A0A087Y5K9_POEFO Loading...

Protein FAM151A

AlphaFold DB , UniProt , Accession A0A087Y5K9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 466 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	I	54.9	Low	57.6	Low	183 Å²	183	109.6 Å²	109.6	94%	0.938	62%	0.617	S	S	*	*				0	-54.8	0	-58	177.3	0	0	0	111.1	L3 S4 T5	I1-L3 VanDerWaalsContact C-N 3.33Å; I1-L3 PolarHBondContact O-N 3.46Å; I1-S4 PolarHBondContact O-N 3.29Å; I1-T5 PolarHBondContact O-N 3.42Å; I1-T5 PolarHBondContact O-OG1 3.24Å
2	M	50.8	Low	57.4	Low	171 Å²	171	109 Å²	109	84%	0.842	61%	0.61	S	S	*	*	H	α-helix	trans	-62	-29.1	179.3	-69.9	-111.4	-75.2	0	0	115.8	T5	M2-T5 PolarHBondContact O-OG1 3.01Å
3	L	49	Very low	57.2	Low	144 Å²	144	104.5 Å²	104.5	75%	0.754	60%	0.595	S	S	*	*	H	α-helix	trans	-76.8	-30.2	178.8	-152	73.3	0	0	0	112.4	I1 V7	I1-L3 VanDerWaalsContact C-N 3.33Å; I1-L3 PolarHBondContact O-N 3.46Å; L3-V7 WeakPolarHBondContact O-CG2 3.31Å; L3-V7 PolarHBondContact O-N 3.36Å
4	S	52.9	Low	57.6	Low	92 Å²	92	103.9 Å²	103.9	64%	0.643	59%	0.588	S	S	*	*	H	α-helix	trans	-76.7	-31.4	-178.9	-53.3	0	0	0	0	112.4	I1 G8	I1-S4 PolarHBondContact O-N 3.29Å; S4-G8 PolarHBondContact O-N 3.14Å; S4-G8 VanDerWaalsContact O-N 3.14Å
5	T	55.9	Low	57.7	Low	81 Å²	81	104.3 Å²	104.3	50%	0.497	59%	0.586	S	S	.	*	H	α-helix	trans	-72.6	-36.6	175.4	45.1	0	0	0	0	112.3	I1 M2 G8 L9	I1-T5 PolarHBondContact O-N 3.42Å; I1-T5 PolarHBondContact O-OG1 3.24Å; M2-T5 PolarHBondContact O-OG1 3.01Å; T5-G8 PolarHBondContact O-N 3.5Å; T5-L9 WeakPolarHBondContact O-CG 3.49Å; T5-L9 PolarHBondContact O-N 3.43Å
6	A	57.7	Low	57.4	Low	56 Å²	56	103.1 Å²	103.1	46%	0.463	58%	0.577	S	S	.	*	H	α-helix	trans	-66.4	-41.3	176.8	0	0	0	0	0	112.3	L9 F10	A6-L9 PolarHBondContact O-N 2.99Å; A6-F10 WeakPolarHBondContact O-CB 3.5Å; A6-F10 PolarHBondContact O-N 3.05Å; A6-F10 VanDerWaalsContact O-N 3.09Å
7	V	67.6	Low	57.1	Low	83 Å²	83	101.9 Å²	101.9	50%	0.503	57%	0.572	S	S	.	*	H	α-helix	trans	-67.9	-39.6	176.1	175.9	0	0	0	0	111.1	L3 F10 I11	L3-V7 WeakPolarHBondContact O-CG2 3.31Å; L3-V7 PolarHBondContact O-N 3.36Å; V7-F10 PolarHBondContact O-N 3.31Å; V7-I11 HydrophobicContact CG1-CD1 3.76Å; V7-I11 HydrophobicContact CG1-CG1 4.39Å; V7-I11 VanDerWaalsContact O-CG1 3.31Å; V7-I11 WeakPolarHBondContact O-CG1 3.38Å; V7-I11 PolarHBondContact O-N 3.09Å
8	G	59.9	Low	56.7	Low	41 Å²	41	99.7 Å²	99.7	42%	0.423	56%	0.563	S	S	.	*	H	α-helix	trans	-61.1	-43.5	175.6	0	0	0	0	0	113.3	S4 T5 L12	S4-G8 PolarHBondContact O-N 3.14Å; S4-G8 VanDerWaalsContact O-N 3.14Å; T5-G8 PolarHBondContact O-N 3.5Å; G8-L12 WeakPolarHBondContact O-CB 3.4Å; G8-L12 PolarHBondContact O-N 2.97Å
9	L	58.8	Low	56.3	Low	123 Å²	123	97.1 Å²	97.1	64%	0.644	56%	0.555	S	S	*	*	H	α-helix	trans	-67.3	-35.8	176.6	-76.7	165.3	0	0	0	112.6	T5 A6 L12 A13	T5-L9 WeakPolarHBondContact O-CG 3.49Å; T5-L9 PolarHBondContact O-N 3.43Å; A6-L9 PolarHBondContact O-N 2.99Å; L9-L12 PolarHBondContact O-N 3.49Å; L9-A13 WeakPolarHBondContact O-CB 3.49Å; L9-A13 PolarHBondContact O-N 2.97Å
10	F	64.3	Low	55.9	Low	144 Å²	144	96.2 Å²	96.2	63%	0.632	55%	0.552	S	S	*	*	H	α-helix	trans	-69.5	-41.4	178.1	-153.1	-101.4	0	0	0	111.8	A6 V7 A13 I14	A6-F10 WeakPolarHBondContact O-CB 3.5Å; A6-F10 PolarHBondContact O-N 3.05Å; A6-F10 VanDerWaalsContact O-N 3.09Å; V7-F10 PolarHBondContact O-N 3.31Å; F10-A13 PolarHBondContact O-N 3Å; F10-I14 HydrophobicContact CD1-CD1 3.49Å; F10-I14 VanDerWaalsContact CD1-CD1 3.49Å; F10-I14 HydrophobicContact CD1-CG1 4.34Å; F10-I14 HydrophobicContact CE1-CD1 3.59Å; F10-I14 HydrophobicContact CE1-CG1 4.42Å; F10-I14 WeakPolarHBondContact O-CB 3.26Å; F10-I14 VanDerWaalsContact O-CG1 3.26Å; F10-I14 WeakPolarHBondContact O-CG1 3.14Å; F10-I14 PolarHBondContact O-N 3.25Å
11	I	61.5	Low	55.5	Low	88 Å²	88	96.8 Å²	96.8	45%	0.451	55%	0.552	S	S	.	*	H	α-helix	trans	-67.1	-40.5	175.2	-65.8	170.4	0	0	0	110.6	V7 A13 I14 I15	V7-I11 HydrophobicContact CG1-CD1 3.76Å; V7-I11 HydrophobicContact CG1-CG1 4.39Å; V7-I11 VanDerWaalsContact O-CG1 3.31Å; V7-I11 WeakPolarHBondContact O-CG1 3.38Å; V7-I11 PolarHBondContact O-N 3.09Å; I11-A13 VanDerWaalsContact C-N 3.34Å; I11-A13 PolarHBondContact O-N 3.46Å; I11-I14 PolarHBondContact O-N 2.95Å; I11-I15 HydrophobicContact CG2-CD1 3.76Å; I11-I15 HydrophobicContact CG2-CG1 4.47Å; I11-I15 WeakPolarHBondContact O-CG1 3.34Å; I11-I15 PolarHBondContact O-N 3.4Å
12	L	55.3	Low	55.1	Low	102 Å²	102	95.3 Å²	95.3	53%	0.534	55%	0.545	S	S	.	.	H	α-helix	trans	-62.9	-40.7	176.4	-153.3	87.7	0	0	0	111.4	G8 L9 I15 I16	G8-L12 WeakPolarHBondContact O-CB 3.4Å; G8-L12 PolarHBondContact O-N 2.97Å; L9-L12 PolarHBondContact O-N 3.49Å; L12-I15 PolarHBondContact O-N 3.38Å; L12-I16 HydrophobicContact CD2-CD1 3.68Å; L12-I16 HydrophobicContact CG-CD1 3.62Å; L12-I16 HydrophobicContact CG-CG1 4.34Å; L12-I16 VanDerWaalsContact O-CB 3.27Å; L12-I16 WeakPolarHBondContact O-CB 3.27Å; L12-I16 WeakPolarHBondContact O-CG1 3.19Å; L12-I16 PolarHBondContact O-N 2.88Å
13	A	55.2	Low	54.6	Low	50 Å²	50	92.1 Å²	92.1	41%	0.413	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-40	174.4	0	0	0	0	0	112.3	L9 F10 I11 I15 V17	L9-A13 WeakPolarHBondContact O-CB 3.49Å; L9-A13 PolarHBondContact O-N 2.97Å; F10-A13 PolarHBondContact O-N 3Å; I11-A13 VanDerWaalsContact C-N 3.34Å; I11-A13 PolarHBondContact O-N 3.46Å; A13-I15 VanDerWaalsContact C-N 3.27Å; A13-I15 PolarHBondContact O-N 3.02Å; A13-V17 VanDerWaalsContact O-CB 3.27Å; A13-V17 WeakPolarHBondContact O-CB 3.37Å; A13-V17 WeakPolarHBondContact O-CG2 3.38Å; A13-V17 PolarHBondContact O-N 3.36Å
14	I	63.1	Low	54	Low	97 Å²	97	94.4 Å²	94.4	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-66.8	-26.4	176.6	-71.4	169	0	0	0	112.3	F10 I11 P18	F10-I14 HydrophobicContact CD1-CD1 3.49Å; F10-I14 VanDerWaalsContact CD1-CD1 3.49Å; F10-I14 HydrophobicContact CD1-CG1 4.34Å; F10-I14 HydrophobicContact CE1-CD1 3.59Å; F10-I14 HydrophobicContact CE1-CG1 4.42Å; F10-I14 WeakPolarHBondContact O-CB 3.26Å; F10-I14 VanDerWaalsContact O-CG1 3.26Å; F10-I14 WeakPolarHBondContact O-CG1 3.14Å; F10-I14 PolarHBondContact O-N 3.25Å; I11-I14 PolarHBondContact O-N 2.95Å; I14-P18 WeakPolarHBondContact O-CD 3.03Å; I14-P18 WeakPolarHBondContact O-CG 2.82Å
15	I	58	Low	53.4	Low	109 Å²	109	95.5 Å²	95.5	56%	0.559	54%	0.539	S	S	*	.	H	α-helix	trans	-91	-40.6	178.4	-64.7	170	0	0	0	111.3	I11 L12 A13 P18 A19	I11-I15 HydrophobicContact CG2-CD1 3.76Å; I11-I15 HydrophobicContact CG2-CG1 4.47Å; I11-I15 WeakPolarHBondContact O-CG1 3.34Å; I11-I15 PolarHBondContact O-N 3.4Å; L12-I15 PolarHBondContact O-N 3.38Å; A13-I15 VanDerWaalsContact C-N 3.27Å; A13-I15 PolarHBondContact O-N 3.02Å; I15-P18 WeakPolarHBondContact O-CD 3.15Å; I15-A19 VanDerWaalsContact O-CB 3.26Å; I15-A19 WeakPolarHBondContact O-CB 3.43Å; I15-A19 PolarHBondContact O-N 2.84Å
16	I	53.9	Low	52.7	Low	86 Å²	86	95.7 Å²	95.7	44%	0.441	55%	0.549	S	S	.	.	H	α-helix	trans	-70.4	-38.8	-178.8	-67.7	173.4	0	0	0	111.1	L12 A19 V20	L12-I16 HydrophobicContact CD2-CD1 3.68Å; L12-I16 HydrophobicContact CG-CD1 3.62Å; L12-I16 HydrophobicContact CG-CG1 4.34Å; L12-I16 VanDerWaalsContact O-CB 3.27Å; L12-I16 WeakPolarHBondContact O-CB 3.27Å; L12-I16 WeakPolarHBondContact O-CG1 3.19Å; L12-I16 PolarHBondContact O-N 2.88Å; I16-A19 PolarHBondContact O-N 2.81Å; I16-V20 HydrophobicContact CG2-CG2 3.88Å; I16-V20 WeakPolarHBondContact O-CB 3.26Å; I16-V20 VanDerWaalsContact O-CG2 3.23Å; I16-V20 WeakPolarHBondContact O-CG2 3.23Å; I16-V20 PolarHBondContact O-N 3.29Å
17	V	52.4	Low	52	Low	82 Å²	82	99.8 Å²	99.8	50%	0.497	57%	0.568	S	S	.	*	H	α-helix	trans	-65.4	-46.9	-176.7	173.1	0	0	0	0	112.2	A13 V20 I21	A13-V17 VanDerWaalsContact O-CB 3.27Å; A13-V17 WeakPolarHBondContact O-CB 3.37Å; A13-V17 WeakPolarHBondContact O-CG2 3.38Å; A13-V17 PolarHBondContact O-N 3.36Å; V17-V20 PolarHBondContact O-N 3Å; V17-I21 HydrophobicContact CG1-CD1 3.74Å; V17-I21 WeakPolarHBondContact O-CB 3.27Å; V17-I21 WeakPolarHBondContact O-CD1 3.35Å; V17-I21 WeakPolarHBondContact O-CG1 3.49Å; V17-I21 PolarHBondContact O-N 3.49Å
18	P	49.3	Very low	51.3	Low	63 Å²	63	101.3 Å²	101.3	41%	0.409	57%	0.568	S	S	.	*	H	α-helix	trans	-66.9	-36.4	173	-20.4	33.3	0	0	0	112.9	I14 I15 I21 L22	I14-P18 WeakPolarHBondContact O-CD 3.03Å; I14-P18 WeakPolarHBondContact O-CG 2.82Å; I15-P18 WeakPolarHBondContact O-CD 3.15Å; P18-I21 PolarHBondContact O-N 3.21Å; P18-L22 WeakPolarHBondContact O-CB 3.42Å; P18-L22 PolarHBondContact O-N 3.33Å
19	A	48.8	Very low	51	Low	49 Å²	49	102.9 Å²	102.9	41%	0.405	58%	0.577	S	S	.	*	H	α-helix	trans	-64.2	-41.8	177.2	0	0	0	0	0	111.7	I15 I16 L22 T23	I15-A19 VanDerWaalsContact O-CB 3.26Å; I15-A19 WeakPolarHBondContact O-CB 3.43Å; I15-A19 PolarHBondContact O-N 2.84Å; I16-A19 PolarHBondContact O-N 2.81Å; A19-L22 PolarHBondContact O-N 3.48Å; A19-T23 WeakPolarHBondContact O-CG2 3.48Å; A19-T23 PolarHBondContact O-N 3.06Å; A19-T23 PolarHBondContact O-OG1 2.96Å; A19-T23 VanDerWaalsContact O-OG1 3.06Å
20	V	48.5	Very low	50.9	Low	80 Å²	80	103 Å²	103	49%	0.485	59%	0.585	S	S	.	*	H	α-helix	trans	-71	-30.2	175.8	172.5	0	0	0	0	112	I16 V17 T23 R24	I16-V20 HydrophobicContact CG2-CG2 3.88Å; I16-V20 WeakPolarHBondContact O-CB 3.26Å; I16-V20 VanDerWaalsContact O-CG2 3.23Å; I16-V20 WeakPolarHBondContact O-CG2 3.23Å; I16-V20 PolarHBondContact O-N 3.29Å; V17-V20 PolarHBondContact O-N 3Å; V20-T23 WeakPolarHBondContact CA-OG1 3.37Å; V20-T23 PolarHBondContact O-OG1 3.35Å; V20-R24 PolarHBondContact O-N 3.32Å
21	I	48.3	Very low	50.6	Low	109 Å²	109	98.2 Å²	98.2	56%	0.559	57%	0.567	S	S	*	*	H	α-helix	trans	-73.2	-34.9	172.6	-68.1	166.2	0	0	0	111.1	V17 P18	V17-I21 HydrophobicContact CG1-CD1 3.74Å; V17-I21 WeakPolarHBondContact O-CB 3.27Å; V17-I21 WeakPolarHBondContact O-CD1 3.35Å; V17-I21 WeakPolarHBondContact O-CG1 3.49Å; V17-I21 PolarHBondContact O-N 3.49Å; P18-I21 PolarHBondContact O-N 3.21Å
22	L	45.5	Very low	51	Low	151 Å²	151	96.9 Å²	96.9	79%	0.791	56%	0.564	S	S	*	*	H	α-helix	trans	-76.3	-23.3	174.8	-106.5	86.6	0	0	0	113.8	P18 A19	P18-L22 WeakPolarHBondContact O-CB 3.42Å; P18-L22 PolarHBondContact O-N 3.33Å; A19-L22 PolarHBondContact O-N 3.48Å
23	T	40.2	Very low	52.3	Low	105 Å²	105	100.3 Å²	100.3	64%	0.644	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	5.7	176.9	60	0	0	0	0	113.6	A19 V20 P25	A19-T23 WeakPolarHBondContact O-CG2 3.48Å; A19-T23 PolarHBondContact O-N 3.06Å; A19-T23 PolarHBondContact O-OG1 2.96Å; A19-T23 VanDerWaalsContact O-OG1 3.06Å; V20-T23 WeakPolarHBondContact CA-OG1 3.37Å; V20-T23 PolarHBondContact O-OG1 3.35Å; T23-P25 WeakPolarHBondContact O-CD 3.32Å
24	R	36.7	Very low	54	Low	192 Å²	192	98.9 Å²	98.9	73%	0.725	57%	0.567	S	S	*	*	S	Bend	trans	-65.4	120.9	164.3	-85.1	-175.8	171.9	-174.6	-2.4	106.9	V20 A26	V20-R24 PolarHBondContact O-N 3.32Å; R24-A26 PolarHBondContact O-N 3.09Å; R24-A26 VanDerWaalsContact O-N 3.09Å
25	P	40.8	Very low	55.4	Low	115 Å²	115	98.1 Å²	98.1	75%	0.747	57%	0.567	S	S	*	*			trans	-53	127.8	167.4	23.4	-30.3	0	0	0	105.8	T23 T27	T23-P25 WeakPolarHBondContact O-CD 3.32Å; P25-T27 PolarHBondContact O-N 2.66Å
26	A	41.7	Very low	57.3	Low	85 Å²	85	93.1 Å²	93.1	70%	0.702	54%	0.541	S	S	*	.			trans	-43.7	123.1	175.1	0	0	0	0	0	106.7	R24 K28	R24-A26 PolarHBondContact O-N 3.09Å; R24-A26 VanDerWaalsContact O-N 3.09Å; A26-K28 PolarHBondContact O-N 3Å
27	T	42.8	Very low	59.3	Low	141 Å²	141	89.6 Å²	89.6	87%	0.865	53%	0.526	S	S	*	.			trans	-59.6	92.1	171.1	39.3	0	0	0	0	105.4	P25 A29	P25-T27 PolarHBondContact O-N 2.66Å; T27-A29 PolarHBondContact O-N 3.18Å
28	K	52.8	Low	61.3	Low	116 Å²	116	86.1 Å²	86.1	50%	0.504	51%	0.507	S	S	.	.			trans	-53.5	126.2	-178.1	-73.3	-175.1	171	-172	0	105.5	A26 E49 R124	A26-K28 PolarHBondContact O-N 3Å; K28-E49 IonicContact NZ-OE1 2.72Å; K28-E49 PolarHBondContact NZ-OE1 3.07Å; K28-E49 IonicContact NZ-OE2 3.78Å; K28-R124 VanDerWaalsContact CB-CZ 3.49Å; K28-R124 PolarHBondContact O-NH2 3.1Å; K28-R124 VanDerWaalsContact O-NH2 3.07Å
29	A	53.1	Low	63.6	Low	74 Å²	74	84.6 Å²	84.6	61%	0.612	50%	0.496	S	S	*	.			trans	-42	151.8	-174.9	0	0	0	0	0	112.5	T27 V31	T27-A29 PolarHBondContact O-N 3.18Å; A29-V31 PolarHBondContact O-N 2.72Å; A29-V31 VanDerWaalsContact O-N 3.1Å
30	P	57.2	Low	65.9	Low	126 Å²	126	82.3 Å²	82.3	82%	0.818	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-50.9	122.8	174.5	-19.5	29.4	0	0	0	109
31	V	57.8	Low	68.2	Low	42 Å²	42	78.5 Å²	78.5	26%	0.255	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-64	128.5	179.6	-176	0	0	0	0	107.1	A29 F43	A29-V31 PolarHBondContact O-N 2.72Å; A29-V31 VanDerWaalsContact O-N 3.1Å; V31-F43 HydrophobicContact CG1-CE2 4.47Å
32	P	68.9	Low	70.5	Confident	60 Å²	60	76.1 Å²	76.1	39%	0.39	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-51.8	150.9	173.8	-25.3	33.9	0	0	0	111.6	F34 Q46 N154	P32-F34 PolarHBondContact O-N 2.87Å; P32-Q46 HydrophobicContact CG-CB 4.38Å; P32-N154 PolarHBondContact O-ND2 2.7Å
33	L	82.4	Confident	72.9	Confident	174 Å²	174	69.1 Å²	69.1	91%	0.911	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-60.6	125.1	171.4	-90.6	147.1	0	0	0	109.2	N154	L33-N154 WeakPolarHBondContact CA-OD1 2.68Å
34	F	91	Very high	75.6	Confident	20 Å²	20	64.1 Å²	64.1	9%	0.088	38%	0.375	C	S	.	.			trans	-133.3	130.8	-171.8	-153.9	-79.5	0	0	0	110.1	P32 G38 D39 D42 F43 N154 P156	P32-F34 PolarHBondContact O-N 2.87Å; F34-G38 VanDerWaalsContact CE1-CA 3.46Å; F34-D39 WeakPolarHBondContact CZ-O 3.37Å; F34-D42 HydrophobicContact CE2-CB 3.99Å; F34-D42 HydrophobicContact CZ-CB 3.99Å; F34-F43 HydrophobicContact CB-CD2 4.19Å; F34-F43 HydrophobicContact CD1-CB 4.15Å; F34-F43 AromaticContact CD1-CD2 4Å; F34-F43 HydrophobicContact CD1-CD2 4Å; F34-F43 HydrophobicContact CD1-CG 4.48Å; F34-F43 HydrophobicContact CD2-CB 4.13Å; F34-F43 HydrophobicContact CD2-CD2 4.05Å; F34-F43 HydrophobicContact CE1-CB 3.8Å; F34-F43 VanDerWaalsContact CE2-CA 3.46Å; F34-F43 HydrophobicContact CE2-CB 3.76Å; F34-F43 HydrophobicContact CG-CB 4.33Å; F34-F43 AromaticContact CG-CD2 3.78Å; F34-F43 HydrophobicContact CG-CD2 3.78Å; F34-F43 HydrophobicContact CZ-CB 3.6Å; F34-N154 PolarHBondContact N-OD1 2.71Å; F34-N154 CarbonylContact O-C 3.56Å; F34-N154 WeakPolarHBondContact O-CA 3.33Å; F34-N154 PolarHBondContact O-OD1 2.76Å; F34-P156 HydrophobicContact CD1-CG 4.06Å; F34-P156 HydrophobicContact CE1-CG 3.55Å; F34-P156 HydrophobicContact CZ-CG 4.35Å
35	T	93.8	Very high	78.4	Confident	82 Å²	82	57.7 Å²	57.7	50%	0.503	35%	0.354	S	S	.	.			trans	-83.7	158.5	-175.7	66.9	0	0	0	0	112.1	G37 G38	T35-G37 VanDerWaalsContact C-N 3.29Å; T35-G37 PolarHBondContact O-N 3.45Å; T35-G38 PolarHBondContact O-N 3.11Å; T35-G38 VanDerWaalsContact O-N 3.16Å; T35-G38 PolarHBondContact OG1-N 3.36Å; T35-G38 VanDerWaalsContact OG1-N 3.16Å
36	T	97.3	Very high	80.9	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.018	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-26	-179.8	47.1	0	0	0	0	113.3	I153 R155 P156 V157 F189 D191	T36-I153 HydrophobicContact CG2-CB 3.52Å; T36-I153 HydrophobicContact CG2-CD1 4.46Å; T36-I153 HydrophobicContact CG2-CG2 3.46Å; T36-I153 VanDerWaalsContact CG2-CG2 3.46Å; T36-R155 WeakPolarHBondContact CA-O 3.47Å; T36-P156 WeakPolarHBondContact O-CA 3.28Å; T36-V157 HydrophobicContact CG2-CG2 3.89Å; T36-V157 PolarHBondContact O-N 3.46Å; T36-F189 HydrophobicContact CG2-CE1 4.27Å; T36-F189 HydrophobicContact CG2-CZ 4.03Å; T36-D191 CarbonylContact C-O 3.54Å; T36-D191 WeakPolarHBondContact CB-O 3.32Å; T36-D191 PolarHBondContact N-OD2 3Å; T36-D191 PolarHBondContact OG1-O 3.48Å; T36-D191 PolarHBondContact OG1-OD2 3.41Å
37	G	96.5	Very high	83.2	Confident	12 Å²	12	53.3 Å²	53.3	12%	0.124	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	6.4	171.9	0	0	0	0	0	115	T35 D191	T35-G37 VanDerWaalsContact C-N 3.29Å; T35-G37 PolarHBondContact O-N 3.45Å; G37-D191 VanDerWaalsContact CA-OD1 3.25Å; G37-D191 WeakPolarHBondContact CA-OD1 3.44Å; G37-D191 VanDerWaalsContact N-CG 3.31Å; G37-D191 PolarHBondContact N-O 2.92Å; G37-D191 PolarHBondContact N-OD1 3.26Å; G37-D191 PolarHBondContact N-OD2 3.45Å
38	G	94.8	Very high	85.6	Confident	10 Å²	10	49.6 Å²	49.6	10%	0.103	30%	0.3	C	S	.	.	S	Bend	trans	-67.2	164.3	176.6	0	0	0	0	0	112.6	F34 T35	F34-G38 VanDerWaalsContact CE1-CA 3.46Å; T35-G38 PolarHBondContact O-N 3.11Å; T35-G38 VanDerWaalsContact O-N 3.16Å; T35-G38 PolarHBondContact OG1-N 3.36Å; T35-G38 VanDerWaalsContact OG1-N 3.16Å
39	D	96.1	Very high	87.6	Confident	31 Å²	31	46.9 Å²	46.9	17%	0.166	29%	0.289	C	S	.	.			trans	-72.5	140.7	-177.5	-170.3	-92.2	0	0	0	112.8	F34 L41 D42 F43 K230	F34-D39 WeakPolarHBondContact CZ-O 3.37Å; D39-L41 WeakPolarHBondContact OD1-CA 3.29Å; D39-L41 WeakPolarHBondContact OD1-CB 3.35Å; D39-L41 PolarHBondContact OD1-N 3.48Å; D39-D42 HydrophobicContact CB-CB 3.91Å; D39-D42 WeakPolarHBondContact CB-OD2 3.45Å; D39-D42 PolarHBondContact O-N 2.91Å; D39-D42 PolarHBondContact OD1-N 3.31Å; D39-F43 PolarHBondContact O-N 3.04Å; D39-F43 VanDerWaalsContact O-N 3.08Å; D39-K230 HydrophobicContact CB-CD 4.45Å
40	M	97.6	Very high	89.6	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-40.9	-177.7	-168.9	78.5	-97.2	0	0	112.3	F43 L44 I80 P156 W158 Y286	M40-F43 HydrophobicContact CE-CB 4.14Å; M40-F43 HydrophobicContact CE-CD1 3.32Å; M40-F43 HydrophobicContact CE-CE1 4.05Å; M40-F43 HydrophobicContact CE-CG 4.06Å; M40-F43 PolarHBondContact O-N 3.4Å; M40-L44 HydrophobicContact CE-CD2 4.31Å; M40-L44 HydrophobicContact CE-CG 4.21Å; M40-L44 HydrophobicContact CG-CD1 4.47Å; M40-L44 VanDerWaalsContact O-CG 3.29Å; M40-L44 WeakPolarHBondContact O-CG 3.48Å; M40-L44 PolarHBondContact O-N 3.43Å; M40-I80 HydrophobicContact CE-CD1 4.48Å; M40-I80 HydrophobicContact CE-CG1 4.23Å; M40-I80 HydrophobicContact CG-CD1 3.55Å; M40-I80 HydrophobicContact CG-CG1 4.28Å; M40-I80 HydrophobicContact SD-CD1 3.75Å; M40-I80 HydrophobicContact SD-CG1 3.89Å; M40-I80 HydrophobicContact SD-CG2 4.46Å; M40-P156 HydrophobicContact CE-CB 4.03Å; M40-P156 HydrophobicContact CE-CG 3.56Å; M40-P156 HydrophobicContact SD-CB 3.98Å; M40-P156 HydrophobicContact SD-CG 4.1Å; M40-W158 HydrophobicContact CB-CH2 4.47Å; M40-W158 HydrophobicContact CB-CZ2 3.48Å; M40-W158 VanDerWaalsContact CB-CZ2 3.48Å; M40-W158 HydrophobicContact CG-CZ2 3.99Å; M40-Y286 HydrophobicContact CB-CE1 3.98Å; M40-Y286 HydrophobicContact CG-CE1 4.19Å
41	L	97.4	Very high	91.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-72.1	-36.5	179.4	-60.7	176.9	0	0	0	111.1	D39 F43 L44 L45 I50 A58 A283 Y286	D39-L41 WeakPolarHBondContact OD1-CA 3.29Å; D39-L41 WeakPolarHBondContact OD1-CB 3.35Å; D39-L41 PolarHBondContact OD1-N 3.48Å; L41-F43 VanDerWaalsContact C-N 3.3Å; L41-F43 PolarHBondContact O-N 3.2Å; L41-L44 PolarHBondContact O-N 2.75Å; L41-L45 VanDerWaalsContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CB 3.18Å; L41-L45 PolarHBondContact O-N 2.88Å; L41-I50 HydrophobicContact CB-CD1 4.32Å; L41-I50 HydrophobicContact CD2-CD1 3.87Å; L41-A58 HydrophobicContact CD2-CB 4.14Å; L41-A283 HydrophobicContact CD1-CB 3.97Å; L41-Y286 HydrophobicContact CD1-CE1 4.29Å; L41-Y286 HydrophobicContact CD2-CD1 4.35Å; L41-Y286 HydrophobicContact CD2-CE1 3.63Å; L41-Y286 HydrophobicContact CG-CE1 3.72Å
42	D	96.6	Very high	93.1	Very high	59 Å²	59	44.8 Å²	44.8	32%	0.316	27%	0.265	S	S	.	.	H	α-helix	trans	-57.8	-45.3	171.6	-74.3	-25.1	0	0	0	111.3	F34 D39 L45 Q46 H53	F34-D42 HydrophobicContact CE2-CB 3.99Å; F34-D42 HydrophobicContact CZ-CB 3.99Å; D39-D42 HydrophobicContact CB-CB 3.91Å; D39-D42 WeakPolarHBondContact CB-OD2 3.45Å; D39-D42 PolarHBondContact O-N 2.91Å; D39-D42 PolarHBondContact OD1-N 3.31Å; D42-L45 PolarHBondContact O-N 3.46Å; D42-Q46 VanDerWaalsContact O-CB 3.29Å; D42-Q46 WeakPolarHBondContact O-CB 3.27Å; D42-Q46 WeakPolarHBondContact O-CG 3.45Å; D42-Q46 PolarHBondContact O-N 3.04Å; D42-H53 IonicContact OD1-CD2 3.95Å; D42-H53 IonicContact OD1-CE1 2.87Å; D42-H53 IonicContact OD1-NE2 2.7Å; D42-H53 PolarHBondContact OD1-NE2 2.78Å
43	F	96.4	Very high	94.3	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.018	26%	0.263	C	S	.	.	H	α-helix	trans	-61.4	-46.4	178.2	172.1	-101.7	0	0	0	112	V31 F34 D39 M40 L41 S47 R124 R155 P156	V31-F43 HydrophobicContact CG1-CE2 4.47Å; F34-F43 HydrophobicContact CB-CD2 4.19Å; F34-F43 HydrophobicContact CD1-CB 4.15Å; F34-F43 AromaticContact CD1-CD2 4Å; F34-F43 HydrophobicContact CD1-CD2 4Å; F34-F43 HydrophobicContact CD1-CG 4.48Å; F34-F43 HydrophobicContact CD2-CB 4.13Å; F34-F43 HydrophobicContact CD2-CD2 4.05Å; F34-F43 HydrophobicContact CE1-CB 3.8Å; F34-F43 VanDerWaalsContact CE2-CA 3.46Å; F34-F43 HydrophobicContact CE2-CB 3.76Å; F34-F43 HydrophobicContact CG-CB 4.33Å; F34-F43 AromaticContact CG-CD2 3.78Å; F34-F43 HydrophobicContact CG-CD2 3.78Å; F34-F43 HydrophobicContact CZ-CB 3.6Å; D39-F43 PolarHBondContact O-N 3.04Å; D39-F43 VanDerWaalsContact O-N 3.08Å; M40-F43 HydrophobicContact CE-CB 4.14Å; M40-F43 HydrophobicContact CE-CD1 3.32Å; M40-F43 HydrophobicContact CE-CE1 4.05Å; M40-F43 HydrophobicContact CE-CG 4.06Å; M40-F43 PolarHBondContact O-N 3.4Å; L41-F43 VanDerWaalsContact C-N 3.3Å; L41-F43 PolarHBondContact O-N 3.2Å; F43-S47 WeakPolarHBondContact O-CB 3.12Å; F43-S47 PolarHBondContact O-N 3.46Å; F43-S47 PolarHBondContact O-OG 3.11Å; F43-R124 VanDerWaalsContact CE1-O 3.27Å; F43-R124 WeakPolarHBondContact CE1-O 3.48Å; F43-R124 VanDerWaalsContact CZ-O 3.23Å; F43-R124 WeakPolarHBondContact CZ-O 3.17Å; F43-R155 HydrophobicContact CD2-CB 4.15Å; F43-R155 HydrophobicContact CE1-CB 4.32Å; F43-R155 HydrophobicContact CE2-CB 3.59Å; F43-R155 HydrophobicContact CZ-CB 3.68Å; F43-P156 HydrophobicContact CB-CG 3.57Å; F43-P156 HydrophobicContact CD1-CG 4.38Å; F43-P156 HydrophobicContact CG-CG 3.93Å
44	L	96.6	Very high	95	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-67.2	-39.3	-179.3	-66.9	179.9	0	0	0	111.9	M40 L41 S47 G48 E49 I50 A58 M79 I80	M40-L44 HydrophobicContact CE-CD2 4.31Å; M40-L44 HydrophobicContact CE-CG 4.21Å; M40-L44 HydrophobicContact CG-CD1 4.47Å; M40-L44 VanDerWaalsContact O-CG 3.29Å; M40-L44 WeakPolarHBondContact O-CG 3.48Å; M40-L44 PolarHBondContact O-N 3.43Å; L41-L44 PolarHBondContact O-N 2.75Å; L44-S47 PolarHBondContact O-N 2.69Å; L44-G48 PolarHBondContact O-N 2.96Å; L44-E49 HydrophobicContact CB-CB 4.44Å; L44-E49 HydrophobicContact CD2-CB 4.25Å; L44-E49 HydrophobicContact CD2-CG 4.47Å; L44-E49 PolarHBondContact O-N 2.91Å; L44-I50 HydrophobicContact CB-CD1 3.7Å; L44-I50 HydrophobicContact CB-CG1 3.81Å; L44-I50 HydrophobicContact CB-CG2 4.28Å; L44-I50 HydrophobicContact CD1-CD1 4.45Å; L44-I50 PolarHBondContact O-N 3.43Å; L44-A58 HydrophobicContact CD1-CB 3.67Å; L44-M79 HydrophobicContact CD1-CB 4.23Å; L44-M79 HydrophobicContact CD1-SD 4.04Å; L44-M79 HydrophobicContact CD2-CB 3.72Å; L44-M79 HydrophobicContact CD2-CG 4.26Å; L44-M79 HydrophobicContact CD2-SD 4.31Å; L44-I80 HydrophobicContact CD1-CD1 4.23Å
45	L	95.3	Very high	95.2	Very high	56 Å²	56	36.6 Å²	36.6	29%	0.293	22%	0.217	S	C	.	.	H	α-helix	trans	-66.2	-48.8	176.8	-174.2	68.7	0	0	0	111.2	L41 D42 S47 G48 I50 H53	L41-L45 VanDerWaalsContact O-CB 3.24Å; L41-L45 WeakPolarHBondContact O-CB 3.18Å; L41-L45 PolarHBondContact O-N 2.88Å; D42-L45 PolarHBondContact O-N 3.46Å; L45-S47 PolarHBondContact O-N 3.18Å; L45-G48 PolarHBondContact O-N 3.09Å; L45-I50 HydrophobicContact CB-CG1 4.18Å; L45-I50 HydrophobicContact CD1-CG1 4.42Å; L45-I50 WeakPolarHBondContact CD1-O 3.3Å; L45-H53 WeakPolarHBondContact CD2-CE1 3.1Å
46	Q	92.6	Very high	95.4	Very high	95 Å²	95	33.1 Å²	33.1	44%	0.444	20%	0.195	S	C	.	.	H	α-helix	trans	-64.5	-28.7	177.7	-71.2	175.6	31.4	0	0	112.6	P32 D42 G48	P32-Q46 HydrophobicContact CG-CB 4.38Å; D42-Q46 VanDerWaalsContact O-CB 3.29Å; D42-Q46 WeakPolarHBondContact O-CB 3.27Å; D42-Q46 WeakPolarHBondContact O-CG 3.45Å; D42-Q46 PolarHBondContact O-N 3.04Å; Q46-G48 VanDerWaalsContact C-N 3.26Å
47	S	90.9	Very high	95.3	Very high	14 Å²	14	34.9 Å²	34.9	10%	0.098	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-8.6	174.4	-61.2	0	0	0	0	113.3	F43 L44 L45 E49	F43-S47 WeakPolarHBondContact O-CB 3.12Å; F43-S47 PolarHBondContact O-N 3.46Å; F43-S47 PolarHBondContact O-OG 3.11Å; L44-S47 PolarHBondContact O-N 2.69Å; L45-S47 PolarHBondContact O-N 3.18Å; S47-E49 VanDerWaalsContact C-N 3.31Å
48	G	93	Very high	95.4	Very high	62 Å²	62	34.4 Å²	34.4	64%	0.639	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	73	20.4	-177.5	0	0	0	0	0	114.1	L44 L45 Q46	L44-G48 PolarHBondContact O-N 2.96Å; L45-G48 PolarHBondContact O-N 3.09Å; Q46-G48 VanDerWaalsContact C-N 3.26Å
49	E	94.5	Very high	95.4	Very high	59 Å²	59	34.9 Å²	34.9	28%	0.276	20%	0.2	S	C	.	.	S	Bend	trans	-84.4	-27.9	179.7	-58.7	-61.8	155.1	0	0	111.8	K28 L44 S47 M79	K28-E49 IonicContact NZ-OE1 2.72Å; K28-E49 PolarHBondContact NZ-OE1 3.07Å; K28-E49 IonicContact NZ-OE2 3.78Å; L44-E49 HydrophobicContact CB-CB 4.44Å; L44-E49 HydrophobicContact CD2-CB 4.25Å; L44-E49 HydrophobicContact CD2-CG 4.47Å; L44-E49 PolarHBondContact O-N 2.91Å; S47-E49 VanDerWaalsContact C-N 3.31Å; E49-M79 HydrophobicContact CB-CE 4.17Å; E49-M79 HydrophobicContact CB-CG 4.21Å; E49-M79 HydrophobicContact CB-SD 4Å; E49-M79 WeakPolarHBondContact O-CE 3.35Å
50	I	96.1	Very high	95.4	Very high	14 Å²	14	34.4 Å²	34.4	7%	0.072	20%	0.196	C	C	.	.			trans	-128.2	158.1	174.1	66.5	-178.5	0	0	0	110.7	L41 L44 L45 E52 L57 M79	L41-I50 HydrophobicContact CB-CD1 4.32Å; L41-I50 HydrophobicContact CD2-CD1 3.87Å; L44-I50 HydrophobicContact CB-CD1 3.7Å; L44-I50 HydrophobicContact CB-CG1 3.81Å; L44-I50 HydrophobicContact CB-CG2 4.28Å; L44-I50 HydrophobicContact CD1-CD1 4.45Å; L44-I50 PolarHBondContact O-N 3.43Å; L45-I50 HydrophobicContact CB-CG1 4.18Å; L45-I50 HydrophobicContact CD1-CG1 4.42Å; L45-I50 WeakPolarHBondContact CD1-O 3.3Å; I50-E52 VanDerWaalsContact CD1-O 3.24Å; I50-E52 WeakPolarHBondContact CD1-O 3.39Å; I50-L57 HydrophobicContact CB-CB 4.02Å; I50-L57 HydrophobicContact CB-CD1 4.16Å; I50-L57 HydrophobicContact CG2-CB 3.58Å; I50-M79 HydrophobicContact CG2-CE 3.87Å; I50-M79 HydrophobicContact CG2-SD 3.59Å; I50-M79 VanDerWaalsContact CG2-SD 3.59Å
51	S	94.1	Very high	95.4	Very high	100 Å²	100	36.3 Å²	36.3	70%	0.699	20%	0.204	S	C	*	.	S	Bend	trans	-93.5	-17.5	-178	52.5	0	0	0	0	114.6
52	E	93.8	Very high	95.2	Very high	85 Å²	85	38.7 Å²	38.7	40%	0.397	22%	0.215	S	C	.	.	S	Bend	trans	-156.8	164.3	-175.1	61.4	-172.9	157.4	0	0	110.7	I50 D54 L57	I50-E52 VanDerWaalsContact CD1-O 3.24Å; I50-E52 WeakPolarHBondContact CD1-O 3.39Å; E52-D54 HydrophobicContact CG-CB 4.11Å; E52-D54 PolarHBondContact O-N 3.38Å; E52-L57 HydrophobicContact CG-CD1 3.7Å
53	H	94.6	Very high	95.1	Very high	77 Å²	77	40.4 Å²	40.4	36%	0.356	22%	0.217	S	C	.	.	S	Bend	trans	-74.1	71.3	176.2	-66.1	90.3	0	0	0	112.2	D42 L45 A283	D42-H53 IonicContact OD1-CD2 3.95Å; D42-H53 IonicContact OD1-CE1 2.87Å; D42-H53 IonicContact OD1-NE2 2.7Å; D42-H53 PolarHBondContact OD1-NE2 2.78Å; L45-H53 WeakPolarHBondContact CD2-CE1 3.1Å; H53-A283 HydrophobicContact CB-CB 4.09Å; H53-A283 WeakPolarHBondContact O-CB 3.37Å; H53-A283 PolarHBondContact O-N 2.85Å
54	D	95.6	Very high	95.2	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.021	22%	0.216	C	C	.	.			trans	-129	117.1	175.1	-171.9	-18.7	0	0	0	110.3	E52 L56 L57 R277 P282	E52-D54 HydrophobicContact CG-CB 4.11Å; E52-D54 PolarHBondContact O-N 3.38Å; D54-L56 PolarHBondContact O-N 3.14Å; D54-L56 VanDerWaalsContact OD1-CB 3.24Å; D54-L56 WeakPolarHBondContact OD1-CB 3.27Å; D54-L56 PolarHBondContact OD1-N 3.29Å; D54-L57 HydrophobicContact CB-CD1 4.21Å; D54-L57 HydrophobicContact CB-CG 4.15Å; D54-L57 WeakPolarHBondContact O-CB 3.06Å; D54-L57 PolarHBondContact O-N 2.6Å; D54-R277 IonicContact OD1-CZ 2.94Å; D54-R277 IonicContact OD1-NH1 2.69Å; D54-R277 PolarHBondContact OD1-NH1 2.68Å; D54-R277 IonicContact OD2-CZ 2.93Å; D54-R277 VanDerWaalsContact OD2-CZ 3.32Å; D54-R277 IonicContact OD2-NH1 2.63Å; D54-R277 PolarHBondContact OD2-NH1 3.16Å; D54-R277 IonicContact OD2-NH2 3.83Å; D54-R277 PolarHBondContact OD2-NH2 3.27Å; D54-P282 HydrophobicContact CB-CB 4.06Å
55	G	97	Very high	95.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.1	-179.5	0	0	0	0	0	114.7	L57 P282 V285	G55-L57 VanDerWaalsContact C-N 3.26Å; G55-P282 PolarHBondContact N-O 3.02Å; G55-V285 WeakPolarHBondContact CA-O 3.32Å
56	L	96.5	Very high	95.4	Very high	9 Å²	9	39.6 Å²	39.6	5%	0.047	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.4	165.8	-178.2	53.4	0	0	0	112.8	D54 Y287 L294 F297 K298 A301	D54-L56 PolarHBondContact O-N 3.14Å; D54-L56 VanDerWaalsContact OD1-CB 3.24Å; D54-L56 WeakPolarHBondContact OD1-CB 3.27Å; D54-L56 PolarHBondContact OD1-N 3.29Å; L56-Y287 HydrophobicContact CB-CD2 4.01Å; L56-Y287 HydrophobicContact CB-CE2 3.93Å; L56-Y287 HydrophobicContact CD1-CD2 4.11Å; L56-Y287 HydrophobicContact CD1-CE2 4.48Å; L56-Y287 HydrophobicContact CD1-CG 4.42Å; L56-L294 HydrophobicContact CD1-CD1 4.27Å; L56-F297 HydrophobicContact CD1-CD1 3.5Å; L56-F297 VanDerWaalsContact CD1-CD1 3.5Å; L56-F297 HydrophobicContact CD1-CE1 3.35Å; L56-F297 HydrophobicContact CD1-CZ 4.29Å; L56-F297 HydrophobicContact CD2-CE1 4.17Å; L56-F297 HydrophobicContact CD2-CZ 4.35Å; L56-F297 HydrophobicContact CG-CE1 4.33Å; L56-K298 HydrophobicContact CD1-CG 3.78Å; L56-K298 HydrophobicContact CD2-CG 4.35Å; L56-K298 HydrophobicContact CG-CG 4.02Å; L56-K298 WeakPolarHBondContact O-CE 2.99Å; L56-A301 HydrophobicContact CD2-CB 3.62Å
57	L	96.6	Very high	95.7	Very high	40 Å²	40	38.6 Å²	38.6	21%	0.209	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-27.3	177	-58.6	179.8	0	0	0	112.1	I50 E52 D54 G55 T59	I50-L57 HydrophobicContact CB-CB 4.02Å; I50-L57 HydrophobicContact CB-CD1 4.16Å; I50-L57 HydrophobicContact CG2-CB 3.58Å; E52-L57 HydrophobicContact CG-CD1 3.7Å; D54-L57 HydrophobicContact CB-CD1 4.21Å; D54-L57 HydrophobicContact CB-CG 4.15Å; D54-L57 WeakPolarHBondContact O-CB 3.06Å; D54-L57 PolarHBondContact O-N 2.6Å; G55-L57 VanDerWaalsContact C-N 3.26Å; L57-T59 PolarHBondContact O-N 3.49Å
58	A	97.1	Very high	96.1	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.017	24%	0.237	C	C	.	.			trans	-69.6	114.6	177.1	0	0	0	0	0	110.8	L41 L44 W60 I80 Y286	L41-A58 HydrophobicContact CD2-CB 4.14Å; L44-A58 HydrophobicContact CD1-CB 3.67Å; A58-W60 PolarHBondContact O-NE1 2.65Å; A58-I80 HydrophobicContact CB-CD1 4.17Å; A58-Y286 HydrophobicContact CB-CD1 4.22Å
59	T	95.9	Very high	96.3	Very high	21 Å²	21	45.1 Å²	45.1	13%	0.129	22%	0.222	C	C	.	.			trans	-100.3	143.3	-179	52.2	0	0	0	0	112	L57 V78 M79 I80	L57-T59 PolarHBondContact O-N 3.49Å; T59-V78 WeakPolarHBondContact OG1-CA 3.29Å; T59-M79 PolarHBondContact O-N 2.96Å; T59-M79 WeakPolarHBondContact OG1-CG 3.21Å; T59-M79 PolarHBondContact OG1-N 3.43Å; T59-M79 VanDerWaalsContact OG1-N 3.1Å; T59-I80 PolarHBondContact O-N 3.45Å
60	W	95.9	Very high	96.5	Very high	20 Å²	20	42.7 Å²	42.7	8%	0.076	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	144.8	-171.9	-58.9	80.2	0	0	0	110.9	A58 I80 K128 W158 Y286 D288	A58-W60 PolarHBondContact O-NE1 2.65Å; W60-I80 CarbonylContact C-O 3.58Å; W60-I80 WeakPolarHBondContact CA-O 3.23Å; W60-I80 HydrophobicContact CD2-CB 4.19Å; W60-I80 HydrophobicContact CD2-CD1 4.13Å; W60-I80 HydrophobicContact CD2-CG2 4.4Å; W60-I80 HydrophobicContact CE3-CB 3.83Å; W60-I80 HydrophobicContact CE3-CD1 4.26Å; W60-I80 HydrophobicContact CE3-CG2 3.58Å; W60-I80 HydrophobicContact CH2-CB 4.46Å; W60-I80 HydrophobicContact CH2-CD1 3.61Å; W60-I80 HydrophobicContact CH2-CG2 3.97Å; W60-I80 HydrophobicContact CZ2-CD1 3.49Å; W60-I80 VanDerWaalsContact CZ2-CD1 3.49Å; W60-I80 HydrophobicContact CZ3-CB 3.99Å; W60-I80 HydrophobicContact CZ3-CD1 4.03Å; W60-I80 HydrophobicContact CZ3-CG2 3.33Å; W60-K128 HydrophobicContact CE3-CD 4.45Å; W60-K128 HydrophobicContact CH2-CD 4.4Å; W60-K128 HydrophobicContact CZ3-CB 4.17Å; W60-K128 HydrophobicContact CZ3-CD 3.68Å; W60-W158 AromaticContact CH2-CE3 3.78Å; W60-W158 HydrophobicContact CH2-CE3 3.78Å; W60-W158 AromaticContact CH2-CH2 3.85Å; W60-W158 HydrophobicContact CH2-CH2 3.85Å; W60-W158 AromaticContact CH2-CZ3 3.36Å; W60-W158 HydrophobicContact CH2-CZ3 3.36Å; W60-W158 HydrophobicContact CZ2-CH2 4.21Å; W60-W158 HydrophobicContact CZ2-CZ3 4.03Å; W60-W158 HydrophobicContact CZ3-CE3 4.38Å; W60-W158 HydrophobicContact CZ3-CZ3 4.32Å; W60-Y286 AromaticContact CZ2-CD1 3.84Å; W60-Y286 HydrophobicContact CZ2-CD1 3.84Å; W60-Y286 HydrophobicContact CZ2-CG 4.1Å; W60-D288 WeakPolarHBondContact CB-OD1 3.25Å; W60-D288 HydrophobicContact CG-CB 4.27Å
61	F	96.6	Very high	96.6	Very high	41 Å²	41	46.3 Å²	46.3	18%	0.18	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	110.7	160.9	-163.3	-74.5	0	0	0	108.2	A64 Q69 M72 A73 V78 I80 L81 E82	F61-A64 HydrophobicContact CD1-CB 3.94Å; F61-A64 HydrophobicContact CE1-CB 4.28Å; F61-Q69 HydrophobicContact CE1-CB 4.17Å; F61-Q69 WeakPolarHBondContact CZ-O 3.47Å; F61-M72 HydrophobicContact CE2-CB 4.18Å; F61-M72 HydrophobicContact CZ-CB 4.11Å; F61-A73 HydrophobicContact CB-CB 3.74Å; F61-A73 HydrophobicContact CD1-CB 3.69Å; F61-A73 HydrophobicContact CD2-CB 3.42Å; F61-A73 VanDerWaalsContact CD2-CB 3.42Å; F61-A73 HydrophobicContact CE1-CB 4.09Å; F61-A73 HydrophobicContact CE2-CB 3.84Å; F61-A73 HydrophobicContact CG-CB 3.32Å; F61-A73 HydrophobicContact CZ-CB 4.15Å; F61-V78 HydrophobicContact CB-CB 4.17Å; F61-V78 HydrophobicContact CB-CG1 4.24Å; F61-V78 HydrophobicContact CB-CG2 3.78Å; F61-V78 HydrophobicContact CD2-CG1 4.24Å; F61-V78 HydrophobicContact CD2-CG2 4.23Å; F61-V78 HydrophobicContact CG-CG2 4.46Å; F61-I80 PolarHBondContact N-O 3.5Å; F61-L81 HydrophobicContact CB-CG 4.46Å; F61-E82 PolarHBondContact O-N 2.75Å
62	H	94.3	Very high	96.8	Very high	49 Å²	49	46.7 Å²	46.7	23%	0.227	22%	0.222	C	C	.	.			trans	-82	140.8	-178	-176.5	56.5	0	0	0	111.8	A64 E82 D288 Y290	H62-A64 PolarHBondContact O-N 3.15Å; H62-E82 IonicContact CE1-OE2 2.82Å; H62-E82 PolarHBondContact CE1-OE2 2.89Å; H62-E82 IonicContact CG-OE2 3.4Å; H62-E82 IonicContact ND1-OE2 2.7Å; H62-E82 PolarHBondContact ND1-OE2 3.38Å; H62-D288 IonicContact ND1-OD2 3.69Å; H62-Y290 HydrophobicContact CB-CE1 3.47Å; H62-Y290 VanDerWaalsContact CB-CE1 3.47Å; H62-Y290 HydrophobicContact CB-CE2 4.42Å; H62-Y290 VanDerWaalsContact CB-CZ 3.42Å; H62-Y290 WeakPolarHBondContact CB-OH 3.16Å; H62-Y290 AromaticContact CD2-CE2 3.96Å; H62-Y290 AromaticContact CD2-CZ 3.58Å; H62-Y290 PolarHBondContact CD2-OH 2.73Å; H62-Y290 AromaticContact CG-CZ 3.59Å; H62-Y290 PolarHBondContact ND1-OH 3.38Å
63	R	94.8	Very high	97	Very high	95 Å²	95	42.7 Å²	42.7	36%	0.358	20%	0.203	S	C	.	.			trans	51.9	55.3	175.4	-57.2	-177.6	-176.7	-147.5	-12.9	113.1	N65 Q69 E82 D84 H103	R63-N65 PolarHBondContact O-N 3.45Å; R63-Q69 PolarHBondContact O-OE1 2.89Å; R63-Q69 VanDerWaalsContact O-OE1 3.11Å; R63-E82 PolarHBondContact N-O 3.05Å; R63-E82 PolarHBondContact N-OE2 2.81Å; R63-D84 WeakPolarHBondContact CG-OD2 3.37Å; R63-H103 PolarHBondContact NH2-CD2 3.48Å; R63-H103 PolarHBondContact NH2-NE2 3.33Å; R63-H103 VanDerWaalsContact NH2-NE2 3.14Å
64	A	97.4	Very high	97.2	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.197	C	C	.	.			trans	-71.4	57	170.6	0	0	0	0	0	111.6	F61 H62 L81 E82 A83 W116	F61-A64 HydrophobicContact CD1-CB 3.94Å; F61-A64 HydrophobicContact CE1-CB 4.28Å; H62-A64 PolarHBondContact O-N 3.15Å; A64-L81 HydrophobicContact CB-CD2 4.25Å; A64-L81 HydrophobicContact CB-CG 4.42Å; A64-E82 PolarHBondContact N-O 3.31Å; A64-A83 HydrophobicContact CB-CB 4.38Å; A64-W116 PolarHBondContact O-NE1 2.98Å
65	N	98.3	Very high	97.3	Very high	18 Å²	18	45.2 Å²	45.2	10%	0.096	23%	0.232	C	C	.	.			trans	-88.8	-25.2	-162	-69.2	-13.6	0	0	0	114	R63 D84 M101 S109	R63-N65 PolarHBondContact O-N 3.45Å; N65-D84 PolarHBondContact ND2-OD2 2.87Å; N65-D84 PolarHBondContact OD1-N 2.69Å; N65-M101 WeakPolarHBondContact O-CB 3.39Å; N65-S109 PolarHBondContact O-OG 2.94Å
66	S	98.4	Very high	97.3	Very high	26 Å²	26	47.2 Å²	47.2	18%	0.182	25%	0.246	C	C	.	.	S	Bend	trans	-103.6	167	173.7	72.7	0	0	0	0	112.1	E68 Q69 M70 D110	S66-E68 PolarHBondContact O-N 2.67Å; S66-E68 PolarHBondContact OG-N 3.18Å; S66-Q69 PolarHBondContact O-N 2.99Å; S66-Q69 WeakPolarHBondContact OG-CG 3.37Å; S66-Q69 PolarHBondContact OG-N 3.18Å; S66-Q69 VanDerWaalsContact OG-N 3.09Å; S66-Q69 PolarHBondContact OG-OE1 3.03Å; S66-M70 VanDerWaalsContact O-CB 3.28Å; S66-M70 WeakPolarHBondContact O-CB 3.46Å; S66-M70 PolarHBondContact O-N 3.44Å; S66-D110 VanDerWaalsContact CA-OD1 3.29Å; S66-D110 WeakPolarHBondContact CA-OD1 3.4Å; S66-D110 WeakPolarHBondContact CB-OD1 3.3Å
67	K	98.6	Very high	97.2	Very high	75 Å²	75	53.1 Å²	53.1	33%	0.326	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-37.9	170.7	-76.3	-179.8	167.7	127.3	0	112	N71 D110 N111 Q115	K67-N71 VanDerWaalsContact O-CB 3.29Å; K67-N71 WeakPolarHBondContact O-CB 3.24Å; K67-N71 PolarHBondContact O-N 2.93Å; K67-N71 PolarHBondContact O-ND2 3.42Å; K67-D110 WeakPolarHBondContact CB-OD2 3.35Å; K67-D110 WeakPolarHBondContact CE-O 3.31Å; K67-D110 PolarHBondContact N-OD1 3.43Å; K67-D110 PolarHBondContact NZ-O 3.41Å; K67-N111 HydrophobicContact CG-CB 3.93Å; K67-Q115 VanDerWaalsContact CE-OE1 3.32Å
68	E	98.5	Very high	97.2	Very high	141 Å²	141	52.1 Å²	52.1	66%	0.659	27%	0.273	S	S	*	.	H	α-helix	trans	-61.4	-53.1	177	-178.3	177.2	-163	0	0	111.3	S66 M70 N71 M72	S66-E68 PolarHBondContact O-N 2.67Å; S66-E68 PolarHBondContact OG-N 3.18Å; E68-M70 PolarHBondContact O-N 2.89Å; E68-N71 PolarHBondContact O-N 3.38Å; E68-M72 HydrophobicContact CG-SD 4.36Å; E68-M72 WeakPolarHBondContact O-CG 3.46Å; E68-M72 PolarHBondContact O-N 2.94Å
69	Q	98.4	Very high	97.2	Very high	72 Å²	72	53.2 Å²	53.2	34%	0.336	28%	0.278	S	S	.	.	H	α-helix	trans	-62.5	-43.5	180	-70.5	169.1	-35.6	0	0	111.9	F61 R63 S66 N71 M72 A73	F61-Q69 HydrophobicContact CE1-CB 4.17Å; F61-Q69 WeakPolarHBondContact CZ-O 3.47Å; R63-Q69 PolarHBondContact O-OE1 2.89Å; R63-Q69 VanDerWaalsContact O-OE1 3.11Å; S66-Q69 PolarHBondContact O-N 2.99Å; S66-Q69 WeakPolarHBondContact OG-CG 3.37Å; S66-Q69 PolarHBondContact OG-N 3.18Å; S66-Q69 VanDerWaalsContact OG-N 3.09Å; S66-Q69 PolarHBondContact OG-OE1 3.03Å; Q69-N71 PolarHBondContact O-N 3.28Å; Q69-M72 WeakPolarHBondContact O-CB 3.28Å; Q69-M72 PolarHBondContact O-N 3.42Å; Q69-A73 PolarHBondContact O-N 3.09Å
70	M	98.5	Very high	97.3	Very high	8 Å²	8	52.2 Å²	52.2	4%	0.039	27%	0.272	C	S	.	.	H	α-helix	trans	-58	-47.9	174	179.8	-171.1	70.4	0	0	111.3	S66 E68 M72 A73 L74 L81 N111 W116 A119 V120	S66-M70 VanDerWaalsContact O-CB 3.28Å; S66-M70 WeakPolarHBondContact O-CB 3.46Å; S66-M70 PolarHBondContact O-N 3.44Å; E68-M70 PolarHBondContact O-N 2.89Å; M70-M72 VanDerWaalsContact C-N 3.34Å; M70-M72 PolarHBondContact O-N 3.4Å; M70-A73 WeakPolarHBondContact O-CB 3.46Å; M70-A73 PolarHBondContact O-N 2.95Å; M70-L74 HydrophobicContact CG-CD1 3.98Å; M70-L74 HydrophobicContact CG-CG 4.36Å; M70-L74 VanDerWaalsContact O-CG 3.24Å; M70-L74 WeakPolarHBondContact O-CG 3.35Å; M70-L74 PolarHBondContact O-N 3.44Å; M70-L81 HydrophobicContact CG-CD2 4.46Å; M70-N111 PolarHBondContact SD-ND2 3.44Å; M70-N111 VanDerWaalsContact SD-ND2 3.38Å; M70-W116 HydrophobicContact CG-CG 4.48Å; M70-W116 HydrophobicContact SD-CB 4.03Å; M70-W116 HydrophobicContact SD-CG 3.72Å; M70-A119 HydrophobicContact CE-CB 3.53Å; M70-A119 HydrophobicContact SD-CB 3.66Å; M70-V120 HydrophobicContact CG-CG2 4.4Å; M70-V120 HydrophobicContact SD-CG2 4.49Å
71	N	98.5	Very high	97.4	Very high	90 Å²	90	51.2 Å²	51.2	48%	0.481	27%	0.268	S	S	.	.	H	α-helix	trans	-65.1	-36.4	179.3	-72.8	-30.1	0	0	0	112.4	K67 E68 Q69 A73 L74 A75	K67-N71 VanDerWaalsContact O-CB 3.29Å; K67-N71 WeakPolarHBondContact O-CB 3.24Å; K67-N71 PolarHBondContact O-N 2.93Å; K67-N71 PolarHBondContact O-ND2 3.42Å; E68-N71 PolarHBondContact O-N 3.38Å; Q69-N71 PolarHBondContact O-N 3.28Å; N71-A73 VanDerWaalsContact C-N 3.35Å; N71-L74 PolarHBondContact O-N 3.18Å; N71-A75 VanDerWaalsContact O-CB 3.32Å; N71-A75 WeakPolarHBondContact O-CB 3.39Å; N71-A75 PolarHBondContact O-N 3.14Å
72	M	98.2	Very high	97.5	Very high	108 Å²	108	49.4 Å²	49.4	53%	0.532	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-44.8	171.8	-72.1	174.5	63.4	0	0	111.6	F61 E68 Q69 M70 A75 S76	F61-M72 HydrophobicContact CE2-CB 4.18Å; F61-M72 HydrophobicContact CZ-CB 4.11Å; E68-M72 HydrophobicContact CG-SD 4.36Å; E68-M72 WeakPolarHBondContact O-CG 3.46Å; E68-M72 PolarHBondContact O-N 2.94Å; Q69-M72 WeakPolarHBondContact O-CB 3.28Å; Q69-M72 PolarHBondContact O-N 3.42Å; M70-M72 VanDerWaalsContact C-N 3.34Å; M70-M72 PolarHBondContact O-N 3.4Å; M72-A75 PolarHBondContact O-N 3.38Å; M72-S76 WeakPolarHBondContact O-CB 3.43Å; M72-S76 PolarHBondContact O-N 2.98Å; M72-S76 VanDerWaalsContact O-N 3.11Å
73	A	97.3	Very high	97.7	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.4	-39.2	178.2	0	0	0	0	0	112.7	F61 Q69 M70 N71 A75 S76 V78 L81 K125	F61-A73 HydrophobicContact CB-CB 3.74Å; F61-A73 HydrophobicContact CD1-CB 3.69Å; F61-A73 HydrophobicContact CD2-CB 3.42Å; F61-A73 VanDerWaalsContact CD2-CB 3.42Å; F61-A73 HydrophobicContact CE1-CB 4.09Å; F61-A73 HydrophobicContact CE2-CB 3.84Å; F61-A73 HydrophobicContact CG-CB 3.32Å; F61-A73 HydrophobicContact CZ-CB 4.15Å; Q69-A73 PolarHBondContact O-N 3.09Å; M70-A73 WeakPolarHBondContact O-CB 3.46Å; M70-A73 PolarHBondContact O-N 2.95Å; N71-A73 VanDerWaalsContact C-N 3.35Å; A73-A75 VanDerWaalsContact C-N 3.3Å; A73-A75 PolarHBondContact O-N 2.91Å; A73-S76 PolarHBondContact O-N 3.31Å; A73-S76 PolarHBondContact O-OG 3.43Å; A73-V78 HydrophobicContact CB-CG2 4.26Å; A73-V78 VanDerWaalsContact O-CG2 3.32Å; A73-V78 WeakPolarHBondContact O-CG2 3.19Å; A73-L81 HydrophobicContact CB-CD1 3.94Å; A73-L81 HydrophobicContact CB-CD2 3.72Å; A73-L81 HydrophobicContact CB-CG 3.64Å; A73-K125 WeakPolarHBondContact O-CE 3.44Å
74	L	98.1	Very high	97.9	Very high	43 Å²	43	42.6 Å²	42.6	23%	0.225	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-34	176.5	-69	174.9	0	0	0	112.1	M70 N71 L81 A119 V120 K125	M70-L74 HydrophobicContact CG-CD1 3.98Å; M70-L74 HydrophobicContact CG-CG 4.36Å; M70-L74 VanDerWaalsContact O-CG 3.24Å; M70-L74 WeakPolarHBondContact O-CG 3.35Å; M70-L74 PolarHBondContact O-N 3.44Å; N71-L74 PolarHBondContact O-N 3.18Å; L74-L81 HydrophobicContact CD2-CD2 4.34Å; L74-A119 HydrophobicContact CD1-CB 4.02Å; L74-V120 HydrophobicContact CD2-CG2 4.34Å; L74-K125 HydrophobicContact CD2-CG 4.24Å
75	A	97.9	Very high	97.9	Very high	91 Å²	91	42.6 Å²	42.6	75%	0.752	23%	0.233	S	C	*	.	H	α-helix	trans	-82.6	-16.9	179.5	0	0	0	0	0	114.3	N71 M72 A73	N71-A75 VanDerWaalsContact O-CB 3.32Å; N71-A75 WeakPolarHBondContact O-CB 3.39Å; N71-A75 PolarHBondContact O-N 3.14Å; M72-A75 PolarHBondContact O-N 3.38Å; A73-A75 VanDerWaalsContact C-N 3.3Å; A73-A75 PolarHBondContact O-N 2.91Å
76	S	96.8	Very high	97.9	Very high	42 Å²	42	41.7 Å²	41.7	29%	0.294	23%	0.228	S	C	.	.	S	Bend	trans	-90.6	-179	-179.1	73.4	0	0	0	0	113.1	M72 A73 V78 K125	M72-S76 WeakPolarHBondContact O-CB 3.43Å; M72-S76 PolarHBondContact O-N 2.98Å; M72-S76 VanDerWaalsContact O-N 3.11Å; A73-S76 PolarHBondContact O-N 3.31Å; A73-S76 PolarHBondContact O-OG 3.43Å; S76-V78 WeakPolarHBondContact OG-CG2 3.29Å; S76-V78 PolarHBondContact OG-N 3.28Å; S76-K125 PolarHBondContact O-NZ 2.93Å
77	D	95.1	Very high	97.9	Very high	134 Å²	134	40.6 Å²	40.6	72%	0.717	22%	0.22	S	C	*	.	S	Bend	trans	-89.1	1.3	177.5	65.3	-21.6	0	0	0	113.8
78	V	96.1	Very high	97.9	Very high	18 Å²	18	39.4 Å²	39.4	11%	0.109	22%	0.216	C	C	.	.			trans	-56.8	144.8	173.8	-61.5	0	0	0	0	110.9	T59 F61 A73 S76 L81 K125	T59-V78 WeakPolarHBondContact OG1-CA 3.29Å; F61-V78 HydrophobicContact CB-CB 4.17Å; F61-V78 HydrophobicContact CB-CG1 4.24Å; F61-V78 HydrophobicContact CB-CG2 3.78Å; F61-V78 HydrophobicContact CD2-CG1 4.24Å; F61-V78 HydrophobicContact CD2-CG2 4.23Å; F61-V78 HydrophobicContact CG-CG2 4.46Å; A73-V78 HydrophobicContact CB-CG2 4.26Å; A73-V78 VanDerWaalsContact O-CG2 3.32Å; A73-V78 WeakPolarHBondContact O-CG2 3.19Å; S76-V78 WeakPolarHBondContact OG-CG2 3.29Å; S76-V78 PolarHBondContact OG-N 3.28Å; V78-L81 HydrophobicContact CG2-CD1 4.36Å; V78-K125 WeakPolarHBondContact O-CD 3.35Å; V78-K125 VanDerWaalsContact O-CE 3.27Å; V78-K125 WeakPolarHBondContact O-CE 3.24Å; V78-K125 PolarHBondContact O-NZ 2.73Å
79	M	97.7	Very high	97.9	Very high	25 Å²	25	32.7 Å²	32.7	12%	0.123	18%	0.184	C	C	.	.			trans	-98.6	-28.5	-172	-67.2	170.7	-166.1	0	0	113	L44 E49 I50 T59 K125 G126	L44-M79 HydrophobicContact CD1-CB 4.23Å; L44-M79 HydrophobicContact CD1-SD 4.04Å; L44-M79 HydrophobicContact CD2-CB 3.72Å; L44-M79 HydrophobicContact CD2-CG 4.26Å; L44-M79 HydrophobicContact CD2-SD 4.31Å; E49-M79 HydrophobicContact CB-CE 4.17Å; E49-M79 HydrophobicContact CB-CG 4.21Å; E49-M79 HydrophobicContact CB-SD 4Å; E49-M79 WeakPolarHBondContact O-CE 3.35Å; I50-M79 HydrophobicContact CG2-CE 3.87Å; I50-M79 HydrophobicContact CG2-SD 3.59Å; I50-M79 VanDerWaalsContact CG2-SD 3.59Å; T59-M79 PolarHBondContact O-N 2.96Å; T59-M79 WeakPolarHBondContact OG1-CG 3.21Å; T59-M79 PolarHBondContact OG1-N 3.43Å; T59-M79 VanDerWaalsContact OG1-N 3.1Å; M79-K125 CarbonylContact O-C 3.52Å; M79-K125 VanDerWaalsContact O-CA 3.3Å; M79-K125 WeakPolarHBondContact O-CA 3.24Å; M79-G126 PolarHBondContact O-N 2.7Å
80	I	98.1	Very high	97.8	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.9	-172.7	-53.7	162.5	0	0	0	108.8	M40 L44 A58 T59 W60 F61	M40-I80 HydrophobicContact CE-CD1 4.48Å; M40-I80 HydrophobicContact CE-CG1 4.23Å; M40-I80 HydrophobicContact CG-CD1 3.55Å; M40-I80 HydrophobicContact CG-CG1 4.28Å; M40-I80 HydrophobicContact SD-CD1 3.75Å; M40-I80 HydrophobicContact SD-CG1 3.89Å; M40-I80 HydrophobicContact SD-CG2 4.46Å; L44-I80 HydrophobicContact CD1-CD1 4.23Å; A58-I80 HydrophobicContact CB-CD1 4.17Å; T59-I80 PolarHBondContact O-N 3.45Å; W60-I80 CarbonylContact C-O 3.58Å; W60-I80 WeakPolarHBondContact CA-O 3.23Å; W60-I80 HydrophobicContact CD2-CB 4.19Å; W60-I80 HydrophobicContact CD2-CD1 4.13Å; W60-I80 HydrophobicContact CD2-CG2 4.4Å; W60-I80 HydrophobicContact CE3-CB 3.83Å; W60-I80 HydrophobicContact CE3-CD1 4.26Å; W60-I80 HydrophobicContact CE3-CG2 3.58Å; W60-I80 HydrophobicContact CH2-CB 4.46Å; W60-I80 HydrophobicContact CH2-CD1 3.61Å; W60-I80 HydrophobicContact CH2-CG2 3.97Å; W60-I80 HydrophobicContact CZ2-CD1 3.49Å; W60-I80 VanDerWaalsContact CZ2-CD1 3.49Å; W60-I80 HydrophobicContact CZ3-CB 3.99Å; W60-I80 HydrophobicContact CZ3-CD1 4.03Å; W60-I80 HydrophobicContact CZ3-CG2 3.33Å; F61-I80 PolarHBondContact N-O 3.5Å
81	L	98.2	Very high	97.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.3	171.8	-80.7	66.9	0	0	0	109	F61 A64 M70 A73 L74 V78 W116 V120 K125 G126 K128	F61-L81 HydrophobicContact CB-CG 4.46Å; A64-L81 HydrophobicContact CB-CD2 4.25Å; A64-L81 HydrophobicContact CB-CG 4.42Å; M70-L81 HydrophobicContact CG-CD2 4.46Å; A73-L81 HydrophobicContact CB-CD1 3.94Å; A73-L81 HydrophobicContact CB-CD2 3.72Å; A73-L81 HydrophobicContact CB-CG 3.64Å; L74-L81 HydrophobicContact CD2-CD2 4.34Å; V78-L81 HydrophobicContact CG2-CD1 4.36Å; L81-W116 HydrophobicContact CB-CH2 4.05Å; L81-W116 HydrophobicContact CB-CZ2 3.69Å; L81-W116 HydrophobicContact CD2-CZ2 4.04Å; L81-V120 HydrophobicContact CD2-CG2 3.76Å; L81-K125 HydrophobicContact CD1-CB 3.55Å; L81-K125 HydrophobicContact CD1-CD 3.98Å; L81-K125 HydrophobicContact CD1-CG 3.58Å; L81-G126 PolarHBondContact N-O 2.86Å; L81-K128 PolarHBondContact O-N 3.01Å
82	E	98.2	Very high	97.6	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.009	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.1	167.2	-177.2	-76.7	142.1	0	0	108.7	F61 H62 R63 A64 K128 D130	F61-E82 PolarHBondContact O-N 2.75Å; H62-E82 IonicContact CE1-OE2 2.82Å; H62-E82 PolarHBondContact CE1-OE2 2.89Å; H62-E82 IonicContact CG-OE2 3.4Å; H62-E82 IonicContact ND1-OE2 2.7Å; H62-E82 PolarHBondContact ND1-OE2 3.38Å; R63-E82 PolarHBondContact N-O 3.05Å; R63-E82 PolarHBondContact N-OE2 2.81Å; A64-E82 PolarHBondContact N-O 3.31Å; E82-K128 VanDerWaalsContact CA-O 3.3Å; E82-K128 WeakPolarHBondContact CA-O 3.4Å; E82-K128 HydrophobicContact CB-CB 4.14Å; E82-K128 HydrophobicContact CB-CD 4.28Å; E82-K128 HydrophobicContact CB-CG 4.44Å; E82-K128 HydrophobicContact CG-CB 4.2Å; E82-K128 HydrophobicContact CG-CD 3.81Å; E82-K128 HydrophobicContact CG-CG 3.98Å; E82-D130 WeakPolarHBondContact OE1-CB 3.16Å
83	A	98.3	Very high	97.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	144	176.5	0	0	0	0	0	111.5	A64 M101 W116 K128 D130	A64-A83 HydrophobicContact CB-CB 4.38Å; A83-M101 HydrophobicContact CB-CE 4.38Å; A83-M101 HydrophobicContact CB-SD 3.39Å; A83-M101 WeakPolarHBondContact CB-SD 3.32Å; A83-W116 HydrophobicContact CB-CZ2 3.83Å; A83-K128 PolarHBondContact N-O 2.97Å; A83-K128 VanDerWaalsContact N-O 3.09Å; A83-D130 PolarHBondContact O-N 3Å
84	D	98.8	Very high	97.5	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	135.1	-177.5	-55.3	-72	0	0	0	110.7	R63 N65 M101 A102 H103 D130 K132	R63-D84 WeakPolarHBondContact CG-OD2 3.37Å; N65-D84 PolarHBondContact ND2-OD2 2.87Å; N65-D84 PolarHBondContact OD1-N 2.69Å; D84-M101 CarbonylContact O-C 3.58Å; D84-M101 WeakPolarHBondContact O-CA 3.19Å; D84-A102 WeakPolarHBondContact CB-O 3.37Å; D84-A102 PolarHBondContact O-N 3.42Å; D84-H103 HydrophobicContact CB-CB 4.02Å; D84-H103 IonicContact OD1-CD2 3.4Å; D84-H103 PolarHBondContact OD1-CD2 3.29Å; D84-H103 WeakPolarHBondContact OD2-CB 3.25Å; D84-H103 IonicContact OD2-CD2 3.96Å; D84-H103 PolarHBondContact OD2-CD2 3.46Å; D84-H103 IonicContact OD2-CG 2.65Å; D84-D130 CarbonylContact C-O 3.56Å; D84-D130 VanDerWaalsContact CA-O 3.28Å; D84-D130 WeakPolarHBondContact CA-O 3.28Å; D84-K132 HydrophobicContact CB-CG 4.19Å; D84-K132 WeakPolarHBondContact OD1-CE 3.44Å; D84-K132 IonicContact OD1-NZ 3.13Å; D84-K132 PolarHBondContact OD1-NZ 2.92Å
85	V	98.8	Very high	97.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.6	-176.8	-173.8	0	0	0	0	111.2	P99 I100 M101 L129 D130 F131 K132	V85-P99 HydrophobicContact CG1-CB 4.1Å; V85-I100 WeakPolarHBondContact CA-O 3.49Å; V85-M101 HydrophobicContact CG2-CE 4.19Å; V85-M101 HydrophobicContact CG2-SD 4.11Å; V85-L129 HydrophobicContact CG2-CB 4.1Å; V85-L129 HydrophobicContact CG2-CD2 4.16Å; V85-D130 PolarHBondContact N-O 3.43Å; V85-F131 HydrophobicContact CB-CD1 3.87Å; V85-F131 HydrophobicContact CB-CE1 4Å; V85-F131 HydrophobicContact CG1-CD1 4Å; V85-F131 HydrophobicContact CG1-CE1 3.86Å; V85-F131 HydrophobicContact CG2-CE1 4.46Å; V85-K132 PolarHBondContact O-N 2.92Å
86	T	98.3	Very high	97.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	-173.9	170	-167.8	0	0	0	0	110.2	Y90 P99 I100 A102	T86-Y90 WeakPolarHBondContact OG1-CB 3.05Å; T86-P99 CarbonylContact O-C 3.55Å; T86-P99 VanDerWaalsContact O-CA 3.3Å; T86-P99 WeakPolarHBondContact O-CA 3.31Å; T86-I100 HydrophobicContact CG2-CD1 4.27Å; T86-I100 HydrophobicContact CG2-CG1 4Å; T86-I100 PolarHBondContact N-O 3.02Å; T86-I100 VanDerWaalsContact N-O 3.12Å; T86-I100 PolarHBondContact O-N 3.3Å; T86-A102 HydrophobicContact CG2-CB 3.89Å
87	L	98.3	Very high	97.6	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	146.6	173.4	-69.1	-176.6	0	0	0	112	G89 Y90 Q95 P99 D135 F139	L87-G89 PolarHBondContact O-N 3.44Å; L87-Y90 HydrophobicContact CB-CD2 4.45Å; L87-Y90 VanDerWaalsContact O-CB 3.29Å; L87-Y90 WeakPolarHBondContact O-CB 3.49Å; L87-Y90 PolarHBondContact O-N 2.88Å; L87-Q95 HydrophobicContact CB-CG 4.29Å; L87-Q95 HydrophobicContact CD1-CG 4.25Å; L87-P99 HydrophobicContact CD2-CG 4.31Å; L87-D135 HydrophobicContact CD1-CB 3.73Å; L87-F139 HydrophobicContact CD2-CD2 4.03Å
88	E	98.4	Very high	97.8	Very high	49 Å²	49	40.2 Å²	40.2	23%	0.229	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	123.9	169.9	-169	-172.5	-164.3	0	0	110	Y90 Q95 K96 V98 I100 Y108	E88-Y90 VanDerWaalsContact C-N 3.3Å; E88-Y90 PolarHBondContact O-N 3.21Å; E88-Q95 CarbonylContact O-C 3.36Å; E88-Q95 VanDerWaalsContact O-CA 3.27Å; E88-Q95 WeakPolarHBondContact O-CA 3.45Å; E88-K96 HydrophobicContact CB-CB 4.42Å; E88-K96 PolarHBondContact O-N 3.03Å; E88-K96 IonicContact OE1-NZ 3.42Å; E88-K96 PolarHBondContact OE1-NZ 2.99Å; E88-K96 VanDerWaalsContact OE1-NZ 3.13Å; E88-K96 VanDerWaalsContact OE2-CD 3.25Å; E88-K96 WeakPolarHBondContact OE2-CD 3.2Å; E88-K96 WeakPolarHBondContact OE2-CE 3.41Å; E88-K96 IonicContact OE2-NZ 2.76Å; E88-K96 PolarHBondContact OE2-NZ 2.86Å; E88-V98 HydrophobicContact CB-CB 4.28Å; E88-V98 PolarHBondContact N-O 3.29Å; E88-I100 HydrophobicContact CB-CD1 4.44Å; E88-I100 HydrophobicContact CB-CG2 3.92Å; E88-I100 HydrophobicContact CG-CG2 4.5Å; E88-Y108 HydrophobicContact CG-CD1 3.92Å; E88-Y108 HydrophobicContact CG-CE1 4.22Å
89	G	97.8	Very high	97.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.4	22.5	-176.6	0	0	0	0	0	114.5	L87 G91 T92 Q95 V107	L87-G89 PolarHBondContact O-N 3.44Å; G89-G91 PolarHBondContact O-N 3.41Å; G89-T92 WeakPolarHBondContact O-CB 3.5Å; G89-T92 PolarHBondContact O-N 3.27Å; G89-T92 PolarHBondContact O-OG1 3.46Å; G89-Q95 WeakPolarHBondContact O-CA 2.88Å; G89-Q95 WeakPolarHBondContact O-CB 3.45Å; G89-V107 PolarHBondContact N-O 2.89Å
90	Y	97.1	Very high	97.9	Very high	78 Å²	78	38.6 Å²	38.6	31%	0.306	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	131	-177.8	-179	-109.7	0	0	0	113.2	T86 L87 E88 T92 V107 A133 D135	T86-Y90 WeakPolarHBondContact OG1-CB 3.05Å; L87-Y90 HydrophobicContact CB-CD2 4.45Å; L87-Y90 VanDerWaalsContact O-CB 3.29Å; L87-Y90 WeakPolarHBondContact O-CB 3.49Å; L87-Y90 PolarHBondContact O-N 2.88Å; E88-Y90 VanDerWaalsContact C-N 3.3Å; E88-Y90 PolarHBondContact O-N 3.21Å; Y90-T92 PolarHBondContact O-N 2.96Å; Y90-V107 WeakPolarHBondContact O-CG1 3.08Å; Y90-A133 HydrophobicContact CD1-CB 4.32Å; Y90-A133 HydrophobicContact CD2-CB 4.03Å; Y90-A133 HydrophobicContact CE1-CB 3.84Å; Y90-A133 HydrophobicContact CE2-CB 3.54Å; Y90-A133 HydrophobicContact CG-CB 4.4Å; Y90-A133 VanDerWaalsContact CZ-CB 3.42Å; Y90-D135 HydrophobicContact CE2-CB 4.35Å
91	G	95.1	Very high	98	Very high	69 Å²	69	38.6 Å²	38.6	71%	0.711	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	5.6	-179.9	0	0	0	0	0	115.1	G89	G89-G91 PolarHBondContact O-N 3.41Å
92	T	96.8	Very high	98	Very high	46 Å²	46	38.7 Å²	38.7	28%	0.282	23%	0.226	S	C	.	.	S	Bend	trans	-113.4	164.3	177	79.9	0	0	0	0	111.5	G89 Y90 N94 Q95 V107	G89-T92 WeakPolarHBondContact O-CB 3.5Å; G89-T92 PolarHBondContact O-N 3.27Å; G89-T92 PolarHBondContact O-OG1 3.46Å; Y90-T92 PolarHBondContact O-N 2.96Å; T92-N94 PolarHBondContact O-N 3.1Å; T92-N94 VanDerWaalsContact O-N 3.07Å; T92-N94 PolarHBondContact OG1-N 2.94Å; T92-Q95 WeakPolarHBondContact O-CB 3.35Å; T92-Q95 PolarHBondContact O-N 3.02Å; T92-Q95 VanDerWaalsContact O-N 3.16Å; T92-V107 HydrophobicContact CG2-CG2 4.27Å
93	P	97.4	Very high	97.9	Very high	137 Å²	137	40.8 Å²	40.8	89%	0.89	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-17.2	172.2	-25.2	35.6	0	0	0	114.8
94	N	97.2	Very high	97.7	Very high	107 Å²	107	43.5 Å²	43.5	57%	0.572	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	11.8	-179	-63	-33.1	0	0	0	113.1	T92 K96	T92-N94 PolarHBondContact O-N 3.1Å; T92-N94 VanDerWaalsContact O-N 3.07Å; T92-N94 PolarHBondContact OG1-N 2.94Å; N94-K96 WeakPolarHBondContact O-CG 3.24Å; N94-K96 PolarHBondContact O-N 2.87Å
95	Q	98.2	Very high	97.5	Very high	74 Å²	74	49.1 Å²	49.1	35%	0.346	29%	0.289	S	S	.	.			trans	-56.5	128.8	-179.3	-176.6	172	-53.9	0	0	111.4	L87 E88 G89 T92	L87-Q95 HydrophobicContact CB-CG 4.29Å; L87-Q95 HydrophobicContact CD1-CG 4.25Å; E88-Q95 CarbonylContact O-C 3.36Å; E88-Q95 VanDerWaalsContact O-CA 3.27Å; E88-Q95 WeakPolarHBondContact O-CA 3.45Å; G89-Q95 WeakPolarHBondContact O-CA 2.88Å; G89-Q95 WeakPolarHBondContact O-CB 3.45Å; T92-Q95 WeakPolarHBondContact O-CB 3.35Å; T92-Q95 PolarHBondContact O-N 3.02Å; T92-Q95 VanDerWaalsContact O-N 3.16Å
96	K	98.1	Very high	97.4	Very high	100 Å²	100	54 Å²	54	44%	0.435	32%	0.315	S	S	.	.			trans	-117.4	151.5	175.4	-51.4	-164.5	-152.3	128.6	0	110.6	E88 N94 V98	E88-K96 HydrophobicContact CB-CB 4.42Å; E88-K96 PolarHBondContact O-N 3.03Å; E88-K96 IonicContact OE1-NZ 3.42Å; E88-K96 PolarHBondContact OE1-NZ 2.99Å; E88-K96 VanDerWaalsContact OE1-NZ 3.13Å; E88-K96 VanDerWaalsContact OE2-CD 3.25Å; E88-K96 WeakPolarHBondContact OE2-CD 3.2Å; E88-K96 WeakPolarHBondContact OE2-CE 3.41Å; E88-K96 IonicContact OE2-NZ 2.76Å; E88-K96 PolarHBondContact OE2-NZ 2.86Å; N94-K96 WeakPolarHBondContact O-CG 3.24Å; N94-K96 PolarHBondContact O-N 2.87Å; K96-V98 HydrophobicContact CB-CB 4.49Å; K96-V98 HydrophobicContact CB-CG2 4.12Å; K96-V98 PolarHBondContact O-N 3.37Å
97	P	97.8	Very high	97.3	Very high	83 Å²	83	55.5 Å²	55.5	54%	0.539	32%	0.324	S	S	.	.	S	Bend	trans	-75.6	46.4	175.1	34.5	-37.4	0	0	0	111.8	F139	P97-F139 HydrophobicContact CB-CD1 4.12Å; P97-F139 HydrophobicContact CB-CD2 4.25Å; P97-F139 HydrophobicContact CB-CE1 3.56Å; P97-F139 HydrophobicContact CB-CE2 3.7Å; P97-F139 HydrophobicContact CB-CG 4.44Å; P97-F139 HydrophobicContact CB-CZ 3.33Å
98	V	98.6	Very high	97.3	Very high	52 Å²	52	60.9 Å²	60.9	32%	0.315	35%	0.345	S	S	.	.			trans	-118.3	108.1	-178.9	-179.9	0	0	0	0	107.6	E88 K96 I100 T112	E88-V98 HydrophobicContact CB-CB 4.28Å; E88-V98 PolarHBondContact N-O 3.29Å; K96-V98 HydrophobicContact CB-CB 4.49Å; K96-V98 HydrophobicContact CB-CG2 4.12Å; K96-V98 PolarHBondContact O-N 3.37Å; V98-I100 HydrophobicContact CG1-CG2 4.35Å; V98-I100 PolarHBondContact O-N 2.68Å; V98-T112 HydrophobicContact CG1-CG2 4.06Å
99	P	98.8	Very high	97.3	Very high	7 Å²	7	60.3 Å²	60.3	5%	0.045	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	131.5	173.8	-21.9	34.3	0	0	0	111.1	V85 T86 L87 L113 F139 S140 L143	V85-P99 HydrophobicContact CG1-CB 4.1Å; T86-P99 CarbonylContact O-C 3.55Å; T86-P99 VanDerWaalsContact O-CA 3.3Å; T86-P99 WeakPolarHBondContact O-CA 3.31Å; L87-P99 HydrophobicContact CD2-CG 4.31Å; P99-L113 HydrophobicContact CB-CB 3.86Å; P99-L113 HydrophobicContact CB-CD2 3.92Å; P99-L113 PolarHBondContact O-N 3.19Å; P99-F139 HydrophobicContact CG-CB 3.5Å; P99-F139 VanDerWaalsContact CG-CB 3.5Å; P99-S140 WeakPolarHBondContact CB-OG 3.43Å; P99-S140 WeakPolarHBondContact CG-OG 3.46Å; P99-L143 HydrophobicContact CG-CD1 4.24Å
100	I	98.8	Very high	97.3	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	157.8	179.6	60.5	163	0	0	0	110.5	V85 T86 E88 V98 A102 V107 T112	V85-I100 WeakPolarHBondContact CA-O 3.49Å; T86-I100 HydrophobicContact CG2-CD1 4.27Å; T86-I100 HydrophobicContact CG2-CG1 4Å; T86-I100 PolarHBondContact N-O 3.02Å; T86-I100 VanDerWaalsContact N-O 3.12Å; T86-I100 PolarHBondContact O-N 3.3Å; E88-I100 HydrophobicContact CB-CD1 4.44Å; E88-I100 HydrophobicContact CB-CG2 3.92Å; E88-I100 HydrophobicContact CG-CG2 4.5Å; V98-I100 HydrophobicContact CG1-CG2 4.35Å; V98-I100 PolarHBondContact O-N 2.68Å; I100-A102 HydrophobicContact CD1-CB 3.96Å; I100-A102 HydrophobicContact CG1-CB 4.3Å; I100-A102 PolarHBondContact O-N 2.98Å; I100-V107 WeakPolarHBondContact CD1-O 3.37Å; I100-T112 HydrophobicContact CG2-CG2 4.35Å
101	M	98.7	Very high	97.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	96.1	175.8	-67.2	-65.2	168.6	0	0	109.8	N65 A83 D84 V85 S109 N111 L113 W116 L129	N65-M101 WeakPolarHBondContact O-CB 3.39Å; A83-M101 HydrophobicContact CB-CE 4.38Å; A83-M101 HydrophobicContact CB-SD 3.39Å; A83-M101 WeakPolarHBondContact CB-SD 3.32Å; D84-M101 CarbonylContact O-C 3.58Å; D84-M101 WeakPolarHBondContact O-CA 3.19Å; V85-M101 HydrophobicContact CG2-CE 4.19Å; V85-M101 HydrophobicContact CG2-SD 4.11Å; M101-S109 WeakPolarHBondContact O-CB 3.2Å; M101-S109 PolarHBondContact O-OG 3.19Å; M101-N111 HydrophobicContact CB-CB 4.38Å; M101-N111 PolarHBondContact N-O 2.82Å; M101-L113 HydrophobicContact CE-CB 4.02Å; M101-L113 HydrophobicContact CE-CD1 3.17Å; M101-L113 HydrophobicContact CE-CG 4.16Å; M101-W116 HydrophobicContact CE-CB 3.71Å; M101-W116 HydrophobicContact CE-CD2 3.57Å; M101-W116 HydrophobicContact CE-CE3 3.81Å; M101-W116 HydrophobicContact CE-CG 3.54Å; M101-W116 HydrophobicContact CG-CB 3.89Å; M101-W116 HydrophobicContact CG-CG 3.86Å; M101-W116 HydrophobicContact SD-CD2 4.35Å; M101-W116 HydrophobicContact SD-CG 4.11Å; M101-L129 HydrophobicContact CE-CD2 3.94Å
102	A	98.1	Very high	97.6	Very high	3 Å²	3	59 Å²	59	3%	0.025	33%	0.33	C	S	.	.			trans	-157.4	143.7	-178.5	0	0	0	0	0	113	D84 T86 I100 D106	D84-A102 WeakPolarHBondContact CB-O 3.37Å; D84-A102 PolarHBondContact O-N 3.42Å; T86-A102 HydrophobicContact CG2-CB 3.89Å; I100-A102 HydrophobicContact CD1-CB 3.96Å; I100-A102 HydrophobicContact CG1-CB 4.3Å; I100-A102 PolarHBondContact O-N 2.98Å; A102-D106 HydrophobicContact CB-CB 4.35Å
103	H	96.6	Very high	97.7	Very high	46 Å²	46	56.8 Å²	56.8	21%	0.213	32%	0.316	C	S	.	.			trans	-106.1	130.9	171.6	-169.1	-72.5	0	0	0	109.4	R63 D84 D106 K132	R63-H103 PolarHBondContact NH2-CD2 3.48Å; R63-H103 PolarHBondContact NH2-NE2 3.33Å; R63-H103 VanDerWaalsContact NH2-NE2 3.14Å; D84-H103 HydrophobicContact CB-CB 4.02Å; D84-H103 IonicContact OD1-CD2 3.4Å; D84-H103 PolarHBondContact OD1-CD2 3.29Å; D84-H103 WeakPolarHBondContact OD2-CB 3.25Å; D84-H103 IonicContact OD2-CD2 3.96Å; D84-H103 PolarHBondContact OD2-CD2 3.46Å; D84-H103 IonicContact OD2-CG 2.65Å; H103-D106 WeakPolarHBondContact O-CB 3.37Å; H103-D106 PolarHBondContact O-N 3.5Å; H103-K132 WeakPolarHBondContact CD2-CE 3.29Å; H103-K132 PolarHBondContact CD2-NZ 2.89Å
104	P	93.3	Very high	97.8	Very high	56 Å²	56	53 Å²	53	36%	0.364	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	139.2	172.4	-28.9	35.7	0	0	0	112.6	D106 K132	P104-D106 VanDerWaalsContact C-N 3.34Å; P104-K132 HydrophobicContact CG-CB 4.08Å; P104-K132 HydrophobicContact CG-CG 4.48Å
105	P	95.3	Very high	97.8	Very high	120 Å²	120	52 Å²	52	78%	0.779	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	cis	-82.4	-1.3	13.8	34.8	-37.4	0	0	0	114.9	V107	P105-V107 PolarHBondContact O-N 3.44Å
106	D	97.4	Very high	97.9	Very high	102 Å²	102	48.4 Å²	48.4	55%	0.545	26%	0.264	S	S	.	.			trans	-69.8	123.6	178.1	-60.6	-39.4	0	0	0	110.1	A102 H103 P104	A102-D106 HydrophobicContact CB-CB 4.35Å; H103-D106 WeakPolarHBondContact O-CB 3.37Å; H103-D106 PolarHBondContact O-N 3.5Å; P104-D106 VanDerWaalsContact C-N 3.34Å
107	V	96.7	Very high	97.9	Very high	31 Å²	31	43.7 Å²	43.7	19%	0.188	24%	0.243	C	C	.	.			trans	-118.2	7.9	177.4	-59.6	0	0	0	0	111.8	G89 Y90 T92 I100 P105	G89-V107 PolarHBondContact N-O 2.89Å; Y90-V107 WeakPolarHBondContact O-CG1 3.08Å; T92-V107 HydrophobicContact CG2-CG2 4.27Å; I100-V107 WeakPolarHBondContact CD1-O 3.37Å; P105-V107 PolarHBondContact O-N 3.44Å
108	Y	98	Very high	97.9	Very high	117 Å²	117	42.4 Å²	42.4	46%	0.459	23%	0.232	S	C	.	.			trans	-134.9	148.6	173.1	-59.6	-75.3	0	0	0	108.6	E88	E88-Y108 HydrophobicContact CG-CD1 3.92Å; E88-Y108 HydrophobicContact CG-CE1 4.22Å
109	S	98.1	Very high	97.9	Very high	37 Å²	37	41.2 Å²	41.2	26%	0.259	23%	0.227	S	C	.	.			trans	-148.3	153.1	176.9	175.7	0	0	0	0	109.6	N65 M101 N111	N65-S109 PolarHBondContact O-OG 2.94Å; M101-S109 WeakPolarHBondContact O-CB 3.2Å; M101-S109 PolarHBondContact O-OG 3.19Å; S109-N111 PolarHBondContact O-N 2.94Å; S109-N111 PolarHBondContact OG-N 2.97Å; S109-N111 VanDerWaalsContact OG-N 3.14Å; S109-N111 PolarHBondContact OG-O 3.28Å
110	D	98.5	Very high	97.9	Very high	85 Å²	85	40.9 Å²	40.9	46%	0.455	23%	0.225	S	C	.	.	S	Bend	trans	-77	-2.1	172.4	76.7	-26.3	0	0	0	112.7	S66 K67	S66-D110 VanDerWaalsContact CA-OD1 3.29Å; S66-D110 WeakPolarHBondContact CA-OD1 3.4Å; S66-D110 WeakPolarHBondContact CB-OD1 3.3Å; K67-D110 WeakPolarHBondContact CB-OD2 3.35Å; K67-D110 WeakPolarHBondContact CE-O 3.31Å; K67-D110 PolarHBondContact N-OD1 3.43Å; K67-D110 PolarHBondContact NZ-O 3.41Å
111	N	98.7	Very high	97.8	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.			trans	-128.1	115.4	-175.9	-154.1	2.1	0	0	0	111.5	K67 M70 M101 S109 Q115 W116	K67-N111 HydrophobicContact CG-CB 3.93Å; M70-N111 PolarHBondContact SD-ND2 3.44Å; M70-N111 VanDerWaalsContact SD-ND2 3.38Å; M101-N111 HydrophobicContact CB-CB 4.38Å; M101-N111 PolarHBondContact N-O 2.82Å; S109-N111 PolarHBondContact O-N 2.94Å; S109-N111 PolarHBondContact OG-N 2.97Å; S109-N111 VanDerWaalsContact OG-N 3.14Å; S109-N111 PolarHBondContact OG-O 3.28Å; N111-Q115 WeakPolarHBondContact OD1-CB 2.98Å; N111-W116 PolarHBondContact OD1-N 2.88Å
112	T	98.8	Very high	97.6	Very high	33 Å²	33	46.6 Å²	46.6	20%	0.202	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-79.1	158.1	170.5	67.7	0	0	0	0	110.1	V98 I100 D114 Q115 W116	V98-T112 HydrophobicContact CG1-CG2 4.06Å; I100-T112 HydrophobicContact CG2-CG2 4.35Å; T112-D114 PolarHBondContact O-N 3.48Å; T112-Q115 PolarHBondContact O-N 2.77Å; T112-Q115 WeakPolarHBondContact OG1-CG 3.37Å; T112-Q115 PolarHBondContact OG1-N 2.84Å; T112-W116 WeakPolarHBondContact O-CB 3.43Å; T112-W116 PolarHBondContact O-N 3Å
113	L	98.8	Very high	97.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-57.9	-36.5	172.4	171.5	63.6	0	0	0	111.8	P99 M101 W116 L117 L129 S140 L143	P99-L113 HydrophobicContact CB-CB 3.86Å; P99-L113 HydrophobicContact CB-CD2 3.92Å; P99-L113 PolarHBondContact O-N 3.19Å; M101-L113 HydrophobicContact CE-CB 4.02Å; M101-L113 HydrophobicContact CE-CD1 3.17Å; M101-L113 HydrophobicContact CE-CG 4.16Å; L113-W116 PolarHBondContact O-N 3.46Å; L113-L117 HydrophobicContact CD1-CD1 3.74Å; L113-L117 HydrophobicContact CD1-CD2 4.25Å; L113-L117 HydrophobicContact CD1-CG 3.67Å; L113-L117 HydrophobicContact CD2-CD1 4.46Å; L113-L117 HydrophobicContact CG-CD1 3.8Å; L113-L117 HydrophobicContact CG-CG 4.17Å; L113-L117 VanDerWaalsContact O-CB 3.31Å; L113-L117 WeakPolarHBondContact O-CB 3.25Å; L113-L117 VanDerWaalsContact O-CG 3.24Å; L113-L117 WeakPolarHBondContact O-CG 3.42Å; L113-L117 PolarHBondContact O-N 2.92Å; L113-L129 HydrophobicContact CD1-CD1 3.95Å; L113-L129 HydrophobicContact CD1-CD2 3.99Å; L113-S140 VanDerWaalsContact CD2-OG 3.28Å; L113-S140 WeakPolarHBondContact CD2-OG 3.3Å; L113-L143 HydrophobicContact CB-CD1 4.36Å; L113-L143 HydrophobicContact CD2-CD1 4.06Å; L113-L143 HydrophobicContact CG-CD1 4.24Å
114	D	98.7	Very high	97.3	Very high	59 Å²	59	49.6 Å²	49.6	32%	0.316	27%	0.269	S	S	.	.	H	α-helix	trans	-61.6	-48.7	178.1	-173.2	43.5	0	0	0	112	T112 L117 D118 L143 K147	T112-D114 PolarHBondContact O-N 3.48Å; D114-L117 PolarHBondContact O-N 3.11Å; D114-D118 PolarHBondContact O-N 2.85Å; D114-L143 HydrophobicContact CB-CD1 4.33Å; D114-L143 HydrophobicContact CB-CD2 4.27Å; D114-K147 WeakPolarHBondContact OD1-CE 3.35Å; D114-K147 IonicContact OD1-NZ 3.26Å; D114-K147 PolarHBondContact OD1-NZ 3.09Å
115	Q	98.8	Very high	97.4	Very high	84 Å²	84	48.3 Å²	48.3	39%	0.393	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-41.5	177	-72.5	173.3	-4.3	0	0	111.9	K67 N111 T112 D118 A119	K67-Q115 VanDerWaalsContact CE-OE1 3.32Å; N111-Q115 WeakPolarHBondContact OD1-CB 2.98Å; T112-Q115 PolarHBondContact O-N 2.77Å; T112-Q115 WeakPolarHBondContact OG1-CG 3.37Å; T112-Q115 PolarHBondContact OG1-N 2.84Å; Q115-D118 PolarHBondContact O-N 2.77Å; Q115-A119 PolarHBondContact O-N 2.88Å; Q115-A119 VanDerWaalsContact O-N 3.15Å
116	W	98.8	Very high	97.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-45.3	177.5	-172	108.1	0	0	0	111.5	A64 M70 L81 A83 M101 N111 T112 L113 D118 A119 V120 I127 L129	A64-W116 PolarHBondContact O-NE1 2.98Å; M70-W116 HydrophobicContact CG-CG 4.48Å; M70-W116 HydrophobicContact SD-CB 4.03Å; M70-W116 HydrophobicContact SD-CG 3.72Å; L81-W116 HydrophobicContact CB-CH2 4.05Å; L81-W116 HydrophobicContact CB-CZ2 3.69Å; L81-W116 HydrophobicContact CD2-CZ2 4.04Å; A83-W116 HydrophobicContact CB-CZ2 3.83Å; M101-W116 HydrophobicContact CE-CB 3.71Å; M101-W116 HydrophobicContact CE-CD2 3.57Å; M101-W116 HydrophobicContact CE-CE3 3.81Å; M101-W116 HydrophobicContact CE-CG 3.54Å; M101-W116 HydrophobicContact CG-CB 3.89Å; M101-W116 HydrophobicContact CG-CG 3.86Å; M101-W116 HydrophobicContact SD-CD2 4.35Å; M101-W116 HydrophobicContact SD-CG 4.11Å; N111-W116 PolarHBondContact OD1-N 2.88Å; T112-W116 WeakPolarHBondContact O-CB 3.43Å; T112-W116 PolarHBondContact O-N 3Å; L113-W116 PolarHBondContact O-N 3.46Å; W116-D118 VanDerWaalsContact C-N 3.34Å; W116-D118 PolarHBondContact O-N 3.13Å; W116-A119 PolarHBondContact O-N 3.42Å; W116-V120 HydrophobicContact CD2-CG2 3.66Å; W116-V120 HydrophobicContact CE3-CB 4.05Å; W116-V120 HydrophobicContact CE3-CG2 3.64Å; W116-V120 HydrophobicContact CG-CG2 4.46Å; W116-V120 HydrophobicContact CH2-CB 4.28Å; W116-V120 HydrophobicContact CH2-CG1 4.18Å; W116-V120 HydrophobicContact CH2-CG2 3.76Å; W116-V120 HydrophobicContact CZ2-CG2 3.81Å; W116-V120 HydrophobicContact CZ3-CB 3.89Å; W116-V120 HydrophobicContact CZ3-CG1 4.08Å; W116-V120 HydrophobicContact CZ3-CG2 3.67Å; W116-V120 WeakPolarHBondContact O-CB 3.25Å; W116-V120 VanDerWaalsContact O-CG2 3.31Å; W116-V120 WeakPolarHBondContact O-CG2 3.24Å; W116-V120 PolarHBondContact O-N 3.36Å; W116-I127 HydrophobicContact CH2-CG1 4.38Å; W116-I127 HydrophobicContact CH2-CG2 4.09Å; W116-I127 HydrophobicContact CZ3-CG1 4.19Å; W116-I127 HydrophobicContact CZ3-CG2 3.94Å; W116-L129 HydrophobicContact CH2-CD2 4.31Å; W116-L129 HydrophobicContact CZ3-CD2 4.07Å
117	L	98.7	Very high	97.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-42.5	176.5	-76.4	172.1	0	0	0	111.1	L113 D114 A119 V120 L121 I127 L143 L144 K147	L113-L117 HydrophobicContact CD1-CD1 3.74Å; L113-L117 HydrophobicContact CD1-CD2 4.25Å; L113-L117 HydrophobicContact CD1-CG 3.67Å; L113-L117 HydrophobicContact CD2-CD1 4.46Å; L113-L117 HydrophobicContact CG-CD1 3.8Å; L113-L117 HydrophobicContact CG-CG 4.17Å; L113-L117 VanDerWaalsContact O-CB 3.31Å; L113-L117 WeakPolarHBondContact O-CB 3.25Å; L113-L117 VanDerWaalsContact O-CG 3.24Å; L113-L117 WeakPolarHBondContact O-CG 3.42Å; L113-L117 PolarHBondContact O-N 2.92Å; D114-L117 PolarHBondContact O-N 3.11Å; L117-A119 PolarHBondContact O-N 2.86Å; L117-V120 PolarHBondContact O-N 3.08Å; L117-L121 HydrophobicContact CB-CD1 4.43Å; L117-L121 WeakPolarHBondContact O-CB 3.42Å; L117-L121 WeakPolarHBondContact O-CD1 3.29Å; L117-L121 WeakPolarHBondContact O-CG 3.48Å; L117-L121 PolarHBondContact O-N 3.49Å; L117-I127 HydrophobicContact CD2-CD1 4.23Å; L117-L143 HydrophobicContact CD1-CB 4.49Å; L117-L144 HydrophobicContact CD1-CD2 4Å; L117-L144 HydrophobicContact CD1-CG 4.48Å; L117-L144 HydrophobicContact CD2-CD2 3.88Å; L117-K147 HydrophobicContact CD1-CG 4.33Å
118	D	98.3	Very high	97.7	Very high	56 Å²	56	36.5 Å²	36.5	30%	0.299	19%	0.187	S	C	.	.	H	α-helix	trans	-58.8	-49.3	177.1	-80.1	-25.9	0	0	0	112.1	D114 Q115 W116 L121 D122 K147	D114-D118 PolarHBondContact O-N 2.85Å; Q115-D118 PolarHBondContact O-N 2.77Å; W116-D118 VanDerWaalsContact C-N 3.34Å; W116-D118 PolarHBondContact O-N 3.13Å; D118-L121 PolarHBondContact O-N 3.21Å; D118-D122 PolarHBondContact O-N 3.16Å; D118-D122 VanDerWaalsContact O-N 3.16Å; D118-K147 WeakPolarHBondContact OD1-CE 3.38Å; D118-K147 IonicContact OD1-NZ 3.75Å; D118-K147 PolarHBondContact OD1-NZ 2.74Å; D118-K147 IonicContact OD2-NZ 3.43Å; D118-K147 PolarHBondContact OD2-NZ 3.46Å
119	A	98.4	Very high	97.7	Very high	27 Å²	27	31 Å²	31	22%	0.223	17%	0.165	C	C	.	.	H	α-helix	trans	-64.7	-43.3	179.8	0	0	0	0	0	112.5	M70 L74 Q115 W116 L117 D122	M70-A119 HydrophobicContact CE-CB 3.53Å; M70-A119 HydrophobicContact SD-CB 3.66Å; L74-A119 HydrophobicContact CD1-CB 4.02Å; Q115-A119 PolarHBondContact O-N 2.88Å; Q115-A119 VanDerWaalsContact O-N 3.15Å; W116-A119 PolarHBondContact O-N 3.42Å; L117-A119 PolarHBondContact O-N 2.86Å; A119-D122 PolarHBondContact O-N 3.39Å
120	V	97.8	Very high	97.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69.6	-40.1	179.5	178.4	0	0	0	0	110.9	M70 L74 L81 W116 L117 D122 S123 K125 I127 R155	M70-V120 HydrophobicContact CG-CG2 4.4Å; M70-V120 HydrophobicContact SD-CG2 4.49Å; L74-V120 HydrophobicContact CD2-CG2 4.34Å; L81-V120 HydrophobicContact CD2-CG2 3.76Å; W116-V120 HydrophobicContact CD2-CG2 3.66Å; W116-V120 HydrophobicContact CE3-CB 4.05Å; W116-V120 HydrophobicContact CE3-CG2 3.64Å; W116-V120 HydrophobicContact CG-CG2 4.46Å; W116-V120 HydrophobicContact CH2-CB 4.28Å; W116-V120 HydrophobicContact CH2-CG1 4.18Å; W116-V120 HydrophobicContact CH2-CG2 3.76Å; W116-V120 HydrophobicContact CZ2-CG2 3.81Å; W116-V120 HydrophobicContact CZ3-CB 3.89Å; W116-V120 HydrophobicContact CZ3-CG1 4.08Å; W116-V120 HydrophobicContact CZ3-CG2 3.67Å; W116-V120 WeakPolarHBondContact O-CB 3.25Å; W116-V120 VanDerWaalsContact O-CG2 3.31Å; W116-V120 WeakPolarHBondContact O-CG2 3.24Å; W116-V120 PolarHBondContact O-N 3.36Å; L117-V120 PolarHBondContact O-N 3.08Å; V120-D122 PolarHBondContact O-N 3.19Å; V120-S123 WeakPolarHBondContact O-CA 3.14Å; V120-S123 WeakPolarHBondContact O-CB 3.38Å; V120-S123 PolarHBondContact O-N 2.76Å; V120-S123 PolarHBondContact O-OG 3.01Å; V120-K125 HydrophobicContact CG1-CB 4.49Å; V120-I127 HydrophobicContact CG1-CD1 4.18Å; V120-I127 HydrophobicContact CG1-CG1 3.77Å; V120-R155 PolarHBondContact O-NH1 3.12Å
121	L	97.1	Very high	97.8	Very high	6 Å²	6	25.9 Å²	25.9	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-64.2	-23.8	177.1	-69.5	174.4	0	0	0	113.3	L117 D118 S123 I127 K147 I153 R155	L117-L121 HydrophobicContact CB-CD1 4.43Å; L117-L121 WeakPolarHBondContact O-CB 3.42Å; L117-L121 WeakPolarHBondContact O-CD1 3.29Å; L117-L121 WeakPolarHBondContact O-CG 3.48Å; L117-L121 PolarHBondContact O-N 3.49Å; D118-L121 PolarHBondContact O-N 3.21Å; L121-S123 PolarHBondContact O-N 3.34Å; L121-I127 HydrophobicContact CD2-CD1 4.14Å; L121-K147 HydrophobicContact CD1-CB 4.03Å; L121-K147 HydrophobicContact CD1-CD 4.48Å; L121-K147 HydrophobicContact CD1-CG 4.31Å; L121-I153 HydrophobicContact CD1-CG1 4.27Å; L121-I153 HydrophobicContact CD2-CB 4.33Å; L121-I153 HydrophobicContact CD2-CG1 3.99Å; L121-I153 HydrophobicContact CD2-CG2 3.86Å; L121-R155 PolarHBondContact O-NH2 2.82Å
122	D	96	Very high	97.7	Very high	117 Å²	117	28 Å²	28	63%	0.626	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.8	171.6	-69.3	-13.2	0	0	0	113.5	D118 A119 V120 R151	D118-D122 PolarHBondContact O-N 3.16Å; D118-D122 VanDerWaalsContact O-N 3.16Å; A119-D122 PolarHBondContact O-N 3.39Å; V120-D122 PolarHBondContact O-N 3.19Å; D122-R151 IonicContact OD1-CZ 3.49Å; D122-R151 VanDerWaalsContact OD1-CZ 3.26Å; D122-R151 IonicContact OD1-NH1 3.65Å; D122-R151 PolarHBondContact OD1-NH1 2.61Å; D122-R151 IonicContact OD1-NH2 2.76Å; D122-R151 PolarHBondContact OD1-NH2 3.38Å
123	S	94.8	Very high	97.6	Very high	27 Å²	27	26.6 Å²	26.6	19%	0.189	14%	0.135	C	C	.	.	S	Bend	trans	-103.1	-172.5	173.4	84.6	0	0	0	0	112.8	V120 L121 K125 R155	V120-S123 WeakPolarHBondContact O-CA 3.14Å; V120-S123 WeakPolarHBondContact O-CB 3.38Å; V120-S123 PolarHBondContact O-N 2.76Å; V120-S123 PolarHBondContact O-OG 3.01Å; L121-S123 PolarHBondContact O-N 3.34Å; S123-K125 VanDerWaalsContact OG-CG 3.3Å; S123-K125 WeakPolarHBondContact OG-CG 3.21Å; S123-K125 PolarHBondContact OG-N 3.3Å; S123-K125 VanDerWaalsContact OG-N 3.11Å; S123-R155 VanDerWaalsContact O-CZ 3.28Å; S123-R155 PolarHBondContact O-NH1 3.34Å; S123-R155 PolarHBondContact O-NH2 3.01Å
124	R	92	Very high	97.6	Very high	84 Å²	84	28.8 Å²	28.8	32%	0.317	15%	0.147	S	C	.	.	S	Bend	trans	-106.3	10.9	171.5	-59.1	-175.6	-174.5	-150.3	-4.4	113.6	K28 F43	K28-R124 VanDerWaalsContact CB-CZ 3.49Å; K28-R124 PolarHBondContact O-NH2 3.1Å; K28-R124 VanDerWaalsContact O-NH2 3.07Å; F43-R124 VanDerWaalsContact CE1-O 3.27Å; F43-R124 WeakPolarHBondContact CE1-O 3.48Å; F43-R124 VanDerWaalsContact CZ-O 3.23Å; F43-R124 WeakPolarHBondContact CZ-O 3.17Å
125	K	96.4	Very high	97.5	Very high	29 Å²	29	29.7 Å²	29.7	13%	0.126	15%	0.152	C	C	.	.			trans	-76.7	143.9	-174	-50.7	-72.8	-172.3	-175.6	0	111.2	A73 L74 S76 V78 M79 L81 V120 S123 R155	A73-K125 WeakPolarHBondContact O-CE 3.44Å; L74-K125 HydrophobicContact CD2-CG 4.24Å; S76-K125 PolarHBondContact O-NZ 2.93Å; V78-K125 WeakPolarHBondContact O-CD 3.35Å; V78-K125 VanDerWaalsContact O-CE 3.27Å; V78-K125 WeakPolarHBondContact O-CE 3.24Å; V78-K125 PolarHBondContact O-NZ 2.73Å; M79-K125 CarbonylContact O-C 3.52Å; M79-K125 VanDerWaalsContact O-CA 3.3Å; M79-K125 WeakPolarHBondContact O-CA 3.24Å; L81-K125 HydrophobicContact CD1-CB 3.55Å; L81-K125 HydrophobicContact CD1-CD 3.98Å; L81-K125 HydrophobicContact CD1-CG 3.58Å; V120-K125 HydrophobicContact CG1-CB 4.49Å; S123-K125 VanDerWaalsContact OG-CG 3.3Å; S123-K125 WeakPolarHBondContact OG-CG 3.21Å; S123-K125 PolarHBondContact OG-N 3.3Å; S123-K125 VanDerWaalsContact OG-N 3.11Å; K125-R155 VanDerWaalsContact O-CD 3.25Å; K125-R155 WeakPolarHBondContact O-CD 3.38Å; K125-R155 PolarHBondContact O-NH1 2.77Å
126	G	97.5	Very high	97.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	160.5	169.1	0	0	0	0	0	112.1	M79 L81	M79-G126 PolarHBondContact O-N 2.7Å; L81-G126 PolarHBondContact N-O 2.86Å
127	I	98.6	Very high	97.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.2	-175.6	-63.4	170	0	0	0	110.1	W116 L117 V120 L121 L129 R155 P156 V157 W158	W116-I127 HydrophobicContact CH2-CG1 4.38Å; W116-I127 HydrophobicContact CH2-CG2 4.09Å; W116-I127 HydrophobicContact CZ3-CG1 4.19Å; W116-I127 HydrophobicContact CZ3-CG2 3.94Å; L117-I127 HydrophobicContact CD2-CD1 4.23Å; V120-I127 HydrophobicContact CG1-CD1 4.18Å; V120-I127 HydrophobicContact CG1-CG1 3.77Å; L121-I127 HydrophobicContact CD2-CD1 4.14Å; I127-L129 HydrophobicContact CG2-CD2 3.99Å; I127-L129 HydrophobicContact CG2-CG 3.89Å; I127-R155 HydrophobicContact CD1-CG 4.29Å; I127-P156 PolarHBondContact N-O 2.85Å; I127-V157 HydrophobicContact CB-CG2 4.48Å; I127-V157 HydrophobicContact CD1-CG2 4.4Å; I127-V157 HydrophobicContact CG2-CG1 4.33Å; I127-W158 PolarHBondContact O-N 2.92Å
128	K	98.8	Very high	97.5	Very high	6 Å²	6	26.7 Å²	26.7	3%	0.026	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.4	163.7	-177.4	179.3	174.1	-172.1	0	109.7	W60 L81 E82 A83 W158 N160	W60-K128 HydrophobicContact CE3-CD 4.45Å; W60-K128 HydrophobicContact CH2-CD 4.4Å; W60-K128 HydrophobicContact CZ3-CB 4.17Å; W60-K128 HydrophobicContact CZ3-CD 3.68Å; L81-K128 PolarHBondContact O-N 3.01Å; E82-K128 VanDerWaalsContact CA-O 3.3Å; E82-K128 WeakPolarHBondContact CA-O 3.4Å; E82-K128 HydrophobicContact CB-CB 4.14Å; E82-K128 HydrophobicContact CB-CD 4.28Å; E82-K128 HydrophobicContact CB-CG 4.44Å; E82-K128 HydrophobicContact CG-CB 4.2Å; E82-K128 HydrophobicContact CG-CD 3.81Å; E82-K128 HydrophobicContact CG-CG 3.98Å; A83-K128 PolarHBondContact N-O 2.97Å; A83-K128 VanDerWaalsContact N-O 3.09Å; K128-W158 WeakPolarHBondContact CA-O 3.11Å; K128-W158 HydrophobicContact CB-CB 3.98Å; K128-W158 HydrophobicContact CD-CE3 4.08Å; K128-W158 HydrophobicContact CG-CB 3.94Å; K128-W158 HydrophobicContact CG-CE3 4.48Å; K128-N160 WeakPolarHBondContact CE-OD1 3.27Å; K128-N160 HydrophobicContact CG-CB 4.33Å
129	L	98.9	Very high	97.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.3	178.4	-59.7	-179.1	0	0	0	109.6	V85 M101 L113 W116 I127 F131 L144 W158 L159 N160	V85-L129 HydrophobicContact CG2-CB 4.1Å; V85-L129 HydrophobicContact CG2-CD2 4.16Å; M101-L129 HydrophobicContact CE-CD2 3.94Å; L113-L129 HydrophobicContact CD1-CD1 3.95Å; L113-L129 HydrophobicContact CD1-CD2 3.99Å; W116-L129 HydrophobicContact CH2-CD2 4.31Å; W116-L129 HydrophobicContact CZ3-CD2 4.07Å; I127-L129 HydrophobicContact CG2-CD2 3.99Å; I127-L129 HydrophobicContact CG2-CG 3.89Å; L129-F131 HydrophobicContact CB-CE2 4.06Å; L129-F131 HydrophobicContact CB-CZ 4.23Å; L129-F131 HydrophobicContact CD1-CZ 4.41Å; L129-L144 HydrophobicContact CD1-CD1 4.09Å; L129-L144 HydrophobicContact CD1-CD2 4.42Å; L129-W158 PolarHBondContact N-O 2.81Å; L129-L159 HydrophobicContact CB-CD2 4.41Å; L129-L159 HydrophobicContact CD1-CD2 4.31Å; L129-N160 WeakPolarHBondContact O-CB 3.3Å; L129-N160 PolarHBondContact O-N 3.49Å
130	D	98.8	Very high	97.5	Very high	15 Å²	15	27 Å²	27	8%	0.08	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	99.5	-179.8	-172.6	3.7	0	0	0	112.5	E82 A83 D84 V85 K132 N160	E82-D130 WeakPolarHBondContact OE1-CB 3.16Å; A83-D130 PolarHBondContact O-N 3Å; D84-D130 CarbonylContact C-O 3.56Å; D84-D130 VanDerWaalsContact CA-O 3.28Å; D84-D130 WeakPolarHBondContact CA-O 3.28Å; V85-D130 PolarHBondContact N-O 3.43Å; D130-K132 PolarHBondContact O-N 3.18Å; D130-K132 IonicContact OD1-NZ 3.13Å; D130-K132 IonicContact OD2-NZ 2.77Å; D130-K132 PolarHBondContact OD2-NZ 3.45Å; D130-N160 HydrophobicContact CB-CB 4.14Å; D130-N160 PolarHBondContact OD1-ND2 3.42Å; D130-N160 PolarHBondContact OD2-ND2 3Å
131	F	98.8	Very high	97.6	Very high	1 Å²	1	27 Å²	27	0%	0.004	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	117.8	-177	-65.2	-81.1	0	0	0	112.2	V85 L129 V137 S140 L159 N160 A161 F181	V85-F131 HydrophobicContact CB-CD1 3.87Å; V85-F131 HydrophobicContact CB-CE1 4Å; V85-F131 HydrophobicContact CG1-CD1 4Å; V85-F131 HydrophobicContact CG1-CE1 3.86Å; V85-F131 HydrophobicContact CG2-CE1 4.46Å; L129-F131 HydrophobicContact CB-CE2 4.06Å; L129-F131 HydrophobicContact CB-CZ 4.23Å; L129-F131 HydrophobicContact CD1-CZ 4.41Å; F131-V137 HydrophobicContact CB-CG2 4.04Å; F131-V137 HydrophobicContact CD1-CB 4.46Å; F131-V137 HydrophobicContact CD1-CG2 3.78Å; F131-V137 HydrophobicContact CD2-CG2 4.49Å; F131-V137 HydrophobicContact CE1-CG2 4.37Å; F131-V137 HydrophobicContact CG-CG2 3.84Å; F131-S140 VanDerWaalsContact CE1-CB 3.45Å; F131-S140 WeakPolarHBondContact CE1-OG 3.34Å; F131-L159 HydrophobicContact CE2-CB 4.23Å; F131-L159 HydrophobicContact CE2-CD2 3.93Å; F131-L159 HydrophobicContact CZ-CD2 4.4Å; F131-N160 WeakPolarHBondContact CD2-O 3.29Å; F131-N160 PolarHBondContact N-O 3.14Å; F131-A161 HydrophobicContact CB-CB 4.23Å; F131-F181 HydrophobicContact CB-CE2 4.36Å; F131-F181 AromaticContact CD2-CE2 3.69Å; F131-F181 HydrophobicContact CD2-CE2 3.69Å; F131-F181 HydrophobicContact CD2-CZ 4.26Å; F131-F181 HydrophobicContact CE2-CE2 4.36Å; F131-F181 HydrophobicContact CG-CE2 4.23Å
132	K	97.9	Very high	97.7	Very high	45 Å²	45	30.8 Å²	30.8	20%	0.196	16%	0.157	C	C	.	.	S	Bend	trans	-89.9	-14	176.7	-54.7	-57.1	177.8	-179.5	0	113.8	D84 V85 H103 P104 D130	D84-K132 HydrophobicContact CB-CG 4.19Å; D84-K132 WeakPolarHBondContact OD1-CE 3.44Å; D84-K132 IonicContact OD1-NZ 3.13Å; D84-K132 PolarHBondContact OD1-NZ 2.92Å; V85-K132 PolarHBondContact O-N 2.92Å; H103-K132 WeakPolarHBondContact CD2-CE 3.29Å; H103-K132 PolarHBondContact CD2-NZ 2.89Å; P104-K132 HydrophobicContact CG-CB 4.08Å; P104-K132 HydrophobicContact CG-CG 4.48Å; D130-K132 PolarHBondContact O-N 3.18Å; D130-K132 IonicContact OD1-NZ 3.13Å; D130-K132 IonicContact OD2-NZ 2.77Å; D130-K132 PolarHBondContact OD2-NZ 3.45Å
133	A	96.2	Very high	97.8	Very high	2 Å²	2	26.6 Å²	26.6	2%	0.017	14%	0.135	C	C	.	.			trans	-146.6	134	-180	0	0	0	0	0	111.6	Y90 D135 S136	Y90-A133 HydrophobicContact CD1-CB 4.32Å; Y90-A133 HydrophobicContact CD2-CB 4.03Å; Y90-A133 HydrophobicContact CE1-CB 3.84Å; Y90-A133 HydrophobicContact CE2-CB 3.54Å; Y90-A133 HydrophobicContact CG-CB 4.4Å; Y90-A133 VanDerWaalsContact CZ-CB 3.42Å; A133-D135 PolarHBondContact O-N 3.49Å; A133-S136 PolarHBondContact O-N 2.88Å; A133-S136 PolarHBondContact O-OG 3.39Å
134	L	98.1	Very high	98	Very high	46 Å²	46	25.3 Å²	25.3	24%	0.241	13%	0.126	C	C	.	.	H	α-helix	trans	-56.7	-36.4	178.1	-174.9	68.7	0	0	0	112.4	S136 V137 V176 N177 R180 F181 L184	L134-S136 PolarHBondContact O-N 3.2Å; L134-S136 VanDerWaalsContact O-N 3.16Å; L134-V137 HydrophobicContact CD1-CG2 4.39Å; L134-V137 VanDerWaalsContact O-CB 3.31Å; L134-V137 WeakPolarHBondContact O-CB 3.31Å; L134-V137 WeakPolarHBondContact O-CG2 3.4Å; L134-V137 PolarHBondContact O-N 2.9Å; L134-V176 HydrophobicContact CB-CG1 4.17Å; L134-V176 HydrophobicContact CD1-CG1 4.15Å; L134-N177 HydrophobicContact CD2-CB 4.06Å; L134-R180 HydrophobicContact CD1-CB 3.94Å; L134-R180 HydrophobicContact CD2-CB 3.79Å; L134-R180 HydrophobicContact CD2-CG 4.36Å; L134-R180 HydrophobicContact CG-CB 4.5Å; L134-F181 HydrophobicContact CD1-CB 4.25Å; L134-L184 HydrophobicContact CD1-CD1 4.08Å
135	D	97.6	Very high	98.3	Very high	79 Å²	79	26.3 Å²	26.3	42%	0.422	13%	0.132	S	C	.	.	H	α-helix	trans	-60	-27.2	-177.2	-63.9	4.7	0	0	0	112.8	L87 Y90 A133 F139	L87-D135 HydrophobicContact CD1-CB 3.73Å; Y90-D135 HydrophobicContact CE2-CB 4.35Å; A133-D135 PolarHBondContact O-N 3.49Å; D135-F139 VanDerWaalsContact O-CD2 3.3Å; D135-F139 WeakPolarHBondContact O-CD2 3.35Å
136	S	98.3	Very high	98.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-81.6	-19.1	178.6	69	0	0	0	0	113.6	A133 L134 S140	A133-S136 PolarHBondContact O-N 2.88Å; A133-S136 PolarHBondContact O-OG 3.39Å; L134-S136 PolarHBondContact O-N 3.2Å; L134-S136 VanDerWaalsContact O-N 3.16Å; S136-S140 VanDerWaalsContact O-CB 3.28Å; S136-S140 WeakPolarHBondContact O-CB 3.33Å; S136-S140 PolarHBondContact O-N 3.44Å; S136-S140 PolarHBondContact O-OG 3.01Å
137	V	98.8	Very high	98.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.1	-50.2	-170.5	177.4	0	0	0	0	110.9	F131 L134 F139 S140 L141 F181 L184	F131-V137 HydrophobicContact CB-CG2 4.04Å; F131-V137 HydrophobicContact CD1-CB 4.46Å; F131-V137 HydrophobicContact CD1-CG2 3.78Å; F131-V137 HydrophobicContact CD2-CG2 4.49Å; F131-V137 HydrophobicContact CE1-CG2 4.37Å; F131-V137 HydrophobicContact CG-CG2 3.84Å; L134-V137 HydrophobicContact CD1-CG2 4.39Å; L134-V137 VanDerWaalsContact O-CB 3.31Å; L134-V137 WeakPolarHBondContact O-CB 3.31Å; L134-V137 WeakPolarHBondContact O-CG2 3.4Å; L134-V137 PolarHBondContact O-N 2.9Å; V137-F139 PolarHBondContact O-N 3.39Å; V137-S140 PolarHBondContact O-N 3.43Å; V137-L141 HydrophobicContact CG1-CD1 3.71Å; V137-L141 HydrophobicContact CG1-CG 4.2Å; V137-L141 WeakPolarHBondContact O-CG 3.36Å; V137-L141 PolarHBondContact O-N 3.18Å; V137-F181 HydrophobicContact CG1-CD2 4.07Å; V137-F181 HydrophobicContact CG1-CE2 4.34Å; V137-F181 HydrophobicContact CG2-CD2 3.83Å; V137-F181 HydrophobicContact CG2-CE2 4.16Å; V137-L184 HydrophobicContact CB-CD1 4.02Å; V137-L184 HydrophobicContact CG1-CB 4.05Å; V137-L184 HydrophobicContact CG1-CD1 3.88Å
138	G	98.6	Very high	98.4	Very high	20 Å²	20	34.3 Å²	34.3	21%	0.206	17%	0.172	C	C	.	.	H	α-helix	trans	-57.5	-52.9	-178.2	0	0	0	0	0	112.7	S140 L141 D142	G138-S140 VanDerWaalsContact C-N 3.27Å; G138-S140 PolarHBondContact O-N 2.84Å; G138-L141 PolarHBondContact O-N 2.92Å; G138-D142 PolarHBondContact O-N 3.33Å
139	F	98.8	Very high	98.3	Very high	89 Å²	89	38.7 Å²	38.7	39%	0.39	20%	0.203	S	C	.	.	H	α-helix	trans	-61	-36.2	178.8	-61.6	-67.4	0	0	0	112.6	L87 P97 P99 D135 V137 D142 L143	L87-F139 HydrophobicContact CD2-CD2 4.03Å; P97-F139 HydrophobicContact CB-CD1 4.12Å; P97-F139 HydrophobicContact CB-CD2 4.25Å; P97-F139 HydrophobicContact CB-CE1 3.56Å; P97-F139 HydrophobicContact CB-CE2 3.7Å; P97-F139 HydrophobicContact CB-CG 4.44Å; P97-F139 HydrophobicContact CB-CZ 3.33Å; P99-F139 HydrophobicContact CG-CB 3.5Å; P99-F139 VanDerWaalsContact CG-CB 3.5Å; D135-F139 VanDerWaalsContact O-CD2 3.3Å; D135-F139 WeakPolarHBondContact O-CD2 3.35Å; V137-F139 PolarHBondContact O-N 3.39Å; F139-D142 PolarHBondContact O-N 2.83Å; F139-L143 PolarHBondContact O-N 2.91Å; F139-L143 VanDerWaalsContact O-N 3.11Å
140	S	98.9	Very high	98.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-71	-39.1	178.4	-58.2	0	0	0	0	112.6	P99 L113 F131 S136 V137 G138 D142 L143 L144	P99-S140 WeakPolarHBondContact CB-OG 3.43Å; P99-S140 WeakPolarHBondContact CG-OG 3.46Å; L113-S140 VanDerWaalsContact CD2-OG 3.28Å; L113-S140 WeakPolarHBondContact CD2-OG 3.3Å; F131-S140 VanDerWaalsContact CE1-CB 3.45Å; F131-S140 WeakPolarHBondContact CE1-OG 3.34Å; S136-S140 VanDerWaalsContact O-CB 3.28Å; S136-S140 WeakPolarHBondContact O-CB 3.33Å; S136-S140 PolarHBondContact O-N 3.44Å; S136-S140 PolarHBondContact O-OG 3.01Å; V137-S140 PolarHBondContact O-N 3.43Å; G138-S140 VanDerWaalsContact C-N 3.27Å; G138-S140 PolarHBondContact O-N 2.84Å; S140-D142 VanDerWaalsContact C-N 3.34Å; S140-L143 PolarHBondContact O-N 3.27Å; S140-L144 WeakPolarHBondContact O-CG 3.48Å; S140-L144 PolarHBondContact O-N 2.95Å
141	L	98.9	Very high	98	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-36.9	175	-64.6	170.4	0	0	0	111.6	V137 G138 L144 K145 L159 L184 I185 T188 F189	V137-L141 HydrophobicContact CG1-CD1 3.71Å; V137-L141 HydrophobicContact CG1-CG 4.2Å; V137-L141 WeakPolarHBondContact O-CG 3.36Å; V137-L141 PolarHBondContact O-N 3.18Å; G138-L141 PolarHBondContact O-N 2.92Å; L141-L144 HydrophobicContact CD2-CD1 4.42Å; L141-L144 PolarHBondContact O-N 3.4Å; L141-K145 VanDerWaalsContact O-CB 3.31Å; L141-K145 WeakPolarHBondContact O-CB 3.49Å; L141-K145 PolarHBondContact O-N 3.11Å; L141-L159 HydrophobicContact CD2-CD1 3.57Å; L141-L184 HydrophobicContact CD1-CB 3.86Å; L141-I185 HydrophobicContact CD1-CG1 4.19Å; L141-I185 HydrophobicContact CD2-CG1 4.22Å; L141-T188 HydrophobicContact CB-CG2 3.62Å; L141-F189 HydrophobicContact CB-CB 4.4Å; L141-F189 HydrophobicContact CD2-CB 3.91Å
142	D	98.8	Very high	97.7	Very high	87 Å²	87	49.6 Å²	49.6	47%	0.465	27%	0.268	S	S	.	.	H	α-helix	trans	-63.8	-41.3	174.2	-73	-24.1	0	0	0	111.4	G138 F139 S140 K145 Q146 T188	G138-D142 PolarHBondContact O-N 3.33Å; F139-D142 PolarHBondContact O-N 2.83Å; S140-D142 VanDerWaalsContact C-N 3.34Å; D142-K145 PolarHBondContact O-N 3.35Å; D142-Q146 WeakPolarHBondContact O-CB 3.3Å; D142-Q146 PolarHBondContact O-N 3.43Å; D142-T188 WeakPolarHBondContact OD1-CG2 3.21Å
143	L	98.6	Very high	97.7	Very high	28 Å²	28	47.8 Å²	47.8	15%	0.147	26%	0.26	C	S	.	.	H	α-helix	trans	-62.5	-47.5	172.8	-76.4	172.2	0	0	0	112.1	P99 L113 D114 L117 F139 S140 K145 Q146 K147	P99-L143 HydrophobicContact CG-CD1 4.24Å; L113-L143 HydrophobicContact CB-CD1 4.36Å; L113-L143 HydrophobicContact CD2-CD1 4.06Å; L113-L143 HydrophobicContact CG-CD1 4.24Å; D114-L143 HydrophobicContact CB-CD1 4.33Å; D114-L143 HydrophobicContact CB-CD2 4.27Å; L117-L143 HydrophobicContact CD1-CB 4.49Å; F139-L143 PolarHBondContact O-N 2.91Å; F139-L143 VanDerWaalsContact O-N 3.11Å; S140-L143 PolarHBondContact O-N 3.27Å; L143-K145 VanDerWaalsContact C-N 3.31Å; L143-K145 PolarHBondContact O-N 2.88Å; L143-Q146 WeakPolarHBondContact O-CB 3.28Å; L143-Q146 PolarHBondContact O-N 3.13Å; L143-K147 WeakPolarHBondContact O-CG 3.46Å; L143-K147 PolarHBondContact O-N 3.11Å
144	L	98.8	Very high	97.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57.5	-44.5	175.6	-75.2	170.5	0	0	0	111.6	L117 L129 S140 L141 Q146 K147 N148 I153 V157 L159 F189	L117-L144 HydrophobicContact CD1-CD2 4Å; L117-L144 HydrophobicContact CD1-CG 4.48Å; L117-L144 HydrophobicContact CD2-CD2 3.88Å; L129-L144 HydrophobicContact CD1-CD1 4.09Å; L129-L144 HydrophobicContact CD1-CD2 4.42Å; S140-L144 WeakPolarHBondContact O-CG 3.48Å; S140-L144 PolarHBondContact O-N 2.95Å; L141-L144 HydrophobicContact CD2-CD1 4.42Å; L141-L144 PolarHBondContact O-N 3.4Å; L144-Q146 PolarHBondContact O-N 3.34Å; L144-K147 PolarHBondContact O-N 3.37Å; L144-N148 VanDerWaalsContact O-CB 3.29Å; L144-N148 WeakPolarHBondContact O-CB 3.49Å; L144-N148 PolarHBondContact O-N 2.85Å; L144-I153 HydrophobicContact CD2-CD1 4.07Å; L144-V157 HydrophobicContact CD1-CG1 4.2Å; L144-V157 HydrophobicContact CD2-CG1 4.3Å; L144-L159 HydrophobicContact CD1-CD2 3.95Å; L144-F189 HydrophobicContact CB-CD1 4.18Å; L144-F189 HydrophobicContact CB-CD2 4.28Å; L144-F189 HydrophobicContact CB-CE1 4.17Å; L144-F189 HydrophobicContact CB-CE2 4.26Å; L144-F189 HydrophobicContact CB-CG 4.24Å; L144-F189 HydrophobicContact CB-CZ 4.21Å; L144-F189 HydrophobicContact CD1-CD1 4.29Å
145	K	98.5	Very high	97.5	Very high	105 Å²	105	48.5 Å²	48.5	46%	0.457	26%	0.263	S	S	.	.	H	α-helix	trans	-62	-42.9	176.7	-175	177.5	-178.4	174.8	0	112.1	L141 D142 L143 S149 T188 F189	L141-K145 VanDerWaalsContact O-CB 3.31Å; L141-K145 WeakPolarHBondContact O-CB 3.49Å; L141-K145 PolarHBondContact O-N 3.11Å; D142-K145 PolarHBondContact O-N 3.35Å; L143-K145 VanDerWaalsContact C-N 3.31Å; L143-K145 PolarHBondContact O-N 2.88Å; K145-S149 VanDerWaalsContact O-CB 3.32Å; K145-S149 WeakPolarHBondContact O-CB 3.28Å; K145-S149 PolarHBondContact O-N 3.23Å; K145-S149 PolarHBondContact O-OG 3.33Å; K145-T188 HydrophobicContact CD-CG2 4.44Å; K145-F189 HydrophobicContact CB-CD2 3.97Å; K145-F189 HydrophobicContact CB-CE2 4.48Å
146	Q	98.4	Very high	97.5	Very high	121 Å²	121	44.7 Å²	44.7	57%	0.565	24%	0.242	S	C	*	.	H	α-helix	trans	-62.5	-50.6	176.2	-176.9	-174.1	2.2	0	0	111.1	D142 L143 L144 N148 S149 S150	D142-Q146 WeakPolarHBondContact O-CB 3.3Å; D142-Q146 PolarHBondContact O-N 3.43Å; L143-Q146 WeakPolarHBondContact O-CB 3.28Å; L143-Q146 PolarHBondContact O-N 3.13Å; L144-Q146 PolarHBondContact O-N 3.34Å; Q146-N148 VanDerWaalsContact C-N 3.34Å; Q146-N148 PolarHBondContact O-N 2.67Å; Q146-S149 PolarHBondContact O-N 3.06Å; Q146-S150 WeakPolarHBondContact O-CB 3.37Å; Q146-S150 PolarHBondContact O-N 2.89Å; Q146-S150 PolarHBondContact O-OG 2.96Å
147	K	98.1	Very high	97.6	Very high	19 Å²	19	44.7 Å²	44.7	8%	0.083	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-41.9	178.3	-65.9	-64.7	-176.6	-172.9	0	111.8	D114 L117 D118 L121 L143 L144 S149 S150 R151 G152 I153	D114-K147 WeakPolarHBondContact OD1-CE 3.35Å; D114-K147 IonicContact OD1-NZ 3.26Å; D114-K147 PolarHBondContact OD1-NZ 3.09Å; L117-K147 HydrophobicContact CD1-CG 4.33Å; D118-K147 WeakPolarHBondContact OD1-CE 3.38Å; D118-K147 IonicContact OD1-NZ 3.75Å; D118-K147 PolarHBondContact OD1-NZ 2.74Å; D118-K147 IonicContact OD2-NZ 3.43Å; D118-K147 PolarHBondContact OD2-NZ 3.46Å; L121-K147 HydrophobicContact CD1-CB 4.03Å; L121-K147 HydrophobicContact CD1-CD 4.48Å; L121-K147 HydrophobicContact CD1-CG 4.31Å; L143-K147 WeakPolarHBondContact O-CG 3.46Å; L143-K147 PolarHBondContact O-N 3.11Å; L144-K147 PolarHBondContact O-N 3.37Å; K147-S149 VanDerWaalsContact C-N 3.31Å; K147-S149 PolarHBondContact O-N 3.14Å; K147-S150 PolarHBondContact O-N 2.79Å; K147-S150 PolarHBondContact O-OG 3.38Å; K147-R151 WeakPolarHBondContact O-CG 3.12Å; K147-R151 PolarHBondContact O-N 3.49Å; K147-R151 VanDerWaalsContact O-N 3.09Å; K147-G152 PolarHBondContact O-N 2.76Å; K147-I153 HydrophobicContact CB-CD1 4.28Å; K147-I153 HydrophobicContact CB-CG1 4.47Å
148	N	97.3	Very high	97.6	Very high	57 Å²	57	44.9 Å²	44.9	31%	0.305	24%	0.243	S	C	.	.	H	α-helix	trans	-64.1	-38.5	177.1	-164	30.9	0	0	0	111.9	L144 Q146 G152 I153 F189	L144-N148 VanDerWaalsContact O-CB 3.29Å; L144-N148 WeakPolarHBondContact O-CB 3.49Å; L144-N148 PolarHBondContact O-N 2.85Å; Q146-N148 VanDerWaalsContact C-N 3.34Å; Q146-N148 PolarHBondContact O-N 2.67Å; N148-G152 WeakPolarHBondContact O-CA 3.33Å; N148-G152 PolarHBondContact O-N 3.43Å; N148-I153 HydrophobicContact CB-CD1 3.97Å; N148-I153 HydrophobicContact CB-CG1 3.99Å; N148-I153 PolarHBondContact OD1-N 2.73Å; N148-F189 HydrophobicContact CB-CE2 3.8Å; N148-F189 HydrophobicContact CB-CZ 4.06Å
149	S	96.6	Very high	97.6	Very high	99 Å²	99	43.9 Å²	43.9	69%	0.692	23%	0.233	S	C	*	.	H	α-helix	trans	-75.7	-33	179.8	-57.4	0	0	0	0	112.9	K145 Q146 K147	K145-S149 VanDerWaalsContact O-CB 3.32Å; K145-S149 WeakPolarHBondContact O-CB 3.28Å; K145-S149 PolarHBondContact O-N 3.23Å; K145-S149 PolarHBondContact O-OG 3.33Å; Q146-S149 PolarHBondContact O-N 3.06Å; K147-S149 VanDerWaalsContact C-N 3.31Å; K147-S149 PolarHBondContact O-N 3.14Å
150	S	96.4	Very high	97.6	Very high	88 Å²	88	39.9 Å²	39.9	62%	0.615	22%	0.216	S	C	*	.	H	α-helix	trans	-83.1	-37	-175.4	65.9	0	0	0	0	113.9	Q146 K147	Q146-S150 WeakPolarHBondContact O-CB 3.37Å; Q146-S150 PolarHBondContact O-N 2.89Å; Q146-S150 PolarHBondContact O-OG 2.96Å; K147-S150 PolarHBondContact O-N 2.79Å; K147-S150 PolarHBondContact O-OG 3.38Å
151	R	94.9	Very high	97.6	Very high	121 Å²	121	39.9 Å²	39.9	46%	0.457	22%	0.216	S	C	.	.	H	α-helix	trans	-134.4	-8.9	-177	63.2	-179.9	-66.4	179.3	1.5	115.1	D122 K147	D122-R151 IonicContact OD1-CZ 3.49Å; D122-R151 VanDerWaalsContact OD1-CZ 3.26Å; D122-R151 IonicContact OD1-NH1 3.65Å; D122-R151 PolarHBondContact OD1-NH1 2.61Å; D122-R151 IonicContact OD1-NH2 2.76Å; D122-R151 PolarHBondContact OD1-NH2 3.38Å; K147-R151 WeakPolarHBondContact O-CG 3.12Å; K147-R151 PolarHBondContact O-N 3.49Å; K147-R151 VanDerWaalsContact O-N 3.09Å
152	G	93.7	Very high	97.5	Very high	36 Å²	36	41.6 Å²	41.6	37%	0.371	23%	0.225	S	C	.	.			trans	76.9	132.1	-171.2	0	0	0	0	0	112.2	K147 N148	K147-G152 PolarHBondContact O-N 2.76Å; N148-G152 WeakPolarHBondContact O-CA 3.33Å; N148-G152 PolarHBondContact O-N 3.43Å
153	I	96.8	Very high	97.5	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	20%	0.204	C	C	.	.			trans	-98	107.7	169	-61.3	175.3	0	0	0	107.9	T36 L121 L144 K147 N148 R155 V157 F189	T36-I153 HydrophobicContact CG2-CB 3.52Å; T36-I153 HydrophobicContact CG2-CD1 4.46Å; T36-I153 HydrophobicContact CG2-CG2 3.46Å; T36-I153 VanDerWaalsContact CG2-CG2 3.46Å; L121-I153 HydrophobicContact CD1-CG1 4.27Å; L121-I153 HydrophobicContact CD2-CB 4.33Å; L121-I153 HydrophobicContact CD2-CG1 3.99Å; L121-I153 HydrophobicContact CD2-CG2 3.86Å; L144-I153 HydrophobicContact CD2-CD1 4.07Å; K147-I153 HydrophobicContact CB-CD1 4.28Å; K147-I153 HydrophobicContact CB-CG1 4.47Å; N148-I153 HydrophobicContact CB-CD1 3.97Å; N148-I153 HydrophobicContact CB-CG1 3.99Å; N148-I153 PolarHBondContact OD1-N 2.73Å; I153-R155 HydrophobicContact CG2-CG 3.88Å; I153-R155 PolarHBondContact O-N 3.42Å; I153-V157 HydrophobicContact CG2-CG2 3.91Å; I153-F189 HydrophobicContact CD1-CZ 4.3Å
154	N	95.3	Very high	97.5	Very high	44 Å²	44	37.5 Å²	37.5	24%	0.235	20%	0.203	C	C	.	.			trans	-97.7	50.5	-174.4	-162.9	58.5	0	0	0	113.1	P32 L33 F34	P32-N154 PolarHBondContact O-ND2 2.7Å; L33-N154 WeakPolarHBondContact CA-OD1 2.68Å; F34-N154 PolarHBondContact N-OD1 2.71Å; F34-N154 CarbonylContact O-C 3.56Å; F34-N154 WeakPolarHBondContact O-CA 3.33Å; F34-N154 PolarHBondContact O-OD1 2.76Å
155	R	96.4	Very high	97.4	Very high	19 Å²	19	41.8 Å²	41.8	7%	0.072	22%	0.219	C	C	.	.	S	Bend	trans	-169.9	160.5	-177.3	65.5	-156.4	70.5	175.4	5.2	111.7	T36 F43 V120 L121 S123 K125 I127 I153	T36-R155 WeakPolarHBondContact CA-O 3.47Å; F43-R155 HydrophobicContact CD2-CB 4.15Å; F43-R155 HydrophobicContact CE1-CB 4.32Å; F43-R155 HydrophobicContact CE2-CB 3.59Å; F43-R155 HydrophobicContact CZ-CB 3.68Å; V120-R155 PolarHBondContact O-NH1 3.12Å; L121-R155 PolarHBondContact O-NH2 2.82Å; S123-R155 VanDerWaalsContact O-CZ 3.28Å; S123-R155 PolarHBondContact O-NH1 3.34Å; S123-R155 PolarHBondContact O-NH2 3.01Å; K125-R155 VanDerWaalsContact O-CD 3.25Å; K125-R155 WeakPolarHBondContact O-CD 3.38Å; K125-R155 PolarHBondContact O-NH1 2.77Å; I127-R155 HydrophobicContact CD1-CG 4.29Å; I153-R155 HydrophobicContact CG2-CG 3.88Å; I153-R155 PolarHBondContact O-N 3.42Å
156	P	97.6	Very high	97.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.198	C	C	.	.			trans	-58.2	139.5	171.5	-20.1	29.4	0	0	0	112.5	F34 T36 M40 F43 I127	F34-P156 HydrophobicContact CD1-CG 4.06Å; F34-P156 HydrophobicContact CE1-CG 3.55Å; F34-P156 HydrophobicContact CZ-CG 4.35Å; T36-P156 WeakPolarHBondContact O-CA 3.28Å; M40-P156 HydrophobicContact CE-CB 4.03Å; M40-P156 HydrophobicContact CE-CG 3.56Å; M40-P156 HydrophobicContact SD-CB 3.98Å; M40-P156 HydrophobicContact SD-CG 4.1Å; F43-P156 HydrophobicContact CB-CG 3.57Å; F43-P156 HydrophobicContact CD1-CG 4.38Å; F43-P156 HydrophobicContact CG-CG 3.93Å; I127-P156 PolarHBondContact N-O 2.85Å
157	V	98.7	Very high	97.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	121.6	169.4	178.2	0	0	0	0	108.1	T36 I127 L144 I153 L159 V192 T193	T36-V157 HydrophobicContact CG2-CG2 3.89Å; T36-V157 PolarHBondContact O-N 3.46Å; I127-V157 HydrophobicContact CB-CG2 4.48Å; I127-V157 HydrophobicContact CD1-CG2 4.4Å; I127-V157 HydrophobicContact CG2-CG1 4.33Å; L144-V157 HydrophobicContact CD1-CG1 4.2Å; L144-V157 HydrophobicContact CD2-CG1 4.3Å; I153-V157 HydrophobicContact CG2-CG2 3.91Å; V157-L159 HydrophobicContact CG1-CD2 3.83Å; V157-V192 HydrophobicContact CB-CG1 4.26Å; V157-V192 HydrophobicContact CG1-CG1 4.29Å; V157-V192 WeakPolarHBondContact O-CB 3.22Å; V157-T193 PolarHBondContact O-N 3.04Å
158	W	98.9	Very high	97	Very high	3 Å²	3	33 Å²	33	1%	0.011	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131.1	176.6	-71.1	24.9	0	0	0	109.7	M40 W60 I127 K128 L129 T193 T232 Y286	M40-W158 HydrophobicContact CB-CH2 4.47Å; M40-W158 HydrophobicContact CB-CZ2 3.48Å; M40-W158 VanDerWaalsContact CB-CZ2 3.48Å; M40-W158 HydrophobicContact CG-CZ2 3.99Å; W60-W158 AromaticContact CH2-CE3 3.78Å; W60-W158 HydrophobicContact CH2-CE3 3.78Å; W60-W158 AromaticContact CH2-CH2 3.85Å; W60-W158 HydrophobicContact CH2-CH2 3.85Å; W60-W158 AromaticContact CH2-CZ3 3.36Å; W60-W158 HydrophobicContact CH2-CZ3 3.36Å; W60-W158 HydrophobicContact CZ2-CH2 4.21Å; W60-W158 HydrophobicContact CZ2-CZ3 4.03Å; W60-W158 HydrophobicContact CZ3-CE3 4.38Å; W60-W158 HydrophobicContact CZ3-CZ3 4.32Å; I127-W158 PolarHBondContact O-N 2.92Å; K128-W158 WeakPolarHBondContact CA-O 3.11Å; K128-W158 HydrophobicContact CB-CB 3.98Å; K128-W158 HydrophobicContact CD-CE3 4.08Å; K128-W158 HydrophobicContact CG-CB 3.94Å; K128-W158 HydrophobicContact CG-CE3 4.48Å; L129-W158 PolarHBondContact N-O 2.81Å; W158-T193 WeakPolarHBondContact CA-O 3.47Å; W158-T193 VanDerWaalsContact CD1-CB 3.44Å; W158-T193 HydrophobicContact CD2-CG2 4.14Å; W158-T193 HydrophobicContact CG-CG2 4.2Å; W158-T193 HydrophobicContact CZ2-CG2 4.41Å; W158-T232 HydrophobicContact CD2-CG2 4.34Å; W158-T232 HydrophobicContact CE3-CG2 3.66Å; W158-T232 HydrophobicContact CH2-CG2 3.97Å; W158-T232 HydrophobicContact CZ3-CG2 3.47Å; W158-T232 VanDerWaalsContact CZ3-CG2 3.47Å; W158-Y286 HydrophobicContact CH2-CD1 4.03Å; W158-Y286 AromaticContact CH2-CD2 3.69Å; W158-Y286 HydrophobicContact CH2-CD2 3.69Å; W158-Y286 AromaticContact CH2-CE1 3.92Å; W158-Y286 HydrophobicContact CH2-CE1 3.92Å; W158-Y286 AromaticContact CH2-CE2 3.61Å; W158-Y286 HydrophobicContact CH2-CE2 3.61Å; W158-Y286 AromaticContact CH2-CG 3.91Å; W158-Y286 HydrophobicContact CH2-CG 3.91Å; W158-Y286 AromaticContact CH2-CZ 3.71Å; W158-Y286 HydrophobicContact CZ2-CE1 4.15Å; W158-Y286 HydrophobicContact CZ2-CE2 4.05Å; W158-Y286 AromaticContact CZ2-CZ 3.81Å
159	L	98.9	Very high	96.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	110.4	177	-54.5	-175.1	0	0	0	109.5	L129 F131 L141 L144 V157 F181 I185 V192 T193 S195	L129-L159 HydrophobicContact CB-CD2 4.41Å; L129-L159 HydrophobicContact CD1-CD2 4.31Å; F131-L159 HydrophobicContact CE2-CB 4.23Å; F131-L159 HydrophobicContact CE2-CD2 3.93Å; F131-L159 HydrophobicContact CZ-CD2 4.4Å; L141-L159 HydrophobicContact CD2-CD1 3.57Å; L144-L159 HydrophobicContact CD1-CD2 3.95Å; V157-L159 HydrophobicContact CG1-CD2 3.83Å; L159-F181 HydrophobicContact CB-CZ 4.24Å; L159-I185 HydrophobicContact CB-CD1 4.07Å; L159-I185 HydrophobicContact CD1-CD1 3.7Å; L159-I185 HydrophobicContact CD1-CG1 3.69Å; L159-I185 HydrophobicContact CD1-CG2 4.11Å; L159-V192 HydrophobicContact CD1-CB 4.35Å; L159-V192 HydrophobicContact CD1-CG1 4.08Å; L159-V192 HydrophobicContact CD1-CG2 3.95Å; L159-V192 HydrophobicContact CG-CB 4.26Å; L159-V192 HydrophobicContact CG-CG1 4.18Å; L159-V192 HydrophobicContact CG-CG2 4.23Å; L159-T193 PolarHBondContact N-O 2.91Å; L159-S195 PolarHBondContact O-N 3.34Å
160	N	98.9	Very high	96.7	Very high	4 Å²	4	28.7 Å²	28.7	2%	0.021	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.7	-177.3	-173.2	100.9	0	0	0	110.9	K128 L129 D130 F131 S195 P234	K128-N160 WeakPolarHBondContact CE-OD1 3.27Å; K128-N160 HydrophobicContact CG-CB 4.33Å; L129-N160 WeakPolarHBondContact O-CB 3.3Å; L129-N160 PolarHBondContact O-N 3.49Å; D130-N160 HydrophobicContact CB-CB 4.14Å; D130-N160 PolarHBondContact OD1-ND2 3.42Å; D130-N160 PolarHBondContact OD2-ND2 3Å; F131-N160 WeakPolarHBondContact CD2-O 3.29Å; F131-N160 PolarHBondContact N-O 3.14Å; N160-S195 VanDerWaalsContact CA-O 3.27Å; N160-S195 WeakPolarHBondContact CA-O 3.45Å; N160-S195 VanDerWaalsContact CG-O 3.25Å; N160-S195 WeakPolarHBondContact OD1-CB 3.35Å; N160-S195 PolarHBondContact OD1-O 3.23Å; N160-S195 PolarHBondContact OD1-OG 2.83Å; N160-P234 WeakPolarHBondContact OD1-CG 3.39Å
161	A	98.7	Very high	96.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	146.3	165.9	0	0	0	0	0	109.1	F131 I163 V176 F181 S195 G197	F131-A161 HydrophobicContact CB-CB 4.23Å; A161-I163 HydrophobicContact CB-CG2 3.77Å; A161-I163 PolarHBondContact O-N 2.83Å; A161-I163 VanDerWaalsContact O-N 3.11Å; A161-V176 HydrophobicContact CB-CB 4.42Å; A161-V176 HydrophobicContact CB-CG1 4.41Å; A161-F181 HydrophobicContact CB-CD1 4.44Å; A161-F181 HydrophobicContact CB-CD2 4.07Å; A161-F181 HydrophobicContact CB-CE1 4.11Å; A161-F181 HydrophobicContact CB-CE2 3.72Å; A161-F181 HydrophobicContact CB-CG 4.4Å; A161-F181 HydrophobicContact CB-CZ 3.73Å; A161-S195 PolarHBondContact N-O 2.72Å; A161-G197 PolarHBondContact O-N 2.79Å
162	D	98.4	Very high	96.3	Very high	37 Å²	37	31.4 Å²	31.4	20%	0.198	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	94.9	167.9	-70.8	-23.4	0	0	0	109.7	P175 V176 M199	D162-P175 VanDerWaalsContact O-CB 3.25Å; D162-P175 WeakPolarHBondContact O-CB 3.43Å; D162-V176 PolarHBondContact O-N 3.33Å; D162-M199 HydrophobicContact CB-CB 4.41Å; D162-M199 HydrophobicContact CB-CG 3.57Å
163	I	98.4	Very high	96.2	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.026	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-9.3	-171.1	62.2	162.8	0	0	0	114.4	A161 V176 F181 P196 G197 M220 L223	A161-I163 HydrophobicContact CB-CG2 3.77Å; A161-I163 PolarHBondContact O-N 2.83Å; A161-I163 VanDerWaalsContact O-N 3.11Å; I163-V176 WeakPolarHBondContact CA-O 3.43Å; I163-V176 HydrophobicContact CG2-CB 4.48Å; I163-F181 HydrophobicContact CG2-CB 4.28Å; I163-F181 HydrophobicContact CG2-CD1 3.84Å; I163-F181 HydrophobicContact CG2-CE1 4.41Å; I163-F181 HydrophobicContact CG2-CG 4.14Å; I163-P196 HydrophobicContact CD1-CB 3.47Å; I163-P196 VanDerWaalsContact CD1-CB 3.47Å; I163-P196 HydrophobicContact CG1-CB 3.82Å; I163-G197 PolarHBondContact N-O 3.24Å; I163-M220 HydrophobicContact CD1-SD 4.17Å; I163-M220 HydrophobicContact CG1-CE 4.22Å; I163-M220 HydrophobicContact CG1-SD 4.44Å; I163-L223 HydrophobicContact CD1-CD1 4.24Å
164	L	98.1	Very high	96	Very high	23 Å²	23	36.1 Å²	36.1	12%	0.12	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	155.5	176.4	-74.7	179.8	0	0	0	110.7	G197 W198 M199 Q219 M220 L223	L164-G197 PolarHBondContact N-O 3.47Å; L164-W198 HydrophobicContact CB-CG 4.34Å; L164-W198 CarbonylContact O-C 3.5Å; L164-W198 VanDerWaalsContact O-CA 3.26Å; L164-W198 WeakPolarHBondContact O-CA 3.49Å; L164-M199 PolarHBondContact O-N 2.63Å; L164-Q219 HydrophobicContact CD1-CB 4.02Å; L164-M220 VanDerWaalsContact CD1-CA 3.45Å; L164-M220 HydrophobicContact CD1-CB 3.79Å; L164-M220 HydrophobicContact CD1-CE 4.06Å; L164-M220 HydrophobicContact CD1-SD 4.18Å; L164-L223 HydrophobicContact CD1-CD1 4.02Å; L164-L223 HydrophobicContact CD2-CD1 3.74Å; L164-L223 HydrophobicContact CG-CD1 3.9Å
165	R	97.4	Very high	96.1	Very high	90 Å²	90	35.9 Å²	35.9	34%	0.34	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	128.7	168.8	-175.5	178.3	-66.2	146.4	3.8	108.8	V169 P170 S171 V173	R165-V169 WeakPolarHBondContact CD-O 3.37Å; R165-V169 HydrophobicContact CG-CB 3.78Å; R165-V169 HydrophobicContact CG-CG1 3.92Å; R165-P170 PolarHBondContact NE-O 3.46Å; R165-S171 VanDerWaalsContact NH1-CA 3.3Å; R165-S171 PolarHBondContact NH1-O 3.32Å; R165-S171 PolarHBondContact NH2-O 2.68Å; R165-V173 PolarHBondContact NE-O 3Å; R165-V173 PolarHBondContact NH2-O 2.97Å
166	G	96.3	Very high	96.1	Very high	2 Å²	2	35.6 Å²	35.6	2%	0.021	20%	0.198	C	C	.	.			trans	-109.3	-160.1	177.6	0	0	0	0	0	113.6	N168 M199	G166-N168 PolarHBondContact O-N 3.16Å; G166-M199 CarbonylContact C-O 3.21Å; G166-M199 WeakPolarHBondContact CA-O 3.43Å; G166-M199 PolarHBondContact N-O 3.42Å
167	P	95.2	Very high	96.2	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	135.3	-176	-27.9	37.1	0	0	0	113.2	V169 L201 T211 Y212 M216 L239	P167-V169 PolarHBondContact O-N 2.75Å; P167-L201 PolarHBondContact O-N 3.36Å; P167-L201 VanDerWaalsContact O-N 3.12Å; P167-T211 VanDerWaalsContact CG-C 3.41Å; P167-Y212 HydrophobicContact CG-CD1 3.88Å; P167-Y212 HydrophobicContact CG-CD2 4.27Å; P167-Y212 HydrophobicContact CG-CE1 4.07Å; P167-Y212 HydrophobicContact CG-CE2 4.45Å; P167-Y212 HydrophobicContact CG-CG 3.97Å; P167-M216 HydrophobicContact CG-SD 4.05Å; P167-L239 HydrophobicContact CB-CD1 3.83Å; P167-L239 HydrophobicContact CG-CD1 4.1Å
168	N	94.5	Very high	96.1	Very high	57 Å²	57	39.9 Å²	39.9	31%	0.305	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	4.3	171.4	-38.2	-65.6	0	0	0	115.9	G166 P170 L201 I209 G210	G166-N168 PolarHBondContact O-N 3.16Å; N168-P170 WeakPolarHBondContact O-CD 3.36Å; N168-L201 HydrophobicContact CB-CB 4.2Å; N168-L201 VanDerWaalsContact CB-O 3.3Å; N168-L201 WeakPolarHBondContact CB-O 3.43Å; N168-L201 PolarHBondContact ND2-O 2.98Å; N168-L201 WeakPolarHBondContact O-CD2 3.2Å; N168-I209 HydrophobicContact CB-CG1 4.44Å; N168-I209 VanDerWaalsContact CG-CG1 3.45Å; N168-I209 VanDerWaalsContact ND2-CG1 3.26Å; N168-I209 WeakPolarHBondContact ND2-CG1 3.48Å; N168-G210 PolarHBondContact ND2-O 3.22Å; N168-G210 VanDerWaalsContact OD1-CA 3.28Å; N168-G210 WeakPolarHBondContact OD1-CA 3.25Å; N168-G210 PolarHBondContact OD1-N 3.17Å
169	V	94.3	Very high	96.1	Very high	21 Å²	21	43.3 Å²	43.3	13%	0.127	24%	0.244	C	C	.	.			trans	-76.4	127.3	178.2	175.6	0	0	0	0	109.9	R165 P167 V173 M199 L201	R165-V169 WeakPolarHBondContact CD-O 3.37Å; R165-V169 HydrophobicContact CG-CB 3.78Å; R165-V169 HydrophobicContact CG-CG1 3.92Å; P167-V169 PolarHBondContact O-N 2.75Å; V169-V173 HydrophobicContact CG1-CB 3.74Å; V169-V173 HydrophobicContact CG1-CG1 4.02Å; V169-V173 HydrophobicContact CG1-CG2 4.47Å; V169-M199 HydrophobicContact CG1-CB 4.37Å; V169-M199 HydrophobicContact CG2-CB 3.91Å; V169-M199 WeakPolarHBondContact CG2-O 3.36Å; V169-L201 HydrophobicContact CG2-CB 4.04Å
170	P	92.5	Very high	96.1	Very high	46 Å²	46	50 Å²	50	30%	0.299	27%	0.269	S	S	.	.			trans	-61.6	153.2	179.3	-24.5	34.3	0	0	0	113.8	R165 N168 F172 V173	R165-P170 PolarHBondContact NE-O 3.46Å; N168-P170 WeakPolarHBondContact O-CD 3.36Å; P170-F172 HydrophobicContact CB-CD1 3.67Å; P170-F172 HydrophobicContact CB-CE1 3.2Å; P170-F172 HydrophobicContact CB-CE2 4.13Å; P170-F172 HydrophobicContact CB-CG 4.31Å; P170-F172 HydrophobicContact CB-CZ 3.46Å; P170-F172 VanDerWaalsContact CB-CZ 3.46Å; P170-F172 HydrophobicContact CG-CE1 3.99Å; P170-F172 HydrophobicContact CG-CZ 3.81Å; P170-F172 PolarHBondContact O-N 3.37Å; P170-F172 VanDerWaalsContact O-N 3.11Å; P170-V173 HydrophobicContact CB-CG2 4.43Å; P170-V173 PolarHBondContact O-N 3.21Å; P170-V173 VanDerWaalsContact O-N 3.07Å
171	S	91.4	Very high	96.1	Very high	97 Å²	97	49.9 Å²	49.9	68%	0.678	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-13.8	-173.5	62.3	0	0	0	0	115.6	R165	R165-S171 VanDerWaalsContact NH1-CA 3.3Å; R165-S171 PolarHBondContact NH1-O 3.32Å; R165-S171 PolarHBondContact NH2-O 2.68Å
172	F	91.3	Very high	96.1	Very high	168 Å²	168	50.6 Å²	50.6	74%	0.737	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-11.9	176.3	59.5	-100	0	0	0	113.4	P170	P170-F172 HydrophobicContact CB-CD1 3.67Å; P170-F172 HydrophobicContact CB-CE1 3.2Å; P170-F172 HydrophobicContact CB-CE2 4.13Å; P170-F172 HydrophobicContact CB-CG 4.31Å; P170-F172 HydrophobicContact CB-CZ 3.46Å; P170-F172 VanDerWaalsContact CB-CZ 3.46Å; P170-F172 HydrophobicContact CG-CE1 3.99Å; P170-F172 HydrophobicContact CG-CZ 3.81Å; P170-F172 PolarHBondContact O-N 3.37Å; P170-F172 VanDerWaalsContact O-N 3.11Å
173	V	91.5	Very high	96.1	Very high	52 Å²	52	53.3 Å²	53.3	32%	0.315	28%	0.284	S	S	.	.			trans	-87.5	123	174.1	-176.4	0	0	0	0	108.2	R165 V169 P170 M199	R165-V173 PolarHBondContact NE-O 3Å; R165-V173 PolarHBondContact NH2-O 2.97Å; V169-V173 HydrophobicContact CG1-CB 3.74Å; V169-V173 HydrophobicContact CG1-CG1 4.02Å; V169-V173 HydrophobicContact CG1-CG2 4.47Å; P170-V173 HydrophobicContact CB-CG2 4.43Å; P170-V173 PolarHBondContact O-N 3.21Å; P170-V173 VanDerWaalsContact O-N 3.07Å; V173-M199 HydrophobicContact CG1-CE 4.46Å; V173-M199 HydrophobicContact CG1-SD 3.75Å
174	S	93.3	Very high	96.1	Very high	89 Å²	89	55.5 Å²	55.5	62%	0.622	30%	0.295	S	S	*	.			trans	-104.5	130.2	-175.6	-66.6	0	0	0	0	110.8	M199	S174-M199 WeakPolarHBondContact O-CE 3.3Å
175	P	96.9	Very high	96.1	Very high	40 Å²	40	54.4 Å²	54.4	26%	0.26	29%	0.289	S	S	.	.			trans	-70.2	171.5	171.9	32.3	-36.4	0	0	0	111.5	D162 M199	D162-P175 VanDerWaalsContact O-CB 3.25Å; D162-P175 WeakPolarHBondContact O-CB 3.43Å; P175-M199 HydrophobicContact CB-CG 4.17Å; P175-M199 HydrophobicContact CB-SD 4.12Å
176	V	97.6	Very high	96.2	Very high	13 Å²	13	53.3 Å²	53.3	8%	0.079	29%	0.288	C	S	.	.			trans	-58.4	139.4	166.1	174.9	0	0	0	0	108.7	L134 A161 D162 I163 G178 F181	L134-V176 HydrophobicContact CB-CG1 4.17Å; L134-V176 HydrophobicContact CD1-CG1 4.15Å; A161-V176 HydrophobicContact CB-CB 4.42Å; A161-V176 HydrophobicContact CB-CG1 4.41Å; D162-V176 PolarHBondContact O-N 3.33Å; I163-V176 WeakPolarHBondContact CA-O 3.43Å; I163-V176 HydrophobicContact CG2-CB 4.48Å; V176-G178 PolarHBondContact O-N 2.97Å; V176-F181 HydrophobicContact CG1-CB 4.3Å
177	N	98.3	Very high	96.3	Very high	84 Å²	84	61.5 Å²	61.5	45%	0.449	32%	0.323	S	S	.	.			trans	-65.9	102.5	179.2	-174.7	-53.3	0	0	0	110.7	L134 T179 R180 F181	L134-N177 HydrophobicContact CD2-CB 4.06Å; N177-T179 PolarHBondContact O-N 3.37Å; N177-T179 PolarHBondContact OD1-N 3.26Å; N177-R180 HydrophobicContact CB-CB 4.18Å; N177-R180 HydrophobicContact CB-CG 4.44Å; N177-R180 PolarHBondContact O-N 3.27Å; N177-R180 PolarHBondContact OD1-N 3.25Å; N177-F181 WeakPolarHBondContact O-CB 3.25Å; N177-F181 PolarHBondContact O-N 3.02Å
178	G	97.9	Very high	96.4	Very high	6 Å²	6	62.6 Å²	62.6	6%	0.062	33%	0.33	C	S	.	.	H	α-helix	trans	-58.7	-45.3	-175.3	0	0	0	0	0	114.7	V176 R180 F181 L182	V176-G178 PolarHBondContact O-N 2.97Å; G178-R180 VanDerWaalsContact C-N 3.32Å; G178-R180 PolarHBondContact O-N 3.16Å; G178-F181 WeakPolarHBondContact O-CB 3.38Å; G178-F181 PolarHBondContact O-N 2.97Å; G178-L182 WeakPolarHBondContact O-CG 3.38Å; G178-L182 PolarHBondContact O-N 3.18Å
179	T	98.1	Very high	96.6	Very high	75 Å²	75	60.5 Å²	60.5	46%	0.46	32%	0.318	S	S	.	.	H	α-helix	trans	-59.9	-43.7	178.4	-56.3	0	0	0	0	111.4	N177 Q183	N177-T179 PolarHBondContact O-N 3.37Å; N177-T179 PolarHBondContact OD1-N 3.26Å; T179-Q183 WeakPolarHBondContact O-CB 3.2Å; T179-Q183 WeakPolarHBondContact O-CG 3.35Å; T179-Q183 PolarHBondContact O-N 2.93Å
180	R	98.6	Very high	96.8	Very high	141 Å²	141	62.4 Å²	62.4	53%	0.532	33%	0.331	S	S	.	.	H	α-helix	trans	-70.4	-40.3	177.7	-71.2	-55.9	-132.7	175.4	5.9	112.6	L134 N177 G178 Q183 L184	L134-R180 HydrophobicContact CD1-CB 3.94Å; L134-R180 HydrophobicContact CD2-CB 3.79Å; L134-R180 HydrophobicContact CD2-CG 4.36Å; L134-R180 HydrophobicContact CG-CB 4.5Å; N177-R180 HydrophobicContact CB-CB 4.18Å; N177-R180 HydrophobicContact CB-CG 4.44Å; N177-R180 PolarHBondContact O-N 3.27Å; N177-R180 PolarHBondContact OD1-N 3.25Å; G178-R180 VanDerWaalsContact C-N 3.32Å; G178-R180 PolarHBondContact O-N 3.16Å; R180-Q183 VanDerWaalsContact CD-OE1 3.23Å; R180-Q183 PolarHBondContact O-N 2.96Å; R180-L184 WeakPolarHBondContact O-CG 3.32Å; R180-L184 PolarHBondContact O-N 3.03Å
181	F	98.8	Very high	97	Very high	1 Å²	1	64 Å²	64	0%	0.004	34%	0.337	C	S	.	.	H	α-helix	trans	-55.3	-52.8	175	175.9	-105.6	0	0	0	111.1	F131 L134 V137 L159 A161 I163 V176 N177 G178 Q183 L184 I185	F131-F181 HydrophobicContact CB-CE2 4.36Å; F131-F181 AromaticContact CD2-CE2 3.69Å; F131-F181 HydrophobicContact CD2-CE2 3.69Å; F131-F181 HydrophobicContact CD2-CZ 4.26Å; F131-F181 HydrophobicContact CE2-CE2 4.36Å; F131-F181 HydrophobicContact CG-CE2 4.23Å; L134-F181 HydrophobicContact CD1-CB 4.25Å; V137-F181 HydrophobicContact CG1-CD2 4.07Å; V137-F181 HydrophobicContact CG1-CE2 4.34Å; V137-F181 HydrophobicContact CG2-CD2 3.83Å; V137-F181 HydrophobicContact CG2-CE2 4.16Å; L159-F181 HydrophobicContact CB-CZ 4.24Å; A161-F181 HydrophobicContact CB-CD1 4.44Å; A161-F181 HydrophobicContact CB-CD2 4.07Å; A161-F181 HydrophobicContact CB-CE1 4.11Å; A161-F181 HydrophobicContact CB-CE2 3.72Å; A161-F181 HydrophobicContact CB-CG 4.4Å; A161-F181 HydrophobicContact CB-CZ 3.73Å; I163-F181 HydrophobicContact CG2-CB 4.28Å; I163-F181 HydrophobicContact CG2-CD1 3.84Å; I163-F181 HydrophobicContact CG2-CE1 4.41Å; I163-F181 HydrophobicContact CG2-CG 4.14Å; V176-F181 HydrophobicContact CG1-CB 4.3Å; N177-F181 WeakPolarHBondContact O-CB 3.25Å; N177-F181 PolarHBondContact O-N 3.02Å; G178-F181 WeakPolarHBondContact O-CB 3.38Å; G178-F181 PolarHBondContact O-N 2.97Å; F181-Q183 PolarHBondContact O-N 3.41Å; F181-L184 PolarHBondContact O-N 3Å; F181-I185 HydrophobicContact CD1-CD1 3.91Å; F181-I185 HydrophobicContact CD2-CD1 4.3Å; F181-I185 HydrophobicContact CE1-CD1 3.46Å; F181-I185 VanDerWaalsContact CE1-CD1 3.46Å; F181-I185 HydrophobicContact CE2-CD1 3.89Å; F181-I185 HydrophobicContact CG-CD1 4.32Å; F181-I185 HydrophobicContact CZ-CD1 3.46Å; F181-I185 VanDerWaalsContact CZ-CD1 3.46Å; F181-I185 WeakPolarHBondContact O-CG1 3.47Å; F181-I185 PolarHBondContact O-N 2.82Å
182	L	98.7	Very high	97.4	Very high	14 Å²	14	59.5 Å²	59.5	7%	0.073	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-44.6	178	-64.8	175.4	0	0	0	111.9	G178 L184 I185 Q186 L194 L223 V227	G178-L182 WeakPolarHBondContact O-CG 3.38Å; G178-L182 PolarHBondContact O-N 3.18Å; L182-L184 VanDerWaalsContact C-N 3.32Å; L182-L184 PolarHBondContact O-N 3.01Å; L182-I185 PolarHBondContact O-N 2.75Å; L182-Q186 WeakPolarHBondContact O-CG 3.3Å; L182-Q186 PolarHBondContact O-N 2.89Å; L182-L194 HydrophobicContact CD2-CD1 3.79Å; L182-L194 HydrophobicContact CD2-CD2 4.24Å; L182-L223 HydrophobicContact CD1-CB 4.48Å; L182-L223 WeakPolarHBondContact CD1-O 3.45Å; L182-V227 HydrophobicContact CD1-CG1 4.33Å; L182-V227 HydrophobicContact CD2-CG1 4.5Å
183	Q	98.5	Very high	97.7	Very high	94 Å²	94	51.6 Å²	51.6	44%	0.439	27%	0.271	S	S	.	.	H	α-helix	trans	-57.3	-42.3	177.2	-79	173.6	-1.6	0	0	112.9	T179 R180 F181 K187	T179-Q183 WeakPolarHBondContact O-CB 3.2Å; T179-Q183 WeakPolarHBondContact O-CG 3.35Å; T179-Q183 PolarHBondContact O-N 2.93Å; R180-Q183 VanDerWaalsContact CD-OE1 3.23Å; R180-Q183 PolarHBondContact O-N 2.96Å; F181-Q183 PolarHBondContact O-N 3.41Å; Q183-K187 VanDerWaalsContact O-CB 3.28Å; Q183-K187 WeakPolarHBondContact O-CB 3.5Å; Q183-K187 PolarHBondContact O-N 3.03Å; Q183-K187 VanDerWaalsContact O-N 3.08Å
184	L	98.8	Very high	98.1	Very high	51 Å²	51	49.2 Å²	49.2	27%	0.267	26%	0.256	S	S	.	.	H	α-helix	trans	-64.2	-44.4	178.2	-73	170.5	0	0	0	111.2	L134 V137 L141 R180 F181 L182 K187 T188	L134-L184 HydrophobicContact CD1-CD1 4.08Å; V137-L184 HydrophobicContact CB-CD1 4.02Å; V137-L184 HydrophobicContact CG1-CB 4.05Å; V137-L184 HydrophobicContact CG1-CD1 3.88Å; L141-L184 HydrophobicContact CD1-CB 3.86Å; R180-L184 WeakPolarHBondContact O-CG 3.32Å; R180-L184 PolarHBondContact O-N 3.03Å; F181-L184 PolarHBondContact O-N 3Å; L182-L184 VanDerWaalsContact C-N 3.32Å; L182-L184 PolarHBondContact O-N 3.01Å; L184-K187 PolarHBondContact O-N 3.49Å; L184-T188 WeakPolarHBondContact O-CB 3.34Å; L184-T188 PolarHBondContact O-N 2.96Å; L184-T188 PolarHBondContact O-OG1 2.86Å
185	I	98.8	Very high	98.3	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-50.5	177.9	-65.5	169.6	0	0	0	110.7	L141 L159 F181 L182 K187 T188 F189 P190 V192 L194	L141-I185 HydrophobicContact CD1-CG1 4.19Å; L141-I185 HydrophobicContact CD2-CG1 4.22Å; L159-I185 HydrophobicContact CB-CD1 4.07Å; L159-I185 HydrophobicContact CD1-CD1 3.7Å; L159-I185 HydrophobicContact CD1-CG1 3.69Å; L159-I185 HydrophobicContact CD1-CG2 4.11Å; F181-I185 HydrophobicContact CD1-CD1 3.91Å; F181-I185 HydrophobicContact CD2-CD1 4.3Å; F181-I185 HydrophobicContact CE1-CD1 3.46Å; F181-I185 VanDerWaalsContact CE1-CD1 3.46Å; F181-I185 HydrophobicContact CE2-CD1 3.89Å; F181-I185 HydrophobicContact CG-CD1 4.32Å; F181-I185 HydrophobicContact CZ-CD1 3.46Å; F181-I185 VanDerWaalsContact CZ-CD1 3.46Å; F181-I185 WeakPolarHBondContact O-CG1 3.47Å; F181-I185 PolarHBondContact O-N 2.82Å; L182-I185 PolarHBondContact O-N 2.75Å; I185-K187 PolarHBondContact O-N 2.74Å; I185-T188 PolarHBondContact O-N 2.98Å; I185-F189 CarbonylContact O-C 3.58Å; I185-F189 PolarHBondContact O-N 3.26Å; I185-P190 WeakPolarHBondContact O-CA 3.36Å; I185-V192 HydrophobicContact CG2-CG2 3.72Å; I185-L194 HydrophobicContact CD1-CD2 3.6Å; I185-L194 HydrophobicContact CG2-CD2 4.05Å
186	Q	98.3	Very high	98.4	Very high	67 Å²	67	43 Å²	43	31%	0.313	21%	0.214	S	C	.	.	H	α-helix	trans	-59.1	-36.4	179.9	-62.2	-52.9	-14.8	0	0	112.4	L182 Q229	L182-Q186 WeakPolarHBondContact O-CG 3.3Å; L182-Q186 PolarHBondContact O-N 2.89Å; Q186-Q229 VanDerWaalsContact CD-NE2 3.31Å; Q186-Q229 VanDerWaalsContact NE2-CD 3.35Å
187	K	98.3	Very high	98.4	Very high	175 Å²	175	42.4 Å²	42.4	76%	0.761	21%	0.211	S	C	*	.	H	α-helix	trans	-75.9	-40	-177.9	-176.5	-178.9	175.9	-173.3	0	112.9	Q183 L184 I185	Q183-K187 VanDerWaalsContact O-CB 3.28Å; Q183-K187 WeakPolarHBondContact O-CB 3.5Å; Q183-K187 PolarHBondContact O-N 3.03Å; Q183-K187 VanDerWaalsContact O-N 3.08Å; L184-K187 PolarHBondContact O-N 3.49Å; I185-K187 PolarHBondContact O-N 2.74Å
188	T	98.4	Very high	98.4	Very high	24 Å²	24	38.4 Å²	38.4	15%	0.147	19%	0.189	C	C	.	.	H	α-helix	trans	-108.3	-42	-163.9	-55.6	0	0	0	0	113.3	L141 D142 K145 L184 I185	L141-T188 HydrophobicContact CB-CG2 3.62Å; D142-T188 WeakPolarHBondContact OD1-CG2 3.21Å; K145-T188 HydrophobicContact CD-CG2 4.44Å; L184-T188 WeakPolarHBondContact O-CB 3.34Å; L184-T188 PolarHBondContact O-N 2.96Å; L184-T188 PolarHBondContact O-OG1 2.86Å; I185-T188 PolarHBondContact O-N 2.98Å
189	F	98.4	Very high	98.3	Very high	12 Å²	12	40.3 Å²	40.3	5%	0.053	20%	0.197	C	C	.	.			trans	-151	70.6	-174.8	-158.2	-101.6	0	0	0	111.2	T36 L141 L144 K145 N148 I153 I185 V192	T36-F189 HydrophobicContact CG2-CE1 4.27Å; T36-F189 HydrophobicContact CG2-CZ 4.03Å; L141-F189 HydrophobicContact CB-CB 4.4Å; L141-F189 HydrophobicContact CD2-CB 3.91Å; L144-F189 HydrophobicContact CB-CD1 4.18Å; L144-F189 HydrophobicContact CB-CD2 4.28Å; L144-F189 HydrophobicContact CB-CE1 4.17Å; L144-F189 HydrophobicContact CB-CE2 4.26Å; L144-F189 HydrophobicContact CB-CG 4.24Å; L144-F189 HydrophobicContact CB-CZ 4.21Å; L144-F189 HydrophobicContact CD1-CD1 4.29Å; K145-F189 HydrophobicContact CB-CD2 3.97Å; K145-F189 HydrophobicContact CB-CE2 4.48Å; N148-F189 HydrophobicContact CB-CE2 3.8Å; N148-F189 HydrophobicContact CB-CZ 4.06Å; I153-F189 HydrophobicContact CD1-CZ 4.3Å; I185-F189 CarbonylContact O-C 3.58Å; I185-F189 PolarHBondContact O-N 3.26Å; F189-V192 HydrophobicContact CD1-CG1 3.5Å; F189-V192 HydrophobicContact CE1-CG1 3.76Å
190	P	98	Very high	98.2	Very high	62 Å²	62	38.1 Å²	38.1	40%	0.403	18%	0.184	S	C	.	.			trans	-77.5	-21.5	-167.8	28.9	-36.2	0	0	0	115.1	I185 V192 Q229	I185-P190 WeakPolarHBondContact O-CA 3.36Å; P190-V192 VanDerWaalsContact C-N 3.32Å; P190-V192 PolarHBondContact O-N 3.46Å; P190-Q229 WeakPolarHBondContact O-CG 3.41Å; P190-Q229 PolarHBondContact O-NE2 2.7Å
191	D	97.8	Very high	97.9	Very high	78 Å²	78	34.6 Å²	34.6	42%	0.417	18%	0.175	S	C	.	.	S	Bend	trans	-80.8	77	-178	-173	40.1	0	0	0	110.6	T36 G37	T36-D191 CarbonylContact C-O 3.54Å; T36-D191 WeakPolarHBondContact CB-O 3.32Å; T36-D191 PolarHBondContact N-OD2 3Å; T36-D191 PolarHBondContact OG1-O 3.48Å; T36-D191 PolarHBondContact OG1-OD2 3.41Å; G37-D191 VanDerWaalsContact CA-OD1 3.25Å; G37-D191 WeakPolarHBondContact CA-OD1 3.44Å; G37-D191 VanDerWaalsContact N-CG 3.31Å; G37-D191 PolarHBondContact N-O 2.92Å; G37-D191 PolarHBondContact N-OD1 3.26Å; G37-D191 PolarHBondContact N-OD2 3.45Å
192	V	98.6	Very high	97.5	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.018	19%	0.186	C	C	.	.	S	Bend	trans	-146.7	168.9	-176.9	-66.3	0	0	0	0	110.7	V157 L159 I185 F189 P190 L194 Q229	V157-V192 HydrophobicContact CB-CG1 4.26Å; V157-V192 HydrophobicContact CG1-CG1 4.29Å; V157-V192 WeakPolarHBondContact O-CB 3.22Å; L159-V192 HydrophobicContact CD1-CB 4.35Å; L159-V192 HydrophobicContact CD1-CG1 4.08Å; L159-V192 HydrophobicContact CD1-CG2 3.95Å; L159-V192 HydrophobicContact CG-CB 4.26Å; L159-V192 HydrophobicContact CG-CG1 4.18Å; L159-V192 HydrophobicContact CG-CG2 4.23Å; I185-V192 HydrophobicContact CG2-CG2 3.72Å; F189-V192 HydrophobicContact CD1-CG1 3.5Å; F189-V192 HydrophobicContact CE1-CG1 3.76Å; P190-V192 VanDerWaalsContact C-N 3.32Å; P190-V192 PolarHBondContact O-N 3.46Å; V192-L194 HydrophobicContact CG2-CD2 4.29Å; V192-Q229 HydrophobicContact CG2-CG 4.3Å; V192-Q229 WeakPolarHBondContact O-CB 3.19Å; V192-Q229 WeakPolarHBondContact O-CG 3.49Å
193	T	98.8	Very high	96.9	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.018	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.6	160.3	-62.6	0	0	0	0	109.4	V157 W158 L159 K230 T232	V157-T193 PolarHBondContact O-N 3.04Å; W158-T193 WeakPolarHBondContact CA-O 3.47Å; W158-T193 VanDerWaalsContact CD1-CB 3.44Å; W158-T193 HydrophobicContact CD2-CG2 4.14Å; W158-T193 HydrophobicContact CG-CG2 4.2Å; W158-T193 HydrophobicContact CZ2-CG2 4.41Å; L159-T193 PolarHBondContact N-O 2.91Å; T193-K230 HydrophobicContact CG2-CB 4.12Å; T193-T232 HydrophobicContact CG2-CG2 4.25Å
194	L	98.9	Very high	96.1	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	136.1	174.5	-63.5	174.5	0	0	0	109.9	L182 I185 V192 P196 V227 Q229 K230 V231 T232	L182-L194 HydrophobicContact CD2-CD1 3.79Å; L182-L194 HydrophobicContact CD2-CD2 4.24Å; I185-L194 HydrophobicContact CD1-CD2 3.6Å; I185-L194 HydrophobicContact CG2-CD2 4.05Å; V192-L194 HydrophobicContact CG2-CD2 4.29Å; L194-P196 WeakPolarHBondContact O-CD 3.34Å; L194-V227 HydrophobicContact CD1-CB 4.02Å; L194-V227 HydrophobicContact CD1-CG1 4.31Å; L194-V227 HydrophobicContact CD1-CG2 3.56Å; L194-Q229 HydrophobicContact CD1-CB 3.94Å; L194-Q229 HydrophobicContact CD1-CG 4.2Å; L194-Q229 HydrophobicContact CG-CB 3.84Å; L194-Q229 HydrophobicContact CG-CG 4.03Å; L194-K230 PolarHBondContact N-O 2.76Å; L194-V231 HydrophobicContact CB-CG1 4.46Å; L194-V231 HydrophobicContact CB-CG2 4.38Å; L194-V231 CarbonylContact O-C 3.53Å; L194-V231 VanDerWaalsContact O-CA 3.31Å; L194-V231 WeakPolarHBondContact O-CA 3.44Å; L194-T232 PolarHBondContact O-N 3.36Å
195	S	98.8	Very high	95.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	59	176.4	-175.3	0	0	0	0	111.7	L159 N160 A161 G197 T232 P234	L159-S195 PolarHBondContact O-N 3.34Å; N160-S195 VanDerWaalsContact CA-O 3.27Å; N160-S195 WeakPolarHBondContact CA-O 3.45Å; N160-S195 VanDerWaalsContact CG-O 3.25Å; N160-S195 WeakPolarHBondContact OD1-CB 3.35Å; N160-S195 PolarHBondContact OD1-O 3.23Å; N160-S195 PolarHBondContact OD1-OG 2.83Å; A161-S195 PolarHBondContact N-O 2.72Å; S195-G197 PolarHBondContact O-N 2.93Å; S195-T232 VanDerWaalsContact CA-O 3.24Å; S195-T232 WeakPolarHBondContact CA-O 3.32Å; S195-P234 VanDerWaalsContact OG-CG 3.3Å; S195-P234 WeakPolarHBondContact OG-CG 3.07Å
196	P	98.6	Very high	94.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	121.9	-174.7	31	-33.4	0	0	0	111.2	I163 L194 M220 I224 V231 T232 F233 P234	I163-P196 HydrophobicContact CD1-CB 3.47Å; I163-P196 VanDerWaalsContact CD1-CB 3.47Å; I163-P196 HydrophobicContact CG1-CB 3.82Å; L194-P196 WeakPolarHBondContact O-CD 3.34Å; P196-M220 HydrophobicContact CB-CE 4.12Å; P196-M220 HydrophobicContact CB-SD 3.86Å; P196-M220 HydrophobicContact CG-SD 3.98Å; P196-M220 WeakPolarHBondContact O-CE 3.26Å; P196-I224 HydrophobicContact CG-CG2 3.99Å; P196-V231 HydrophobicContact CG-CG1 3.65Å; P196-T232 WeakPolarHBondContact CD-O 3.33Å; P196-F233 HydrophobicContact CG-CD1 4.16Å; P196-F233 HydrophobicContact CG-CE1 4.1Å; P196-P234 VanDerWaalsContact O-CD 3.23Å; P196-P234 WeakPolarHBondContact O-CD 3.45Å
197	G	98	Very high	92.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	174.5	-179.8	0	0	0	0	0	113.7	A161 I163 L164 S195 M220	A161-G197 PolarHBondContact O-N 2.79Å; I163-G197 PolarHBondContact N-O 3.24Å; L164-G197 PolarHBondContact N-O 3.47Å; S195-G197 PolarHBondContact O-N 2.93Å; G197-M220 WeakPolarHBondContact O-CE 3.25Å
198	W	98.2	Very high	91.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.7	164.1	-60.2	-102	0	0	0	108.6	L164 V200 Y212 M216 V217 M220 F233 V235 I247 L250	L164-W198 HydrophobicContact CB-CG 4.34Å; L164-W198 CarbonylContact O-C 3.5Å; L164-W198 VanDerWaalsContact O-CA 3.26Å; L164-W198 WeakPolarHBondContact O-CA 3.49Å; W198-V200 WeakPolarHBondContact O-CG2 3.27Å; W198-V200 PolarHBondContact O-N 2.88Å; W198-Y212 HydrophobicContact CB-CE1 4.33Å; W198-Y212 HydrophobicContact CD2-CD1 4.22Å; W198-Y212 AromaticContact CD2-CE1 3.89Å; W198-Y212 HydrophobicContact CD2-CE1 3.89Å; W198-Y212 HydrophobicContact CE3-CD1 4.29Å; W198-Y212 AromaticContact CE3-CE1 3.7Å; W198-Y212 HydrophobicContact CE3-CE1 3.7Å; W198-Y212 HydrophobicContact CG-CE1 4.19Å; W198-Y212 HydrophobicContact CZ3-CE1 4.3Å; W198-M216 PolarHBondContact NE1-O 3.31Å; W198-V217 HydrophobicContact CZ2-CG2 4.31Å; W198-M220 HydrophobicContact CD2-CE 3.8Å; W198-M220 HydrophobicContact CE3-CE 4.05Å; W198-M220 HydrophobicContact CG-CE 4.38Å; W198-M220 HydrophobicContact CH2-CB 4.13Å; W198-M220 HydrophobicContact CH2-CE 4.06Å; W198-M220 HydrophobicContact CH2-CG 3.92Å; W198-M220 HydrophobicContact CZ2-CB 3.35Å; W198-M220 HydrophobicContact CZ2-CE 3.82Å; W198-M220 HydrophobicContact CZ2-CG 3.63Å; W198-M220 HydrophobicContact CZ3-CE 4.17Å; W198-F233 HydrophobicContact CH2-CB 4.41Å; W198-F233 HydrophobicContact CH2-CD1 4.37Å; W198-F233 HydrophobicContact CZ3-CB 4.16Å; W198-V235 HydrophobicContact CE3-CG1 4.47Å; W198-V235 HydrophobicContact CZ3-CG1 3.84Å; W198-I247 HydrophobicContact CH2-CD1 4.49Å; W198-L250 HydrophobicContact CH2-CD2 4Å
199	M	95.9	Very high	90.6	Very high	46 Å²	46	45.9 Å²	45.9	23%	0.227	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	129.1	162.8	-70.9	-170.2	150.9	0	0	108.6	D162 L164 G166 V169 V173 S174 P175	D162-M199 HydrophobicContact CB-CB 4.41Å; D162-M199 HydrophobicContact CB-CG 3.57Å; L164-M199 PolarHBondContact O-N 2.63Å; G166-M199 CarbonylContact C-O 3.21Å; G166-M199 WeakPolarHBondContact CA-O 3.43Å; G166-M199 PolarHBondContact N-O 3.42Å; V169-M199 HydrophobicContact CG1-CB 4.37Å; V169-M199 HydrophobicContact CG2-CB 3.91Å; V169-M199 WeakPolarHBondContact CG2-O 3.36Å; V173-M199 HydrophobicContact CG1-CE 4.46Å; V173-M199 HydrophobicContact CG1-SD 3.75Å; S174-M199 WeakPolarHBondContact O-CE 3.3Å; P175-M199 HydrophobicContact CB-CG 4.17Å; P175-M199 HydrophobicContact CB-SD 4.12Å
200	V	94.4	Very high	90	Very high	29 Å²	29	46.8 Å²	46.8	18%	0.176	28%	0.275	C	S	.	.			trans	-121.3	133.8	178.9	-179.8	0	0	0	0	109.4	W198 Y212 H236 L239 W262	W198-V200 WeakPolarHBondContact O-CG2 3.27Å; W198-V200 PolarHBondContact O-N 2.88Å; V200-Y212 WeakPolarHBondContact CG2-OH 3.19Å; V200-H236 HydrophobicContact CG1-CB 4.07Å; V200-H236 HydrophobicContact CG2-CB 4.31Å; V200-L239 HydrophobicContact CG1-CD1 3.53Å; V200-W262 HydrophobicContact CB-CH2 4.36Å; V200-W262 HydrophobicContact CB-CZ2 4.04Å; V200-W262 HydrophobicContact CG2-CZ2 4Å
201	L	92.8	Very high	89.8	Confident	67 Å²	67	45.4 Å²	45.4	35%	0.351	27%	0.266	S	S	.	.			trans	-108.4	116.8	162.4	-178.8	59.2	0	0	0	108.2	P167 N168 V169 I203	P167-L201 PolarHBondContact O-N 3.36Å; P167-L201 VanDerWaalsContact O-N 3.12Å; N168-L201 HydrophobicContact CB-CB 4.2Å; N168-L201 VanDerWaalsContact CB-O 3.3Å; N168-L201 WeakPolarHBondContact CB-O 3.43Å; N168-L201 PolarHBondContact ND2-O 2.98Å; N168-L201 WeakPolarHBondContact O-CD2 3.2Å; V169-L201 HydrophobicContact CG2-CB 4.04Å; L201-I203 HydrophobicContact CD1-CG1 4.17Å; L201-I203 HydrophobicContact CD2-CD1 4.13Å; L201-I203 HydrophobicContact CD2-CG1 4.46Å; L201-I203 HydrophobicContact CG-CD1 4.26Å; L201-I203 HydrophobicContact CG-CG1 4.04Å
202	Y	89.8	Confident	89.7	Confident	63 Å²	63	41.8 Å²	41.8	25%	0.247	25%	0.246	C	C	.	.			trans	-110.9	126.7	170	-177.4	-104.1	0	0	0	108.4	P204 I209 L238 L239 D266	Y202-P204 HydrophobicContact CD1-CG 4.23Å; Y202-P204 HydrophobicContact CE1-CB 4.35Å; Y202-P204 HydrophobicContact CE1-CG 3.84Å; Y202-I209 HydrophobicContact CD2-CD1 3.9Å; Y202-I209 HydrophobicContact CE2-CD1 4.35Å; Y202-I209 HydrophobicContact CE2-CG2 4.44Å; Y202-L238 HydrophobicContact CD1-CD1 4.09Å; Y202-L238 HydrophobicContact CD2-CB 4.48Å; Y202-L238 HydrophobicContact CE1-CD1 3.49Å; Y202-L238 VanDerWaalsContact CE1-CD1 3.49Å; Y202-L238 HydrophobicContact CE2-CB 4.07Å; Y202-L238 HydrophobicContact CE2-CD1 4.32Å; Y202-L239 HydrophobicContact CD2-CD2 3.9Å; Y202-L239 HydrophobicContact CD2-CG 4.34Å; Y202-L239 HydrophobicContact CE2-CD2 4.21Å; Y202-D266 HydrophobicContact CE1-CB 4.15Å
203	I	86.1	Confident	89.4	Confident	72 Å²	72	43.7 Å²	43.7	37%	0.369	26%	0.259	S	S	.	.			trans	-121.9	111.7	174.9	-52.7	175.5	0	0	0	106.7	L201 I206 I209	L201-I203 HydrophobicContact CD1-CG1 4.17Å; L201-I203 HydrophobicContact CD2-CD1 4.13Å; L201-I203 HydrophobicContact CD2-CG1 4.46Å; L201-I203 HydrophobicContact CG-CD1 4.26Å; L201-I203 HydrophobicContact CG-CG1 4.04Å; I203-I206 HydrophobicContact CB-CD1 3.76Å; I203-I206 HydrophobicContact CB-CG1 4.17Å; I203-I206 HydrophobicContact CD1-CD1 3.94Å; I203-I206 HydrophobicContact CG1-CD1 4.45Å; I203-I206 HydrophobicContact CG2-CD1 3.49Å; I203-I206 VanDerWaalsContact CG2-CD1 3.49Å; I203-I206 HydrophobicContact CG2-CG1 3.81Å; I203-I209 HydrophobicContact CB-CD1 4.32Å; I203-I209 WeakPolarHBondContact O-CD1 3.47Å
204	P	82.4	Confident	89.2	Confident	42 Å²	42	49.8 Å²	49.8	27%	0.273	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	148.9	177.6	-27.4	35.1	0	0	0	112.1	Y202 I206 D266	Y202-P204 HydrophobicContact CD1-CG 4.23Å; Y202-P204 HydrophobicContact CE1-CB 4.35Å; Y202-P204 HydrophobicContact CE1-CG 3.84Å; P204-I206 PolarHBondContact O-N 2.92Å; P204-D266 WeakPolarHBondContact CG-OD2 3.38Å
205	H	77	Confident	89	Confident	185 Å²	185	54.6 Å²	54.6	86%	0.856	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	9.1	170.7	-45.9	-62.4	0	0	0	116.8	P207	H205-P207 VanDerWaalsContact O-CD 3.31Å; H205-P207 WeakPolarHBondContact O-CD 3.32Å
206	I	79.1	Confident	89	Confident	85 Å²	85	56.6 Å²	56.6	44%	0.436	32%	0.318	S	S	.	.			trans	-83.3	114.3	167.8	-64.3	-169	0	0	0	109.4	I203 P204 I209	I203-I206 HydrophobicContact CB-CD1 3.76Å; I203-I206 HydrophobicContact CB-CG1 4.17Å; I203-I206 HydrophobicContact CD1-CD1 3.94Å; I203-I206 HydrophobicContact CG1-CD1 4.45Å; I203-I206 HydrophobicContact CG2-CD1 3.49Å; I203-I206 VanDerWaalsContact CG2-CD1 3.49Å; I203-I206 HydrophobicContact CG2-CG1 3.81Å; P204-I206 PolarHBondContact O-N 2.92Å; I206-I209 PolarHBondContact O-N 3.02Å
207	P	70.2	Confident	89	Confident	122 Å²	122	56.6 Å²	56.6	79%	0.792	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	139.7	174.1	-18.8	32.4	0	0	0	110.6	H205 I209	H205-P207 VanDerWaalsContact O-CD 3.31Å; H205-P207 WeakPolarHBondContact O-CD 3.32Å; P207-I209 VanDerWaalsContact C-N 3.29Å; P207-I209 PolarHBondContact O-N 2.73Å
208	G	69	Low	89	Confident	75 Å²	75	58.9 Å²	58.9	77%	0.773	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	15.8	177.2	0	0	0	0	0	114.9	G210	G208-G210 PolarHBondContact O-N 3.16Å
209	I	81.4	Confident	89	Confident	19 Å²	19	64 Å²	64	10%	0.097	35%	0.352	C	S	.	.			trans	-54.7	124.9	171.8	-168	167.5	0	0	0	109.9	N168 Y202 I203 I206 P207 R242	N168-I209 HydrophobicContact CB-CG1 4.44Å; N168-I209 VanDerWaalsContact CG-CG1 3.45Å; N168-I209 VanDerWaalsContact ND2-CG1 3.26Å; N168-I209 WeakPolarHBondContact ND2-CG1 3.48Å; Y202-I209 HydrophobicContact CD2-CD1 3.9Å; Y202-I209 HydrophobicContact CE2-CD1 4.35Å; Y202-I209 HydrophobicContact CE2-CG2 4.44Å; I203-I209 HydrophobicContact CB-CD1 4.32Å; I203-I209 WeakPolarHBondContact O-CD1 3.47Å; I206-I209 PolarHBondContact O-N 3.02Å; P207-I209 VanDerWaalsContact C-N 3.29Å; P207-I209 PolarHBondContact O-N 2.73Å; I209-R242 VanDerWaalsContact CG2-NH2 3.31Å; I209-R242 VanDerWaalsContact O-CZ 3.23Å; I209-R242 PolarHBondContact O-NH1 2.89Å; I209-R242 PolarHBondContact O-NH2 3.33Å
210	G	86.2	Confident	89.1	Confident	31 Å²	31	61.8 Å²	61.8	32%	0.32	34%	0.341	S	S	.	.			trans	-65.6	161.4	-175.2	0	0	0	0	0	112.7	N168 G208	N168-G210 PolarHBondContact ND2-O 3.22Å; N168-G210 VanDerWaalsContact OD1-CA 3.28Å; N168-G210 WeakPolarHBondContact OD1-CA 3.25Å; N168-G210 PolarHBondContact OD1-N 3.17Å; G208-G210 PolarHBondContact O-N 3.16Å
211	T	93.1	Very high	89.3	Confident	33 Å²	33	62.9 Å²	62.9	20%	0.202	34%	0.343	C	S	.	.			trans	-124.3	-177.5	175.2	-169.9	0	0	0	0	110.3	P167 S213 L239 R242 G243	P167-T211 VanDerWaalsContact CG-C 3.41Å; T211-S213 PolarHBondContact O-N 3.29Å; T211-L239 PolarHBondContact OG1-O 3.25Å; T211-R242 HydrophobicContact CG2-CB 3.78Å; T211-G243 PolarHBondContact OG1-N 3.07Å
212	Y	95.5	Very high	89.6	Confident	1 Å²	1	65 Å²	65	0%	0.004	35%	0.35	C	S	.	.			trans	-56.2	118.6	174.7	-61.4	-83.8	0	0	0	110.1	P167 W198 V200 V235 H236 L239 H246 I247	P167-Y212 HydrophobicContact CG-CD1 3.88Å; P167-Y212 HydrophobicContact CG-CD2 4.27Å; P167-Y212 HydrophobicContact CG-CE1 4.07Å; P167-Y212 HydrophobicContact CG-CE2 4.45Å; P167-Y212 HydrophobicContact CG-CG 3.97Å; W198-Y212 HydrophobicContact CB-CE1 4.33Å; W198-Y212 HydrophobicContact CD2-CD1 4.22Å; W198-Y212 AromaticContact CD2-CE1 3.89Å; W198-Y212 HydrophobicContact CD2-CE1 3.89Å; W198-Y212 HydrophobicContact CE3-CD1 4.29Å; W198-Y212 AromaticContact CE3-CE1 3.7Å; W198-Y212 HydrophobicContact CE3-CE1 3.7Å; W198-Y212 HydrophobicContact CG-CE1 4.19Å; W198-Y212 HydrophobicContact CZ3-CE1 4.3Å; V200-Y212 WeakPolarHBondContact CG2-OH 3.19Å; Y212-V235 HydrophobicContact CE1-CG1 4.44Å; Y212-V235 HydrophobicContact CE2-CB 4.07Å; Y212-V235 HydrophobicContact CE2-CG1 4.4Å; Y212-V235 WeakPolarHBondContact OH-CA 3.24Å; Y212-H236 PolarHBondContact OH-N 3.36Å; Y212-L239 HydrophobicContact CD2-CB 4.21Å; Y212-L239 HydrophobicContact CE2-CB 3.85Å; Y212-H246 PolarHBondContact O-CD2 3.4Å; Y212-I247 HydrophobicContact CD1-CD1 4.4Å; Y212-I247 HydrophobicContact CD2-CD1 4.48Å; Y212-I247 HydrophobicContact CG-CD1 4.11Å
213	S	94	Very high	90	Very high	43 Å²	43	64.4 Å²	64.4	30%	0.301	35%	0.352	S	S	.	.			trans	-90.9	165.4	175.1	71	0	0	0	0	111.5	T211 D215 M216 V217	T211-S213 PolarHBondContact O-N 3.29Å; S213-D215 VanDerWaalsContact C-N 3.34Å; S213-D215 PolarHBondContact O-N 3.12Å; S213-M216 PolarHBondContact O-N 2.94Å; S213-M216 WeakPolarHBondContact OG-CG 3.29Å; S213-M216 PolarHBondContact OG-N 2.83Å; S213-V217 WeakPolarHBondContact O-CG2 3.44Å; S213-V217 PolarHBondContact O-N 3.29Å
214	R	93.2	Very high	90.5	Very high	131 Å²	131	61 Å²	61	49%	0.494	33%	0.334	S	S	.	.	H	α-helix	trans	-50.5	-52.4	171.5	-174	174.1	178.1	171.1	-2.5	112.1	M216 V217 E218 H246	R214-M216 VanDerWaalsContact C-N 3.3Å; R214-M216 PolarHBondContact O-N 3.19Å; R214-V217 PolarHBondContact O-N 2.97Å; R214-E218 HydrophobicContact CG-CG 4.19Å; R214-E218 IonicContact CZ-OE1 3.32Å; R214-E218 IonicContact NE-OE1 3.99Å; R214-E218 PolarHBondContact NE-OE1 3.31Å; R214-E218 IonicContact NH2-OE1 3.75Å; R214-E218 PolarHBondContact NH2-OE1 3.46Å; R214-E218 VanDerWaalsContact NH2-OE1 3.13Å; R214-E218 PolarHBondContact O-N 3.36Å; R214-H246 PolarHBondContact N-CD2 2.67Å
215	D	96.3	Very high	91.2	Very high	103 Å²	103	62.9 Å²	62.9	55%	0.551	34%	0.338	S	S	*	.	H	α-helix	trans	-59	-40.2	-178.1	-63.3	-10.6	0	0	0	112.6	S213 V217 Q219	S213-D215 VanDerWaalsContact C-N 3.34Å; S213-D215 PolarHBondContact O-N 3.12Å; D215-V217 VanDerWaalsContact C-N 3.28Å; D215-V217 PolarHBondContact O-N 2.82Å; D215-Q219 WeakPolarHBondContact O-CB 3.28Å; D215-Q219 WeakPolarHBondContact O-CG 3.35Å; D215-Q219 PolarHBondContact O-N 3Å; D215-Q219 PolarHBondContact O-NE2 3.29Å
216	M	97.5	Very high	92.1	Very high	42 Å²	42	60.3 Å²	60.3	21%	0.207	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-39	177.7	-71.6	173.3	-178.2	0	0	111.4	P167 W198 S213 R214 M220	P167-M216 HydrophobicContact CG-SD 4.05Å; W198-M216 PolarHBondContact NE1-O 3.31Å; S213-M216 PolarHBondContact O-N 2.94Å; S213-M216 WeakPolarHBondContact OG-CG 3.29Å; S213-M216 PolarHBondContact OG-N 2.83Å; R214-M216 VanDerWaalsContact C-N 3.3Å; R214-M216 PolarHBondContact O-N 3.19Å; M216-M220 PolarHBondContact O-N 3.47Å
217	V	98.1	Very high	93	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-79.1	-40.9	-176.6	173.9	0	0	0	0	112	W198 S213 R214 D215 Q219 M220 Y221 H246 I247 W249 L250	W198-V217 HydrophobicContact CZ2-CG2 4.31Å; S213-V217 WeakPolarHBondContact O-CG2 3.44Å; S213-V217 PolarHBondContact O-N 3.29Å; R214-V217 PolarHBondContact O-N 2.97Å; D215-V217 VanDerWaalsContact C-N 3.28Å; D215-V217 PolarHBondContact O-N 2.82Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 2.84Å; V217-M220 WeakPolarHBondContact O-CB 3.39Å; V217-M220 PolarHBondContact O-N 3.11Å; V217-Y221 PolarHBondContact O-N 2.81Å; V217-H246 HydrophobicContact CB-CB 4.11Å; V217-H246 HydrophobicContact CG1-CB 4.38Å; V217-H246 WeakPolarHBondContact CG1-O 3.25Å; V217-H246 HydrophobicContact CG2-CB 3.83Å; V217-I247 HydrophobicContact CG2-CD1 3.84Å; V217-W249 HydrophobicContact CG1-CE3 4.06Å; V217-W249 HydrophobicContact CG1-CZ3 4.24Å; V217-L250 HydrophobicContact CG1-CB 3.58Å; V217-L250 HydrophobicContact CG1-CD1 4.45Å; V217-L250 HydrophobicContact CG1-CD2 4.03Å; V217-L250 HydrophobicContact CG1-CG 4.23Å
218	E	98.3	Very high	94.2	Very high	47 Å²	47	55.8 Å²	55.8	22%	0.22	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-38.1	174.7	-72.7	-175.2	176	0	0	111.5	R214 M220 Y221 H222 W249	R214-E218 HydrophobicContact CG-CG 4.19Å; R214-E218 IonicContact CZ-OE1 3.32Å; R214-E218 IonicContact NE-OE1 3.99Å; R214-E218 PolarHBondContact NE-OE1 3.31Å; R214-E218 IonicContact NH2-OE1 3.75Å; R214-E218 PolarHBondContact NH2-OE1 3.46Å; R214-E218 VanDerWaalsContact NH2-OE1 3.13Å; R214-E218 PolarHBondContact O-N 3.36Å; E218-M220 VanDerWaalsContact C-N 3.34Å; E218-M220 PolarHBondContact O-N 3.18Å; E218-Y221 WeakPolarHBondContact O-CB 3.24Å; E218-Y221 PolarHBondContact O-N 2.85Å; E218-H222 PolarHBondContact O-CD2 2.94Å; E218-H222 PolarHBondContact O-N 3.12Å; E218-W249 HydrophobicContact CG-CH2 3.97Å; E218-W249 HydrophobicContact CG-CZ3 4.01Å
219	Q	98.3	Very high	95.6	Very high	107 Å²	107	52.8 Å²	52.8	50%	0.5	27%	0.272	S	S	.	.	H	α-helix	trans	-59.5	-43.5	172	-78.8	172.6	72.3	0	0	112.2	L164 D215 V217 H222 L223	L164-Q219 HydrophobicContact CD1-CB 4.02Å; D215-Q219 WeakPolarHBondContact O-CB 3.28Å; D215-Q219 WeakPolarHBondContact O-CG 3.35Å; D215-Q219 PolarHBondContact O-N 3Å; D215-Q219 PolarHBondContact O-NE2 3.29Å; V217-Q219 VanDerWaalsContact C-N 3.34Å; V217-Q219 PolarHBondContact O-N 2.84Å; Q219-H222 PolarHBondContact O-N 3.46Å; Q219-L223 PolarHBondContact O-N 2.93Å
220	M	98.7	Very high	96.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.2	-51.3	174.7	-177.9	63.2	80.7	0	0	110.3	I163 L164 P196 G197 W198 M216 V217 E218 H222 L223 I224 F233 L250	I163-M220 HydrophobicContact CD1-SD 4.17Å; I163-M220 HydrophobicContact CG1-CE 4.22Å; I163-M220 HydrophobicContact CG1-SD 4.44Å; L164-M220 VanDerWaalsContact CD1-CA 3.45Å; L164-M220 HydrophobicContact CD1-CB 3.79Å; L164-M220 HydrophobicContact CD1-CE 4.06Å; L164-M220 HydrophobicContact CD1-SD 4.18Å; P196-M220 HydrophobicContact CB-CE 4.12Å; P196-M220 HydrophobicContact CB-SD 3.86Å; P196-M220 HydrophobicContact CG-SD 3.98Å; P196-M220 WeakPolarHBondContact O-CE 3.26Å; G197-M220 WeakPolarHBondContact O-CE 3.25Å; W198-M220 HydrophobicContact CD2-CE 3.8Å; W198-M220 HydrophobicContact CE3-CE 4.05Å; W198-M220 HydrophobicContact CG-CE 4.38Å; W198-M220 HydrophobicContact CH2-CB 4.13Å; W198-M220 HydrophobicContact CH2-CE 4.06Å; W198-M220 HydrophobicContact CH2-CG 3.92Å; W198-M220 HydrophobicContact CZ2-CB 3.35Å; W198-M220 HydrophobicContact CZ2-CE 3.82Å; W198-M220 HydrophobicContact CZ2-CG 3.63Å; W198-M220 HydrophobicContact CZ3-CE 4.17Å; M216-M220 PolarHBondContact O-N 3.47Å; V217-M220 WeakPolarHBondContact O-CB 3.39Å; V217-M220 PolarHBondContact O-N 3.11Å; E218-M220 VanDerWaalsContact C-N 3.34Å; E218-M220 PolarHBondContact O-N 3.18Å; M220-H222 VanDerWaalsContact C-N 3.31Å; M220-H222 PolarHBondContact O-N 2.87Å; M220-L223 PolarHBondContact O-N 2.86Å; M220-L223 VanDerWaalsContact O-N 3.08Å; M220-I224 HydrophobicContact CG-CG1 4.48Å; M220-I224 WeakPolarHBondContact O-CG1 3.39Å; M220-I224 PolarHBondContact O-N 3.33Å; M220-I224 HydrophobicContact SD-CG2 4.09Å; M220-F233 HydrophobicContact CG-CD1 3.89Å; M220-F233 HydrophobicContact CG-CE1 3.61Å; M220-F233 HydrophobicContact SD-CD1 4.38Å; M220-F233 HydrophobicContact SD-CE1 4.2Å; M220-L250 HydrophobicContact CG-CD2 4.44Å
221	Y	98.6	Very high	97	Very high	53 Å²	53	53.8 Å²	53.8	21%	0.208	27%	0.267	C	S	.	.	H	α-helix	trans	-52.8	-47.1	178.2	174.1	-116.8	0	0	0	112.5	V217 E218 L223 I224 K225 W249 L250 Q253 F257	V217-Y221 PolarHBondContact O-N 2.81Å; E218-Y221 WeakPolarHBondContact O-CB 3.24Å; E218-Y221 PolarHBondContact O-N 2.85Å; Y221-L223 VanDerWaalsContact C-N 3.26Å; Y221-L223 PolarHBondContact O-N 2.96Å; Y221-I224 HydrophobicContact CD2-CD1 4.4Å; Y221-I224 PolarHBondContact O-N 3.24Å; Y221-I224 VanDerWaalsContact O-N 3.17Å; Y221-K225 HydrophobicContact CD2-CB 4.02Å; Y221-K225 HydrophobicContact CE1-CB 4.5Å; Y221-K225 HydrophobicContact CE1-CD 4.27Å; Y221-K225 HydrophobicContact CE2-CB 3.58Å; Y221-K225 VanDerWaalsContact O-CB 3.3Å; Y221-K225 WeakPolarHBondContact O-CB 3.33Å; Y221-K225 WeakPolarHBondContact O-CG 3.31Å; Y221-K225 PolarHBondContact O-N 3.08Å; Y221-W249 AromaticContact CD1-CH2 3.69Å; Y221-W249 HydrophobicContact CD1-CH2 3.69Å; Y221-W249 HydrophobicContact CD1-CZ3 4.43Å; Y221-W249 HydrophobicContact CE1-CH2 4.27Å; Y221-W249 AromaticContact CG-CH2 3.93Å; Y221-W249 HydrophobicContact CG-CH2 3.93Å; Y221-W249 HydrophobicContact CG-CZ3 4.24Å; Y221-L250 HydrophobicContact CD2-CD1 4.27Å; Y221-L250 HydrophobicContact CG-CD1 4.47Å; Y221-Q253 HydrophobicContact CD2-CB 3.93Å; Y221-Q253 HydrophobicContact CD2-CG 3.86Å; Y221-Q253 HydrophobicContact CE2-CB 3.54Å; Y221-Q253 HydrophobicContact CE2-CG 3.75Å; Y221-Q253 HydrophobicContact CG-CG 4.45Å; Y221-F257 HydrophobicContact CD2-CE2 4.23Å; Y221-F257 HydrophobicContact CE2-CE2 4.38Å
222	H	98.4	Very high	97.3	Very high	110 Å²	110	52.2 Å²	52.2	51%	0.509	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-30.9	-179.8	-72.8	-41.3	0	0	0	113.9	E218 Q219 M220	E218-H222 PolarHBondContact O-CD2 2.94Å; E218-H222 PolarHBondContact O-N 3.12Å; Q219-H222 PolarHBondContact O-N 3.46Å; M220-H222 VanDerWaalsContact C-N 3.31Å; M220-H222 PolarHBondContact O-N 2.87Å
223	L	97.9	Very high	97.4	Very high	52 Å²	52	52.2 Å²	52.2	27%	0.272	26%	0.258	S	S	.	.	H	α-helix	trans	-74.9	-33	175.8	-72.7	176.4	0	0	0	113.1	I163 L164 L182 Q219 M220 Y221	I163-L223 HydrophobicContact CD1-CD1 4.24Å; L164-L223 HydrophobicContact CD1-CD1 4.02Å; L164-L223 HydrophobicContact CD2-CD1 3.74Å; L164-L223 HydrophobicContact CG-CD1 3.9Å; L182-L223 HydrophobicContact CD1-CB 4.48Å; L182-L223 WeakPolarHBondContact CD1-O 3.45Å; Q219-L223 PolarHBondContact O-N 2.93Å; M220-L223 PolarHBondContact O-N 2.86Å; M220-L223 VanDerWaalsContact O-N 3.08Å; Y221-L223 VanDerWaalsContact C-N 3.26Å; Y221-L223 PolarHBondContact O-N 2.96Å
224	I	98	Very high	97.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-108	-15.2	-166.6	61.9	85.9	0	0	0	114.1	P196 M220 Y221 D226 V227 F233 F257	P196-I224 HydrophobicContact CG-CG2 3.99Å; M220-I224 HydrophobicContact CG-CG1 4.48Å; M220-I224 WeakPolarHBondContact O-CG1 3.39Å; M220-I224 PolarHBondContact O-N 3.33Å; M220-I224 HydrophobicContact SD-CG2 4.09Å; Y221-I224 HydrophobicContact CD2-CD1 4.4Å; Y221-I224 PolarHBondContact O-N 3.24Å; Y221-I224 VanDerWaalsContact O-N 3.17Å; I224-D226 PolarHBondContact O-N 3.31Å; I224-D226 VanDerWaalsContact O-N 3.12Å; I224-V227 WeakPolarHBondContact O-CG2 3.41Å; I224-V227 PolarHBondContact O-N 2.96Å; I224-V227 VanDerWaalsContact O-N 3.15Å; I224-F233 HydrophobicContact CD1-CE1 4.21Å; I224-F233 HydrophobicContact CD1-CZ 3.68Å; I224-F233 HydrophobicContact CG1-CE1 4.03Å; I224-F233 HydrophobicContact CG1-CZ 4.02Å; I224-F257 HydrophobicContact CD1-CD1 4.32Å; I224-F257 HydrophobicContact CD1-CD2 4.31Å; I224-F257 HydrophobicContact CD1-CE1 3.47Å; I224-F257 VanDerWaalsContact CD1-CE1 3.47Å; I224-F257 HydrophobicContact CD1-CE2 3.43Å; I224-F257 VanDerWaalsContact CD1-CE2 3.43Å; I224-F257 HydrophobicContact CD1-CZ 2.97Å; I224-F257 HydrophobicContact CG1-CZ 4.47Å
225	K	97.3	Very high	97.8	Very high	81 Å²	81	44.1 Å²	44.1	35%	0.352	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.1	-172	57.2	172.2	-174.5	166.6	0	113.7	Y221 R256	Y221-K225 HydrophobicContact CD2-CB 4.02Å; Y221-K225 HydrophobicContact CE1-CB 4.5Å; Y221-K225 HydrophobicContact CE1-CD 4.27Å; Y221-K225 HydrophobicContact CE2-CB 3.58Å; Y221-K225 VanDerWaalsContact O-CB 3.3Å; Y221-K225 WeakPolarHBondContact O-CB 3.33Å; Y221-K225 WeakPolarHBondContact O-CG 3.31Å; Y221-K225 PolarHBondContact O-N 3.08Å; K225-R256 PolarHBondContact O-NH2 3.08Å; K225-R256 VanDerWaalsContact O-NH2 3.09Å
226	D	95.8	Very high	97.8	Very high	132 Å²	132	39.6 Å²	39.6	71%	0.706	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-1.4	-173.5	-57.9	-43.4	0	0	0	113.3	I224	I224-D226 PolarHBondContact O-N 3.31Å; I224-D226 VanDerWaalsContact O-N 3.12Å
227	V	96.6	Very high	97.8	Very high	14 Å²	14	37.6 Å²	37.6	9%	0.085	19%	0.187	C	C	.	.			trans	-75.6	139.2	176.7	-49.6	0	0	0	0	109.9	L182 L194 I224 V231 R256	L182-V227 HydrophobicContact CD1-CG1 4.33Å; L182-V227 HydrophobicContact CD2-CG1 4.5Å; L194-V227 HydrophobicContact CD1-CB 4.02Å; L194-V227 HydrophobicContact CD1-CG1 4.31Å; L194-V227 HydrophobicContact CD1-CG2 3.56Å; I224-V227 WeakPolarHBondContact O-CG2 3.41Å; I224-V227 PolarHBondContact O-N 2.96Å; I224-V227 VanDerWaalsContact O-N 3.15Å; V227-V231 HydrophobicContact CG2-CG2 3.87Å; V227-R256 PolarHBondContact O-NH1 2.93Å; V227-R256 PolarHBondContact O-NH2 3.43Å; V227-R256 VanDerWaalsContact O-NH2 3.16Å
228	P	96.1	Very high	97.5	Very high	97 Å²	97	39.1 Å²	39.1	63%	0.63	19%	0.194	S	C	*	.			trans	-76.8	-20.8	-177.9	29	-36.6	0	0	0	114.3
229	Q	98.3	Very high	97.3	Very high	12 Å²	12	36.9 Å²	36.9	6%	0.056	18%	0.184	C	C	.	.	S	Bend	trans	-65.7	160.6	-173.9	-67.6	82.9	-3.5	0	0	113	Q186 P190 V192 L194 R256	Q186-Q229 VanDerWaalsContact CD-NE2 3.31Å; Q186-Q229 VanDerWaalsContact NE2-CD 3.35Å; P190-Q229 WeakPolarHBondContact O-CG 3.41Å; P190-Q229 PolarHBondContact O-NE2 2.7Å; V192-Q229 HydrophobicContact CG2-CG 4.3Å; V192-Q229 WeakPolarHBondContact O-CB 3.19Å; V192-Q229 WeakPolarHBondContact O-CG 3.49Å; L194-Q229 HydrophobicContact CD1-CB 3.94Å; L194-Q229 HydrophobicContact CD1-CG 4.2Å; L194-Q229 HydrophobicContact CG-CB 3.84Å; L194-Q229 HydrophobicContact CG-CG 4.03Å; Q229-R256 PolarHBondContact O-NH1 3.41Å
230	K	98.4	Very high	97	Very high	72 Å²	72	31.8 Å²	31.8	31%	0.313	16%	0.161	S	C	.	.			trans	-61.9	147	156.6	-64.1	-167.1	-175.2	86.1	0	109.5	D39 T193 L194	D39-K230 HydrophobicContact CB-CD 4.45Å; T193-K230 HydrophobicContact CG2-CB 4.12Å; L194-K230 PolarHBondContact N-O 2.76Å
231	V	98.8	Very high	96.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.4	179.1	-169.3	0	0	0	0	109.2	L194 P196 V227 F233 R256 F257 S258	L194-V231 HydrophobicContact CB-CG1 4.46Å; L194-V231 HydrophobicContact CB-CG2 4.38Å; L194-V231 CarbonylContact O-C 3.53Å; L194-V231 VanDerWaalsContact O-CA 3.31Å; L194-V231 WeakPolarHBondContact O-CA 3.44Å; P196-V231 HydrophobicContact CG-CG1 3.65Å; V227-V231 HydrophobicContact CG2-CG2 3.87Å; V231-F233 HydrophobicContact CB-CZ 4.28Å; V231-F233 HydrophobicContact CG1-CD1 4.1Å; V231-F233 HydrophobicContact CG1-CE1 3.5Å; V231-F233 HydrophobicContact CG1-CE2 4.3Å; V231-F233 HydrophobicContact CG1-CZ 3.63Å; V231-R256 PolarHBondContact N-O 2.95Å; V231-R256 VanDerWaalsContact O-O 3.11Å; V231-F257 HydrophobicContact CB-CD1 3.73Å; V231-F257 HydrophobicContact CB-CE1 4.03Å; V231-F257 HydrophobicContact CG2-CD1 4.03Å; V231-F257 HydrophobicContact CG2-CE1 3.84Å; V231-F257 CarbonylContact O-C 3.56Å; V231-F257 WeakPolarHBondContact O-CA 3.45Å; V231-S258 PolarHBondContact O-N 2.69Å; V231-S258 PolarHBondContact O-OG 3.36Å; V231-S258 VanDerWaalsContact O-OG 3.12Å
232	T	98.6	Very high	95.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.7	169.6	-175.9	0	0	0	0	108.7	W158 T193 L194 S195 P196 P234 S258 T260	W158-T232 HydrophobicContact CD2-CG2 4.34Å; W158-T232 HydrophobicContact CE3-CG2 3.66Å; W158-T232 HydrophobicContact CH2-CG2 3.97Å; W158-T232 HydrophobicContact CZ3-CG2 3.47Å; W158-T232 VanDerWaalsContact CZ3-CG2 3.47Å; T193-T232 HydrophobicContact CG2-CG2 4.25Å; L194-T232 PolarHBondContact O-N 3.36Å; S195-T232 VanDerWaalsContact CA-O 3.24Å; S195-T232 WeakPolarHBondContact CA-O 3.32Å; P196-T232 WeakPolarHBondContact CD-O 3.33Å; T232-P234 WeakPolarHBondContact O-CD 3.36Å; T232-S258 CarbonylContact C-O 3.51Å; T232-S258 WeakPolarHBondContact CA-O 3.5Å; T232-S258 WeakPolarHBondContact CA-OG 3.3Å; T232-S258 VanDerWaalsContact CB-OG 3.24Å; T232-S258 WeakPolarHBondContact CB-OG 3.47Å; T232-S258 PolarHBondContact OG1-OG 2.97Å; T232-T260 PolarHBondContact OG1-N 3.32Å; T232-T260 PolarHBondContact OG1-OG1 3.48Å
233	F	98.8	Very high	95.5	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	112.1	-178.1	-58.6	-70.5	0	0	0	110.3	P196 W198 M220 I224 V231 V235 L250 L251 F257 S258 L259 T260	P196-F233 HydrophobicContact CG-CD1 4.16Å; P196-F233 HydrophobicContact CG-CE1 4.1Å; W198-F233 HydrophobicContact CH2-CB 4.41Å; W198-F233 HydrophobicContact CH2-CD1 4.37Å; W198-F233 HydrophobicContact CZ3-CB 4.16Å; M220-F233 HydrophobicContact CG-CD1 3.89Å; M220-F233 HydrophobicContact CG-CE1 3.61Å; M220-F233 HydrophobicContact SD-CD1 4.38Å; M220-F233 HydrophobicContact SD-CE1 4.2Å; I224-F233 HydrophobicContact CD1-CE1 4.21Å; I224-F233 HydrophobicContact CD1-CZ 3.68Å; I224-F233 HydrophobicContact CG1-CE1 4.03Å; I224-F233 HydrophobicContact CG1-CZ 4.02Å; V231-F233 HydrophobicContact CB-CZ 4.28Å; V231-F233 HydrophobicContact CG1-CD1 4.1Å; V231-F233 HydrophobicContact CG1-CE1 3.5Å; V231-F233 HydrophobicContact CG1-CE2 4.3Å; V231-F233 HydrophobicContact CG1-CZ 3.63Å; F233-V235 PolarHBondContact O-N 3.35Å; F233-L250 HydrophobicContact CD1-CD2 3.97Å; F233-L250 HydrophobicContact CD2-CD2 3.6Å; F233-L250 HydrophobicContact CD2-CG 4.07Å; F233-L250 HydrophobicContact CE1-CD2 3.95Å; F233-L250 HydrophobicContact CE2-CD1 4.13Å; F233-L250 HydrophobicContact CE2-CD2 3.56Å; F233-L250 HydrophobicContact CE2-CG 3.63Å; F233-L250 HydrophobicContact CG-CD2 3.8Å; F233-L250 HydrophobicContact CZ-CD1 3.97Å; F233-L250 HydrophobicContact CZ-CD2 3.75Å; F233-L250 HydrophobicContact CZ-CG 3.94Å; F233-L251 HydrophobicContact CD2-CD2 4.33Å; F233-F257 HydrophobicContact CE2-CB 3.8Å; F233-F257 HydrophobicContact CE2-CD1 4.25Å; F233-F257 AromaticContact CE2-CD2 3.99Å; F233-F257 HydrophobicContact CE2-CD2 3.99Å; F233-F257 AromaticContact CE2-CG 3.73Å; F233-F257 HydrophobicContact CE2-CG 3.73Å; F233-F257 HydrophobicContact CZ-CD1 4.25Å; F233-F257 HydrophobicContact CZ-CD2 4.2Å; F233-F257 HydrophobicContact CZ-CG 4.08Å; F233-S258 WeakPolarHBondContact CD2-O 3.47Å; F233-S258 PolarHBondContact N-O 2.76Å; F233-L259 HydrophobicContact CB-CD1 4.22Å; F233-L259 WeakPolarHBondContact O-CD1 3.37Å; F233-T260 PolarHBondContact O-N 3.34Å
234	P	98	Very high	95.2	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.026	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	116.8	169.1	-16	29.9	0	0	0	110.1	N160 S195 P196 T232 T260	N160-P234 WeakPolarHBondContact OD1-CG 3.39Å; S195-P234 VanDerWaalsContact OG-CG 3.3Å; S195-P234 WeakPolarHBondContact OG-CG 3.07Å; P196-P234 VanDerWaalsContact O-CD 3.23Å; P196-P234 WeakPolarHBondContact O-CD 3.45Å; T232-P234 WeakPolarHBondContact O-CD 3.36Å; P234-T260 CarbonylContact C-O 3.1Å; P234-T260 VanDerWaalsContact CA-O 3.25Å; P234-T260 WeakPolarHBondContact CA-O 3.48Å
235	V	97.7	Very high	94.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.6	173.5	-61.5	0	0	0	0	111	W198 Y212 F233 A237 V240 I247 L259 T260 L261 W262	W198-V235 HydrophobicContact CE3-CG1 4.47Å; W198-V235 HydrophobicContact CZ3-CG1 3.84Å; Y212-V235 HydrophobicContact CE1-CG1 4.44Å; Y212-V235 HydrophobicContact CE2-CB 4.07Å; Y212-V235 HydrophobicContact CE2-CG1 4.4Å; Y212-V235 WeakPolarHBondContact OH-CA 3.24Å; F233-V235 PolarHBondContact O-N 3.35Å; V235-A237 PolarHBondContact O-N 2.99Å; V235-V240 HydrophobicContact CB-CG2 4.47Å; V235-V240 HydrophobicContact CG2-CB 4.12Å; V235-V240 HydrophobicContact CG2-CG2 3.7Å; V235-I247 HydrophobicContact CG1-CD1 3.93Å; V235-L259 HydrophobicContact CB-CD1 4.31Å; V235-L259 HydrophobicContact CG1-CD1 3.8Å; V235-L259 HydrophobicContact CG2-CD1 3.52Å; V235-L259 HydrophobicContact CG2-CD2 3.9Å; V235-L259 HydrophobicContact CG2-CG 3.73Å; V235-T260 PolarHBondContact N-O 3.02Å; V235-L261 HydrophobicContact CG2-CD2 3.34Å; V235-L261 WeakPolarHBondContact O-CA 3.48Å; V235-W262 VanDerWaalsContact O-CD1 3.23Å; V235-W262 PolarHBondContact O-N 3.25Å
236	H	96.6	Very high	94.3	Very high	7 Å²	7	29.4 Å²	29.4	3%	0.032	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	122.4	-178.1	-167.6	-61.1	0	0	0	109.8	V200 Y212 L238 L239 V240 W262	V200-H236 HydrophobicContact CG1-CB 4.07Å; V200-H236 HydrophobicContact CG2-CB 4.31Å; Y212-H236 PolarHBondContact OH-N 3.36Å; H236-L238 VanDerWaalsContact C-N 3.28Å; H236-L238 PolarHBondContact ND1-N 3.49Å; H236-L238 PolarHBondContact O-N 2.88Å; H236-L239 HydrophobicContact CB-CB 4.4Å; H236-L239 HydrophobicContact CB-CD1 4.35Å; H236-L239 HydrophobicContact CB-CG 4.36Å; H236-L239 PolarHBondContact O-N 2.89Å; H236-V240 PolarHBondContact O-N 3.13Å; H236-V240 VanDerWaalsContact O-N 3.09Å; H236-W262 HydrophobicContact CB-CH2 4.45Å; H236-W262 HydrophobicContact CB-CZ2 3.91Å; H236-W262 AromaticContact CD2-CH2 3.27Å; H236-W262 WeakPolarHBondContact CD2-CH2 3.13Å; H236-W262 AromaticContact CD2-CZ2 3.63Å; H236-W262 AromaticContact CD2-CZ3 3.54Å; H236-W262 AromaticContact NE2-CZ3 3.99Å
237	A	95.8	Very high	94.3	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-59.3	-33.6	-171.5	0	0	0	0	0	113.7	V235 L239 V240 W262 P268 L273 I289	V235-A237 PolarHBondContact O-N 2.99Å; A237-L239 VanDerWaalsContact C-N 3.31Å; A237-L239 PolarHBondContact O-N 2.7Å; A237-V240 WeakPolarHBondContact O-CG1 3.28Å; A237-W262 WeakPolarHBondContact CB-O 3.22Å; A237-W262 PolarHBondContact N-O 2.95Å; A237-P268 HydrophobicContact CB-CB 3.71Å; A237-P268 HydrophobicContact CB-CG 3.81Å; A237-L273 HydrophobicContact CB-CD2 4.31Å; A237-I289 HydrophobicContact CB-CD1 4.05Å
238	L	93.2	Very high	94	Very high	31 Å²	31	23.6 Å²	23.6	16%	0.162	12%	0.117	C	C	.	.	H	α-helix	trans	-75.6	-10.6	175.7	-70.5	171.8	0	0	0	115.5	Y202 H236 D266 P268	Y202-L238 HydrophobicContact CD1-CD1 4.09Å; Y202-L238 HydrophobicContact CD2-CB 4.48Å; Y202-L238 HydrophobicContact CE1-CD1 3.49Å; Y202-L238 VanDerWaalsContact CE1-CD1 3.49Å; Y202-L238 HydrophobicContact CE2-CB 4.07Å; Y202-L238 HydrophobicContact CE2-CD1 4.32Å; H236-L238 VanDerWaalsContact C-N 3.28Å; H236-L238 PolarHBondContact ND1-N 3.49Å; H236-L238 PolarHBondContact O-N 2.88Å; L238-D266 HydrophobicContact CD1-CB 3.5Å; L238-P268 HydrophobicContact CD2-CB 4.22Å; L238-P268 HydrophobicContact CG-CB 4.43Å
239	L	93.3	Very high	93.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-109.6	-28	-178.5	-63	-174.8	0	0	0	112.4	P167 V200 Y202 T211 Y212 H236 A237 H241 R242 G243	P167-L239 HydrophobicContact CB-CD1 3.83Å; P167-L239 HydrophobicContact CG-CD1 4.1Å; V200-L239 HydrophobicContact CG1-CD1 3.53Å; Y202-L239 HydrophobicContact CD2-CD2 3.9Å; Y202-L239 HydrophobicContact CD2-CG 4.34Å; Y202-L239 HydrophobicContact CE2-CD2 4.21Å; T211-L239 PolarHBondContact OG1-O 3.25Å; Y212-L239 HydrophobicContact CD2-CB 4.21Å; Y212-L239 HydrophobicContact CE2-CB 3.85Å; H236-L239 HydrophobicContact CB-CB 4.4Å; H236-L239 HydrophobicContact CB-CD1 4.35Å; H236-L239 HydrophobicContact CB-CG 4.36Å; H236-L239 PolarHBondContact O-N 2.89Å; A237-L239 VanDerWaalsContact C-N 3.31Å; A237-L239 PolarHBondContact O-N 2.7Å; L239-H241 VanDerWaalsContact C-N 3.27Å; L239-H241 PolarHBondContact O-N 3.38Å; L239-R242 PolarHBondContact O-N 3.27Å; L239-G243 PolarHBondContact O-N 2.87Å
240	V	91.9	Very high	93.7	Very high	1 Å²	1	23 Å²	23	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-54.2	-39.7	-171.3	71.7	0	0	0	0	113.4	V235 H236 A237 R242 G243 W244 L259 L261 V276	V235-V240 HydrophobicContact CB-CG2 4.47Å; V235-V240 HydrophobicContact CG2-CB 4.12Å; V235-V240 HydrophobicContact CG2-CG2 3.7Å; H236-V240 PolarHBondContact O-N 3.13Å; H236-V240 VanDerWaalsContact O-N 3.09Å; A237-V240 WeakPolarHBondContact O-CG1 3.28Å; V240-R242 PolarHBondContact O-N 2.82Å; V240-G243 CarbonylContact O-C 3.55Å; V240-G243 PolarHBondContact O-N 3.22Å; V240-W244 HydrophobicContact CG2-CE3 3.9Å; V240-W244 HydrophobicContact CG2-CZ3 4.09Å; V240-W244 WeakPolarHBondContact O-CA 3.45Å; V240-W244 WeakPolarHBondContact O-CB 3.43Å; V240-W244 PolarHBondContact O-N 3.18Å; V240-L259 HydrophobicContact CG2-CD2 4.46Å; V240-L261 HydrophobicContact CB-CD2 4.3Å; V240-L261 HydrophobicContact CG1-CD2 4.15Å; V240-L261 HydrophobicContact CG2-CD2 4.03Å; V240-V276 HydrophobicContact CB-CG2 4.49Å; V240-V276 HydrophobicContact CG1-CG2 3.58Å; V240-V276 HydrophobicContact CG2-CG2 4.04Å
241	H	88.6	Confident	93.5	Very high	37 Å²	37	19.8 Å²	19.8	17%	0.171	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-45.8	-176.6	-174.4	-161.9	0	0	0	112.2	L239 G243 W244 D272 F275 Y414 Y455	L239-H241 VanDerWaalsContact C-N 3.27Å; L239-H241 PolarHBondContact O-N 3.38Å; H241-G243 PolarHBondContact O-N 3.5Å; H241-W244 VanDerWaalsContact O-CB 3.25Å; H241-W244 WeakPolarHBondContact O-CB 3.27Å; H241-W244 PolarHBondContact O-N 2.55Å; H241-D272 IonicContact CG-OD1 3.79Å; H241-D272 IonicContact ND1-OD1 2.73Å; H241-D272 PolarHBondContact ND1-OD1 3.17Å; H241-F275 HydrophobicContact CB-CD1 4.43Å; H241-F275 AromaticContact CD2-CD1 3.37Å; H241-F275 WeakPolarHBondContact CD2-CD1 3.37Å; H241-F275 AromaticContact CD2-CD2 3.55Å; H241-F275 AromaticContact CD2-CE1 3.39Å; H241-F275 WeakPolarHBondContact CD2-CE1 3.4Å; H241-F275 AromaticContact CD2-CE2 3.59Å; H241-F275 AromaticContact CD2-CG 3.47Å; H241-F275 VanDerWaalsContact CD2-CG 3.47Å; H241-F275 WeakPolarHBondContact CD2-CG 3.28Å; H241-F275 AromaticContact CD2-CZ 3.5Å; H241-F275 AromaticContact NE2-CD1 3.97Å; H241-F275 AromaticContact NE2-CD2 3.25Å; H241-F275 VanDerWaalsContact NE2-CD2 3.25Å; H241-F275 WeakPolarHBondContact NE2-CD2 3.42Å; H241-F275 AromaticContact NE2-CE2 3.46Å; H241-F275 WeakPolarHBondContact NE2-CE2 3.44Å; H241-F275 AromaticContact NE2-CG 3.56Å; H241-F275 AromaticContact NE2-CZ 3.88Å; H241-Y414 PolarHBondContact CD2-OH 3.23Å; H241-Y414 AromaticContact NE2-CE1 3.66Å; H241-Y414 AromaticContact NE2-CZ 3.51Å; H241-Y414 PolarHBondContact NE2-OH 3.39Å; H241-Y455 PolarHBondContact O-OH 3.06Å; H241-Y455 VanDerWaalsContact O-OH 3.09Å
242	R	86.4	Confident	93.2	Very high	112 Å²	112	25.5 Å²	25.5	42%	0.423	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-26.3	-178.4	-66.3	-175	-69.9	155.4	7.1	113.2	I209 T211 L239 V240	I209-R242 VanDerWaalsContact CG2-NH2 3.31Å; I209-R242 VanDerWaalsContact O-CZ 3.23Å; I209-R242 PolarHBondContact O-NH1 2.89Å; I209-R242 PolarHBondContact O-NH2 3.33Å; T211-R242 HydrophobicContact CG2-CB 3.78Å; L239-R242 PolarHBondContact O-N 3.27Å; V240-R242 PolarHBondContact O-N 2.82Å
243	G	89.1	Confident	93	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	7.6	177	0	0	0	0	0	113.3	T211 L239 V240 H241 Q245 H246 I247	T211-G243 PolarHBondContact OG1-N 3.07Å; L239-G243 PolarHBondContact O-N 2.87Å; V240-G243 CarbonylContact O-C 3.55Å; V240-G243 PolarHBondContact O-N 3.22Å; H241-G243 PolarHBondContact O-N 3.5Å; G243-Q245 VanDerWaalsContact C-N 3.32Å; G243-Q245 PolarHBondContact O-N 3.49Å; G243-H246 PolarHBondContact O-N 3.11Å; G243-H246 VanDerWaalsContact O-N 3.09Å; G243-I247 PolarHBondContact O-N 3.44Å
244	W	91	Very high	92.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.1	-38.7	-162.4	178.5	-103.6	0	0	0	113.7	V240 H241 H246 I247 S248 L251 L259 F275 V276 N279 T280 P312 Y455	V240-W244 HydrophobicContact CG2-CE3 3.9Å; V240-W244 HydrophobicContact CG2-CZ3 4.09Å; V240-W244 WeakPolarHBondContact O-CA 3.45Å; V240-W244 WeakPolarHBondContact O-CB 3.43Å; V240-W244 PolarHBondContact O-N 3.18Å; H241-W244 VanDerWaalsContact O-CB 3.25Å; H241-W244 WeakPolarHBondContact O-CB 3.27Å; H241-W244 PolarHBondContact O-N 2.55Å; W244-H246 PolarHBondContact O-N 3.38Å; W244-I247 HydrophobicContact CE3-CB 4.43Å; W244-I247 HydrophobicContact CE3-CG2 4.38Å; W244-I247 HydrophobicContact CZ3-CG2 4.12Å; W244-I247 PolarHBondContact O-N 2.83Å; W244-S248 VanDerWaalsContact O-CB 3.26Å; W244-S248 WeakPolarHBondContact O-CB 3.23Å; W244-S248 PolarHBondContact O-N 2.94Å; W244-L251 HydrophobicContact CH2-CD1 4.31Å; W244-L259 HydrophobicContact CZ3-CD2 4.13Å; W244-F275 HydrophobicContact CB-CE1 3.66Å; W244-F275 HydrophobicContact CB-CZ 3.91Å; W244-F275 AromaticContact CD1-CE1 3.73Å; W244-F275 AromaticContact CD1-CZ 3.5Å; W244-F275 AromaticContact CD2-CE1 3.53Å; W244-F275 HydrophobicContact CD2-CE1 3.53Å; W244-F275 HydrophobicContact CD2-CZ 4.13Å; W244-F275 HydrophobicContact CE3-CE1 4.06Å; W244-F275 AromaticContact CG-CE1 3.31Å; W244-F275 HydrophobicContact CG-CE1 3.31Å; W244-F275 AromaticContact CG-CZ 3.53Å; W244-F275 HydrophobicContact CG-CZ 3.53Å; W244-V276 HydrophobicContact CE3-CG2 4.24Å; W244-V276 HydrophobicContact CH2-CG1 3.99Å; W244-V276 HydrophobicContact CZ3-CB 4.31Å; W244-V276 HydrophobicContact CZ3-CG1 3.8Å; W244-V276 HydrophobicContact CZ3-CG2 3.97Å; W244-N279 HydrophobicContact CH2-CB 4.33Å; W244-N279 HydrophobicContact CZ2-CB 3.4Å; W244-N279 VanDerWaalsContact CZ2-CB 3.4Å; W244-T280 HydrophobicContact CH2-CG2 3.46Å; W244-T280 VanDerWaalsContact CH2-CG2 3.46Å; W244-T280 HydrophobicContact CZ2-CG2 4.09Å; W244-P312 VanDerWaalsContact NE1-CB 3.27Å; W244-Y455 HydrophobicContact CB-CE1 4.33Å
245	Q	85.5	Confident	92.6	Very high	58 Å²	58	35.8 Å²	35.8	27%	0.271	18%	0.18	S	C	.	.	H	α-helix	trans	-53.2	-40.4	178.3	54.4	168.6	-11.1	0	0	112.8	G243 W249	G243-Q245 VanDerWaalsContact C-N 3.32Å; G243-Q245 PolarHBondContact O-N 3.49Å; Q245-W249 WeakPolarHBondContact O-CB 3.37Å; Q245-W249 PolarHBondContact O-N 3.27Å; Q245-W249 VanDerWaalsContact O-N 3.12Å
246	H	91.6	Very high	92.6	Very high	38 Å²	38	39 Å²	39	18%	0.176	19%	0.192	C	C	.	.	H	α-helix	trans	-77.9	-42.9	-178.7	-52.5	-51.2	0	0	0	110.5	Y212 R214 V217 G243 W244 S248 W249 L250	Y212-H246 PolarHBondContact O-CD2 3.4Å; R214-H246 PolarHBondContact N-CD2 2.67Å; V217-H246 HydrophobicContact CB-CB 4.11Å; V217-H246 HydrophobicContact CG1-CB 4.38Å; V217-H246 WeakPolarHBondContact CG1-O 3.25Å; V217-H246 HydrophobicContact CG2-CB 3.83Å; G243-H246 PolarHBondContact O-N 3.11Å; G243-H246 VanDerWaalsContact O-N 3.09Å; W244-H246 PolarHBondContact O-N 3.38Å; H246-S248 VanDerWaalsContact C-N 3.35Å; H246-S248 PolarHBondContact O-N 3.27Å; H246-W249 WeakPolarHBondContact O-CB 3.37Å; H246-W249 PolarHBondContact O-N 3.04Å; H246-L250 PolarHBondContact O-N 3.3Å
247	I	95.2	Very high	92.6	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-43.5	176.4	-60	-56.3	0	0	0	111.3	W198 Y212 V217 V235 G243 W244 W249 L250 L251 L259	W198-I247 HydrophobicContact CH2-CD1 4.49Å; Y212-I247 HydrophobicContact CD1-CD1 4.4Å; Y212-I247 HydrophobicContact CD2-CD1 4.48Å; Y212-I247 HydrophobicContact CG-CD1 4.11Å; V217-I247 HydrophobicContact CG2-CD1 3.84Å; V235-I247 HydrophobicContact CG1-CD1 3.93Å; G243-I247 PolarHBondContact O-N 3.44Å; W244-I247 HydrophobicContact CE3-CB 4.43Å; W244-I247 HydrophobicContact CE3-CG2 4.38Å; W244-I247 HydrophobicContact CZ3-CG2 4.12Å; W244-I247 PolarHBondContact O-N 2.83Å; I247-W249 PolarHBondContact O-N 3.25Å; I247-L250 WeakPolarHBondContact O-CB 3.38Å; I247-L250 PolarHBondContact O-N 3.04Å; I247-L251 HydrophobicContact CG2-CD1 4.43Å; I247-L251 WeakPolarHBondContact O-CG 3.27Å; I247-L251 PolarHBondContact O-N 3.1Å; I247-L259 HydrophobicContact CG2-CD1 3.69Å; I247-L259 HydrophobicContact CG2-CD2 4.35Å
248	S	91.4	Very high	92.8	Very high	24 Å²	24	39.4 Å²	39.4	17%	0.168	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-41.8	176.1	-175.4	0	0	0	0	111.5	W244 H246 L250 L251 N252	W244-S248 VanDerWaalsContact O-CB 3.26Å; W244-S248 WeakPolarHBondContact O-CB 3.23Å; W244-S248 PolarHBondContact O-N 2.94Å; H246-S248 VanDerWaalsContact C-N 3.35Å; H246-S248 PolarHBondContact O-N 3.27Å; S248-L250 VanDerWaalsContact C-N 3.32Å; S248-L250 PolarHBondContact O-N 3.19Å; S248-L251 PolarHBondContact O-N 3.09Å; S248-N252 PolarHBondContact O-N 2.89Å; S248-N252 VanDerWaalsContact O-N 3.14Å; S248-N252 PolarHBondContact O-ND2 3.44Å; S248-N252 VanDerWaalsContact O-ND2 3.09Å
249	W	92.1	Very high	93	Very high	94 Å²	94	38 Å²	38	36%	0.356	19%	0.188	S	C	.	.	H	α-helix	trans	-57.6	-44.5	172.7	173.2	89.4	0	0	0	111.8	V217 E218 Y221 Q245 H246 I247 N252 Q253	V217-W249 HydrophobicContact CG1-CE3 4.06Å; V217-W249 HydrophobicContact CG1-CZ3 4.24Å; E218-W249 HydrophobicContact CG-CH2 3.97Å; E218-W249 HydrophobicContact CG-CZ3 4.01Å; Y221-W249 AromaticContact CD1-CH2 3.69Å; Y221-W249 HydrophobicContact CD1-CH2 3.69Å; Y221-W249 HydrophobicContact CD1-CZ3 4.43Å; Y221-W249 HydrophobicContact CE1-CH2 4.27Å; Y221-W249 AromaticContact CG-CH2 3.93Å; Y221-W249 HydrophobicContact CG-CH2 3.93Å; Y221-W249 HydrophobicContact CG-CZ3 4.24Å; Q245-W249 WeakPolarHBondContact O-CB 3.37Å; Q245-W249 PolarHBondContact O-N 3.27Å; Q245-W249 VanDerWaalsContact O-N 3.12Å; H246-W249 WeakPolarHBondContact O-CB 3.37Å; H246-W249 PolarHBondContact O-N 3.04Å; I247-W249 PolarHBondContact O-N 3.25Å; W249-N252 PolarHBondContact O-N 3.48Å; W249-Q253 HydrophobicContact CD2-CG 4.42Å; W249-Q253 VanDerWaalsContact CE2-NE2 3.31Å; W249-Q253 HydrophobicContact CE3-CG 4.39Å; W249-Q253 HydrophobicContact CH2-CG 4.15Å; W249-Q253 HydrophobicContact CZ2-CG 4.17Å; W249-Q253 HydrophobicContact CZ3-CG 4.26Å; W249-Q253 WeakPolarHBondContact O-CG 3.42Å; W249-Q253 PolarHBondContact O-N 3.28Å; W249-Q253 PolarHBondContact O-NE2 3.09Å
250	L	96.1	Very high	93.2	Very high	1 Å²	1	38 Å²	38	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-49	178	178.3	63.3	0	0	0	111.6	W198 V217 M220 Y221 F233 H246 I247 S248 N252 Q253 F257	W198-L250 HydrophobicContact CH2-CD2 4Å; V217-L250 HydrophobicContact CG1-CB 3.58Å; V217-L250 HydrophobicContact CG1-CD1 4.45Å; V217-L250 HydrophobicContact CG1-CD2 4.03Å; V217-L250 HydrophobicContact CG1-CG 4.23Å; M220-L250 HydrophobicContact CG-CD2 4.44Å; Y221-L250 HydrophobicContact CD2-CD1 4.27Å; Y221-L250 HydrophobicContact CG-CD1 4.47Å; F233-L250 HydrophobicContact CD1-CD2 3.97Å; F233-L250 HydrophobicContact CD2-CD2 3.6Å; F233-L250 HydrophobicContact CD2-CG 4.07Å; F233-L250 HydrophobicContact CE1-CD2 3.95Å; F233-L250 HydrophobicContact CE2-CD1 4.13Å; F233-L250 HydrophobicContact CE2-CD2 3.56Å; F233-L250 HydrophobicContact CE2-CG 3.63Å; F233-L250 HydrophobicContact CG-CD2 3.8Å; F233-L250 HydrophobicContact CZ-CD1 3.97Å; F233-L250 HydrophobicContact CZ-CD2 3.75Å; F233-L250 HydrophobicContact CZ-CG 3.94Å; H246-L250 PolarHBondContact O-N 3.3Å; I247-L250 WeakPolarHBondContact O-CB 3.38Å; I247-L250 PolarHBondContact O-N 3.04Å; S248-L250 VanDerWaalsContact C-N 3.32Å; S248-L250 PolarHBondContact O-N 3.19Å; L250-N252 PolarHBondContact O-N 2.84Å; L250-Q253 WeakPolarHBondContact O-CB 3.31Å; L250-Q253 WeakPolarHBondContact O-CG 3.44Å; L250-Q253 PolarHBondContact O-N 2.76Å; L250-F257 WeakPolarHBondContact O-CD2 3.33Å
251	L	94.5	Very high	93.5	Very high	6 Å²	6	37.9 Å²	37.9	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-59.2	-31.2	179.3	-68.4	176.4	0	0	0	112.6	F233 W244 I247 S248 Q253 F257 L259 T280	F233-L251 HydrophobicContact CD2-CD2 4.33Å; W244-L251 HydrophobicContact CH2-CD1 4.31Å; I247-L251 HydrophobicContact CG2-CD1 4.43Å; I247-L251 WeakPolarHBondContact O-CG 3.27Å; I247-L251 PolarHBondContact O-N 3.1Å; S248-L251 PolarHBondContact O-N 3.09Å; L251-Q253 VanDerWaalsContact C-N 3.29Å; L251-Q253 PolarHBondContact O-N 3.43Å; L251-F257 HydrophobicContact CD2-CB 4.5Å; L251-L259 HydrophobicContact CD1-CB 4.39Å; L251-L259 HydrophobicContact CD2-CB 4.28Å; L251-T280 HydrophobicContact CD1-CG2 4.15Å
252	N	91	Very high	93.9	Very high	119 Å²	119	38.8 Å²	38.8	64%	0.636	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-7.1	178.4	-73	-37.3	0	0	0	114.3	S248 W249 L250	S248-N252 PolarHBondContact O-N 2.89Å; S248-N252 VanDerWaalsContact O-N 3.14Å; S248-N252 PolarHBondContact O-ND2 3.44Å; S248-N252 VanDerWaalsContact O-ND2 3.09Å; W249-N252 PolarHBondContact O-N 3.48Å; L250-N252 PolarHBondContact O-N 2.84Å
253	Q	94.9	Very high	94.2	Very high	67 Å²	67	33.8 Å²	33.8	31%	0.313	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-23.1	-179.6	-59.7	-49.1	-67.1	0	0	113.3	Y221 W249 L250 L251 F257	Y221-Q253 HydrophobicContact CD2-CB 3.93Å; Y221-Q253 HydrophobicContact CD2-CG 3.86Å; Y221-Q253 HydrophobicContact CE2-CB 3.54Å; Y221-Q253 HydrophobicContact CE2-CG 3.75Å; Y221-Q253 HydrophobicContact CG-CG 4.45Å; W249-Q253 HydrophobicContact CD2-CG 4.42Å; W249-Q253 VanDerWaalsContact CE2-NE2 3.31Å; W249-Q253 HydrophobicContact CE3-CG 4.39Å; W249-Q253 HydrophobicContact CH2-CG 4.15Å; W249-Q253 HydrophobicContact CZ2-CG 4.17Å; W249-Q253 HydrophobicContact CZ3-CG 4.26Å; W249-Q253 WeakPolarHBondContact O-CG 3.42Å; W249-Q253 PolarHBondContact O-N 3.28Å; W249-Q253 PolarHBondContact O-NE2 3.09Å; L250-Q253 WeakPolarHBondContact O-CB 3.31Å; L250-Q253 WeakPolarHBondContact O-CG 3.44Å; L250-Q253 PolarHBondContact O-N 2.76Å; L251-Q253 VanDerWaalsContact C-N 3.29Å; L251-Q253 PolarHBondContact O-N 3.43Å; Q253-F257 HydrophobicContact CB-CD2 4.2Å; Q253-F257 HydrophobicContact CB-CE2 3.9Å
254	S	95.2	Very high	94.2	Very high	20 Å²	20	35 Å²	35	14%	0.14	18%	0.183	C	C	.	.			trans	-158.7	140.3	179.9	-166.4	0	0	0	0	112.4	R256 F257	S254-R256 PolarHBondContact O-N 2.68Å; S254-R256 VanDerWaalsContact O-N 3.1Å; S254-R256 PolarHBondContact OG-N 2.85Å; S254-F257 WeakPolarHBondContact O-CB 3.5Å; S254-F257 PolarHBondContact O-N 3.09Å
255	P	93.8	Very high	94.2	Very high	134 Å²	134	40.6 Å²	40.6	87%	0.87	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-11.5	171.7	29.4	-36.9	0	0	0	113.3	F257	P255-F257 PolarHBondContact O-N 3.13Å
256	R	96.6	Very high	94.4	Very high	67 Å²	67	40.7 Å²	40.7	25%	0.253	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-10.9	173.1	-66.3	-176.3	-63.9	112.3	-7.4	113	K225 V227 Q229 V231 S254	K225-R256 PolarHBondContact O-NH2 3.08Å; K225-R256 VanDerWaalsContact O-NH2 3.09Å; V227-R256 PolarHBondContact O-NH1 2.93Å; V227-R256 PolarHBondContact O-NH2 3.43Å; V227-R256 VanDerWaalsContact O-NH2 3.16Å; Q229-R256 PolarHBondContact O-NH1 3.41Å; V231-R256 PolarHBondContact N-O 2.95Å; V231-R256 VanDerWaalsContact O-O 3.11Å; S254-R256 PolarHBondContact O-N 2.68Å; S254-R256 VanDerWaalsContact O-N 3.1Å; S254-R256 PolarHBondContact OG-N 2.85Å
257	F	98.3	Very high	94.4	Very high	3 Å²	3	43.5 Å²	43.5	1%	0.013	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.9	-170.7	-65.1	-7.4	0	0	0	111.6	Y221 I224 V231 F233 L250 L251 Q253 S254 P255 Q284	Y221-F257 HydrophobicContact CD2-CE2 4.23Å; Y221-F257 HydrophobicContact CE2-CE2 4.38Å; I224-F257 HydrophobicContact CD1-CD1 4.32Å; I224-F257 HydrophobicContact CD1-CD2 4.31Å; I224-F257 HydrophobicContact CD1-CE1 3.47Å; I224-F257 VanDerWaalsContact CD1-CE1 3.47Å; I224-F257 HydrophobicContact CD1-CE2 3.43Å; I224-F257 VanDerWaalsContact CD1-CE2 3.43Å; I224-F257 HydrophobicContact CD1-CZ 2.97Å; I224-F257 HydrophobicContact CG1-CZ 4.47Å; V231-F257 HydrophobicContact CB-CD1 3.73Å; V231-F257 HydrophobicContact CB-CE1 4.03Å; V231-F257 HydrophobicContact CG2-CD1 4.03Å; V231-F257 HydrophobicContact CG2-CE1 3.84Å; V231-F257 CarbonylContact O-C 3.56Å; V231-F257 WeakPolarHBondContact O-CA 3.45Å; F233-F257 HydrophobicContact CE2-CB 3.8Å; F233-F257 HydrophobicContact CE2-CD1 4.25Å; F233-F257 AromaticContact CE2-CD2 3.99Å; F233-F257 HydrophobicContact CE2-CD2 3.99Å; F233-F257 AromaticContact CE2-CG 3.73Å; F233-F257 HydrophobicContact CE2-CG 3.73Å; F233-F257 HydrophobicContact CZ-CD1 4.25Å; F233-F257 HydrophobicContact CZ-CD2 4.2Å; F233-F257 HydrophobicContact CZ-CG 4.08Å; L250-F257 WeakPolarHBondContact O-CD2 3.33Å; L251-F257 HydrophobicContact CD2-CB 4.5Å; Q253-F257 HydrophobicContact CB-CD2 4.2Å; Q253-F257 HydrophobicContact CB-CE2 3.9Å; S254-F257 WeakPolarHBondContact O-CB 3.5Å; S254-F257 PolarHBondContact O-N 3.09Å; P255-F257 PolarHBondContact O-N 3.13Å; F257-Q284 WeakPolarHBondContact O-CG 3.37Å; F257-Q284 PolarHBondContact O-NE2 3.04Å; F257-Q284 VanDerWaalsContact O-NE2 3.08Å
258	S	98.4	Very high	94.4	Very high	15 Å²	15	43.7 Å²	43.7	11%	0.105	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	174.6	177.9	56.5	0	0	0	0	110.3	V231 T232 F233 Q284	V231-S258 PolarHBondContact O-N 2.69Å; V231-S258 PolarHBondContact O-OG 3.36Å; V231-S258 VanDerWaalsContact O-OG 3.12Å; T232-S258 CarbonylContact C-O 3.51Å; T232-S258 WeakPolarHBondContact CA-O 3.5Å; T232-S258 WeakPolarHBondContact CA-OG 3.3Å; T232-S258 VanDerWaalsContact CB-OG 3.24Å; T232-S258 WeakPolarHBondContact CB-OG 3.47Å; T232-S258 PolarHBondContact OG1-OG 2.97Å; F233-S258 WeakPolarHBondContact CD2-O 3.47Å; F233-S258 PolarHBondContact N-O 2.76Å; S258-Q284 CarbonylContact C-O 3.48Å; S258-Q284 VanDerWaalsContact CA-O 3.25Å; S258-Q284 WeakPolarHBondContact CA-O 3.5Å; S258-Q284 VanDerWaalsContact CB-O 3.26Å; S258-Q284 WeakPolarHBondContact CB-O 3.32Å
259	L	98.1	Very high	94.4	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.9	-177.2	-161.3	70.5	0	0	0	110.1	F233 V235 V240 W244 I247 L251 L261 V276 Q284 V285 Y286	F233-L259 HydrophobicContact CB-CD1 4.22Å; F233-L259 WeakPolarHBondContact O-CD1 3.37Å; V235-L259 HydrophobicContact CB-CD1 4.31Å; V235-L259 HydrophobicContact CG1-CD1 3.8Å; V235-L259 HydrophobicContact CG2-CD1 3.52Å; V235-L259 HydrophobicContact CG2-CD2 3.9Å; V235-L259 HydrophobicContact CG2-CG 3.73Å; V240-L259 HydrophobicContact CG2-CD2 4.46Å; W244-L259 HydrophobicContact CZ3-CD2 4.13Å; I247-L259 HydrophobicContact CG2-CD1 3.69Å; I247-L259 HydrophobicContact CG2-CD2 4.35Å; L251-L259 HydrophobicContact CD1-CB 4.39Å; L251-L259 HydrophobicContact CD2-CB 4.28Å; L259-L261 HydrophobicContact CD2-CD2 3.5Å; L259-L261 HydrophobicContact CD2-CG 4.3Å; L259-L261 HydrophobicContact CG-CD2 4.07Å; L259-V276 HydrophobicContact CD2-CG1 3.85Å; L259-Q284 PolarHBondContact N-O 3.07Å; L259-V285 HydrophobicContact CB-CB 4.35Å; L259-V285 HydrophobicContact CB-CG2 4.2Å; L259-V285 HydrophobicContact CD2-CG2 4.33Å; L259-V285 CarbonylContact O-C 3.44Å; L259-V285 WeakPolarHBondContact O-CA 3.46Å; L259-Y286 PolarHBondContact O-N 2.92Å
260	T	98.1	Very high	94.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	109.9	163.2	-60.9	0	0	0	0	108.1	T232 F233 P234 V235 W262 Y286 D288	T232-T260 PolarHBondContact OG1-N 3.32Å; T232-T260 PolarHBondContact OG1-OG1 3.48Å; F233-T260 PolarHBondContact O-N 3.34Å; P234-T260 CarbonylContact C-O 3.1Å; P234-T260 VanDerWaalsContact CA-O 3.25Å; P234-T260 WeakPolarHBondContact CA-O 3.48Å; V235-T260 PolarHBondContact N-O 3.02Å; T260-W262 PolarHBondContact O-N 2.98Å; T260-Y286 WeakPolarHBondContact CA-O 3.39Å; T260-D288 HydrophobicContact CG2-CB 4.23Å
261	L	97.8	Very high	94.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	121.7	170.6	-60.6	-169.8	0	0	0	108.4	V235 V240 L259 L273 V276 V285 Y286 Y287 D288	V235-L261 HydrophobicContact CG2-CD2 3.34Å; V235-L261 WeakPolarHBondContact O-CA 3.48Å; V240-L261 HydrophobicContact CB-CD2 4.3Å; V240-L261 HydrophobicContact CG1-CD2 4.15Å; V240-L261 HydrophobicContact CG2-CD2 4.03Å; L259-L261 HydrophobicContact CD2-CD2 3.5Å; L259-L261 HydrophobicContact CD2-CG 4.3Å; L259-L261 HydrophobicContact CG-CD2 4.07Å; L261-L273 HydrophobicContact CD1-CD2 3.81Å; L261-V276 HydrophobicContact CD1-CB 3.86Å; L261-V276 HydrophobicContact CD1-CG1 3.91Å; L261-V276 HydrophobicContact CD1-CG2 3.87Å; L261-V276 HydrophobicContact CD2-CG1 4.29Å; L261-V276 HydrophobicContact CD2-CG2 4.29Å; L261-V276 HydrophobicContact CG-CG1 4.35Å; L261-V285 HydrophobicContact CG-CG2 4.14Å; L261-Y286 PolarHBondContact N-O 2.95Å; L261-Y287 HydrophobicContact CB-CD1 4.29Å; L261-Y287 HydrophobicContact CD1-CD1 3.82Å; L261-Y287 HydrophobicContact CD1-CE1 3.66Å; L261-Y287 HydrophobicContact CG-CD1 4.31Å; L261-Y287 HydrophobicContact CG-CE1 4.39Å; L261-D288 WeakPolarHBondContact O-CA 3.26Å; L261-D288 PolarHBondContact O-N 3.1Å
262	W	96.1	Very high	93.8	Very high	55 Å²	55	45.5 Å²	45.5	21%	0.208	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144.6	173.9	66.1	-89.4	0	0	0	110.7	V200 V235 H236 A237 T260 D288	V200-W262 HydrophobicContact CB-CH2 4.36Å; V200-W262 HydrophobicContact CB-CZ2 4.04Å; V200-W262 HydrophobicContact CG2-CZ2 4Å; V235-W262 VanDerWaalsContact O-CD1 3.23Å; V235-W262 PolarHBondContact O-N 3.25Å; H236-W262 HydrophobicContact CB-CH2 4.45Å; H236-W262 HydrophobicContact CB-CZ2 3.91Å; H236-W262 AromaticContact CD2-CH2 3.27Å; H236-W262 WeakPolarHBondContact CD2-CH2 3.13Å; H236-W262 AromaticContact CD2-CZ2 3.63Å; H236-W262 AromaticContact CD2-CZ3 3.54Å; H236-W262 AromaticContact NE2-CZ3 3.99Å; A237-W262 WeakPolarHBondContact CB-O 3.22Å; A237-W262 PolarHBondContact N-O 2.95Å; T260-W262 PolarHBondContact O-N 2.98Å; W262-D288 WeakPolarHBondContact CA-O 3.32Å; W262-D288 HydrophobicContact CB-CB 4.25Å
263	Q	93.1	Very high	94	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.033	23%	0.23	C	C	.	.			trans	-101.4	142.1	171.7	69.7	172.5	58.4	0	0	111.4	P268 D288 I289 Y290	Q263-P268 HydrophobicContact CB-CG 4.35Å; Q263-D288 PolarHBondContact N-O 3.26Å; Q263-D288 VanDerWaalsContact N-O 3.14Å; Q263-I289 HydrophobicContact CB-CD1 3.88Å; Q263-I289 HydrophobicContact CG-CD1 4.31Å; Q263-I289 VanDerWaalsContact OE1-CG2 3.25Å; Q263-Y290 VanDerWaalsContact CD-CD2 3.46Å; Q263-Y290 HydrophobicContact CG-CD2 3.58Å; Q263-Y290 HydrophobicContact CG-CE2 3.45Å; Q263-Y290 VanDerWaalsContact CG-CE2 3.45Å; Q263-Y290 HydrophobicContact CG-CG 4.22Å
264	G	90.2	Very high	93.8	Very high	25 Å²	25	37.2 Å²	37.2	26%	0.258	22%	0.217	S	C	.	.			trans	-82.2	-146.5	164.8	0	0	0	0	0	111.1	D266	G264-D266 VanDerWaalsContact C-N 3.28Å; G264-D266 PolarHBondContact O-N 3.32Å
265	S	89.4	Confident	93.5	Very high	119 Å²	119	36.2 Å²	36.2	83%	0.832	21%	0.211	S	C	*	.	S	Bend	trans	-69.2	-27.8	174.8	-53	0	0	0	0	113
266	D	91	Very high	93.4	Very high	60 Å²	60	29.9 Å²	29.9	32%	0.321	17%	0.169	S	C	.	.	S	Bend	trans	-89.2	135	-179.8	-61.6	-76.6	0	0	0	111.3	Y202 P204 L238 G264	Y202-D266 HydrophobicContact CE1-CB 4.15Å; P204-D266 WeakPolarHBondContact CG-OD2 3.38Å; L238-D266 HydrophobicContact CD1-CB 3.5Å; G264-D266 VanDerWaalsContact C-N 3.28Å; G264-D266 PolarHBondContact O-N 3.32Å
267	H	91.8	Very high	93.1	Very high	97 Å²	97	28.6 Å²	28.6	45%	0.449	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-74.9	126.5	-179.9	-70.3	-89.7	0	0	0	111	T293	H267-T293 PolarHBondContact ND1-OG1 2.85Å
268	P	93.8	Very high	92.5	Very high	5 Å²	5	30 Å²	30	3%	0.032	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-67.8	155.7	169	28.7	-32	0	0	0	111.1	A237 L238 Q263 L273 I289 T293	A237-P268 HydrophobicContact CB-CB 3.71Å; A237-P268 HydrophobicContact CB-CG 3.81Å; L238-P268 HydrophobicContact CD2-CB 4.22Å; L238-P268 HydrophobicContact CG-CB 4.43Å; Q263-P268 HydrophobicContact CB-CG 4.35Å; P268-L273 HydrophobicContact CB-CD2 4.34Å; P268-L273 HydrophobicContact CB-CG 4.4Å; P268-L273 HydrophobicContact CG-CD1 4.22Å; P268-L273 HydrophobicContact CG-CD2 4.14Å; P268-L273 HydrophobicContact CG-CG 4.32Å; P268-I289 HydrophobicContact CG-CD1 4Å; P268-T293 HydrophobicContact CG-CG2 4.26Å; P268-T293 WeakPolarHBondContact O-CG2 3.02Å
269	T	91.9	Very high	91.8	Very high	71 Å²	71	30.3 Å²	30.3	44%	0.436	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-75.2	149	174.2	76.9	0	0	0	0	110	S271 D272 L273	T269-S271 PolarHBondContact O-N 3.43Å; T269-D272 PolarHBondContact O-N 3.37Å; T269-D272 PolarHBondContact OG1-N 3.5Å; T269-D272 PolarHBondContact OG1-OD2 3.24Å; T269-L273 PolarHBondContact O-N 2.99Å
270	V	93.1	Very high	91.2	Very high	42 Å²	42	31.1 Å²	31.1	26%	0.255	18%	0.178	S	C	.	.	H	α-helix	trans	-59.9	-31.3	172.8	170.3	0	0	0	0	110.9	L273 L274 A296 F297 A300	V270-L273 PolarHBondContact O-N 2.88Å; V270-L274 HydrophobicContact CG1-CD1 3.58Å; V270-L274 HydrophobicContact CG1-CG 4.16Å; V270-L274 WeakPolarHBondContact O-CB 3.45Å; V270-L274 WeakPolarHBondContact O-CD1 3.34Å; V270-L274 WeakPolarHBondContact O-CG 3.17Å; V270-L274 PolarHBondContact O-N 3.28Å; V270-A296 HydrophobicContact CG2-CB 3.88Å; V270-F297 HydrophobicContact CG1-CD2 4.5Å; V270-F297 HydrophobicContact CG2-CB 4.5Å; V270-A300 HydrophobicContact CG1-CB 3.64Å
271	S	88.3	Confident	90.7	Very high	23 Å²	23	36.1 Å²	36.1	16%	0.161	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-45.3	176.5	-167	0	0	0	0	112.1	T269 L273 L274 F275 E417	T269-S271 PolarHBondContact O-N 3.43Å; S271-L273 VanDerWaalsContact C-N 3.32Å; S271-L273 PolarHBondContact O-N 3.09Å; S271-L274 PolarHBondContact O-N 3.41Å; S271-F275 WeakPolarHBondContact O-CB 3.32Å; S271-F275 PolarHBondContact O-N 3.28Å; S271-E417 VanDerWaalsContact CB-OE1 3.27Å; S271-E417 WeakPolarHBondContact CB-OE1 3.48Å; S271-E417 PolarHBondContact OG-OE1 2.9Å; S271-E417 PolarHBondContact OG-OE2 2.73Å
272	D	89	Confident	90.4	Very high	27 Å²	27	37 Å²	37	14%	0.144	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-40.8	177.5	-61.8	-42.5	0	0	0	111.9	H241 T269 F275 V276	H241-D272 IonicContact CG-OD1 3.79Å; H241-D272 IonicContact ND1-OD1 2.73Å; H241-D272 PolarHBondContact ND1-OD1 3.17Å; T269-D272 PolarHBondContact O-N 3.37Å; T269-D272 PolarHBondContact OG1-N 3.5Å; T269-D272 PolarHBondContact OG1-OD2 3.24Å; D272-F275 WeakPolarHBondContact O-CB 3.33Å; D272-F275 PolarHBondContact O-N 3.37Å; D272-V276 PolarHBondContact O-N 2.98Å; D272-V276 VanDerWaalsContact O-N 3.13Å
273	L	94.6	Very high	90.3	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-42	178.2	-62.7	177.4	0	0	0	111.8	A237 L261 P268 T269 V270 S271 F275 V276 R277 Y287 I289 T293 F297	A237-L273 HydrophobicContact CB-CD2 4.31Å; L261-L273 HydrophobicContact CD1-CD2 3.81Å; P268-L273 HydrophobicContact CB-CD2 4.34Å; P268-L273 HydrophobicContact CB-CG 4.4Å; P268-L273 HydrophobicContact CG-CD1 4.22Å; P268-L273 HydrophobicContact CG-CD2 4.14Å; P268-L273 HydrophobicContact CG-CG 4.32Å; T269-L273 PolarHBondContact O-N 2.99Å; V270-L273 PolarHBondContact O-N 2.88Å; S271-L273 VanDerWaalsContact C-N 3.32Å; S271-L273 PolarHBondContact O-N 3.09Å; L273-F275 VanDerWaalsContact C-N 3.31Å; L273-V276 PolarHBondContact O-N 3.25Å; L273-R277 PolarHBondContact O-N 3.18Å; L273-Y287 HydrophobicContact CD2-CD1 4.43Å; L273-I289 HydrophobicContact CD1-CG1 4.46Å; L273-I289 HydrophobicContact CD1-CG2 4.11Å; L273-I289 HydrophobicContact CD2-CD1 4.02Å; L273-I289 HydrophobicContact CD2-CG1 4.15Å; L273-T293 HydrophobicContact CD1-CG2 3.87Å; L273-F297 HydrophobicContact CB-CD1 4.1Å; L273-F297 HydrophobicContact CB-CD2 3.63Å; L273-F297 HydrophobicContact CB-CE1 4.01Å; L273-F297 HydrophobicContact CB-CE2 3.55Å; L273-F297 HydrophobicContact CB-CG 3.92Å; L273-F297 HydrophobicContact CB-CZ 3.75Å; L273-F297 HydrophobicContact CD1-CB 3.91Å; L273-F297 HydrophobicContact CD1-CD1 3.84Å; L273-F297 HydrophobicContact CD1-CD2 4.28Å; L273-F297 HydrophobicContact CD1-CE1 4.43Å; L273-F297 HydrophobicContact CD1-CG 3.75Å
274	L	90.8	Very high	90.4	Very high	10 Å²	10	37.7 Å²	37.7	5%	0.052	22%	0.219	C	C	.	.	H	α-helix	trans	-66.8	-34.5	174.6	-73.4	167.7	0	0	0	111.9	V270 S271 R277 D278 F297 A300 A301	V270-L274 HydrophobicContact CG1-CD1 3.58Å; V270-L274 HydrophobicContact CG1-CG 4.16Å; V270-L274 WeakPolarHBondContact O-CB 3.45Å; V270-L274 WeakPolarHBondContact O-CD1 3.34Å; V270-L274 WeakPolarHBondContact O-CG 3.17Å; V270-L274 PolarHBondContact O-N 3.28Å; S271-L274 PolarHBondContact O-N 3.41Å; L274-R277 PolarHBondContact O-N 2.94Å; L274-D278 VanDerWaalsContact O-CB 3.25Å; L274-D278 WeakPolarHBondContact O-CB 3.18Å; L274-D278 VanDerWaalsContact O-CG 3.25Å; L274-D278 PolarHBondContact O-N 3.39Å; L274-F297 HydrophobicContact CB-CE2 4.5Å; L274-F297 HydrophobicContact CD2-CD2 4.06Å; L274-F297 HydrophobicContact CD2-CE2 3.69Å; L274-F297 HydrophobicContact CG-CD2 4Å; L274-F297 HydrophobicContact CG-CE2 3.83Å; L274-A300 HydrophobicContact CD1-CB 3.87Å; L274-A301 HydrophobicContact CD2-CB 4.28Å
275	F	88.9	Confident	90.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.7	-49.6	173.2	169.8	-86.2	0	0	0	110.2	H241 W244 S271 D272 L273 D278 N279 F310 P312 Y414	H241-F275 HydrophobicContact CB-CD1 4.43Å; H241-F275 AromaticContact CD2-CD1 3.37Å; H241-F275 WeakPolarHBondContact CD2-CD1 3.37Å; H241-F275 AromaticContact CD2-CD2 3.55Å; H241-F275 AromaticContact CD2-CE1 3.39Å; H241-F275 WeakPolarHBondContact CD2-CE1 3.4Å; H241-F275 AromaticContact CD2-CE2 3.59Å; H241-F275 AromaticContact CD2-CG 3.47Å; H241-F275 VanDerWaalsContact CD2-CG 3.47Å; H241-F275 WeakPolarHBondContact CD2-CG 3.28Å; H241-F275 AromaticContact CD2-CZ 3.5Å; H241-F275 AromaticContact NE2-CD1 3.97Å; H241-F275 AromaticContact NE2-CD2 3.25Å; H241-F275 VanDerWaalsContact NE2-CD2 3.25Å; H241-F275 WeakPolarHBondContact NE2-CD2 3.42Å; H241-F275 AromaticContact NE2-CE2 3.46Å; H241-F275 WeakPolarHBondContact NE2-CE2 3.44Å; H241-F275 AromaticContact NE2-CG 3.56Å; H241-F275 AromaticContact NE2-CZ 3.88Å; W244-F275 HydrophobicContact CB-CE1 3.66Å; W244-F275 HydrophobicContact CB-CZ 3.91Å; W244-F275 AromaticContact CD1-CE1 3.73Å; W244-F275 AromaticContact CD1-CZ 3.5Å; W244-F275 AromaticContact CD2-CE1 3.53Å; W244-F275 HydrophobicContact CD2-CE1 3.53Å; W244-F275 HydrophobicContact CD2-CZ 4.13Å; W244-F275 HydrophobicContact CE3-CE1 4.06Å; W244-F275 AromaticContact CG-CE1 3.31Å; W244-F275 HydrophobicContact CG-CE1 3.31Å; W244-F275 AromaticContact CG-CZ 3.53Å; W244-F275 HydrophobicContact CG-CZ 3.53Å; S271-F275 WeakPolarHBondContact O-CB 3.32Å; S271-F275 PolarHBondContact O-N 3.28Å; D272-F275 WeakPolarHBondContact O-CB 3.33Å; D272-F275 PolarHBondContact O-N 3.37Å; L273-F275 VanDerWaalsContact C-N 3.31Å; F275-D278 PolarHBondContact O-N 3.33Å; F275-N279 VanDerWaalsContact CE2-ND2 3.28Å; F275-N279 WeakPolarHBondContact CE2-ND2 3.46Å; F275-N279 WeakPolarHBondContact CZ-ND2 2.92Å; F275-N279 WeakPolarHBondContact O-CB 3.03Å; F275-N279 VanDerWaalsContact O-CG 3.31Å; F275-N279 PolarHBondContact O-N 3.01Å; F275-N279 PolarHBondContact O-ND2 2.88Å; F275-F310 HydrophobicContact CB-CD2 3.99Å; F275-F310 HydrophobicContact CB-CE2 4.15Å; F275-F310 HydrophobicContact CB-CG 4.37Å; F275-F310 HydrophobicContact CD2-CB 3.45Å; F275-F310 VanDerWaalsContact CD2-CB 3.45Å; F275-F310 AromaticContact CD2-CD1 3.74Å; F275-F310 HydrophobicContact CD2-CD1 3.74Å; F275-F310 AromaticContact CD2-CD2 3.92Å; F275-F310 HydrophobicContact CD2-CD2 3.92Å; F275-F310 HydrophobicContact CD2-CE1 4.45Å; F275-F310 AromaticContact CD2-CG 3.42Å; F275-F310 HydrophobicContact CD2-CG 3.42Å; F275-F310 VanDerWaalsContact CD2-CG 3.42Å; F275-F310 HydrophobicContact CE2-CB 3.72Å; F275-F310 HydrophobicContact CE2-CD1 4.38Å; F275-F310 HydrophobicContact CE2-CG 4.14Å; F275-F310 HydrophobicContact CG-CD2 4.43Å; F275-F310 HydrophobicContact CG-CG 4.35Å; F275-P312 HydrophobicContact CZ-CB 4.33Å; F275-Y414 HydrophobicContact CE2-CE2 4.32Å; F275-Y414 AromaticContact CE2-CZ 3.97Å; F275-Y414 WeakPolarHBondContact CE2-OH 3.47Å; F275-Y414 WeakPolarHBondContact CZ-OH 3.34Å
276	V	91.9	Very high	91.1	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-47.2	177.2	176.7	0	0	0	0	110.4	V240 W244 L259 L261 D272 L273 D278 N279 T280 V285	V240-V276 HydrophobicContact CB-CG2 4.49Å; V240-V276 HydrophobicContact CG1-CG2 3.58Å; V240-V276 HydrophobicContact CG2-CG2 4.04Å; W244-V276 HydrophobicContact CE3-CG2 4.24Å; W244-V276 HydrophobicContact CH2-CG1 3.99Å; W244-V276 HydrophobicContact CZ3-CB 4.31Å; W244-V276 HydrophobicContact CZ3-CG1 3.8Å; W244-V276 HydrophobicContact CZ3-CG2 3.97Å; L259-V276 HydrophobicContact CD2-CG1 3.85Å; L261-V276 HydrophobicContact CD1-CB 3.86Å; L261-V276 HydrophobicContact CD1-CG1 3.91Å; L261-V276 HydrophobicContact CD1-CG2 3.87Å; L261-V276 HydrophobicContact CD2-CG1 4.29Å; L261-V276 HydrophobicContact CD2-CG2 4.29Å; L261-V276 HydrophobicContact CG-CG1 4.35Å; D272-V276 PolarHBondContact O-N 2.98Å; D272-V276 VanDerWaalsContact O-N 3.13Å; L273-V276 PolarHBondContact O-N 3.25Å; V276-D278 VanDerWaalsContact C-N 3.31Å; V276-D278 PolarHBondContact O-N 2.85Å; V276-N279 CarbonylContact O-C 3.52Å; V276-N279 WeakPolarHBondContact O-CA 3.38Å; V276-N279 PolarHBondContact O-N 2.91Å; V276-T280 HydrophobicContact CG1-CG2 4.03Å; V276-T280 PolarHBondContact O-N 2.91Å; V276-T280 VanDerWaalsContact O-N 3.11Å; V276-T280 PolarHBondContact O-OG1 3.12Å; V276-V285 HydrophobicContact CG1-CG2 4.07Å
277	R	91	Very high	91.4	Very high	41 Å²	41	28.3 Å²	28.3	16%	0.155	15%	0.153	C	C	.	.	H	α-helix	trans	-55.7	-43.9	179.7	-172.5	173.4	174.6	80.2	-3.1	112.8	D54 L273 L274 N279 T280 Y287 F297	D54-R277 IonicContact OD1-CZ 2.94Å; D54-R277 IonicContact OD1-NH1 2.69Å; D54-R277 PolarHBondContact OD1-NH1 2.68Å; D54-R277 IonicContact OD2-CZ 2.93Å; D54-R277 VanDerWaalsContact OD2-CZ 3.32Å; D54-R277 IonicContact OD2-NH1 2.63Å; D54-R277 PolarHBondContact OD2-NH1 3.16Å; D54-R277 IonicContact OD2-NH2 3.83Å; D54-R277 PolarHBondContact OD2-NH2 3.27Å; L273-R277 PolarHBondContact O-N 3.18Å; L274-R277 PolarHBondContact O-N 2.94Å; R277-N279 PolarHBondContact O-N 3.23Å; R277-T280 PolarHBondContact O-N 3Å; R277-T280 VanDerWaalsContact O-O 3.13Å; R277-Y287 WeakPolarHBondContact CB-OH 3.43Å; R277-F297 HydrophobicContact CB-CZ 4.24Å
278	D	84.5	Confident	91.6	Very high	33 Å²	33	23.8 Å²	23.8	18%	0.176	13%	0.133	C	C	.	.	H	α-helix	trans	-64.5	-17.3	178.6	-82.5	2.6	0	0	0	112.9	L274 F275 V276 R304 R308 R309	L274-D278 VanDerWaalsContact O-CB 3.25Å; L274-D278 WeakPolarHBondContact O-CB 3.18Å; L274-D278 VanDerWaalsContact O-CG 3.25Å; L274-D278 PolarHBondContact O-N 3.39Å; F275-D278 PolarHBondContact O-N 3.33Å; V276-D278 VanDerWaalsContact C-N 3.31Å; V276-D278 PolarHBondContact O-N 2.85Å; D278-R304 IonicContact OD1-NH1 2.74Å; D278-R304 PolarHBondContact OD1-NH1 3.47Å; D278-R304 IonicContact OD2-CZ 2.67Å; D278-R304 IonicContact OD2-NH1 2.74Å; D278-R304 PolarHBondContact OD2-NH1 2.87Å; D278-R308 HydrophobicContact CB-CG 4.14Å; D278-R308 WeakPolarHBondContact O-CD 3.17Å; D278-R308 PolarHBondContact O-NE 3.09Å; D278-R308 VanDerWaalsContact O-NE 3.13Å; D278-R309 PolarHBondContact OD2-N 3.02Å
279	N	84.4	Confident	91.7	Very high	20 Å²	20	23.9 Å²	23.9	11%	0.107	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	7.5	-171.4	-66.1	-48.6	0	0	0	113.7	W244 F275 V276 R277 R308 F310 P312	W244-N279 HydrophobicContact CH2-CB 4.33Å; W244-N279 HydrophobicContact CZ2-CB 3.4Å; W244-N279 VanDerWaalsContact CZ2-CB 3.4Å; F275-N279 VanDerWaalsContact CE2-ND2 3.28Å; F275-N279 WeakPolarHBondContact CE2-ND2 3.46Å; F275-N279 WeakPolarHBondContact CZ-ND2 2.92Å; F275-N279 WeakPolarHBondContact O-CB 3.03Å; F275-N279 VanDerWaalsContact O-CG 3.31Å; F275-N279 PolarHBondContact O-N 3.01Å; F275-N279 PolarHBondContact O-ND2 2.88Å; V276-N279 CarbonylContact O-C 3.52Å; V276-N279 WeakPolarHBondContact O-CA 3.38Å; V276-N279 PolarHBondContact O-N 2.91Å; R277-N279 PolarHBondContact O-N 3.23Å; N279-R308 VanDerWaalsContact OD1-CZ 3.28Å; N279-R308 PolarHBondContact OD1-NE 3.32Å; N279-R308 VanDerWaalsContact OD1-NE 3.09Å; N279-R308 PolarHBondContact OD1-NH2 3.33Å; N279-F310 PolarHBondContact OD1-O 2.91Å; N279-P312 HydrophobicContact CB-CG 4.18Å; N279-P312 WeakPolarHBondContact OD1-CD 3.47Å; N279-P312 WeakPolarHBondContact OD1-CG 3.25Å
280	T	86.5	Confident	91.7	Very high	17 Å²	17	23.3 Å²	23.3	10%	0.104	12%	0.123	C	C	.	.	S	Bend	trans	-133.2	156.9	176.9	52.8	0	0	0	0	111	W244 L251 V276 R277 V285	W244-T280 HydrophobicContact CH2-CG2 3.46Å; W244-T280 VanDerWaalsContact CH2-CG2 3.46Å; W244-T280 HydrophobicContact CZ2-CG2 4.09Å; L251-T280 HydrophobicContact CD1-CG2 4.15Å; V276-T280 HydrophobicContact CG1-CG2 4.03Å; V276-T280 PolarHBondContact O-N 2.91Å; V276-T280 VanDerWaalsContact O-N 3.11Å; V276-T280 PolarHBondContact O-OG1 3.12Å; R277-T280 PolarHBondContact O-N 3Å; R277-T280 VanDerWaalsContact O-O 3.13Å; T280-V285 WeakPolarHBondContact OG1-CG1 3.39Å
281	Q	87	Confident	91.7	Very high	105 Å²	105	26 Å²	26	49%	0.491	13%	0.133	S	C	.	.			trans	-69.3	144.6	163.4	-64.1	-178.3	37.7	0	0	109.9	A283 Q284	Q281-A283 VanDerWaalsContact C-N 3.26Å; Q281-A283 PolarHBondContact O-N 3.44Å; Q281-Q284 HydrophobicContact CB-CB 4.03Å; Q281-Q284 WeakPolarHBondContact O-CA 3.39Å; Q281-Q284 VanDerWaalsContact O-CB 3.29Å; Q281-Q284 WeakPolarHBondContact O-CB 3.25Å; Q281-Q284 PolarHBondContact O-N 2.8Å
282	P	91	Very high	92	Very high	19 Å²	19	29.3 Å²	29.3	12%	0.123	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-58.7	-36.6	-177.8	-21.8	31.3	0	0	0	113.5	D54 G55 Q284 W326	D54-P282 HydrophobicContact CB-CB 4.06Å; G55-P282 PolarHBondContact N-O 3.02Å; P282-Q284 PolarHBondContact O-N 2.97Å; P282-W326 HydrophobicContact CB-CE3 4.05Å; P282-W326 HydrophobicContact CB-CH2 3.79Å; P282-W326 HydrophobicContact CB-CZ2 4.48Å; P282-W326 HydrophobicContact CB-CZ3 3.53Å; P282-W326 HydrophobicContact CG-CD2 3.77Å; P282-W326 HydrophobicContact CG-CE3 3.47Å; P282-W326 VanDerWaalsContact CG-CE3 3.47Å; P282-W326 HydrophobicContact CG-CH2 2.95Å; P282-W326 HydrophobicContact CG-CZ2 3.25Å; P282-W326 HydrophobicContact CG-CZ3 3.06Å
283	A	93.9	Very high	92.3	Very high	41 Å²	41	28.7 Å²	28.7	34%	0.339	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-75.2	-10.7	175.8	0	0	0	0	0	113.5	L41 H53 Q281	L41-A283 HydrophobicContact CD1-CB 3.97Å; H53-A283 HydrophobicContact CB-CB 4.09Å; H53-A283 WeakPolarHBondContact O-CB 3.37Å; H53-A283 PolarHBondContact O-N 2.85Å; Q281-A283 VanDerWaalsContact C-N 3.26Å; Q281-A283 PolarHBondContact O-N 3.44Å
284	Q	94.9	Very high	92.4	Very high	36 Å²	36	29.5 Å²	29.5	17%	0.168	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-96.7	-4	-175.7	-162.5	179.1	29.8	0	0	112.8	F257 S258 L259 Q281 P282	F257-Q284 WeakPolarHBondContact O-CG 3.37Å; F257-Q284 PolarHBondContact O-NE2 3.04Å; F257-Q284 VanDerWaalsContact O-NE2 3.08Å; S258-Q284 CarbonylContact C-O 3.48Å; S258-Q284 VanDerWaalsContact CA-O 3.25Å; S258-Q284 WeakPolarHBondContact CA-O 3.5Å; S258-Q284 VanDerWaalsContact CB-O 3.26Å; S258-Q284 WeakPolarHBondContact CB-O 3.32Å; L259-Q284 PolarHBondContact N-O 3.07Å; Q281-Q284 HydrophobicContact CB-CB 4.03Å; Q281-Q284 WeakPolarHBondContact O-CA 3.39Å; Q281-Q284 VanDerWaalsContact O-CB 3.29Å; Q281-Q284 WeakPolarHBondContact O-CB 3.25Å; Q281-Q284 PolarHBondContact O-N 2.8Å; P282-Q284 PolarHBondContact O-N 2.97Å
285	V	97.1	Very high	92.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	131.6	-178.3	58.6	0	0	0	0	112.1	G55 L259 L261 V276 T280 Y287	G55-V285 WeakPolarHBondContact CA-O 3.32Å; L259-V285 HydrophobicContact CB-CB 4.35Å; L259-V285 HydrophobicContact CB-CG2 4.2Å; L259-V285 HydrophobicContact CD2-CG2 4.33Å; L259-V285 CarbonylContact O-C 3.44Å; L259-V285 WeakPolarHBondContact O-CA 3.46Å; L261-V285 HydrophobicContact CG-CG2 4.14Å; V276-V285 HydrophobicContact CG1-CG2 4.07Å; T280-V285 WeakPolarHBondContact OG1-CG1 3.39Å; V285-Y287 HydrophobicContact CB-CE2 4.45Å; V285-Y287 HydrophobicContact CG1-CE2 3.79Å; V285-Y287 VanDerWaalsContact CG1-OH 3.28Å; V285-Y287 WeakPolarHBondContact CG1-OH 3.49Å; V285-Y287 HydrophobicContact CG2-CE1 4Å; V285-Y287 HydrophobicContact CG2-CE2 4.03Å
286	Y	98.1	Very high	93	Very high	2 Å²	2	34 Å²	34	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	153.6	173	-59.6	-97.5	0	0	0	110.1	M40 L41 A58 W60 W158 L259 T260 L261	M40-Y286 HydrophobicContact CB-CE1 3.98Å; M40-Y286 HydrophobicContact CG-CE1 4.19Å; L41-Y286 HydrophobicContact CD1-CE1 4.29Å; L41-Y286 HydrophobicContact CD2-CD1 4.35Å; L41-Y286 HydrophobicContact CD2-CE1 3.63Å; L41-Y286 HydrophobicContact CG-CE1 3.72Å; A58-Y286 HydrophobicContact CB-CD1 4.22Å; W60-Y286 AromaticContact CZ2-CD1 3.84Å; W60-Y286 HydrophobicContact CZ2-CD1 3.84Å; W60-Y286 HydrophobicContact CZ2-CG 4.1Å; W158-Y286 HydrophobicContact CH2-CD1 4.03Å; W158-Y286 AromaticContact CH2-CD2 3.69Å; W158-Y286 HydrophobicContact CH2-CD2 3.69Å; W158-Y286 AromaticContact CH2-CE1 3.92Å; W158-Y286 HydrophobicContact CH2-CE1 3.92Å; W158-Y286 AromaticContact CH2-CE2 3.61Å; W158-Y286 HydrophobicContact CH2-CE2 3.61Å; W158-Y286 AromaticContact CH2-CG 3.91Å; W158-Y286 HydrophobicContact CH2-CG 3.91Å; W158-Y286 AromaticContact CH2-CZ 3.71Å; W158-Y286 HydrophobicContact CZ2-CE1 4.15Å; W158-Y286 HydrophobicContact CZ2-CE2 4.05Å; W158-Y286 AromaticContact CZ2-CZ 3.81Å; L259-Y286 PolarHBondContact O-N 2.92Å; T260-Y286 WeakPolarHBondContact CA-O 3.39Å; L261-Y286 PolarHBondContact N-O 2.95Å
287	Y	97.5	Very high	93.2	Very high	4 Å²	4	34 Å²	34	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	96.3	-174.4	-58.1	-90.7	0	0	0	111.1	L56 L261 L273 R277 V285 I289 F297	L56-Y287 HydrophobicContact CB-CD2 4.01Å; L56-Y287 HydrophobicContact CB-CE2 3.93Å; L56-Y287 HydrophobicContact CD1-CD2 4.11Å; L56-Y287 HydrophobicContact CD1-CE2 4.48Å; L56-Y287 HydrophobicContact CD1-CG 4.42Å; L261-Y287 HydrophobicContact CB-CD1 4.29Å; L261-Y287 HydrophobicContact CD1-CD1 3.82Å; L261-Y287 HydrophobicContact CD1-CE1 3.66Å; L261-Y287 HydrophobicContact CG-CD1 4.31Å; L261-Y287 HydrophobicContact CG-CE1 4.39Å; L273-Y287 HydrophobicContact CD2-CD1 4.43Å; R277-Y287 WeakPolarHBondContact CB-OH 3.43Å; V285-Y287 HydrophobicContact CB-CE2 4.45Å; V285-Y287 HydrophobicContact CG1-CE2 3.79Å; V285-Y287 VanDerWaalsContact CG1-OH 3.28Å; V285-Y287 WeakPolarHBondContact CG1-OH 3.49Å; V285-Y287 HydrophobicContact CG2-CE1 4Å; V285-Y287 HydrophobicContact CG2-CE2 4.03Å; Y287-I289 PolarHBondContact O-N 3.22Å; Y287-I289 VanDerWaalsContact O-N 3.11Å; Y287-F297 HydrophobicContact CD1-CD1 4.42Å; Y287-F297 AromaticContact CD1-CE1 3.51Å; Y287-F297 HydrophobicContact CD1-CE1 3.51Å; Y287-F297 HydrophobicContact CD1-CZ 4.15Å; Y287-F297 HydrophobicContact CD2-CE1 4.28Å; Y287-F297 AromaticContact CE1-CE1 3.44Å; Y287-F297 HydrophobicContact CE1-CE1 3.44Å; Y287-F297 VanDerWaalsContact CE1-CE1 3.44Å; Y287-F297 AromaticContact CE1-CZ 3.59Å; Y287-F297 HydrophobicContact CE1-CZ 3.59Å; Y287-F297 HydrophobicContact CE2-CE1 4.22Å; Y287-F297 HydrophobicContact CE2-CZ 4.5Å; Y287-F297 AromaticContact CG-CE1 3.93Å; Y287-F297 HydrophobicContact CG-CE1 3.93Å; Y287-F297 AromaticContact CZ-CE1 3.8Å; Y287-F297 AromaticContact CZ-CZ 3.78Å
288	D	95.9	Very high	93.4	Very high	3 Å²	3	34 Å²	34	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	68.9	169.6	-166	12	0	0	0	109.1	W60 H62 T260 L261 W262 Q263 Y290	W60-D288 WeakPolarHBondContact CB-OD1 3.25Å; W60-D288 HydrophobicContact CG-CB 4.27Å; H62-D288 IonicContact ND1-OD2 3.69Å; T260-D288 HydrophobicContact CG2-CB 4.23Å; L261-D288 WeakPolarHBondContact O-CA 3.26Å; L261-D288 PolarHBondContact O-N 3.1Å; W262-D288 WeakPolarHBondContact CA-O 3.32Å; W262-D288 HydrophobicContact CB-CB 4.25Å; Q263-D288 PolarHBondContact N-O 3.26Å; Q263-D288 VanDerWaalsContact N-O 3.14Å; D288-Y290 WeakPolarHBondContact OD1-CE1 3.26Å; D288-Y290 PolarHBondContact OD1-OH 3.01Å
289	I	95.6	Very high	93.9	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	21%	0.205	C	C	.	.			trans	-123.5	136.8	-171.6	-57.3	-58.9	0	0	0	108.1	A237 Q263 P268 L273 Y287 T293 L294	A237-I289 HydrophobicContact CB-CD1 4.05Å; Q263-I289 HydrophobicContact CB-CD1 3.88Å; Q263-I289 HydrophobicContact CG-CD1 4.31Å; Q263-I289 VanDerWaalsContact OE1-CG2 3.25Å; P268-I289 HydrophobicContact CG-CD1 4Å; L273-I289 HydrophobicContact CD1-CG1 4.46Å; L273-I289 HydrophobicContact CD1-CG2 4.11Å; L273-I289 HydrophobicContact CD2-CD1 4.02Å; L273-I289 HydrophobicContact CD2-CG1 4.15Å; Y287-I289 PolarHBondContact O-N 3.22Å; Y287-I289 VanDerWaalsContact O-N 3.11Å; I289-T293 HydrophobicContact CG2-CG2 3.98Å; I289-L294 HydrophobicContact CB-CD1 4.4Å; I289-L294 HydrophobicContact CG2-CB 4.26Å
290	Y	91.5	Very high	94.2	Very high	59 Å²	59	38.1 Å²	38.1	23%	0.231	21%	0.211	C	C	.	.			trans	-105.1	165.6	-173.5	-42.6	-47	0	0	0	112.1	H62 Q263 D288 T293 L294	H62-Y290 HydrophobicContact CB-CE1 3.47Å; H62-Y290 VanDerWaalsContact CB-CE1 3.47Å; H62-Y290 HydrophobicContact CB-CE2 4.42Å; H62-Y290 VanDerWaalsContact CB-CZ 3.42Å; H62-Y290 WeakPolarHBondContact CB-OH 3.16Å; H62-Y290 AromaticContact CD2-CE2 3.96Å; H62-Y290 AromaticContact CD2-CZ 3.58Å; H62-Y290 PolarHBondContact CD2-OH 2.73Å; H62-Y290 AromaticContact CG-CZ 3.59Å; H62-Y290 PolarHBondContact ND1-OH 3.38Å; Q263-Y290 VanDerWaalsContact CD-CD2 3.46Å; Q263-Y290 HydrophobicContact CG-CD2 3.58Å; Q263-Y290 HydrophobicContact CG-CE2 3.45Å; Q263-Y290 VanDerWaalsContact CG-CE2 3.45Å; Q263-Y290 HydrophobicContact CG-CG 4.22Å; D288-Y290 WeakPolarHBondContact OD1-CE1 3.26Å; D288-Y290 PolarHBondContact OD1-OH 3.01Å; Y290-T293 PolarHBondContact O-N 3.45Å; Y290-L294 PolarHBondContact O-N 3.4Å; Y290-L294 VanDerWaalsContact O-N 3.13Å
291	E	93.1	Very high	94.4	Very high	98 Å²	98	38 Å²	38	46%	0.458	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	149.4	175.7	-62.4	-58.1	166.4	0	0	112	T295	E291-T295 PolarHBondContact OE1-OG1 2.96Å; E291-T295 WeakPolarHBondContact OE2-CB 3.47Å; E291-T295 PolarHBondContact OE2-N 3.13Å; E291-T295 PolarHBondContact OE2-OG1 3.39Å
292	P	94.9	Very high	94.5	Very high	94 Å²	94	42.1 Å²	42.1	61%	0.61	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	cis	-85.7	-2.6	2.4	34.8	-36.4	0	0	0	114.6	L294 T295 A296	P292-L294 VanDerWaalsContact C-N 3.34Å; P292-L294 PolarHBondContact O-N 3.39Å; P292-T295 PolarHBondContact O-N 2.91Å; P292-A296 PolarHBondContact O-N 2.95Å
293	T	96.2	Very high	94	Very high	14 Å²	14	47.8 Å²	47.8	9%	0.086	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-38.9	-175.3	-57.8	0	0	0	0	112	H267 P268 L273 I289 Y290 T295 A296 F297	H267-T293 PolarHBondContact ND1-OG1 2.85Å; P268-T293 HydrophobicContact CG-CG2 4.26Å; P268-T293 WeakPolarHBondContact O-CG2 3.02Å; L273-T293 HydrophobicContact CD1-CG2 3.87Å; I289-T293 HydrophobicContact CG2-CG2 3.98Å; Y290-T293 PolarHBondContact O-N 3.45Å; T293-T295 PolarHBondContact O-N 2.68Å; T293-A296 PolarHBondContact O-N 3.06Å; T293-F297 VanDerWaalsContact O-CB 3.3Å; T293-F297 WeakPolarHBondContact O-CB 3.3Å; T293-F297 PolarHBondContact O-N 3.29Å
294	L	95.4	Very high	93	Very high	17 Å²	17	47.9 Å²	47.9	9%	0.089	24%	0.244	C	C	.	.	H	α-helix	trans	-60	-46.6	179.4	-178.4	63	0	0	0	112.1	L56 I289 Y290 P292 F297 K298	L56-L294 HydrophobicContact CD1-CD1 4.27Å; I289-L294 HydrophobicContact CB-CD1 4.4Å; I289-L294 HydrophobicContact CG2-CB 4.26Å; Y290-L294 PolarHBondContact O-N 3.4Å; Y290-L294 VanDerWaalsContact O-N 3.13Å; P292-L294 VanDerWaalsContact C-N 3.34Å; P292-L294 PolarHBondContact O-N 3.39Å; L294-F297 PolarHBondContact O-N 3.08Å; L294-K298 HydrophobicContact CD1-CD 4.37Å; L294-K298 HydrophobicContact CD1-CG 4.42Å; L294-K298 HydrophobicContact CG-CD 4.24Å; L294-K298 WeakPolarHBondContact O-CB 3.49Å; L294-K298 WeakPolarHBondContact O-CG 3.31Å; L294-K298 PolarHBondContact O-N 3.09Å
295	T	95.8	Very high	91.4	Very high	63 Å²	63	50.9 Å²	50.9	39%	0.387	27%	0.269	S	S	.	.	H	α-helix	trans	-60.1	-50.6	176.3	-68.3	0	0	0	0	111.4	E291 P292 T293 F297 K298 E299	E291-T295 PolarHBondContact OE1-OG1 2.96Å; E291-T295 WeakPolarHBondContact OE2-CB 3.47Å; E291-T295 PolarHBondContact OE2-N 3.13Å; E291-T295 PolarHBondContact OE2-OG1 3.39Å; P292-T295 PolarHBondContact O-N 2.91Å; T293-T295 PolarHBondContact O-N 2.68Å; T295-F297 VanDerWaalsContact C-N 3.26Å; T295-F297 PolarHBondContact O-N 2.89Å; T295-K298 PolarHBondContact O-N 3.16Å; T295-E299 WeakPolarHBondContact O-CG 3.23Å; T295-E299 PolarHBondContact O-N 3.22Å
296	A	96.4	Very high	89.6	Confident	41 Å²	41	52.8 Å²	52.8	34%	0.339	29%	0.289	S	S	.	.	H	α-helix	trans	-59.7	-38.7	179.4	0	0	0	0	0	112.1	V270 P292 T293 A300	V270-A296 HydrophobicContact CG2-CB 3.88Å; P292-A296 PolarHBondContact O-N 2.95Å; T293-A296 PolarHBondContact O-N 3.06Å; A296-A300 WeakPolarHBondContact O-CB 2.91Å; A296-A300 PolarHBondContact O-N 3.09Å
297	F	96.1	Very high	87.9	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66.5	-45.6	176.1	175.9	-136.2	0	0	0	112.2	L56 V270 L273 L274 R277 Y287 T293 L294 T295 E299 A300 A301	L56-F297 HydrophobicContact CD1-CD1 3.5Å; L56-F297 VanDerWaalsContact CD1-CD1 3.5Å; L56-F297 HydrophobicContact CD1-CE1 3.35Å; L56-F297 HydrophobicContact CD1-CZ 4.29Å; L56-F297 HydrophobicContact CD2-CE1 4.17Å; L56-F297 HydrophobicContact CD2-CZ 4.35Å; L56-F297 HydrophobicContact CG-CE1 4.33Å; V270-F297 HydrophobicContact CG1-CD2 4.5Å; V270-F297 HydrophobicContact CG2-CB 4.5Å; L273-F297 HydrophobicContact CB-CD1 4.1Å; L273-F297 HydrophobicContact CB-CD2 3.63Å; L273-F297 HydrophobicContact CB-CE1 4.01Å; L273-F297 HydrophobicContact CB-CE2 3.55Å; L273-F297 HydrophobicContact CB-CG 3.92Å; L273-F297 HydrophobicContact CB-CZ 3.75Å; L273-F297 HydrophobicContact CD1-CB 3.91Å; L273-F297 HydrophobicContact CD1-CD1 3.84Å; L273-F297 HydrophobicContact CD1-CD2 4.28Å; L273-F297 HydrophobicContact CD1-CE1 4.43Å; L273-F297 HydrophobicContact CD1-CG 3.75Å; L274-F297 HydrophobicContact CB-CE2 4.5Å; L274-F297 HydrophobicContact CD2-CD2 4.06Å; L274-F297 HydrophobicContact CD2-CE2 3.69Å; L274-F297 HydrophobicContact CG-CD2 4Å; L274-F297 HydrophobicContact CG-CE2 3.83Å; R277-F297 HydrophobicContact CB-CZ 4.24Å; Y287-F297 HydrophobicContact CD1-CD1 4.42Å; Y287-F297 AromaticContact CD1-CE1 3.51Å; Y287-F297 HydrophobicContact CD1-CE1 3.51Å; Y287-F297 HydrophobicContact CD1-CZ 4.15Å; Y287-F297 HydrophobicContact CD2-CE1 4.28Å; Y287-F297 AromaticContact CE1-CE1 3.44Å; Y287-F297 HydrophobicContact CE1-CE1 3.44Å; Y287-F297 VanDerWaalsContact CE1-CE1 3.44Å; Y287-F297 AromaticContact CE1-CZ 3.59Å; Y287-F297 HydrophobicContact CE1-CZ 3.59Å; Y287-F297 HydrophobicContact CE2-CE1 4.22Å; Y287-F297 HydrophobicContact CE2-CZ 4.5Å; Y287-F297 AromaticContact CG-CE1 3.93Å; Y287-F297 HydrophobicContact CG-CE1 3.93Å; Y287-F297 AromaticContact CZ-CE1 3.8Å; Y287-F297 AromaticContact CZ-CZ 3.78Å; T293-F297 VanDerWaalsContact O-CB 3.3Å; T293-F297 WeakPolarHBondContact O-CB 3.3Å; T293-F297 PolarHBondContact O-N 3.29Å; L294-F297 PolarHBondContact O-N 3.08Å; T295-F297 VanDerWaalsContact C-N 3.26Å; T295-F297 PolarHBondContact O-N 2.89Å; F297-E299 VanDerWaalsContact C-N 3.35Å; F297-E299 PolarHBondContact O-N 3.48Å; F297-A300 PolarHBondContact O-N 3.43Å; F297-A301 WeakPolarHBondContact O-CB 3.42Å; F297-A301 PolarHBondContact O-N 3.14Å
298	K	95.4	Very high	86.6	Confident	42 Å²	42	58.3 Å²	58.3	18%	0.183	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-43.4	176.4	-77.5	176.7	174.1	174.8	0	112	L56 L294 T295 A301 R302	L56-K298 HydrophobicContact CD1-CG 3.78Å; L56-K298 HydrophobicContact CD2-CG 4.35Å; L56-K298 HydrophobicContact CG-CG 4.02Å; L56-K298 WeakPolarHBondContact O-CE 2.99Å; L294-K298 HydrophobicContact CD1-CD 4.37Å; L294-K298 HydrophobicContact CD1-CG 4.42Å; L294-K298 HydrophobicContact CG-CD 4.24Å; L294-K298 WeakPolarHBondContact O-CB 3.49Å; L294-K298 WeakPolarHBondContact O-CG 3.31Å; L294-K298 PolarHBondContact O-N 3.09Å; T295-K298 PolarHBondContact O-N 3.16Å; K298-A301 PolarHBondContact O-N 3.36Å; K298-R302 WeakPolarHBondContact O-CB 3.37Å; K298-R302 VanDerWaalsContact O-CG 3.28Å; K298-R302 WeakPolarHBondContact O-CG 3.23Å; K298-R302 PolarHBondContact O-N 3.03Å
299	E	94.7	Very high	85.3	Confident	111 Å²	111	63.7 Å²	63.7	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-61.8	-47.1	175.4	-72	179.4	175.4	0	0	111.7	T295 F297 A301 R302 N303	T295-E299 WeakPolarHBondContact O-CG 3.23Å; T295-E299 PolarHBondContact O-N 3.22Å; F297-E299 VanDerWaalsContact C-N 3.35Å; F297-E299 PolarHBondContact O-N 3.48Å; E299-A301 VanDerWaalsContact C-N 3.34Å; E299-A301 PolarHBondContact O-N 3.48Å; E299-R302 PolarHBondContact O-N 3.48Å; E299-N303 WeakPolarHBondContact O-CB 3.02Å; E299-N303 VanDerWaalsContact O-CG 3.3Å; E299-N303 PolarHBondContact O-N 3.21Å; E299-N303 PolarHBondContact O-ND2 3.25Å
300	A	92	Very high	84.2	Confident	28 Å²	28	63.5 Å²	63.5	23%	0.231	34%	0.336	C	S	.	.	H	α-helix	trans	-64.8	-37.4	178.8	0	0	0	0	0	112.5	V270 L274 A296 F297 R304	V270-A300 HydrophobicContact CG1-CB 3.64Å; L274-A300 HydrophobicContact CD1-CB 3.87Å; A296-A300 WeakPolarHBondContact O-CB 2.91Å; A296-A300 PolarHBondContact O-N 3.09Å; F297-A300 PolarHBondContact O-N 3.43Å; A300-R304 WeakPolarHBondContact O-CG 3.26Å
301	A	90.7	Very high	83.3	Confident	16 Å²	16	61 Å²	61	13%	0.132	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-38.4	176.1	0	0	0	0	0	112.3	L56 L274 F297 K298 E299	L56-A301 HydrophobicContact CD2-CB 3.62Å; L274-A301 HydrophobicContact CD2-CB 4.28Å; F297-A301 WeakPolarHBondContact O-CB 3.42Å; F297-A301 PolarHBondContact O-N 3.14Å; K298-A301 PolarHBondContact O-N 3.36Å; E299-A301 VanDerWaalsContact C-N 3.34Å; E299-A301 PolarHBondContact O-N 3.48Å
302	R	88.2	Confident	82.1	Confident	190 Å²	190	56.8 Å²	56.8	72%	0.717	31%	0.308	S	S	*	.	H	α-helix	trans	-70.3	-38.1	177.1	-74.3	172.7	-180	178.6	0.5	113.1	K298 E299 R304	K298-R302 WeakPolarHBondContact O-CB 3.37Å; K298-R302 VanDerWaalsContact O-CG 3.28Å; K298-R302 WeakPolarHBondContact O-CG 3.23Å; K298-R302 PolarHBondContact O-N 3.03Å; E299-R302 PolarHBondContact O-N 3.48Å; R302-R304 PolarHBondContact O-N 3.01Å
303	N	81.1	Confident	80.6	Confident	138 Å²	138	53 Å²	53	74%	0.738	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	1.8	-175.3	-70.3	-24.1	0	0	0	113.9	E299	E299-N303 WeakPolarHBondContact O-CB 3.02Å; E299-N303 VanDerWaalsContact O-CG 3.3Å; E299-N303 PolarHBondContact O-N 3.21Å; E299-N303 PolarHBondContact O-ND2 3.25Å
304	R	72.1	Confident	79.2	Confident	43 Å²	43	54.8 Å²	54.8	16%	0.162	31%	0.306	C	S	.	.			trans	-83.7	137.9	-177.5	-90.9	-179.8	171.1	-153.7	-1.8	112.1	D278 A300 R302 G306	D278-R304 IonicContact OD1-NH1 2.74Å; D278-R304 PolarHBondContact OD1-NH1 3.47Å; D278-R304 IonicContact OD2-CZ 2.67Å; D278-R304 IonicContact OD2-NH1 2.74Å; D278-R304 PolarHBondContact OD2-NH1 2.87Å; A300-R304 WeakPolarHBondContact O-CG 3.26Å; R302-R304 PolarHBondContact O-N 3.01Å; R304-G306 PolarHBondContact O-N 2.87Å
305	S	61.3	Low	77.8	Confident	100 Å²	100	58.3 Å²	58.3	70%	0.699	33%	0.326	S	S	*	.			trans	-72.3	17.2	-180	53.2	0	0	0	0	114.9	V307	S305-V307 PolarHBondContact O-N 3.12Å
306	G	59.1	Low	76.5	Confident	40 Å²	40	56.7 Å²	56.7	41%	0.412	31%	0.314	S	S	.	.	S	Bend	trans	72.6	-5.2	-174.9	0	0	0	0	0	115.3	R304 R308 H324	R304-G306 PolarHBondContact O-N 2.87Å; G306-R308 PolarHBondContact O-N 3.15Å; G306-H324 PolarHBondContact O-CE1 3.29Å; G306-H324 VanDerWaalsContact O-CE1 3.29Å; G306-H324 PolarHBondContact O-NE2 3.08Å
307	V	62.8	Low	75.2	Confident	70 Å²	70	55.8 Å²	55.8	42%	0.424	30%	0.303	S	S	.	.			trans	-76.1	114.1	179.1	-177.3	0	0	0	0	110.2	S305 R309 Y420	S305-V307 PolarHBondContact O-N 3.12Å; V307-R309 PolarHBondContact O-N 3.42Å; V307-Y420 HydrophobicContact CG1-CE2 4.47Å
308	R	69.6	Low	73.8	Confident	52 Å²	52	60.3 Å²	60.3	20%	0.196	33%	0.327	C	S	.	.			trans	-57.5	120.9	170.8	-175.5	176.2	-176.3	175.9	6.7	109.9	D278 N279 G306 F310	D278-R308 HydrophobicContact CB-CG 4.14Å; D278-R308 WeakPolarHBondContact O-CD 3.17Å; D278-R308 PolarHBondContact O-NE 3.09Å; D278-R308 VanDerWaalsContact O-NE 3.13Å; N279-R308 VanDerWaalsContact OD1-CZ 3.28Å; N279-R308 PolarHBondContact OD1-NE 3.32Å; N279-R308 VanDerWaalsContact OD1-NE 3.09Å; N279-R308 PolarHBondContact OD1-NH2 3.33Å; G306-R308 PolarHBondContact O-N 3.15Å; R308-F310 WeakPolarHBondContact CD-O 2.86Å; R308-F310 WeakPolarHBondContact CG-O 3.39Å; R308-F310 PolarHBondContact NE-O 3.15Å
309	R	70.3	Confident	72.6	Confident	115 Å²	115	59 Å²	59	43%	0.434	32%	0.322	S	S	.	.			trans	-97.5	0.6	-178.3	-65.8	-161.5	-173.7	171.4	-2.3	114	D278 V307 Y420	D278-R309 PolarHBondContact OD2-N 3.02Å; V307-R309 PolarHBondContact O-N 3.42Å; R309-Y420 WeakPolarHBondContact O-CB 3.29Å
310	F	71.3	Confident	71.2	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.009	30%	0.299	C	S	.	.			trans	-144.2	126.6	-179.2	-58.9	-76.7	0	0	0	109.2	F275 N279 R308 Y414 E417	F275-F310 HydrophobicContact CB-CD2 3.99Å; F275-F310 HydrophobicContact CB-CE2 4.15Å; F275-F310 HydrophobicContact CB-CG 4.37Å; F275-F310 HydrophobicContact CD2-CB 3.45Å; F275-F310 VanDerWaalsContact CD2-CB 3.45Å; F275-F310 AromaticContact CD2-CD1 3.74Å; F275-F310 HydrophobicContact CD2-CD1 3.74Å; F275-F310 AromaticContact CD2-CD2 3.92Å; F275-F310 HydrophobicContact CD2-CD2 3.92Å; F275-F310 HydrophobicContact CD2-CE1 4.45Å; F275-F310 AromaticContact CD2-CG 3.42Å; F275-F310 HydrophobicContact CD2-CG 3.42Å; F275-F310 VanDerWaalsContact CD2-CG 3.42Å; F275-F310 HydrophobicContact CE2-CB 3.72Å; F275-F310 HydrophobicContact CE2-CD1 4.38Å; F275-F310 HydrophobicContact CE2-CG 4.14Å; F275-F310 HydrophobicContact CG-CD2 4.43Å; F275-F310 HydrophobicContact CG-CG 4.35Å; N279-F310 PolarHBondContact OD1-O 2.91Å; R308-F310 WeakPolarHBondContact CD-O 2.86Å; R308-F310 WeakPolarHBondContact CG-O 3.39Å; R308-F310 PolarHBondContact NE-O 3.15Å; F310-Y414 HydrophobicContact CD1-CE2 4.46Å; F310-E417 HydrophobicContact CE1-CB 4.13Å; F310-E417 HydrophobicContact CE1-CG 4.04Å; F310-E417 HydrophobicContact CZ-CB 4.25Å; F310-E417 HydrophobicContact CZ-CG 4.04Å
311	Y	72.8	Confident	69.9	Low	6 Å²	6	54.6 Å²	54.6	2%	0.024	30%	0.295	C	S	.	.			trans	-112.9	117.3	170.3	-177.8	-96.9	0	0	0	108.7	G313 G314 F319 P422	Y311-G313 VanDerWaalsContact CD1-N 3.34Å; Y311-G314 PolarHBondContact OH-N 3.09Å; Y311-G314 PolarHBondContact OH-O 3.1Å; Y311-F319 HydrophobicContact CD2-CB 4.05Å; Y311-F319 AromaticContact CD2-CD2 3.81Å; Y311-F319 HydrophobicContact CD2-CD2 3.81Å; Y311-F319 HydrophobicContact CD2-CG 4.17Å; Y311-F319 HydrophobicContact CE2-CB 3.88Å; Y311-F319 HydrophobicContact CE2-CD2 4.48Å; Y311-F319 HydrophobicContact CE2-CG 4.42Å; Y311-F319 HydrophobicContact CG-CD2 4.49Å; Y311-P422 HydrophobicContact CD1-CB 3.7Å; Y311-P422 HydrophobicContact CD2-CB 4.19Å; Y311-P422 HydrophobicContact CE1-CB 3.41Å; Y311-P422 VanDerWaalsContact CE1-CB 3.41Å; Y311-P422 HydrophobicContact CE2-CB 3.98Å; Y311-P422 HydrophobicContact CG-CB 4.03Å
312	P	67.3	Low	68.3	Low	11 Å²	11	56.9 Å²	56.9	7%	0.071	31%	0.309	C	S	.	.			trans	-95.6	6.3	-172.2	36.1	-30.7	0	0	0	112.8	W244 F275 N279 Y455	W244-P312 VanDerWaalsContact NE1-CB 3.27Å; F275-P312 HydrophobicContact CZ-CB 4.33Å; N279-P312 HydrophobicContact CB-CG 4.18Å; N279-P312 WeakPolarHBondContact OD1-CD 3.47Å; N279-P312 WeakPolarHBondContact OD1-CG 3.25Å; P312-Y455 HydrophobicContact CB-CD1 4.21Å
313	G	64.8	Low	66.7	Low	14 Å²	14	52.3 Å²	52.3	14%	0.144	30%	0.302	C	S	.	.	S	Bend	trans	95.6	174.1	-157.1	0	0	0	0	0	111.7	Y311	Y311-G313 VanDerWaalsContact CD1-N 3.34Å
314	G	65.8	Low	65.2	Low	51 Å²	51	51.1 Å²	51.1	53%	0.526	29%	0.292	S	S	.	.			trans	122	-162.1	177.7	0	0	0	0	0	114.7	Y311 L316	Y311-G314 PolarHBondContact OH-N 3.09Å; Y311-G314 PolarHBondContact OH-O 3.1Å; G314-L316 PolarHBondContact O-N 3.35Å
315	N	65.9	Low	63.7	Low	92 Å²	92	55.8 Å²	55.8	49%	0.492	32%	0.32	S	S	.	.			trans	-72.8	120.8	179.2	-173.4	-19.4	0	0	0	109.8	M317 D318	N315-M317 PolarHBondContact O-N 3.12Å; N315-M317 VanDerWaalsContact O-N 3.13Å; N315-M317 WeakPolarHBondContact OD1-CB 3.46Å; N315-M317 WeakPolarHBondContact OD1-CG 3.19Å; N315-M317 PolarHBondContact OD1-N 3.49Å; N315-D318 WeakPolarHBondContact O-CB 3.31Å; N315-D318 PolarHBondContact O-N 3.46Å; N315-D318 VanDerWaalsContact O-N 3.08Å
316	L	69.3	Low	62.9	Low	28 Å²	28	57.3 Å²	57.3	15%	0.147	31%	0.31	C	S	.	.	H	α-helix	trans	-50.8	-37.8	176.6	175.6	52.1	0	0	0	113.1	G314 D318 F319 L320 I369 P422 W424	G314-L316 PolarHBondContact O-N 3.35Å; L316-D318 PolarHBondContact O-N 3.2Å; L316-F319 PolarHBondContact O-N 3.2Å; L316-L320 HydrophobicContact CD1-CD1 3.56Å; L316-L320 HydrophobicContact CD1-CD2 4.23Å; L316-L320 HydrophobicContact CD1-CG 3.58Å; L316-L320 HydrophobicContact CD2-CD1 3.85Å; L316-L320 HydrophobicContact CG-CD1 3.49Å; L316-L320 VanDerWaalsContact CG-CD1 3.49Å; L316-L320 HydrophobicContact CG-CG 3.98Å; L316-L320 PolarHBondContact O-N 3.18Å; L316-I369 HydrophobicContact CD2-CD1 3.7Å; L316-P422 HydrophobicContact CD1-CB 4.45Å; L316-P422 HydrophobicContact CD1-CG 4.04Å; L316-W424 HydrophobicContact CB-CZ2 3.89Å; L316-W424 HydrophobicContact CD1-CH2 3.25Å; L316-W424 HydrophobicContact CD1-CZ2 3.44Å; L316-W424 VanDerWaalsContact CD1-CZ2 3.44Å; L316-W424 HydrophobicContact CD2-CH2 3.95Å; L316-W424 HydrophobicContact CD2-CZ2 3.71Å; L316-W424 HydrophobicContact CG-CH2 4.08Å; L316-W424 HydrophobicContact CG-CZ2 3.84Å
317	M	69.5	Low	61.7	Low	22 Å²	22	62.4 Å²	62.4	11%	0.108	33%	0.328	C	S	.	.	H	α-helix	trans	-65.2	-30.4	-174.8	-58.1	-55.9	-80.2	0	0	111.2	N315 F319 L320 Y321 H337 S338 S339 V342	N315-M317 PolarHBondContact O-N 3.12Å; N315-M317 VanDerWaalsContact O-N 3.13Å; N315-M317 WeakPolarHBondContact OD1-CB 3.46Å; N315-M317 WeakPolarHBondContact OD1-CG 3.19Å; N315-M317 PolarHBondContact OD1-N 3.49Å; M317-F319 VanDerWaalsContact C-N 3.27Å; M317-F319 PolarHBondContact O-N 3.24Å; M317-L320 PolarHBondContact O-N 2.77Å; M317-Y321 HydrophobicContact CB-CD2 4.44Å; M317-Y321 HydrophobicContact CE-CD2 3.81Å; M317-Y321 HydrophobicContact CE-CE2 3.21Å; M317-Y321 WeakPolarHBondContact O-CA 3.47Å; M317-Y321 VanDerWaalsContact O-CB 3.3Å; M317-Y321 WeakPolarHBondContact O-CB 3.41Å; M317-Y321 WeakPolarHBondContact O-CD2 3.38Å; M317-Y321 PolarHBondContact O-N 2.99Å; M317-Y321 HydrophobicContact SD-CD2 4.35Å; M317-Y321 HydrophobicContact SD-CE2 3.98Å; M317-H337 HydrophobicContact CE-CB 4.19Å; M317-H337 WeakPolarHBondContact CE-O 3.41Å; M317-S338 WeakPolarHBondContact CE-O 3.41Å; M317-S339 VanDerWaalsContact CE-N 3.35Å; M317-V342 HydrophobicContact SD-CG2 4.44Å
318	D	66.9	Low	60.4	Low	95 Å²	95	65 Å²	65	51%	0.508	35%	0.349	S	S	.	.	H	α-helix	trans	-67.1	-31.7	175.8	-55.3	-15.8	0	0	0	111.5	N315 L316	N315-D318 WeakPolarHBondContact O-CB 3.31Å; N315-D318 PolarHBondContact O-N 3.46Å; N315-D318 VanDerWaalsContact O-N 3.08Å; L316-D318 PolarHBondContact O-N 3.2Å
319	F	70.1	Confident	58.7	Low	15 Å²	15	65.6 Å²	65.6	7%	0.066	36%	0.361	C	S	.	.	H	α-helix	trans	-78.9	-43	175.1	-179.8	-91.6	0	0	0	112.4	Y311 L316 M317 Y321 P322 Y420 P422	Y311-F319 HydrophobicContact CD2-CB 4.05Å; Y311-F319 AromaticContact CD2-CD2 3.81Å; Y311-F319 HydrophobicContact CD2-CD2 3.81Å; Y311-F319 HydrophobicContact CD2-CG 4.17Å; Y311-F319 HydrophobicContact CE2-CB 3.88Å; Y311-F319 HydrophobicContact CE2-CD2 4.48Å; Y311-F319 HydrophobicContact CE2-CG 4.42Å; Y311-F319 HydrophobicContact CG-CD2 4.49Å; L316-F319 PolarHBondContact O-N 3.2Å; M317-F319 VanDerWaalsContact C-N 3.27Å; M317-F319 PolarHBondContact O-N 3.24Å; F319-Y321 VanDerWaalsContact C-N 3.34Å; F319-P322 WeakPolarHBondContact O-CD 3.3Å; F319-Y420 WeakPolarHBondContact CE2-O 3.32Å; F319-P422 VanDerWaalsContact CD1-CD 3.42Å; F319-P422 HydrophobicContact CD1-CG 3.55Å; F319-P422 HydrophobicContact CE1-CG 3.86Å; F319-P422 HydrophobicContact CG-CG 3.97Å; F319-P422 VanDerWaalsContact CZ-CD 3.49Å
320	L	65.2	Low	57.2	Low	8 Å²	8	68.7 Å²	68.7	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-77.3	-23.8	-176.3	-67.3	177.3	0	0	0	113.2	L316 M317 P322 V342 K367	L316-L320 HydrophobicContact CD1-CD1 3.56Å; L316-L320 HydrophobicContact CD1-CD2 4.23Å; L316-L320 HydrophobicContact CD1-CG 3.58Å; L316-L320 HydrophobicContact CD2-CD1 3.85Å; L316-L320 HydrophobicContact CG-CD1 3.49Å; L316-L320 VanDerWaalsContact CG-CD1 3.49Å; L316-L320 HydrophobicContact CG-CG 3.98Å; L316-L320 PolarHBondContact O-N 3.18Å; M317-L320 PolarHBondContact O-N 2.77Å; L320-P322 VanDerWaalsContact C-CD 3.4Å; L320-V342 HydrophobicContact CD1-CB 4.43Å; L320-V342 HydrophobicContact CD1-CG1 4.06Å; L320-V342 HydrophobicContact CD1-CG2 3.46Å; L320-V342 VanDerWaalsContact CD1-CG2 3.46Å; L320-K367 HydrophobicContact CB-CB 4.46Å; L320-K367 HydrophobicContact CB-CD 3.86Å; L320-K367 HydrophobicContact CB-CG 3.96Å; L320-K367 HydrophobicContact CD1-CB 4.01Å; L320-K367 HydrophobicContact CD1-CD 4.42Å; L320-K367 HydrophobicContact CD1-CG 4.39Å; L320-K367 HydrophobicContact CD2-CB 3.88Å; L320-K367 HydrophobicContact CD2-CG 4.03Å; L320-K367 HydrophobicContact CG-CB 4.34Å; L320-K367 HydrophobicContact CG-CG 4.34Å; L320-K367 WeakPolarHBondContact O-CE 3.4Å
321	Y	64.1	Low	55.5	Low	38 Å²	38	76.4 Å²	76.4	15%	0.149	42%	0.419	C	S	.	.	S	Bend	trans	-125.1	66.5	177.5	-59.6	-102.3	0	0	0	108.2	M317 F319 V323 Q336 H337 S338 K367	M317-Y321 HydrophobicContact CB-CD2 4.44Å; M317-Y321 HydrophobicContact CE-CD2 3.81Å; M317-Y321 HydrophobicContact CE-CE2 3.21Å; M317-Y321 WeakPolarHBondContact O-CA 3.47Å; M317-Y321 VanDerWaalsContact O-CB 3.3Å; M317-Y321 WeakPolarHBondContact O-CB 3.41Å; M317-Y321 WeakPolarHBondContact O-CD2 3.38Å; M317-Y321 PolarHBondContact O-N 2.99Å; M317-Y321 HydrophobicContact SD-CD2 4.35Å; M317-Y321 HydrophobicContact SD-CE2 3.98Å; F319-Y321 VanDerWaalsContact C-N 3.34Å; Y321-V323 PolarHBondContact O-N 2.96Å; Y321-V323 VanDerWaalsContact O-N 3.09Å; Y321-Q336 WeakPolarHBondContact CE1-O 3.38Å; Y321-H337 VanDerWaalsContact CB-CE1 3.5Å; Y321-H337 WeakPolarHBondContact CB-CE1 3.5Å; Y321-H337 WeakPolarHBondContact CB-ND1 3.26Å; Y321-H337 AromaticContact CD1-ND1 3.94Å; Y321-H337 AromaticContact CD2-ND1 3.98Å; Y321-H337 AromaticContact CG-ND1 3.48Å; Y321-S338 PolarHBondContact OH-O 3.27Å; Y321-K367 VanDerWaalsContact CD1-NZ 3.3Å; Y321-K367 HydrophobicContact CD2-CD 4.26Å; Y321-K367 HydrophobicContact CE1-CD 4.28Å; Y321-K367 VanDerWaalsContact CE1-CE 3.45Å; Y321-K367 HydrophobicContact CE2-CD 3.58Å; Y321-K367 PolarHBondContact OH-NZ 3.28Å
322	P	57.7	Low	53.6	Low	64 Å²	64	80.9 Å²	80.9	42%	0.416	45%	0.447	S	S	.	.			trans	-60.1	122.6	177.3	27.1	-31.4	0	0	0	107.4	F319 L320 H324	F319-P322 WeakPolarHBondContact O-CD 3.3Å; L320-P322 VanDerWaalsContact C-CD 3.4Å; P322-H324 VanDerWaalsContact C-N 3.32Å; P322-H324 PolarHBondContact O-N 3.21Å
323	V	53.6	Low	52.2	Low	94 Å²	94	83.7 Å²	83.7	57%	0.57	46%	0.462	S	S	*	.			trans	-65.7	95.8	-179.2	-175.5	0	0	0	0	107.2	Y321 W326	Y321-V323 PolarHBondContact O-N 2.96Å; Y321-V323 VanDerWaalsContact O-N 3.09Å; V323-W326 PolarHBondContact O-NE1 3.17Å
324	H	49.8	Very low	51.1	Low	114 Å²	114	89.1 Å²	89.1	53%	0.528	49%	0.492	S	S	.	.			trans	-101.1	21.3	-176.3	-84.6	13.6	0	0	0	113.1	G306 P322	G306-H324 PolarHBondContact O-CE1 3.29Å; G306-H324 VanDerWaalsContact O-CE1 3.29Å; G306-H324 PolarHBondContact O-NE2 3.08Å; P322-H324 VanDerWaalsContact C-N 3.32Å; P322-H324 PolarHBondContact O-N 3.21Å
325	N	39.8	Very low	50	Low	141 Å²	141	92.8 Å²	92.8	75%	0.754	50%	0.504	S	S	*	.			trans	-141.4	101.8	165.8	-88.4	-34	0	0	0	108.9	N327	N325-N327 PolarHBondContact O-N 3.28Å
326	W	45.6	Very low	49.1	Very low	132 Å²	132	94.6 Å²	94.6	50%	0.5	51%	0.509	S	S	.	.			trans	-81	45.3	-177.2	-59.2	-0.9	0	0	0	111.7	P282 V323	P282-W326 HydrophobicContact CB-CE3 4.05Å; P282-W326 HydrophobicContact CB-CH2 3.79Å; P282-W326 HydrophobicContact CB-CZ2 4.48Å; P282-W326 HydrophobicContact CB-CZ3 3.53Å; P282-W326 HydrophobicContact CG-CD2 3.77Å; P282-W326 HydrophobicContact CG-CE3 3.47Å; P282-W326 VanDerWaalsContact CG-CE3 3.47Å; P282-W326 HydrophobicContact CG-CH2 2.95Å; P282-W326 HydrophobicContact CG-CZ2 3.25Å; P282-W326 HydrophobicContact CG-CZ3 3.06Å; V323-W326 PolarHBondContact O-NE1 3.17Å
327	N	33.5	Very low	48.6	Very low	146 Å²	146	96.5 Å²	96.5	78%	0.781	52%	0.517	S	S	*	.			trans	-98.3	129.7	167.8	-89.3	-19.7	0	0	0	109.2	N325 S329	N325-N327 PolarHBondContact O-N 3.28Å; N327-S329 PolarHBondContact O-N 3.31Å
328	S	34.8	Very low	48.3	Very low	124 Å²	124	98 Å²	98	87%	0.867	53%	0.53	S	S	*	.	S	Bend	trans	-54.2	98.2	-175.2	60	0	0	0	0	113.2
329	S	34.6	Very low	48.3	Very low	65 Å²	65	97.3 Å²	97.3	46%	0.455	53%	0.532	S	S	.	.			trans	-156.6	77	156.4	63.4	0	0	0	0	110.7	N327 L331 T332	N327-S329 PolarHBondContact O-N 3.31Å; S329-L331 PolarHBondContact O-N 3.48Å; S329-T332 WeakPolarHBondContact CB-OG1 3.5Å; S329-T332 PolarHBondContact OG-OG1 2.81Å; S329-T332 VanDerWaalsContact OG-OG1 3.12Å
330	F	38.7	Very low	48.2	Very low	181 Å²	181	104.1 Å²	104.1	79%	0.794	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	4.9	175.9	-142.8	-96.4	0	0	0	113.8
331	L	34.9	Very low	48.2	Very low	163 Å²	163	105.6 Å²	105.6	85%	0.853	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	-2.4	-171.2	-89.6	156.2	0	0	0	115.3	S329	S329-L331 PolarHBondContact O-N 3.48Å
332	T	32.8	Very low	48.6	Very low	100 Å²	100	104.6 Å²	104.6	61%	0.613	58%	0.584	S	S	*	*	S	Bend	trans	-115.1	-8.2	-175.9	38.8	0	0	0	0	116.2	S329	S329-T332 WeakPolarHBondContact CB-OG1 3.5Å; S329-T332 PolarHBondContact OG-OG1 2.81Å; S329-T332 VanDerWaalsContact OG-OG1 3.12Å
333	D	38.7	Very low	49.4	Very low	71 Å²	71	107.8 Å²	107.8	38%	0.38	59%	0.588	S	S	.	*			trans	-103.4	7.2	-169	-115.2	-13.8	0	0	0	116.5	T335 Q336 H337	D333-T335 PolarHBondContact O-N 2.8Å; D333-Q336 PolarHBondContact O-N 3.37Å; D333-H337 PolarHBondContact O-CD2 3.2Å; D333-H337 VanDerWaalsContact O-CD2 3.25Å
334	V	41.8	Very low	50.4	Low	128 Å²	128	110 Å²	110	78%	0.776	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-18.3	179.5	-176.8	0	0	0	0	112.7
335	T	41.8	Very low	51.7	Low	128 Å²	128	107 Å²	107	79%	0.785	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-13.7	179.3	56.3	0	0	0	0	115.1	D333	D333-T335 PolarHBondContact O-N 2.8Å
336	Q	48.5	Very low	53.3	Low	130 Å²	130	103.4 Å²	103.4	61%	0.607	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-17.7	177.9	-69.7	-162.6	17.3	0	0	114.4	Y321 D333 S338	Y321-Q336 WeakPolarHBondContact CE1-O 3.38Å; D333-Q336 PolarHBondContact O-N 3.37Å; Q336-S338 PolarHBondContact O-N 3.49Å
337	H	57.7	Low	54.6	Low	68 Å²	68	97.8 Å²	97.8	32%	0.315	54%	0.537	S	S	.	.			trans	-91.8	58	-179.1	-59.8	-79	0	0	0	112.7	M317 Y321 D333	M317-H337 HydrophobicContact CE-CB 4.19Å; M317-H337 WeakPolarHBondContact CE-O 3.41Å; Y321-H337 VanDerWaalsContact CB-CE1 3.5Å; Y321-H337 WeakPolarHBondContact CB-CE1 3.5Å; Y321-H337 WeakPolarHBondContact CB-ND1 3.26Å; Y321-H337 AromaticContact CD1-ND1 3.94Å; Y321-H337 AromaticContact CD2-ND1 3.98Å; Y321-H337 AromaticContact CG-ND1 3.48Å; D333-H337 PolarHBondContact O-CD2 3.2Å; D333-H337 VanDerWaalsContact O-CD2 3.25Å
338	S	63.9	Low	56.4	Low	52 Å²	52	95.4 Å²	95.4	36%	0.364	53%	0.528	S	S	.	.			trans	-86.9	123.1	178.3	-173.4	0	0	0	0	112.4	M317 Y321 Q336 L340 G341	M317-S338 WeakPolarHBondContact CE-O 3.41Å; Y321-S338 PolarHBondContact OH-O 3.27Å; Q336-S338 PolarHBondContact O-N 3.49Å; S338-L340 PolarHBondContact O-N 3.22Å; S338-L340 WeakPolarHBondContact OG-CB 3.43Å; S338-L340 PolarHBondContact OG-N 3.21Å; S338-G341 PolarHBondContact O-N 3.28Å
339	S	66.8	Low	58.2	Low	81 Å²	81	92.8 Å²	92.8	57%	0.566	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-63.7	-21.2	173.4	56.5	0	0	0	0	112.6	M317 G341 V342	M317-S339 VanDerWaalsContact CE-N 3.35Å; S339-G341 PolarHBondContact O-N 3.09Å; S339-V342 WeakPolarHBondContact O-CB 3.44Å; S339-V342 WeakPolarHBondContact O-CG2 3.48Å; S339-V342 PolarHBondContact O-N 3.22Å
340	L	67.4	Low	59.9	Low	159 Å²	159	92.8 Å²	92.8	83%	0.832	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-64.1	-19.2	176.5	-58.7	176.3	0	0	0	113	S338 V342	S338-L340 PolarHBondContact O-N 3.22Å; S338-L340 WeakPolarHBondContact OG-CB 3.43Å; S338-L340 PolarHBondContact OG-N 3.21Å; L340-V342 VanDerWaalsContact C-N 3.3Å
341	G	65.9	Low	61.7	Low	39 Å²	39	87.5 Å²	87.5	40%	0.402	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-78.4	-9.5	174.4	0	0	0	0	0	114.5	S338 S339	S338-G341 PolarHBondContact O-N 3.28Å; S339-G341 PolarHBondContact O-N 3.09Å
342	V	72.6	Confident	63.6	Low	17 Å²	17	82.7 Å²	82.7	10%	0.103	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123.3	-176.5	-172.8	0	0	0	0	110.2	M317 L320 S339 L340 K367 I369	M317-V342 HydrophobicContact SD-CG2 4.44Å; L320-V342 HydrophobicContact CD1-CB 4.43Å; L320-V342 HydrophobicContact CD1-CG1 4.06Å; L320-V342 HydrophobicContact CD1-CG2 3.46Å; L320-V342 VanDerWaalsContact CD1-CG2 3.46Å; S339-V342 WeakPolarHBondContact O-CB 3.44Å; S339-V342 WeakPolarHBondContact O-CG2 3.48Å; S339-V342 PolarHBondContact O-N 3.22Å; L340-V342 VanDerWaalsContact C-N 3.3Å; V342-K367 HydrophobicContact CG2-CB 4.36Å; V342-I369 HydrophobicContact CG1-CD1 3.74Å; V342-I369 HydrophobicContact CG1-CG1 3.96Å
343	R	74.2	Confident	65.6	Low	131 Å²	131	78 Å²	78	49%	0.494	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.4	-179.3	-63	-173.3	-178.1	-158.1	-1.1	111.1	F345 K367 V368 I369	R343-F345 HydrophobicContact CB-CE2 3.79Å; R343-F345 HydrophobicContact CB-CZ 4.02Å; R343-K367 PolarHBondContact N-O 3.24Å; R343-V368 CarbonylContact O-C 3.48Å; R343-V368 WeakPolarHBondContact O-CA 3.46Å; R343-I369 PolarHBondContact O-N 3.31Å
344	W	75.6	Confident	67.2	Low	140 Å²	140	77.9 Å²	77.9	53%	0.53	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.1	176.5	-66.7	74.2	0	0	0	110.6	I369 Y394	W344-I369 WeakPolarHBondContact CA-O 3.11Å; W344-I369 HydrophobicContact CD2-CB 3.89Å; W344-I369 HydrophobicContact CD2-CD1 4.13Å; W344-I369 HydrophobicContact CD2-CG2 4.09Å; W344-I369 HydrophobicContact CE3-CB 3.84Å; W344-I369 HydrophobicContact CE3-CD1 4.42Å; W344-I369 HydrophobicContact CE3-CG2 3.5Å; W344-I369 HydrophobicContact CG-CB 4.42Å; W344-I369 HydrophobicContact CH2-CB 4.48Å; W344-I369 HydrophobicContact CH2-CD1 3.7Å; W344-I369 HydrophobicContact CH2-CG2 3.96Å; W344-I369 HydrophobicContact CZ2-CD1 3.33Å; W344-I369 HydrophobicContact CZ2-CG1 4.5Å; W344-I369 HydrophobicContact CZ2-CG2 4.49Å; W344-I369 HydrophobicContact CZ3-CB 4.14Å; W344-I369 HydrophobicContact CZ3-CD1 4.23Å; W344-I369 HydrophobicContact CZ3-CG2 3.43Å; W344-I369 VanDerWaalsContact CZ3-CG2 3.43Å; W344-Y394 HydrophobicContact CE3-CD1 4.32Å; W344-Y394 AromaticContact CZ3-CD1 3.58Å; W344-Y394 HydrophobicContact CZ3-CD1 3.58Å; W344-Y394 HydrophobicContact CZ3-CE1 4.39Å; W344-Y394 AromaticContact CZ3-CG 3.91Å; W344-Y394 HydrophobicContact CZ3-CG 3.91Å
345	F	75.8	Confident	68.7	Low	52 Å²	52	74.4 Å²	74.4	23%	0.228	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.7	172.4	-57.8	-81	0	0	0	110.1	R343 V368 I369 S371	R343-F345 HydrophobicContact CB-CE2 3.79Å; R343-F345 HydrophobicContact CB-CZ 4.02Å; F345-V368 HydrophobicContact CD2-CG1 3.41Å; F345-V368 VanDerWaalsContact CD2-CG1 3.41Å; F345-V368 HydrophobicContact CE2-CB 4.43Å; F345-V368 HydrophobicContact CE2-CG1 3.67Å; F345-V368 HydrophobicContact CE2-CG2 3.91Å; F345-I369 PolarHBondContact N-O 3.46Å; F345-S371 PolarHBondContact O-N 3.5Å
346	S	74.9	Confident	70.2	Confident	65 Å²	65	74.2 Å²	74.2	46%	0.455	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	130.5	168.9	-66.5	0	0	0	0	109.6	F352 R396	S346-F352 WeakPolarHBondContact O-CE1 3.29Å; S346-R396 PolarHBondContact OG-NH2 3.44Å
347	V	72.5	Confident	71.2	Confident	13 Å²	13	69.8 Å²	69.8	8%	0.079	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	122.6	176.2	-178.7	0	0	0	0	109.2	D349 L353 I370 S371 F372 I375	V347-D349 WeakPolarHBondContact CG1-O 3.19Å; V347-L353 HydrophobicContact CG1-CB 3.92Å; V347-L353 HydrophobicContact CG2-CD1 3.95Å; V347-I370 HydrophobicContact CG2-CG2 3.2Å; V347-S371 PolarHBondContact N-O 3.05Å; V347-F372 HydrophobicContact CB-CE1 4.33Å; V347-F372 HydrophobicContact CG1-CE1 4.34Å; V347-F372 HydrophobicContact CG2-CE1 4.36Å; V347-F372 HydrophobicContact CG2-CZ 4.26Å; V347-I375 HydrophobicContact CG1-CD1 4.24Å
348	T	71	Confident	71.5	Confident	97 Å²	97	70.5 Å²	70.5	60%	0.595	39%	0.392	S	S	*	.			trans	-101.9	-24.9	179.1	53.2	0	0	0	0	113.4	I375	T348-I375 WeakPolarHBondContact O-CD1 3.12Å
349	D	72.9	Confident	71.3	Confident	69 Å²	69	71.6 Å²	71.6	37%	0.369	40%	0.404	S	S	.	.	S	Bend	trans	-165.4	170.6	-178.7	56.4	74	0	0	0	112	V347 A351 F352 L353	V347-D349 WeakPolarHBondContact CG1-O 3.19Å; D349-A351 PolarHBondContact OD1-N 3.2Å; D349-A351 VanDerWaalsContact OD1-N 3.13Å; D349-F352 PolarHBondContact O-N 3.44Å; D349-F352 WeakPolarHBondContact OD1-CB 3.42Å; D349-F352 PolarHBondContact OD1-N 3.36Å; D349-L353 PolarHBondContact O-N 3.01Å; D349-L353 VanDerWaalsContact O-N 3.16Å
350	E	70.2	Confident	70.5	Confident	65 Å²	65	77.3 Å²	77.3	30%	0.304	42%	0.419	S	S	.	.	H	α-helix	trans	-60.8	-42.5	-179.9	179.3	160.2	-155	0	0	113.1	F352 L353 L354 Y380 K383	E350-F352 VanDerWaalsContact C-N 3.32Å; E350-F352 PolarHBondContact O-N 3.31Å; E350-L353 PolarHBondContact O-N 3.11Å; E350-L354 HydrophobicContact CG-CD1 3.71Å; E350-L354 HydrophobicContact CG-CG 4.09Å; E350-L354 WeakPolarHBondContact O-CB 3.45Å; E350-L354 WeakPolarHBondContact O-CG 3.4Å; E350-L354 PolarHBondContact O-N 2.88Å; E350-Y380 HydrophobicContact CB-CE1 3.56Å; E350-Y380 HydrophobicContact CG-CD1 4.49Å; E350-Y380 HydrophobicContact CG-CE1 3.61Å; E350-K383 IonicContact OE1-NZ 3.59Å; E350-K383 PolarHBondContact OE1-NZ 3.35Å
351	A	75.3	Confident	69.7	Low	70 Å²	70	75 Å²	75	58%	0.579	42%	0.416	S	S	*	.	H	α-helix	trans	-65.1	-40.6	-175.9	0	0	0	0	0	110.6	D349 L354 A355	D349-A351 PolarHBondContact OD1-N 3.2Å; D349-A351 VanDerWaalsContact OD1-N 3.13Å; A351-L354 PolarHBondContact O-N 3.01Å; A351-A355 VanDerWaalsContact O-CB 3.25Å; A351-A355 WeakPolarHBondContact O-CB 3.39Å; A351-A355 PolarHBondContact O-N 2.78Å
352	F	74.8	Confident	68.6	Low	62 Å²	62	79.2 Å²	79.2	27%	0.272	44%	0.439	S	S	.	.	H	α-helix	trans	-63.8	-42.7	174.3	-170.1	-98.4	0	0	0	111.7	S346 D349 E350 R356	S346-F352 WeakPolarHBondContact O-CE1 3.29Å; D349-F352 PolarHBondContact O-N 3.44Å; D349-F352 WeakPolarHBondContact OD1-CB 3.42Å; D349-F352 PolarHBondContact OD1-N 3.36Å; E350-F352 VanDerWaalsContact C-N 3.32Å; E350-F352 PolarHBondContact O-N 3.31Å; F352-R356 HydrophobicContact CD1-CG 4.42Å; F352-R356 HydrophobicContact CE1-CG 4.2Å; F352-R356 VanDerWaalsContact O-CG 3.29Å; F352-R356 WeakPolarHBondContact O-CG 3.48Å; F352-R356 PolarHBondContact O-N 3.47Å; F352-R356 VanDerWaalsContact O-N 3.16Å
353	L	74.8	Confident	67.2	Low	1 Å²	1	82.5 Å²	82.5	1%	0.005	46%	0.463	C	S	.	.	H	α-helix	trans	-60.2	-54.2	175.3	-179.2	66	0	0	0	110.8	V347 D349 E350 A355 R356 L357 I370 Y380 L384	V347-L353 HydrophobicContact CG1-CB 3.92Å; V347-L353 HydrophobicContact CG2-CD1 3.95Å; D349-L353 PolarHBondContact O-N 3.01Å; D349-L353 VanDerWaalsContact O-N 3.16Å; E350-L353 PolarHBondContact O-N 3.11Å; L353-A355 VanDerWaalsContact C-N 3.32Å; L353-A355 PolarHBondContact O-N 3.19Å; L353-R356 WeakPolarHBondContact O-CA 3.38Å; L353-R356 WeakPolarHBondContact O-CB 3.28Å; L353-R356 PolarHBondContact O-N 3.49Å; L353-L357 HydrophobicContact CD1-CD1 4.5Å; L353-L357 HydrophobicContact CD1-CD2 3.67Å; L353-L357 HydrophobicContact CD1-CG 4.24Å; L353-L357 HydrophobicContact CG-CD1 4.24Å; L353-L357 HydrophobicContact CG-CD2 4.16Å; L353-L357 HydrophobicContact CG-CG 4.17Å; L353-L357 WeakPolarHBondContact O-CD2 3.44Å; L353-L357 VanDerWaalsContact O-CG 3.25Å; L353-L357 WeakPolarHBondContact O-CG 3.43Å; L353-L357 PolarHBondContact O-N 3.42Å; L353-I370 HydrophobicContact CD1-CD1 4.22Å; L353-I370 HydrophobicContact CD1-CG2 4.2Å; L353-Y380 HydrophobicContact CD2-CD1 3.59Å; L353-Y380 HydrophobicContact CD2-CG 3.76Å; L353-L384 HydrophobicContact CD1-CD2 3.72Å; L353-L384 HydrophobicContact CD2-CD2 4.38Å
354	L	73.1	Confident	65.6	Low	69 Å²	69	79.9 Å²	79.9	36%	0.361	46%	0.464	S	S	.	.	H	α-helix	trans	-61.2	-37.7	-178.4	-69.2	176.7	0	0	0	112.5	E350 A351 R356 L357 S358 K383	E350-L354 HydrophobicContact CG-CD1 3.71Å; E350-L354 HydrophobicContact CG-CG 4.09Å; E350-L354 WeakPolarHBondContact O-CB 3.45Å; E350-L354 WeakPolarHBondContact O-CG 3.4Å; E350-L354 PolarHBondContact O-N 2.88Å; A351-L354 PolarHBondContact O-N 3.01Å; L354-R356 VanDerWaalsContact C-N 3.25Å; L354-R356 PolarHBondContact O-N 2.95Å; L354-L357 PolarHBondContact O-N 3.22Å; L354-S358 VanDerWaalsContact O-CB 3.23Å; L354-S358 WeakPolarHBondContact O-CB 3.45Å; L354-S358 PolarHBondContact O-N 3.31Å; L354-S358 PolarHBondContact O-OG 3.4Å; L354-K383 HydrophobicContact CD2-CD 4.21Å
355	A	72.8	Confident	64.3	Low	55 Å²	55	80 Å²	80	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-61.9	-34	173.9	0	0	0	0	0	112.2	A351 L353 S358 A359	A351-A355 VanDerWaalsContact O-CB 3.25Å; A351-A355 WeakPolarHBondContact O-CB 3.39Å; A351-A355 PolarHBondContact O-N 2.78Å; L353-A355 VanDerWaalsContact C-N 3.32Å; L353-A355 PolarHBondContact O-N 3.19Å; A355-S358 PolarHBondContact O-OG 2.79Å; A355-A359 PolarHBondContact O-N 3.11Å
356	R	73.2	Confident	63.3	Low	124 Å²	124	81.9 Å²	81.9	47%	0.468	48%	0.483	S	S	.	.	H	α-helix	trans	-76.6	-37.4	175.5	-65.3	-62.6	179.2	-169.7	-0.4	112.7	F352 L353 L354	F352-R356 HydrophobicContact CD1-CG 4.42Å; F352-R356 HydrophobicContact CE1-CG 4.2Å; F352-R356 VanDerWaalsContact O-CG 3.29Å; F352-R356 WeakPolarHBondContact O-CG 3.48Å; F352-R356 PolarHBondContact O-N 3.47Å; F352-R356 VanDerWaalsContact O-N 3.16Å; L353-R356 WeakPolarHBondContact O-CA 3.38Å; L353-R356 WeakPolarHBondContact O-CB 3.28Å; L353-R356 PolarHBondContact O-N 3.49Å; L354-R356 VanDerWaalsContact C-N 3.25Å; L354-R356 PolarHBondContact O-N 2.95Å
357	L	69	Low	63	Low	36 Å²	36	80 Å²	80	19%	0.188	47%	0.467	C	S	.	.	H	α-helix	trans	-71	-34	177.6	-48.7	-159.9	0	0	0	112.3	L353 L354 I370 L384 T387 W391	L353-L357 HydrophobicContact CD1-CD1 4.5Å; L353-L357 HydrophobicContact CD1-CD2 3.67Å; L353-L357 HydrophobicContact CD1-CG 4.24Å; L353-L357 HydrophobicContact CG-CD1 4.24Å; L353-L357 HydrophobicContact CG-CD2 4.16Å; L353-L357 HydrophobicContact CG-CG 4.17Å; L353-L357 WeakPolarHBondContact O-CD2 3.44Å; L353-L357 VanDerWaalsContact O-CG 3.25Å; L353-L357 WeakPolarHBondContact O-CG 3.43Å; L353-L357 PolarHBondContact O-N 3.42Å; L354-L357 PolarHBondContact O-N 3.22Å; L357-I370 HydrophobicContact CD2-CD1 4.15Å; L357-L384 HydrophobicContact CD1-CD2 4.24Å; L357-L384 HydrophobicContact CD2-CD2 4.04Å; L357-T387 HydrophobicContact CD1-CG2 4.15Å; L357-W391 HydrophobicContact CB-CH2 3.65Å; L357-W391 HydrophobicContact CB-CZ2 4.49Å; L357-W391 HydrophobicContact CB-CZ3 4.37Å; L357-W391 HydrophobicContact CD1-CH2 4.05Å; L357-W391 HydrophobicContact CD1-CZ3 3.91Å; L357-W391 HydrophobicContact CD2-CE3 4.05Å; L357-W391 HydrophobicContact CD2-CH2 3.11Å; L357-W391 HydrophobicContact CD2-CZ2 3.93Å; L357-W391 HydrophobicContact CD2-CZ3 3.16Å; L357-W391 HydrophobicContact CG-CH2 3.68Å; L357-W391 HydrophobicContact CG-CZ3 3.91Å
358	S	65.3	Low	62.8	Low	83 Å²	83	80 Å²	80	58%	0.58	47%	0.467	S	S	*	.	H	α-helix	trans	-87.6	-11.2	-175.6	60.1	0	0	0	0	115	L354 A355 K360	L354-S358 VanDerWaalsContact O-CB 3.23Å; L354-S358 WeakPolarHBondContact O-CB 3.45Å; L354-S358 PolarHBondContact O-N 3.31Å; L354-S358 PolarHBondContact O-OG 3.4Å; A355-S358 PolarHBondContact O-OG 2.79Å; S358-K360 PolarHBondContact O-N 2.69Å
359	A	59.9	Low	62.7	Low	75 Å²	75	75.4 Å²	75.4	62%	0.62	44%	0.439	S	S	*	.			trans	-67	79.2	176	0	0	0	0	0	110.8	A355	A355-A359 PolarHBondContact O-N 3.11Å
360	K	50	Low	62.8	Low	202 Å²	202	72.5 Å²	72.5	88%	0.878	42%	0.423	S	S	*	.			trans	-60.2	138.2	174.4	-85.1	-173.5	174.4	-177.9	0	110.8	S358	S358-K360 PolarHBondContact O-N 2.69Å
361	S	50.6	Low	62.9	Low	111 Å²	111	69.6 Å²	69.6	78%	0.776	41%	0.41	S	S	*	.			trans	-40.2	134.4	-179.2	59.4	0	0	0	0	117.3
362	S	43.3	Very low	62.7	Low	126 Å²	126	66.5 Å²	66.5	88%	0.881	38%	0.383	S	S	*	.	S	Bend	trans	-136.6	-8.6	146.4	57.5	0	0	0	0	113.8
363	S	42.4	Very low	62	Low	87 Å²	87	64.3 Å²	64.3	61%	0.608	38%	0.377	S	S	*	.	S	Bend	trans	-161.1	146.8	159	71.1	0	0	0	0	110.5
364	C	40.4	Very low	61.3	Low	75 Å²	75	73.5 Å²	73.5	51%	0.507	42%	0.417	S	S	.	.			trans	86.8	116.7	167.5	-163	0	0	0	0	113.9	K366	C364-K366 HydrophobicContact CB-CD 4.37Å; C364-K366 HydrophobicContact CB-CG 3.63Å; C364-K366 PolarHBondContact O-N 3.37Å; C364-K366 VanDerWaalsContact SG-CG 3.53Å
365	N	48.7	Very low	60.8	Low	143 Å²	143	72.3 Å²	72.3	77%	0.765	41%	0.41	S	S	*	.				42.1	20.3	71.9	-80.3	-6.6	0	0	0	114.4	K367	N365-K367 PolarHBondContact O-N 3.04Å; N365-K367 VanDerWaalsContact O-N 3.1Å
366	K	54.7	Low	60.4	Low	92 Å²	92	73.7 Å²	73.7	40%	0.4	42%	0.417	S	S	.	.			trans	-82.7	97.4	-179	-65.8	-178.7	-171.5	169.3	0	109	C364 V368	C364-K366 HydrophobicContact CB-CD 4.37Å; C364-K366 HydrophobicContact CB-CG 3.63Å; C364-K366 PolarHBondContact O-N 3.37Å; C364-K366 VanDerWaalsContact SG-CG 3.53Å; K366-V368 HydrophobicContact CB-CG2 3.94Å; K366-V368 PolarHBondContact O-N 3.18Å
367	K	68.2	Low	60.3	Low	25 Å²	25	68.2 Å²	68.2	11%	0.109	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	108.1	166.7	-67.8	163.1	174.6	124.6	0	107.8	L320 Y321 V342 R343 N365	L320-K367 HydrophobicContact CB-CB 4.46Å; L320-K367 HydrophobicContact CB-CD 3.86Å; L320-K367 HydrophobicContact CB-CG 3.96Å; L320-K367 HydrophobicContact CD1-CB 4.01Å; L320-K367 HydrophobicContact CD1-CD 4.42Å; L320-K367 HydrophobicContact CD1-CG 4.39Å; L320-K367 HydrophobicContact CD2-CB 3.88Å; L320-K367 HydrophobicContact CD2-CG 4.03Å; L320-K367 HydrophobicContact CG-CB 4.34Å; L320-K367 HydrophobicContact CG-CG 4.34Å; L320-K367 WeakPolarHBondContact O-CE 3.4Å; Y321-K367 VanDerWaalsContact CD1-NZ 3.3Å; Y321-K367 HydrophobicContact CD2-CD 4.26Å; Y321-K367 HydrophobicContact CE1-CD 4.28Å; Y321-K367 VanDerWaalsContact CE1-CE 3.45Å; Y321-K367 HydrophobicContact CE2-CD 3.58Å; Y321-K367 PolarHBondContact OH-NZ 3.28Å; V342-K367 HydrophobicContact CG2-CB 4.36Å; R343-K367 PolarHBondContact N-O 3.24Å; N365-K367 PolarHBondContact O-N 3.04Å; N365-K367 VanDerWaalsContact O-N 3.1Å
368	V	68.1	Low	60.3	Low	14 Å²	14	68.3 Å²	68.3	9%	0.085	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	135.2	-167	174.7	0	0	0	0	111.2	R343 F345 K366 I370 W391 G392	R343-V368 CarbonylContact O-C 3.48Å; R343-V368 WeakPolarHBondContact O-CA 3.46Å; F345-V368 HydrophobicContact CD2-CG1 3.41Å; F345-V368 VanDerWaalsContact CD2-CG1 3.41Å; F345-V368 HydrophobicContact CE2-CB 4.43Å; F345-V368 HydrophobicContact CE2-CG1 3.67Å; F345-V368 HydrophobicContact CE2-CG2 3.91Å; K366-V368 HydrophobicContact CB-CG2 3.94Å; K366-V368 PolarHBondContact O-N 3.18Å; V368-I370 HydrophobicContact CG1-CG1 4.06Å; V368-W391 CarbonylContact O-C 3.55Å; V368-W391 VanDerWaalsContact O-CA 3.26Å; V368-W391 WeakPolarHBondContact O-CA 3.47Å; V368-G392 PolarHBondContact O-N 3.21Å
369	I	70	Confident	60.5	Low	0 Å²	0	70.1 Å²	70.1	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.8	167.7	-61.2	171.1	0	0	0	109.6	L316 V342 R343 W344 F345 G392 W424	L316-I369 HydrophobicContact CD2-CD1 3.7Å; V342-I369 HydrophobicContact CG1-CD1 3.74Å; V342-I369 HydrophobicContact CG1-CG1 3.96Å; R343-I369 PolarHBondContact O-N 3.31Å; W344-I369 WeakPolarHBondContact CA-O 3.11Å; W344-I369 HydrophobicContact CD2-CB 3.89Å; W344-I369 HydrophobicContact CD2-CD1 4.13Å; W344-I369 HydrophobicContact CD2-CG2 4.09Å; W344-I369 HydrophobicContact CE3-CB 3.84Å; W344-I369 HydrophobicContact CE3-CD1 4.42Å; W344-I369 HydrophobicContact CE3-CG2 3.5Å; W344-I369 HydrophobicContact CG-CB 4.42Å; W344-I369 HydrophobicContact CH2-CB 4.48Å; W344-I369 HydrophobicContact CH2-CD1 3.7Å; W344-I369 HydrophobicContact CH2-CG2 3.96Å; W344-I369 HydrophobicContact CZ2-CD1 3.33Å; W344-I369 HydrophobicContact CZ2-CG1 4.5Å; W344-I369 HydrophobicContact CZ2-CG2 4.49Å; W344-I369 HydrophobicContact CZ3-CB 4.14Å; W344-I369 HydrophobicContact CZ3-CD1 4.23Å; W344-I369 HydrophobicContact CZ3-CG2 3.43Å; W344-I369 VanDerWaalsContact CZ3-CG2 3.43Å; F345-I369 PolarHBondContact N-O 3.46Å; I369-G392 WeakPolarHBondContact CA-O 3.37Å; I369-W424 HydrophobicContact CD1-CH2 4.03Å; I369-W424 HydrophobicContact CD1-CZ3 4Å; I369-W424 HydrophobicContact CG1-CH2 4.32Å; I369-W424 HydrophobicContact CG1-CZ3 4.03Å; I369-W424 HydrophobicContact CG2-CE3 4.22Å; I369-W424 HydrophobicContact CG2-CZ3 4.15Å
370	I	74.1	Confident	61.1	Low	7 Å²	7	67.8 Å²	67.8	4%	0.036	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.5	-180	-59.2	-179.1	0	0	0	108.4	V347 L353 L357 V368 F372 L384 W391 G392 V393 Y394	V347-I370 HydrophobicContact CG2-CG2 3.2Å; L353-I370 HydrophobicContact CD1-CD1 4.22Å; L353-I370 HydrophobicContact CD1-CG2 4.2Å; L357-I370 HydrophobicContact CD2-CD1 4.15Å; V368-I370 HydrophobicContact CG1-CG1 4.06Å; I370-F372 HydrophobicContact CB-CE2 4.26Å; I370-F372 HydrophobicContact CG2-CD2 4.21Å; I370-F372 HydrophobicContact CG2-CE2 3.46Å; I370-F372 VanDerWaalsContact CG2-CE2 3.46Å; I370-F372 HydrophobicContact CG2-CZ 3.8Å; I370-L384 HydrophobicContact CD1-CD2 3.54Å; I370-W391 HydrophobicContact CD1-CD2 4.07Å; I370-W391 HydrophobicContact CD1-CE3 3.81Å; I370-W391 HydrophobicContact CD1-CG 4.43Å; I370-W391 HydrophobicContact CD1-CZ3 4.39Å; I370-G392 PolarHBondContact N-O 3.05Å; I370-V393 WeakPolarHBondContact O-CA 3.49Å; I370-Y394 PolarHBondContact O-N 3.26Å
371	S	73.4	Confident	62.3	Low	4 Å²	4	58.3 Å²	58.3	3%	0.028	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125	179.5	-176.8	0	0	0	0	111.8	F345 V347 Y394 R396	F345-S371 PolarHBondContact O-N 3.5Å; V347-S371 PolarHBondContact N-O 3.05Å; S371-Y394 CarbonylContact C-O 3.54Å; S371-Y394 VanDerWaalsContact CA-O 3.24Å; S371-Y394 WeakPolarHBondContact CA-O 3.36Å; S371-R396 PolarHBondContact OG-NE 2.84Å; S371-R396 VanDerWaalsContact OG-NE 3.09Å; S371-R396 PolarHBondContact OG-NH2 3.42Å
372	F	70.1	Confident	63.4	Low	5 Å²	5	59.7 Å²	59.7	2%	0.022	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	116.6	172.7	-68.5	-92.6	0	0	0	109	V347 I370 F377 Y380 L384 V393 Y394 L395 R396	V347-F372 HydrophobicContact CB-CE1 4.33Å; V347-F372 HydrophobicContact CG1-CE1 4.34Å; V347-F372 HydrophobicContact CG2-CE1 4.36Å; V347-F372 HydrophobicContact CG2-CZ 4.26Å; I370-F372 HydrophobicContact CB-CE2 4.26Å; I370-F372 HydrophobicContact CG2-CD2 4.21Å; I370-F372 HydrophobicContact CG2-CE2 3.46Å; I370-F372 VanDerWaalsContact CG2-CE2 3.46Å; I370-F372 HydrophobicContact CG2-CZ 3.8Å; F372-F377 HydrophobicContact CD2-CD2 4.41Å; F372-Y380 HydrophobicContact CE1-CD2 4.48Å; F372-L384 HydrophobicContact CE2-CD1 3.6Å; F372-L384 HydrophobicContact CZ-CD1 3.44Å; F372-L384 VanDerWaalsContact CZ-CD1 3.44Å; F372-L384 HydrophobicContact CZ-CG 4.46Å; F372-V393 HydrophobicContact CD2-CG1 3.71Å; F372-V393 HydrophobicContact CE2-CG1 3.81Å; F372-Y394 PolarHBondContact N-O 3.35Å; F372-L395 HydrophobicContact CB-CD2 4.09Å; F372-L395 HydrophobicContact CD2-CD2 3.99Å; F372-L395 HydrophobicContact CG-CD2 4.3Å; F372-R396 WeakPolarHBondContact O-CB 3.45Å; F372-R396 PolarHBondContact O-N 3.3Å
373	A	60.6	Low	64.9	Low	17 Å²	17	57.4 Å²	57.4	14%	0.14	31%	0.305	C	S	.	.	S	Bend	trans	-117.7	-20.4	-179.4	0	0	0	0	0	114.3	R396 H398	A373-R396 HydrophobicContact CB-CB 4.35Å; A373-H398 PolarHBondContact O-CD2 3.45Å; A373-H398 PolarHBondContact O-NE2 2.91Å
374	K	59.4	Low	66.4	Low	193 Å²	193	53.3 Å²	53.3	84%	0.839	28%	0.276	S	S	*	.	S	Bend	trans	-144.4	5.4	-170.7	-64.6	-173.4	179.3	-179	0	114.7
375	I	62.1	Low	67.9	Low	45 Å²	45	50.2 Å²	50.2	23%	0.231	26%	0.255	C	S	.	.	S	Bend	trans	-126	141.9	-170.7	-58.6	175.9	0	0	0	107.8	V347 T348 F377 Y380	V347-I375 HydrophobicContact CG1-CD1 4.24Å; T348-I375 WeakPolarHBondContact O-CD1 3.12Å; I375-F377 PolarHBondContact O-N 3.35Å; I375-Y380 HydrophobicContact CG2-CD2 3.78Å; I375-Y380 HydrophobicContact CG2-CE2 3.2Å
376	S	65.8	Low	68.9	Low	84 Å²	84	50.5 Å²	50.5	59%	0.587	25%	0.253	S	S	*	.			trans	-58.9	110.8	173.5	178.7	0	0	0	0	110.1	G378 H379	S376-G378 PolarHBondContact O-N 2.85Å; S376-H379 PolarHBondContact O-N 2.88Å
377	F	69.9	Low	69.6	Low	9 Å²	9	47.3 Å²	47.3	4%	0.039	24%	0.241	C	C	.	.	H	α-helix	trans	-49.7	-39.7	173.7	169.3	-120.1	0	0	0	111.7	F372 I375 H379 Y380 F381 V393 L395 L409 L410	F372-F377 HydrophobicContact CD2-CD2 4.41Å; I375-F377 PolarHBondContact O-N 3.35Å; F377-H379 VanDerWaalsContact C-N 3.27Å; F377-H379 PolarHBondContact O-N 3.3Å; F377-Y380 PolarHBondContact O-N 3.38Å; F377-Y380 VanDerWaalsContact O-N 3.12Å; F377-F381 HydrophobicContact CD2-CB 4.31Å; F377-F381 HydrophobicContact CD2-CD2 4.36Å; F377-F381 HydrophobicContact CE1-CB 4.26Å; F377-F381 HydrophobicContact CE1-CD1 4.14Å; F377-F381 AromaticContact CE1-CD2 3.82Å; F377-F381 HydrophobicContact CE1-CD2 3.82Å; F377-F381 HydrophobicContact CE1-CE1 4.28Å; F377-F381 HydrophobicContact CE1-CE2 4.07Å; F377-F381 AromaticContact CE1-CG 3.85Å; F377-F381 HydrophobicContact CE1-CG 3.85Å; F377-F381 HydrophobicContact CE1-CZ 4.29Å; F377-F381 HydrophobicContact CE2-CB 4.02Å; F377-F381 AromaticContact CE2-CD2 3.31Å; F377-F381 HydrophobicContact CE2-CD2 3.31Å; F377-F381 AromaticContact CE2-CE2 3.92Å; F377-F381 HydrophobicContact CE2-CE2 3.92Å; F377-F381 AromaticContact CE2-CG 3.87Å; F377-F381 HydrophobicContact CE2-CG 3.87Å; F377-F381 HydrophobicContact CZ-CB 4.04Å; F377-F381 HydrophobicContact CZ-CD1 4.13Å; F377-F381 AromaticContact CZ-CD2 2.99Å; F377-F381 HydrophobicContact CZ-CD2 2.99Å; F377-F381 HydrophobicContact CZ-CE1 4.23Å; F377-F381 AromaticContact CZ-CE2 3.24Å; F377-F381 HydrophobicContact CZ-CE2 3.24Å; F377-F381 AromaticContact CZ-CG 3.49Å; F377-F381 HydrophobicContact CZ-CG 3.49Å; F377-F381 VanDerWaalsContact CZ-CG 3.49Å; F377-F381 AromaticContact CZ-CZ 3.87Å; F377-F381 HydrophobicContact CZ-CZ 3.87Å; F377-F381 WeakPolarHBondContact O-CB 3.32Å; F377-F381 PolarHBondContact O-N 2.99Å; F377-V393 HydrophobicContact CD2-CG1 4.47Å; F377-V393 HydrophobicContact CE2-CG1 3.96Å; F377-L395 HydrophobicContact CB-CD2 4.07Å; F377-L395 HydrophobicContact CD1-CD1 4.11Å; F377-L395 HydrophobicContact CD1-CD2 4.36Å; F377-L395 HydrophobicContact CD2-CD1 4.48Å; F377-L395 HydrophobicContact CD2-CD2 3.43Å; F377-L395 VanDerWaalsContact CD2-CD2 3.43Å; F377-L395 HydrophobicContact CE1-CD1 4.08Å; F377-L395 HydrophobicContact CE2-CD1 4.44Å; F377-L395 HydrophobicContact CE2-CD2 3.81Å; F377-L395 HydrophobicContact CG-CD1 4.28Å; F377-L395 HydrophobicContact CG-CD2 3.71Å; F377-L395 HydrophobicContact CZ-CD1 4.19Å; F377-L395 HydrophobicContact CZ-CD2 4.39Å; F377-L409 HydrophobicContact CD1-CD2 3.79Å; F377-L409 HydrophobicContact CE1-CD2 3.95Å; F377-L410 HydrophobicContact CE1-CD2 3.57Å; F377-L410 HydrophobicContact CE1-CG 4.03Å; F377-L410 HydrophobicContact CZ-CD2 3.63Å
378	G	69.4	Low	69.3	Low	37 Å²	37	53.7 Å²	53.7	38%	0.381	28%	0.277	S	S	.	.	H	α-helix	trans	-61.6	-29.6	-175	0	0	0	0	0	115.3	S376 Y380	S376-G378 PolarHBondContact O-N 2.85Å; G378-Y380 VanDerWaalsContact C-N 3.28Å; G378-Y380 PolarHBondContact O-N 2.94Å
379	H	69.6	Low	69.2	Low	122 Å²	122	54.7 Å²	54.7	57%	0.565	29%	0.286	S	S	*	.	H	α-helix	trans	-69.6	-27.6	179.8	-167.1	83.5	0	0	0	112.7	S376 F377	S376-H379 PolarHBondContact O-N 2.88Å; F377-H379 VanDerWaalsContact C-N 3.27Å; F377-H379 PolarHBondContact O-N 3.3Å
380	Y	72.8	Confident	69	Low	26 Å²	26	57.4 Å²	57.4	10%	0.102	30%	0.304	C	S	.	.	H	α-helix	trans	-111.7	-14.4	-172.1	-59.6	-75.7	0	0	0	113.8	E350 L353 F372 I375 F377 G378 K382 K383 L384	E350-Y380 HydrophobicContact CB-CE1 3.56Å; E350-Y380 HydrophobicContact CG-CD1 4.49Å; E350-Y380 HydrophobicContact CG-CE1 3.61Å; L353-Y380 HydrophobicContact CD2-CD1 3.59Å; L353-Y380 HydrophobicContact CD2-CG 3.76Å; F372-Y380 HydrophobicContact CE1-CD2 4.48Å; I375-Y380 HydrophobicContact CG2-CD2 3.78Å; I375-Y380 HydrophobicContact CG2-CE2 3.2Å; F377-Y380 PolarHBondContact O-N 3.38Å; F377-Y380 VanDerWaalsContact O-N 3.12Å; G378-Y380 VanDerWaalsContact C-N 3.28Å; G378-Y380 PolarHBondContact O-N 2.94Å; Y380-K382 PolarHBondContact O-N 3.16Å; Y380-K383 WeakPolarHBondContact O-CB 3.25Å; Y380-K383 PolarHBondContact O-N 2.9Å; Y380-K383 VanDerWaalsContact O-N 3.09Å; Y380-L384 PolarHBondContact O-N 2.87Å; Y380-L384 VanDerWaalsContact O-N 3.1Å
381	F	74.6	Confident	69	Low	2 Å²	2	58.2 Å²	58.2	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-57.3	-47.3	-170.9	-178.7	-136.6	0	0	0	113.6	F377 K383 L384 M385 L409 L410 T413 L419	F377-F381 HydrophobicContact CD2-CB 4.31Å; F377-F381 HydrophobicContact CD2-CD2 4.36Å; F377-F381 HydrophobicContact CE1-CB 4.26Å; F377-F381 HydrophobicContact CE1-CD1 4.14Å; F377-F381 AromaticContact CE1-CD2 3.82Å; F377-F381 HydrophobicContact CE1-CD2 3.82Å; F377-F381 HydrophobicContact CE1-CE1 4.28Å; F377-F381 HydrophobicContact CE1-CE2 4.07Å; F377-F381 AromaticContact CE1-CG 3.85Å; F377-F381 HydrophobicContact CE1-CG 3.85Å; F377-F381 HydrophobicContact CE1-CZ 4.29Å; F377-F381 HydrophobicContact CE2-CB 4.02Å; F377-F381 AromaticContact CE2-CD2 3.31Å; F377-F381 HydrophobicContact CE2-CD2 3.31Å; F377-F381 AromaticContact CE2-CE2 3.92Å; F377-F381 HydrophobicContact CE2-CE2 3.92Å; F377-F381 AromaticContact CE2-CG 3.87Å; F377-F381 HydrophobicContact CE2-CG 3.87Å; F377-F381 HydrophobicContact CZ-CB 4.04Å; F377-F381 HydrophobicContact CZ-CD1 4.13Å; F377-F381 AromaticContact CZ-CD2 2.99Å; F377-F381 HydrophobicContact CZ-CD2 2.99Å; F377-F381 HydrophobicContact CZ-CE1 4.23Å; F377-F381 AromaticContact CZ-CE2 3.24Å; F377-F381 HydrophobicContact CZ-CE2 3.24Å; F377-F381 AromaticContact CZ-CG 3.49Å; F377-F381 HydrophobicContact CZ-CG 3.49Å; F377-F381 VanDerWaalsContact CZ-CG 3.49Å; F377-F381 AromaticContact CZ-CZ 3.87Å; F377-F381 HydrophobicContact CZ-CZ 3.87Å; F377-F381 WeakPolarHBondContact O-CB 3.32Å; F377-F381 PolarHBondContact O-N 2.99Å; F381-K383 VanDerWaalsContact C-N 3.3Å; F381-K383 PolarHBondContact O-N 2.81Å; F381-L384 WeakPolarHBondContact O-CB 3.48Å; F381-L384 PolarHBondContact O-N 2.87Å; F381-L384 VanDerWaalsContact O-N 3.09Å; F381-M385 HydrophobicContact CD2-CE 3.87Å; F381-M385 HydrophobicContact CD2-CG 3.83Å; F381-M385 HydrophobicContact CD2-SD 4.27Å; F381-M385 HydrophobicContact CE2-CE 3.58Å; F381-M385 HydrophobicContact CE2-CG 3.53Å; F381-M385 HydrophobicContact CE2-SD 3.58Å; F381-M385 VanDerWaalsContact CE2-SD 3.58Å; F381-M385 HydrophobicContact CG-CG 4.46Å; F381-M385 HydrophobicContact CZ-CG 3.98Å; F381-M385 HydrophobicContact CZ-SD 4.19Å; F381-M385 WeakPolarHBondContact O-CG 3.42Å; F381-M385 PolarHBondContact O-N 3.43Å; F381-L409 HydrophobicContact CB-CD2 4.32Å; F381-L409 HydrophobicContact CD1-CD1 4.31Å; F381-L409 HydrophobicContact CD1-CD2 3.9Å; F381-L409 HydrophobicContact CD1-CG 3.93Å; F381-L409 HydrophobicContact CE1-CG 4.2Å; F381-L409 HydrophobicContact CG-CD2 4.43Å; F381-L410 HydrophobicContact CE1-CD2 4.39Å; F381-L410 HydrophobicContact CE2-CD2 4.16Å; F381-L410 HydrophobicContact CZ-CD2 3.77Å; F381-T413 HydrophobicContact CD1-CG2 4.34Å; F381-T413 VanDerWaalsContact CE1-CB 3.45Å; F381-T413 HydrophobicContact CE1-CG2 3.45Å; F381-T413 VanDerWaalsContact CE1-CG2 3.45Å; F381-T413 WeakPolarHBondContact CE1-OG1 3.24Å; F381-T413 HydrophobicContact CZ-CG2 3.8Å; F381-L419 HydrophobicContact CE2-CD1 4.03Å; F381-L419 HydrophobicContact CZ-CD1 3.81Å; F381-L419 HydrophobicContact CZ-CD2 4.32Å; F381-L419 HydrophobicContact CZ-CG 4.44Å
382	K	73.7	Confident	69.2	Low	140 Å²	140	58 Å²	58	61%	0.609	31%	0.305	S	S	*	.	H	α-helix	trans	-59.3	-40.5	177.2	-72.4	-166.3	173	-164.2	0	112.6	Y380 L384 M385 M386	Y380-K382 PolarHBondContact O-N 3.16Å; K382-L384 VanDerWaalsContact C-N 3.3Å; K382-L384 PolarHBondContact O-N 2.87Å; K382-M385 PolarHBondContact O-N 2.65Å; K382-M386 WeakPolarHBondContact O-CG 3.29Å; K382-M386 PolarHBondContact O-N 3.12Å; K382-M386 VanDerWaalsContact O-N 3.15Å
383	K	75.1	Confident	69.8	Low	78 Å²	78	57.9 Å²	57.9	34%	0.339	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-35.8	177.4	-64.6	-177	-175.1	179.3	0	111.7	E350 L354 Y380 F381 T387	E350-K383 IonicContact OE1-NZ 3.59Å; E350-K383 PolarHBondContact OE1-NZ 3.35Å; L354-K383 HydrophobicContact CD2-CD 4.21Å; Y380-K383 WeakPolarHBondContact O-CB 3.25Å; Y380-K383 PolarHBondContact O-N 2.9Å; Y380-K383 VanDerWaalsContact O-N 3.09Å; F381-K383 VanDerWaalsContact C-N 3.3Å; F381-K383 PolarHBondContact O-N 2.81Å; K383-T387 WeakPolarHBondContact O-CG2 3.44Å
384	L	73.4	Confident	71	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-67.1	-43.8	175.4	-68.8	168.7	0	0	0	112.4	L353 L357 I370 F372 Y380 F381 K382 M386 T387 W391 V393	L353-L384 HydrophobicContact CD1-CD2 3.72Å; L353-L384 HydrophobicContact CD2-CD2 4.38Å; L357-L384 HydrophobicContact CD1-CD2 4.24Å; L357-L384 HydrophobicContact CD2-CD2 4.04Å; I370-L384 HydrophobicContact CD1-CD2 3.54Å; F372-L384 HydrophobicContact CE2-CD1 3.6Å; F372-L384 HydrophobicContact CZ-CD1 3.44Å; F372-L384 VanDerWaalsContact CZ-CD1 3.44Å; F372-L384 HydrophobicContact CZ-CG 4.46Å; Y380-L384 PolarHBondContact O-N 2.87Å; Y380-L384 VanDerWaalsContact O-N 3.1Å; F381-L384 WeakPolarHBondContact O-CB 3.48Å; F381-L384 PolarHBondContact O-N 2.87Å; F381-L384 VanDerWaalsContact O-N 3.09Å; K382-L384 VanDerWaalsContact C-N 3.3Å; K382-L384 PolarHBondContact O-N 2.87Å; L384-M386 VanDerWaalsContact C-N 3.32Å; L384-M386 PolarHBondContact O-N 2.97Å; L384-T387 PolarHBondContact O-N 3.38Å; L384-T387 PolarHBondContact O-OG1 3.16Å; L384-W391 HydrophobicContact CD2-CE3 4.04Å; L384-W391 HydrophobicContact CD2-CZ3 4Å; L384-V393 HydrophobicContact CD1-CG2 4.42Å
385	M	73.1	Confident	72.2	Confident	11 Å²	11	49.9 Å²	49.9	5%	0.054	27%	0.266	C	S	.	.	H	α-helix	trans	-72.9	-24.4	-175.5	-63.7	-55.6	104	0	0	113	F381 K382 T387 V393 L419 Y420 R421	F381-M385 HydrophobicContact CD2-CE 3.87Å; F381-M385 HydrophobicContact CD2-CG 3.83Å; F381-M385 HydrophobicContact CD2-SD 4.27Å; F381-M385 HydrophobicContact CE2-CE 3.58Å; F381-M385 HydrophobicContact CE2-CG 3.53Å; F381-M385 HydrophobicContact CE2-SD 3.58Å; F381-M385 VanDerWaalsContact CE2-SD 3.58Å; F381-M385 HydrophobicContact CG-CG 4.46Å; F381-M385 HydrophobicContact CZ-CG 3.98Å; F381-M385 HydrophobicContact CZ-SD 4.19Å; F381-M385 WeakPolarHBondContact O-CG 3.42Å; F381-M385 PolarHBondContact O-N 3.43Å; K382-M385 PolarHBondContact O-N 2.65Å; M385-T387 PolarHBondContact O-N 3.01Å; M385-V393 HydrophobicContact CE-CG2 4.25Å; M385-L419 HydrophobicContact SD-CD1 3.86Å; M385-Y420 PolarHBondContact O-OH 3.09Å; M385-R421 HydrophobicContact CE-CB 4.19Å; M385-R421 HydrophobicContact CE-CG 3.95Å; M385-R421 HydrophobicContact SD-CB 4.3Å; M385-R421 HydrophobicContact SD-CG 3.94Å
386	M	69.4	Low	73.2	Confident	148 Å²	148	51 Å²	51	73%	0.729	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	2.5	176.8	-72.4	-168.8	-57.5	0	0	114.5	K382 L384	K382-M386 WeakPolarHBondContact O-CG 3.29Å; K382-M386 PolarHBondContact O-N 3.12Å; K382-M386 VanDerWaalsContact O-N 3.15Å; L384-M386 VanDerWaalsContact C-N 3.32Å; L384-M386 PolarHBondContact O-N 2.97Å
387	T	68.8	Low	73.9	Confident	25 Å²	25	47.3 Å²	47.3	15%	0.153	24%	0.242	C	C	.	.			trans	-100.7	139.1	-176.4	83	0	0	0	0	111.9	L357 K383 L384 M385 A389 W391 R421	L357-T387 HydrophobicContact CD1-CG2 4.15Å; K383-T387 WeakPolarHBondContact O-CG2 3.44Å; L384-T387 PolarHBondContact O-N 3.38Å; L384-T387 PolarHBondContact O-OG1 3.16Å; M385-T387 PolarHBondContact O-N 3.01Å; T387-A389 PolarHBondContact O-N 3.44Å; T387-W391 VanDerWaalsContact CB-CH2 3.44Å; T387-W391 HydrophobicContact CG2-CE3 4.47Å; T387-W391 HydrophobicContact CG2-CH2 3.38Å; T387-W391 HydrophobicContact CG2-CZ2 4.5Å; T387-W391 HydrophobicContact CG2-CZ3 3.38Å; T387-W391 VanDerWaalsContact OG1-CE3 3.26Å; T387-W391 WeakPolarHBondContact OG1-CH2 3.25Å; T387-W391 WeakPolarHBondContact OG1-CZ3 3.36Å; T387-R421 PolarHBondContact O-NH2 2.94Å
388	D	62.6	Low	74.5	Confident	160 Å²	160	50.9 Å²	50.9	86%	0.856	26%	0.258	S	S	*	.			trans	-77.4	-4.8	-177.9	-63.3	-38.1	0	0	0	113.8
389	A	65.8	Low	75	Confident	35 Å²	35	50.6 Å²	50.6	29%	0.289	26%	0.255	S	S	.	.	S	Bend	trans	-81.1	144.1	-177.6	0	0	0	0	0	112	T387 W391 R421	T387-A389 PolarHBondContact O-N 3.44Å; A389-W391 HydrophobicContact CB-CD2 4.35Å; A389-W391 VanDerWaalsContact CB-CE2 3.47Å; A389-W391 HydrophobicContact CB-CZ2 3.7Å; A389-W391 PolarHBondContact O-N 2.94Å; A389-R421 PolarHBondContact O-NH2 2.91Å
390	P	65.6	Low	75.6	Confident	57 Å²	57	47.4 Å²	47.4	37%	0.37	24%	0.24	S	C	.	.			trans	-76.2	91.6	-178.7	30.6	-34.2	0	0	0	110.3
391	W	73.1	Confident	76.2	Confident	23 Å²	23	54.1 Å²	54.1	9%	0.087	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	150.7	177.3	-55.4	-20.2	0	0	0	111.8	L357 V368 I370 L384 T387 A389 R421	L357-W391 HydrophobicContact CB-CH2 3.65Å; L357-W391 HydrophobicContact CB-CZ2 4.49Å; L357-W391 HydrophobicContact CB-CZ3 4.37Å; L357-W391 HydrophobicContact CD1-CH2 4.05Å; L357-W391 HydrophobicContact CD1-CZ3 3.91Å; L357-W391 HydrophobicContact CD2-CE3 4.05Å; L357-W391 HydrophobicContact CD2-CH2 3.11Å; L357-W391 HydrophobicContact CD2-CZ2 3.93Å; L357-W391 HydrophobicContact CD2-CZ3 3.16Å; L357-W391 HydrophobicContact CG-CH2 3.68Å; L357-W391 HydrophobicContact CG-CZ3 3.91Å; V368-W391 CarbonylContact O-C 3.55Å; V368-W391 VanDerWaalsContact O-CA 3.26Å; V368-W391 WeakPolarHBondContact O-CA 3.47Å; I370-W391 HydrophobicContact CD1-CD2 4.07Å; I370-W391 HydrophobicContact CD1-CE3 3.81Å; I370-W391 HydrophobicContact CD1-CG 4.43Å; I370-W391 HydrophobicContact CD1-CZ3 4.39Å; L384-W391 HydrophobicContact CD2-CE3 4.04Å; L384-W391 HydrophobicContact CD2-CZ3 4Å; T387-W391 VanDerWaalsContact CB-CH2 3.44Å; T387-W391 HydrophobicContact CG2-CE3 4.47Å; T387-W391 HydrophobicContact CG2-CH2 3.38Å; T387-W391 HydrophobicContact CG2-CZ2 4.5Å; T387-W391 HydrophobicContact CG2-CZ3 3.38Å; T387-W391 VanDerWaalsContact OG1-CE3 3.26Å; T387-W391 WeakPolarHBondContact OG1-CH2 3.25Å; T387-W391 WeakPolarHBondContact OG1-CZ3 3.36Å; A389-W391 HydrophobicContact CB-CD2 4.35Å; A389-W391 VanDerWaalsContact CB-CE2 3.47Å; A389-W391 HydrophobicContact CB-CZ2 3.7Å; A389-W391 PolarHBondContact O-N 2.94Å; W391-R421 WeakPolarHBondContact O-CB 3.36Å; W391-R421 VanDerWaalsContact O-CD 3.31Å; W391-R421 WeakPolarHBondContact O-CD 3.27Å
392	G	79.3	Confident	76.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	161.5	161.4	0	0	0	0	0	110.8	V368 I369 I370 P422	V368-G392 PolarHBondContact O-N 3.21Å; I369-G392 WeakPolarHBondContact CA-O 3.37Å; I370-G392 PolarHBondContact N-O 3.05Å; G392-P422 CarbonylContact C-O 3.58Å; G392-P422 WeakPolarHBondContact CA-O 3.36Å
393	V	82.3	Confident	77.2	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127	-180	-176.6	0	0	0	0	109.8	I370 F372 F377 L384 M385 L395 P422 I423 W424	I370-V393 WeakPolarHBondContact O-CA 3.49Å; F372-V393 HydrophobicContact CD2-CG1 3.71Å; F372-V393 HydrophobicContact CE2-CG1 3.81Å; F377-V393 HydrophobicContact CD2-CG1 4.47Å; F377-V393 HydrophobicContact CE2-CG1 3.96Å; L384-V393 HydrophobicContact CD1-CG2 4.42Å; M385-V393 HydrophobicContact CE-CG2 4.25Å; V393-L395 HydrophobicContact CG1-CD2 3.54Å; V393-L395 HydrophobicContact CG1-CG 4.07Å; V393-P422 PolarHBondContact N-O 3.42Å; V393-I423 HydrophobicContact CB-CD1 3.64Å; V393-I423 HydrophobicContact CG1-CD1 4.47Å; V393-I423 HydrophobicContact CG2-CD1 3.94Å; V393-I423 CarbonylContact O-C 3.53Å; V393-I423 VanDerWaalsContact O-CA 3.3Å; V393-I423 WeakPolarHBondContact O-CA 3.49Å; V393-W424 VanDerWaalsContact O-CE3 3.28Å; V393-W424 PolarHBondContact O-N 2.83Å
394	Y	84.5	Confident	77.9	Confident	37 Å²	37	51.1 Å²	51.1	15%	0.145	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	112.9	171.3	175.4	-143.1	0	0	0	110.6	W344 I370 S371 F372 R396 W424 S426 V459	W344-Y394 HydrophobicContact CE3-CD1 4.32Å; W344-Y394 AromaticContact CZ3-CD1 3.58Å; W344-Y394 HydrophobicContact CZ3-CD1 3.58Å; W344-Y394 HydrophobicContact CZ3-CE1 4.39Å; W344-Y394 AromaticContact CZ3-CG 3.91Å; W344-Y394 HydrophobicContact CZ3-CG 3.91Å; I370-Y394 PolarHBondContact O-N 3.26Å; S371-Y394 CarbonylContact C-O 3.54Å; S371-Y394 VanDerWaalsContact CA-O 3.24Å; S371-Y394 WeakPolarHBondContact CA-O 3.36Å; F372-Y394 PolarHBondContact N-O 3.35Å; Y394-R396 HydrophobicContact CD1-CG 4.21Å; Y394-R396 HydrophobicContact CE1-CG 3.57Å; Y394-R396 HydrophobicContact CE2-CG 4.02Å; Y394-R396 VanDerWaalsContact CZ-CG 3.45Å; Y394-W424 HydrophobicContact CD2-CB 3.52Å; Y394-W424 HydrophobicContact CE2-CB 4.27Å; Y394-W424 HydrophobicContact CG-CB 4.25Å; Y394-S426 WeakPolarHBondContact CE2-OG 3.33Å; Y394-S426 WeakPolarHBondContact OH-CB 3.49Å; Y394-S426 PolarHBondContact OH-OG 2.92Å; Y394-V459 HydrophobicContact CE2-CB 4.17Å; Y394-V459 HydrophobicContact CE2-CG1 4.43Å; Y394-V459 HydrophobicContact CE2-CG2 4.23Å
395	L	84.5	Confident	78.5	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	111.8	179	-56.7	-179	0	0	0	109.6	F372 F377 V393 V397 L410 I423 W424 I425 S426	F372-L395 HydrophobicContact CB-CD2 4.09Å; F372-L395 HydrophobicContact CD2-CD2 3.99Å; F372-L395 HydrophobicContact CG-CD2 4.3Å; F377-L395 HydrophobicContact CB-CD2 4.07Å; F377-L395 HydrophobicContact CD1-CD1 4.11Å; F377-L395 HydrophobicContact CD1-CD2 4.36Å; F377-L395 HydrophobicContact CD2-CD1 4.48Å; F377-L395 HydrophobicContact CD2-CD2 3.43Å; F377-L395 VanDerWaalsContact CD2-CD2 3.43Å; F377-L395 HydrophobicContact CE1-CD1 4.08Å; F377-L395 HydrophobicContact CE2-CD1 4.44Å; F377-L395 HydrophobicContact CE2-CD2 3.81Å; F377-L395 HydrophobicContact CG-CD1 4.28Å; F377-L395 HydrophobicContact CG-CD2 3.71Å; F377-L395 HydrophobicContact CZ-CD1 4.19Å; F377-L395 HydrophobicContact CZ-CD2 4.39Å; V393-L395 HydrophobicContact CG1-CD2 3.54Å; V393-L395 HydrophobicContact CG1-CG 4.07Å; L395-V397 HydrophobicContact CB-CG2 4.19Å; L395-L410 HydrophobicContact CD1-CD1 4.21Å; L395-I423 HydrophobicContact CD1-CG2 3.91Å; L395-I423 HydrophobicContact CG-CG2 4.23Å; L395-W424 PolarHBondContact N-O 3.39Å; L395-I425 HydrophobicContact CB-CG1 4.16Å; L395-I425 WeakPolarHBondContact O-CA 3.44Å; L395-S426 PolarHBondContact O-N 2.87Å
396	R	83.3	Confident	79.2	Confident	68 Å²	68	54 Å²	54	26%	0.257	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	105.2	166.8	-72	-177.2	-76.1	177.9	-7.8	107.9	S346 S371 F372 A373 Y394 S426	S346-R396 PolarHBondContact OG-NH2 3.44Å; S371-R396 PolarHBondContact OG-NE 2.84Å; S371-R396 VanDerWaalsContact OG-NE 3.09Å; S371-R396 PolarHBondContact OG-NH2 3.42Å; F372-R396 WeakPolarHBondContact O-CB 3.45Å; F372-R396 PolarHBondContact O-N 3.3Å; A373-R396 HydrophobicContact CB-CB 4.35Å; Y394-R396 HydrophobicContact CD1-CG 4.21Å; Y394-R396 HydrophobicContact CE1-CG 3.57Å; Y394-R396 HydrophobicContact CE2-CG 4.02Å; Y394-R396 VanDerWaalsContact CZ-CG 3.45Å; R396-S426 WeakPolarHBondContact CG-OG 3.42Å
397	V	81.9	Confident	80.2	Confident	8 Å²	8	47 Å²	47	5%	0.048	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	138.3	-173.4	-174.1	0	0	0	0	110.2	L395 L402 L403 I425 S426 M427 E428	L395-V397 HydrophobicContact CB-CG2 4.19Å; V397-L402 HydrophobicContact CG1-CB 3.53Å; V397-L403 HydrophobicContact CG1-CB 4.07Å; V397-L403 VanDerWaalsContact CG1-N 3.32Å; V397-I425 HydrophobicContact CG2-CD1 3.97Å; V397-I425 HydrophobicContact CG2-CG1 3.96Å; V397-S426 PolarHBondContact N-O 3.26Å; V397-M427 WeakPolarHBondContact O-CA 3.45Å; V397-E428 PolarHBondContact O-N 3.25Å
398	H	81.4	Confident	81.2	Confident	84 Å²	84	51 Å²	51	39%	0.389	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	95.5	177.5	-61.7	-81	0	0	0	110.1	A373 E428	A373-H398 PolarHBondContact O-CD2 3.45Å; A373-H398 PolarHBondContact O-NE2 2.91Å; H398-E428 IonicContact CE1-OE1 3.11Å; H398-E428 IonicContact CE1-OE2 3.03Å; H398-E428 PolarHBondContact CE1-OE2 3.35Å; H398-E428 IonicContact ND1-OE2 3.47Å; H398-E428 PolarHBondContact ND1-OE2 3.13Å
399	G	79.6	Confident	82.5	Confident	30 Å²	30	46 Å²	46	31%	0.309	24%	0.243	S	C	.	.	S	Bend	trans	91.2	157.1	176	0	0	0	0	0	115.3	Q401 L402 L403	G399-Q401 PolarHBondContact O-N 3.05Å; G399-L402 PolarHBondContact O-N 3Å; G399-L403 PolarHBondContact O-N 3.45Å
400	H	83.6	Confident	83.5	Confident	55 Å²	55	44.3 Å²	44.3	26%	0.255	23%	0.229	S	C	.	.	H	α-helix	trans	-64.1	-36.5	-168.8	-164.5	105.3	0	0	0	113.7	L402 L403 E404 D444 T448	H400-L402 VanDerWaalsContact C-N 3.35Å; H400-L402 PolarHBondContact O-N 2.83Å; H400-L403 VanDerWaalsContact O-CB 3.31Å; H400-L403 WeakPolarHBondContact O-CB 3.3Å; H400-L403 PolarHBondContact O-N 3.36Å; H400-L403 VanDerWaalsContact O-N 3.13Å; H400-E404 IonicContact CD2-OE1 2.7Å; H400-E404 PolarHBondContact CD2-OE1 3.14Å; H400-E404 IonicContact NE2-OE1 3.9Å; H400-E404 PolarHBondContact NE2-OE1 3.4Å; H400-E404 PolarHBondContact O-N 3.44Å; H400-D444 IonicContact CE1-OD1 3.42Å; H400-D444 IonicContact CE1-OD2 2.81Å; H400-D444 PolarHBondContact CE1-OD2 3.45Å; H400-D444 IonicContact CG-OD2 3.01Å; H400-D444 IonicContact ND1-OD2 3.58Å; H400-D444 PolarHBondContact ND1-OD2 2.65Å; H400-T448 PolarHBondContact CE1-OG1 3.01Å
401	Q	84.1	Confident	84.6	Confident	168 Å²	168	44.6 Å²	44.6	79%	0.785	23%	0.226	S	C	*	.	H	α-helix	trans	-63.1	-39.6	179.5	-171.2	-179	8.8	0	0	112.7	G399 L403 A405	G399-Q401 PolarHBondContact O-N 3.05Å; Q401-L403 VanDerWaalsContact C-N 3.33Å; Q401-A405 WeakPolarHBondContact O-CB 3.46Å; Q401-A405 PolarHBondContact O-N 2.79Å; Q401-A405 VanDerWaalsContact O-N 3.15Å
402	L	83.3	Confident	85.2	Confident	93 Å²	93	46.4 Å²	46.4	49%	0.487	25%	0.246	S	C	.	.	H	α-helix	trans	-73.6	-29.1	176.7	-71.1	179.5	0	0	0	111.7	V397 G399 H400 S406	V397-L402 HydrophobicContact CG1-CB 3.53Å; G399-L402 PolarHBondContact O-N 3Å; H400-L402 VanDerWaalsContact C-N 3.35Å; H400-L402 PolarHBondContact O-N 2.83Å; L402-S406 VanDerWaalsContact O-CB 3.29Å; L402-S406 WeakPolarHBondContact O-CB 3.41Å; L402-S406 PolarHBondContact O-N 3.5Å; L402-S406 PolarHBondContact O-OG 2.8Å
403	L	86.6	Confident	85.4	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-55.8	174.9	171	68.8	0	0	0	109.5	V397 G399 H400 Q401 A405 S406 L407 I425 M427 F445 T448 V449	V397-L403 HydrophobicContact CG1-CB 4.07Å; V397-L403 VanDerWaalsContact CG1-N 3.32Å; G399-L403 PolarHBondContact O-N 3.45Å; H400-L403 VanDerWaalsContact O-CB 3.31Å; H400-L403 WeakPolarHBondContact O-CB 3.3Å; H400-L403 PolarHBondContact O-N 3.36Å; H400-L403 VanDerWaalsContact O-N 3.13Å; Q401-L403 VanDerWaalsContact C-N 3.33Å; L403-A405 VanDerWaalsContact C-N 3.33Å; L403-A405 PolarHBondContact O-N 2.89Å; L403-S406 PolarHBondContact O-N 3.47Å; L403-S406 VanDerWaalsContact O-N 3.15Å; L403-L407 HydrophobicContact CD1-CD1 3.65Å; L403-L407 HydrophobicContact CD1-CG 4.07Å; L403-L407 HydrophobicContact CG-CD1 3.77Å; L403-L407 HydrophobicContact CG-CG 4.49Å; L403-L407 WeakPolarHBondContact O-CG 3.2Å; L403-L407 PolarHBondContact O-N 3.13Å; L403-I425 HydrophobicContact CD1-CD1 3.46Å; L403-I425 VanDerWaalsContact CD1-CD1 3.46Å; L403-I425 HydrophobicContact CD1-CG1 4.22Å; L403-M427 HydrophobicContact CB-SD 4.39Å; L403-M427 HydrophobicContact CD2-SD 4.06Å; L403-F445 HydrophobicContact CD1-CD2 3.98Å; L403-F445 HydrophobicContact CD1-CE2 3.74Å; L403-F445 HydrophobicContact CD2-CD2 3.63Å; L403-F445 HydrophobicContact CD2-CE2 4.28Å; L403-F445 HydrophobicContact CG-CD2 4.45Å; L403-T448 HydrophobicContact CD2-CG2 3.84Å; L403-T448 HydrophobicContact CG-CG2 4.19Å; L403-V449 HydrophobicContact CD1-CG2 4.25Å
404	E	89.4	Confident	85.4	Confident	63 Å²	63	47.4 Å²	47.4	29%	0.294	25%	0.25	S	S	.	.	H	α-helix	trans	-56.1	-46.7	177.7	-74.4	-169.5	-135.7	0	0	112.3	H400 S406 L407 K408 T448 L452	H400-E404 IonicContact CD2-OE1 2.7Å; H400-E404 PolarHBondContact CD2-OE1 3.14Å; H400-E404 IonicContact NE2-OE1 3.9Å; H400-E404 PolarHBondContact NE2-OE1 3.4Å; H400-E404 PolarHBondContact O-N 3.44Å; E404-S406 VanDerWaalsContact C-N 3.29Å; E404-S406 PolarHBondContact O-N 3.16Å; E404-L407 PolarHBondContact O-N 2.78Å; E404-K408 WeakPolarHBondContact O-CB 3.33Å; E404-K408 VanDerWaalsContact O-CG 3.27Å; E404-K408 WeakPolarHBondContact O-CG 3.47Å; E404-K408 PolarHBondContact O-N 2.89Å; E404-K408 IonicContact OE2-NZ 3.32Å; E404-K408 PolarHBondContact OE2-NZ 2.84Å; E404-T448 HydrophobicContact CG-CG2 4.11Å; E404-L452 HydrophobicContact CB-CD1 4.04Å; E404-L452 HydrophobicContact CG-CD1 3.87Å
405	A	87.3	Confident	85.2	Confident	57 Å²	57	49.7 Å²	49.7	47%	0.471	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-39.3	-179.7	0	0	0	0	0	111.9	Q401 L403 L409	Q401-A405 WeakPolarHBondContact O-CB 3.46Å; Q401-A405 PolarHBondContact O-N 2.79Å; Q401-A405 VanDerWaalsContact O-N 3.15Å; L403-A405 VanDerWaalsContact C-N 3.33Å; L403-A405 PolarHBondContact O-N 2.89Å; A405-L409 WeakPolarHBondContact O-CB 3.4Å; A405-L409 PolarHBondContact O-N 2.81Å; A405-L409 VanDerWaalsContact O-N 3.14Å
406	S	87.8	Confident	85	Confident	17 Å²	17	51.9 Å²	51.9	12%	0.119	29%	0.291	C	S	.	.	H	α-helix	trans	-68.4	-46	177.5	-58.6	0	0	0	0	111.3	L402 L403 E404 L409 L410	L402-S406 VanDerWaalsContact O-CB 3.29Å; L402-S406 WeakPolarHBondContact O-CB 3.41Å; L402-S406 PolarHBondContact O-N 3.5Å; L402-S406 PolarHBondContact O-OG 2.8Å; L403-S406 PolarHBondContact O-N 3.47Å; L403-S406 VanDerWaalsContact O-N 3.15Å; E404-S406 VanDerWaalsContact C-N 3.29Å; E404-S406 PolarHBondContact O-N 3.16Å; S406-L409 WeakPolarHBondContact O-CB 3.32Å; S406-L409 PolarHBondContact O-N 3.21Å; S406-L410 VanDerWaalsContact O-CG 3.32Å; S406-L410 WeakPolarHBondContact O-CG 3.44Å; S406-L410 PolarHBondContact O-N 3Å
407	L	90.1	Very high	84.7	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-41.8	178.9	-65.7	168.6	0	0	0	111.7	L403 E404 L409 L410 Q411 I425 T448 V449 L452 F453	L403-L407 HydrophobicContact CD1-CD1 3.65Å; L403-L407 HydrophobicContact CD1-CG 4.07Å; L403-L407 HydrophobicContact CG-CD1 3.77Å; L403-L407 HydrophobicContact CG-CG 4.49Å; L403-L407 WeakPolarHBondContact O-CG 3.2Å; L403-L407 PolarHBondContact O-N 3.13Å; E404-L407 PolarHBondContact O-N 2.78Å; L407-L409 VanDerWaalsContact C-N 3.31Å; L407-L409 PolarHBondContact O-N 3.49Å; L407-L410 HydrophobicContact CD2-CD1 4.42Å; L407-L410 PolarHBondContact O-N 3.2Å; L407-Q411 WeakPolarHBondContact O-CB 3.4Å; L407-Q411 PolarHBondContact O-N 2.74Å; L407-I425 HydrophobicContact CD2-CD1 4.09Å; L407-I425 HydrophobicContact CG-CD1 4.45Å; L407-T448 HydrophobicContact CD1-CG2 3.98Å; L407-V449 HydrophobicContact CD1-CG2 4.03Å; L407-V449 HydrophobicContact CD2-CG2 4.27Å; L407-L452 HydrophobicContact CB-CB 3.75Å; L407-L452 HydrophobicContact CB-CD1 4.2Å; L407-L452 HydrophobicContact CD1-CB 4.09Å; L407-L452 HydrophobicContact CD1-CD1 4.21Å; L407-F453 HydrophobicContact CB-CB 4.15Å; L407-F453 HydrophobicContact CD2-CB 3.96Å
408	K	90.2	Very high	84.6	Confident	109 Å²	109	57 Å²	57	47%	0.474	32%	0.317	S	S	.	.	H	α-helix	trans	-61.1	-38.9	174.5	-73.9	168.6	-175.3	161.3	0	112	E404 A412	E404-K408 WeakPolarHBondContact O-CB 3.33Å; E404-K408 VanDerWaalsContact O-CG 3.27Å; E404-K408 WeakPolarHBondContact O-CG 3.47Å; E404-K408 PolarHBondContact O-N 2.89Å; E404-K408 IonicContact OE2-NZ 3.32Å; E404-K408 PolarHBondContact OE2-NZ 2.84Å; K408-A412 WeakPolarHBondContact O-CB 3.41Å; K408-A412 PolarHBondContact O-N 2.71Å
409	L	88.6	Confident	84.5	Confident	55 Å²	55	53.2 Å²	53.2	29%	0.288	30%	0.3	S	S	.	.	H	α-helix	trans	-66.5	-43.5	174.6	176.8	65.9	0	0	0	112.1	F377 F381 A405 S406 L407 A412 T413	F377-L409 HydrophobicContact CD1-CD2 3.79Å; F377-L409 HydrophobicContact CE1-CD2 3.95Å; F381-L409 HydrophobicContact CB-CD2 4.32Å; F381-L409 HydrophobicContact CD1-CD1 4.31Å; F381-L409 HydrophobicContact CD1-CD2 3.9Å; F381-L409 HydrophobicContact CD1-CG 3.93Å; F381-L409 HydrophobicContact CE1-CG 4.2Å; F381-L409 HydrophobicContact CG-CD2 4.43Å; A405-L409 WeakPolarHBondContact O-CB 3.4Å; A405-L409 PolarHBondContact O-N 2.81Å; A405-L409 VanDerWaalsContact O-N 3.14Å; S406-L409 WeakPolarHBondContact O-CB 3.32Å; S406-L409 PolarHBondContact O-N 3.21Å; L407-L409 VanDerWaalsContact C-N 3.31Å; L407-L409 PolarHBondContact O-N 3.49Å; L409-A412 PolarHBondContact O-N 2.96Å; L409-T413 WeakPolarHBondContact O-CB 3.5Å; L409-T413 PolarHBondContact O-N 3.2Å; L409-T413 PolarHBondContact O-OG1 3.15Å
410	L	87.9	Confident	84.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-46.7	175.9	-68.7	172.1	0	0	0	110.6	F377 F381 L395 S406 L407 A412 T413 Y414 L419 I423 F453 V456	F377-L410 HydrophobicContact CE1-CD2 3.57Å; F377-L410 HydrophobicContact CE1-CG 4.03Å; F377-L410 HydrophobicContact CZ-CD2 3.63Å; F381-L410 HydrophobicContact CE1-CD2 4.39Å; F381-L410 HydrophobicContact CE2-CD2 4.16Å; F381-L410 HydrophobicContact CZ-CD2 3.77Å; L395-L410 HydrophobicContact CD1-CD1 4.21Å; S406-L410 VanDerWaalsContact O-CG 3.32Å; S406-L410 WeakPolarHBondContact O-CG 3.44Å; S406-L410 PolarHBondContact O-N 3Å; L407-L410 HydrophobicContact CD2-CD1 4.42Å; L407-L410 PolarHBondContact O-N 3.2Å; L410-A412 PolarHBondContact O-N 3.27Å; L410-T413 PolarHBondContact O-N 3.13Å; L410-Y414 VanDerWaalsContact O-CB 3.29Å; L410-Y414 WeakPolarHBondContact O-CB 3.23Å; L410-Y414 PolarHBondContact O-N 3.4Å; L410-L419 HydrophobicContact CB-CD2 3.97Å; L410-L419 HydrophobicContact CD2-CD1 4.49Å; L410-L419 HydrophobicContact CD2-CD2 3.65Å; L410-L419 HydrophobicContact CG-CD2 4.4Å; L410-I423 HydrophobicContact CD1-CG2 3.99Å; L410-I423 HydrophobicContact CD2-CD1 4.25Å; L410-I423 HydrophobicContact CD2-CG1 4.05Å; L410-I423 HydrophobicContact CD2-CG2 4.46Å; L410-F453 HydrophobicContact CB-CD1 3.47Å; L410-F453 VanDerWaalsContact CB-CD1 3.47Å; L410-F453 HydrophobicContact CB-CD2 4.4Å; L410-F453 HydrophobicContact CB-CE1 3.66Å; L410-F453 HydrophobicContact CB-CG 3.9Å; L410-F453 HydrophobicContact CB-CZ 4.19Å; L410-F453 HydrophobicContact CD1-CD1 3.78Å; L410-F453 HydrophobicContact CD1-CE1 4.1Å; L410-F453 HydrophobicContact CG-CD1 4.24Å; L410-F453 HydrophobicContact CG-CE1 4.36Å; L410-V456 HydrophobicContact CD1-CG1 4.08Å
411	Q	87.2	Confident	84.3	Confident	63 Å²	63	51.7 Å²	51.7	29%	0.294	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-48	176.1	179.5	57.4	58.6	0	0	111.8	L407 T413 Y414 S415 L452 F453	L407-Q411 WeakPolarHBondContact O-CB 3.4Å; L407-Q411 PolarHBondContact O-N 2.74Å; Q411-T413 VanDerWaalsContact C-N 3.25Å; Q411-T413 PolarHBondContact O-N 3.25Å; Q411-Y414 PolarHBondContact O-N 2.9Å; Q411-S415 PolarHBondContact NE2-OG 2.88Å; Q411-S415 WeakPolarHBondContact O-CB 3.36Å; Q411-S415 PolarHBondContact O-N 2.99Å; Q411-S415 PolarHBondContact O-OG 3.4Å; Q411-S415 VanDerWaalsContact O-OG 3.11Å; Q411-L452 PolarHBondContact OE1-O 2.93Å; Q411-F453 HydrophobicContact CB-CB 4.44Å; Q411-F453 HydrophobicContact CB-CD2 4Å
412	A	86.4	Confident	84.1	Confident	61 Å²	61	43.7 Å²	43.7	50%	0.504	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-37.2	178.3	0	0	0	0	0	112.4	K408 L409 L410 A416	K408-A412 WeakPolarHBondContact O-CB 3.41Å; K408-A412 PolarHBondContact O-N 2.71Å; L409-A412 PolarHBondContact O-N 2.96Å; L410-A412 PolarHBondContact O-N 3.27Å; A412-A416 PolarHBondContact O-N 3.36Å
413	T	83.3	Confident	84.2	Confident	11 Å²	11	39.3 Å²	39.3	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-80.7	-34.5	-177.6	-52.7	0	0	0	0	111.9	F381 L409 L410 Q411 A416 E417 E418 L419	F381-T413 HydrophobicContact CD1-CG2 4.34Å; F381-T413 VanDerWaalsContact CE1-CB 3.45Å; F381-T413 HydrophobicContact CE1-CG2 3.45Å; F381-T413 VanDerWaalsContact CE1-CG2 3.45Å; F381-T413 WeakPolarHBondContact CE1-OG1 3.24Å; F381-T413 HydrophobicContact CZ-CG2 3.8Å; L409-T413 WeakPolarHBondContact O-CB 3.5Å; L409-T413 PolarHBondContact O-N 3.2Å; L409-T413 PolarHBondContact O-OG1 3.15Å; L410-T413 PolarHBondContact O-N 3.13Å; Q411-T413 VanDerWaalsContact C-N 3.25Å; Q411-T413 PolarHBondContact O-N 3.25Å; T413-A416 CarbonylContact O-C 3.46Å; T413-A416 PolarHBondContact O-N 2.98Å; T413-E417 PolarHBondContact O-N 2.88Å; T413-E418 HydrophobicContact CG2-CB 3.49Å; T413-E418 VanDerWaalsContact CG2-CB 3.49Å; T413-E418 PolarHBondContact O-N 2.92Å; T413-L419 HydrophobicContact CG2-CB 4.06Å; T413-L419 PolarHBondContact O-N 2.99Å
414	Y	81.8	Confident	84.1	Confident	12 Å²	12	40.3 Å²	40.3	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-44.6	169.2	-177.4	-97.6	0	0	0	111.6	H241 F275 F310 L410 Q411 A416 E417 F453 Y455	H241-Y414 PolarHBondContact CD2-OH 3.23Å; H241-Y414 AromaticContact NE2-CE1 3.66Å; H241-Y414 AromaticContact NE2-CZ 3.51Å; H241-Y414 PolarHBondContact NE2-OH 3.39Å; F275-Y414 HydrophobicContact CE2-CE2 4.32Å; F275-Y414 AromaticContact CE2-CZ 3.97Å; F275-Y414 WeakPolarHBondContact CE2-OH 3.47Å; F275-Y414 WeakPolarHBondContact CZ-OH 3.34Å; F310-Y414 HydrophobicContact CD1-CE2 4.46Å; L410-Y414 VanDerWaalsContact O-CB 3.29Å; L410-Y414 WeakPolarHBondContact O-CB 3.23Å; L410-Y414 PolarHBondContact O-N 3.4Å; Q411-Y414 PolarHBondContact O-N 2.9Å; Y414-A416 PolarHBondContact O-N 3.36Å; Y414-E417 PolarHBondContact O-N 2.97Å; Y414-F453 VanDerWaalsContact CB-CE2 3.5Å; Y414-F453 HydrophobicContact CD1-CE2 4.13Å; Y414-F453 HydrophobicContact CD2-CE2 4.01Å; Y414-F453 HydrophobicContact CD2-CZ 4.07Å; Y414-F453 AromaticContact CG-CE2 3.63Å; Y414-F453 HydrophobicContact CG-CE2 3.63Å; Y414-F453 HydrophobicContact CG-CZ 4.12Å; Y414-Y455 HydrophobicContact CD1-CD2 4.48Å; Y414-Y455 HydrophobicContact CD1-CE2 4.45Å; Y414-Y455 HydrophobicContact CE1-CD2 4.06Å; Y414-Y455 AromaticContact CE1-CE2 3.78Å; Y414-Y455 HydrophobicContact CE1-CE2 3.78Å; Y414-Y455 HydrophobicContact CE2-CD2 4.24Å; Y414-Y455 HydrophobicContact CE2-CG 4.41Å; Y414-Y455 AromaticContact CZ-CD2 3.91Å; Y414-Y455 AromaticContact CZ-CE2 3.87Å
415	S	80.5	Confident	84	Confident	85 Å²	85	37.3 Å²	37.3	59%	0.594	21%	0.212	S	C	*	.	H	α-helix	trans	-63.2	-22.1	173.7	-67.5	0	0	0	0	113.5	Q411 E417	Q411-S415 PolarHBondContact NE2-OG 2.88Å; Q411-S415 WeakPolarHBondContact O-CB 3.36Å; Q411-S415 PolarHBondContact O-N 2.99Å; Q411-S415 PolarHBondContact O-OG 3.4Å; Q411-S415 VanDerWaalsContact O-OG 3.11Å; S415-E417 VanDerWaalsContact C-N 3.34Å
416	A	81.3	Confident	83.9	Confident	51 Å²	51	35 Å²	35	42%	0.421	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	2.9	173	0	0	0	0	0	113.5	A412 T413 Y414 E418	A412-A416 PolarHBondContact O-N 3.36Å; T413-A416 CarbonylContact O-C 3.46Å; T413-A416 PolarHBondContact O-N 2.98Å; Y414-A416 PolarHBondContact O-N 3.36Å; A416-E418 HydrophobicContact CB-CB 4.48Å; A416-E418 HydrophobicContact CB-CG 4.14Å; A416-E418 PolarHBondContact O-N 3.25Å
417	E	77.4	Confident	83.7	Confident	91 Å²	91	34.6 Å²	34.6	43%	0.425	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	24.3	-174.3	-51.7	-176.5	-177.2	0	0	114	S271 F310 T413 Y414 S415	S271-E417 VanDerWaalsContact CB-OE1 3.27Å; S271-E417 WeakPolarHBondContact CB-OE1 3.48Å; S271-E417 PolarHBondContact OG-OE1 2.9Å; S271-E417 PolarHBondContact OG-OE2 2.73Å; F310-E417 HydrophobicContact CE1-CB 4.13Å; F310-E417 HydrophobicContact CE1-CG 4.04Å; F310-E417 HydrophobicContact CZ-CB 4.25Å; F310-E417 HydrophobicContact CZ-CG 4.04Å; T413-E417 PolarHBondContact O-N 2.88Å; Y414-E417 PolarHBondContact O-N 2.97Å; S415-E417 VanDerWaalsContact C-N 3.34Å
418	E	78.6	Confident	82.9	Confident	92 Å²	92	38.9 Å²	38.9	43%	0.43	21%	0.208	S	C	.	.			trans	-100.8	-7.9	-177.8	-72	179.4	-178.9	0	0	112.4	T413 A416 Y420	T413-E418 HydrophobicContact CG2-CB 3.49Å; T413-E418 VanDerWaalsContact CG2-CB 3.49Å; T413-E418 PolarHBondContact O-N 2.92Å; A416-E418 HydrophobicContact CB-CB 4.48Å; A416-E418 HydrophobicContact CB-CG 4.14Å; A416-E418 PolarHBondContact O-N 3.25Å; E418-Y420 WeakPolarHBondContact O-CD1 3.42Å
419	L	80.3	Confident	81.6	Confident	5 Å²	5	36 Å²	36	3%	0.026	20%	0.202	C	C	.	.			trans	-107.1	101.6	-179.4	179.7	53.5	0	0	0	112.2	F381 M385 L410 T413 I423 F453	F381-L419 HydrophobicContact CE2-CD1 4.03Å; F381-L419 HydrophobicContact CZ-CD1 3.81Å; F381-L419 HydrophobicContact CZ-CD2 4.32Å; F381-L419 HydrophobicContact CZ-CG 4.44Å; M385-L419 HydrophobicContact SD-CD1 3.86Å; L410-L419 HydrophobicContact CB-CD2 3.97Å; L410-L419 HydrophobicContact CD2-CD1 4.49Å; L410-L419 HydrophobicContact CD2-CD2 3.65Å; L410-L419 HydrophobicContact CG-CD2 4.4Å; T413-L419 HydrophobicContact CG2-CB 4.06Å; T413-L419 PolarHBondContact O-N 2.99Å; L419-I423 HydrophobicContact CD1-CD1 4.03Å; L419-I423 HydrophobicContact CD1-CG1 4.07Å; L419-F453 HydrophobicContact CD2-CE1 3.82Å; L419-F453 HydrophobicContact CD2-CE2 4.41Å; L419-F453 HydrophobicContact CD2-CZ 3.5Å; L419-F453 VanDerWaalsContact CD2-CZ 3.5Å
420	Y	77.9	Confident	80	Confident	38 Å²	38	38.4 Å²	38.4	15%	0.149	22%	0.223	C	C	.	.			trans	-133.1	13.7	-174.4	59.9	-75.4	0	0	0	113.3	V307 R309 F319 M385 E418	V307-Y420 HydrophobicContact CG1-CE2 4.47Å; R309-Y420 WeakPolarHBondContact O-CB 3.29Å; F319-Y420 WeakPolarHBondContact CE2-O 3.32Å; M385-Y420 PolarHBondContact O-OH 3.09Å; E418-Y420 WeakPolarHBondContact O-CD1 3.42Å
421	R	79.6	Confident	78.2	Confident	15 Å²	15	47.8 Å²	47.8	6%	0.057	27%	0.267	C	S	.	.	S	Bend	trans	-108.1	146.9	178	-60	-53.4	-172.5	-135.4	-3.3	110.2	M385 T387 A389 W391 I423	M385-R421 HydrophobicContact CE-CB 4.19Å; M385-R421 HydrophobicContact CE-CG 3.95Å; M385-R421 HydrophobicContact SD-CB 4.3Å; M385-R421 HydrophobicContact SD-CG 3.94Å; T387-R421 PolarHBondContact O-NH2 2.94Å; A389-R421 PolarHBondContact O-NH2 2.91Å; W391-R421 WeakPolarHBondContact O-CB 3.36Å; W391-R421 VanDerWaalsContact O-CD 3.31Å; W391-R421 WeakPolarHBondContact O-CD 3.27Å; R421-I423 PolarHBondContact O-N 2.86Å
422	P	81.8	Confident	76.2	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.279	C	S	.	.			trans	-66.8	133.6	175.9	28.8	-35.6	0	0	0	111.3	Y311 L316 F319 G392 V393 W424	Y311-P422 HydrophobicContact CD1-CB 3.7Å; Y311-P422 HydrophobicContact CD2-CB 4.19Å; Y311-P422 HydrophobicContact CE1-CB 3.41Å; Y311-P422 VanDerWaalsContact CE1-CB 3.41Å; Y311-P422 HydrophobicContact CE2-CB 3.98Å; Y311-P422 HydrophobicContact CG-CB 4.03Å; L316-P422 HydrophobicContact CD1-CB 4.45Å; L316-P422 HydrophobicContact CD1-CG 4.04Å; F319-P422 VanDerWaalsContact CD1-CD 3.42Å; F319-P422 HydrophobicContact CD1-CG 3.55Å; F319-P422 HydrophobicContact CE1-CG 3.86Å; F319-P422 HydrophobicContact CG-CG 3.97Å; F319-P422 VanDerWaalsContact CZ-CD 3.49Å; G392-P422 CarbonylContact C-O 3.58Å; G392-P422 WeakPolarHBondContact CA-O 3.36Å; V393-P422 PolarHBondContact N-O 3.42Å; P422-W424 HydrophobicContact CB-CH2 3.53Å; P422-W424 HydrophobicContact CB-CZ2 4.06Å; P422-W424 HydrophobicContact CB-CZ3 4.06Å; P422-W424 HydrophobicContact CG-CH2 3.63Å; P422-W424 HydrophobicContact CG-CZ3 4.13Å
423	I	83.9	Confident	74.3	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.3	179.2	-51.4	-61.3	0	0	0	108.8	V393 L395 L410 L419 R421 V456 T457	V393-I423 HydrophobicContact CB-CD1 3.64Å; V393-I423 HydrophobicContact CG1-CD1 4.47Å; V393-I423 HydrophobicContact CG2-CD1 3.94Å; V393-I423 CarbonylContact O-C 3.53Å; V393-I423 VanDerWaalsContact O-CA 3.3Å; V393-I423 WeakPolarHBondContact O-CA 3.49Å; L395-I423 HydrophobicContact CD1-CG2 3.91Å; L395-I423 HydrophobicContact CG-CG2 4.23Å; L410-I423 HydrophobicContact CD1-CG2 3.99Å; L410-I423 HydrophobicContact CD2-CD1 4.25Å; L410-I423 HydrophobicContact CD2-CG1 4.05Å; L410-I423 HydrophobicContact CD2-CG2 4.46Å; L419-I423 HydrophobicContact CD1-CD1 4.03Å; L419-I423 HydrophobicContact CD1-CG1 4.07Å; R421-I423 PolarHBondContact O-N 2.86Å; I423-V456 HydrophobicContact CB-CG1 4Å; I423-V456 HydrophobicContact CG2-CG1 4.01Å; I423-V456 WeakPolarHBondContact O-CA 3.37Å; I423-T457 PolarHBondContact O-N 2.76Å
424	W	85.2	Confident	72.9	Confident	21 Å²	21	59.1 Å²	59.1	8%	0.08	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	145.3	163.1	-62.4	-95.9	0	0	0	109.1	L316 I369 V393 Y394 L395 P422 T457 V459	L316-W424 HydrophobicContact CB-CZ2 3.89Å; L316-W424 HydrophobicContact CD1-CH2 3.25Å; L316-W424 HydrophobicContact CD1-CZ2 3.44Å; L316-W424 VanDerWaalsContact CD1-CZ2 3.44Å; L316-W424 HydrophobicContact CD2-CH2 3.95Å; L316-W424 HydrophobicContact CD2-CZ2 3.71Å; L316-W424 HydrophobicContact CG-CH2 4.08Å; L316-W424 HydrophobicContact CG-CZ2 3.84Å; I369-W424 HydrophobicContact CD1-CH2 4.03Å; I369-W424 HydrophobicContact CD1-CZ3 4Å; I369-W424 HydrophobicContact CG1-CH2 4.32Å; I369-W424 HydrophobicContact CG1-CZ3 4.03Å; I369-W424 HydrophobicContact CG2-CE3 4.22Å; I369-W424 HydrophobicContact CG2-CZ3 4.15Å; V393-W424 VanDerWaalsContact O-CE3 3.28Å; V393-W424 PolarHBondContact O-N 2.83Å; Y394-W424 HydrophobicContact CD2-CB 3.52Å; Y394-W424 HydrophobicContact CE2-CB 4.27Å; Y394-W424 HydrophobicContact CG-CB 4.25Å; L395-W424 PolarHBondContact N-O 3.39Å; P422-W424 HydrophobicContact CB-CH2 3.53Å; P422-W424 HydrophobicContact CB-CZ2 4.06Å; P422-W424 HydrophobicContact CB-CZ3 4.06Å; P422-W424 HydrophobicContact CG-CH2 3.63Å; P422-W424 HydrophobicContact CG-CZ3 4.13Å; W424-T457 CarbonylContact C-O 3.58Å; W424-T457 VanDerWaalsContact CA-O 3.23Å; W424-T457 WeakPolarHBondContact CA-O 3.33Å; W424-T457 HydrophobicContact CG-CG2 4.48Å; W424-V459 HydrophobicContact CB-CG2 3.87Å; W424-V459 HydrophobicContact CG-CG2 4.1Å
425	I	86.6	Confident	71.7	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.3	173.8	-164.9	161.4	0	0	0	109.8	L395 V397 L403 L407 F445 V449 V456 T457 V459	L395-I425 HydrophobicContact CB-CG1 4.16Å; L395-I425 WeakPolarHBondContact O-CA 3.44Å; V397-I425 HydrophobicContact CG2-CD1 3.97Å; V397-I425 HydrophobicContact CG2-CG1 3.96Å; L403-I425 HydrophobicContact CD1-CD1 3.46Å; L403-I425 VanDerWaalsContact CD1-CD1 3.46Å; L403-I425 HydrophobicContact CD1-CG1 4.22Å; L407-I425 HydrophobicContact CD2-CD1 4.09Å; L407-I425 HydrophobicContact CG-CD1 4.45Å; I425-F445 HydrophobicContact CG1-CE2 4.42Å; I425-F445 HydrophobicContact CG2-CE2 4.28Å; I425-F445 HydrophobicContact CG2-CZ 4.09Å; I425-V449 HydrophobicContact CG2-CG2 4.18Å; I425-V456 HydrophobicContact CG2-CB 4.21Å; I425-V456 HydrophobicContact CG2-CG2 3.63Å; I425-T457 PolarHBondContact N-O 3.28Å; I425-V459 PolarHBondContact O-N 2.97Å
426	S	86.7	Confident	70.5	Confident	7 Å²	7	64.4 Å²	64.4	5%	0.049	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	150.7	166.7	62.1	0	0	0	0	108.8	Y394 L395 R396 V397 V459	Y394-S426 WeakPolarHBondContact CE2-OG 3.33Å; Y394-S426 WeakPolarHBondContact OH-CB 3.49Å; Y394-S426 PolarHBondContact OH-OG 2.92Å; L395-S426 PolarHBondContact O-N 2.87Å; R396-S426 WeakPolarHBondContact CG-OG 3.42Å; V397-S426 PolarHBondContact N-O 3.26Å; S426-V459 WeakPolarHBondContact CA-O 3.42Å; S426-V459 WeakPolarHBondContact CB-O 3.49Å
427	M	82.8	Confident	69.5	Low	9 Å²	9	64.3 Å²	64.3	4%	0.044	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.3	170.9	-168.7	163.1	69.4	0	0	109.4	V397 L403 F441 F445	V397-M427 WeakPolarHBondContact O-CA 3.45Å; L403-M427 HydrophobicContact CB-SD 4.39Å; L403-M427 HydrophobicContact CD2-SD 4.06Å; M427-F441 HydrophobicContact CE-CD1 4.09Å; M427-F441 HydrophobicContact CE-CD2 4.02Å; M427-F441 HydrophobicContact CE-CE1 3.49Å; M427-F441 VanDerWaalsContact CE-CE1 3.49Å; M427-F441 HydrophobicContact CE-CE2 3.43Å; M427-F441 VanDerWaalsContact CE-CE2 3.43Å; M427-F441 HydrophobicContact CE-CG 4.33Å; M427-F441 HydrophobicContact CE-CZ 3.14Å; M427-F441 HydrophobicContact CG-CE1 4.27Å; M427-F441 HydrophobicContact CG-CZ 3.8Å; M427-F441 HydrophobicContact SD-CE2 4.43Å; M427-F441 HydrophobicContact SD-CZ 4.01Å; M427-F445 HydrophobicContact CB-CD2 3.94Å; M427-F445 HydrophobicContact CB-CE2 4.05Å; M427-F445 HydrophobicContact CB-CG 4.2Å; M427-F445 HydrophobicContact CB-CZ 4.37Å; M427-F445 HydrophobicContact CE-CB 3.71Å; M427-F445 HydrophobicContact CE-CD2 4.35Å; M427-F445 HydrophobicContact CE-CG 4.23Å
428	E	73.8	Confident	68.8	Low	90 Å²	90	62.9 Å²	62.9	42%	0.421	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	130.3	172.6	-74.4	-172.9	-164.2	0	0	109.9	V397 H398	V397-E428 PolarHBondContact O-N 3.25Å; H398-E428 IonicContact CE1-OE1 3.11Å; H398-E428 IonicContact CE1-OE2 3.03Å; H398-E428 PolarHBondContact CE1-OE2 3.35Å; H398-E428 IonicContact ND1-OE2 3.47Å; H398-E428 PolarHBondContact ND1-OE2 3.13Å
429	S	62.4	Low	68.1	Low	50 Å²	50	65.5 Å²	65.5	35%	0.35	36%	0.355	S	S	.	.			trans	-75	127.1	172.2	58.9	0	0	0	0	109.5	Q431	S429-Q431 PolarHBondContact O-N 3.08Å
430	S	55.2	Low	67.2	Low	104 Å²	104	70.4 Å²	70.4	73%	0.727	38%	0.381	S	S	*	.			trans	-64.9	108.8	163.5	53.7	0	0	0	0	106.8	S432	S430-S432 PolarHBondContact O-N 3.5Å
431	Q	49.9	Very low	67	Low	197 Å²	197	71.3 Å²	71.3	92%	0.921	39%	0.385	S	S	*	.			trans	-36.6	102.8	-176.5	-67.6	177.6	-9.6	0	0	113.6	S429	S429-Q431 PolarHBondContact O-N 3.08Å
432	S	45.5	Very low	66.7	Low	76 Å²	76	71.9 Å²	71.9	53%	0.531	39%	0.389	S	S	.	.			trans	-141.7	112.6	157.6	67.8	0	0	0	0	109.5	S430 Y434	S430-S432 PolarHBondContact O-N 3.5Å; S432-Y434 VanDerWaalsContact C-N 3.33Å; S432-Y434 PolarHBondContact O-N 3.16Å
433	S	45.9	Very low	66.5	Low	120 Å²	120	76.7 Å²	76.7	84%	0.839	41%	0.411	S	S	*	.			trans	-77.8	58	-165.6	52.7	0	0	0	0	114.8
434	Y	53.4	Low	66.5	Low	178 Å²	178	80.1 Å²	80.1	70%	0.698	43%	0.429	S	S	*	.			trans	-124.4	119.9	170	-73.5	-80.9	0	0	0	110.7	S432 T436 S437 H438	S432-Y434 VanDerWaalsContact C-N 3.33Å; S432-Y434 PolarHBondContact O-N 3.16Å; Y434-T436 VanDerWaalsContact C-N 3.26Å; Y434-T436 PolarHBondContact O-N 3.38Å; Y434-S437 PolarHBondContact O-N 2.9Å; Y434-S437 PolarHBondContact O-OG 3.49Å; Y434-H438 PolarHBondContact O-N 3.35Å; Y434-H438 VanDerWaalsContact O-N 3.17Å
435	S	56.7	Low	66.5	Low	105 Å²	105	79.4 Å²	79.4	73%	0.734	43%	0.427	S	S	*	.	H	α-helix	trans	-55.1	-37.6	-175.2	57	0	0	0	0	113.4	H438 Y439	S435-H438 PolarHBondContact O-N 2.97Å; S435-Y439 PolarHBondContact O-N 3.15Å
436	T	54.8	Low	66.5	Low	103 Å²	103	81.6 Å²	81.6	63%	0.632	44%	0.44	S	S	*	.	H	α-helix	trans	-68.6	-33.8	177.2	-37.8	0	0	0	0	112.8	Y434 I440	Y434-T436 VanDerWaalsContact C-N 3.26Å; Y434-T436 PolarHBondContact O-N 3.38Å; T436-I440 WeakPolarHBondContact O-CG1 3.01Å; T436-I440 PolarHBondContact O-N 2.69Å
437	S	60.4	Low	66.4	Low	48 Å²	48	83.8 Å²	83.8	34%	0.336	46%	0.456	S	S	.	.	H	α-helix	trans	-73.5	-30.3	177.2	68.7	0	0	0	0	112.5	Y434 F441	Y434-S437 PolarHBondContact O-N 2.9Å; Y434-S437 PolarHBondContact O-OG 3.49Å; S437-F441 VanDerWaalsContact O-CB 3.32Å; S437-F441 WeakPolarHBondContact O-CB 3.31Å; S437-F441 PolarHBondContact O-N 2.99Å; S437-F441 VanDerWaalsContact O-N 3.12Å
438	H	63.9	Low	66.8	Low	62 Å²	62	83.8 Å²	83.8	29%	0.287	46%	0.456	S	S	.	.	H	α-helix	trans	-69.9	-42.9	177.4	-159.7	-90	0	0	0	111.9	Y434 S435 F441 E442	Y434-H438 PolarHBondContact O-N 3.35Å; Y434-H438 VanDerWaalsContact O-N 3.17Å; S435-H438 PolarHBondContact O-N 2.97Å; H438-F441 WeakPolarHBondContact O-CB 3.37Å; H438-F441 PolarHBondContact O-N 3.37Å; H438-E442 IonicContact CE1-OE1 2.98Å; H438-E442 PolarHBondContact CE1-OE1 3.04Å; H438-E442 IonicContact ND1-OE1 3.22Å; H438-E442 PolarHBondContact ND1-OE1 3.14Å; H438-E442 IonicContact ND1-OE2 3.89Å; H438-E442 WeakPolarHBondContact O-CG 3.4Å; H438-E442 PolarHBondContact O-N 2.99Å
439	Y	62.3	Low	67.5	Low	146 Å²	146	79.8 Å²	79.8	57%	0.573	44%	0.438	S	S	*	.	H	α-helix	trans	-62.6	-44.7	177.7	-178.9	-94.1	0	0	0	112.3	S435 F441 E442 Q443	S435-Y439 PolarHBondContact O-N 3.15Å; Y439-F441 VanDerWaalsContact C-N 3.3Å; Y439-F441 PolarHBondContact O-N 2.95Å; Y439-E442 PolarHBondContact O-N 2.77Å; Y439-Q443 WeakPolarHBondContact O-CB 3.42Å; Y439-Q443 PolarHBondContact O-N 3.38Å; Y439-Q443 PolarHBondContact OH-OE1 3.41Å
440	I	62.1	Low	68.5	Low	109 Å²	109	82.2 Å²	82.2	56%	0.559	44%	0.444	S	S	*	.	H	α-helix	trans	-62.6	-40.1	176.6	-65.4	169.2	0	0	0	110.6	T436 Q443 D444	T436-I440 WeakPolarHBondContact O-CG1 3.01Å; T436-I440 PolarHBondContact O-N 2.69Å; I440-Q443 PolarHBondContact O-N 3.32Å; I440-D444 VanDerWaalsContact O-CB 3.26Å; I440-D444 WeakPolarHBondContact O-CB 3.34Å; I440-D444 PolarHBondContact O-N 2.92Å
441	F	73.4	Confident	69.9	Low	56 Å²	56	85 Å²	85	25%	0.246	45%	0.445	C	S	.	.	H	α-helix	trans	-65.6	-43.3	177.3	179.4	-90.9	0	0	0	113.1	M427 S437 H438 Y439 F445	M427-F441 HydrophobicContact CE-CD1 4.09Å; M427-F441 HydrophobicContact CE-CD2 4.02Å; M427-F441 HydrophobicContact CE-CE1 3.49Å; M427-F441 VanDerWaalsContact CE-CE1 3.49Å; M427-F441 HydrophobicContact CE-CE2 3.43Å; M427-F441 VanDerWaalsContact CE-CE2 3.43Å; M427-F441 HydrophobicContact CE-CG 4.33Å; M427-F441 HydrophobicContact CE-CZ 3.14Å; M427-F441 HydrophobicContact CG-CE1 4.27Å; M427-F441 HydrophobicContact CG-CZ 3.8Å; M427-F441 HydrophobicContact SD-CE2 4.43Å; M427-F441 HydrophobicContact SD-CZ 4.01Å; S437-F441 VanDerWaalsContact O-CB 3.32Å; S437-F441 WeakPolarHBondContact O-CB 3.31Å; S437-F441 PolarHBondContact O-N 2.99Å; S437-F441 VanDerWaalsContact O-N 3.12Å; H438-F441 WeakPolarHBondContact O-CB 3.37Å; H438-F441 PolarHBondContact O-N 3.37Å; Y439-F441 VanDerWaalsContact C-N 3.3Å; Y439-F441 PolarHBondContact O-N 2.95Å; F441-F445 WeakPolarHBondContact O-CB 3.37Å; F441-F445 PolarHBondContact O-N 2.94Å
442	E	73.6	Confident	71.8	Confident	28 Å²	28	77.3 Å²	77.3	13%	0.131	41%	0.41	C	S	.	.	H	α-helix	trans	-65.1	-40.9	175.2	-75	179.4	163.2	0	0	111.6	H438 Y439 F445 V446	H438-E442 IonicContact CE1-OE1 2.98Å; H438-E442 PolarHBondContact CE1-OE1 3.04Å; H438-E442 IonicContact ND1-OE1 3.22Å; H438-E442 PolarHBondContact ND1-OE1 3.14Å; H438-E442 IonicContact ND1-OE2 3.89Å; H438-E442 WeakPolarHBondContact O-CG 3.4Å; H438-E442 PolarHBondContact O-N 2.99Å; Y439-E442 PolarHBondContact O-N 2.77Å; E442-F445 WeakPolarHBondContact O-CB 3.49Å; E442-F445 PolarHBondContact O-N 3.38Å; E442-V446 WeakPolarHBondContact O-CG2 3.37Å; E442-V446 PolarHBondContact O-N 3.32Å
443	Q	77	Confident	73.8	Confident	101 Å²	101	73.8 Å²	73.8	47%	0.472	39%	0.385	S	S	.	.	H	α-helix	trans	-67.4	-39.9	178.6	-169.1	160.8	6.3	0	0	111.8	Y439 I440 S447	Y439-Q443 WeakPolarHBondContact O-CB 3.42Å; Y439-Q443 PolarHBondContact O-N 3.38Å; Y439-Q443 PolarHBondContact OH-OE1 3.41Å; I440-Q443 PolarHBondContact O-N 3.32Å; Q443-S447 VanDerWaalsContact O-CB 3.23Å; Q443-S447 WeakPolarHBondContact O-CB 3.34Å; Q443-S447 PolarHBondContact O-N 2.81Å; Q443-S447 PolarHBondContact O-OG 2.96Å
444	D	83.8	Confident	75.6	Confident	72 Å²	72	69.3 Å²	69.3	39%	0.385	35%	0.353	S	S	.	.	H	α-helix	trans	-64.1	-43.4	174.4	-175.1	51.8	0	0	0	111.7	H400 I440 S447 T448	H400-D444 IonicContact CE1-OD1 3.42Å; H400-D444 IonicContact CE1-OD2 2.81Å; H400-D444 PolarHBondContact CE1-OD2 3.45Å; H400-D444 IonicContact CG-OD2 3.01Å; H400-D444 IonicContact ND1-OD2 3.58Å; H400-D444 PolarHBondContact ND1-OD2 2.65Å; I440-D444 VanDerWaalsContact O-CB 3.26Å; I440-D444 WeakPolarHBondContact O-CB 3.34Å; I440-D444 PolarHBondContact O-N 2.92Å; D444-S447 PolarHBondContact O-N 3.42Å; D444-T448 WeakPolarHBondContact O-CB 3.49Å; D444-T448 PolarHBondContact O-N 3.21Å; D444-T448 PolarHBondContact O-OG1 3.03Å
445	F	86.9	Confident	76.9	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-57.2	-53.3	173.6	170.4	-134.1	0	0	0	112.5	L403 I425 M427 F441 E442 T448 V449 V458 L460	L403-F445 HydrophobicContact CD1-CD2 3.98Å; L403-F445 HydrophobicContact CD1-CE2 3.74Å; L403-F445 HydrophobicContact CD2-CD2 3.63Å; L403-F445 HydrophobicContact CD2-CE2 4.28Å; L403-F445 HydrophobicContact CG-CD2 4.45Å; I425-F445 HydrophobicContact CG1-CE2 4.42Å; I425-F445 HydrophobicContact CG2-CE2 4.28Å; I425-F445 HydrophobicContact CG2-CZ 4.09Å; M427-F445 HydrophobicContact CB-CD2 3.94Å; M427-F445 HydrophobicContact CB-CE2 4.05Å; M427-F445 HydrophobicContact CB-CG 4.2Å; M427-F445 HydrophobicContact CB-CZ 4.37Å; M427-F445 HydrophobicContact CE-CB 3.71Å; M427-F445 HydrophobicContact CE-CD2 4.35Å; M427-F445 HydrophobicContact CE-CG 4.23Å; F441-F445 WeakPolarHBondContact O-CB 3.37Å; F441-F445 PolarHBondContact O-N 2.94Å; E442-F445 WeakPolarHBondContact O-CB 3.49Å; E442-F445 PolarHBondContact O-N 3.38Å; F445-T448 PolarHBondContact O-N 3.39Å; F445-V449 HydrophobicContact CD2-CG2 4.09Å; F445-V449 HydrophobicContact CE2-CG2 3.75Å; F445-V449 HydrophobicContact CZ-CG2 4.4Å; F445-V449 WeakPolarHBondContact O-CG2 3.23Å; F445-V449 PolarHBondContact O-N 3.47Å; F445-V449 VanDerWaalsContact O-N 3.08Å; F445-V458 HydrophobicContact CD1-CG1 4.24Å; F445-V458 HydrophobicContact CE1-CG1 3.4Å; F445-V458 VanDerWaalsContact CE1-CG1 3.4Å; F445-V458 HydrophobicContact CZ-CG1 3.87Å; F445-L460 HydrophobicContact CD1-CD2 4.26Å; F445-L460 HydrophobicContact CE1-CD2 4.2Å
446	V	85.5	Confident	78.3	Confident	46 Å²	46	57.1 Å²	57.1	28%	0.279	29%	0.291	S	S	.	.	H	α-helix	trans	-64.7	-44.3	-178.5	173.1	0	0	0	0	110.5	E442 T448 V449 E450 V458	E442-V446 WeakPolarHBondContact O-CG2 3.37Å; E442-V446 PolarHBondContact O-N 3.32Å; V446-T448 VanDerWaalsContact C-N 3.29Å; V446-T448 PolarHBondContact O-N 3.11Å; V446-V449 PolarHBondContact O-N 3.05Å; V446-V449 VanDerWaalsContact O-N 3.16Å; V446-E450 HydrophobicContact CG1-CG 4.28Å; V446-E450 WeakPolarHBondContact O-CG 3.37Å; V446-E450 PolarHBondContact O-N 2.9Å; V446-V458 HydrophobicContact CG2-CG1 4.45Å
447	S	85.8	Confident	79.6	Confident	54 Å²	54	54 Å²	54	38%	0.378	27%	0.273	S	S	.	.	H	α-helix	trans	-60.4	-41	179	-56.7	0	0	0	0	111.4	Q443 D444 V449 E450 E451	Q443-S447 VanDerWaalsContact O-CB 3.23Å; Q443-S447 WeakPolarHBondContact O-CB 3.34Å; Q443-S447 PolarHBondContact O-N 2.81Å; Q443-S447 PolarHBondContact O-OG 2.96Å; D444-S447 PolarHBondContact O-N 3.42Å; S447-V449 PolarHBondContact O-N 2.98Å; S447-E450 PolarHBondContact O-N 3.43Å; S447-E451 WeakPolarHBondContact O-CB 3.47Å; S447-E451 PolarHBondContact O-N 3.12Å
448	T	89.6	Confident	80.7	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.055	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-39.6	177.5	-55.7	0	0	0	0	112	H400 L403 E404 L407 D444 F445 V446 L452	H400-T448 PolarHBondContact CE1-OG1 3.01Å; L403-T448 HydrophobicContact CD2-CG2 3.84Å; L403-T448 HydrophobicContact CG-CG2 4.19Å; E404-T448 HydrophobicContact CG-CG2 4.11Å; L407-T448 HydrophobicContact CD1-CG2 3.98Å; D444-T448 WeakPolarHBondContact O-CB 3.49Å; D444-T448 PolarHBondContact O-N 3.21Å; D444-T448 PolarHBondContact O-OG1 3.03Å; F445-T448 PolarHBondContact O-N 3.39Å; V446-T448 VanDerWaalsContact C-N 3.29Å; V446-T448 PolarHBondContact O-N 3.11Å; T448-L452 HydrophobicContact CG2-CD1 3.79Å; T448-L452 HydrophobicContact CG2-CG 4.36Å; T448-L452 WeakPolarHBondContact O-CB 3.32Å; T448-L452 WeakPolarHBondContact O-CG 3.26Å; T448-L452 PolarHBondContact O-N 3.41Å
449	V	88.7	Confident	81.6	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-48.1	174.5	170.4	0	0	0	0	110.8	L403 L407 I425 F445 V446 S447 E451 F453 V456 V458	L403-V449 HydrophobicContact CD1-CG2 4.25Å; L407-V449 HydrophobicContact CD1-CG2 4.03Å; L407-V449 HydrophobicContact CD2-CG2 4.27Å; I425-V449 HydrophobicContact CG2-CG2 4.18Å; F445-V449 HydrophobicContact CD2-CG2 4.09Å; F445-V449 HydrophobicContact CE2-CG2 3.75Å; F445-V449 HydrophobicContact CZ-CG2 4.4Å; F445-V449 WeakPolarHBondContact O-CG2 3.23Å; F445-V449 PolarHBondContact O-N 3.47Å; F445-V449 VanDerWaalsContact O-N 3.08Å; V446-V449 PolarHBondContact O-N 3.05Å; V446-V449 VanDerWaalsContact O-N 3.16Å; S447-V449 PolarHBondContact O-N 2.98Å; V449-E451 VanDerWaalsContact C-N 3.29Å; V449-E451 PolarHBondContact O-N 3.22Å; V449-F453 CarbonylContact O-C 3.06Å; V449-F453 PolarHBondContact O-N 3.26Å; V449-V456 HydrophobicContact CG1-CG2 3.36Å; V449-V458 HydrophobicContact CB-CG2 4.45Å; V449-V458 HydrophobicContact CG1-CG2 3.95Å; V449-V458 HydrophobicContact CG2-CG2 4.47Å
450	E	84.4	Confident	82.1	Confident	102 Å²	102	51 Å²	51	48%	0.477	27%	0.267	S	S	.	.	H	α-helix	trans	-60.1	-39.3	178.5	-73	-175.9	165.8	0	0	112.1	V446 S447	V446-E450 HydrophobicContact CG1-CG 4.28Å; V446-E450 WeakPolarHBondContact O-CG 3.37Å; V446-E450 PolarHBondContact O-N 2.9Å; S447-E450 PolarHBondContact O-N 3.43Å
451	E	85.3	Confident	82.1	Confident	161 Å²	161	48.4 Å²	48.4	75%	0.752	26%	0.262	S	S	*	.	H	α-helix	trans	-72.9	-47.4	179.9	-175.4	-179.6	171.4	0	0	112.7	S447 V449	S447-E451 WeakPolarHBondContact O-CB 3.47Å; S447-E451 PolarHBondContact O-N 3.12Å; V449-E451 VanDerWaalsContact C-N 3.29Å; V449-E451 PolarHBondContact O-N 3.22Å
452	L	88.9	Confident	81	Confident	36 Å²	36	54.3 Å²	54.3	19%	0.188	29%	0.291	C	S	.	.	H	α-helix	trans	-93.2	-39.6	-168.2	-64.3	-178	0	0	0	114.1	E404 L407 Q411 T448	E404-L452 HydrophobicContact CB-CD1 4.04Å; E404-L452 HydrophobicContact CG-CD1 3.87Å; L407-L452 HydrophobicContact CB-CB 3.75Å; L407-L452 HydrophobicContact CB-CD1 4.2Å; L407-L452 HydrophobicContact CD1-CB 4.09Å; L407-L452 HydrophobicContact CD1-CD1 4.21Å; Q411-L452 PolarHBondContact OE1-O 2.93Å; T448-L452 HydrophobicContact CG2-CD1 3.79Å; T448-L452 HydrophobicContact CG2-CG 4.36Å; T448-L452 WeakPolarHBondContact O-CB 3.32Å; T448-L452 WeakPolarHBondContact O-CG 3.26Å; T448-L452 PolarHBondContact O-N 3.41Å
453	F	88	Confident	79.5	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.009	31%	0.314	C	S	.	.			trans	-163.6	86.8	-179.3	-171.2	-112	0	0	0	111.6	L407 L410 Q411 Y414 L419 V449 Y455 V456	L407-F453 HydrophobicContact CB-CB 4.15Å; L407-F453 HydrophobicContact CD2-CB 3.96Å; L410-F453 HydrophobicContact CB-CD1 3.47Å; L410-F453 VanDerWaalsContact CB-CD1 3.47Å; L410-F453 HydrophobicContact CB-CD2 4.4Å; L410-F453 HydrophobicContact CB-CE1 3.66Å; L410-F453 HydrophobicContact CB-CG 3.9Å; L410-F453 HydrophobicContact CB-CZ 4.19Å; L410-F453 HydrophobicContact CD1-CD1 3.78Å; L410-F453 HydrophobicContact CD1-CE1 4.1Å; L410-F453 HydrophobicContact CG-CD1 4.24Å; L410-F453 HydrophobicContact CG-CE1 4.36Å; Q411-F453 HydrophobicContact CB-CB 4.44Å; Q411-F453 HydrophobicContact CB-CD2 4Å; Y414-F453 VanDerWaalsContact CB-CE2 3.5Å; Y414-F453 HydrophobicContact CD1-CE2 4.13Å; Y414-F453 HydrophobicContact CD2-CE2 4.01Å; Y414-F453 HydrophobicContact CD2-CZ 4.07Å; Y414-F453 AromaticContact CG-CE2 3.63Å; Y414-F453 HydrophobicContact CG-CE2 3.63Å; Y414-F453 HydrophobicContact CG-CZ 4.12Å; L419-F453 HydrophobicContact CD2-CE1 3.82Å; L419-F453 HydrophobicContact CD2-CE2 4.41Å; L419-F453 HydrophobicContact CD2-CZ 3.5Å; L419-F453 VanDerWaalsContact CD2-CZ 3.5Å; V449-F453 CarbonylContact O-C 3.06Å; V449-F453 PolarHBondContact O-N 3.26Å; F453-Y455 VanDerWaalsContact C-N 3.26Å; F453-Y455 HydrophobicContact CD2-CD2 4Å; F453-Y455 AromaticContact CE2-CD2 3.61Å; F453-Y455 HydrophobicContact CE2-CD2 3.61Å; F453-Y455 HydrophobicContact CE2-CG 4.37Å; F453-Y455 HydrophobicContact CZ-CD2 4.09Å; F453-Y455 HydrophobicContact CZ-CG 4.41Å; F453-Y455 PolarHBondContact O-N 2.97Å; F453-V456 HydrophobicContact CD1-CG1 3.42Å; F453-V456 VanDerWaalsContact CD1-CG1 3.42Å; F453-V456 HydrophobicContact CE1-CG1 3.56Å
454	P	82.9	Confident	77.5	Confident	26 Å²	26	60.7 Å²	60.7	17%	0.169	33%	0.325	C	S	.	.			trans	-75.7	-7.3	-172.9	25.8	-33.3	0	0	0	115.1	V456	P454-V456 PolarHBondContact O-N 3.4Å
455	Y	82	Confident	74.7	Confident	14 Å²	14	68.3 Å²	68.3	6%	0.055	35%	0.348	C	S	.	.	S	Bend	trans	-82.1	37	-174.4	-52.5	-72.1	0	0	0	113.2	H241 W244 P312 Y414 F453	H241-Y455 PolarHBondContact O-OH 3.06Å; H241-Y455 VanDerWaalsContact O-OH 3.09Å; W244-Y455 HydrophobicContact CB-CE1 4.33Å; P312-Y455 HydrophobicContact CB-CD1 4.21Å; Y414-Y455 HydrophobicContact CD1-CD2 4.48Å; Y414-Y455 HydrophobicContact CD1-CE2 4.45Å; Y414-Y455 HydrophobicContact CE1-CD2 4.06Å; Y414-Y455 AromaticContact CE1-CE2 3.78Å; Y414-Y455 HydrophobicContact CE1-CE2 3.78Å; Y414-Y455 HydrophobicContact CE2-CD2 4.24Å; Y414-Y455 HydrophobicContact CE2-CG 4.41Å; Y414-Y455 AromaticContact CZ-CD2 3.91Å; Y414-Y455 AromaticContact CZ-CE2 3.87Å; F453-Y455 VanDerWaalsContact C-N 3.26Å; F453-Y455 HydrophobicContact CD2-CD2 4Å; F453-Y455 AromaticContact CE2-CD2 3.61Å; F453-Y455 HydrophobicContact CE2-CD2 3.61Å; F453-Y455 HydrophobicContact CE2-CG 4.37Å; F453-Y455 HydrophobicContact CZ-CD2 4.09Å; F453-Y455 HydrophobicContact CZ-CG 4.41Å; F453-Y455 PolarHBondContact O-N 2.97Å
456	V	84.3	Confident	72.2	Confident	13 Å²	13	77.2 Å²	77.2	8%	0.079	41%	0.407	C	S	.	.	S	Bend	trans	-125.4	154.6	-179.5	-56.7	0	0	0	0	110.5	L410 I423 I425 V449 F453 P454	L410-V456 HydrophobicContact CD1-CG1 4.08Å; I423-V456 HydrophobicContact CB-CG1 4Å; I423-V456 HydrophobicContact CG2-CG1 4.01Å; I423-V456 WeakPolarHBondContact O-CA 3.37Å; I425-V456 HydrophobicContact CG2-CB 4.21Å; I425-V456 HydrophobicContact CG2-CG2 3.63Å; V449-V456 HydrophobicContact CG1-CG2 3.36Å; F453-V456 HydrophobicContact CD1-CG1 3.42Å; F453-V456 VanDerWaalsContact CD1-CG1 3.42Å; F453-V456 HydrophobicContact CE1-CG1 3.56Å; P454-V456 PolarHBondContact O-N 3.4Å
457	T	83.3	Confident	71.6	Confident	39 Å²	39	78.8 Å²	78.8	24%	0.239	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116	169	-58.5	0	0	0	0	109.4	I423 W424 I425 V459	I423-T457 PolarHBondContact O-N 2.76Å; W424-T457 CarbonylContact C-O 3.58Å; W424-T457 VanDerWaalsContact CA-O 3.23Å; W424-T457 WeakPolarHBondContact CA-O 3.33Å; W424-T457 HydrophobicContact CG-CG2 4.48Å; I425-T457 PolarHBondContact N-O 3.28Å; T457-V459 PolarHBondContact O-N 3.17Å
458	V	83.9	Confident	70.8	Confident	51 Å²	51	80.1 Å²	80.1	31%	0.309	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	126.2	173.7	178.4	0	0	0	0	109.5	F445 V446 V449 L460	F445-V458 HydrophobicContact CD1-CG1 4.24Å; F445-V458 HydrophobicContact CE1-CG1 3.4Å; F445-V458 VanDerWaalsContact CE1-CG1 3.4Å; F445-V458 HydrophobicContact CZ-CG1 3.87Å; V446-V458 HydrophobicContact CG2-CG1 4.45Å; V449-V458 HydrophobicContact CB-CG2 4.45Å; V449-V458 HydrophobicContact CG1-CG2 3.95Å; V449-V458 HydrophobicContact CG2-CG2 4.47Å; V458-L460 HydrophobicContact CG1-CD2 3.82Å; V458-L460 HydrophobicContact CG1-CG 4.26Å
459	V	81.9	Confident	69.8	Low	48 Å²	48	84 Å²	84	29%	0.291	44%	0.435	S	S	.	.			trans	-110	106.6	173	178.5	0	0	0	0	107.1	Y394 W424 I425 S426 T457	Y394-V459 HydrophobicContact CE2-CB 4.17Å; Y394-V459 HydrophobicContact CE2-CG1 4.43Å; Y394-V459 HydrophobicContact CE2-CG2 4.23Å; W424-V459 HydrophobicContact CB-CG2 3.87Å; W424-V459 HydrophobicContact CG-CG2 4.1Å; I425-V459 PolarHBondContact O-N 2.97Å; S426-V459 WeakPolarHBondContact CA-O 3.42Å; S426-V459 WeakPolarHBondContact CB-O 3.49Å; T457-V459 PolarHBondContact O-N 3.17Å
460	L	74.1	Confident	68.7	Low	93 Å²	93	88.6 Å²	88.6	49%	0.487	46%	0.459	S	S	.	.			trans	-76.9	138.3	174.5	-59.7	176.2	0	0	0	108.8	F445 V458	F445-L460 HydrophobicContact CD1-CD2 4.26Å; F445-L460 HydrophobicContact CE1-CD2 4.2Å; V458-L460 HydrophobicContact CG1-CD2 3.82Å; V458-L460 HydrophobicContact CG1-CG 4.26Å
461	A	61.8	Low	67.7	Low	55 Å²	55	87.8 Å²	87.8	46%	0.455	46%	0.457	S	S	.	.			trans	-62.4	139.6	171.5	0	0	0	0	0	108.7	Q463	A461-Q463 PolarHBondContact O-N 2.68Å
462	E	50.6	Low	66.5	Low	179 Å²	179	82.9 Å²	82.9	84%	0.836	44%	0.438	S	S	*	.			trans	-42.4	112.1	-175.7	-70.6	176.8	165.8	0	0	112.2	N464	E462-N464 PolarHBondContact O-N 3.19Å
463	Q	41.5	Very low	64.9	Low	135 Å²	135	86.3 Å²	86.3	63%	0.631	46%	0.456	S	S	*	.			trans	-71.8	106.3	151	-77.1	-173.7	4.5	0	0	106.5	A461	A461-Q463 PolarHBondContact O-N 2.68Å
464	N	33.9	Very low	63.1	Low	129 Å²	129	92.8 Å²	92.8	69%	0.69	49%	0.49	S	S	*	.			trans	-55.9	133.5	143.2	-80.6	-52.6	0	0	0	107.8	E462	E462-N464 PolarHBondContact O-N 3.19Å
465	W	26.5	Very low	61.5	Low	231 Å²	231	98.3 Å²	98.3	88%	0.875	52%	0.517	S	S	*	.			trans	100.1	147.1	161.3	-60.8	94.8	0	0	0	118.5
466	P	34.2	Very low	59.6	Low	193 Å²	193	106 Å²	106	100%	1.253	56%	0.559	S	S	*	*				-94.8	0	-51.7	36.4	-27.5	0	0	0	113.5

Retrieved 466 of 466 residues in 812.2 ms (Link to these results)

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