75.6	Confident	71.6	Confident	22 Å²	22	63.3 Å²	63.3	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-60.3	-37.2	174.1	-81.5	14.1	0	0	0	112.1	A491 V492 A493 R499 R519	A491-D495 WeakPolarHBondContact O-CB 3.27Å; A491-D495 PolarHBondContact O-N 3.48Å; V492-D495 PolarHBondContact O-N 3.42Å; A493-D495 VanDerWaalsContact C-N 3.34Å; A493-D495 PolarHBondContact O-N 3.46Å; D495-R499 WeakPolarHBondContact O-CB 3.03Å; D495-R499 WeakPolarHBondContact O-CG 3.45Å; D495-R499 PolarHBondContact O-N 3.39Å; D495-R499 IonicContact OD2-NH2 3.74Å; D495-R519 IonicContact OD1-CZ 3.04Å; D495-R519 IonicContact OD1-NE 2.63Å; D495-R519 PolarHBondContact OD1-NE 3.46Å; D495-R519 IonicContact OD1-NH2 2.74Å; D495-R519 PolarHBondContact OD1-NH2 3.1Å; D495-R519 IonicContact OD2-CZ 3.96Å; D495-R519 IonicContact OD2-NH2 2.97Å; D495-R519 PolarHBondContact OD2-NH2 3.42Å
496	A	71	Confident	71.8	Confident	54 Å²	54	64.9 Å²	64.9	45%	0.446	35%	0.353	S	S	.	.	H	α-helix	trans	-67.1	-44.7	176.9	0	0	0	0	0	111.6	V492 A493 F494 R499 F500	V492-A496 PolarHBondContact O-N 3.05Å; A493-A496 WeakPolarHBondContact O-CB 3.45Å; A493-A496 PolarHBondContact O-N 3.41Å; A493-A496 VanDerWaalsContact O-N 3.12Å; F494-A496 VanDerWaalsContact C-N 3.27Å; F494-A496 PolarHBondContact O-N 2.9Å; A496-R499 PolarHBondContact O-N 3.39Å; A496-F500 WeakPolarHBondContact O-CB 3.46Å; A496-F500 PolarHBondContact O-N 3Å
497	V	73.4	Confident	71.3	Confident	79 Å²	79	65.1 Å²	65.1	48%	0.479	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-43.6	175.3	174	0	0	0	0	111	A493 F494 F500 A501	A493-V497 WeakPolarHBondContact O-CG2 3.43Å; A493-V497 PolarHBondContact O-N 3.37Å; F494-V497 PolarHBondContact O-N 3.25Å; V497-F500 WeakPolarHBondContact O-CB 3.31Å; V497-F500 PolarHBondContact O-N 3.17Å; V497-A501 WeakPolarHBondContact O-CB 3.42Å; V497-A501 PolarHBondContact O-N 3.49Å
498	L	72.7	Confident	70.8	Confident	11 Å²	11	65.1 Å²	65.1	6%	0.058	35%	0.352	C	S	.	.	H	α-helix	trans	-63.4	-45.9	178.3	-164.6	117.2	0	0	0	111.8	F494 F500 A501 E502 L515 R516 R519	F494-L498 WeakPolarHBondContact O-CB 2.76Å; F494-L498 PolarHBondContact O-N 2.73Å; L498-F500 VanDerWaalsContact C-N 3.28Å; L498-F500 PolarHBondContact O-N 3.43Å; L498-A501 PolarHBondContact O-N 3.06Å; L498-E502 VanDerWaalsContact CD2-OE1 3.3Å; L498-E502 WeakPolarHBondContact CD2-OE1 3.36Å; L498-E502 WeakPolarHBondContact O-CB 3.4Å; L498-E502 VanDerWaalsContact O-CG 3.28Å; L498-E502 WeakPolarHBondContact O-CG 3.19Å; L498-E502 PolarHBondContact O-N 2.92Å; L498-L515 HydrophobicContact CD1-CB 3.99Å; L498-R516 HydrophobicContact CD1-CB 4.24Å; L498-R516 HydrophobicContact CD1-CG 3.61Å; L498-R516 HydrophobicContact CD2-CG 4.2Å; L498-R516 HydrophobicContact CG-CG 4.33Å; L498-R519 HydrophobicContact CD1-CB 4.45Å
499	R	76.4	Confident	70.3	Confident	130 Å²	130	61.8 Å²	61.8	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-34.3	175.4	-73.3	176.8	-148.7	152.6	6.6	112.3	D495 A496 R503	D495-R499 WeakPolarHBondContact O-CB 3.03Å; D495-R499 WeakPolarHBondContact O-CG 3.45Å; D495-R499 PolarHBondContact O-N 3.39Å; D495-R499 IonicContact OD2-NH2 3.74Å; A496-R499 PolarHBondContact O-N 3.39Å; R499-R503 WeakPolarHBondContact O-CD 3.46Å; R499-R503 WeakPolarHBondContact O-CG 2.96Å; R499-R503 PolarHBondContact O-N 3.48Å
500	F	74.6	Confident	69.5	Low	112 Å²	112	60 Å²	60	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-52.8	173.8	176.6	-97.4	0	0	0	110	A496 V497 L498 E502 R503 Q504 F507	A496-F500 WeakPolarHBondContact O-CB 3.46Å; A496-F500 PolarHBondContact O-N 3Å; V497-F500 WeakPolarHBondContact O-CB 3.31Å; V497-F500 PolarHBondContact O-N 3.17Å; L498-F500 VanDerWaalsContact C-N 3.28Å; L498-F500 PolarHBondContact O-N 3.43Å; F500-E502 VanDerWaalsContact C-N 3.3Å; F500-E502 PolarHBondContact O-N 3.44Å; F500-R503 WeakPolarHBondContact O-CA 3.41Å; F500-R503 PolarHBondContact O-N 3.18Å; F500-Q504 HydrophobicContact CD1-CG 4.02Å; F500-Q504 HydrophobicContact CD2-CG 4.1Å; F500-Q504 HydrophobicContact CE1-CG 3.65Å; F500-Q504 HydrophobicContact CE2-CG 3.74Å; F500-Q504 HydrophobicContact CG-CG 4.24Å; F500-Q504 HydrophobicContact CZ-CG 3.5Å; F500-Q504 WeakPolarHBondContact O-CG 3.49Å; F500-Q504 PolarHBondContact O-N 3.34Å; F500-Q504 VanDerWaalsContact O-N 3.08Å; F500-F507 HydrophobicContact CD1-CE2 4.24Å; F500-F507 HydrophobicContact CE1-CE2 4.04Å; F500-F507 HydrophobicContact CE1-CZ 4.49Å
501	A	72.3	Confident	69.1	Low	2 Å²	2	62 Å²	62	2%	0.017	33%	0.333	C	S	.	.	H	α-helix	trans	-58.2	-39.6	178.8	0	0	0	0	0	112.6	V497 L498 R503 Q504 F507 V512 L515	V497-A501 WeakPolarHBondContact O-CB 3.42Å; V497-A501 PolarHBondContact O-N 3.49Å; L498-A501 PolarHBondContact O-N 3.06Å; A501-R503 PolarHBondContact O-N 2.91Å; A501-Q504 PolarHBondContact O-N 2.91Å; A501-F507 HydrophobicContact CB-CB 4.45Å; A501-F507 HydrophobicContact CB-CD1 4.05Å; A501-F507 HydrophobicContact CB-CD2 3.91Å; A501-F507 HydrophobicContact CB-CE1 4.23Å; A501-F507 HydrophobicContact CB-CE2 4.1Å; A501-F507 HydrophobicContact CB-CG 3.87Å; A501-F507 HydrophobicContact CB-CZ 4.25Å; A501-V512 HydrophobicContact CB-CG2 4.35Å; A501-L515 HydrophobicContact CB-CD1 3.51Å
502	E	72.5	Confident	68.9	Low	23 Å²	23	62.1 Å²	62.1	11%	0.107	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.1	174.8	-74.7	177.1	167.8	0	0	114.4	F364 L498 F500 V512 R516	F364-E502 HydrophobicContact CZ-CG 4.47Å; L498-E502 VanDerWaalsContact CD2-OE1 3.3Å; L498-E502 WeakPolarHBondContact CD2-OE1 3.36Å; L498-E502 WeakPolarHBondContact O-CB 3.4Å; L498-E502 VanDerWaalsContact O-CG 3.28Å; L498-E502 WeakPolarHBondContact O-CG 3.19Å; L498-E502 PolarHBondContact O-N 2.92Å; F500-E502 VanDerWaalsContact C-N 3.3Å; F500-E502 PolarHBondContact O-N 3.44Å; E502-V512 HydrophobicContact CG-CG1 3.75Å; E502-R516 IonicContact OE1-CZ 3.27Å; E502-R516 VanDerWaalsContact OE1-CZ 3.27Å; E502-R516 IonicContact OE1-NE 3.06Å; E502-R516 PolarHBondContact OE1-NE 2.63Å; E502-R516 IonicContact OE1-NH2 2.67Å; E502-R516 PolarHBondContact OE1-NH2 3.45Å
503	R	75.3	Confident	68.4	Low	114 Å²	114	58.2 Å²	58.2	43%	0.43	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-18.1	-180	-73.2	174.1	-179.7	-178.4	6	113.3	G246 H249 R499 F500 A501	G246-R503 PolarHBondContact O-NE 3.06Å; H249-R503 PolarHBondContact CD2-O 3.4Å; R499-R503 WeakPolarHBondContact O-CD 3.46Å; R499-R503 WeakPolarHBondContact O-CG 2.96Å; R499-R503 PolarHBondContact O-N 3.48Å; F500-R503 WeakPolarHBondContact O-CA 3.41Å; F500-R503 PolarHBondContact O-N 3.18Å; A501-R503 PolarHBondContact O-N 2.91Å
504	Q	67.6	Low	68.2	Low	71 Å²	71	59.5 Å²	59.5	33%	0.332	31%	0.308	S	S	.	.			trans	-95	134.2	-176.9	-64.3	-51.5	-39.2	0	0	111.1	F500 A501 C506 F507	F500-Q504 HydrophobicContact CD1-CG 4.02Å; F500-Q504 HydrophobicContact CD2-CG 4.1Å; F500-Q504 HydrophobicContact CE1-CG 3.65Å; F500-Q504 HydrophobicContact CE2-CG 3.74Å; F500-Q504 HydrophobicContact CG-CG 4.24Å; F500-Q504 HydrophobicContact CZ-CG 3.5Å; F500-Q504 WeakPolarHBondContact O-CG 3.49Å; F500-Q504 PolarHBondContact O-N 3.34Å; F500-Q504 VanDerWaalsContact O-N 3.08Å; A501-Q504 PolarHBondContact O-N 2.91Å; Q504-C506 PolarHBondContact O-N 2.96Å; Q504-F507 HydrophobicContact CB-CD2 3.83Å; Q504-F507 HydrophobicContact CB-CE2 4.07Å; Q504-F507 HydrophobicContact CG-CE2 4.45Å
505	P	60.4	Low	67.9	Low	96 Å²	96	59.7 Å²	59.7	62%	0.623	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-13.1	179.2	30.1	-35.4	0	0	0	113.4	F507	P505-F507 VanDerWaalsContact C-N 3.31Å; P505-F507 PolarHBondContact O-N 3.47Å
506	C	64.9	Low	67.7	Low	92 Å²	92	59.4 Å²	59.4	62%	0.622	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-14.3	-179.3	58.9	0	0	0	0	114.1	Q504	Q504-C506 PolarHBondContact O-N 2.96Å
507	F	61.4	Low	67.3	Low	59 Å²	59	57.2 Å²	57.2	26%	0.259	29%	0.289	S	S	.	.	S	Bend	trans	-94.8	125.8	175.7	-65.4	-91.8	0	0	0	110.6	F500 A501 Q504 P505 E511 V512	F500-F507 HydrophobicContact CD1-CE2 4.24Å; F500-F507 HydrophobicContact CE1-CE2 4.04Å; F500-F507 HydrophobicContact CE1-CZ 4.49Å; A501-F507 HydrophobicContact CB-CB 4.45Å; A501-F507 HydrophobicContact CB-CD1 4.05Å; A501-F507 HydrophobicContact CB-CD2 3.91Å; A501-F507 HydrophobicContact CB-CE1 4.23Å; A501-F507 HydrophobicContact CB-CE2 4.1Å; A501-F507 HydrophobicContact CB-CG 3.87Å; A501-F507 HydrophobicContact CB-CZ 4.25Å; Q504-F507 HydrophobicContact CB-CD2 3.83Å; Q504-F507 HydrophobicContact CB-CE2 4.07Å; Q504-F507 HydrophobicContact CG-CE2 4.45Å; P505-F507 VanDerWaalsContact C-N 3.31Å; P505-F507 PolarHBondContact O-N 3.47Å; F507-E511 HydrophobicContact CD1-CB 4.4Å; F507-V512 HydrophobicContact CB-CG2 3.8Å
508	S	64.4	Low	67.1	Low	52 Å²	52	58.2 Å²	58.2	36%	0.364	29%	0.291	S	S	.	.			trans	-67.7	157	170.6	70.3	0	0	0	0	111.4	Q510 E511 V512	S508-Q510 PolarHBondContact O-N 3.43Å; S508-Q510 VanDerWaalsContact O-N 3.17Å; S508-E511 WeakPolarHBondContact CA-OE2 3.43Å; S508-E511 VanDerWaalsContact CB-OE2 3.24Å; S508-E511 WeakPolarHBondContact CB-OE2 3.24Å; S508-E511 PolarHBondContact N-OE2 2.71Å; S508-E511 PolarHBondContact O-N 3.4Å; S508-E511 VanDerWaalsContact O-N 3.13Å; S508-E511 VanDerWaalsContact OG-CD 3.27Å; S508-E511 VanDerWaalsContact OG-CG 3.28Å; S508-E511 WeakPolarHBondContact OG-CG 3.43Å; S508-E511 PolarHBondContact OG-N 3.01Å; S508-E511 VanDerWaalsContact OG-N 3.16Å; S508-E511 PolarHBondContact OG-OE2 2.75Å; S508-V512 WeakPolarHBondContact O-CG2 3.2Å; S508-V512 PolarHBondContact O-N 2.77Å
509	A	62.4	Low	67.3	Low	15 Å²	15	60.5 Å²	60.5	12%	0.124	30%	0.299	C	S	.	.	H	α-helix	trans	-57	-32.3	174.9	0	0	0	0	0	112.6	P251 A367 G513	P251-A509 HydrophobicContact CB-CB 3.54Å; P251-A509 HydrophobicContact CG-CB 4.45Å; A367-A509 HydrophobicContact CB-CB 4.04Å; A509-G513 PolarHBondContact O-N 3.48Å
510	Q	55.9	Low	66.7	Low	114 Å²	114	54.3 Å²	54.3	53%	0.533	28%	0.276	S	S	.	.	H	α-helix	trans	-69	-45.7	177.3	180	174.8	-14.6	0	0	111.2	S508 G513 Q514	S508-Q510 PolarHBondContact O-N 3.43Å; S508-Q510 VanDerWaalsContact O-N 3.17Å; Q510-G513 CarbonylContact O-C 3.6Å; Q510-G513 WeakPolarHBondContact O-CA 3.49Å; Q510-G513 PolarHBondContact O-N 3.21Å; Q510-Q514 WeakPolarHBondContact O-CG 3.44Å; Q510-Q514 PolarHBondContact O-N 3.16Å
511	E	60.6	Low	66.4	Low	82 Å²	82	52.4 Å²	52.4	38%	0.383	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-43.2	177.1	-71.9	159.7	139.1	0	0	111.4	F507 S508 G513 Q514 L515	F507-E511 HydrophobicContact CD1-CB 4.4Å; S508-E511 WeakPolarHBondContact CA-OE2 3.43Å; S508-E511 VanDerWaalsContact CB-OE2 3.24Å; S508-E511 WeakPolarHBondContact CB-OE2 3.24Å; S508-E511 PolarHBondContact N-OE2 2.71Å; S508-E511 PolarHBondContact O-N 3.4Å; S508-E511 VanDerWaalsContact O-N 3.13Å; S508-E511 VanDerWaalsContact OG-CD 3.27Å; S508-E511 VanDerWaalsContact OG-CG 3.28Å; S508-E511 WeakPolarHBondContact OG-CG 3.43Å; S508-E511 PolarHBondContact OG-N 3.01Å; S508-E511 VanDerWaalsContact OG-N 3.16Å; S508-E511 PolarHBondContact OG-OE2 2.75Å; E511-G513 VanDerWaalsContact C-N 3.3Å; E511-G513 PolarHBondContact O-N 3.5Å; E511-Q514 PolarHBondContact O-N 3.46Å; E511-L515 WeakPolarHBondContact O-CG 3.36Å; E511-L515 PolarHBondContact O-N 2.72Å
512	V	68.1	Low	66.6	Low	4 Å²	4	54.1 Å²	54.1	2%	0.024	28%	0.28	C	S	.	.	H	α-helix	trans	-64	-38.7	173.6	-179.3	0	0	0	0	111.1	F364 A501 E502 F507 S508 L515 R516	F364-V512 HydrophobicContact CD1-CB 4.18Å; F364-V512 HydrophobicContact CD1-CG1 3.88Å; F364-V512 HydrophobicContact CE1-CB 3.71Å; F364-V512 HydrophobicContact CE1-CG1 3.35Å; F364-V512 HydrophobicContact CE1-CG2 4.32Å; F364-V512 HydrophobicContact CZ-CG1 4.06Å; A501-V512 HydrophobicContact CB-CG2 4.35Å; E502-V512 HydrophobicContact CG-CG1 3.75Å; F507-V512 HydrophobicContact CB-CG2 3.8Å; S508-V512 WeakPolarHBondContact O-CG2 3.2Å; S508-V512 PolarHBondContact O-N 2.77Å; V512-L515 PolarHBondContact O-N 2.74Å; V512-R516 WeakPolarHBondContact O-CG 3.22Å; V512-R516 PolarHBondContact O-N 3.13Å
513	G	61.4	Low	66.5	Low	4 Å²	4	55.6 Å²	55.6	4%	0.041	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-44.1	172.7	0	0	0	0	0	112.6	L350 A509 Q510 E511 R516 A517	L350-G513 WeakPolarHBondContact CD2-O 3.25Å; A509-G513 PolarHBondContact O-N 3.48Å; Q510-G513 CarbonylContact O-C 3.6Å; Q510-G513 WeakPolarHBondContact O-CA 3.49Å; Q510-G513 PolarHBondContact O-N 3.21Å; E511-G513 VanDerWaalsContact C-N 3.3Å; E511-G513 PolarHBondContact O-N 3.5Å; G513-R516 PolarHBondContact O-N 3.29Å; G513-A517 PolarHBondContact O-N 3.08Å
514	Q	63.7	Low	65.9	Low	82 Å²	82	52.1 Å²	52.1	38%	0.383	28%	0.278	S	S	.	.	H	α-helix	trans	-63.6	-43.5	175.2	-72.9	172.3	-16	0	0	111.7	Q510 E511 R516 A517 L518	Q510-Q514 WeakPolarHBondContact O-CG 3.44Å; Q510-Q514 PolarHBondContact O-N 3.16Å; E511-Q514 PolarHBondContact O-N 3.46Å; Q514-R516 VanDerWaalsContact C-N 3.31Å; Q514-R516 PolarHBondContact O-N 3.17Å; Q514-A517 WeakPolarHBondContact O-CB 3.23Å; Q514-A517 PolarHBondContact O-N 3.01Å; Q514-L518 WeakPolarHBondContact O-CG 3.23Å; Q514-L518 PolarHBondContact O-N 3.15Å
515	L	70.6	Confident	65.8	Low	35 Å²	35	52.5 Å²	52.5	18%	0.183	28%	0.28	C	S	.	.	H	α-helix	trans	-60	-40.8	174.4	-72.5	171.8	0	0	0	111.8	F494 L498 A501 E511 V512 L518 R519	F494-L515 WeakPolarHBondContact CE1-O 3.48Å; L498-L515 HydrophobicContact CD1-CB 3.99Å; A501-L515 HydrophobicContact CB-CD1 3.51Å; E511-L515 WeakPolarHBondContact O-CG 3.36Å; E511-L515 PolarHBondContact O-N 2.72Å; V512-L515 PolarHBondContact O-N 2.74Å; L515-L518 PolarHBondContact O-N 3.15Å; L515-R519 WeakPolarHBondContact O-CB 3.49Å; L515-R519 PolarHBondContact O-N 2.94Å
516	R	71.6	Confident	66.2	Low	16 Å²	16	48.6 Å²	48.6	6%	0.06	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-40.4	174.6	-74	-175.6	-178.3	175.1	9.4	112.1	L350 N360 D361 F364 L498 E502 V512 G513 Q514 R519 A520	L350-R516 HydrophobicContact CD2-CB 3.51Å; N360-R516 VanDerWaalsContact CG-NH2 3.27Å; N360-R516 PolarHBondContact ND2-NH2 3.3Å; N360-R516 VanDerWaalsContact ND2-NH2 3.16Å; N360-R516 PolarHBondContact O-NH1 3.14Å; N360-R516 PolarHBondContact OD1-NH2 3.46Å; D361-R516 IonicContact OD1-NH1 3.7Å; F364-R516 VanDerWaalsContact CB-NH1 3.26Å; F364-R516 VanDerWaalsContact CD2-CZ 3.48Å; L498-R516 HydrophobicContact CD1-CB 4.24Å; L498-R516 HydrophobicContact CD1-CG 3.61Å; L498-R516 HydrophobicContact CD2-CG 4.2Å; L498-R516 HydrophobicContact CG-CG 4.33Å; E502-R516 IonicContact OE1-CZ 3.27Å; E502-R516 VanDerWaalsContact OE1-CZ 3.27Å; E502-R516 IonicContact OE1-NE 3.06Å; E502-R516 PolarHBondContact OE1-NE 2.63Å; E502-R516 IonicContact OE1-NH2 2.67Å; E502-R516 PolarHBondContact OE1-NH2 3.45Å; V512-R516 WeakPolarHBondContact O-CG 3.22Å; V512-R516 PolarHBondContact O-N 3.13Å; G513-R516 PolarHBondContact O-N 3.29Å; Q514-R516 VanDerWaalsContact C-N 3.31Å; Q514-R516 PolarHBondContact O-N 3.17Å; R516-R519 WeakPolarHBondContact O-CB 3.39Å; R516-R519 PolarHBondContact O-N 3.03Å; R516-A520 PolarHBondContact O-N 3.43Å; R516-A520 VanDerWaalsContact O-N 3.08Å
517	A	63.7	Low	65.9	Low	8 Å²	8	48.7 Å²	48.7	7%	0.066	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-45	175.5	0	0	0	0	0	111.6	T348 P349 L350 G513 Q514 R519 A520 V521	T348-A517 HydrophobicContact CG2-CB 3.6Å; P349-A517 WeakPolarHBondContact O-CB 3.46Å; L350-A517 HydrophobicContact CD2-CB 4.26Å; G513-A517 PolarHBondContact O-N 3.08Å; Q514-A517 WeakPolarHBondContact O-CB 3.23Å; Q514-A517 PolarHBondContact O-N 3.01Å; A517-R519 VanDerWaalsContact C-N 3.35Å; A517-R519 PolarHBondContact O-N 2.89Å; A517-A520 WeakPolarHBondContact O-CA 3.46Å; A517-A520 VanDerWaalsContact O-CB 3.24Å; A517-A520 WeakPolarHBondContact O-CB 3.39Å; A517-A520 PolarHBondContact O-N 3.26Å; A517-A520 VanDerWaalsContact O-N 3.09Å; A517-V521 WeakPolarHBondContact O-CG2 3.22Å; A517-V521 PolarHBondContact O-N 3.38Å
518	L	69.4	Low	65.8	Low	101 Å²	101	50.2 Å²	50.2	53%	0.529	26%	0.259	S	S	.	.	H	α-helix	trans	-60.7	-42.7	176.4	-73.8	169.2	0	0	0	112	F494 Q514 L515 A520 V521 F522	F494-L518 HydrophobicContact CE1-CB 4.48Å; F494-L518 HydrophobicContact CZ-CB 3.69Å; Q514-L518 WeakPolarHBondContact O-CG 3.23Å; Q514-L518 PolarHBondContact O-N 3.15Å; L515-L518 PolarHBondContact O-N 3.15Å; L518-A520 PolarHBondContact O-N 3.42Å; L518-V521 PolarHBondContact O-N 3.07Å; L518-F522 WeakPolarHBondContact O-CB 3.13Å; L518-F522 PolarHBondContact O-N 3.4Å
519	R	75.9	Confident	65.4	Low	58 Å²	58	50.2 Å²	50.2	22%	0.219	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-39.8	173.3	-174.5	-175	178.1	-135.5	6.7	112.1	F494 D495 L498 L515 R516 A517 F522 R523	F494-R519 HydrophobicContact CD1-CB 3.69Å; F494-R519 HydrophobicContact CD1-CG 3.92Å; F494-R519 HydrophobicContact CE1-CB 3.56Å; F494-R519 HydrophobicContact CE1-CG 4.31Å; F494-R519 HydrophobicContact CZ-CB 4.37Å; D495-R519 IonicContact OD1-CZ 3.04Å; D495-R519 IonicContact OD1-NE 2.63Å; D495-R519 PolarHBondContact OD1-NE 3.46Å; D495-R519 IonicContact OD1-NH2 2.74Å; D495-R519 PolarHBondContact OD1-NH2 3.1Å; D495-R519 IonicContact OD2-CZ 3.96Å; D495-R519 IonicContact OD2-NH2 2.97Å; D495-R519 PolarHBondContact OD2-NH2 3.42Å; L498-R519 HydrophobicContact CD1-CB 4.45Å; L515-R519 WeakPolarHBondContact O-CB 3.49Å; L515-R519 PolarHBondContact O-N 2.94Å; R516-R519 WeakPolarHBondContact O-CB 3.39Å; R516-R519 PolarHBondContact O-N 3.03Å; A517-R519 VanDerWaalsContact C-N 3.35Å; A517-R519 PolarHBondContact O-N 2.89Å; R519-F522 PolarHBondContact O-N 3Å; R519-R523 PolarHBondContact O-N 3.25Å
520	A	64.1	Low	64.9	Low	1 Å²	1	53.2 Å²	53.2	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-65.4	-43.1	178.8	0	0	0	0	0	111.7	R516 A517 L518 R523 S524	R516-A520 PolarHBondContact O-N 3.43Å; R516-A520 VanDerWaalsContact O-N 3.08Å; A517-A520 WeakPolarHBondContact O-CA 3.46Å; A517-A520 VanDerWaalsContact O-CB 3.24Å; A517-A520 WeakPolarHBondContact O-CB 3.39Å; A517-A520 PolarHBondContact O-N 3.26Å; A517-A520 VanDerWaalsContact O-N 3.09Å; L518-A520 PolarHBondContact O-N 3.42Å; A520-R523 PolarHBondContact O-N 2.94Å; A520-S524 PolarHBondContact O-N 3.38Å; A520-S524 PolarHBondContact O-OG 3.26Å
521	V	68.4	Low	64.5	Low	72 Å²	72	54.4 Å²	54.4	44%	0.436	28%	0.284	S	S	.	.	H	α-helix	trans	-64.8	-42.2	173.7	175.7	0	0	0	0	111.3	A517 L518 R523 S524 Q525	A517-V521 WeakPolarHBondContact O-CG2 3.22Å; A517-V521 PolarHBondContact O-N 3.38Å; L518-V521 PolarHBondContact O-N 3.07Å; V521-R523 PolarHBondContact O-N 3.36Å; V521-S524 WeakPolarHBondContact CA-OG 3.48Å; V521-S524 PolarHBondContact O-N 2.96Å; V521-S524 PolarHBondContact O-OG 3.33Å; V521-Q525 WeakPolarHBondContact O-CG 3.43Å; V521-Q525 PolarHBondContact O-N 3.37Å
522	F	75.5	Confident	63.5	Low	37 Å²	37	53.7 Å²	53.7	16%	0.162	30%	0.298	C	S	.	.	H	α-helix	trans	-59.1	-47.1	176.3	174.1	-90.6	0	0	0	111.7	W487 A490 A491 L518 R519 Q525 Q526	W487-F522 HydrophobicContact CE3-CD2 4.38Å; W487-F522 HydrophobicContact CE3-CE1 4.1Å; W487-F522 AromaticContact CE3-CE2 3.59Å; W487-F522 HydrophobicContact CE3-CE2 3.59Å; W487-F522 AromaticContact CE3-CZ 3.41Å; W487-F522 HydrophobicContact CE3-CZ 3.41Å; W487-F522 VanDerWaalsContact CE3-CZ 3.41Å; W487-F522 HydrophobicContact CH2-CE2 4.44Å; W487-F522 AromaticContact CZ3-CD2 3.77Å; W487-F522 HydrophobicContact CZ3-CD2 3.77Å; W487-F522 HydrophobicContact CZ3-CE1 4.36Å; W487-F522 AromaticContact CZ3-CE2 3.33Å; W487-F522 HydrophobicContact CZ3-CE2 3.33Å; W487-F522 HydrophobicContact CZ3-CG 4.46Å; W487-F522 AromaticContact CZ3-CZ 3.67Å; W487-F522 HydrophobicContact CZ3-CZ 3.67Å; A490-F522 HydrophobicContact CB-CE2 4.09Å; A490-F522 HydrophobicContact CB-CZ 3.64Å; A491-F522 HydrophobicContact CB-CE1 3.75Å; L518-F522 WeakPolarHBondContact O-CB 3.13Å; L518-F522 PolarHBondContact O-N 3.4Å; R519-F522 PolarHBondContact O-N 3Å; F522-Q525 PolarHBondContact O-N 3.21Å; F522-Q526 PolarHBondContact O-N 3.04Å
523	R	70.8	Confident	62.1	Low	54 Å²	54	61.6 Å²	61.6	20%	0.204	33%	0.333	C	S	.	.	H	α-helix	trans	-68.6	-32.6	177.9	-76.6	-66.9	-164.5	175.7	1.7	113	E488 A491 R519 A520 V521 Q526 Q527	E488-R523 IonicContact OE1-CZ 3.79Å; E488-R523 IonicContact OE1-NH1 3.46Å; E488-R523 PolarHBondContact OE1-NH1 3.49Å; E488-R523 IonicContact OE1-NH2 3.1Å; E488-R523 PolarHBondContact OE1-NH2 3.19Å; E488-R523 VanDerWaalsContact OE1-NH2 3.1Å; E488-R523 IonicContact OE2-CZ 3.82Å; E488-R523 IonicContact OE2-NH1 2.88Å; E488-R523 PolarHBondContact OE2-NH1 3.08Å; E488-R523 IonicContact OE2-NH2 3.85Å; A491-R523 VanDerWaalsContact CB-CZ 3.41Å; A491-R523 VanDerWaalsContact CB-NH2 3.35Å; R519-R523 PolarHBondContact O-N 3.25Å; A520-R523 PolarHBondContact O-N 2.94Å; V521-R523 PolarHBondContact O-N 3.36Å; R523-Q526 VanDerWaalsContact CD-OE1 3.26Å; R523-Q527 PolarHBondContact O-N 3.44Å
524	S	63.3	Low	60.9	Low	41 Å²	41	67.1 Å²	67.1	29%	0.287	37%	0.37	S	S	.	.	H	α-helix	trans	-69.6	-37.3	174.7	66.9	0	0	0	0	111.8	A520 V521 Q527 V528	A520-S524 PolarHBondContact O-N 3.38Å; A520-S524 PolarHBondContact O-OG 3.26Å; V521-S524 WeakPolarHBondContact CA-OG 3.48Å; V521-S524 PolarHBondContact O-N 2.96Å; V521-S524 PolarHBondContact O-OG 3.33Å; S524-Q527 PolarHBondContact O-N 3.48Å; S524-V528 WeakPolarHBondContact O-CG2 3.38Å; S524-V528 PolarHBondContact O-N 2.93Å
525	Q	65.3	Low	59.6	Low	79 Å²	79	67.2 Å²	67.2	37%	0.369	39%	0.385	S	S	.	.	H	α-helix	trans	-67.1	-42.3	174.9	-72.4	179.9	-2.7	0	0	112	W487 V521 F522 Q527 V528 T529	W487-Q525 HydrophobicContact CH2-CB 4.47Å; V521-Q525 WeakPolarHBondContact O-CG 3.43Å; V521-Q525 PolarHBondContact O-N 3.37Å; F522-Q525 PolarHBondContact O-N 3.21Å; Q525-Q527 VanDerWaalsContact C-N 3.29Å; Q525-Q527 PolarHBondContact O-N 3.46Å; Q525-V528 PolarHBondContact O-N 3.23Å; Q525-V528 VanDerWaalsContact O-N 3.15Å; Q525-T529 PolarHBondContact O-N 3.05Å; Q525-T529 PolarHBondContact O-OG1 3.49Å
526	Q	69.8	Low	57.8	Low	15 Å²	15	73.6 Å²	73.6	7%	0.07	42%	0.419	C	S	.	.	H	α-helix	trans	-53.8	-45	174.1	-173.8	-175.8	15.4	0	0	111.8	W487 E488 F522 R523 T529 T530	W487-Q526 HydrophobicContact CB-CG 3.87Å; W487-Q526 HydrophobicContact CD2-CB 4.2Å; W487-Q526 HydrophobicContact CD2-CG 4.02Å; W487-Q526 HydrophobicContact CE3-CB 3.73Å; W487-Q526 HydrophobicContact CE3-CG 3.94Å; W487-Q526 HydrophobicContact CG-CG 4Å; W487-Q526 HydrophobicContact CZ3-CB 4.13Å; E488-Q526 PolarHBondContact OE2-NE2 3.21Å; E488-Q526 VanDerWaalsContact OE2-NE2 3.11Å; F522-Q526 PolarHBondContact O-N 3.04Å; R523-Q526 VanDerWaalsContact CD-OE1 3.26Å; Q526-T529 WeakPolarHBondContact CA-OG1 3.5Å; Q526-T529 PolarHBondContact O-N 3.36Å; Q526-T529 PolarHBondContact O-OG1 3Å; Q526-T530 PolarHBondContact O-N 3.08Å; Q526-T530 VanDerWaalsContact O-N 3.09Å; Q526-T530 PolarHBondContact O-OG1 3.46Å
527	Q	57.4	Low	56.2	Low	94 Å²	94	78 Å²	78	44%	0.439	45%	0.452	S	S	.	.	H	α-helix	trans	-65.9	-37.4	179.2	-75.4	180	-0.7	0	0	113.1	R523 S524 Q525 T530 D531	R523-Q527 PolarHBondContact O-N 3.44Å; S524-Q527 PolarHBondContact O-N 3.48Å; Q525-Q527 VanDerWaalsContact C-N 3.29Å; Q525-Q527 PolarHBondContact O-N 3.46Å; Q527-T530 WeakPolarHBondContact CA-OG1 3.19Å; Q527-T530 PolarHBondContact O-N 3.06Å; Q527-T530 PolarHBondContact O-OG1 3.09Å; Q527-D531 PolarHBondContact O-N 2.95Å
528	V	60.2	Low	55	Low	90 Å²	90	86.6 Å²	86.6	55%	0.545	48%	0.483	S	S	.	.	H	α-helix	trans	-68.6	-36	177.2	173	0	0	0	0	111.5	S524 Q525	S524-V528 WeakPolarHBondContact O-CG2 3.38Å; S524-V528 PolarHBondContact O-N 2.93Å; Q525-V528 PolarHBondContact O-N 3.23Å; Q525-V528 VanDerWaalsContact O-N 3.15Å
529	T	55.7	Low	53.4	Low	52 Å²	52	85.4 Å²	85.4	32%	0.319	48%	0.481	S	S	.	.	H	α-helix	trans	-70.6	-34.6	175	32.8	0	0	0	0	113.2	Q525 Q526 D531	Q525-T529 PolarHBondContact O-N 3.05Å; Q525-T529 PolarHBondContact O-OG1 3.49Å; Q526-T529 WeakPolarHBondContact CA-OG1 3.5Å; Q526-T529 PolarHBondContact O-N 3.36Å; Q526-T529 PolarHBondContact O-OG1 3Å; T529-D531 VanDerWaalsContact C-N 3.33Å
530	T	52.5	Low	51.4	Low	78 Å²	78	90.2 Å²	90.2	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-72.6	-23.1	176.7	48.4	0	0	0	0	113.5	Q526 Q527 G532	Q526-T530 PolarHBondContact O-N 3.08Å; Q526-T530 VanDerWaalsContact O-N 3.09Å; Q526-T530 PolarHBondContact O-OG1 3.46Å; Q527-T530 WeakPolarHBondContact CA-OG1 3.19Å; Q527-T530 PolarHBondContact O-N 3.06Å; Q527-T530 PolarHBondContact O-OG1 3.09Å; T530-G532 VanDerWaalsContact C-N 3.29Å; T530-G532 PolarHBondContact O-N 2.8Å
531	D	46.9	Very low	49.8	Very low	140 Å²	140	92.9 Å²	92.9	75%	0.749	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	15	179.2	-76.8	-19.3	0	0	0	114.1	Q527 T529	Q527-D531 PolarHBondContact O-N 2.95Å; T529-D531 VanDerWaalsContact C-N 3.33Å
532	G	38.8	Very low	48.2	Very low	67 Å²	67	95.1 Å²	95.1	69%	0.691	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.4	17	162.9	0	0	0	0	0	117.4	T530	T530-G532 VanDerWaalsContact C-N 3.29Å; T530-G532 PolarHBondContact O-N 2.8Å
533	F	38	Very low	46.3	Very low	170 Å²	170	101.6 Å²	101.6	75%	0.746	57%	0.57	S	S	*	*			trans	-96	106.7	167.1	-88.3	-88.9	0	0	0	110.8	A535	F533-A535 PolarHBondContact O-N 2.73Å
534	S	37.4	Very low	44.5	Very low	119 Å²	119	106.1 Å²	106.1	83%	0.832	60%	0.597	S	S	*	*			trans	-73	126.9	177.5	79.2	0	0	0	0	112.5
535	A	37.1	Very low	42.9	Very low	84 Å²	84	112 Å²	112	69%	0.694	62%	0.62	S	S	*	*			trans	62.4	106.1	147.7	0	0	0	0	0	120.1	F533	F533-A535 PolarHBondContact O-N 2.73Å
536	L	32.7	Very low	41.2	Very low	170 Å²	170	110.8 Å²	110.8	89%	0.89	62%	0.623	S	S	*	*				-115.5	114.7	121.4	-85.9	164.7	0	0	0	107.5	W538	L536-W538 PolarHBondContact O-N 3.23Å
537	S	36.8	Very low	39.3	Very low	109 Å²	109	115.5 Å²	115.5	76%	0.762	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-53.1	121.4	176.9	55.6	0	0	0	0	111.3
538	W	38.3	Very low	38.4	Very low	187 Å²	187	120.4 Å²	120.4	71%	0.708	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-85.5	129.3	156.8	-99.3	59.7	0	0	0	109	L536 L540	L536-W538 PolarHBondContact O-N 3.23Å; W538-L540 PolarHBondContact O-N 3.2Å
539	P	36.5	Very low	37	Very low	76 Å²	76	121.8 Å²	121.8	49%	0.494	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-76.7	118	166.1	29.5	-27.2	0	0	0	108.2	A541 L542	P539-A541 HydrophobicContact CB-CB 4.28Å; P539-A541 PolarHBondContact O-N 2.93Å; P539-L542 PolarHBondContact O-N 3.32Å
540	L	34	Very low	36	Very low	159 Å²	159	122.7 Å²	122.7	83%	0.832	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-52.3	-7.8	165.9	-104.5	98.5	0	0	0	113.7	W538 L542	W538-L540 PolarHBondContact O-N 3.2Å; L540-L542 VanDerWaalsContact C-N 3.35Å; L540-L542 PolarHBondContact O-N 3Å
541	A	30.4	Very low	34.8	Very low	58 Å²	58	124.5 Å²	124.5	48%	0.479	71%	0.708	S	S	.	*	G	3₁₀ helix	trans	-69.5	-21.6	-179.6	0	0	0	0	0	114.8	P539 H545	P539-A541 HydrophobicContact CB-CB 4.28Å; P539-A541 PolarHBondContact O-N 2.93Å; A541-H545 PolarHBondContact O-N 3.38Å
542	L	35	Very low	34.1	Very low	119 Å²	119	124.1 Å²	124.1	62%	0.623	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-78.6	-17.4	-178.4	-82.8	164.7	0	0	0	114.2	P539 L540	P539-L542 PolarHBondContact O-N 3.32Å; L540-L542 VanDerWaalsContact C-N 3.35Å; L540-L542 PolarHBondContact O-N 3Å
543	F	35.8	Very low	33.8	Very low	172 Å²	172	128.5 Å²	128.5	75%	0.754	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-18	176.4	-127.5	-90.8	0	0	0	113.1
544	L	32.6	Very low	33.4	Very low	149 Å²	149	125.9 Å²	125.9	78%	0.78	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-10.8	179.1	-74.2	166.1	0	0	0	113.8
545	H	30.3	Very low	33.4	Very low	164 Å²	164	125.9 Å²	125.9	76%	0.759	72%	0.716	S	S	*	*			trans	-129.2	22.7	-176.7	-85.3	-73.9	0	0	0	115.2	A541	A541-H545 PolarHBondContact O-N 3.38Å
546	A	28.9	Very low	33.2	Very low	54 Å²	54	129.4 Å²	129.4	45%	0.446	72%	0.723	S	S	.	*	S	Bend	trans	-71.8	132.4	160.3	0	0	0	0	0	108.6	W548	A546-W548 VanDerWaalsContact O-CD1 3.31Å; A546-W548 PolarHBondContact O-N 2.92Å
547	P	29.8	Very low	33.5	Very low	114 Å²	114	127.2 Å²	127.2	74%	0.74	72%	0.719	S	S	*	*			trans	-71.8	105.1	-179.8	28	-30.4	0	0	0	108.9	S549	P547-S549 PolarHBondContact O-N 2.96Å
548	W	37.6	Very low	33.6	Very low	198 Å²	198	131.9 Å²	131.9	75%	0.75	74%	0.743	S	S	*	*			trans	-72.2	45.4	161.1	-67.6	64.2	0	0	0	109.7	A546 G550 M551	A546-W548 VanDerWaalsContact O-CD1 3.31Å; A546-W548 PolarHBondContact O-N 2.92Å; W548-G550 VanDerWaalsContact C-N 3.31Å; W548-G550 PolarHBondContact O-N 3.38Å; W548-G550 VanDerWaalsContact O-N 3.09Å; W548-M551 HydrophobicContact CE3-CB 4.47Å; W548-M551 HydrophobicContact CE3-CG 4.41Å; W548-M551 HydrophobicContact CE3-SD 3.46Å; W548-M551 HydrophobicContact CZ3-CE 4.28Å; W548-M551 HydrophobicContact CZ3-SD 3.31Å; W548-M551 WeakPolarHBondContact CZ3-SD 3.15Å
549	S	32.3	Very low	33.4	Very low	118 Å²	118	129.2 Å²	129.2	83%	0.825	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	80	175.8	-65.4	0	0	0	0	108.1	P547	P547-S549 PolarHBondContact O-N 2.96Å
550	G	33.3	Very low	33.2	Very low	71 Å²	71	131.9 Å²	131.9	73%	0.732	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.4	-17.4	175.4	0	0	0	0	0	115.3	W548 V552	W548-G550 VanDerWaalsContact C-N 3.31Å; W548-G550 PolarHBondContact O-N 3.38Å; W548-G550 VanDerWaalsContact O-N 3.09Å; G550-V552 PolarHBondContact O-N 3.02Å
551	M	29.1	Very low	33.2	Very low	116 Å²	116	130.4 Å²	130.4	57%	0.571	75%	0.754	S	S	*	*			trans	-84.3	94.8	171.2	-86.7	-173.5	171.9	0	0	109.9	W548 L553	W548-M551 HydrophobicContact CE3-CB 4.47Å; W548-M551 HydrophobicContact CE3-CG 4.41Å; W548-M551 HydrophobicContact CE3-SD 3.46Å; W548-M551 HydrophobicContact CZ3-CE 4.28Å; W548-M551 HydrophobicContact CZ3-SD 3.31Å; W548-M551 WeakPolarHBondContact CZ3-SD 3.15Å; M551-L553 PolarHBondContact O-N 2.92Å
552	V	32.3	Very low	33.4	Very low	133 Å²	133	134.7 Å²	134.7	81%	0.806	77%	0.77	S	S	*	*			trans	-64.1	104.9	158.4	178.3	0	0	0	0	106.4	G550 C554	G550-V552 PolarHBondContact O-N 3.02Å; V552-C554 PolarHBondContact O-N 2.74Å; V552-C554 VanDerWaalsContact O-N 3.14Å
553	L	32	Very low	33.3	Very low	158 Å²	158	135.7 Å²	135.7	83%	0.827	78%	0.779	S	S	*	*			trans	-60.2	112	165.5	-70	165.8	0	0	0	107.3	M551	M551-L553 PolarHBondContact O-N 2.92Å
554	C	30.2	Very low	33.1	Very low	115 Å²	115	133.3 Å²	133.3	78%	0.777	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-62.7	129.6	165	-84.1	0	0	0	0	108.4	V552	V552-C554 PolarHBondContact O-N 2.74Å; V552-C554 VanDerWaalsContact O-N 3.14Å
555	P	36.1	Very low	33.1	Very low	120 Å²	120	132.1 Å²	132.1	78%	0.779	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-68.9	140.8	172.3	27.6	-30.3	0	0	0	110.2
556	D	33.1	Very low	33.3	Very low	157 Å²	157	129.7 Å²	129.7	84%	0.84	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-52.9	135.2	176.9	-78.8	-43.3	0	0	0	111.9
557	P	38.4	Very low	33.7	Very low	124 Å²	124	136 Å²	136	81%	0.805	81%	0.811	S	S	*	*			trans	-84	113.5	161.9	30.9	-25.5	0	0	0	109.3
558	T	40.1	Very low	34	Very low	208 Å²	208	138 Å²	138	100%	1.276	82%	0.817	S	S	*	*			trans	-61.8	0	155.7	46.8	0	0	0	0	111.9

Retrieved 558 of 558 residues in 126.1 ms (Link to these results)

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