A0A5K4F9X6_SCHMA Loading...

Fucosyltransferase

AlphaFold DB , UniProt , Accession A0A5K4F9X6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 416 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61	Low	80.8	Confident	198 Å²	198	142.4 Å²	142.4	98%	0.975	67%	0.665	S	S	*	*				0	-46.6	0	-73	177.5	66.6	0	0	115.1	R3 T4 R5	M1-R3 PolarHBondContact O-N 3.36Å; M1-T4 PolarHBondContact O-N 2.98Å; M1-R5 PolarHBondContact O-N 3.13Å
2	K	69.2	Low	81.5	Confident	196 Å²	196	137.6 Å²	137.6	85%	0.852	65%	0.652	S	S	*	*	H	α-helix	trans	-57.3	-41.5	-178.8	-82.2	-177.9	171.5	176.8	0	114.3	T4 R5 H6	K2-T4 PolarHBondContact O-N 3.07Å; K2-R5 PolarHBondContact O-N 2.96Å; K2-H6 PolarHBondContact O-N 2.73Å; K2-H6 VanDerWaalsContact O-N 3.13Å
3	R	74.3	Confident	82.2	Confident	230 Å²	230	135.8 Å²	135.8	87%	0.868	64%	0.643	S	S	*	*	H	α-helix	trans	-64.5	-38.5	-178.9	-146.4	175.7	-172.5	-178	1.5	112.7	M1 H6 L7	M1-R3 PolarHBondContact O-N 3.36Å; R3-H6 PolarHBondContact O-N 2.81Å; R3-L7 PolarHBondContact O-N 3.42Å; R3-L7 VanDerWaalsContact O-N 3.13Å
4	T	80.5	Confident	82.7	Confident	91 Å²	91	133.8 Å²	133.8	56%	0.558	64%	0.637	S	S	*	*	H	α-helix	trans	-67.8	-45.5	177.9	-20.9	0	0	0	0	111.5	M1 K2 H6 L7 V8	M1-T4 PolarHBondContact O-N 2.98Å; K2-T4 PolarHBondContact O-N 3.07Å; T4-H6 VanDerWaalsContact C-N 3.29Å; T4-H6 PolarHBondContact O-N 2.79Å; T4-L7 PolarHBondContact O-N 3.47Å; T4-V8 WeakPolarHBondContact O-CG2 3.22Å; T4-V8 PolarHBondContact O-N 2.98Å
5	R	79.2	Confident	83.1	Confident	198 Å²	198	128.7 Å²	128.7	75%	0.747	63%	0.626	S	S	*	*	H	α-helix	trans	-57.5	-41.9	174	-95.4	-175.8	168.5	178	-3.2	112	M1 K2 V8 V9	M1-R5 PolarHBondContact O-N 3.13Å; K2-R5 PolarHBondContact O-N 2.96Å; R5-V8 PolarHBondContact O-N 3.19Å; R5-V9 WeakPolarHBondContact O-CG2 3.45Å; R5-V9 PolarHBondContact O-N 3.06Å
6	H	81.2	Confident	83.4	Confident	121 Å²	121	125.4 Å²	125.4	56%	0.56	62%	0.616	S	S	*	*	H	α-helix	trans	-68.3	-37	-178.6	-136.4	6.8	0	0	0	112.8	K2 R3 T4 R10	K2-H6 PolarHBondContact O-N 2.73Å; K2-H6 VanDerWaalsContact O-N 3.13Å; R3-H6 PolarHBondContact O-N 2.81Å; T4-H6 VanDerWaalsContact C-N 3.29Å; T4-H6 PolarHBondContact O-N 2.79Å; H6-R10 WeakPolarHBondContact O-CG 3.39Å; H6-R10 PolarHBondContact O-N 3.13Å; H6-R10 VanDerWaalsContact O-N 3.14Å
7	L	87.7	Confident	83.7	Confident	113 Å²	113	123.9 Å²	123.9	59%	0.592	61%	0.61	S	S	*	*	H	α-helix	trans	-64.5	-46.1	174	-172.6	70.2	0	0	0	111.4	R3 T4 V9 R10 V11	R3-L7 PolarHBondContact O-N 3.42Å; R3-L7 VanDerWaalsContact O-N 3.13Å; T4-L7 PolarHBondContact O-N 3.47Å; L7-V9 VanDerWaalsContact C-N 3.34Å; L7-V9 PolarHBondContact O-N 3.34Å; L7-R10 PolarHBondContact O-N 3.01Å; L7-V11 WeakPolarHBondContact O-CG2 3.45Å; L7-V11 PolarHBondContact O-N 3.33Å
8	V	88.3	Confident	83.9	Confident	87 Å²	87	122.9 Å²	122.9	53%	0.527	61%	0.607	S	S	.	*	H	α-helix	trans	-59.2	-45.1	177.9	173.5	0	0	0	0	111.2	T4 R5 R10 V11 V12	T4-V8 WeakPolarHBondContact O-CG2 3.22Å; T4-V8 PolarHBondContact O-N 2.98Å; R5-V8 PolarHBondContact O-N 3.19Å; V8-R10 VanDerWaalsContact C-N 3.34Å; V8-R10 PolarHBondContact O-N 3.13Å; V8-V11 PolarHBondContact O-N 2.95Å; V8-V12 HydrophobicContact CG1-CG2 4.48Å; V8-V12 WeakPolarHBondContact O-CG2 3.37Å; V8-V12 PolarHBondContact O-N 3.47Å
9	V	88.5	Confident	84	Confident	74 Å²	74	123.5 Å²	123.5	45%	0.448	61%	0.606	S	S	.	*	H	α-helix	trans	-60.2	-43.2	177.2	171.9	0	0	0	0	111.5	R5 L7 V12 Q13	R5-V9 WeakPolarHBondContact O-CG2 3.45Å; R5-V9 PolarHBondContact O-N 3.06Å; L7-V9 VanDerWaalsContact C-N 3.34Å; L7-V9 PolarHBondContact O-N 3.34Å; V9-V12 PolarHBondContact O-N 3.03Å; V9-Q13 HydrophobicContact CG1-CG 4.48Å; V9-Q13 WeakPolarHBondContact O-CB 3.43Å; V9-Q13 WeakPolarHBondContact O-CG 3.5Å; V9-Q13 PolarHBondContact O-N 3.2Å
10	R	88.2	Confident	84	Confident	167 Å²	167	121.9 Å²	121.9	63%	0.63	60%	0.598	S	S	*	*	H	α-helix	trans	-65.6	-39.4	178	-74.3	-175.1	179.3	-166.7	-0.5	112.6	H6 L7 V8 Q13 L14	H6-R10 WeakPolarHBondContact O-CG 3.39Å; H6-R10 PolarHBondContact O-N 3.13Å; H6-R10 VanDerWaalsContact O-N 3.14Å; L7-R10 PolarHBondContact O-N 3.01Å; V8-R10 VanDerWaalsContact C-N 3.34Å; V8-R10 PolarHBondContact O-N 3.13Å; R10-Q13 PolarHBondContact O-N 2.7Å; R10-L14 WeakPolarHBondContact O-CB 3.35Å; R10-L14 PolarHBondContact O-N 3.36Å
11	V	90.2	Very high	83.7	Confident	91 Å²	91	119 Å²	119	55%	0.552	59%	0.59	S	S	*	*	H	α-helix	trans	-64.6	-43.3	177	171.8	0	0	0	0	110.9	L7 V8 L14 A15	L7-V11 WeakPolarHBondContact O-CG2 3.45Å; L7-V11 PolarHBondContact O-N 3.33Å; V8-V11 PolarHBondContact O-N 2.95Å; V11-L14 PolarHBondContact O-N 3.5Å; V11-A15 WeakPolarHBondContact O-CB 3.4Å; V11-A15 PolarHBondContact O-N 3.08Å
12	V	90	Very high	84.6	Confident	85 Å²	85	116.6 Å²	116.6	52%	0.515	57%	0.572	S	S	.	*	H	α-helix	trans	-64.8	-44.7	176.8	173.8	0	0	0	0	111.1	V8 V9 L14 A15 V16	V8-V12 HydrophobicContact CG1-CG2 4.48Å; V8-V12 WeakPolarHBondContact O-CG2 3.37Å; V8-V12 PolarHBondContact O-N 3.47Å; V9-V12 PolarHBondContact O-N 3.03Å; V12-L14 VanDerWaalsContact C-N 3.32Å; V12-L14 PolarHBondContact O-N 2.84Å; V12-A15 PolarHBondContact O-N 3.02Å; V12-V16 HydrophobicContact CG1-CG2 4.47Å; V12-V16 WeakPolarHBondContact O-CG2 3.25Å; V12-V16 PolarHBondContact O-N 3.49Å
13	Q	90	Very high	84.7	Confident	115 Å²	115	109.3 Å²	109.3	54%	0.537	54%	0.54	S	S	.	.	H	α-helix	trans	-59.2	-43.4	175.6	-76.7	177.3	-34.9	0	0	111.8	V9 R10 V16 I17	V9-Q13 HydrophobicContact CG1-CG 4.48Å; V9-Q13 WeakPolarHBondContact O-CB 3.43Å; V9-Q13 WeakPolarHBondContact O-CG 3.5Å; V9-Q13 PolarHBondContact O-N 3.2Å; R10-Q13 PolarHBondContact O-N 2.7Å; Q13-V16 PolarHBondContact O-N 2.98Å; Q13-I17 WeakPolarHBondContact O-CD1 3.41Å; Q13-I17 VanDerWaalsContact O-CG1 3.26Å; Q13-I17 WeakPolarHBondContact O-CG1 3.17Å; Q13-I17 PolarHBondContact O-N 3.47Å
14	L	90	Very high	84.3	Confident	107 Å²	107	102.8 Å²	102.8	56%	0.56	52%	0.522	S	S	*	.	H	α-helix	trans	-63.5	-42.8	177.7	-157.7	80.8	0	0	0	111.6	R10 V11 V12 I17 I18	R10-L14 WeakPolarHBondContact O-CB 3.35Å; R10-L14 PolarHBondContact O-N 3.36Å; V11-L14 PolarHBondContact O-N 3.5Å; V12-L14 VanDerWaalsContact C-N 3.32Å; V12-L14 PolarHBondContact O-N 2.84Å; L14-I17 PolarHBondContact O-N 2.99Å; L14-I18 HydrophobicContact CD2-CD1 4.44Å; L14-I18 HydrophobicContact CG-CD1 4.23Å; L14-I18 VanDerWaalsContact O-CG1 3.26Å; L14-I18 WeakPolarHBondContact O-CG1 3.43Å; L14-I18 PolarHBondContact O-N 3.29Å
15	A	88	Confident	83.7	Confident	57 Å²	57	101.8 Å²	101.8	47%	0.471	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-41.1	177.4	0	0	0	0	0	112.4	V11 V12 I18 F19	V11-A15 WeakPolarHBondContact O-CB 3.4Å; V11-A15 PolarHBondContact O-N 3.08Å; V12-A15 PolarHBondContact O-N 3.02Å; A15-I18 PolarHBondContact O-N 3.35Å; A15-F19 WeakPolarHBondContact O-CB 3.05Å; A15-F19 PolarHBondContact O-N 2.88Å
16	V	87.8	Confident	82.9	Confident	77 Å²	77	97.8 Å²	97.8	47%	0.467	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-42.8	175.6	171.8	0	0	0	0	111.1	V12 Q13 F19 I20	V12-V16 HydrophobicContact CG1-CG2 4.47Å; V12-V16 WeakPolarHBondContact O-CG2 3.25Å; V12-V16 PolarHBondContact O-N 3.49Å; Q13-V16 PolarHBondContact O-N 2.98Å; V16-F19 PolarHBondContact O-N 2.8Å; V16-I20 HydrophobicContact CG1-CD1 3.68Å; V16-I20 HydrophobicContact CG1-CG1 4.36Å; V16-I20 WeakPolarHBondContact O-CB 3.31Å; V16-I20 VanDerWaalsContact O-CG1 3.29Å; V16-I20 WeakPolarHBondContact O-CG1 3.42Å; V16-I20 PolarHBondContact O-N 3.04Å
17	I	88.9	Confident	81.2	Confident	100 Å²	100	95.9 Å²	95.9	51%	0.513	50%	0.495	S	S	.	.	H	α-helix	trans	-61.7	-46.7	176.3	-69.6	164.2	0	0	0	110.6	Q13 L14 F19 I20 S21	Q13-I17 WeakPolarHBondContact O-CD1 3.41Å; Q13-I17 VanDerWaalsContact O-CG1 3.26Å; Q13-I17 WeakPolarHBondContact O-CG1 3.17Å; Q13-I17 PolarHBondContact O-N 3.47Å; L14-I17 PolarHBondContact O-N 2.99Å; I17-F19 VanDerWaalsContact C-N 3.31Å; I17-F19 PolarHBondContact O-N 2.93Å; I17-I20 PolarHBondContact O-N 2.84Å; I17-S21 WeakPolarHBondContact O-CB 3.44Å; I17-S21 PolarHBondContact O-N 3.22Å; I17-S21 PolarHBondContact O-OG 3.43Å; I17-S21 VanDerWaalsContact O-OG 3.13Å
18	I	87.1	Confident	79.2	Confident	106 Å²	106	96 Å²	96	54%	0.544	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-42.7	178	-68.9	164.8	0	0	0	110.7	L14 A15 S21 Y22	L14-I18 HydrophobicContact CD2-CD1 4.44Å; L14-I18 HydrophobicContact CG-CD1 4.23Å; L14-I18 VanDerWaalsContact O-CG1 3.26Å; L14-I18 WeakPolarHBondContact O-CG1 3.43Å; L14-I18 PolarHBondContact O-N 3.29Å; A15-I18 PolarHBondContact O-N 3.35Å; I18-S21 PolarHBondContact O-N 2.92Å; I18-Y22 WeakPolarHBondContact O-CB 3.48Å; I18-Y22 PolarHBondContact O-N 3.04Å
19	F	86.3	Confident	76.9	Confident	134 Å²	134	98.6 Å²	98.6	59%	0.588	50%	0.5	S	S	*	.	H	α-helix	trans	-66.1	-44.4	178.9	-169.2	-96.8	0	0	0	112.2	A15 V16 I17 Y22 E23	A15-F19 WeakPolarHBondContact O-CB 3.05Å; A15-F19 PolarHBondContact O-N 2.88Å; V16-F19 PolarHBondContact O-N 2.8Å; I17-F19 VanDerWaalsContact C-N 3.31Å; I17-F19 PolarHBondContact O-N 2.93Å; F19-Y22 PolarHBondContact O-N 2.68Å; F19-E23 HydrophobicContact CD1-CG 4.22Å; F19-E23 HydrophobicContact CE1-CG 3.83Å; F19-E23 HydrophobicContact CZ-CG 4.09Å; F19-E23 PolarHBondContact O-N 2.79Å
20	I	82.8	Confident	74.4	Confident	90 Å²	90	100.7 Å²	100.7	46%	0.462	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-43.6	175.7	-70.1	169.5	0	0	0	110.7	V16 I17 Y22 E23 L24	V16-I20 HydrophobicContact CG1-CD1 3.68Å; V16-I20 HydrophobicContact CG1-CG1 4.36Å; V16-I20 WeakPolarHBondContact O-CB 3.31Å; V16-I20 VanDerWaalsContact O-CG1 3.29Å; V16-I20 WeakPolarHBondContact O-CG1 3.42Å; V16-I20 PolarHBondContact O-N 3.04Å; I17-I20 PolarHBondContact O-N 2.84Å; I20-Y22 VanDerWaalsContact C-N 3.34Å; I20-E23 PolarHBondContact O-N 3.31Å; I20-L24 HydrophobicContact CG2-CD1 3.77Å; I20-L24 VanDerWaalsContact O-CB 3.3Å; I20-L24 WeakPolarHBondContact O-CB 3.48Å; I20-L24 PolarHBondContact O-N 3.27Å
21	S	77.7	Confident	71.6	Confident	61 Å²	61	102.1 Å²	102.1	43%	0.427	51%	0.511	S	S	.	.	H	α-helix	trans	-63	-40	175.5	-68.4	0	0	0	0	112.1	I17 I18 T25	I17-S21 WeakPolarHBondContact O-CB 3.44Å; I17-S21 PolarHBondContact O-N 3.22Å; I17-S21 PolarHBondContact O-OG 3.43Å; I17-S21 VanDerWaalsContact O-OG 3.13Å; I18-S21 PolarHBondContact O-N 2.92Å; S21-T25 VanDerWaalsContact O-CB 3.27Å; S21-T25 WeakPolarHBondContact O-CB 3.31Å; S21-T25 PolarHBondContact O-N 2.03Å; S21-T25 PolarHBondContact O-OG1 2.97Å
22	Y	80.6	Confident	68.6	Low	149 Å²	149	104.5 Å²	104.5	58%	0.584	51%	0.514	S	S	*	.	H	α-helix	trans	-63.4	-47.4	174.6	177.8	-98.5	0	0	0	111.6	I18 F19 I20 T25 R26	I18-Y22 WeakPolarHBondContact O-CB 3.48Å; I18-Y22 PolarHBondContact O-N 3.04Å; F19-Y22 PolarHBondContact O-N 2.68Å; I20-Y22 VanDerWaalsContact C-N 3.34Å; Y22-T25 PolarHBondContact O-N 3.39Å; Y22-R26 VanDerWaalsContact O-CB 3.3Å; Y22-R26 WeakPolarHBondContact O-CB 3.45Å; Y22-R26 PolarHBondContact O-N 2.95Å
23	E	71.6	Confident	65.5	Low	42 Å²	42	109.1 Å²	109.1	20%	0.196	52%	0.522	C	S	.	.	H	α-helix	trans	-68.9	-37	178.7	-72.4	-60.4	147.8	0	0	112.5	F19 I20 R26 L27	F19-E23 HydrophobicContact CD1-CG 4.22Å; F19-E23 HydrophobicContact CE1-CG 3.83Å; F19-E23 HydrophobicContact CZ-CG 4.09Å; F19-E23 PolarHBondContact O-N 2.79Å; I20-E23 PolarHBondContact O-N 3.31Å; E23-R26 VanDerWaalsContact CD-NH1 3.33Å; E23-R26 PolarHBondContact O-N 2.96Å; E23-R26 IonicContact OE1-CZ 2.8Å; E23-R26 IonicContact OE1-NH1 3.49Å; E23-R26 PolarHBondContact OE1-NH1 3.4Å; E23-R26 IonicContact OE2-CZ 2.82Å; E23-R26 IonicContact OE2-NE 2.98Å; E23-R26 PolarHBondContact OE2-NE 3.1Å; E23-R26 IonicContact OE2-NH1 3.67Å; E23-R26 PolarHBondContact OE2-NH1 3.27Å; E23-R26 IonicContact OE2-NH2 2.98Å; E23-R26 PolarHBondContact OE2-NH2 2.75Å; E23-L27 VanDerWaalsContact O-CB 3.26Å; E23-L27 WeakPolarHBondContact O-CB 3.43Å; E23-L27 WeakPolarHBondContact O-CG 3.39Å; E23-L27 PolarHBondContact O-N 3.26Å
24	L	66.9	Low	62.5	Low	94 Å²	94	106.3 Å²	106.3	49%	0.492	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-43.2	170.4	-91.8	158.6	0	0	0	111.4	I20 R26 L27 L28	I20-L24 HydrophobicContact CG2-CD1 3.77Å; I20-L24 VanDerWaalsContact O-CB 3.3Å; I20-L24 WeakPolarHBondContact O-CB 3.48Å; I20-L24 PolarHBondContact O-N 3.27Å; L24-R26 VanDerWaalsContact C-N 3.34Å; L24-L27 PolarHBondContact O-N 3.2Å; L24-L28 WeakPolarHBondContact O-CB 3.34Å; L24-L28 WeakPolarHBondContact O-CD1 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.36Å; L24-L28 PolarHBondContact O-N 3.33Å
25	T	67.9	Low	59.5	Low	69 Å²	69	106.8 Å²	106.8	42%	0.423	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-43.3	175.9	-55.8	0	0	0	0	109.6	S21 Y22 L28 F29	S21-T25 VanDerWaalsContact O-CB 3.27Å; S21-T25 WeakPolarHBondContact O-CB 3.31Å; S21-T25 PolarHBondContact O-N 2.03Å; S21-T25 PolarHBondContact O-OG1 2.97Å; Y22-T25 PolarHBondContact O-N 3.39Å; T25-L28 PolarHBondContact O-N 3.25Å; T25-F29 HydrophobicContact CG2-CD2 3.66Å; T25-F29 HydrophobicContact CG2-CE2 3.78Å; T25-F29 VanDerWaalsContact O-CB 3.32Å; T25-F29 WeakPolarHBondContact O-CB 3.28Å; T25-F29 VanDerWaalsContact O-CD2 3.28Å; T25-F29 WeakPolarHBondContact O-CD2 2.83Å; T25-F29 PolarHBondContact O-N 3.28Å
26	R	61.1	Low	56.7	Low	114 Å²	114	107.9 Å²	107.9	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-61.9	-44.2	176.4	-161.7	-172.2	91.4	-174	9.6	112.1	Y22 E23 L24 F29 Q30	Y22-R26 VanDerWaalsContact O-CB 3.3Å; Y22-R26 WeakPolarHBondContact O-CB 3.45Å; Y22-R26 PolarHBondContact O-N 2.95Å; E23-R26 VanDerWaalsContact CD-NH1 3.33Å; E23-R26 PolarHBondContact O-N 2.96Å; E23-R26 IonicContact OE1-CZ 2.8Å; E23-R26 IonicContact OE1-NH1 3.49Å; E23-R26 PolarHBondContact OE1-NH1 3.4Å; E23-R26 IonicContact OE2-CZ 2.82Å; E23-R26 IonicContact OE2-NE 2.98Å; E23-R26 PolarHBondContact OE2-NE 3.1Å; E23-R26 IonicContact OE2-NH1 3.67Å; E23-R26 PolarHBondContact OE2-NH1 3.27Å; E23-R26 IonicContact OE2-NH2 2.98Å; E23-R26 PolarHBondContact OE2-NH2 2.75Å; L24-R26 VanDerWaalsContact C-N 3.34Å; R26-F29 PolarHBondContact O-N 3.34Å; R26-Q30 WeakPolarHBondContact O-CB 3.39Å; R26-Q30 PolarHBondContact O-N 3.28Å
27	L	45.7	Very low	53.9	Low	82 Å²	82	107.9 Å²	107.9	43%	0.429	50%	0.498	S	S	.	.	H	α-helix	trans	-66.3	-43.1	175.6	-82.6	160.5	0	0	0	111.4	E23 L24 F29 Q30 Y31	E23-L27 VanDerWaalsContact O-CB 3.26Å; E23-L27 WeakPolarHBondContact O-CB 3.43Å; E23-L27 WeakPolarHBondContact O-CG 3.39Å; E23-L27 PolarHBondContact O-N 3.26Å; L24-L27 PolarHBondContact O-N 3.2Å; L27-F29 VanDerWaalsContact C-N 3.29Å; L27-F29 PolarHBondContact O-N 3.49Å; L27-Q30 PolarHBondContact O-N 3.11Å; L27-Y31 WeakPolarHBondContact O-CB 3.04Å; L27-Y31 WeakPolarHBondContact O-CD2 3.35Å; L27-Y31 PolarHBondContact O-N 2.96Å
28	L	45	Very low	51	Low	116 Å²	116	104.9 Å²	104.9	61%	0.607	49%	0.493	S	S	*	.	H	α-helix	trans	-65.2	-33.2	174.9	-72.7	168.1	0	0	0	111.7	L24 T25 K32	L24-L28 WeakPolarHBondContact O-CB 3.34Å; L24-L28 WeakPolarHBondContact O-CD1 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.36Å; L24-L28 PolarHBondContact O-N 3.33Å; T25-L28 PolarHBondContact O-N 3.25Å; L28-K32 WeakPolarHBondContact O-CB 3.31Å; L28-K32 PolarHBondContact O-N 3.06Å
29	F	41.6	Very low	48.1	Very low	140 Å²	140	103 Å²	103	61%	0.614	48%	0.483	S	S	*	.	H	α-helix	trans	-73.9	-36.9	172	-95.9	-84.1	0	0	0	112.2	T25 R26 L27 K32 W33	T25-F29 HydrophobicContact CG2-CD2 3.66Å; T25-F29 HydrophobicContact CG2-CE2 3.78Å; T25-F29 VanDerWaalsContact O-CB 3.32Å; T25-F29 WeakPolarHBondContact O-CB 3.28Å; T25-F29 VanDerWaalsContact O-CD2 3.28Å; T25-F29 WeakPolarHBondContact O-CD2 2.83Å; T25-F29 PolarHBondContact O-N 3.28Å; R26-F29 PolarHBondContact O-N 3.34Å; L27-F29 VanDerWaalsContact C-N 3.29Å; L27-F29 PolarHBondContact O-N 3.49Å; F29-K32 PolarHBondContact O-N 2.97Å; F29-W33 PolarHBondContact O-NE1 3.28Å; F29-W33 VanDerWaalsContact O-NE1 3.07Å
30	Q	35.2	Very low	45.1	Very low	118 Å²	118	98.8 Å²	98.8	55%	0.551	47%	0.47	S	S	*	.	H	α-helix	trans	-69	-34.1	175	-97.1	-177.2	-45.5	0	0	112.4	R26 L27 K32	R26-Q30 WeakPolarHBondContact O-CB 3.39Å; R26-Q30 PolarHBondContact O-N 3.28Å; L27-Q30 PolarHBondContact O-N 3.11Å; Q30-K32 VanDerWaalsContact C-N 3.28Å; Q30-K32 PolarHBondContact O-N 3.38Å
31	Y	29.5	Very low	42.3	Very low	198 Å²	198	104.5 Å²	104.5	78%	0.776	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	4.1	177.2	-90.1	-86.9	0	0	0	114	L27	L27-Y31 WeakPolarHBondContact O-CB 3.04Å; L27-Y31 WeakPolarHBondContact O-CD2 3.35Å; L27-Y31 PolarHBondContact O-N 2.96Å
32	K	26.5	Very low	39.8	Very low	141 Å²	141	108.3 Å²	108.3	61%	0.613	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	15.6	178.6	-117	-165.1	176.4	-176.7	0	115.4	L28 F29 Q30 I50	L28-K32 WeakPolarHBondContact O-CB 3.31Å; L28-K32 PolarHBondContact O-N 3.06Å; F29-K32 PolarHBondContact O-N 2.97Å; Q30-K32 VanDerWaalsContact C-N 3.28Å; Q30-K32 PolarHBondContact O-N 3.38Å; K32-I50 HydrophobicContact CD-CD1 3.88Å; K32-I50 HydrophobicContact CG-CD1 3.72Å
33	W	25.8	Very low	37.1	Very low	181 Å²	181	108.3 Å²	108.3	69%	0.686	51%	0.512	S	S	*	.			trans	-112.6	136.8	177	-62.1	89.4	0	0	0	105.8	F29	F29-W33 PolarHBondContact O-NE1 3.28Å; F29-W33 VanDerWaalsContact O-NE1 3.07Å
34	D	26.7	Very low	34.9	Very low	57 Å²	57	109.6 Å²	109.6	31%	0.305	54%	0.536	S	S	.	.			cis	165.6	98	26.8	-108.1	2.6	0	0	0	108.7	Y48	D34-Y48 VanDerWaalsContact CA-CE1 3.5Å; D34-Y48 HydrophobicContact CB-CD1 3.48Å; D34-Y48 VanDerWaalsContact CB-CD1 3.48Å; D34-Y48 HydrophobicContact CB-CD2 4.14Å; D34-Y48 HydrophobicContact CB-CE1 3.16Å; D34-Y48 HydrophobicContact CB-CE2 3.86Å; D34-Y48 HydrophobicContact CB-CG 3.93Å; D34-Y48 VanDerWaalsContact CG-CD1 3.46Å; D34-Y48 WeakPolarHBondContact O-CE1 3.48Å; D34-Y48 WeakPolarHBondContact OD1-CB 3.28Å; D34-Y48 WeakPolarHBondContact OD1-CD1 3.11Å; D34-Y48 WeakPolarHBondContact OD1-CD2 3.39Å; D34-Y48 VanDerWaalsContact OD1-CE2 3.3Å; D34-Y48 WeakPolarHBondContact OD1-CE2 3.18Å; D34-Y48 WeakPolarHBondContact OD2-CD2 3.32Å; D34-Y48 WeakPolarHBondContact OD2-CE2 3.46Å; D34-Y48 PolarHBondContact OD2-OH 3.29Å
35	E	26.6	Very low	32.8	Very low	116 Å²	116	111.8 Å²	111.8	54%	0.542	55%	0.548	S	S	.	.			trans	-152.6	109.2	159.4	-71.3	-165.4	172.6	0	0	111.1	Y48	E35-Y48 VanDerWaalsContact N-CD1 3.35Å
36	K	28.7	Very low	30.8	Very low	80 Å²	80	113.4 Å²	113.4	35%	0.348	55%	0.55	S	S	.	.			trans	-147.3	158	163.8	-101	-167	-179.2	170.4	0	112	N49	K36-N49 HydrophobicContact CD-CB 4.12Å; K36-N49 WeakPolarHBondContact CD-O 3.49Å; K36-N49 WeakPolarHBondContact CE-O 3.2Å; K36-N49 WeakPolarHBondContact CG-O 3.45Å; K36-N49 PolarHBondContact NZ-O 2.67Å
37	F	29.3	Very low	29.1	Very low	77 Å²	77	116.1 Å²	116.1	34%	0.338	57%	0.565	S	S	.	*			trans	-58.2	139.9	-166.8	-61.5	-93.5	0	0	0	115.8	I115 L195 S372 P373	F37-I115 HydrophobicContact CB-CG2 4.27Å; F37-I115 HydrophobicContact CD1-CB 4.49Å; F37-I115 HydrophobicContact CD1-CD1 4.28Å; F37-I115 HydrophobicContact CD1-CG2 3.6Å; F37-I115 HydrophobicContact CE1-CD1 4.27Å; F37-I115 HydrophobicContact CE1-CG2 4.15Å; F37-I115 HydrophobicContact CG-CG2 4.18Å; F37-L195 HydrophobicContact CE1-CD1 4.4Å; F37-S372 WeakPolarHBondContact CZ-OG 3.4Å; F37-P373 HydrophobicContact CE1-CG 3.88Å; F37-P373 HydrophobicContact CZ-CG 3.74Å
38	G	28.1	Very low	28.2	Very low	38 Å²	38	115.3 Å²	115.3	39%	0.392	56%	0.556	S	S	.	*			trans	177.7	123.3	165.8	0	0	0	0	0	112.5	S40 N114	G38-S40 PolarHBondContact O-N 3.38Å; G38-N114 WeakPolarHBondContact O-CB 3.2Å; G38-N114 PolarHBondContact O-ND2 3.31Å
39	I	25.6	Very low	27.4	Very low	67 Å²	67	115.1 Å²	115.1	34%	0.344	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.4	113.1	160.3	-63.5	171.3	0	0	0	105.6	L111 F163 H165	I39-L111 HydrophobicContact CG2-CB 4.17Å; I39-L111 HydrophobicContact CG2-CD1 4.37Å; I39-L111 HydrophobicContact CG2-CD2 4.05Å; I39-L111 HydrophobicContact CG2-CG 4.43Å; I39-F163 HydrophobicContact CD1-CE1 4.07Å; I39-F163 HydrophobicContact CG1-CE1 4.29Å; I39-H165 HydrophobicContact CD1-CB 3.83Å
40	S	24.7	Very low	26.7	Very low	44 Å²	44	113.2 Å²	113.2	31%	0.308	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.4	123.2	174.3	-177.6	0	0	0	0	109.2	G38	G38-S40 PolarHBondContact O-N 3.38Å
41	R	24.2	Very low	26.2	Very low	211 Å²	211	112.5 Å²	112.5	80%	0.796	55%	0.551	S	S	*	*			trans	-86.2	132	153.7	-102.2	-179	160.4	163.8	-4.7	106.4	N43 L111	R41-N43 PolarHBondContact O-N 3.18Å; R41-L111 HydrophobicContact CG-CD2 3.86Å
42	N	23.9	Very low	26	Very low	141 Å²	141	111.1 Å²	111.1	75%	0.754	56%	0.556	S	S	*	*	S	Bend	trans	-25.4	100.6	177.2	-91.3	-18.9	0	0	0	112.6
43	N	25	Very low	25.8	Very low	149 Å²	149	112.3 Å²	112.3	80%	0.797	56%	0.563	S	S	*	*	S	Bend	trans	177.1	85.5	146.9	-86	-8.2	0	0	0	108.6	R41 D45	R41-N43 PolarHBondContact O-N 3.18Å; N43-D45 PolarHBondContact O-N 3.48Å
44	G	25.1	Very low	25.8	Very low	69 Å²	69	112.7 Å²	112.7	71%	0.711	57%	0.573	S	S	*	*			trans	82.1	-49.7	135.4	0	0	0	0	0	121.2
45	D	23.3	Very low	25.6	Very low	140 Å²	140	115.7 Å²	115.7	75%	0.749	60%	0.598	S	S	*	*			trans	-122.2	126.9	-153.7	-62.1	-38.3	0	0	0	115.2	N43 F47	N43-D45 PolarHBondContact O-N 3.48Å; D45-F47 HydrophobicContact CB-CE2 4.34Å
46	F	25.3	Very low	25.4	Very low	103 Å²	103	117.3 Å²	117.3	45%	0.452	60%	0.6	S	S	.	*			trans	-99.6	140.7	-178.6	-101.4	-95.9	0	0	0	111.4	Y48	F46-Y48 HydrophobicContact CB-CE2 3.88Å; F46-Y48 HydrophobicContact CD1-CE1 4.07Å; F46-Y48 AromaticContact CD1-CE2 3.86Å; F46-Y48 HydrophobicContact CD1-CE2 3.86Å; F46-Y48 AromaticContact CD1-CZ 3.47Å; F46-Y48 VanDerWaalsContact CD1-CZ 3.47Å; F46-Y48 WeakPolarHBondContact CD1-OH 3.45Å; F46-Y48 HydrophobicContact CE1-CE1 4.49Å; F46-Y48 HydrophobicContact CG-CE2 4.27Å
47	F	26.4	Very low	25.1	Very low	170 Å²	170	119.2 Å²	119.2	75%	0.746	62%	0.624	S	S	*	*			trans	-143	140.4	169.5	-73.3	-80.1	0	0	0	113.3	D45	D45-F47 HydrophobicContact CB-CE2 4.34Å
48	Y	25.9	Very low	25	Very low	65 Å²	65	120.6 Å²	120.6	26%	0.255	64%	0.643	S	S	.	*			trans	-127.8	153.4	-162.5	-64.4	-84.5	0	0	0	112.7	D34 E35 F46	D34-Y48 VanDerWaalsContact CA-CE1 3.5Å; D34-Y48 HydrophobicContact CB-CD1 3.48Å; D34-Y48 VanDerWaalsContact CB-CD1 3.48Å; D34-Y48 HydrophobicContact CB-CD2 4.14Å; D34-Y48 HydrophobicContact CB-CE1 3.16Å; D34-Y48 HydrophobicContact CB-CE2 3.86Å; D34-Y48 HydrophobicContact CB-CG 3.93Å; D34-Y48 VanDerWaalsContact CG-CD1 3.46Å; D34-Y48 WeakPolarHBondContact O-CE1 3.48Å; D34-Y48 WeakPolarHBondContact OD1-CB 3.28Å; D34-Y48 WeakPolarHBondContact OD1-CD1 3.11Å; D34-Y48 WeakPolarHBondContact OD1-CD2 3.39Å; D34-Y48 VanDerWaalsContact OD1-CE2 3.3Å; D34-Y48 WeakPolarHBondContact OD1-CE2 3.18Å; D34-Y48 WeakPolarHBondContact OD2-CD2 3.32Å; D34-Y48 WeakPolarHBondContact OD2-CE2 3.46Å; D34-Y48 PolarHBondContact OD2-OH 3.29Å; E35-Y48 VanDerWaalsContact N-CD1 3.35Å; F46-Y48 HydrophobicContact CB-CE2 3.88Å; F46-Y48 HydrophobicContact CD1-CE1 4.07Å; F46-Y48 AromaticContact CD1-CE2 3.86Å; F46-Y48 HydrophobicContact CD1-CE2 3.86Å; F46-Y48 AromaticContact CD1-CZ 3.47Å; F46-Y48 VanDerWaalsContact CD1-CZ 3.47Å; F46-Y48 WeakPolarHBondContact CD1-OH 3.45Å; F46-Y48 HydrophobicContact CE1-CE1 4.49Å; F46-Y48 HydrophobicContact CG-CE2 4.27Å
49	N	28.1	Very low	24.9	Very low	113 Å²	113	127.3 Å²	127.3	60%	0.604	67%	0.669	S	S	*	*			trans	-160.4	149.6	165.2	-90.6	-50.6	0	0	0	114.5	K36	K36-N49 HydrophobicContact CD-CB 4.12Å; K36-N49 WeakPolarHBondContact CD-O 3.49Å; K36-N49 WeakPolarHBondContact CE-O 3.2Å; K36-N49 WeakPolarHBondContact CG-O 3.45Å; K36-N49 PolarHBondContact NZ-O 2.67Å
50	I	25.9	Very low	24.8	Very low	100 Å²	100	131 Å²	131	51%	0.513	69%	0.694	S	S	.	*			trans	-91.2	157.9	-163	-68.7	162.3	0	0	0	115	K32	K32-I50 HydrophobicContact CD-CD1 3.88Å; K32-I50 HydrophobicContact CG-CD1 3.72Å
51	L	26.6	Very low	24.9	Very low	103 Å²	103	132.8 Å²	132.8	54%	0.539	72%	0.72	S	S	.	*			trans	-135.5	155	160.6	-96.1	166.3	0	0	0	114	D369	L51-D369 HydrophobicContact CD1-CB 4.43Å; L51-D369 WeakPolarHBondContact CD1-O 3.35Å
52	L	24.3	Very low	24.8	Very low	168 Å²	168	130 Å²	130	88%	0.88	72%	0.721	S	S	*	*			trans	-93.6	150.7	-167.6	-74.7	160.4	0	0	0	113.8
53	H	22.8	Very low	25	Very low	167 Å²	167	130.8 Å²	130.8	77%	0.773	73%	0.725	S	S	*	*			trans	-80	130.3	177.3	-108.5	-87.7	0	0	0	112
54	E	25	Very low	25	Very low	189 Å²	189	131.7 Å²	131.7	88%	0.883	73%	0.729	S	S	*	*			trans	-130.3	149.7	157.3	-81.2	-169.6	164.7	0	0	111.7
55	S	23	Very low	24.9	Very low	120 Å²	120	135.9 Å²	135.9	84%	0.839	73%	0.73	S	S	*	*			trans	-101.1	145.1	-160.9	49.6	0	0	0	0	114.1
56	Y	23.3	Very low	24.9	Very low	149 Å²	149	134.9 Å²	134.9	58%	0.584	73%	0.729	S	S	*	*			trans	-69.3	146.4	-176.3	-81	-102.1	0	0	0	116.7	E74	Y56-E74 WeakPolarHBondContact CE1-OE2 3.22Å; Y56-E74 WeakPolarHBondContact OH-CB 3.47Å; Y56-E74 PolarHBondContact OH-OE2 3.15Å; Y56-E74 VanDerWaalsContact OH-OE2 3.13Å
57	S	21.6	Very low	24.9	Very low	120 Å²	120	136 Å²	136	84%	0.839	73%	0.732	S	S	*	*			trans	-148.3	148.9	145.4	87.9	0	0	0	0	113.1
58	S	26.2	Very low	24.8	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	73%	0.731	S	S	*	*			trans	-50.5	144.1	-170.5	52.4	0	0	0	0	119.1
59	L	25.9	Very low	24.9	Very low	180 Å²	180	134.9 Å²	134.9	94%	0.942	73%	0.726	S	S	*	*			trans	-145.8	129	151	-88.2	169.6	0	0	0	112.8
60	T	24.5	Very low	25.1	Very low	143 Å²	143	132 Å²	132	88%	0.877	71%	0.714	S	S	*	*			trans	-94.6	134.6	172.3	47.4	0	0	0	0	110.3
61	G	25.7	Very low	25.4	Very low	82 Å²	82	131.6 Å²	131.6	85%	0.845	72%	0.721	S	S	*	*			trans	-167.5	151.5	177.3	0	0	0	0	0	115.1
62	N	24.1	Very low	25.6	Very low	154 Å²	154	132.6 Å²	132.6	82%	0.824	72%	0.722	S	S	*	*			trans	-64.6	158	-157.9	-88.8	-32.5	0	0	0	120.1	N64	N62-N64 PolarHBondContact O-N 3.35Å
63	L	26.8	Very low	25.9	Very low	157 Å²	157	127.6 Å²	127.6	82%	0.822	70%	0.696	S	S	*	*	S	Bend	trans	-57.4	108.1	173.9	-71.3	119.8	0	0	0	114.4
64	N	25	Very low	26.6	Very low	167 Å²	167	123.6 Å²	123.6	89%	0.893	68%	0.677	S	S	*	*	S	Bend	trans	170.4	30.7	143.3	-95	-11.6	0	0	0	111.3	N62	N62-N64 PolarHBondContact O-N 3.35Å
65	Q	23.4	Very low	27.3	Very low	158 Å²	158	120.2 Å²	120.2	74%	0.738	66%	0.659	S	S	*	*	S	Bend	trans	-120.3	141	-176.1	-74.5	-179.4	-7	0	0	111	Y67	Q65-Y67 PolarHBondContact O-N 2.96Å
66	T	23.7	Very low	28.1	Very low	118 Å²	118	117 Å²	117	72%	0.724	63%	0.629	S	S	*	*			trans	-35.2	120.1	167.7	-38.2	0	0	0	0	110.1	Y68	T66-Y68 VanDerWaalsContact O-CD2 3.24Å; T66-Y68 WeakPolarHBondContact O-CD2 3.43Å; T66-Y68 PolarHBondContact O-N 3.05Å
67	Y	24.6	Very low	29.3	Very low	128 Å²	128	114.7 Å²	114.7	50%	0.502	62%	0.624	S	S	.	*			trans	-60.3	100.4	-175.7	-65	-100.3	0	0	0	110.2	Q65 V69 E86 L89	Q65-Y67 PolarHBondContact O-N 2.96Å; Y67-V69 PolarHBondContact O-N 3.28Å; Y67-E86 HydrophobicContact CD1-CG 4.46Å; Y67-E86 HydrophobicContact CE1-CB 3.98Å; Y67-E86 VanDerWaalsContact CE1-CD 3.43Å; Y67-E86 HydrophobicContact CE1-CG 3.81Å; Y67-E86 HydrophobicContact CE2-CB 4.35Å; Y67-E86 PolarHBondContact OH-OE2 3.42Å; Y67-L89 HydrophobicContact CG-CD1 4.34Å
68	Y	25	Very low	30.7	Very low	186 Å²	186	109.4 Å²	109.4	73%	0.729	59%	0.586	S	S	*	*			trans	-79.2	113	160.4	-65.6	-86.4	0	0	0	106.5	T66 S70	T66-Y68 VanDerWaalsContact O-CD2 3.24Å; T66-Y68 WeakPolarHBondContact O-CD2 3.43Å; T66-Y68 PolarHBondContact O-N 3.05Å; Y68-S70 PolarHBondContact O-N 3.2Å
69	V	27.1	Very low	32.3	Very low	25 Å²	25	110 Å²	110	15%	0.152	58%	0.575	C	S	.	*			trans	-73.8	60.6	173.6	-170.7	0	0	0	0	108.5	Y67 M73 L89 Y93	Y67-V69 PolarHBondContact O-N 3.28Å; V69-M73 HydrophobicContact CB-CG 4.19Å; V69-M73 HydrophobicContact CB-SD 3.43Å; V69-M73 WeakPolarHBondContact CB-SD 3.35Å; V69-M73 HydrophobicContact CG1-CG 3.95Å; V69-M73 HydrophobicContact CG1-SD 3.28Å; V69-M73 WeakPolarHBondContact CG1-SD 3.12Å; V69-M73 HydrophobicContact CG2-SD 4.13Å; V69-M73 WeakPolarHBondContact O-CB 3.36Å; V69-M73 WeakPolarHBondContact O-CG 3.46Å; V69-M73 PolarHBondContact O-N 3.4Å; V69-L89 HydrophobicContact CG2-CD1 3.57Å; V69-L89 HydrophobicContact CG2-CD2 3.54Å; V69-L89 HydrophobicContact CG2-CG 4.06Å; V69-Y93 HydrophobicContact CG1-CE2 3.61Å; V69-Y93 WeakPolarHBondContact CG1-OH 3.37Å
70	S	32.6	Very low	34	Very low	52 Å²	52	103.1 Å²	103.1	36%	0.364	54%	0.539	S	S	.	.	H	α-helix	trans	-81.5	-29.7	-149.9	55.2	0	0	0	0	115.9	Y68 Q72 E74	Y68-S70 PolarHBondContact O-N 3.2Å; S70-Q72 VanDerWaalsContact C-N 3.35Å; S70-Q72 PolarHBondContact O-N 3.42Å; S70-E74 WeakPolarHBondContact CB-OE1 3.35Å; S70-E74 VanDerWaalsContact O-CB 3.29Å; S70-E74 WeakPolarHBondContact O-CB 3.46Å; S70-E74 WeakPolarHBondContact O-CG 3.03Å; S70-E74 PolarHBondContact O-N 3.28Å
71	S	32.1	Very low	35.9	Very low	92 Å²	92	99.3 Å²	99.3	64%	0.643	52%	0.516	S	S	*	.	H	α-helix	trans	-74.5	-18.5	-166.2	71.3	0	0	0	0	116.1
72	Q	30.2	Very low	37.9	Very low	123 Å²	123	97 Å²	97	58%	0.575	48%	0.484	S	S	*	.	H	α-helix	trans	-124.6	-16.8	170.6	-65.2	-146.2	-16.5	0	0	114.2	S70 Y76	S70-Q72 VanDerWaalsContact C-N 3.35Å; S70-Q72 PolarHBondContact O-N 3.42Å; Q72-Y76 WeakPolarHBondContact O-CD2 3.31Å
73	M	31.5	Very low	39.7	Very low	64 Å²	64	93 Å²	93	32%	0.315	48%	0.479	S	S	.	.	H	α-helix	trans	-92	-10.1	178.1	-54.6	-178.6	51.8	0	0	114.1	V69 K75 Y76 I80	V69-M73 HydrophobicContact CB-CG 4.19Å; V69-M73 HydrophobicContact CB-SD 3.43Å; V69-M73 WeakPolarHBondContact CB-SD 3.35Å; V69-M73 HydrophobicContact CG1-CG 3.95Å; V69-M73 HydrophobicContact CG1-SD 3.28Å; V69-M73 WeakPolarHBondContact CG1-SD 3.12Å; V69-M73 HydrophobicContact CG2-SD 4.13Å; V69-M73 WeakPolarHBondContact O-CB 3.36Å; V69-M73 WeakPolarHBondContact O-CG 3.46Å; V69-M73 PolarHBondContact O-N 3.4Å; M73-K75 PolarHBondContact O-N 3.13Å; M73-Y76 CarbonylContact O-C 3.54Å; M73-Y76 PolarHBondContact O-N 3.14Å; M73-I80 HydrophobicContact CE-CD1 4.35Å
74	E	37	Very low	41.6	Very low	83 Å²	83	87.8 Å²	87.8	39%	0.388	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.2	168.8	-89.3	175.9	-167.1	0	0	112.8	Y56 S70 E77	Y56-E74 WeakPolarHBondContact CE1-OE2 3.22Å; Y56-E74 WeakPolarHBondContact OH-CB 3.47Å; Y56-E74 PolarHBondContact OH-OE2 3.15Å; Y56-E74 VanDerWaalsContact OH-OE2 3.13Å; S70-E74 WeakPolarHBondContact CB-OE1 3.35Å; S70-E74 VanDerWaalsContact O-CB 3.29Å; S70-E74 WeakPolarHBondContact O-CB 3.46Å; S70-E74 WeakPolarHBondContact O-CG 3.03Å; S70-E74 PolarHBondContact O-N 3.28Å; E74-E77 VanDerWaalsContact O-CG 3.31Å; E74-E77 WeakPolarHBondContact O-CG 3.35Å
75	K	39.1	Very low	43.6	Very low	117 Å²	117	83.4 Å²	83.4	51%	0.509	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-15	173.8	-154.7	173.1	-177.4	-179.8	0	113.9	M73	M73-K75 PolarHBondContact O-N 3.13Å
76	Y	39.8	Very low	45.6	Very low	53 Å²	53	80.4 Å²	80.4	21%	0.208	42%	0.415	C	S	.	.	S	Bend	trans	-121.3	42	-172.2	-57.1	-76.2	0	0	0	111.6	Q72 M73 N78 F121 M374 C377	Q72-Y76 WeakPolarHBondContact O-CD2 3.31Å; M73-Y76 CarbonylContact O-C 3.54Å; M73-Y76 PolarHBondContact O-N 3.14Å; Y76-N78 VanDerWaalsContact C-N 3.27Å; Y76-N78 PolarHBondContact O-N 3.36Å; Y76-F121 HydrophobicContact CE1-CD2 4.04Å; Y76-F121 PolarHBondContact OH-O 3.26Å; Y76-M374 HydrophobicContact CD1-CB 4.03Å; Y76-M374 HydrophobicContact CD1-CG 4.15Å; Y76-M374 HydrophobicContact CD1-SD 3.24Å; Y76-M374 WeakPolarHBondContact CD1-SD 3.45Å; Y76-M374 HydrophobicContact CE1-CE 4.42Å; Y76-M374 HydrophobicContact CE1-SD 3.28Å; Y76-M374 WeakPolarHBondContact CE1-SD 3.38Å; Y76-M374 HydrophobicContact CG-SD 4.46Å; Y76-C377 HydrophobicContact CD1-CB 4.18Å
77	E	48.9	Very low	47.9	Very low	101 Å²	101	81.1 Å²	81.1	47%	0.472	41%	0.408	S	S	.	.			trans	-76.9	52.6	-165.4	-60.6	-172.5	155.2	0	0	116	E74 K79 W371	E74-E77 VanDerWaalsContact O-CG 3.31Å; E74-E77 WeakPolarHBondContact O-CG 3.35Å; E77-K79 PolarHBondContact O-N 3.43Å; E77-W371 VanDerWaalsContact C-CE2 3.45Å; E77-W371 WeakPolarHBondContact O-CH2 3.24Å; E77-W371 WeakPolarHBondContact O-CZ2 3.11Å
78	N	51.7	Low	50.1	Low	9 Å²	9	76.6 Å²	76.6	5%	0.048	39%	0.393	C	S	.	.			trans	-62.1	129.1	155.6	-65.1	-57.9	0	0	0	106.8	Y76 I80 I193 Y194 P373 M374 P375 V378	Y76-N78 VanDerWaalsContact C-N 3.27Å; Y76-N78 PolarHBondContact O-N 3.36Å; N78-I80 VanDerWaalsContact C-N 3.33Å; N78-I80 HydrophobicContact CB-CG1 4.47Å; N78-I80 PolarHBondContact O-N 3.36Å; N78-I193 HydrophobicContact CB-CG2 3.57Å; N78-I193 VanDerWaalsContact CG-CG2 3.44Å; N78-Y194 PolarHBondContact OD1-O 3.49Å; N78-P373 VanDerWaalsContact OD1-CB 3.3Å; N78-P373 WeakPolarHBondContact OD1-CB 3.47Å; N78-M374 PolarHBondContact ND2-O 3.41Å; N78-M374 VanDerWaalsContact ND2-O 3.16Å; N78-P375 WeakPolarHBondContact ND2-CA 3.12Å; N78-V378 HydrophobicContact CB-CG2 4.19Å; N78-V378 WeakPolarHBondContact ND2-CG2 3.48Å
79	K	59.6	Low	52	Low	117 Å²	117	68.7 Å²	68.7	51%	0.509	36%	0.363	S	S	.	.			trans	-65	100.7	166.1	-175.4	-177.1	177.5	-173.6	0	107.1	E77 T81 Y194	E77-K79 PolarHBondContact O-N 3.43Å; K79-T81 PolarHBondContact O-N 3.13Å; K79-Y194 PolarHBondContact O-N 3.21Å
80	I	62.6	Low	54	Low	37 Å²	37	72 Å²	72	19%	0.19	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-83.4	107	176.8	-57.3	171.9	0	0	0	108.1	M73 N78 L82 F84 T192 V378	M73-I80 HydrophobicContact CE-CD1 4.35Å; N78-I80 VanDerWaalsContact C-N 3.33Å; N78-I80 HydrophobicContact CB-CG1 4.47Å; N78-I80 PolarHBondContact O-N 3.36Å; I80-L82 VanDerWaalsContact C-N 3.3Å; I80-L82 HydrophobicContact CG2-CB 3.87Å; I80-L82 HydrophobicContact CG2-CD1 3.58Å; I80-L82 HydrophobicContact CG2-CG 3.57Å; I80-L82 PolarHBondContact O-N 3.37Å; I80-F84 HydrophobicContact CG2-CD2 4.37Å; I80-F84 HydrophobicContact CG2-CE2 3.67Å; I80-F84 HydrophobicContact CG2-CZ 4.42Å; I80-T192 CarbonylContact C-O 3.59Å; I80-T192 VanDerWaalsContact CA-O 3.31Å; I80-T192 WeakPolarHBondContact CA-O 3.37Å; I80-V378 HydrophobicContact CD1-CB 4.39Å; I80-V378 HydrophobicContact CD1-CG1 3.6Å; I80-V378 HydrophobicContact CD1-CG2 3.86Å; I80-V378 HydrophobicContact CG1-CG1 3.96Å; I80-V378 HydrophobicContact CG1-CG2 4.26Å
81	T	64.2	Low	55.7	Low	63 Å²	63	71.6 Å²	71.6	39%	0.387	37%	0.369	S	S	.	.			trans	-91.8	65.6	176.6	-43.7	0	0	0	0	109.6	K79 S191 T192	K79-T81 PolarHBondContact O-N 3.13Å; T81-S191 PolarHBondContact OG1-O 2.81Å; T81-T192 PolarHBondContact N-O 2.9Å
82	L	65.9	Low	57.4	Low	34 Å²	34	67.9 Å²	67.9	18%	0.178	34%	0.342	C	S	.	.	S	Bend	trans	-108.3	-7.3	175.4	-72.9	177.2	0	0	0	113.9	I80 F84 Y183 T192 L382 Y392	I80-L82 VanDerWaalsContact C-N 3.3Å; I80-L82 HydrophobicContact CG2-CB 3.87Å; I80-L82 HydrophobicContact CG2-CD1 3.58Å; I80-L82 HydrophobicContact CG2-CG 3.57Å; I80-L82 PolarHBondContact O-N 3.37Å; L82-F84 HydrophobicContact CB-CD1 4.19Å; L82-F84 HydrophobicContact CB-CD2 4.06Å; L82-F84 HydrophobicContact CB-CE1 3.92Å; L82-F84 HydrophobicContact CB-CE2 3.81Å; L82-F84 HydrophobicContact CB-CG 4.26Å; L82-F84 HydrophobicContact CB-CZ 3.76Å; L82-F84 HydrophobicContact CD1-CE1 3.92Å; L82-F84 HydrophobicContact CD1-CE2 3.78Å; L82-F84 HydrophobicContact CD1-CZ 3.26Å; L82-F84 HydrophobicContact CG-CE2 4.34Å; L82-F84 HydrophobicContact CG-CZ 4.11Å; L82-F84 PolarHBondContact O-N 3.1Å; L82-Y183 HydrophobicContact CD1-CD1 4.37Å; L82-Y183 HydrophobicContact CD1-CE1 3.92Å; L82-Y183 HydrophobicContact CD2-CD1 3.7Å; L82-Y183 HydrophobicContact CD2-CE1 3.47Å; L82-Y183 VanDerWaalsContact CD2-CE1 3.47Å; L82-Y183 HydrophobicContact CG-CE1 4.38Å; L82-T192 HydrophobicContact CD1-CG2 4.07Å; L82-T192 HydrophobicContact CD2-CG2 3.45Å; L82-T192 VanDerWaalsContact CD2-CG2 3.45Å; L82-T192 HydrophobicContact CG-CG2 3.64Å; L82-L382 HydrophobicContact CD1-CD1 4.28Å; L82-L382 HydrophobicContact CD1-CD2 3.86Å; L82-Y392 HydrophobicContact CD2-CD1 4.19Å; L82-Y392 HydrophobicContact CD2-CE1 4.1Å
83	G	62.5	Low	58.9	Low	70 Å²	70	67.2 Å²	67.2	72%	0.722	34%	0.335	S	S	*	.			trans	60.3	36.8	-178.3	0	0	0	0	0	112.3	T85	G83-T85 PolarHBondContact O-N 2.98Å
84	F	66.6	Low	60.6	Low	46 Å²	46	70.3 Å²	70.3	20%	0.202	35%	0.347	C	S	.	.			trans	-55.1	132.4	178.8	-69.4	-54.2	0	0	0	111.1	I80 L82 D88 L89 L92 L382 L389	I80-F84 HydrophobicContact CG2-CD2 4.37Å; I80-F84 HydrophobicContact CG2-CE2 3.67Å; I80-F84 HydrophobicContact CG2-CZ 4.42Å; L82-F84 HydrophobicContact CB-CD1 4.19Å; L82-F84 HydrophobicContact CB-CD2 4.06Å; L82-F84 HydrophobicContact CB-CE1 3.92Å; L82-F84 HydrophobicContact CB-CE2 3.81Å; L82-F84 HydrophobicContact CB-CG 4.26Å; L82-F84 HydrophobicContact CB-CZ 3.76Å; L82-F84 HydrophobicContact CD1-CE1 3.92Å; L82-F84 HydrophobicContact CD1-CE2 3.78Å; L82-F84 HydrophobicContact CD1-CZ 3.26Å; L82-F84 HydrophobicContact CG-CE2 4.34Å; L82-F84 HydrophobicContact CG-CZ 4.11Å; L82-F84 PolarHBondContact O-N 3.1Å; F84-D88 HydrophobicContact CB-CB 4.08Å; F84-D88 HydrophobicContact CD1-CB 3.7Å; F84-D88 HydrophobicContact CG-CB 4.28Å; F84-L89 HydrophobicContact CB-CD2 3.99Å; F84-L89 HydrophobicContact CB-CG 4.21Å; F84-L89 HydrophobicContact CD2-CD2 4.29Å; F84-L89 HydrophobicContact CG-CD2 4.35Å; F84-L92 HydrophobicContact CE2-CD1 4.4Å; F84-L92 HydrophobicContact CZ-CD1 4.36Å; F84-L382 HydrophobicContact CZ-CD2 4.28Å; F84-L389 HydrophobicContact CE1-CD1 3.68Å; F84-L389 HydrophobicContact CE1-CD2 4.34Å; F84-L389 HydrophobicContact CZ-CD1 4.39Å
85	T	68.2	Low	61.8	Low	75 Å²	75	67.5 Å²	67.5	46%	0.46	34%	0.335	S	S	.	.			trans	-78.2	163	167.7	66.3	0	0	0	0	110.1	G83 K87 D88 L89	G83-T85 PolarHBondContact O-N 2.98Å; T85-K87 PolarHBondContact O-N 3.09Å; T85-D88 WeakPolarHBondContact CB-OD2 3.03Å; T85-D88 PolarHBondContact N-OD2 3.29Å; T85-D88 WeakPolarHBondContact O-CB 3.26Å; T85-D88 PolarHBondContact O-N 3.18Å; T85-D88 PolarHBondContact OG1-N 3.3Å; T85-D88 PolarHBondContact OG1-OD2 3.23Å; T85-L89 WeakPolarHBondContact O-CG 3.46Å; T85-L89 PolarHBondContact O-N 3.47Å; T85-L89 VanDerWaalsContact O-N 3.11Å
86	E	65.6	Low	62.7	Low	96 Å²	96	69.9 Å²	69.9	45%	0.449	35%	0.346	S	S	.	.	H	α-helix	trans	-53.5	-38	172.2	-175.4	168.6	-160.4	0	0	111.9	Y67 L89 E90	Y67-E86 HydrophobicContact CD1-CG 4.46Å; Y67-E86 HydrophobicContact CE1-CB 3.98Å; Y67-E86 VanDerWaalsContact CE1-CD 3.43Å; Y67-E86 HydrophobicContact CE1-CG 3.81Å; Y67-E86 HydrophobicContact CE2-CB 4.35Å; Y67-E86 PolarHBondContact OH-OE2 3.42Å; E86-L89 WeakPolarHBondContact O-CB 3.39Å; E86-L89 PolarHBondContact O-N 2.88Å; E86-E90 WeakPolarHBondContact O-CG 3.33Å; E86-E90 PolarHBondContact O-N 2.93Å
87	K	71.5	Confident	63.2	Low	133 Å²	133	72.6 Å²	72.6	58%	0.578	37%	0.372	S	S	*	.	H	α-helix	trans	-62.1	-43.9	175.2	-175.2	-175.4	173.8	-168.7	0	112.6	T85 L89 E90 E91	T85-K87 PolarHBondContact O-N 3.09Å; K87-L89 VanDerWaalsContact C-N 3.27Å; K87-L89 PolarHBondContact O-N 3.05Å; K87-E90 PolarHBondContact O-N 2.86Å; K87-E91 VanDerWaalsContact CE-OE1 3.26Å; K87-E91 WeakPolarHBondContact CE-OE1 3.36Å; K87-E91 WeakPolarHBondContact O-CG 3.38Å; K87-E91 PolarHBondContact O-N 3.19Å
88	D	69.7	Low	63.5	Low	32 Å²	32	70.9 Å²	70.9	17%	0.171	38%	0.375	C	S	.	.	H	α-helix	trans	-60.6	-43.1	177.2	-59.3	-53.4	0	0	0	110	F84 T85 E91 L92 L389	F84-D88 HydrophobicContact CB-CB 4.08Å; F84-D88 HydrophobicContact CD1-CB 3.7Å; F84-D88 HydrophobicContact CG-CB 4.28Å; T85-D88 WeakPolarHBondContact CB-OD2 3.03Å; T85-D88 PolarHBondContact N-OD2 3.29Å; T85-D88 WeakPolarHBondContact O-CB 3.26Å; T85-D88 PolarHBondContact O-N 3.18Å; T85-D88 PolarHBondContact OG1-N 3.3Å; T85-D88 PolarHBondContact OG1-OD2 3.23Å; D88-E91 PolarHBondContact O-N 2.93Å; D88-L92 VanDerWaalsContact O-CG 3.32Å; D88-L92 WeakPolarHBondContact O-CG 3.4Å; D88-L92 PolarHBondContact O-N 3.12Å; D88-L389 HydrophobicContact CB-CD2 3.88Å; D88-L389 WeakPolarHBondContact OD1-CD2 3.48Å
89	L	66.4	Low	63.7	Low	20 Å²	20	77 Å²	77	11%	0.105	42%	0.416	C	S	.	.	H	α-helix	trans	-62.7	-44.7	177.7	-63	175.5	0	0	0	112.3	Y67 V69 F84 T85 E86 K87 E91 L92 Y93	Y67-L89 HydrophobicContact CG-CD1 4.34Å; V69-L89 HydrophobicContact CG2-CD1 3.57Å; V69-L89 HydrophobicContact CG2-CD2 3.54Å; V69-L89 HydrophobicContact CG2-CG 4.06Å; F84-L89 HydrophobicContact CB-CD2 3.99Å; F84-L89 HydrophobicContact CB-CG 4.21Å; F84-L89 HydrophobicContact CD2-CD2 4.29Å; F84-L89 HydrophobicContact CG-CD2 4.35Å; T85-L89 WeakPolarHBondContact O-CG 3.46Å; T85-L89 PolarHBondContact O-N 3.47Å; T85-L89 VanDerWaalsContact O-N 3.11Å; E86-L89 WeakPolarHBondContact O-CB 3.39Å; E86-L89 PolarHBondContact O-N 2.88Å; K87-L89 VanDerWaalsContact C-N 3.27Å; K87-L89 PolarHBondContact O-N 3.05Å; L89-E91 VanDerWaalsContact C-N 3.3Å; L89-E91 PolarHBondContact O-N 3.39Å; L89-L92 HydrophobicContact CD2-CD1 4.14Å; L89-L92 WeakPolarHBondContact O-CB 3.47Å; L89-L92 PolarHBondContact O-N 3.33Å; L89-Y93 VanDerWaalsContact O-CD2 3.25Å; L89-Y93 WeakPolarHBondContact O-CD2 3.46Å; L89-Y93 PolarHBondContact O-N 3.1Å
90	E	67.6	Low	64.1	Low	95 Å²	95	73.6 Å²	73.6	44%	0.444	41%	0.409	S	S	.	.	H	α-helix	trans	-58.8	-40.5	173.8	-73.8	-178.2	-174.5	0	0	112.5	E86 K87 Y93 K94	E86-E90 WeakPolarHBondContact O-CG 3.33Å; E86-E90 PolarHBondContact O-N 2.93Å; K87-E90 PolarHBondContact O-N 2.86Å; E90-Y93 PolarHBondContact O-N 2.93Å; E90-K94 WeakPolarHBondContact O-CG 3.45Å; E90-K94 PolarHBondContact O-N 2.04Å; E90-K94 VanDerWaalsContact O-N 3.11Å
91	E	68.8	Low	65.1	Low	44 Å²	44	75.5 Å²	75.5	21%	0.206	43%	0.431	C	S	.	.	H	α-helix	trans	-65.8	-37.2	176.9	-74.7	-176.4	-172.9	0	0	112.3	K87 D88 L89 K94	K87-E91 VanDerWaalsContact CE-OE1 3.26Å; K87-E91 WeakPolarHBondContact CE-OE1 3.36Å; K87-E91 WeakPolarHBondContact O-CG 3.38Å; K87-E91 PolarHBondContact O-N 3.19Å; D88-E91 PolarHBondContact O-N 2.93Å; L89-E91 VanDerWaalsContact C-N 3.3Å; L89-E91 PolarHBondContact O-N 3.39Å; E91-K94 PolarHBondContact O-N 3.09Å
92	L	67.1	Low	66.4	Low	13 Å²	13	79.4 Å²	79.4	7%	0.068	44%	0.438	C	S	.	.	H	α-helix	trans	-61.5	-43	172.2	-64.9	174.7	0	0	0	111.2	F84 D88 L89 K94 V95 L381 T385	F84-L92 HydrophobicContact CE2-CD1 4.4Å; F84-L92 HydrophobicContact CZ-CD1 4.36Å; D88-L92 VanDerWaalsContact O-CG 3.32Å; D88-L92 WeakPolarHBondContact O-CG 3.4Å; D88-L92 PolarHBondContact O-N 3.12Å; L89-L92 HydrophobicContact CD2-CD1 4.14Å; L89-L92 WeakPolarHBondContact O-CB 3.47Å; L89-L92 PolarHBondContact O-N 3.33Å; L92-K94 PolarHBondContact O-N 3.37Å; L92-V95 PolarHBondContact O-N 3.48Å; L92-L381 HydrophobicContact CD1-CD2 4.27Å; L92-L381 HydrophobicContact CD2-CD1 4.06Å; L92-L381 HydrophobicContact CD2-CD2 4.22Å; L92-L381 HydrophobicContact CD2-CG 4Å; L92-T385 VanDerWaalsContact CD2-CB 3.42Å; L92-T385 HydrophobicContact CD2-CG2 3.34Å; L92-T385 WeakPolarHBondContact CD2-OG1 3.43Å
93	Y	62.9	Low	67.7	Low	109 Å²	109	79.7 Å²	79.7	43%	0.427	44%	0.438	S	S	.	.	H	α-helix	trans	-64.8	-35	178.2	-86.8	-69.8	0	0	0	113.5	V69 L89 E90 V95 K96 F123	V69-Y93 HydrophobicContact CG1-CE2 3.61Å; V69-Y93 WeakPolarHBondContact CG1-OH 3.37Å; L89-Y93 VanDerWaalsContact O-CD2 3.25Å; L89-Y93 WeakPolarHBondContact O-CD2 3.46Å; L89-Y93 PolarHBondContact O-N 3.1Å; E90-Y93 PolarHBondContact O-N 2.93Å; Y93-V95 PolarHBondContact O-N 2.92Å; Y93-K96 PolarHBondContact O-N 3.35Å; Y93-F123 HydrophobicContact CD1-CZ 4.48Å
94	K	66.5	Low	69.3	Low	130 Å²	130	77.8 Å²	77.8	57%	0.565	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-67.2	-14.8	179.6	-73.7	170.2	-173.5	164.3	0	114	E90 E91 L92 K96 S97	E90-K94 WeakPolarHBondContact O-CG 3.45Å; E90-K94 PolarHBondContact O-N 2.04Å; E90-K94 VanDerWaalsContact O-N 3.11Å; E91-K94 PolarHBondContact O-N 3.09Å; L92-K94 PolarHBondContact O-N 3.37Å; K94-K96 PolarHBondContact O-N 3.22Å; K94-S97 PolarHBondContact O-OG 2.87Å
95	V	63	Low	70.7	Confident	24 Å²	24	75.6 Å²	75.6	15%	0.145	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-64.5	-20.5	178.9	175.6	0	0	0	0	113	L92 Y93 S97 H384 T385	L92-V95 PolarHBondContact O-N 3.48Å; Y93-V95 PolarHBondContact O-N 2.92Å; V95-S97 PolarHBondContact O-N 2.92Å; V95-S97 VanDerWaalsContact O-N 3.07Å; V95-H384 HydrophobicContact CG1-CB 4.42Å; V95-T385 HydrophobicContact CG2-CG2 3.58Å
96	K	57	Low	72.1	Confident	167 Å²	167	72 Å²	72	73%	0.726	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-58.8	-22.3	-179.3	-167.7	175.3	179.1	179.9	0	114.8	Y93 K94 F123	Y93-K96 PolarHBondContact O-N 3.35Å; K94-K96 PolarHBondContact O-N 3.22Å; K96-F123 HydrophobicContact CB-CZ 4.17Å; K96-F123 HydrophobicContact CD-CE2 4.4Å; K96-F123 HydrophobicContact CD-CZ 4.47Å
97	S	51.1	Low	73.5	Confident	109 Å²	109	67.6 Å²	67.6	76%	0.762	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-102.9	1.3	-166.1	58.5	0	0	0	0	116.5	K94 V95	K94-S97 PolarHBondContact O-OG 2.87Å; V95-S97 PolarHBondContact O-N 2.92Å; V95-S97 VanDerWaalsContact O-N 3.07Å
98	A	54.2	Low	74.7	Confident	65 Å²	65	62.7 Å²	62.7	54%	0.537	34%	0.337	S	S	.	.	S	Bend	trans	-122	140	179.5	0	0	0	0	0	111.6	A100	A98-A100 VanDerWaalsContact C-N 3.32Å; A98-A100 PolarHBondContact O-N 3.49Å
99	P	57.1	Low	75.8	Confident	138 Å²	138	61.7 Å²	61.7	90%	0.896	33%	0.334	S	S	*	.			trans	-62.4	98.3	163.4	25.5	-29.4	0	0	0	108
100	A	68.3	Low	77	Confident	46 Å²	46	65.1 Å²	65.1	38%	0.38	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-81.7	142.2	172.4	0	0	0	0	0	108.8	A98	A98-A100 VanDerWaalsContact C-N 3.32Å; A98-A100 PolarHBondContact O-N 3.49Å
101	A	82.9	Confident	78	Confident	77 Å²	77	62.4 Å²	62.4	64%	0.636	34%	0.341	S	S	*	.	P	Polyproline II helix	trans	-62.8	139.3	172.2	0	0	0	0	0	110	K103 H384	A101-K103 PolarHBondContact O-N 3.38Å; A101-H384 PolarHBondContact O-CE1 2.96Å; A101-H384 VanDerWaalsContact O-CE1 3.32Å
102	R	91.4	Very high	78.6	Confident	144 Å²	144	65.2 Å²	65.2	54%	0.543	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-48.5	135	173.7	178.2	170.3	-69.8	-178.6	2.1	111.3	D126 E128	R102-D126 WeakPolarHBondContact CA-O 3.34Å; R102-D126 VanDerWaalsContact CA-OD2 3.3Å; R102-D126 WeakPolarHBondContact CA-OD2 3.47Å; R102-D126 WeakPolarHBondContact CB-OD2 3.47Å; R102-D126 IonicContact CZ-OD1 3.66Å; R102-D126 PolarHBondContact N-OD2 3.16Å; R102-D126 IonicContact NE-OD1 2.62Å; R102-D126 PolarHBondContact NE-OD1 3Å; R102-D126 IonicContact NH2-OD1 3.86Å; R102-D126 PolarHBondContact NH2-OD1 3.09Å; R102-E128 HydrophobicContact CG-CB 4.46Å; R102-E128 IonicContact NH1-OE2 2.84Å
103	K	93.9	Very high	79.2	Confident	41 Å²	41	64.8 Å²	64.8	18%	0.178	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.7	177.6	-65.2	-70.8	170.2	-178.1	0	111.9	A101 D126 C127 E128 D140 A383 H384	A101-K103 PolarHBondContact O-N 3.38Å; K103-D126 PolarHBondContact N-O 3.06Å; K103-C127 CarbonylContact O-C 3.56Å; K103-C127 VanDerWaalsContact O-CA 3.26Å; K103-C127 WeakPolarHBondContact O-CA 3.4Å; K103-E128 PolarHBondContact O-N 2.96Å; K103-D140 WeakPolarHBondContact CA-OD2 3.37Å; K103-D140 HydrophobicContact CB-CB 4.47Å; K103-D140 HydrophobicContact CD-CB 3.83Å; K103-D140 WeakPolarHBondContact CD-OD1 3.27Å; K103-D140 WeakPolarHBondContact CD-OD2 3.25Å; K103-D140 IonicContact NZ-OD1 2.77Å; K103-D140 PolarHBondContact NZ-OD1 2.95Å; K103-A383 HydrophobicContact CB-CB 3.95Å; K103-A383 HydrophobicContact CD-CB 4.33Å; K103-A383 WeakPolarHBondContact CE-O 3.18Å; K103-A383 HydrophobicContact CG-CB 3.97Å; K103-H384 WeakPolarHBondContact CG-CE1 3.43Å; K103-H384 WeakPolarHBondContact CG-NE2 3.25Å
104	I	95.8	Very high	79.7	Confident	30 Å²	30	60.8 Å²	60.8	15%	0.154	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	119.9	177.8	-60.9	176.1	0	0	0	108.9	I130 A139 D140 V141	I104-I130 HydrophobicContact CG2-CD1 3.42Å; I104-I130 VanDerWaalsContact CG2-CD1 3.42Å; I104-I130 HydrophobicContact CG2-CG1 3.69Å; I104-I130 HydrophobicContact CG2-CG2 4.44Å; I104-A139 HydrophobicContact CG2-CB 4.08Å; I104-D140 PolarHBondContact N-OD2 3.46Å; I104-D140 PolarHBondContact O-N 2.98Å; I104-V141 PolarHBondContact O-N 3.42Å
105	I	96.1	Very high	80	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.4	173.6	-59.4	167.4	0	0	0	107	F119 C127 E128 L129 I130 V141 I143 I379	I105-F119 HydrophobicContact CD1-CE1 3.52Å; I105-F119 HydrophobicContact CD1-CE2 4.29Å; I105-F119 HydrophobicContact CD1-CZ 3.38Å; I105-C127 HydrophobicContact CD1-CB 3.73Å; I105-C127 HydrophobicContact CG1-CB 4.47Å; I105-E128 PolarHBondContact N-O 2.99Å; I105-L129 HydrophobicContact CB-CD1 4.25Å; I105-L129 HydrophobicContact CG2-CD1 3.82Å; I105-L129 CarbonylContact O-C 3.46Å; I105-L129 WeakPolarHBondContact O-CA 3.35Å; I105-L129 WeakPolarHBondContact O-CD1 3.47Å; I105-I130 WeakPolarHBondContact O-CG1 3.32Å; I105-I130 PolarHBondContact O-N 3.45Å; I105-V141 CarbonylContact C-O 3.58Å; I105-V141 HydrophobicContact CB-CB 4.35Å; I105-V141 HydrophobicContact CG1-CB 4.03Å; I105-V141 HydrophobicContact CG1-CG2 4.24Å; I105-V141 HydrophobicContact CG2-CB 4.21Å; I105-V141 HydrophobicContact CG2-CG1 4.22Å; I105-I143 HydrophobicContact CG2-CD1 3.48Å; I105-I143 VanDerWaalsContact CG2-CD1 3.48Å; I105-I143 HydrophobicContact CG2-CG1 3.91Å; I105-I379 HydrophobicContact CD1-CG2 3.76Å; I105-I379 HydrophobicContact CG1-CG2 4.26Å; I105-I379 HydrophobicContact CG2-CG2 4.32Å
106	L	97	Very high	80.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.6	-179.9	173.5	60.3	0	0	0	110.3	Y108 I130 D132 W136 A139 V141 I142 I143	L106-Y108 HydrophobicContact CD2-CD2 3.87Å; L106-Y108 HydrophobicContact CG-CD2 4.35Å; L106-Y108 PolarHBondContact O-N 2.99Å; L106-I130 HydrophobicContact CB-CD1 4.31Å; L106-I130 HydrophobicContact CB-CG1 3.99Å; L106-I130 HydrophobicContact CD1-CD1 4.07Å; L106-I130 HydrophobicContact CD1-CG1 3.8Å; L106-I130 HydrophobicContact CG-CG1 4.46Å; L106-D132 WeakPolarHBondContact CD1-O 3.46Å; L106-W136 HydrophobicContact CD2-CB 3.5Å; L106-W136 VanDerWaalsContact CD2-CB 3.5Å; L106-A139 HydrophobicContact CB-CB 3.76Å; L106-A139 HydrophobicContact CD2-CB 4.33Å; L106-V141 PolarHBondContact N-O 2.99Å; L106-I142 HydrophobicContact CB-CD1 4.07Å; L106-I142 HydrophobicContact CD2-CD1 3.82Å; L106-I142 HydrophobicContact CG-CD1 4.36Å; L106-I143 PolarHBondContact O-N 2.94Å
107	N	96.5	Very high	81.7	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.016	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	119.4	161.9	-177.8	-50.4	0	0	0	108.5	L111 I113 L129 I130 F131	N107-L111 PolarHBondContact ND2-O 2.94Å; N107-L111 PolarHBondContact OD1-O 3.38Å; N107-I113 WeakPolarHBondContact ND2-CG1 3.28Å; N107-I113 PolarHBondContact ND2-N 3Å; N107-I113 VanDerWaalsContact ND2-N 3.14Å; N107-L129 HydrophobicContact CB-CD1 4.22Å; N107-I130 PolarHBondContact N-O 3.23Å; N107-F131 HydrophobicContact CB-CD1 3.7Å; N107-F131 HydrophobicContact CB-CE1 3.85Å
108	Y	95.9	Very high	83.2	Confident	30 Å²	30	50.3 Å²	50.3	12%	0.118	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	90.9	-176.4	-160.2	-73.9	0	0	0	110.3	L106 R133 W136 I142 I143 L144 T145 L148 Y149 P150	L106-Y108 HydrophobicContact CD2-CD2 3.87Å; L106-Y108 HydrophobicContact CG-CD2 4.35Å; L106-Y108 PolarHBondContact O-N 2.99Å; Y108-R133 HydrophobicContact CD2-CB 4.12Å; Y108-R133 HydrophobicContact CD2-CG 4.04Å; Y108-R133 HydrophobicContact CE2-CB 3.79Å; Y108-R133 HydrophobicContact CE2-CG 4.13Å; Y108-R133 HydrophobicContact CG-CG 4.41Å; Y108-W136 HydrophobicContact CD2-CB 4.2Å; Y108-W136 HydrophobicContact CE2-CB 3.94Å; Y108-W136 HydrophobicContact CE2-CG 4.31Å; Y108-I142 HydrophobicContact CD2-CG2 4.35Å; Y108-I142 HydrophobicContact CG-CG2 4.06Å; Y108-I143 PolarHBondContact N-O 3.06Å; Y108-L144 HydrophobicContact CD1-CD2 4.03Å; Y108-L144 HydrophobicContact CG-CD2 4.29Å; Y108-L144 WeakPolarHBondContact O-CA 3.34Å; Y108-T145 PolarHBondContact O-N 3.08Å; Y108-L148 HydrophobicContact CD1-CB 4.44Å; Y108-L148 HydrophobicContact CE1-CB 4.2Å; Y108-Y149 VanDerWaalsContact CE1-C 3.41Å; Y108-P150 HydrophobicContact CD2-CG 3.98Å; Y108-P150 HydrophobicContact CE1-CG 4.25Å; Y108-P150 HydrophobicContact CE2-CB 4.45Å; Y108-P150 HydrophobicContact CE2-CG 3.6Å; Y108-P150 HydrophobicContact CG-CG 4.46Å; Y108-P150 WeakPolarHBondContact OH-CA 3.36Å
109	G	93.5	Very high	84.7	Confident	10 Å²	10	47.6 Å²	47.6	10%	0.103	25%	0.249	C	C	.	.	S	Bend	trans	162.5	-178	175.8	0	0	0	0	0	109.7	T145	G109-T145 WeakPolarHBondContact CA-OG1 3.32Å
110	D	91.4	Very high	85.9	Confident	93 Å²	93	45.4 Å²	45.4	50%	0.497	24%	0.237	S	C	.	.	S	Bend	trans	-88.4	-12.3	179	-59	-25.9	0	0	0	111.7	R133 D146	D110-R133 IonicContact OD1-CZ 2.78Å; D110-R133 IonicContact OD1-NH1 3.32Å; D110-R133 PolarHBondContact OD1-NH1 3.36Å; D110-R133 IonicContact OD1-NH2 3.82Å; D110-D146 WeakPolarHBondContact CB-OD2 3.45Å; D110-D146 PolarHBondContact N-OD2 3.17Å
111	L	87.2	Confident	86.4	Confident	37 Å²	37	46.1 Å²	46.1	19%	0.194	23%	0.231	C	C	.	.	S	Bend	trans	-90.7	114.7	175.5	-64.6	-178.2	0	0	0	111.2	I39 R41 N107 T145	I39-L111 HydrophobicContact CG2-CB 4.17Å; I39-L111 HydrophobicContact CG2-CD1 4.37Å; I39-L111 HydrophobicContact CG2-CD2 4.05Å; I39-L111 HydrophobicContact CG2-CG 4.43Å; R41-L111 HydrophobicContact CG-CD2 3.86Å; N107-L111 PolarHBondContact ND2-O 2.94Å; N107-L111 PolarHBondContact OD1-O 3.38Å; L111-T145 WeakPolarHBondContact O-CB 3.29Å; L111-T145 WeakPolarHBondContact O-CG2 3.47Å; L111-T145 PolarHBondContact O-OG1 3.47Å
112	Y	82.8	Confident	86.2	Confident	103 Å²	103	42.8 Å²	42.8	40%	0.404	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.3	177	-70.8	-97.8	0	0	0	110.8	N114 F131	Y112-N114 PolarHBondContact O-N 3.37Å; Y112-F131 AromaticContact CD1-CD1 3.53Å; Y112-F131 HydrophobicContact CD1-CD1 3.53Å; Y112-F131 AromaticContact CD1-CE1 3.53Å; Y112-F131 HydrophobicContact CD1-CE1 3.53Å; Y112-F131 HydrophobicContact CD1-CG 4.43Å; Y112-F131 HydrophobicContact CD1-CZ 4.41Å; Y112-F131 HydrophobicContact CE1-CB 4.48Å; Y112-F131 AromaticContact CE1-CD1 3.61Å; Y112-F131 HydrophobicContact CE1-CD1 3.61Å; Y112-F131 HydrophobicContact CE1-CE1 4.08Å; Y112-F131 HydrophobicContact CE1-CG 4.16Å
113	I	79.6	Confident	85.3	Confident	4 Å²	4	40 Å²	40	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	107	174.1	-55	161.3	0	0	0	108.1	N107 I115 I116 I143 T145 F163	N107-I113 WeakPolarHBondContact ND2-CG1 3.28Å; N107-I113 PolarHBondContact ND2-N 3Å; N107-I113 VanDerWaalsContact ND2-N 3.14Å; I113-I115 HydrophobicContact CG2-CD1 4.49Å; I113-I115 HydrophobicContact CG2-CG1 3.58Å; I113-I116 HydrophobicContact CB-CD1 4.47Å; I113-I116 HydrophobicContact CD1-CD1 4.05Å; I113-I116 HydrophobicContact CG2-CB 4.03Å; I113-I116 HydrophobicContact CG2-CD1 3.72Å; I113-I116 HydrophobicContact CG2-CG1 3.71Å; I113-I143 HydrophobicContact CD1-CB 4.21Å; I113-I143 HydrophobicContact CD1-CD1 4.4Å; I113-I143 HydrophobicContact CD1-CG2 3.46Å; I113-I143 VanDerWaalsContact CD1-CG2 3.46Å; I113-T145 HydrophobicContact CD1-CG2 3.44Å; I113-T145 VanDerWaalsContact CD1-CG2 3.44Å; I113-T145 HydrophobicContact CG1-CG2 3.62Å; I113-F163 HydrophobicContact CD1-CB 3.92Å; I113-F163 HydrophobicContact CD1-CD1 3.98Å; I113-F163 HydrophobicContact CD1-CD2 4.09Å; I113-F163 HydrophobicContact CD1-CG 3.72Å; I113-F163 HydrophobicContact CG1-CD1 3.79Å; I113-F163 HydrophobicContact CG1-CE1 4.06Å; I113-F163 HydrophobicContact CG1-CG 4.05Å; I113-F163 HydrophobicContact CG2-CD2 4.44Å; I113-F163 HydrophobicContact CG2-CE1 4.17Å; I113-F163 HydrophobicContact CG2-CE2 4.02Å; I113-F163 HydrophobicContact CG2-CZ 3.89Å
114	N	72.3	Confident	84.1	Confident	26 Å²	26	38.6 Å²	38.6	14%	0.139	19%	0.191	C	C	.	.	S	Bend	trans	-82	-22.9	-179.8	-66.2	-37.2	0	0	0	113.7	G38 Y112 I116 R117	G38-N114 WeakPolarHBondContact O-CB 3.2Å; G38-N114 PolarHBondContact O-ND2 3.31Å; Y112-N114 PolarHBondContact O-N 3.37Å; N114-I116 VanDerWaalsContact C-N 3.28Å; N114-I116 PolarHBondContact O-N 3.21Å; N114-R117 WeakPolarHBondContact O-CD 3.4Å; N114-R117 WeakPolarHBondContact O-CG 3.47Å; N114-R117 PolarHBondContact OD1-NE 2.92Å; N114-R117 PolarHBondContact OD1-NH2 2.82Å
115	I	73.8	Confident	83.2	Confident	25 Å²	25	40.4 Å²	40.4	13%	0.128	21%	0.206	C	C	.	.	S	Bend	trans	-78.2	-14.8	-176.3	65.4	172	0	0	0	113.3	F37 I113 F163 L195 P375 Q376	F37-I115 HydrophobicContact CB-CG2 4.27Å; F37-I115 HydrophobicContact CD1-CB 4.49Å; F37-I115 HydrophobicContact CD1-CD1 4.28Å; F37-I115 HydrophobicContact CD1-CG2 3.6Å; F37-I115 HydrophobicContact CE1-CD1 4.27Å; F37-I115 HydrophobicContact CE1-CG2 4.15Å; F37-I115 HydrophobicContact CG-CG2 4.18Å; I113-I115 HydrophobicContact CG2-CD1 4.49Å; I113-I115 HydrophobicContact CG2-CG1 3.58Å; I115-F163 HydrophobicContact CD1-CE2 3.79Å; I115-F163 HydrophobicContact CD1-CZ 3.65Å; I115-F163 HydrophobicContact CG1-CE2 4.36Å; I115-F163 HydrophobicContact CG1-CZ 4.21Å; I115-L195 HydrophobicContact CD1-CD1 4.43Å; I115-L195 HydrophobicContact CD1-CD2 3.66Å; I115-P375 HydrophobicContact CD1-CG 3.69Å; I115-P375 HydrophobicContact CG1-CG 4.22Å; I115-Q376 PolarHBondContact O-NE2 3.3Å; I115-Q376 PolarHBondContact O-OE1 3.11Å
116	I	78	Confident	82.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	-106.9	93.7	174.5	-57	170.9	0	0	0	105.6	I113 N114 F119 L129 I143 F163 P375 Q376 I379	I113-I116 HydrophobicContact CB-CD1 4.47Å; I113-I116 HydrophobicContact CD1-CD1 4.05Å; I113-I116 HydrophobicContact CG2-CB 4.03Å; I113-I116 HydrophobicContact CG2-CD1 3.72Å; I113-I116 HydrophobicContact CG2-CG1 3.71Å; N114-I116 VanDerWaalsContact C-N 3.28Å; N114-I116 PolarHBondContact O-N 3.21Å; I116-F119 HydrophobicContact CG2-CE1 4.15Å; I116-F119 HydrophobicContact CG2-CE2 4.45Å; I116-F119 HydrophobicContact CG2-CZ 3.58Å; I116-L129 HydrophobicContact CG2-CD2 4.27Å; I116-L129 WeakPolarHBondContact O-CD2 2.9Å; I116-I143 HydrophobicContact CD1-CD1 3.7Å; I116-F163 HydrophobicContact CD1-CD2 4.41Å; I116-P375 HydrophobicContact CG1-CG 4.26Å; I116-Q376 HydrophobicContact CB-CB 4.19Å; I116-Q376 HydrophobicContact CG1-CB 4.18Å; I116-Q376 HydrophobicContact CG2-CB 3.82Å; I116-I379 HydrophobicContact CD1-CD1 3.37Å; I116-I379 HydrophobicContact CG1-CD1 4.2Å
117	R	77.4	Confident	82.5	Confident	129 Å²	129	43.7 Å²	43.7	49%	0.487	22%	0.224	S	C	.	.			trans	-143.1	-38.8	176.6	-74.7	-175.7	176.7	-138.4	2.8	112	N114	N114-R117 WeakPolarHBondContact O-CD 3.4Å; N114-R117 WeakPolarHBondContact O-CG 3.47Å; N114-R117 PolarHBondContact OD1-NE 2.92Å; N114-R117 PolarHBondContact OD1-NH2 2.82Å
118	N	82.1	Confident	82.4	Confident	55 Å²	55	47 Å²	47	29%	0.294	24%	0.239	S	C	.	.			trans	-112.3	118.7	-175.7	-172.1	3.1	0	0	0	110.8	S120 F121	N118-S120 VanDerWaalsContact OD1-CB 3.28Å; N118-S120 WeakPolarHBondContact OD1-CB 3.38Å; N118-S120 PolarHBondContact OD1-N 2.75Å; N118-S120 PolarHBondContact OD1-OG 2.93Å; N118-F121 HydrophobicContact CB-CD1 4.42Å; N118-F121 HydrophobicContact CB-CE1 3.79Å; N118-F121 WeakPolarHBondContact O-CE1 3.24Å; N118-F121 WeakPolarHBondContact O-CZ 3.33Å
119	F	85.8	Confident	82.3	Confident	9 Å²	9	46.8 Å²	46.8	4%	0.039	24%	0.24	C	C	.	.			trans	-103.9	-3.3	176.1	-58.7	-86.3	0	0	0	112.3	I105 I116 F121 C122 C125 C127 L129 Q376 C380	I105-F119 HydrophobicContact CD1-CE1 3.52Å; I105-F119 HydrophobicContact CD1-CE2 4.29Å; I105-F119 HydrophobicContact CD1-CZ 3.38Å; I116-F119 HydrophobicContact CG2-CE1 4.15Å; I116-F119 HydrophobicContact CG2-CE2 4.45Å; I116-F119 HydrophobicContact CG2-CZ 3.58Å; F119-F121 PolarHBondContact O-N 2.74Å; F119-F121 VanDerWaalsContact O-N 3.09Å; F119-C122 VanDerWaalsContact O-CB 3.32Å; F119-C122 WeakPolarHBondContact O-CB 3.26Å; F119-C122 PolarHBondContact O-N 2.83Å; F119-C125 WeakPolarHBondContact O-CA 3.49Å; F119-C125 WeakPolarHBondContact O-CB 3.49Å; F119-C127 HydrophobicContact CB-CB 4.5Å; F119-C127 HydrophobicContact CD1-CB 3.95Å; F119-C127 HydrophobicContact CD2-CB 4.09Å; F119-C127 WeakPolarHBondContact CD2-O 2.88Å; F119-C127 HydrophobicContact CE1-CB 4.14Å; F119-C127 HydrophobicContact CE2-CB 4.3Å; F119-C127 HydrophobicContact CG-CB 3.92Å; F119-C127 HydrophobicContact CZ-CB 4.33Å; F119-L129 HydrophobicContact CE2-CB 4.1Å; F119-Q376 HydrophobicContact CD1-CB 3.99Å; F119-Q376 WeakPolarHBondContact CD1-O 3.46Å; F119-Q376 HydrophobicContact CE1-CB 3.64Å; F119-Q376 VanDerWaalsContact CE1-O 3.3Å; F119-Q376 WeakPolarHBondContact CE1-O 3.43Å; F119-Q376 HydrophobicContact CZ-CB 4.29Å; F119-C380 HydrophobicContact CD1-CB 3.66Å; F119-C380 HydrophobicContact CE1-CB 3.97Å
120	S	82.4	Confident	82.4	Confident	92 Å²	92	46.7 Å²	46.7	64%	0.643	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.4	-169.7	74.8	0	0	0	0	113.7	N118	N118-S120 VanDerWaalsContact OD1-CB 3.28Å; N118-S120 WeakPolarHBondContact OD1-CB 3.38Å; N118-S120 PolarHBondContact OD1-N 2.75Å; N118-S120 PolarHBondContact OD1-OG 2.93Å
121	F	78	Confident	82.5	Confident	60 Å²	60	45.9 Å²	45.9	26%	0.263	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-8.6	177.9	53.9	-100.5	0	0	0	113.5	Y76 N118 F119 M374 Q376	Y76-F121 HydrophobicContact CE1-CD2 4.04Å; Y76-F121 PolarHBondContact OH-O 3.26Å; N118-F121 HydrophobicContact CB-CD1 4.42Å; N118-F121 HydrophobicContact CB-CE1 3.79Å; N118-F121 WeakPolarHBondContact O-CE1 3.24Å; N118-F121 WeakPolarHBondContact O-CZ 3.33Å; F119-F121 PolarHBondContact O-N 2.74Å; F119-F121 VanDerWaalsContact O-N 3.09Å; F121-M374 HydrophobicContact CD2-SD 3.97Å; F121-M374 HydrophobicContact CE2-CG 4.34Å; F121-M374 HydrophobicContact CE2-SD 3.47Å; F121-M374 WeakPolarHBondContact CE2-SD 3.01Å; F121-M374 HydrophobicContact CZ-SD 4.39Å; F121-Q376 HydrophobicContact CE2-CG 4.4Å; F121-Q376 HydrophobicContact CZ-CG 4.32Å
122	C	80	Confident	82.9	Confident	8 Å²	8	48 Å²	48	5%	0.054	24%	0.241	C	C	.	.	S	Bend	trans	-76.4	151.6	-177.2	-60.7	0	0	0	0	112	F119 A124 C125 C377	F119-C122 VanDerWaalsContact O-CB 3.32Å; F119-C122 WeakPolarHBondContact O-CB 3.26Å; F119-C122 PolarHBondContact O-N 2.83Å; C122-A124 VanDerWaalsContact C-N 3.3Å; C122-A124 WeakPolarHBondContact CB-O 3.38Å; C122-A124 PolarHBondContact O-N 3.24Å; C122-C125 WeakPolarHBondContact O-CB 3.26Å; C122-C377 WeakPolarHBondContact CA-SG 3.41Å; C122-C377 HydrophobicContact CB-CB 3.61Å; C122-C377 WeakPolarHBondContact CB-SG 3.47Å; C122-C377 WeakPolarHBondContact SG-CA 3.49Å; C122-C377 WeakPolarHBondContact SG-CB 3.31Å; C122-C377 CovalentContact SG-SG 2.05Å; C122-C377 PolarHBondContact SG-SG 2.92Å
123	F	71	Confident	83.6	Confident	86 Å²	86	47.5 Å²	47.5	38%	0.377	24%	0.238	S	C	.	.	S	Bend	trans	-58.2	-42.9	175.2	178.6	-95.7	0	0	0	112.3	Y93 K96 L381	Y93-F123 HydrophobicContact CD1-CZ 4.48Å; K96-F123 HydrophobicContact CB-CZ 4.17Å; K96-F123 HydrophobicContact CD-CE2 4.4Å; K96-F123 HydrophobicContact CD-CZ 4.47Å; F123-L381 HydrophobicContact CD1-CD1 4.42Å
124	A	70.3	Confident	84.4	Confident	10 Å²	10	51.4 Å²	51.4	8%	0.083	27%	0.266	C	S	.	.	S	Bend	trans	-99.9	115.4	161.4	0	0	0	0	0	107.4	C122 C380 L381	C122-A124 VanDerWaalsContact C-N 3.3Å; C122-A124 WeakPolarHBondContact CB-O 3.38Å; C122-A124 PolarHBondContact O-N 3.24Å; A124-C380 PolarHBondContact O-SG 2.99Å; A124-L381 HydrophobicContact CB-CB 4.48Å; A124-L381 HydrophobicContact CB-CD1 4.34Å
125	C	75.7	Confident	85.5	Confident	68 Å²	68	54.2 Å²	54.2	46%	0.459	28%	0.275	S	S	.	.			trans	-118.5	-13.8	-170.8	60.2	0	0	0	0	115.2	F119 C122 C127	F119-C125 WeakPolarHBondContact O-CA 3.49Å; F119-C125 WeakPolarHBondContact O-CB 3.49Å; C122-C125 WeakPolarHBondContact O-CB 3.26Å; C125-C127 PolarHBondContact O-N 3.27Å
126	D	88	Confident	86.7	Confident	57 Å²	57	54.5 Å²	54.5	31%	0.305	28%	0.275	S	S	.	.			trans	-83.8	67.3	179.7	-161.5	23.9	0	0	0	111.1	R102 K103 H384	R102-D126 WeakPolarHBondContact CA-O 3.34Å; R102-D126 VanDerWaalsContact CA-OD2 3.3Å; R102-D126 WeakPolarHBondContact CA-OD2 3.47Å; R102-D126 WeakPolarHBondContact CB-OD2 3.47Å; R102-D126 IonicContact CZ-OD1 3.66Å; R102-D126 PolarHBondContact N-OD2 3.16Å; R102-D126 IonicContact NE-OD1 2.62Å; R102-D126 PolarHBondContact NE-OD1 3Å; R102-D126 IonicContact NH2-OD1 3.86Å; R102-D126 PolarHBondContact NH2-OD1 3.09Å; K103-D126 PolarHBondContact N-O 3.06Å; D126-H384 PolarHBondContact O-NE2 3.24Å; D126-H384 VanDerWaalsContact O-NE2 3.09Å
127	C	91.7	Very high	87.6	Confident	13 Å²	13	59.6 Å²	59.6	9%	0.088	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147	171.6	-66.2	0	0	0	0	110.3	K103 I105 F119 C125 C380	K103-C127 CarbonylContact O-C 3.56Å; K103-C127 VanDerWaalsContact O-CA 3.26Å; K103-C127 WeakPolarHBondContact O-CA 3.4Å; I105-C127 HydrophobicContact CD1-CB 3.73Å; I105-C127 HydrophobicContact CG1-CB 4.47Å; F119-C127 HydrophobicContact CB-CB 4.5Å; F119-C127 HydrophobicContact CD1-CB 3.95Å; F119-C127 HydrophobicContact CD2-CB 4.09Å; F119-C127 WeakPolarHBondContact CD2-O 2.88Å; F119-C127 HydrophobicContact CE1-CB 4.14Å; F119-C127 HydrophobicContact CE2-CB 4.3Å; F119-C127 HydrophobicContact CG-CB 3.92Å; F119-C127 HydrophobicContact CZ-CB 4.33Å; C125-C127 PolarHBondContact O-N 3.27Å; C127-C380 HydrophobicContact CB-CB 3.86Å; C127-C380 WeakPolarHBondContact CB-SG 3.36Å; C127-C380 WeakPolarHBondContact SG-CA 3.44Å; C127-C380 WeakPolarHBondContact SG-CB 3.24Å; C127-C380 CovalentContact SG-SG 2.03Å; C127-C380 PolarHBondContact SG-SG 2.89Å
128	E	92.9	Very high	88.5	Confident	71 Å²	71	58.1 Å²	58.1	33%	0.332	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.2	176.6	-179.9	-178.6	156.4	0	0	109.4	R102 K103 I105 I130	R102-E128 HydrophobicContact CG-CB 4.46Å; R102-E128 IonicContact NH1-OE2 2.84Å; K103-E128 PolarHBondContact O-N 2.96Å; I105-E128 PolarHBondContact N-O 2.99Å; E128-I130 HydrophobicContact CG-CG2 4.09Å; E128-I130 WeakPolarHBondContact OE1-CG2 3.38Å
129	L	94.1	Very high	89.2	Confident	26 Å²	26	55.7 Å²	55.7	14%	0.136	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	125.9	170	-179.3	66.5	0	0	0	110.3	I105 N107 I116 F119 F131	I105-L129 HydrophobicContact CB-CD1 4.25Å; I105-L129 HydrophobicContact CG2-CD1 3.82Å; I105-L129 CarbonylContact O-C 3.46Å; I105-L129 WeakPolarHBondContact O-CA 3.35Å; I105-L129 WeakPolarHBondContact O-CD1 3.47Å; N107-L129 HydrophobicContact CB-CD1 4.22Å; I116-L129 HydrophobicContact CG2-CD2 4.27Å; I116-L129 WeakPolarHBondContact O-CD2 2.9Å; F119-L129 HydrophobicContact CE2-CB 4.1Å; L129-F131 HydrophobicContact CD2-CE1 4.13Å; L129-F131 HydrophobicContact CD2-CE2 3.98Å; L129-F131 HydrophobicContact CD2-CZ 3.47Å; L129-F131 VanDerWaalsContact CD2-CZ 3.47Å; L129-F131 HydrophobicContact CG-CE2 4.05Å; L129-F131 HydrophobicContact CG-CZ 3.98Å
130	I	95	Very high	89.7	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.046	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	160.7	172.8	62.7	163.2	0	0	0	110.9	I104 I105 L106 N107 E128 R135	I104-I130 HydrophobicContact CG2-CD1 3.42Å; I104-I130 VanDerWaalsContact CG2-CD1 3.42Å; I104-I130 HydrophobicContact CG2-CG1 3.69Å; I104-I130 HydrophobicContact CG2-CG2 4.44Å; I105-I130 WeakPolarHBondContact O-CG1 3.32Å; I105-I130 PolarHBondContact O-N 3.45Å; L106-I130 HydrophobicContact CB-CD1 4.31Å; L106-I130 HydrophobicContact CB-CG1 3.99Å; L106-I130 HydrophobicContact CD1-CD1 4.07Å; L106-I130 HydrophobicContact CD1-CG1 3.8Å; L106-I130 HydrophobicContact CG-CG1 4.46Å; N107-I130 PolarHBondContact N-O 3.23Å; E128-I130 HydrophobicContact CG-CG2 4.09Å; E128-I130 WeakPolarHBondContact OE1-CG2 3.38Å; I130-R135 HydrophobicContact CD1-CB 3.85Å
131	F	94.7	Very high	90.4	Very high	76 Å²	76	53 Å²	53	33%	0.333	27%	0.266	S	S	.	.			trans	-124.3	-8.1	-178.2	-62.1	-90.4	0	0	0	113.4	N107 Y112 L129 R133	N107-F131 HydrophobicContact CB-CD1 3.7Å; N107-F131 HydrophobicContact CB-CE1 3.85Å; Y112-F131 AromaticContact CD1-CD1 3.53Å; Y112-F131 HydrophobicContact CD1-CD1 3.53Å; Y112-F131 AromaticContact CD1-CE1 3.53Å; Y112-F131 HydrophobicContact CD1-CE1 3.53Å; Y112-F131 HydrophobicContact CD1-CG 4.43Å; Y112-F131 HydrophobicContact CD1-CZ 4.41Å; Y112-F131 HydrophobicContact CE1-CB 4.48Å; Y112-F131 AromaticContact CE1-CD1 3.61Å; Y112-F131 HydrophobicContact CE1-CD1 3.61Å; Y112-F131 HydrophobicContact CE1-CE1 4.08Å; Y112-F131 HydrophobicContact CE1-CG 4.16Å; L129-F131 HydrophobicContact CD2-CE1 4.13Å; L129-F131 HydrophobicContact CD2-CE2 3.98Å; L129-F131 HydrophobicContact CD2-CZ 3.47Å; L129-F131 VanDerWaalsContact CD2-CZ 3.47Å; L129-F131 HydrophobicContact CG-CE2 4.05Å; L129-F131 HydrophobicContact CG-CZ 3.98Å; F131-R133 PolarHBondContact O-N 2.76Å; F131-R133 VanDerWaalsContact O-N 3.11Å
132	D	96.1	Very high	91.4	Very high	81 Å²	81	50.1 Å²	50.1	43%	0.433	25%	0.253	S	S	.	.			trans	-74.9	102.5	176.9	179.1	1.2	0	0	0	110.1	L106 S134 R135	L106-D132 WeakPolarHBondContact CD1-O 3.46Å; D132-S134 PolarHBondContact O-N 3.32Å; D132-S134 VanDerWaalsContact O-N 3.14Å; D132-S134 VanDerWaalsContact OD1-CB 3.29Å; D132-S134 WeakPolarHBondContact OD1-CB 3.48Å; D132-S134 PolarHBondContact OD1-N 2.95Å; D132-S134 PolarHBondContact OD1-OG 3.44Å; D132-S134 PolarHBondContact OD2-OG 3.42Å; D132-S134 VanDerWaalsContact OD2-OG 3.07Å; D132-R135 HydrophobicContact CB-CG 4.29Å; D132-R135 WeakPolarHBondContact O-CB 3.43Å; D132-R135 PolarHBondContact O-N 3.49Å; D132-R135 VanDerWaalsContact O-N 3.09Å
133	R	95.9	Very high	92.2	Very high	92 Å²	92	49.7 Å²	49.7	35%	0.347	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-61.9	-20	-178.7	-64.5	-170.2	-61.9	-153	-2.3	113.6	Y108 D110 F131 R135 W136	Y108-R133 HydrophobicContact CD2-CB 4.12Å; Y108-R133 HydrophobicContact CD2-CG 4.04Å; Y108-R133 HydrophobicContact CE2-CB 3.79Å; Y108-R133 HydrophobicContact CE2-CG 4.13Å; Y108-R133 HydrophobicContact CG-CG 4.41Å; D110-R133 IonicContact OD1-CZ 2.78Å; D110-R133 IonicContact OD1-NH1 3.32Å; D110-R133 PolarHBondContact OD1-NH1 3.36Å; D110-R133 IonicContact OD1-NH2 3.82Å; F131-R133 PolarHBondContact O-N 2.76Å; F131-R133 VanDerWaalsContact O-N 3.11Å; R133-R135 PolarHBondContact O-N 3.36Å; R133-W136 VanDerWaalsContact O-CD1 3.3Å; R133-W136 PolarHBondContact O-N 3.41Å
134	S	96.3	Very high	93.4	Very high	87 Å²	87	45.6 Å²	45.6	61%	0.608	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-68.2	-25.2	177.2	75.5	0	0	0	0	112.2	D132 W136	D132-S134 PolarHBondContact O-N 3.32Å; D132-S134 VanDerWaalsContact O-N 3.14Å; D132-S134 VanDerWaalsContact OD1-CB 3.29Å; D132-S134 WeakPolarHBondContact OD1-CB 3.48Å; D132-S134 PolarHBondContact OD1-N 2.95Å; D132-S134 PolarHBondContact OD1-OG 3.44Å; D132-S134 PolarHBondContact OD2-OG 3.42Å; D132-S134 VanDerWaalsContact OD2-OG 3.07Å; S134-W136 PolarHBondContact O-N 3.39Å
135	R	97	Very high	94.6	Very high	84 Å²	84	45.3 Å²	45.3	32%	0.317	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-83.8	14.7	179.6	-63.4	174.8	62.6	-163.6	-5.2	113.7	I130 D132 R133 L137 E138 A139	I130-R135 HydrophobicContact CD1-CB 3.85Å; D132-R135 HydrophobicContact CB-CG 4.29Å; D132-R135 WeakPolarHBondContact O-CB 3.43Å; D132-R135 PolarHBondContact O-N 3.49Å; D132-R135 VanDerWaalsContact O-N 3.09Å; R133-R135 PolarHBondContact O-N 3.36Å; R135-L137 PolarHBondContact O-N 3.27Å; R135-L137 VanDerWaalsContact O-N 3.16Å; R135-E138 HydrophobicContact CB-CG 3.97Å; R135-E138 IonicContact CZ-OE1 3.72Å; R135-E138 IonicContact NE-OE1 3.36Å; R135-E138 PolarHBondContact NE-OE1 2.95Å; R135-E138 IonicContact NH2-OE1 3.56Å; R135-E138 PolarHBondContact NH2-OE1 3.32Å; R135-E138 WeakPolarHBondContact O-CG 3.5Å; R135-E138 PolarHBondContact O-N 2.94Å; R135-A139 PolarHBondContact O-N 2.97Å
136	W	97.5	Very high	95.3	Very high	32 Å²	32	42.4 Å²	42.4	12%	0.121	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-63.8	-22.7	-176.7	77.3	-86.8	0	0	0	114.3	L106 Y108 R133 S134 I142 P150 P153 Q158	L106-W136 HydrophobicContact CD2-CB 3.5Å; L106-W136 VanDerWaalsContact CD2-CB 3.5Å; Y108-W136 HydrophobicContact CD2-CB 4.2Å; Y108-W136 HydrophobicContact CE2-CB 3.94Å; Y108-W136 HydrophobicContact CE2-CG 4.31Å; R133-W136 VanDerWaalsContact O-CD1 3.3Å; R133-W136 PolarHBondContact O-N 3.41Å; S134-W136 PolarHBondContact O-N 3.39Å; W136-I142 HydrophobicContact CB-CD1 3.97Å; W136-P150 HydrophobicContact CB-CG 4.16Å; W136-P150 HydrophobicContact CD2-CB 3.46Å; W136-P150 VanDerWaalsContact CD2-CB 3.46Å; W136-P150 HydrophobicContact CD2-CG 3.78Å; W136-P150 HydrophobicContact CE3-CB 3.46Å; W136-P150 VanDerWaalsContact CE3-CB 3.46Å; W136-P150 HydrophobicContact CE3-CG 3.69Å; W136-P150 HydrophobicContact CG-CB 4.03Å; W136-P150 HydrophobicContact CG-CG 3.98Å; W136-P150 HydrophobicContact CH2-CB 3.98Å; W136-P150 HydrophobicContact CZ2-CB 3.99Å; W136-P150 HydrophobicContact CZ3-CB 3.72Å; W136-P150 HydrophobicContact CZ3-CG 4.34Å; W136-P153 WeakPolarHBondContact CH2-O 3.44Å; W136-Q158 PolarHBondContact O-NE2 3.2Å
137	L	97.5	Very high	95.4	Very high	106 Å²	106	45.5 Å²	45.5	56%	0.555	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-71.9	-28.9	178.3	-75	170.9	0	0	0	113.3	R135 P155	R135-L137 PolarHBondContact O-N 3.27Å; R135-L137 VanDerWaalsContact O-N 3.16Å; L137-P155 HydrophobicContact CD2-CG 4.12Å
138	E	96.1	Very high	95.5	Very high	99 Å²	99	47.1 Å²	47.1	46%	0.463	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-12.9	178.1	57.4	170.7	-131.7	0	0	113.1	R135	R135-E138 HydrophobicContact CB-CG 3.97Å; R135-E138 IonicContact CZ-OE1 3.72Å; R135-E138 IonicContact NE-OE1 3.36Å; R135-E138 PolarHBondContact NE-OE1 2.95Å; R135-E138 IonicContact NH2-OE1 3.56Å; R135-E138 PolarHBondContact NH2-OE1 3.32Å; R135-E138 WeakPolarHBondContact O-CG 3.5Å; R135-E138 PolarHBondContact O-N 2.94Å
139	A	97.5	Very high	95.6	Very high	4 Å²	4	46.2 Å²	46.2	3%	0.033	22%	0.224	C	C	.	.			trans	-68.6	134.1	179.6	0	0	0	0	0	111.7	I104 L106 R135 I142 Q158	I104-A139 HydrophobicContact CG2-CB 4.08Å; L106-A139 HydrophobicContact CB-CB 3.76Å; L106-A139 HydrophobicContact CD2-CB 4.33Å; R135-A139 PolarHBondContact O-N 2.97Å; A139-I142 HydrophobicContact CB-CD1 3.72Å; A139-Q158 WeakPolarHBondContact O-CG 3.48Å; A139-Q158 PolarHBondContact O-NE2 2.78Å
140	D	96.7	Very high	95.6	Very high	43 Å²	43	45.2 Å²	45.2	23%	0.23	22%	0.219	C	C	.	.	S	Bend	trans	-75.6	-31.7	171.1	-61.1	-95.6	0	0	0	111.5	K103 I104 Q158 L159	K103-D140 WeakPolarHBondContact CA-OD2 3.37Å; K103-D140 HydrophobicContact CB-CB 4.47Å; K103-D140 HydrophobicContact CD-CB 3.83Å; K103-D140 WeakPolarHBondContact CD-OD1 3.27Å; K103-D140 WeakPolarHBondContact CD-OD2 3.25Å; K103-D140 IonicContact NZ-OD1 2.77Å; K103-D140 PolarHBondContact NZ-OD1 2.95Å; I104-D140 PolarHBondContact N-OD2 3.46Å; I104-D140 PolarHBondContact O-N 2.98Å; D140-Q158 CarbonylContact O-C 3.51Å; D140-Q158 VanDerWaalsContact O-CA 3.31Å; D140-Q158 WeakPolarHBondContact O-CA 3.48Å; D140-L159 PolarHBondContact O-N 3.49Å
141	V	97.4	Very high	95.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	132.2	179.6	-178.9	0	0	0	0	110.3	I104 I105 L106 I143 L159 F161 I379 A383	I104-V141 PolarHBondContact O-N 3.42Å; I105-V141 CarbonylContact C-O 3.58Å; I105-V141 HydrophobicContact CB-CB 4.35Å; I105-V141 HydrophobicContact CG1-CB 4.03Å; I105-V141 HydrophobicContact CG1-CG2 4.24Å; I105-V141 HydrophobicContact CG2-CB 4.21Å; I105-V141 HydrophobicContact CG2-CG1 4.22Å; L106-V141 PolarHBondContact N-O 2.99Å; V141-I143 HydrophobicContact CG1-CG1 4.05Å; V141-L159 CarbonylContact C-O 3.35Å; V141-L159 WeakPolarHBondContact CA-O 3.28Å; V141-L159 HydrophobicContact CG2-CB 4.27Å; V141-L159 HydrophobicContact CG2-CD1 4.29Å; V141-F161 HydrophobicContact CG1-CD2 3.42Å; V141-F161 VanDerWaalsContact CG1-CD2 3.42Å; V141-F161 HydrophobicContact CG1-CE2 3.53Å; V141-F161 HydrophobicContact CG1-CG 4.41Å; V141-F161 HydrophobicContact CG2-CE2 4.4Å; V141-I379 HydrophobicContact CG1-CG2 4.02Å; V141-I379 HydrophobicContact CG2-CG2 4.49Å; V141-A383 HydrophobicContact CG2-CB 3.56Å
142	I	97.7	Very high	95.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.6	168.4	-53.3	-60.1	0	0	0	108	L106 Y108 W136 A139 L144 Q158 L159 W160 F161	L106-I142 HydrophobicContact CB-CD1 4.07Å; L106-I142 HydrophobicContact CD2-CD1 3.82Å; L106-I142 HydrophobicContact CG-CD1 4.36Å; Y108-I142 HydrophobicContact CD2-CG2 4.35Å; Y108-I142 HydrophobicContact CG-CG2 4.06Å; W136-I142 HydrophobicContact CB-CD1 3.97Å; A139-I142 HydrophobicContact CB-CD1 3.72Å; I142-L144 HydrophobicContact CG2-CD2 3.59Å; I142-L144 HydrophobicContact CG2-CG 4.3Å; I142-Q158 HydrophobicContact CG1-CG 4.01Å; I142-L159 PolarHBondContact N-O 3.25Å; I142-W160 HydrophobicContact CB-CG 4.21Å; I142-W160 CarbonylContact O-C 3.47Å; I142-W160 WeakPolarHBondContact O-CA 3.43Å; I142-F161 PolarHBondContact O-N 3.41Å
143	I	97.2	Very high	95.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	104.3	171.7	-50.5	178.3	0	0	0	108.2	I105 L106 Y108 I113 I116 V141 T145 F161 F163 I379	I105-I143 HydrophobicContact CG2-CD1 3.48Å; I105-I143 VanDerWaalsContact CG2-CD1 3.48Å; I105-I143 HydrophobicContact CG2-CG1 3.91Å; L106-I143 PolarHBondContact O-N 2.94Å; Y108-I143 PolarHBondContact N-O 3.06Å; I113-I143 HydrophobicContact CD1-CB 4.21Å; I113-I143 HydrophobicContact CD1-CD1 4.4Å; I113-I143 HydrophobicContact CD1-CG2 3.46Å; I113-I143 VanDerWaalsContact CD1-CG2 3.46Å; I116-I143 HydrophobicContact CD1-CD1 3.7Å; V141-I143 HydrophobicContact CG1-CG1 4.05Å; I143-T145 HydrophobicContact CG2-CG2 4.41Å; I143-F161 HydrophobicContact CG1-CB 4.34Å; I143-F161 HydrophobicContact CG2-CB 4.33Å; I143-F163 HydrophobicContact CG2-CB 3.51Å; I143-F163 HydrophobicContact CG2-CG 4.45Å; I143-I379 HydrophobicContact CD1-CD1 3.89Å; I143-I379 HydrophobicContact CD1-CG2 4.47Å
144	L	96.8	Very high	95.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122.8	175.4	-52.7	179	0	0	0	109.2	Y108 I142 W160 F161 F163 L177 I181	Y108-L144 HydrophobicContact CD1-CD2 4.03Å; Y108-L144 HydrophobicContact CG-CD2 4.29Å; Y108-L144 WeakPolarHBondContact O-CA 3.34Å; I142-L144 HydrophobicContact CG2-CD2 3.59Å; I142-L144 HydrophobicContact CG2-CG 4.3Å; L144-W160 HydrophobicContact CD1-CE3 3.9Å; L144-W160 HydrophobicContact CD1-CZ3 4.28Å; L144-F161 WeakPolarHBondContact CB-O 3.42Å; L144-F161 PolarHBondContact N-O 3.15Å; L144-F163 PolarHBondContact O-N 2.95Å; L144-L177 HydrophobicContact CD1-CD1 3.57Å; L144-L177 HydrophobicContact CD1-CD2 4.36Å; L144-I181 HydrophobicContact CD1-CD1 3.75Å
145	T	94.4	Very high	95.1	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.018	25%	0.246	C	C	.	.			trans	-110	-11.6	-178.3	63	0	0	0	0	113.4	Y108 G109 L111 I113 I143 I173	Y108-T145 PolarHBondContact O-N 3.08Å; G109-T145 WeakPolarHBondContact CA-OG1 3.32Å; L111-T145 WeakPolarHBondContact O-CB 3.29Å; L111-T145 WeakPolarHBondContact O-CG2 3.47Å; L111-T145 PolarHBondContact O-OG1 3.47Å; I113-T145 HydrophobicContact CD1-CG2 3.44Å; I113-T145 VanDerWaalsContact CD1-CG2 3.44Å; I113-T145 HydrophobicContact CG1-CG2 3.62Å; I143-T145 HydrophobicContact CG2-CG2 4.41Å; T145-I173 VanDerWaalsContact C-CD1 3.46Å
146	D	91.5	Very high	94.9	Very high	8 Å²	8	50.1 Å²	50.1	4%	0.043	27%	0.267	C	S	.	.	S	Bend	trans	-151.2	-167.1	173.4	61.5	30.5	0	0	0	111.4	D110 L148 I171 I173	D110-D146 WeakPolarHBondContact CB-OD2 3.45Å; D110-D146 PolarHBondContact N-OD2 3.17Å; D146-L148 PolarHBondContact O-N 3.49Å; D146-L148 WeakPolarHBondContact OD1-CB 3.25Å; D146-L148 WeakPolarHBondContact OD1-CG 3.34Å; D146-L148 PolarHBondContact OD1-N 3.09Å; D146-I171 HydrophobicContact CB-CD1 3.64Å; D146-I173 WeakPolarHBondContact O-CG1 3.46Å
147	H	89.8	Confident	94.6	Very high	121 Å²	121	54.9 Å²	54.9	56%	0.56	30%	0.295	S	S	*	.	S	Bend	trans	-61.7	-7.6	179.8	68.6	-62.1	0	0	0	115.5	Y149	H147-Y149 WeakPolarHBondContact O-CD1 3.44Å
148	L	92.9	Very high	94.5	Very high	48 Å²	48	50.2 Å²	50.2	25%	0.251	27%	0.27	S	S	.	.			trans	-81.7	138	179.4	-56.6	175.6	0	0	0	110.3	Y108 D146	Y108-L148 HydrophobicContact CD1-CB 4.44Å; Y108-L148 HydrophobicContact CE1-CB 4.2Å; D146-L148 PolarHBondContact O-N 3.49Å; D146-L148 WeakPolarHBondContact OD1-CB 3.25Å; D146-L148 WeakPolarHBondContact OD1-CG 3.34Å; D146-L148 PolarHBondContact OD1-N 3.09Å
149	Y	94.6	Very high	94.5	Very high	52 Å²	52	46.1 Å²	46.1	20%	0.204	25%	0.251	C	S	.	.			trans	-152.4	153.4	174.5	59.5	-92.8	0	0	0	110.5	Y108 H147 K151 W160 L177	Y108-Y149 VanDerWaalsContact CE1-C 3.41Å; H147-Y149 WeakPolarHBondContact O-CD1 3.44Å; Y149-K151 HydrophobicContact CD2-CD 4.27Å; Y149-K151 HydrophobicContact CE2-CD 3.92Å; Y149-K151 PolarHBondContact O-N 2.69Å; Y149-K151 PolarHBondContact OH-NZ 2.84Å; Y149-K151 VanDerWaalsContact OH-NZ 3.16Å; Y149-W160 HydrophobicContact CD2-CH2 4.36Å; Y149-W160 HydrophobicContact CD2-CZ3 4.37Å; Y149-W160 HydrophobicContact CG-CZ3 4.49Å; Y149-L177 HydrophobicContact CD1-CD2 3.7Å; Y149-L177 HydrophobicContact CD1-CG 4.43Å; Y149-L177 HydrophobicContact CD2-CD2 4.07Å; Y149-L177 HydrophobicContact CE1-CD2 4.01Å; Y149-L177 HydrophobicContact CE2-CD2 4.39Å; Y149-L177 HydrophobicContact CG-CD2 3.71Å
150	P	95.5	Very high	94.5	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.026	25%	0.251	C	S	.	.			trans	-54	135.1	178.3	-26	32.1	0	0	0	113.8	Y108 W136 W160	Y108-P150 HydrophobicContact CD2-CG 3.98Å; Y108-P150 HydrophobicContact CE1-CG 4.25Å; Y108-P150 HydrophobicContact CE2-CB 4.45Å; Y108-P150 HydrophobicContact CE2-CG 3.6Å; Y108-P150 HydrophobicContact CG-CG 4.46Å; Y108-P150 WeakPolarHBondContact OH-CA 3.36Å; W136-P150 HydrophobicContact CB-CG 4.16Å; W136-P150 HydrophobicContact CD2-CB 3.46Å; W136-P150 VanDerWaalsContact CD2-CB 3.46Å; W136-P150 HydrophobicContact CD2-CG 3.78Å; W136-P150 HydrophobicContact CE3-CB 3.46Å; W136-P150 VanDerWaalsContact CE3-CB 3.46Å; W136-P150 HydrophobicContact CE3-CG 3.69Å; W136-P150 HydrophobicContact CG-CB 4.03Å; W136-P150 HydrophobicContact CG-CG 3.98Å; W136-P150 HydrophobicContact CH2-CB 3.98Å; W136-P150 HydrophobicContact CZ2-CB 3.99Å; W136-P150 HydrophobicContact CZ3-CB 3.72Å; W136-P150 HydrophobicContact CZ3-CG 4.34Å; P150-W160 HydrophobicContact CB-CH2 4.24Å; P150-W160 HydrophobicContact CB-CZ2 4.06Å; P150-W160 HydrophobicContact CG-CH2 4.16Å; P150-W160 HydrophobicContact CG-CZ2 3.84Å
151	K	92.7	Very high	94.6	Very high	148 Å²	148	44.2 Å²	44.2	64%	0.643	24%	0.24	S	C	*	.			trans	-98.1	95.9	172.9	-52.6	-54.3	-177.2	-168.2	0	108.5	Y149	Y149-K151 HydrophobicContact CD2-CD 4.27Å; Y149-K151 HydrophobicContact CE2-CD 3.92Å; Y149-K151 PolarHBondContact O-N 2.69Å; Y149-K151 PolarHBondContact OH-NZ 2.84Å; Y149-K151 VanDerWaalsContact OH-NZ 3.16Å
152	G	91.9	Very high	94.5	Very high	44 Å²	44	44.3 Å²	44.3	45%	0.454	24%	0.24	S	C	.	.	S	Bend	trans	169.2	175.1	179.1	0	0	0	0	0	113.2	R154	G152-R154 PolarHBondContact O-N 2.87Å
153	P	93.5	Very high	94.4	Very high	115 Å²	115	44.6 Å²	44.6	75%	0.747	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-64.9	127.7	171.1	28.8	-33.1	0	0	0	109	W136 P155	W136-P153 WeakPolarHBondContact CH2-O 3.44Å; P153-P155 WeakPolarHBondContact O-CD 3.25Å
154	R	93.8	Very high	94.2	Very high	78 Å²	78	44.9 Å²	44.9	29%	0.294	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-70.9	127.3	177.3	-178.5	-169.9	-178.6	147.1	4.1	110	G152 Q158 L159 W160 K180 N182	G152-R154 PolarHBondContact O-N 2.87Å; R154-Q158 HydrophobicContact CG-CB 4.42Å; R154-Q158 PolarHBondContact NE-O 2.71Å; R154-Q158 PolarHBondContact NH2-O 3.03Å; R154-L159 VanDerWaalsContact NH2-C 3.33Å; R154-L159 VanDerWaalsContact NH2-CA 3.29Å; R154-W160 VanDerWaalsContact CZ-CD1 3.41Å; R154-K180 PolarHBondContact NH1-O 3.08Å; R154-N182 PolarHBondContact NH2-OD1 3.04Å
155	P	95.2	Very high	93.9	Very high	31 Å²	31	45.7 Å²	45.7	20%	0.201	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-55	146.6	173.4	-26.1	33.8	0	0	0	112.7	L137 P153 Q158	L137-P155 HydrophobicContact CD2-CG 4.12Å; P153-P155 WeakPolarHBondContact O-CD 3.25Å; P155-Q158 HydrophobicContact CB-CB 4.2Å; P155-Q158 WeakPolarHBondContact O-CB 3.33Å; P155-Q158 PolarHBondContact O-N 2.82Å
156	P	91.7	Very high	93.8	Very high	117 Å²	117	49 Å²	49	76%	0.76	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	141.9	173.3	-23.6	33.5	0	0	0	111.6	Q158	P156-Q158 PolarHBondContact O-N 2.7Å
157	N	91.2	Very high	93.9	Very high	132 Å²	132	48.7 Å²	48.7	71%	0.706	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	-6.8	178.5	-53.7	-41	0	0	0	117.1	L159	N157-L159 PolarHBondContact O-N 2.93Å
158	Q	96.2	Very high	94.1	Very high	7 Å²	7	43 Å²	43	3%	0.033	24%	0.235	C	C	.	.			trans	-58.7	134.9	169.8	177.8	177	90.2	0	0	108.6	W136 A139 D140 I142 R154 P155 P156	W136-Q158 PolarHBondContact O-NE2 3.2Å; A139-Q158 WeakPolarHBondContact O-CG 3.48Å; A139-Q158 PolarHBondContact O-NE2 2.78Å; D140-Q158 CarbonylContact O-C 3.51Å; D140-Q158 VanDerWaalsContact O-CA 3.31Å; D140-Q158 WeakPolarHBondContact O-CA 3.48Å; I142-Q158 HydrophobicContact CG1-CG 4.01Å; R154-Q158 HydrophobicContact CG-CB 4.42Å; R154-Q158 PolarHBondContact NE-O 2.71Å; R154-Q158 PolarHBondContact NH2-O 3.03Å; P155-Q158 HydrophobicContact CB-CB 4.2Å; P155-Q158 WeakPolarHBondContact O-CB 3.33Å; P155-Q158 PolarHBondContact O-N 2.82Å; P156-Q158 PolarHBondContact O-N 2.7Å
159	L	97.1	Very high	93.9	Very high	14 Å²	14	44.3 Å²	44.3	7%	0.073	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	143.3	179.5	-59.8	172.2	0	0	0	111.1	D140 V141 I142 R154 N157 F161 N182 Y183 L382 A386	D140-L159 PolarHBondContact O-N 3.49Å; V141-L159 CarbonylContact C-O 3.35Å; V141-L159 WeakPolarHBondContact CA-O 3.28Å; V141-L159 HydrophobicContact CG2-CB 4.27Å; V141-L159 HydrophobicContact CG2-CD1 4.29Å; I142-L159 PolarHBondContact N-O 3.25Å; R154-L159 VanDerWaalsContact NH2-C 3.33Å; R154-L159 VanDerWaalsContact NH2-CA 3.29Å; N157-L159 PolarHBondContact O-N 2.93Å; L159-F161 HydrophobicContact CB-CD2 4.31Å; L159-F161 HydrophobicContact CB-CE2 3.85Å; L159-F161 HydrophobicContact CD1-CE2 4.21Å; L159-N182 WeakPolarHBondContact CA-OD1 3.45Å; L159-N182 HydrophobicContact CD2-CB 4.41Å; L159-Y183 HydrophobicContact CD1-CE2 4.12Å; L159-Y183 HydrophobicContact CD2-CE2 4.09Å; L159-L382 HydrophobicContact CD1-CB 4.41Å; L159-A386 HydrophobicContact CD1-CB 3.7Å; L159-A386 HydrophobicContact CD2-CB 3.84Å; L159-A386 HydrophobicContact CG-CB 4.31Å
160	W	97.6	Very high	93.6	Very high	7 Å²	7	45.2 Å²	45.2	3%	0.027	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.7	179	-77.6	29.8	0	0	0	108.4	I142 L144 Y149 P150 R154 L177 K180 I181 N182 Y183	I142-W160 HydrophobicContact CB-CG 4.21Å; I142-W160 CarbonylContact O-C 3.47Å; I142-W160 WeakPolarHBondContact O-CA 3.43Å; L144-W160 HydrophobicContact CD1-CE3 3.9Å; L144-W160 HydrophobicContact CD1-CZ3 4.28Å; Y149-W160 HydrophobicContact CD2-CH2 4.36Å; Y149-W160 HydrophobicContact CD2-CZ3 4.37Å; Y149-W160 HydrophobicContact CG-CZ3 4.49Å; P150-W160 HydrophobicContact CB-CH2 4.24Å; P150-W160 HydrophobicContact CB-CZ2 4.06Å; P150-W160 HydrophobicContact CG-CH2 4.16Å; P150-W160 HydrophobicContact CG-CZ2 3.84Å; R154-W160 VanDerWaalsContact CZ-CD1 3.41Å; W160-L177 HydrophobicContact CZ3-CD2 4.06Å; W160-K180 WeakPolarHBondContact CB-O 3.32Å; W160-K180 HydrophobicContact CE3-CB 4.21Å; W160-K180 HydrophobicContact CZ3-CB 4.44Å; W160-K180 HydrophobicContact CZ3-CD 4.31Å; W160-I181 HydrophobicContact CB-CD1 4.21Å; W160-I181 HydrophobicContact CE3-CD1 4.27Å; W160-N182 PolarHBondContact N-OD1 2.74Å; W160-N182 PolarHBondContact O-N 3.37Å; W160-Y183 PolarHBondContact O-N 2.97Å
161	F	97.2	Very high	93.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	143.5	176.6	-71.6	-113.4	0	0	0	109.2	V141 I142 I143 L144 L159 Y183 I185 I193 I379 L382	V141-F161 HydrophobicContact CG1-CD2 3.42Å; V141-F161 VanDerWaalsContact CG1-CD2 3.42Å; V141-F161 HydrophobicContact CG1-CE2 3.53Å; V141-F161 HydrophobicContact CG1-CG 4.41Å; V141-F161 HydrophobicContact CG2-CE2 4.4Å; I142-F161 PolarHBondContact O-N 3.41Å; I143-F161 HydrophobicContact CG1-CB 4.34Å; I143-F161 HydrophobicContact CG2-CB 4.33Å; L144-F161 WeakPolarHBondContact CB-O 3.42Å; L144-F161 PolarHBondContact N-O 3.15Å; L159-F161 HydrophobicContact CB-CD2 4.31Å; L159-F161 HydrophobicContact CB-CE2 3.85Å; L159-F161 HydrophobicContact CD1-CE2 4.21Å; F161-Y183 CarbonylContact C-O 3.52Å; F161-Y183 WeakPolarHBondContact CA-O 3.41Å; F161-Y183 HydrophobicContact CD1-CD2 4.28Å; F161-Y183 HydrophobicContact CD1-CG 4.37Å; F161-Y183 HydrophobicContact CD2-CD2 4.24Å; F161-Y183 VanDerWaalsContact CE1-CB 3.49Å; F161-Y183 AromaticContact CE1-CD2 3.64Å; F161-Y183 HydrophobicContact CE1-CD2 3.64Å; F161-Y183 AromaticContact CE1-CG 3.92Å; F161-Y183 HydrophobicContact CE1-CG 3.92Å; F161-Y183 AromaticContact CE2-CD2 3.6Å; F161-Y183 HydrophobicContact CE2-CD2 3.6Å; F161-Y183 HydrophobicContact CE2-CE2 4.34Å; F161-Y183 AromaticContact CZ-CD2 3.27Å; F161-Y183 HydrophobicContact CZ-CD2 3.27Å; F161-Y183 HydrophobicContact CZ-CE2 4.04Å; F161-Y183 HydrophobicContact CZ-CG 4.04Å; F161-I185 HydrophobicContact CD1-CD1 3.72Å; F161-I185 HydrophobicContact CD1-CG1 3.94Å; F161-I185 HydrophobicContact CE1-CD1 4.35Å; F161-I193 HydrophobicContact CE1-CD1 4.1Å; F161-I379 HydrophobicContact CD1-CG1 4.18Å; F161-I379 HydrophobicContact CE1-CG1 3.82Å; F161-I379 HydrophobicContact CE2-CG2 4.45Å; F161-I379 HydrophobicContact CZ-CB 4.48Å; F161-I379 HydrophobicContact CZ-CG1 4.24Å; F161-I379 HydrophobicContact CZ-CG2 4.26Å; F161-L382 HydrophobicContact CE1-CD1 3.98Å; F161-L382 HydrophobicContact CZ-CB 4.18Å; F161-L382 HydrophobicContact CZ-CD1 3.8Å
162	I	96.2	Very high	92.8	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.9	159.5	-78.7	178.6	0	0	0	107.8	V164 I173 A174 L177 I181 Y183 T184 I185 V397	I162-V164 HydrophobicContact CG2-CB 4.49Å; I162-V164 HydrophobicContact CG2-CG1 3.78Å; I162-I173 HydrophobicContact CD1-CG2 4.41Å; I162-I173 HydrophobicContact CG2-CD1 4.09Å; I162-I173 HydrophobicContact CG2-CG1 4.41Å; I162-I173 HydrophobicContact CG2-CG2 3.97Å; I162-A174 HydrophobicContact CD1-CB 3.96Å; I162-L177 HydrophobicContact CD1-CD1 4.33Å; I162-I181 HydrophobicContact CB-CG2 4.46Å; I162-I181 HydrophobicContact CD1-CD1 4.02Å; I162-I181 HydrophobicContact CD1-CG1 3.7Å; I162-I181 HydrophobicContact CD1-CG2 4.31Å; I162-I181 HydrophobicContact CG1-CD1 3.8Å; I162-I181 HydrophobicContact CG1-CG1 3.96Å; I162-I181 HydrophobicContact CG1-CG2 4.14Å; I162-Y183 PolarHBondContact N-O 3.3Å; I162-T184 HydrophobicContact CB-CG2 4.45Å; I162-I185 PolarHBondContact O-N 3.45Å; I162-V397 HydrophobicContact CD1-CG2 3.9Å
163	F	94.9	Very high	92.7	Very high	5 Å²	5	44.6 Å²	44.6	2%	0.022	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.7	169.4	-175.8	-77.9	0	0	0	109.4	I39 I113 I115 I116 I143 L144 H165 I185 L195	I39-F163 HydrophobicContact CD1-CE1 4.07Å; I39-F163 HydrophobicContact CG1-CE1 4.29Å; I113-F163 HydrophobicContact CD1-CB 3.92Å; I113-F163 HydrophobicContact CD1-CD1 3.98Å; I113-F163 HydrophobicContact CD1-CD2 4.09Å; I113-F163 HydrophobicContact CD1-CG 3.72Å; I113-F163 HydrophobicContact CG1-CD1 3.79Å; I113-F163 HydrophobicContact CG1-CE1 4.06Å; I113-F163 HydrophobicContact CG1-CG 4.05Å; I113-F163 HydrophobicContact CG2-CD2 4.44Å; I113-F163 HydrophobicContact CG2-CE1 4.17Å; I113-F163 HydrophobicContact CG2-CE2 4.02Å; I113-F163 HydrophobicContact CG2-CZ 3.89Å; I115-F163 HydrophobicContact CD1-CE2 3.79Å; I115-F163 HydrophobicContact CD1-CZ 3.65Å; I115-F163 HydrophobicContact CG1-CE2 4.36Å; I115-F163 HydrophobicContact CG1-CZ 4.21Å; I116-F163 HydrophobicContact CD1-CD2 4.41Å; I143-F163 HydrophobicContact CG2-CB 3.51Å; I143-F163 HydrophobicContact CG2-CG 4.45Å; L144-F163 PolarHBondContact O-N 2.95Å; F163-H165 AromaticContact CE1-CD2 3.64Å; F163-H165 AromaticContact CE1-NE2 3.93Å; F163-H165 AromaticContact CZ-CD2 3.63Å; F163-H165 AromaticContact CZ-NE2 3.4Å; F163-H165 WeakPolarHBondContact CZ-NE2 3.33Å; F163-I185 WeakPolarHBondContact CA-O 3.3Å; F163-I185 HydrophobicContact CD2-CB 3.89Å; F163-I185 HydrophobicContact CD2-CD1 4.25Å; F163-I185 HydrophobicContact CD2-CG2 3.77Å; F163-I185 HydrophobicContact CE2-CG2 3.95Å; F163-L195 HydrophobicContact CD2-CD2 4.38Å; F163-L195 HydrophobicContact CE2-CD2 3.39Å; F163-L195 HydrophobicContact CZ-CD2 3.75Å
164	V	93.3	Very high	92.5	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.042	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	129.4	179.2	58.6	0	0	0	0	111.6	I162 E166 I171 I173 I185 T186 W401	I162-V164 HydrophobicContact CG2-CB 4.49Å; I162-V164 HydrophobicContact CG2-CG1 3.78Å; V164-E166 HydrophobicContact CG2-CB 4.42Å; V164-E166 WeakPolarHBondContact CG2-O 3.33Å; V164-I171 HydrophobicContact CG2-CG2 3.53Å; V164-I173 HydrophobicContact CB-CD1 4.21Å; V164-I173 HydrophobicContact CB-CG2 4.35Å; V164-I173 HydrophobicContact CG1-CG2 4.02Å; V164-I185 PolarHBondContact N-O 3.34Å; V164-I185 VanDerWaalsContact N-O 3.08Å; V164-T186 HydrophobicContact CG1-CG2 3.47Å; V164-T186 VanDerWaalsContact CG1-CG2 3.47Å; V164-T186 VanDerWaalsContact O-CA 3.31Å; V164-T186 WeakPolarHBondContact O-CA 3.27Å; V164-T186 VanDerWaalsContact O-CB 3.3Å; V164-T186 WeakPolarHBondContact O-CB 3.36Å; V164-W401 HydrophobicContact CB-CH2 4.33Å; V164-W401 HydrophobicContact CB-CZ2 4.17Å; V164-W401 HydrophobicContact CG1-CD2 4.32Å; V164-W401 HydrophobicContact CG1-CE3 4.27Å; V164-W401 HydrophobicContact CG1-CH2 3.4Å; V164-W401 HydrophobicContact CG1-CZ2 3.43Å; V164-W401 VanDerWaalsContact CG1-CZ2 3.43Å; V164-W401 HydrophobicContact CG1-CZ3 3.84Å; V164-W401 HydrophobicContact CG2-CH2 4.03Å; V164-W401 HydrophobicContact CG2-CZ2 3.58Å
165	H	90.7	Very high	92.3	Very high	16 Å²	16	38.8 Å²	38.8	7%	0.074	21%	0.205	C	C	.	.			trans	-108.9	-14.3	174.4	-80.5	-134.6	0	0	0	113	I39 F163 Y187 L195 Y197 Y295	I39-H165 HydrophobicContact CD1-CB 3.83Å; F163-H165 AromaticContact CE1-CD2 3.64Å; F163-H165 AromaticContact CE1-NE2 3.93Å; F163-H165 AromaticContact CZ-CD2 3.63Å; F163-H165 AromaticContact CZ-NE2 3.4Å; F163-H165 WeakPolarHBondContact CZ-NE2 3.33Å; H165-Y187 WeakPolarHBondContact O-CD1 3.29Å; H165-L195 WeakPolarHBondContact NE2-CD2 3.42Å; H165-L195 WeakPolarHBondContact NE2-CG 3.34Å; H165-Y197 HydrophobicContact CB-CE2 4.14Å; H165-Y197 WeakPolarHBondContact O-CE2 3.46Å; H165-Y197 PolarHBondContact O-OH 3.17Å; H165-Y295 WeakPolarHBondContact O-CE2 3.37Å
166	E	92.8	Very high	92	Very high	74 Å²	74	39.6 Å²	39.6	35%	0.346	22%	0.22	S	C	.	.	S	Bend	trans	-80.4	156.1	176.9	-78.4	-64.1	163.3	0	0	111.4	V164 I171 Y295 W401	V164-E166 HydrophobicContact CG2-CB 4.42Å; V164-E166 WeakPolarHBondContact CG2-O 3.33Å; E166-I171 HydrophobicContact CB-CG2 4.21Å; E166-Y295 PolarHBondContact OE2-OH 3.28Å; E166-W401 WeakPolarHBondContact O-CH2 3.18Å; E166-W401 WeakPolarHBondContact O-CZ2 3.32Å
167	A	94.2	Very high	92.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.			trans	-65.5	152.9	178.5	0	0	0	0	0	112.3	L169 S170 I171 Y295	A167-L169 PolarHBondContact O-N 3.48Å; A167-S170 WeakPolarHBondContact O-CA 3.36Å; A167-S170 VanDerWaalsContact O-CB 3.29Å; A167-S170 WeakPolarHBondContact O-CB 3.5Å; A167-S170 PolarHBondContact O-N 3.22Å; A167-I171 PolarHBondContact O-N 3.03Å; A167-Y295 HydrophobicContact CB-CD1 4.15Å; A167-Y295 HydrophobicContact CB-CD2 4.32Å; A167-Y295 HydrophobicContact CB-CE1 3.98Å; A167-Y295 HydrophobicContact CB-CE2 4.15Å; A167-Y295 HydrophobicContact CB-CG 4.3Å
168	P	92.6	Very high	92.2	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.013	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.3	178.1	-26.8	28.6	0	0	0	115.2	S170 I171 Y187 W401	P168-S170 VanDerWaalsContact C-N 3.29Å; P168-I171 CarbonylContact O-C 3.46Å; P168-I171 PolarHBondContact O-N 3.25Å; P168-Y187 WeakPolarHBondContact CD-OH 3.4Å; P168-W401 HydrophobicContact CB-CZ2 4.46Å; P168-W401 WeakPolarHBondContact CB-O 3.46Å; P168-W401 HydrophobicContact CG-CD2 4.01Å; P168-W401 HydrophobicContact CG-CE3 4.42Å; P168-W401 HydrophobicContact CG-CG 4.45Å; P168-W401 HydrophobicContact CG-CH2 4.32Å; P168-W401 HydrophobicContact CG-CZ2 3.91Å; P168-W401 WeakPolarHBondContact CG-O 3.38Å
169	L	90	Very high	92	Very high	76 Å²	76	36.1 Å²	36.1	40%	0.398	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-15.7	176.6	-59.5	-179.9	0	0	0	113.7	A167 K238 C405	A167-L169 PolarHBondContact O-N 3.48Å; L169-K238 HydrophobicContact CB-CB 4.34Å; L169-K238 HydrophobicContact CB-CG 4.01Å; L169-K238 HydrophobicContact CD1-CB 3.72Å; L169-K238 HydrophobicContact CD1-CG 4.22Å; L169-C405 HydrophobicContact CD1-CB 4.06Å; L169-C405 HydrophobicContact CD2-CB 4.48Å; L169-C405 HydrophobicContact CG-CB 4.06Å
170	S	88.1	Confident	91.9	Very high	70 Å²	70	39.3 Å²	39.3	49%	0.49	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-37.1	171.2	-57.6	0	0	0	0	110.9	A167 P168	A167-S170 WeakPolarHBondContact O-CA 3.36Å; A167-S170 VanDerWaalsContact O-CB 3.29Å; A167-S170 WeakPolarHBondContact O-CB 3.5Å; A167-S170 PolarHBondContact O-N 3.22Å; P168-S170 VanDerWaalsContact C-N 3.29Å
171	I	85.4	Confident	91.8	Very high	31 Å²	31	39 Å²	39	16%	0.159	21%	0.205	C	C	.	.			trans	-148.7	118.5	-179	-166.7	167.8	0	0	0	113.1	D146 V164 E166 A167 P168 I173 W401	D146-I171 HydrophobicContact CB-CD1 3.64Å; V164-I171 HydrophobicContact CG2-CG2 3.53Å; E166-I171 HydrophobicContact CB-CG2 4.21Å; A167-I171 PolarHBondContact O-N 3.03Å; P168-I171 CarbonylContact O-C 3.46Å; P168-I171 PolarHBondContact O-N 3.25Å; I171-I173 HydrophobicContact CG1-CB 4.23Å; I171-I173 PolarHBondContact O-N 3.35Å; I171-I173 VanDerWaalsContact O-N 3.12Å; I171-W401 PolarHBondContact O-NE1 3.24Å
172	R	84.7	Confident	91.7	Very high	152 Å²	152	39.8 Å²	39.8	57%	0.574	21%	0.209	S	C	*	.			trans	-87	62	172.6	-65.2	-171.3	175.1	-157.8	-2.5	111.1	A174 D175	R172-A174 PolarHBondContact O-N 3.42Å; R172-D175 WeakPolarHBondContact CB-OD2 3.46Å; R172-D175 PolarHBondContact O-N 3.19Å
173	I	90.7	Very high	91.7	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.2	-172.3	-171.6	160.5	0	0	0	113.9	T145 D146 I162 V164 I171 L177 W401	T145-I173 VanDerWaalsContact C-CD1 3.46Å; D146-I173 WeakPolarHBondContact O-CG1 3.46Å; I162-I173 HydrophobicContact CD1-CG2 4.41Å; I162-I173 HydrophobicContact CG2-CD1 4.09Å; I162-I173 HydrophobicContact CG2-CG1 4.41Å; I162-I173 HydrophobicContact CG2-CG2 3.97Å; V164-I173 HydrophobicContact CB-CD1 4.21Å; V164-I173 HydrophobicContact CB-CG2 4.35Å; V164-I173 HydrophobicContact CG1-CG2 4.02Å; I171-I173 HydrophobicContact CG1-CB 4.23Å; I171-I173 PolarHBondContact O-N 3.35Å; I171-I173 VanDerWaalsContact O-N 3.12Å; I173-L177 WeakPolarHBondContact O-CD1 3.3Å; I173-W401 HydrophobicContact CG2-CG 4.37Å
174	A	88.8	Confident	91.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	1.8	-171.3	0	0	0	0	0	114.6	I162 R172 G176 L177 V397 S398 W401	I162-A174 HydrophobicContact CD1-CB 3.96Å; R172-A174 PolarHBondContact O-N 3.42Å; A174-G176 PolarHBondContact O-N 2.97Å; A174-L177 PolarHBondContact O-N 2.82Å; A174-V397 HydrophobicContact CB-CG1 4.38Å; A174-V397 HydrophobicContact CB-CG2 4.2Å; A174-S398 WeakPolarHBondContact O-CB 3.46Å; A174-W401 HydrophobicContact CB-CB 4.04Å; A174-W401 HydrophobicContact CB-CG 4.48Å
175	D	89.8	Confident	91.8	Very high	70 Å²	70	39.4 Å²	39.4	37%	0.374	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	125.9	-177.1	-75.4	-3.3	0	0	0	112.3	R172 L177 S398 N402	R172-D175 WeakPolarHBondContact CB-OD2 3.46Å; R172-D175 PolarHBondContact O-N 3.19Å; D175-L177 PolarHBondContact O-N 3.47Å; D175-S398 PolarHBondContact OD1-OG 3.14Å; D175-N402 PolarHBondContact OD1-ND2 3.04Å
176	G	89.5	Confident	91.9	Very high	49 Å²	49	38.7 Å²	38.7	51%	0.505	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	11.9	-179.9	0	0	0	0	0	114.9	A174 K180	A174-G176 PolarHBondContact O-N 2.97Å; G176-K180 PolarHBondContact O-NZ 2.76Å; G176-K180 VanDerWaalsContact O-NZ 3.08Å
177	L	93.6	Very high	91.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.			trans	-103.5	13	179.4	-59.4	-179.9	0	0	0	113.4	L144 Y149 W160 I162 I173 A174 D175 N179 K180 I181 V397	L144-L177 HydrophobicContact CD1-CD1 3.57Å; L144-L177 HydrophobicContact CD1-CD2 4.36Å; Y149-L177 HydrophobicContact CD1-CD2 3.7Å; Y149-L177 HydrophobicContact CD1-CG 4.43Å; Y149-L177 HydrophobicContact CD2-CD2 4.07Å; Y149-L177 HydrophobicContact CE1-CD2 4.01Å; Y149-L177 HydrophobicContact CE2-CD2 4.39Å; Y149-L177 HydrophobicContact CG-CD2 3.71Å; W160-L177 HydrophobicContact CZ3-CD2 4.06Å; I162-L177 HydrophobicContact CD1-CD1 4.33Å; I173-L177 WeakPolarHBondContact O-CD1 3.3Å; A174-L177 PolarHBondContact O-N 2.82Å; D175-L177 PolarHBondContact O-N 3.47Å; L177-N179 PolarHBondContact O-N 2.77Å; L177-K180 HydrophobicContact CD2-CD 4.26Å; L177-K180 WeakPolarHBondContact O-CB 3.34Å; L177-K180 PolarHBondContact O-N 3.05Å; L177-I181 HydrophobicContact CB-CD1 4.12Å; L177-I181 HydrophobicContact CB-CG1 3.95Å; L177-I181 HydrophobicContact CD1-CD1 4.08Å; L177-V397 HydrophobicContact CB-CG1 4.44Å
178	E	93.5	Very high	91.7	Very high	60 Å²	60	36.4 Å²	36.4	28%	0.28	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	135.9	175.9	-163.1	53.2	-127.6	0	0	111	K180 N396 V397	E178-K180 PolarHBondContact O-N 2.8Å; E178-K180 VanDerWaalsContact O-N 3.12Å; E178-N396 VanDerWaalsContact CD-CA 3.49Å; E178-N396 WeakPolarHBondContact OE1-CA 3.27Å; E178-N396 PolarHBondContact OE1-N 3.08Å; E178-N396 VanDerWaalsContact OE2-C 3.28Å; E178-N396 VanDerWaalsContact OE2-CA 3.24Å; E178-N396 WeakPolarHBondContact OE2-CA 3.31Å; E178-V397 PolarHBondContact OE2-N 3.14Å
179	N	91.5	Very high	91.6	Very high	123 Å²	123	38.2 Å²	38.2	66%	0.658	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	12.6	-173.2	-54	-56.7	0	0	0	116.1	L177 T393	L177-N179 PolarHBondContact O-N 2.77Å; N179-T393 VanDerWaalsContact C-CG2 3.42Å; N179-T393 VanDerWaalsContact CA-CG2 3.49Å; N179-T393 HydrophobicContact CB-CG2 4.43Å
180	K	94.3	Very high	91.7	Very high	81 Å²	81	38 Å²	38	35%	0.352	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-21.8	179.2	-62.3	179.1	-171.6	159	0	113.6	R154 W160 G176 L177 E178	R154-K180 PolarHBondContact NH1-O 3.08Å; W160-K180 WeakPolarHBondContact CB-O 3.32Å; W160-K180 HydrophobicContact CE3-CB 4.21Å; W160-K180 HydrophobicContact CZ3-CB 4.44Å; W160-K180 HydrophobicContact CZ3-CD 4.31Å; G176-K180 PolarHBondContact O-NZ 2.76Å; G176-K180 VanDerWaalsContact O-NZ 3.08Å; L177-K180 HydrophobicContact CD2-CD 4.26Å; L177-K180 WeakPolarHBondContact O-CB 3.34Å; L177-K180 PolarHBondContact O-N 3.05Å; E178-K180 PolarHBondContact O-N 2.8Å; E178-K180 VanDerWaalsContact O-N 3.12Å
181	I	96.4	Very high	91.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.			trans	-89.7	128.3	-176.8	-57.3	-52.6	0	0	0	109.7	L144 W160 I162 L177 Y183 T184 T393 F394 V397	L144-I181 HydrophobicContact CD1-CD1 3.75Å; W160-I181 HydrophobicContact CB-CD1 4.21Å; W160-I181 HydrophobicContact CE3-CD1 4.27Å; I162-I181 HydrophobicContact CB-CG2 4.46Å; I162-I181 HydrophobicContact CD1-CD1 4.02Å; I162-I181 HydrophobicContact CD1-CG1 3.7Å; I162-I181 HydrophobicContact CD1-CG2 4.31Å; I162-I181 HydrophobicContact CG1-CD1 3.8Å; I162-I181 HydrophobicContact CG1-CG1 3.96Å; I162-I181 HydrophobicContact CG1-CG2 4.14Å; L177-I181 HydrophobicContact CB-CD1 4.12Å; L177-I181 HydrophobicContact CB-CG1 3.95Å; L177-I181 HydrophobicContact CD1-CD1 4.08Å; I181-Y183 VanDerWaalsContact CG2-O 3.32Å; I181-Y183 WeakPolarHBondContact CG2-O 3.47Å; I181-T184 HydrophobicContact CG2-CG2 4.06Å; I181-T393 CarbonylContact O-C 3.5Å; I181-T393 WeakPolarHBondContact O-CA 3.37Å; I181-T393 WeakPolarHBondContact O-CG2 3.46Å; I181-F394 HydrophobicContact CG2-CB 4.38Å; I181-F394 PolarHBondContact O-N 3.22Å; I181-V397 HydrophobicContact CB-CG1 4.31Å; I181-V397 HydrophobicContact CB-CG2 4.23Å; I181-V397 HydrophobicContact CG1-CG1 3.97Å; I181-V397 HydrophobicContact CG1-CG2 4.22Å; I181-V397 HydrophobicContact CG2-CG2 4.35Å
182	N	95.9	Very high	92.1	Very high	17 Å²	17	33.3 Å²	33.3	9%	0.091	17%	0.169	C	C	.	.			trans	-82.8	-49.2	170.4	-53.1	92.5	0	0	0	109.9	R154 L159 W160 Y392	R154-N182 PolarHBondContact NH2-OD1 3.04Å; L159-N182 WeakPolarHBondContact CA-OD1 3.45Å; L159-N182 HydrophobicContact CD2-CB 4.41Å; W160-N182 PolarHBondContact N-OD1 2.74Å; W160-N182 PolarHBondContact O-N 3.37Å; N182-Y392 PolarHBondContact ND2-O 3.22Å; N182-Y392 WeakPolarHBondContact O-CD1 3.17Å; N182-Y392 WeakPolarHBondContact O-CE1 3Å
183	Y	95.4	Very high	92.4	Very high	6 Å²	6	26 Å²	26	2%	0.024	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.9	-166.2	-53.8	-56.7	0	0	0	111.6	L82 L159 W160 F161 I162 I181 T192 L382 Y392	L82-Y183 HydrophobicContact CD1-CD1 4.37Å; L82-Y183 HydrophobicContact CD1-CE1 3.92Å; L82-Y183 HydrophobicContact CD2-CD1 3.7Å; L82-Y183 HydrophobicContact CD2-CE1 3.47Å; L82-Y183 VanDerWaalsContact CD2-CE1 3.47Å; L82-Y183 HydrophobicContact CG-CE1 4.38Å; L159-Y183 HydrophobicContact CD1-CE2 4.12Å; L159-Y183 HydrophobicContact CD2-CE2 4.09Å; W160-Y183 PolarHBondContact O-N 2.97Å; F161-Y183 CarbonylContact C-O 3.52Å; F161-Y183 WeakPolarHBondContact CA-O 3.41Å; F161-Y183 HydrophobicContact CD1-CD2 4.28Å; F161-Y183 HydrophobicContact CD1-CG 4.37Å; F161-Y183 HydrophobicContact CD2-CD2 4.24Å; F161-Y183 VanDerWaalsContact CE1-CB 3.49Å; F161-Y183 AromaticContact CE1-CD2 3.64Å; F161-Y183 HydrophobicContact CE1-CD2 3.64Å; F161-Y183 AromaticContact CE1-CG 3.92Å; F161-Y183 HydrophobicContact CE1-CG 3.92Å; F161-Y183 AromaticContact CE2-CD2 3.6Å; F161-Y183 HydrophobicContact CE2-CD2 3.6Å; F161-Y183 HydrophobicContact CE2-CE2 4.34Å; F161-Y183 AromaticContact CZ-CD2 3.27Å; F161-Y183 HydrophobicContact CZ-CD2 3.27Å; F161-Y183 HydrophobicContact CZ-CE2 4.04Å; F161-Y183 HydrophobicContact CZ-CG 4.04Å; I162-Y183 PolarHBondContact N-O 3.3Å; I181-Y183 VanDerWaalsContact CG2-O 3.32Å; I181-Y183 WeakPolarHBondContact CG2-O 3.47Å; Y183-T192 WeakPolarHBondContact CA-OG1 2.9Å; Y183-T192 HydrophobicContact CD1-CG2 3.65Å; Y183-T192 HydrophobicContact CG-CG2 4.16Å; Y183-L382 HydrophobicContact CD2-CD1 3.93Å; Y183-L382 HydrophobicContact CE2-CB 4.29Å; Y183-L382 HydrophobicContact CE2-CD1 3.89Å; Y183-L382 HydrophobicContact CE2-CD2 4.25Å; Y183-L382 HydrophobicContact CE2-CG 4.38Å; Y183-L382 HydrophobicContact CG-CD1 4.24Å; Y183-Y392 AromaticContact CD1-CD1 3.88Å; Y183-Y392 HydrophobicContact CD1-CD1 3.88Å; Y183-Y392 HydrophobicContact CD1-CE1 4.15Å; Y183-Y392 AromaticContact CE1-CD1 3.62Å; Y183-Y392 HydrophobicContact CE1-CD1 3.62Å; Y183-Y392 HydrophobicContact CE1-CE1 4.29Å; Y183-Y392 HydrophobicContact CE1-CG 4.47Å
184	T	94.9	Very high	92.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135.5	-179.6	55.6	0	0	0	0	110.7	I162 I181 S191 T192 I193 F394 V397 W400	I162-T184 HydrophobicContact CB-CG2 4.45Å; I181-T184 HydrophobicContact CG2-CG2 4.06Å; T184-S191 WeakPolarHBondContact OG1-CA 3.45Å; T184-S191 WeakPolarHBondContact OG1-CB 3.03Å; T184-T192 PolarHBondContact N-OG1 3.14Å; T184-T192 VanDerWaalsContact N-OG1 3.08Å; T184-T192 WeakPolarHBondContact O-CB 3.25Å; T184-T192 PolarHBondContact O-N 3.34Å; T184-T192 VanDerWaalsContact O-N 3.15Å; T184-T192 PolarHBondContact OG1-N 3.35Å; T184-T192 PolarHBondContact OG1-OG1 2.77Å; T184-I193 PolarHBondContact O-N 3.07Å; T184-F394 HydrophobicContact CG2-CB 4.43Å; T184-F394 HydrophobicContact CG2-CD1 4.28Å; T184-F394 HydrophobicContact CG2-CD2 3.78Å; T184-F394 HydrophobicContact CG2-CE2 4.07Å; T184-F394 HydrophobicContact CG2-CG 3.89Å; T184-F394 HydrophobicContact CG2-CZ 4.43Å; T184-F394 VanDerWaalsContact OG1-CE2 3.27Å; T184-F394 WeakPolarHBondContact OG1-CE2 3.2Å; T184-V397 HydrophobicContact CG2-CG2 4.08Å; T184-W400 HydrophobicContact CG2-CH2 4.15Å; T184-W400 HydrophobicContact CG2-CZ3 3.78Å
185	I	94.3	Very high	92.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	101.5	179.5	-44.2	-173.6	0	0	0	108.1	F161 I162 F163 V164 I193 L195 P375 I379	F161-I185 HydrophobicContact CD1-CD1 3.72Å; F161-I185 HydrophobicContact CD1-CG1 3.94Å; F161-I185 HydrophobicContact CE1-CD1 4.35Å; I162-I185 PolarHBondContact O-N 3.45Å; F163-I185 WeakPolarHBondContact CA-O 3.3Å; F163-I185 HydrophobicContact CD2-CB 3.89Å; F163-I185 HydrophobicContact CD2-CD1 4.25Å; F163-I185 HydrophobicContact CD2-CG2 3.77Å; F163-I185 HydrophobicContact CE2-CG2 3.95Å; V164-I185 PolarHBondContact N-O 3.34Å; V164-I185 VanDerWaalsContact N-O 3.08Å; I185-I193 WeakPolarHBondContact CA-O 3.39Å; I185-I193 HydrophobicContact CB-CB 4.41Å; I185-I193 HydrophobicContact CD1-CD1 4Å; I185-I193 HydrophobicContact CG1-CB 4.09Å; I185-I193 HydrophobicContact CG1-CD1 4.02Å; I185-I193 HydrophobicContact CG1-CG1 4.41Å; I185-I193 HydrophobicContact CG2-CB 4.16Å; I185-I193 HydrophobicContact CG2-CG2 4.06Å; I185-L195 HydrophobicContact CG2-CB 3.92Å; I185-L195 HydrophobicContact CG2-CD2 3.49Å; I185-L195 VanDerWaalsContact CG2-CD2 3.49Å; I185-L195 HydrophobicContact CG2-CG 4.34Å; I185-P375 HydrophobicContact CD1-CB 4.37Å; I185-P375 HydrophobicContact CG2-CB 4.13Å; I185-I379 HydrophobicContact CD1-CD1 3.54Å; I185-I379 HydrophobicContact CD1-CG1 3.8Å
186	T	93.3	Very high	92.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	171.4	-173.3	77.9	0	0	0	0	111.4	V164 R188 S191 I193 L195 W400 W401	V164-T186 HydrophobicContact CG1-CG2 3.47Å; V164-T186 VanDerWaalsContact CG1-CG2 3.47Å; V164-T186 VanDerWaalsContact O-CA 3.31Å; V164-T186 WeakPolarHBondContact O-CA 3.27Å; V164-T186 VanDerWaalsContact O-CB 3.3Å; V164-T186 WeakPolarHBondContact O-CB 3.36Å; T186-R188 PolarHBondContact O-N 3.35Å; T186-R188 WeakPolarHBondContact OG1-CB 3.29Å; T186-R188 PolarHBondContact OG1-N 3.33Å; T186-S191 PolarHBondContact O-OG 2.88Å; T186-S191 WeakPolarHBondContact OG1-CB 3.3Å; T186-S191 PolarHBondContact OG1-OG 3.29Å; T186-I193 PolarHBondContact N-O 3.13Å; T186-L195 CarbonylContact C-O 3.54Å; T186-L195 PolarHBondContact O-N 2.73Å; T186-W400 HydrophobicContact CG2-CH2 4.18Å; T186-W401 HydrophobicContact CG2-CE3 4.38Å; T186-W401 HydrophobicContact CG2-CH2 4.41Å; T186-W401 HydrophobicContact CG2-CZ3 3.83Å
187	Y	91.6	Very high	92.2	Very high	3 Å²	3	24.1 Å²	24.1	1%	0.012	12%	0.116	C	C	.	.	S	Bend	trans	-67.3	-10.9	170.4	67.2	-100.3	0	0	0	114	H165 P168 Y194 L195 A293 D294 Y295 W401	H165-Y187 WeakPolarHBondContact O-CD1 3.29Å; P168-Y187 WeakPolarHBondContact CD-OH 3.4Å; Y187-Y194 WeakPolarHBondContact O-CE2 3.25Å; Y187-L195 VanDerWaalsContact CA-O 3.29Å; Y187-L195 WeakPolarHBondContact CA-O 3.43Å; Y187-L195 PolarHBondContact N-O 2.76Å; Y187-A293 WeakPolarHBondContact CE2-O 3.34Å; Y187-D294 HydrophobicContact CD2-CB 4.28Å; Y187-D294 WeakPolarHBondContact CD2-O 3.33Å; Y187-Y295 AromaticContact CD1-CD2 3.82Å; Y187-Y295 HydrophobicContact CD1-CD2 3.82Å; Y187-Y295 HydrophobicContact CD1-CE2 4.29Å; Y187-Y295 HydrophobicContact CD2-CD2 4.19Å; Y187-Y295 AromaticContact CE1-CD2 3.39Å; Y187-Y295 HydrophobicContact CE1-CD2 3.39Å; Y187-Y295 AromaticContact CE1-CE2 3.93Å; Y187-Y295 HydrophobicContact CE1-CE2 3.93Å; Y187-Y295 HydrophobicContact CE1-CG 4.4Å; Y187-Y295 VanDerWaalsContact CE2-CA 3.5Å; Y187-Y295 AromaticContact CE2-CD2 3.84Å; Y187-Y295 HydrophobicContact CE2-CD2 3.84Å; Y187-Y295 HydrophobicContact CE2-CG 4.22Å; Y187-Y295 HydrophobicContact CG-CD2 4.2Å; Y187-Y295 AromaticContact CZ-CD2 3.41Å; Y187-Y295 VanDerWaalsContact CZ-CD2 3.41Å; Y187-Y295 AromaticContact CZ-CG 4Å; Y187-W401 AromaticContact CE1-CH2 3.68Å; Y187-W401 HydrophobicContact CE1-CH2 3.68Å; Y187-W401 HydrophobicContact CE1-CZ3 4.31Å; Y187-W401 AromaticContact CZ-CH2 3.98Å
188	R	92.6	Very high	92	Very high	23 Å²	23	25.8 Å²	25.8	9%	0.087	12%	0.124	C	C	.	.			trans	-71	135.2	179.5	-71.6	-176.5	59	140.8	-2.2	110.9	T186 D190 S191 W400 W401	T186-R188 PolarHBondContact O-N 3.35Å; T186-R188 WeakPolarHBondContact OG1-CB 3.29Å; T186-R188 PolarHBondContact OG1-N 3.33Å; R188-D190 WeakPolarHBondContact CB-OD1 3.35Å; R188-D190 IonicContact CZ-OD1 3.33Å; R188-D190 IonicContact CZ-OD2 3.3Å; R188-D190 IonicContact NE-OD1 2.65Å; R188-D190 PolarHBondContact NE-OD1 2.86Å; R188-D190 IonicContact NE-OD2 2.81Å; R188-D190 IonicContact NH2-OD1 3.3Å; R188-D190 PolarHBondContact NH2-OD1 3.28Å; R188-D190 IonicContact NH2-OD2 3.63Å; R188-D190 PolarHBondContact NH2-OD2 2.68Å; R188-D190 PolarHBondContact O-N 3.49Å; R188-S191 WeakPolarHBondContact O-CB 2.87Å; R188-S191 PolarHBondContact O-N 2.98Å; R188-S191 VanDerWaalsContact O-N 3.1Å; R188-S191 PolarHBondContact O-OG 2.85Å; R188-W400 HydrophobicContact CB-CZ2 3.99Å; R188-W400 HydrophobicContact CG-CZ2 4.37Å; R188-W400 VanDerWaalsContact CZ-NE1 3.31Å; R188-W400 PolarHBondContact NH1-O 3.35Å; R188-W400 VanDerWaalsContact NH2-CD1 3.35Å; R188-W401 HydrophobicContact CG-CZ3 4.18Å
189	M	89.6	Confident	91.6	Very high	41 Å²	41	23.9 Å²	23.9	20%	0.202	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.6	-178.3	-71	-75.6	-73.3	0	0	113.4	Y194 D294	M189-Y194 HydrophobicContact CG-CE2 4.08Å; M189-Y194 HydrophobicContact SD-CD1 4.18Å; M189-Y194 HydrophobicContact SD-CD2 4.02Å; M189-Y194 HydrophobicContact SD-CE1 3.66Å; M189-Y194 HydrophobicContact SD-CE2 3.47Å; M189-Y194 WeakPolarHBondContact SD-CE2 3.37Å; M189-Y194 HydrophobicContact SD-CG 4.33Å; M189-Y194 PolarHBondContact SD-OH 3.28Å; M189-D294 WeakPolarHBondContact CB-OD2 3.42Å; M189-D294 HydrophobicContact CG-CB 4.4Å; M189-D294 PolarHBondContact N-OD2 3.06Å
190	D	91.2	Very high	91.5	Very high	71 Å²	71	19.4 Å²	19.4	38%	0.38	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	11.7	179.1	67.9	-13.2	0	0	0	113.4	R188 W400	R188-D190 WeakPolarHBondContact CB-OD1 3.35Å; R188-D190 IonicContact CZ-OD1 3.33Å; R188-D190 IonicContact CZ-OD2 3.3Å; R188-D190 IonicContact NE-OD1 2.65Å; R188-D190 PolarHBondContact NE-OD1 2.86Å; R188-D190 IonicContact NE-OD2 2.81Å; R188-D190 IonicContact NH2-OD1 3.3Å; R188-D190 PolarHBondContact NH2-OD1 3.28Å; R188-D190 IonicContact NH2-OD2 3.63Å; R188-D190 PolarHBondContact NH2-OD2 2.68Å; R188-D190 PolarHBondContact O-N 3.49Å; D190-W400 WeakPolarHBondContact OD1-CZ2 3.36Å; D190-W400 PolarHBondContact OD1-NE1 2.86Å; D190-W400 VanDerWaalsContact OD1-NE1 3.08Å; D190-W400 PolarHBondContact OD2-NE1 2.87Å
191	S	92.7	Very high	91.2	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.007	9%	0.089	C	C	.	.	S	Bend	trans	-72.4	161.7	168.3	62.5	0	0	0	0	111.6	T81 T184 T186 R188 I193	T81-S191 PolarHBondContact OG1-O 2.81Å; T184-S191 WeakPolarHBondContact OG1-CA 3.45Å; T184-S191 WeakPolarHBondContact OG1-CB 3.03Å; T186-S191 PolarHBondContact O-OG 2.88Å; T186-S191 WeakPolarHBondContact OG1-CB 3.3Å; T186-S191 PolarHBondContact OG1-OG 3.29Å; R188-S191 WeakPolarHBondContact O-CB 2.87Å; R188-S191 PolarHBondContact O-N 2.98Å; R188-S191 VanDerWaalsContact O-N 3.1Å; R188-S191 PolarHBondContact O-OG 2.85Å; S191-I193 VanDerWaalsContact C-N 3.3Å; S191-I193 PolarHBondContact O-N 3.39Å; S191-I193 PolarHBondContact OG-O 2.85Å
192	T	90.9	Very high	91	Very high	1 Å²	1	20 Å²	20	1%	0.006	10%	0.1	C	C	.	.	S	Bend	trans	-59.5	-45	176.9	-55.1	0	0	0	0	111.2	I80 T81 L82 Y183 T184	I80-T192 CarbonylContact C-O 3.59Å; I80-T192 VanDerWaalsContact CA-O 3.31Å; I80-T192 WeakPolarHBondContact CA-O 3.37Å; T81-T192 PolarHBondContact N-O 2.9Å; L82-T192 HydrophobicContact CD1-CG2 4.07Å; L82-T192 HydrophobicContact CD2-CG2 3.45Å; L82-T192 VanDerWaalsContact CD2-CG2 3.45Å; L82-T192 HydrophobicContact CG-CG2 3.64Å; Y183-T192 WeakPolarHBondContact CA-OG1 2.9Å; Y183-T192 HydrophobicContact CD1-CG2 3.65Å; Y183-T192 HydrophobicContact CG-CG2 4.16Å; T184-T192 PolarHBondContact N-OG1 3.14Å; T184-T192 VanDerWaalsContact N-OG1 3.08Å; T184-T192 WeakPolarHBondContact O-CB 3.25Å; T184-T192 PolarHBondContact O-N 3.34Å; T184-T192 VanDerWaalsContact O-N 3.15Å; T184-T192 PolarHBondContact OG1-N 3.35Å; T184-T192 PolarHBondContact OG1-OG1 2.77Å
193	I	89.5	Confident	90.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	101.1	179.4	-57.4	180	0	0	0	106	N78 F161 T184 I185 T186 S191 L195 P375 V378	N78-I193 HydrophobicContact CB-CG2 3.57Å; N78-I193 VanDerWaalsContact CG-CG2 3.44Å; F161-I193 HydrophobicContact CE1-CD1 4.1Å; T184-I193 PolarHBondContact O-N 3.07Å; I185-I193 WeakPolarHBondContact CA-O 3.39Å; I185-I193 HydrophobicContact CB-CB 4.41Å; I185-I193 HydrophobicContact CD1-CD1 4Å; I185-I193 HydrophobicContact CG1-CB 4.09Å; I185-I193 HydrophobicContact CG1-CD1 4.02Å; I185-I193 HydrophobicContact CG1-CG1 4.41Å; I185-I193 HydrophobicContact CG2-CB 4.16Å; I185-I193 HydrophobicContact CG2-CG2 4.06Å; T186-I193 PolarHBondContact N-O 3.13Å; S191-I193 VanDerWaalsContact C-N 3.3Å; S191-I193 PolarHBondContact O-N 3.39Å; S191-I193 PolarHBondContact OG-O 2.85Å; I193-L195 PolarHBondContact O-N 3.33Å; I193-P375 HydrophobicContact CG2-CB 4.35Å; I193-V378 HydrophobicContact CD1-CB 3.89Å; I193-V378 HydrophobicContact CD1-CG1 3.45Å; I193-V378 VanDerWaalsContact CD1-CG1 3.45Å; I193-V378 HydrophobicContact CG1-CG1 4.02Å
194	Y	88.2	Confident	90.4	Very high	29 Å²	29	26.1 Å²	26.1	11%	0.114	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	121.9	176.1	174.3	-125.7	0	0	0	110.4	N78 K79 Y187 M189 P196	N78-Y194 PolarHBondContact OD1-O 3.49Å; K79-Y194 PolarHBondContact O-N 3.21Å; Y187-Y194 WeakPolarHBondContact O-CE2 3.25Å; M189-Y194 HydrophobicContact CG-CE2 4.08Å; M189-Y194 HydrophobicContact SD-CD1 4.18Å; M189-Y194 HydrophobicContact SD-CD2 4.02Å; M189-Y194 HydrophobicContact SD-CE1 3.66Å; M189-Y194 HydrophobicContact SD-CE2 3.47Å; M189-Y194 WeakPolarHBondContact SD-CE2 3.37Å; M189-Y194 HydrophobicContact SD-CG 4.33Å; M189-Y194 PolarHBondContact SD-OH 3.28Å; Y194-P196 HydrophobicContact CD1-CG 4.3Å; Y194-P196 HydrophobicContact CE1-CB 4.17Å; Y194-P196 HydrophobicContact CE1-CG 3.63Å; Y194-P196 HydrophobicContact CE2-CB 3.88Å; Y194-P196 HydrophobicContact CE2-CG 4.15Å; Y194-P196 WeakPolarHBondContact OH-CB 3.44Å
195	L	89.9	Confident	89.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.184	C	C	.	.			trans	-134.8	79.8	-175.9	-174.5	58.8	0	0	0	109.7	F37 I115 F163 H165 I185 T186 Y187 I193 P373 P375	F37-L195 HydrophobicContact CE1-CD1 4.4Å; I115-L195 HydrophobicContact CD1-CD1 4.43Å; I115-L195 HydrophobicContact CD1-CD2 3.66Å; F163-L195 HydrophobicContact CD2-CD2 4.38Å; F163-L195 HydrophobicContact CE2-CD2 3.39Å; F163-L195 HydrophobicContact CZ-CD2 3.75Å; H165-L195 WeakPolarHBondContact NE2-CD2 3.42Å; H165-L195 WeakPolarHBondContact NE2-CG 3.34Å; I185-L195 HydrophobicContact CG2-CB 3.92Å; I185-L195 HydrophobicContact CG2-CD2 3.49Å; I185-L195 VanDerWaalsContact CG2-CD2 3.49Å; I185-L195 HydrophobicContact CG2-CG 4.34Å; T186-L195 CarbonylContact C-O 3.54Å; T186-L195 PolarHBondContact O-N 2.73Å; Y187-L195 VanDerWaalsContact CA-O 3.29Å; Y187-L195 WeakPolarHBondContact CA-O 3.43Å; Y187-L195 PolarHBondContact N-O 2.76Å; I193-L195 PolarHBondContact O-N 3.33Å; L195-P373 HydrophobicContact CD1-CB 3.15Å; L195-P373 HydrophobicContact CD1-CG 3.31Å; L195-P375 HydrophobicContact CD1-CG 4.38Å; L195-P375 HydrophobicContact CD2-CB 4.42Å; L195-P375 HydrophobicContact CD2-CG 4.04Å
196	P	89.4	Confident	89.6	Confident	9 Å²	9	36 Å²	36	6%	0.058	22%	0.218	C	C	.	.			trans	-72	167.3	178	31.3	-34.2	0	0	0	111.6	Y194 H198 W371	Y194-P196 HydrophobicContact CD1-CG 4.3Å; Y194-P196 HydrophobicContact CE1-CB 4.17Å; Y194-P196 HydrophobicContact CE1-CG 3.63Å; Y194-P196 HydrophobicContact CE2-CB 3.88Å; Y194-P196 HydrophobicContact CE2-CG 4.15Å; Y194-P196 WeakPolarHBondContact OH-CB 3.44Å; P196-H198 VanDerWaalsContact C-N 3.33Å; P196-H198 WeakPolarHBondContact CB-O 3.36Å; P196-W371 HydrophobicContact CG-CZ3 3.88Å
197	Y	88.3	Confident	89.4	Confident	42 Å²	42	38.5 Å²	38.5	17%	0.165	23%	0.23	C	C	.	.	S	Bend	trans	-66.4	-38.9	171.7	-80.5	-103.5	0	0	0	112.1	H165 Y295 T297	H165-Y197 HydrophobicContact CB-CE2 4.14Å; H165-Y197 WeakPolarHBondContact O-CE2 3.46Å; H165-Y197 PolarHBondContact O-OH 3.17Å; Y197-Y295 HydrophobicContact CE2-CE2 4.27Å; Y197-T297 HydrophobicContact CD2-CG2 4.09Å; Y197-T297 HydrophobicContact CE1-CG2 4.43Å; Y197-T297 HydrophobicContact CE2-CG2 3.84Å
198	H	89.3	Confident	89.4	Confident	35 Å²	35	39.7 Å²	39.7	16%	0.162	24%	0.242	C	C	.	.			trans	-156.6	166.9	-175.5	-64.8	107.7	0	0	0	108.7	P196 E298 F301 D369	P196-H198 VanDerWaalsContact C-N 3.33Å; P196-H198 WeakPolarHBondContact CB-O 3.36Å; H198-E298 VanDerWaalsContact CE1-CA 3.47Å; H198-E298 WeakPolarHBondContact CE1-CA 3.09Å; H198-F301 HydrophobicContact CB-CB 3.41Å; H198-F301 VanDerWaalsContact CB-CB 3.41Å; H198-F301 HydrophobicContact CB-CD1 3.74Å; H198-F301 HydrophobicContact CB-CD2 3.6Å; H198-F301 HydrophobicContact CB-CE1 4.37Å; H198-F301 HydrophobicContact CB-CE2 4.22Å; H198-F301 HydrophobicContact CB-CG 3.32Å; H198-F301 VanDerWaalsContact CG-CB 3.47Å; H198-F301 AromaticContact CG-CG 3.97Å; H198-F301 WeakPolarHBondContact ND1-CB 3.32Å; H198-D369 WeakPolarHBondContact CA-OD1 3Å; H198-D369 WeakPolarHBondContact CB-OD1 3.49Å; H198-D369 IonicContact CD2-OD1 2.85Å; H198-D369 PolarHBondContact CD2-OD1 3.39Å; H198-D369 IonicContact CD2-OD2 3.5Å; H198-D369 PolarHBondContact CD2-OD2 2.89Å; H198-D369 VanDerWaalsContact CD2-OD2 3.22Å; H198-D369 IonicContact CG-OD1 3.87Å; H198-D369 VanDerWaalsContact CG-OD1 3.3Å; H198-D369 IonicContact NE2-OD2 3.69Å
199	N	85.3	Confident	89.3	Confident	19 Å²	19	41.2 Å²	41.2	10%	0.102	26%	0.256	C	S	.	.			trans	-144.1	155	179.3	69	-69.8	0	0	0	111.6	V201 I368 D369 W371	N199-V201 WeakPolarHBondContact ND2-CG2 3.48Å; N199-I368 CarbonylContact O-C 3.59Å; N199-I368 WeakPolarHBondContact O-CA 3.29Å; N199-D369 PolarHBondContact O-N 3.21Å; N199-W371 HydrophobicContact CB-CE3 4.27Å; N199-W371 PolarHBondContact OD1-O 3.09Å; N199-W371 VanDerWaalsContact OD1-O 3.06Å
200	Y	89	Confident	89.4	Confident	30 Å²	30	45.6 Å²	45.6	12%	0.118	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.4	166.6	170	-108.1	0	0	0	109.3	P202 V324 P326 W362 H365 T367 I368	Y200-P202 HydrophobicContact CE1-CB 3.95Å; Y200-P202 HydrophobicContact CE1-CG 4.46Å; Y200-V324 WeakPolarHBondContact CB-O 3.28Å; Y200-P326 HydrophobicContact CD1-CB 4.27Å; Y200-P326 HydrophobicContact CD1-CG 4.45Å; Y200-P326 HydrophobicContact CD2-CB 3.93Å; Y200-P326 HydrophobicContact CD2-CG 3.6Å; Y200-P326 HydrophobicContact CE1-CB 4.22Å; Y200-P326 HydrophobicContact CE2-CB 3.81Å; Y200-P326 HydrophobicContact CE2-CG 3.95Å; Y200-P326 HydrophobicContact CG-CB 4.13Å; Y200-P326 HydrophobicContact CG-CG 3.85Å; Y200-W362 HydrophobicContact CD2-CE3 4.41Å; Y200-W362 AromaticContact CE2-CE3 3.93Å; Y200-W362 HydrophobicContact CE2-CE3 3.93Å; Y200-W362 HydrophobicContact CE2-CZ3 4.48Å; Y200-H365 PolarHBondContact OH-O 2.83Å; Y200-T367 WeakPolarHBondContact CA-O 3.33Å; Y200-I368 HydrophobicContact CD2-CD1 3.92Å; Y200-I368 HydrophobicContact CG-CD1 4.43Å
201	V	88.8	Confident	89.5	Confident	56 Å²	56	43.9 Å²	43.9	34%	0.339	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	115.4	172.9	-175.9	0	0	0	0	108.8	N199 G366 T367 A370	N199-V201 WeakPolarHBondContact ND2-CG2 3.48Å; V201-G366 CarbonylContact O-C 3.59Å; V201-G366 WeakPolarHBondContact O-CA 3.06Å; V201-T367 PolarHBondContact N-O 2.85Å; V201-T367 PolarHBondContact O-N 3.31Å; V201-A370 HydrophobicContact CB-CB 3.89Å; V201-A370 HydrophobicContact CG2-CB 3.62Å
202	P	90.8	Very high	89.6	Confident	37 Å²	37	53.4 Å²	53.4	24%	0.24	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	141.9	173	29.6	-32.9	0	0	0	110.3	Y200 V204 H207 H365	Y200-P202 HydrophobicContact CE1-CB 3.95Å; Y200-P202 HydrophobicContact CE1-CG 4.46Å; P202-V204 PolarHBondContact O-N 2.97Å; P202-H207 HydrophobicContact CB-CB 3.97Å; P202-H365 WeakPolarHBondContact CA-O 3.06Å
203	S	89.6	Confident	89.9	Confident	89 Å²	89	55.1 Å²	55.1	62%	0.622	32%	0.32	S	S	*	.	S	Bend	trans	-65.6	-17	174.6	-54.7	0	0	0	0	113	H365 G366	S203-H365 PolarHBondContact N-O 3.19Å; S203-H365 VanDerWaalsContact OG-C 3.28Å; S203-H365 PolarHBondContact OG-O 3.03Å; S203-G366 PolarHBondContact OG-N 2.86Å
204	V	89.3	Confident	90.1	Very high	63 Å²	63	63.8 Å²	63.8	38%	0.382	36%	0.357	S	S	.	.	S	Bend	trans	-123.5	118.6	175.7	-179.2	0	0	0	0	108.4	P202 S206 H207	P202-V204 PolarHBondContact O-N 2.97Å; V204-S206 WeakPolarHBondContact CG1-OG 3.26Å; V204-S206 PolarHBondContact O-N 3.01Å; V204-S206 VanDerWaalsContact O-N 3.11Å; V204-H207 WeakPolarHBondContact O-CB 3.09Å; V204-H207 PolarHBondContact O-N 3.48Å
205	A	84.8	Confident	90.5	Very high	104 Å²	104	66.6 Å²	66.6	86%	0.86	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.8	-174.1	0	0	0	0	0	114.6	H207	A205-H207 VanDerWaalsContact C-N 3.33Å
206	S	88.1	Confident	90.8	Very high	104 Å²	104	67.3 Å²	67.3	73%	0.727	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-9.7	176.1	62	0	0	0	0	113.9	V204	V204-S206 WeakPolarHBondContact CG1-OG 3.26Å; V204-S206 PolarHBondContact O-N 3.01Å; V204-S206 VanDerWaalsContact O-N 3.11Å
207	H	89.7	Confident	91	Very high	52 Å²	52	72.2 Å²	72.2	24%	0.241	41%	0.413	C	S	.	.			trans	-72.4	135.9	175.8	-66	178.9	0	0	0	110.3	P202 V204 A205 T211 Y213	P202-H207 HydrophobicContact CB-CB 3.97Å; V204-H207 WeakPolarHBondContact O-CB 3.09Å; V204-H207 PolarHBondContact O-N 3.48Å; A205-H207 VanDerWaalsContact C-N 3.33Å; H207-T211 WeakPolarHBondContact CA-OG1 3.47Å; H207-T211 HydrophobicContact CB-CG2 4.25Å; H207-Y213 WeakPolarHBondContact CB-OH 3.3Å; H207-Y213 AromaticContact CE1-CE1 3.59Å; H207-Y213 AromaticContact ND1-CE1 3.37Å; H207-Y213 WeakPolarHBondContact ND1-CE1 3.42Å; H207-Y213 AromaticContact ND1-CZ 3.62Å; H207-Y213 PolarHBondContact ND1-OH 3.15Å
208	G	89.7	Confident	91.4	Very high	27 Å²	27	76.6 Å²	76.6	28%	0.278	43%	0.429	S	S	.	.			trans	-136.1	-174.5	-177.2	0	0	0	0	0	112	D210 T211 P327	G208-D210 PolarHBondContact O-N 3.01Å; G208-T211 PolarHBondContact N-OG1 2.65Å; G208-T211 VanDerWaalsContact O-CB 3.3Å; G208-T211 WeakPolarHBondContact O-CB 3.19Å; G208-T211 PolarHBondContact O-N 3.32Å; G208-T211 PolarHBondContact O-OG1 3.23Å; G208-T211 VanDerWaalsContact O-OG1 3.14Å; G208-P327 WeakPolarHBondContact O-CG 3.34Å
209	P	90.8	Very high	91.7	Very high	56 Å²	56	77.3 Å²	77.3	36%	0.364	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.3	-171.3	-27.1	35.6	0	0	0	115.6	K322	P209-K322 HydrophobicContact CB-CB 4.05Å; P209-K322 WeakPolarHBondContact CB-O 3.39Å; P209-K322 VanDerWaalsContact CG-O 3.3Å; P209-K322 WeakPolarHBondContact CG-O 3.35Å
210	D	92.5	Very high	92.3	Very high	133 Å²	133	77.3 Å²	77.3	71%	0.711	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	3.6	-178.8	-58.5	-51	0	0	0	113.5	G208 K212	G208-D210 PolarHBondContact O-N 3.01Å; D210-K212 PolarHBondContact O-N 3.15Å
211	T	94.1	Very high	92.6	Very high	35 Å²	35	76.1 Å²	76.1	22%	0.215	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-62.1	129.8	176.5	-64.1	0	0	0	0	110.4	H207 G208 Y213 P327	H207-T211 WeakPolarHBondContact CA-OG1 3.47Å; H207-T211 HydrophobicContact CB-CG2 4.25Å; G208-T211 PolarHBondContact N-OG1 2.65Å; G208-T211 VanDerWaalsContact O-CB 3.3Å; G208-T211 WeakPolarHBondContact O-CB 3.19Å; G208-T211 PolarHBondContact O-N 3.32Å; G208-T211 PolarHBondContact O-OG1 3.23Å; G208-T211 VanDerWaalsContact O-OG1 3.14Å; T211-Y213 HydrophobicContact CG2-CD1 3.96Å; T211-Y213 HydrophobicContact CG2-CE1 3.39Å; T211-Y213 HydrophobicContact CG2-CE2 4.35Å; T211-P327 VanDerWaalsContact O-CB 3.27Å; T211-P327 WeakPolarHBondContact O-CB 2.77Å
212	K	94.6	Very high	93	Very high	201 Å²	201	78.4 Å²	78.4	87%	0.874	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-102.7	116.3	177.1	-63.3	-174.6	-179.2	-178.2	0	110.1	D210	D210-K212 PolarHBondContact O-N 3.15Å
213	Y	95.4	Very high	93.1	Very high	36 Å²	36	79.6 Å²	79.6	14%	0.141	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-90.7	159.5	176	-61.1	-55.3	0	0	0	111.7	H207 T211 P327 W362 H365	H207-Y213 WeakPolarHBondContact CB-OH 3.3Å; H207-Y213 AromaticContact CE1-CE1 3.59Å; H207-Y213 AromaticContact ND1-CE1 3.37Å; H207-Y213 WeakPolarHBondContact ND1-CE1 3.42Å; H207-Y213 AromaticContact ND1-CZ 3.62Å; H207-Y213 PolarHBondContact ND1-OH 3.15Å; T211-Y213 HydrophobicContact CG2-CD1 3.96Å; T211-Y213 HydrophobicContact CG2-CE1 3.39Å; T211-Y213 HydrophobicContact CG2-CE2 4.35Å; Y213-P327 HydrophobicContact CE2-CB 4.14Å; Y213-P327 HydrophobicContact CE2-CG 3.91Å; Y213-W362 HydrophobicContact CD2-CB 4.12Å; Y213-W362 HydrophobicContact CE2-CB 4.12Å; Y213-H365 HydrophobicContact CD1-CB 3.94Å; Y213-H365 AromaticContact CD1-CD2 3.12Å; Y213-H365 WeakPolarHBondContact CD1-CD2 3.47Å; Y213-H365 AromaticContact CD1-CG 3.53Å; Y213-H365 AromaticContact CD1-NE2 3.69Å; Y213-H365 HydrophobicContact CD2-CB 4.45Å; Y213-H365 AromaticContact CD2-CD2 3.99Å; Y213-H365 HydrophobicContact CE1-CB 3.55Å; Y213-H365 AromaticContact CE1-CD2 3.71Å; Y213-H365 AromaticContact CE1-CG 3.61Å; Y213-H365 HydrophobicContact CE2-CB 4.1Å; Y213-H365 HydrophobicContact CG-CB 4.38Å; Y213-H365 AromaticContact CG-CD2 3.29Å
214	K	95.6	Very high	93.5	Very high	182 Å²	182	76.2 Å²	76.2	79%	0.791	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-73.9	156	170.6	-67.3	-178.5	-179.6	177.3	0	109.2	A361	K214-A361 VanDerWaalsContact O-CB 3.29Å; K214-A361 WeakPolarHBondContact O-CB 3.35Å
215	L	95.9	Very high	93.8	Very high	89 Å²	89	78 Å²	78	47%	0.466	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-53	139.7	174.7	-74.9	171	0	0	0	111	T354 N357 E358	L215-T354 HydrophobicContact CD1-CG2 3.86Å; L215-N357 HydrophobicContact CD2-CB 4.23Å; L215-E358 HydrophobicContact CD2-CB 4.41Å; L215-E358 HydrophobicContact CD2-CG 3.64Å
216	P	95.7	Very high	94.4	Very high	15 Å²	15	76.5 Å²	76.5	10%	0.097	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-67.3	152.2	179.7	29.3	-33.9	0	0	0	110.8	R218 Y220 N357 F360	P216-R218 PolarHBondContact O-N 3.01Å; P216-Y220 HydrophobicContact CB-CD2 4.45Å; P216-Y220 HydrophobicContact CB-CE2 3.91Å; P216-Y220 HydrophobicContact CG-CD2 4.03Å; P216-Y220 HydrophobicContact CG-CE2 3.98Å; P216-N357 WeakPolarHBondContact CD-O 3.24Å; P216-N357 HydrophobicContact CG-CB 4.33Å; P216-F360 HydrophobicContact CG-CB 4.19Å
217	S	94.4	Very high	94.8	Very high	112 Å²	112	73.4 Å²	73.4	78%	0.783	40%	0.401	S	S	*	.	S	Bend	trans	-62.4	-32.8	175.3	54.7	0	0	0	0	113.1	E364	S217-E364 WeakPolarHBondContact CB-OE1 3.44Å; S217-E364 PolarHBondContact N-OE1 3.36Å; S217-E364 VanDerWaalsContact N-OE1 3.14Å; S217-E364 PolarHBondContact OG-OE1 3.36Å
218	R	95.5	Very high	95.2	Very high	134 Å²	134	71 Å²	71	51%	0.506	39%	0.39	S	S	.	.	S	Bend	trans	-88.8	132.9	178.2	175.9	-178.4	176.1	-171.8	-0	111.2	P216 Y220 N357	P216-R218 PolarHBondContact O-N 3.01Å; R218-Y220 HydrophobicContact CB-CD2 4.42Å; R218-Y220 HydrophobicContact CB-CE2 4.04Å; R218-Y220 HydrophobicContact CG-CD2 4.32Å; R218-Y220 HydrophobicContact CG-CE2 4.23Å; R218-Y220 VanDerWaalsContact O-CD2 3.24Å; R218-Y220 WeakPolarHBondContact O-CD2 3.12Å; R218-Y220 PolarHBondContact O-N 2.87Å; R218-N357 PolarHBondContact O-OD1 3.18Å
219	N	96.5	Very high	95.6	Very high	49 Å²	49	69.8 Å²	69.8	26%	0.262	38%	0.377	S	S	.	.			trans	-78.7	108.3	163.8	-174.8	-6.6	0	0	0	110.5	A221 T222 E353 N357	N219-A221 VanDerWaalsContact C-N 3.3Å; N219-A221 VanDerWaalsContact OD1-CB 3.28Å; N219-A221 WeakPolarHBondContact OD1-CB 3.37Å; N219-A221 PolarHBondContact OD1-N 2.75Å; N219-T222 PolarHBondContact O-OG1 3.17Å; N219-E353 PolarHBondContact ND2-OE2 2.86Å; N219-N357 WeakPolarHBondContact CA-OD1 3.21Å; N219-N357 PolarHBondContact OD1-ND2 2.8Å
220	Y	96.7	Very high	95.9	Very high	20 Å²	20	67.2 Å²	67.2	8%	0.078	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-10.4	179.3	-75	-90.5	0	0	0	113.7	P216 R218 K224 N308 N357 F360 H363	P216-Y220 HydrophobicContact CB-CD2 4.45Å; P216-Y220 HydrophobicContact CB-CE2 3.91Å; P216-Y220 HydrophobicContact CG-CD2 4.03Å; P216-Y220 HydrophobicContact CG-CE2 3.98Å; R218-Y220 HydrophobicContact CB-CD2 4.42Å; R218-Y220 HydrophobicContact CB-CE2 4.04Å; R218-Y220 HydrophobicContact CG-CD2 4.32Å; R218-Y220 HydrophobicContact CG-CE2 4.23Å; R218-Y220 VanDerWaalsContact O-CD2 3.24Å; R218-Y220 WeakPolarHBondContact O-CD2 3.12Å; R218-Y220 PolarHBondContact O-N 2.87Å; Y220-K224 WeakPolarHBondContact O-CD 3.46Å; Y220-K224 WeakPolarHBondContact O-CE 3.33Å; Y220-N308 HydrophobicContact CD1-CB 3.95Å; Y220-N308 HydrophobicContact CE1-CB 4.09Å; Y220-N357 PolarHBondContact N-OD1 3.13Å; Y220-F360 HydrophobicContact CD1-CB 4.43Å; Y220-F360 AromaticContact CD1-CD1 3.66Å; Y220-F360 HydrophobicContact CD1-CD1 3.66Å; Y220-F360 HydrophobicContact CD1-CE1 4.11Å; Y220-F360 HydrophobicContact CD1-CG 4.06Å; Y220-F360 HydrophobicContact CD2-CB 3.33Å; Y220-F360 HydrophobicContact CD2-CD1 4.1Å; Y220-F360 HydrophobicContact CD2-CD2 4.34Å; Y220-F360 AromaticContact CD2-CG 3.67Å; Y220-F360 HydrophobicContact CD2-CG 3.67Å; Y220-F360 HydrophobicContact CE1-CD1 4.09Å; Y220-F360 HydrophobicContact CE2-CB 3.62Å; Y220-F360 HydrophobicContact CE2-CD1 4.49Å; Y220-F360 HydrophobicContact CE2-CG 4.27Å; Y220-F360 HydrophobicContact CG-CB 3.78Å; Y220-F360 AromaticContact CG-CD1 3.65Å; Y220-F360 HydrophobicContact CG-CD1 3.65Å; Y220-F360 HydrophobicContact CG-CD2 4.06Å; Y220-F360 HydrophobicContact CG-CE1 4.27Å; Y220-F360 AromaticContact CG-CG 3.55Å; Y220-F360 HydrophobicContact CG-CG 3.55Å; Y220-H363 AromaticContact CE1-NE2 3.99Å; Y220-H363 AromaticContact CZ-CD2 3.86Å; Y220-H363 AromaticContact CZ-CG 3.82Å; Y220-H363 WeakPolarHBondContact OH-CB 3.32Å; Y220-H363 PolarHBondContact OH-CD2 2.63Å; Y220-H363 VanDerWaalsContact OH-CG 3.24Å
221	A	96.6	Very high	96.1	Very high	5 Å²	5	62.2 Å²	62.2	4%	0.041	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-25	174.4	0	0	0	0	0	112.3	N219 G223 K224 E353 Y356	N219-A221 VanDerWaalsContact C-N 3.3Å; N219-A221 VanDerWaalsContact OD1-CB 3.28Å; N219-A221 WeakPolarHBondContact OD1-CB 3.37Å; N219-A221 PolarHBondContact OD1-N 2.75Å; A221-G223 PolarHBondContact O-N 2.93Å; A221-K224 WeakPolarHBondContact O-CB 3.44Å; A221-K224 PolarHBondContact O-N 2.95Å; A221-K224 VanDerWaalsContact O-N 3.1Å; A221-E353 HydrophobicContact CB-CG 4.21Å; A221-Y356 HydrophobicContact CB-CD1 3.74Å; A221-Y356 HydrophobicContact CB-CE1 3.91Å
222	T	95.9	Very high	96.1	Very high	103 Å²	103	60.9 Å²	60.9	63%	0.632	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	124.2	-175.3	-56	0	0	0	0	112.3	N219 K224	N219-T222 PolarHBondContact O-OG1 3.17Å; T222-K224 VanDerWaalsContact C-N 3.29Å; T222-K224 PolarHBondContact O-N 2.95Å
223	G	94.7	Very high	96	Very high	63 Å²	63	55.1 Å²	55.1	65%	0.649	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	-11.6	176.6	0	0	0	0	0	115.4	A221 S225	A221-G223 PolarHBondContact O-N 2.93Å; G223-S225 PolarHBondContact O-N 3.22Å
224	K	96.9	Very high	95.9	Very high	18 Å²	18	56.4 Å²	56.4	8%	0.078	32%	0.318	C	S	.	.			trans	-81.9	113.5	177.6	-62.9	170.4	178.8	-67.2	0	110.2	Y220 A221 T222 G278 H280 Y281 K282 N308 Y356	Y220-K224 WeakPolarHBondContact O-CD 3.46Å; Y220-K224 WeakPolarHBondContact O-CE 3.33Å; A221-K224 WeakPolarHBondContact O-CB 3.44Å; A221-K224 PolarHBondContact O-N 2.95Å; A221-K224 VanDerWaalsContact O-N 3.1Å; T222-K224 VanDerWaalsContact C-N 3.29Å; T222-K224 PolarHBondContact O-N 2.95Å; K224-G278 PolarHBondContact NZ-O 3.36Å; K224-H280 CarbonylContact C-O 3.58Å; K224-H280 WeakPolarHBondContact CA-O 3.36Å; K224-Y281 WeakPolarHBondContact CD-O 3.29Å; K224-Y281 WeakPolarHBondContact CE-O 3.42Å; K224-Y281 PolarHBondContact NZ-O 2.96Å; K224-K282 HydrophobicContact CB-CG 3.9Å; K224-K282 HydrophobicContact CD-CG 4.03Å; K224-N308 WeakPolarHBondContact CE-O 3.33Å; K224-N308 PolarHBondContact NZ-O 3.02Å; K224-Y356 WeakPolarHBondContact CD-OH 3.42Å
225	S	95.4	Very high	95.9	Very high	99 Å²	99	49.7 Å²	49.7	69%	0.692	29%	0.293	S	S	*	.			trans	-104.7	-9.6	-179.1	58.5	0	0	0	0	114.2	G223 H280	G223-S225 PolarHBondContact O-N 3.22Å; S225-H280 PolarHBondContact N-O 2.59Å; S225-H280 VanDerWaalsContact N-O 3.13Å
226	K	97.3	Very high	95.9	Very high	73 Å²	73	53.3 Å²	53.3	32%	0.317	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	150.5	-178.5	-60.6	-172.5	170.3	-160.5	0	111	D255 H280 Y281 K282	K226-D255 IonicContact NZ-OD2 3.77Å; K226-D255 PolarHBondContact NZ-OD2 2.9Å; K226-H280 WeakPolarHBondContact CA-O 3.44Å; K226-H280 WeakPolarHBondContact CB-O 3.36Å; K226-H280 HydrophobicContact CD-CB 4.34Å; K226-H280 HydrophobicContact CG-CB 4.45Å; K226-H280 PolarHBondContact N-O 3.41Å; K226-Y281 HydrophobicContact CB-CD1 3.45Å; K226-Y281 VanDerWaalsContact CB-CD1 3.45Å; K226-Y281 HydrophobicContact CB-CE1 3.54Å; K226-Y281 HydrophobicContact CB-CG 4.04Å; K226-Y281 HydrophobicContact CD-CD1 4.15Å; K226-Y281 HydrophobicContact CD-CE1 3.43Å; K226-Y281 VanDerWaalsContact CD-CE1 3.43Å; K226-Y281 HydrophobicContact CD-CE2 3.94Å; K226-Y281 WeakPolarHBondContact CD-OH 3.4Å; K226-Y281 HydrophobicContact CG-CD1 4.48Å; K226-Y281 HydrophobicContact CG-CE1 4.16Å; K226-Y281 PolarHBondContact NZ-OH 3.33Å; K226-Y281 VanDerWaalsContact NZ-OH 3.13Å; K226-Y281 WeakPolarHBondContact O-CA 3.35Å; K226-K282 PolarHBondContact O-N 2.9Å
227	M	96.2	Very high	95.9	Very high	40 Å²	40	53.6 Å²	53.6	20%	0.197	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-75.4	-177.1	-60	-173.1	86	0	0	111.6	I252 K282 F283 K347 D350	M227-I252 HydrophobicContact CB-CD1 4.17Å; M227-I252 HydrophobicContact CB-CG1 4.39Å; M227-I252 HydrophobicContact CE-CD1 3.48Å; M227-I252 VanDerWaalsContact CE-CD1 3.48Å; M227-I252 HydrophobicContact CE-CG1 4.2Å; M227-I252 HydrophobicContact SD-CD1 3.73Å; M227-I252 HydrophobicContact SD-CG1 3.78Å; M227-K282 PolarHBondContact O-N 3.12Å; M227-F283 HydrophobicContact CB-CD2 4.43Å; M227-F283 WeakPolarHBondContact O-CD2 3.45Å; M227-F283 PolarHBondContact O-N 3.4Å; M227-K347 HydrophobicContact CE-CB 4.28Å; M227-K347 HydrophobicContact CE-CG 3.75Å; M227-D350 HydrophobicContact CE-CB 3.6Å
228	V	98.7	Very high	95.9	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.012	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.2	-166.5	-170.1	0	0	0	0	111.3	I252 I254 D255 F283 L285 L346	V228-I252 HydrophobicContact CG2-CD1 3.69Å; V228-I252 HydrophobicContact CG2-CG1 4.12Å; V228-I254 HydrophobicContact CB-CG1 4.14Å; V228-I254 HydrophobicContact CB-CG2 4.46Å; V228-I254 HydrophobicContact CG1-CG1 4.15Å; V228-I254 HydrophobicContact CG1-CG2 4.05Å; V228-D255 PolarHBondContact O-N 3.24Å; V228-F283 WeakPolarHBondContact CA-O 3.34Å; V228-F283 HydrophobicContact CG2-CB 4.21Å; V228-F283 HydrophobicContact CG2-CD2 4.17Å; V228-L285 HydrophobicContact CG1-CD1 4.15Å; V228-L285 HydrophobicContact CG1-CD2 3.56Å; V228-L285 HydrophobicContact CG1-CG 3.6Å; V228-L346 HydrophobicContact CG2-CD1 3.94Å
229	A	98.1	Very high	95.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	151.9	168	0	0	0	0	0	111.8	F231 D255 L277 Y281 F283 Y284 L285	A229-F231 HydrophobicContact CB-CE2 4.35Å; A229-D255 WeakPolarHBondContact CA-O 3.47Å; A229-L277 HydrophobicContact CB-CD2 3.27Å; A229-Y281 HydrophobicContact CB-CD1 3.57Å; A229-Y281 HydrophobicContact CB-CD2 4.03Å; A229-Y281 HydrophobicContact CB-CE1 3.69Å; A229-Y281 HydrophobicContact CB-CE2 4.1Å; A229-Y281 HydrophobicContact CB-CG 3.73Å; A229-F283 PolarHBondContact N-O 2.9Å; A229-Y284 WeakPolarHBondContact O-CA 3.3Å; A229-L285 PolarHBondContact O-N 3.08Å
230	W	97.9	Very high	95.9	Very high	3 Å²	3	48.1 Å²	48.1	1%	0.011	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	125.7	172.5	-173.1	33.6	0	0	0	111.6	V232 R241 M242 V245 I254 D255 I256 Y257 L285	W230-V232 HydrophobicContact CD2-CB 4.01Å; W230-V232 HydrophobicContact CD2-CG1 3.75Å; W230-V232 HydrophobicContact CE3-CB 4.37Å; W230-V232 HydrophobicContact CE3-CG1 3.68Å; W230-V232 HydrophobicContact CG-CG1 4.39Å; W230-V232 HydrophobicContact CH2-CB 4.33Å; W230-V232 HydrophobicContact CH2-CG1 4.17Å; W230-V232 HydrophobicContact CH2-CG2 4.07Å; W230-V232 HydrophobicContact CZ2-CB 3.9Å; W230-V232 HydrophobicContact CZ2-CG1 4.17Å; W230-V232 HydrophobicContact CZ2-CG2 3.74Å; W230-V232 HydrophobicContact CZ3-CG1 3.9Å; W230-R241 HydrophobicContact CH2-CG 4.3Å; W230-R241 HydrophobicContact CZ2-CB 4.32Å; W230-R241 HydrophobicContact CZ2-CG 4.03Å; W230-M242 HydrophobicContact CH2-CE 4.4Å; W230-M242 HydrophobicContact CH2-SD 3.54Å; W230-M242 VanDerWaalsContact CH2-SD 3.54Å; W230-M242 HydrophobicContact CZ2-SD 4.47Å; W230-M242 HydrophobicContact CZ3-CE 4.48Å; W230-M242 HydrophobicContact CZ3-SD 4.18Å; W230-V245 HydrophobicContact CD2-CG2 4.09Å; W230-V245 HydrophobicContact CE3-CB 4.04Å; W230-V245 HydrophobicContact CE3-CG1 3.64Å; W230-V245 HydrophobicContact CE3-CG2 3.71Å; W230-V245 HydrophobicContact CH2-CB 4.12Å; W230-V245 HydrophobicContact CH2-CG2 3.72Å; W230-V245 HydrophobicContact CZ2-CG2 4.14Å; W230-V245 HydrophobicContact CZ3-CB 3.62Å; W230-V245 HydrophobicContact CZ3-CG1 3.61Å; W230-V245 HydrophobicContact CZ3-CG2 3.52Å; W230-I254 HydrophobicContact CB-CG2 4.19Å; W230-D255 PolarHBondContact N-O 2.73Å; W230-I256 HydrophobicContact CE3-CD1 4.19Å; W230-I256 HydrophobicContact CE3-CG1 4.25Å; W230-I256 HydrophobicContact CE3-CG2 3.84Å; W230-I256 HydrophobicContact CZ3-CG2 4.5Å; W230-I256 CarbonylContact O-C 3.54Å; W230-I256 WeakPolarHBondContact O-CA 3.5Å; W230-Y257 PolarHBondContact O-N 3.39Å; W230-L285 HydrophobicContact CB-CB 4.01Å; W230-L285 HydrophobicContact CB-CD1 4.01Å; W230-L285 HydrophobicContact CB-CG 4.17Å; W230-L285 HydrophobicContact CD2-CD1 4.44Å; W230-L285 HydrophobicContact CG-CB 3.85Å; W230-L285 HydrophobicContact CG-CD1 4.11Å; W230-L285 HydrophobicContact CG-CG 4.4Å
231	F	95.3	Very high	95.9	Very high	28 Å²	28	47.4 Å²	47.4	12%	0.123	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.7	178	-75.8	-115.8	0	0	0	108.7	A229 Y257 C265 C273 F274 L277 Y284	A229-F231 HydrophobicContact CB-CE2 4.35Å; F231-Y257 HydrophobicContact CD1-CG 4.36Å; F231-Y257 HydrophobicContact CD2-CD2 4.06Å; F231-Y257 HydrophobicContact CD2-CG 4.36Å; F231-Y257 HydrophobicContact CE1-CD1 4.32Å; F231-Y257 HydrophobicContact CE1-CD2 4.4Å; F231-Y257 AromaticContact CE1-CG 3.96Å; F231-Y257 HydrophobicContact CE1-CG 3.96Å; F231-Y257 AromaticContact CE2-CD2 3.56Å; F231-Y257 HydrophobicContact CE2-CD2 3.56Å; F231-Y257 HydrophobicContact CE2-CE2 4.06Å; F231-Y257 AromaticContact CE2-CG 3.95Å; F231-Y257 HydrophobicContact CE2-CG 3.95Å; F231-Y257 HydrophobicContact CZ-CD1 4.17Å; F231-Y257 AromaticContact CZ-CD2 3.77Å; F231-Y257 HydrophobicContact CZ-CD2 3.77Å; F231-Y257 HydrophobicContact CZ-CE2 4.2Å; F231-Y257 AromaticContact CZ-CG 3.76Å; F231-Y257 HydrophobicContact CZ-CG 3.76Å; F231-C265 HydrophobicContact CD1-CB 4.23Å; F231-C265 HydrophobicContact CE1-CB 3.8Å; F231-C273 HydrophobicContact CE1-CB 3.65Å; F231-C273 HydrophobicContact CZ-CB 4.05Å; F231-F274 HydrophobicContact CB-CE1 4.16Å; F231-F274 HydrophobicContact CD1-CD1 4.26Å; F231-F274 AromaticContact CD1-CE1 3.74Å; F231-F274 HydrophobicContact CD1-CE1 3.74Å; F231-F274 HydrophobicContact CD1-CZ 4.4Å; F231-F274 HydrophobicContact CD2-CE1 4.33Å; F231-F274 HydrophobicContact CE1-CD1 4.23Å; F231-F274 HydrophobicContact CE1-CE1 4.17Å; F231-F274 HydrophobicContact CG-CD1 4.48Å; F231-F274 AromaticContact CG-CE1 3.81Å; F231-F274 HydrophobicContact CG-CE1 3.81Å; F231-F274 HydrophobicContact CZ-CD1 4.42Å; F231-L277 HydrophobicContact CD2-CD1 4.34Å; F231-L277 HydrophobicContact CD2-CD2 4.21Å; F231-L277 HydrophobicContact CE2-CD1 4.06Å; F231-L277 HydrophobicContact CE2-CD2 3.52Å; F231-L277 HydrophobicContact CE2-CG 3.83Å; F231-L277 HydrophobicContact CZ-CD2 4.37Å; F231-L277 HydrophobicContact CZ-CG 4.32Å; F231-Y284 HydrophobicContact CB-CE2 4.12Å; F231-Y284 HydrophobicContact CD2-CD2 4.34Å; F231-Y284 AromaticContact CD2-CE2 3.7Å; F231-Y284 HydrophobicContact CD2-CE2 3.7Å; F231-Y284 HydrophobicContact CG-CE2 4.25Å
232	V	95.1	Very high	95.9	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.042	29%	0.285	C	S	.	.			trans	-146.9	128.2	-170.4	57.2	0	0	0	0	112	W230 I256 Y257 G258 T259 C260	W230-V232 HydrophobicContact CD2-CB 4.01Å; W230-V232 HydrophobicContact CD2-CG1 3.75Å; W230-V232 HydrophobicContact CE3-CB 4.37Å; W230-V232 HydrophobicContact CE3-CG1 3.68Å; W230-V232 HydrophobicContact CG-CG1 4.39Å; W230-V232 HydrophobicContact CH2-CB 4.33Å; W230-V232 HydrophobicContact CH2-CG1 4.17Å; W230-V232 HydrophobicContact CH2-CG2 4.07Å; W230-V232 HydrophobicContact CZ2-CB 3.9Å; W230-V232 HydrophobicContact CZ2-CG1 4.17Å; W230-V232 HydrophobicContact CZ2-CG2 3.74Å; W230-V232 HydrophobicContact CZ3-CG1 3.9Å; V232-I256 HydrophobicContact CG1-CG2 3.58Å; V232-Y257 PolarHBondContact N-O 2.71Å; V232-G258 CarbonylContact O-C 3.49Å; V232-G258 WeakPolarHBondContact O-CA 3.33Å; V232-T259 PolarHBondContact O-N 2.91Å; V232-C260 HydrophobicContact CG1-CB 3.83Å; V232-C260 HydrophobicContact CG2-CB 4.27Å
233	S	92.4	Very high	95.9	Very high	80 Å²	80	47 Å²	47	56%	0.559	27%	0.265	S	S	*	.			trans	-118.6	-22.7	178.1	57.2	0	0	0	0	113.9	T259	S233-T259 VanDerWaalsContact CA-OG1 3.26Å; S233-T259 WeakPolarHBondContact CA-OG1 3.11Å; S233-T259 PolarHBondContact O-OG1 3.13Å
234	N	93.8	Very high	96.1	Very high	63 Å²	63	44.1 Å²	44.1	34%	0.337	24%	0.235	S	C	.	.			trans	-95.1	100	175.5	171.6	16.7	0	0	0	110.4	Q236 R241	N234-Q236 VanDerWaalsContact C-N 3.31Å; N234-Q236 PolarHBondContact O-N 3.05Å; N234-Q236 PolarHBondContact OD1-N 3.3Å; N234-Q236 VanDerWaalsContact OD1-N 3.17Å; N234-Q236 PolarHBondContact OD1-O 3.41Å; N234-R241 PolarHBondContact O-NH2 3.01Å
235	C	96.1	Very high	96.2	Very high	41 Å²	41	43.4 Å²	43.4	28%	0.277	23%	0.232	S	C	.	.	S	Bend	trans	-84.9	-6.2	-175	-41.6	0	0	0	0	113.7	P237 C260	C235-P237 WeakPolarHBondContact O-CD 3.43Å; C235-C260 WeakPolarHBondContact CA-SG 3.21Å; C235-C260 HydrophobicContact CB-CB 3.86Å; C235-C260 WeakPolarHBondContact CB-SG 3.45Å; C235-C260 PolarHBondContact N-SG 2.87Å; C235-C260 WeakPolarHBondContact SG-CA 3.49Å; C235-C260 WeakPolarHBondContact SG-CB 3.14Å; C235-C260 CovalentContact SG-SG 2.04Å; C235-C260 PolarHBondContact SG-SG 3.44Å
236	Q	95.1	Very high	96.2	Very high	164 Å²	164	46.4 Å²	46.4	77%	0.766	23%	0.228	S	C	*	.	S	Bend	trans	-123.3	58	178	-60.1	-60.6	-30.2	0	0	110.4	N234	N234-Q236 VanDerWaalsContact C-N 3.31Å; N234-Q236 PolarHBondContact O-N 3.05Å; N234-Q236 PolarHBondContact OD1-N 3.3Å; N234-Q236 VanDerWaalsContact OD1-N 3.17Å; N234-Q236 PolarHBondContact OD1-O 3.41Å
237	P	95	Very high	96.3	Very high	21 Å²	21	44.8 Å²	44.8	14%	0.136	22%	0.222	C	C	.	.			trans	-67.6	163	178.9	32.7	-36.4	0	0	0	111.3	C235 S239 R241 M242	C235-P237 WeakPolarHBondContact O-CD 3.43Å; P237-S239 VanDerWaalsContact C-N 3.33Å; P237-R241 HydrophobicContact CB-CG 4.06Å; P237-R241 HydrophobicContact CG-CG 3.52Å; P237-M242 HydrophobicContact CG-CG 3.79Å
238	K	94.7	Very high	96.4	Very high	149 Å²	149	42.9 Å²	42.9	65%	0.648	21%	0.213	S	C	*	.	S	Bend	trans	-84.9	-12.4	171	-59	-61.2	-174.3	-175.1	0	112.3	L169 N289	L169-K238 HydrophobicContact CB-CB 4.34Å; L169-K238 HydrophobicContact CB-CG 4.01Å; L169-K238 HydrophobicContact CD1-CB 3.72Å; L169-K238 HydrophobicContact CD1-CG 4.22Å; K238-N289 PolarHBondContact N-O 2.97Å
239	S	95.6	Very high	96.4	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.063	23%	0.229	C	C	.	.	S	Bend	trans	-86	160.2	171	70	0	0	0	0	112.3	P237 R241 E288 N289	P237-S239 VanDerWaalsContact C-N 3.33Å; S239-R241 PolarHBondContact O-N 2.58Å; S239-R241 VanDerWaalsContact O-N 3.09Å; S239-R241 WeakPolarHBondContact OG-CG 3.39Å; S239-E288 WeakPolarHBondContact CB-O 3.27Å; S239-E288 PolarHBondContact OG-O 3.18Å; S239-N289 PolarHBondContact N-O 3.05Å; S239-N289 PolarHBondContact OG-O 2.97Å
240	P	95.9	Very high	96.4	Very high	23 Å²	23	53.6 Å²	53.6	15%	0.149	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	13.6	177.6	32.8	-36.7	0	0	0	113.9	M242 I243 Y244 L291 M314 I410 F414	P240-M242 VanDerWaalsContact C-N 3.28Å; P240-M242 PolarHBondContact O-N 3.31Å; P240-M242 VanDerWaalsContact O-N 3.15Å; P240-I243 PolarHBondContact O-N 3.41Å; P240-Y244 PolarHBondContact O-N 3.49Å; P240-L291 HydrophobicContact CG-CD1 4.32Å; P240-M314 HydrophobicContact CG-SD 4.17Å; P240-I410 HydrophobicContact CG-CD1 3.83Å; P240-I410 HydrophobicContact CG-CG1 4.14Å; P240-F414 HydrophobicContact CB-CE1 4.08Å
241	R	97	Very high	96.4	Very high	5 Å²	5	57.5 Å²	57.5	2%	0.019	28%	0.276	C	S	.	.	H	α-helix	trans	-57	-35.7	-169.9	69.1	-178.9	-165.3	-171.9	-14.7	114.2	W230 N234 P237 S239 Y244 V245 F287 E288 N289 M314	W230-R241 HydrophobicContact CH2-CG 4.3Å; W230-R241 HydrophobicContact CZ2-CB 4.32Å; W230-R241 HydrophobicContact CZ2-CG 4.03Å; N234-R241 PolarHBondContact O-NH2 3.01Å; P237-R241 HydrophobicContact CB-CG 4.06Å; P237-R241 HydrophobicContact CG-CG 3.52Å; S239-R241 PolarHBondContact O-N 2.58Å; S239-R241 VanDerWaalsContact O-N 3.09Å; S239-R241 WeakPolarHBondContact OG-CG 3.39Å; R241-Y244 PolarHBondContact O-N 3.12Å; R241-V245 WeakPolarHBondContact O-CB 3.39Å; R241-V245 VanDerWaalsContact O-CG2 3.31Å; R241-V245 WeakPolarHBondContact O-CG2 3.46Å; R241-V245 PolarHBondContact O-N 3.24Å; R241-F287 HydrophobicContact CB-CB 3.86Å; R241-F287 HydrophobicContact CB-CD2 3.92Å; R241-F287 HydrophobicContact CB-CG 4.33Å; R241-F287 PolarHBondContact NH1-O 3.22Å; R241-F287 VanDerWaalsContact NH1-O 3.08Å; R241-E288 WeakPolarHBondContact CD-O 3.1Å; R241-N289 PolarHBondContact NH1-OD1 3.41Å; R241-N289 PolarHBondContact NH2-OD1 3.24Å; R241-M314 HydrophobicContact CB-SD 3.98Å
242	M	97.2	Very high	96.6	Very high	57 Å²	57	56.6 Å²	56.6	28%	0.281	27%	0.272	S	S	.	.	H	α-helix	trans	-65.9	-42.1	178.7	-63.1	-55.3	-59.5	0	0	111.5	W230 P237 P240 R246 C260	W230-M242 HydrophobicContact CH2-CE 4.4Å; W230-M242 HydrophobicContact CH2-SD 3.54Å; W230-M242 VanDerWaalsContact CH2-SD 3.54Å; W230-M242 HydrophobicContact CZ2-SD 4.47Å; W230-M242 HydrophobicContact CZ3-CE 4.48Å; W230-M242 HydrophobicContact CZ3-SD 4.18Å; P237-M242 HydrophobicContact CG-CG 3.79Å; P240-M242 VanDerWaalsContact C-N 3.28Å; P240-M242 PolarHBondContact O-N 3.31Å; P240-M242 VanDerWaalsContact O-N 3.15Å; M242-R246 WeakPolarHBondContact O-CB 3.47Å; M242-R246 PolarHBondContact O-N 3.28Å; M242-R246 VanDerWaalsContact O-N 3.1Å; M242-C260 HydrophobicContact CE-CB 4.08Å
243	I	96.3	Very high	96.7	Very high	42 Å²	42	62.9 Å²	62.9	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-69	-43.6	178.8	-63.3	172.5	0	0	0	109.8	P240 R246 E247 W412 F414	P240-I243 PolarHBondContact O-N 3.41Å; I243-R246 PolarHBondContact O-N 3.19Å; I243-E247 PolarHBondContact O-N 3.24Å; I243-E247 VanDerWaalsContact O-N 3.09Å; I243-W412 HydrophobicContact CG2-CH2 4.33Å; I243-W412 HydrophobicContact CG2-CZ3 4.25Å; I243-F414 HydrophobicContact CD1-CD2 4.5Å; I243-F414 HydrophobicContact CD1-CE2 4.09Å; I243-F414 HydrophobicContact CD1-CZ 4.4Å; I243-F414 HydrophobicContact CG2-CD2 4.38Å; I243-F414 HydrophobicContact CG2-CG 4.29Å
244	Y	98.2	Very high	97	Very high	2 Å²	2	60 Å²	60	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-45.1	179.4	-164.8	-79.9	0	0	0	112.2	P240 R241 E247 L248 F287 M314 V333 P339 L342 I410 W412	P240-Y244 PolarHBondContact O-N 3.49Å; R241-Y244 PolarHBondContact O-N 3.12Å; Y244-E247 PolarHBondContact O-N 2.86Å; Y244-L248 HydrophobicContact CE1-CD2 4.39Å; Y244-L248 WeakPolarHBondContact O-CB 3.48Å; Y244-L248 PolarHBondContact O-N 3.24Å; Y244-F287 AromaticContact CD1-CE2 3.77Å; Y244-F287 HydrophobicContact CD1-CE2 3.77Å; Y244-F287 AromaticContact CD1-CZ 3.88Å; Y244-F287 HydrophobicContact CD1-CZ 3.88Å; Y244-F287 HydrophobicContact CE1-CE2 4.42Å; Y244-F287 HydrophobicContact CE1-CZ 4.07Å; Y244-M314 VanDerWaalsContact CB-CE 3.48Å; Y244-M314 HydrophobicContact CD1-CE 3.79Å; Y244-M314 HydrophobicContact CD2-CE 3.38Å; Y244-M314 HydrophobicContact CE1-CE 4.37Å; Y244-M314 HydrophobicContact CE2-CE 4.02Å; Y244-M314 HydrophobicContact CG-CE 3.26Å; Y244-V333 HydrophobicContact CD1-CG1 4.49Å; Y244-V333 HydrophobicContact CE1-CB 4.42Å; Y244-V333 HydrophobicContact CE1-CG1 3.73Å; Y244-V333 HydrophobicContact CE2-CB 4.14Å; Y244-V333 HydrophobicContact CE2-CG1 4.28Å; Y244-P339 HydrophobicContact CD1-CG 4.45Å; Y244-P339 HydrophobicContact CD2-CG 4.12Å; Y244-P339 HydrophobicContact CE1-CB 4.28Å; Y244-P339 HydrophobicContact CE1-CG 4.16Å; Y244-P339 HydrophobicContact CE2-CG 3.8Å; Y244-P339 HydrophobicContact CG-CG 4.43Å; Y244-L342 HydrophobicContact CE1-CD2 3.84Å; Y244-L342 WeakPolarHBondContact OH-CD2 3.35Å; Y244-I410 HydrophobicContact CD2-CD1 3.61Å; Y244-I410 HydrophobicContact CE2-CD1 4.08Å; Y244-W412 HydrophobicContact CD2-CD2 4.33Å; Y244-W412 AromaticContact CD2-CE3 3.5Å; Y244-W412 HydrophobicContact CD2-CE3 3.5Å; Y244-W412 AromaticContact CD2-CZ3 3.93Å; Y244-W412 HydrophobicContact CD2-CZ3 3.93Å; Y244-W412 HydrophobicContact CE2-CB 4.23Å; Y244-W412 HydrophobicContact CE2-CD2 4.37Å; Y244-W412 AromaticContact CE2-CE3 3.98Å; Y244-W412 HydrophobicContact CE2-CE3 3.98Å; Y244-W412 HydrophobicContact CG-CE3 4.44Å; Y244-W412 HydrophobicContact CG-CZ3 4.46Å
245	V	98.2	Very high	97.2	Very high	3 Å²	3	58 Å²	58	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-64.4	-42.7	177.5	173.2	0	0	0	0	111.1	W230 R241 E247 L248 S249 I254 I256 L285 F287	W230-V245 HydrophobicContact CD2-CG2 4.09Å; W230-V245 HydrophobicContact CE3-CB 4.04Å; W230-V245 HydrophobicContact CE3-CG1 3.64Å; W230-V245 HydrophobicContact CE3-CG2 3.71Å; W230-V245 HydrophobicContact CH2-CB 4.12Å; W230-V245 HydrophobicContact CH2-CG2 3.72Å; W230-V245 HydrophobicContact CZ2-CG2 4.14Å; W230-V245 HydrophobicContact CZ3-CB 3.62Å; W230-V245 HydrophobicContact CZ3-CG1 3.61Å; W230-V245 HydrophobicContact CZ3-CG2 3.52Å; R241-V245 WeakPolarHBondContact O-CB 3.39Å; R241-V245 VanDerWaalsContact O-CG2 3.31Å; R241-V245 WeakPolarHBondContact O-CG2 3.46Å; R241-V245 PolarHBondContact O-N 3.24Å; V245-E247 PolarHBondContact O-N 3.46Å; V245-L248 PolarHBondContact O-N 3.41Å; V245-S249 WeakPolarHBondContact O-CB 3.38Å; V245-S249 PolarHBondContact O-N 2.77Å; V245-S249 PolarHBondContact O-OG 3.41Å; V245-I254 HydrophobicContact CG1-CD1 3.98Å; V245-I256 HydrophobicContact CG1-CD1 3.97Å; V245-L285 HydrophobicContact CG1-CD1 4.49Å; V245-L285 HydrophobicContact CG2-CD1 3.65Å; V245-F287 HydrophobicContact CG2-CD2 3.61Å; V245-F287 HydrophobicContact CG2-CE2 3.45Å; V245-F287 VanDerWaalsContact CG2-CE2 3.45Å
246	R	97.2	Very high	97.2	Very high	162 Å²	162	57.5 Å²	57.5	61%	0.611	26%	0.263	S	S	*	.	H	α-helix	trans	-55.6	-42.2	176	-177.3	178.8	65.9	-144.2	2.7	111.9	M242 I243	M242-R246 WeakPolarHBondContact O-CB 3.47Å; M242-R246 PolarHBondContact O-N 3.28Å; M242-R246 VanDerWaalsContact O-N 3.1Å; I243-R246 PolarHBondContact O-N 3.19Å
247	E	98	Very high	97.3	Very high	40 Å²	40	50.9 Å²	50.9	19%	0.187	23%	0.231	C	C	.	.	H	α-helix	trans	-72.2	-43.5	177.2	-172.5	61	-165.6	0	0	112	I243 Y244 V245 S249 R250 Y251 P339 W412	I243-E247 PolarHBondContact O-N 3.24Å; I243-E247 VanDerWaalsContact O-N 3.09Å; Y244-E247 PolarHBondContact O-N 2.86Å; V245-E247 PolarHBondContact O-N 3.46Å; E247-S249 VanDerWaalsContact C-N 3.28Å; E247-S249 PolarHBondContact O-N 2.79Å; E247-R250 WeakPolarHBondContact O-CB 2.87Å; E247-R250 WeakPolarHBondContact O-CG 2.81Å; E247-R250 PolarHBondContact O-N 2.78Å; E247-R250 VanDerWaalsContact O-N 3.13Å; E247-R250 IonicContact OE1-CZ 3.92Å; E247-R250 IonicContact OE1-NH1 3.01Å; E247-R250 PolarHBondContact OE1-NH1 2.03Å; E247-R250 WeakPolarHBondContact OE2-CD 3.18Å; E247-R250 IonicContact OE2-CZ 2.73Å; E247-R250 IonicContact OE2-NE 2.98Å; E247-R250 IonicContact OE2-NH1 3.86Å; E247-R250 PolarHBondContact OE2-NH1 3.39Å; E247-Y251 HydrophobicContact CG-CE2 4.19Å; E247-Y251 VanDerWaalsContact O-CD2 3.25Å; E247-Y251 WeakPolarHBondContact O-CD2 3.12Å; E247-Y251 WeakPolarHBondContact O-CE2 3.37Å; E247-Y251 PolarHBondContact OE1-OH 3.41Å; E247-P339 HydrophobicContact CB-CB 4.39Å; E247-P339 HydrophobicContact CB-CG 4.13Å; E247-P339 HydrophobicContact CG-CB 4.1Å; E247-P339 HydrophobicContact CG-CG 3.88Å; E247-W412 HydrophobicContact CB-CH2 3.74Å; E247-W412 HydrophobicContact CB-CZ2 4.17Å; E247-W412 HydrophobicContact CG-CH2 3.88Å; E247-W412 HydrophobicContact CG-CZ2 3.76Å
248	L	98.6	Very high	97.2	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59	-39.3	177.4	-173	62.8	0	0	0	112	Y244 V245 R250 Y251 I252 I254 L285 P339 L342 A343	Y244-L248 HydrophobicContact CE1-CD2 4.39Å; Y244-L248 WeakPolarHBondContact O-CB 3.48Å; Y244-L248 PolarHBondContact O-N 3.24Å; V245-L248 PolarHBondContact O-N 3.41Å; L248-R250 PolarHBondContact O-N 3.07Å; L248-Y251 PolarHBondContact O-N 2.92Å; L248-I252 HydrophobicContact CD1-CG2 3.93Å; L248-I252 HydrophobicContact CG-CG2 3.81Å; L248-I252 PolarHBondContact O-N 3.44Å; L248-I254 HydrophobicContact CB-CD1 3.99Å; L248-I254 HydrophobicContact CD2-CD1 3.79Å; L248-I254 HydrophobicContact CG-CD1 3.8Å; L248-L285 HydrophobicContact CD2-CD1 4.41Å; L248-L285 HydrophobicContact CD2-CD2 4.32Å; L248-P339 HydrophobicContact CB-CB 4.09Å; L248-P339 HydrophobicContact CD1-CB 4.06Å; L248-P339 WeakPolarHBondContact CD1-O 3.28Å; L248-L342 HydrophobicContact CD1-CB 4.44Å; L248-L342 HydrophobicContact CD1-CD2 4.11Å; L248-L342 HydrophobicContact CD1-CG 4.26Å; L248-L342 HydrophobicContact CD2-CD2 4.15Å; L248-A343 HydrophobicContact CD1-CB 3.95Å
249	S	98.2	Very high	97.1	Very high	52 Å²	52	49.2 Å²	49.2	36%	0.364	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.9	177.9	-69.7	0	0	0	0	114.2	V245 E247 Y251 I252	V245-S249 WeakPolarHBondContact O-CB 3.38Å; V245-S249 PolarHBondContact O-N 2.77Å; V245-S249 PolarHBondContact O-OG 3.41Å; E247-S249 VanDerWaalsContact C-N 3.28Å; E247-S249 PolarHBondContact O-N 2.79Å; S249-Y251 VanDerWaalsContact C-N 3.26Å; S249-Y251 PolarHBondContact O-N 3.26Å; S249-I252 WeakPolarHBondContact CA-O 3.43Å
250	R	98.3	Very high	97.1	Very high	174 Å²	174	50.2 Å²	50.2	66%	0.657	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-22.3	175.4	-58.9	173	69.2	-173.8	1.2	112.5	E247 L248	E247-R250 WeakPolarHBondContact O-CB 2.87Å; E247-R250 WeakPolarHBondContact O-CG 2.81Å; E247-R250 PolarHBondContact O-N 2.78Å; E247-R250 VanDerWaalsContact O-N 3.13Å; E247-R250 IonicContact OE1-CZ 3.92Å; E247-R250 IonicContact OE1-NH1 3.01Å; E247-R250 PolarHBondContact OE1-NH1 2.03Å; E247-R250 WeakPolarHBondContact OE2-CD 3.18Å; E247-R250 IonicContact OE2-CZ 2.73Å; E247-R250 IonicContact OE2-NE 2.98Å; E247-R250 IonicContact OE2-NH1 3.86Å; E247-R250 PolarHBondContact OE2-NH1 3.39Å; L248-R250 PolarHBondContact O-N 3.07Å
251	Y	98.6	Very high	97.1	Very high	86 Å²	86	50.4 Å²	50.4	34%	0.337	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-22.8	-171.5	-55.3	-73.1	0	0	0	112.9	E247 L248 S249 A340 A343 K347	E247-Y251 HydrophobicContact CG-CE2 4.19Å; E247-Y251 VanDerWaalsContact O-CD2 3.25Å; E247-Y251 WeakPolarHBondContact O-CD2 3.12Å; E247-Y251 WeakPolarHBondContact O-CE2 3.37Å; E247-Y251 PolarHBondContact OE1-OH 3.41Å; L248-Y251 PolarHBondContact O-N 2.92Å; S249-Y251 VanDerWaalsContact C-N 3.26Å; S249-Y251 PolarHBondContact O-N 3.26Å; Y251-A340 HydrophobicContact CD1-CB 3.93Å; Y251-A340 HydrophobicContact CD2-CB 3.95Å; Y251-A340 HydrophobicContact CE1-CB 3.78Å; Y251-A340 HydrophobicContact CE2-CB 3.8Å; Y251-A340 HydrophobicContact CG-CB 4.01Å; Y251-A343 VanDerWaalsContact CB-CB 3.45Å; Y251-K347 WeakPolarHBondContact O-CE 3.07Å; Y251-K347 PolarHBondContact O-NZ 2.85Å
252	I	98.5	Very high	97	Very high	9 Å²	9	56.6 Å²	56.6	5%	0.046	29%	0.289	C	S	.	.	S	Bend	trans	-148	142.8	-179.3	-170.9	165.3	0	0	0	109.9	M227 V228 L248 S249 I254 A343 L346	M227-I252 HydrophobicContact CB-CD1 4.17Å; M227-I252 HydrophobicContact CB-CG1 4.39Å; M227-I252 HydrophobicContact CE-CD1 3.48Å; M227-I252 VanDerWaalsContact CE-CD1 3.48Å; M227-I252 HydrophobicContact CE-CG1 4.2Å; M227-I252 HydrophobicContact SD-CD1 3.73Å; M227-I252 HydrophobicContact SD-CG1 3.78Å; V228-I252 HydrophobicContact CG2-CD1 3.69Å; V228-I252 HydrophobicContact CG2-CG1 4.12Å; L248-I252 HydrophobicContact CD1-CG2 3.93Å; L248-I252 HydrophobicContact CG-CG2 3.81Å; L248-I252 PolarHBondContact O-N 3.44Å; S249-I252 WeakPolarHBondContact CA-O 3.43Å; I252-I254 HydrophobicContact CG2-CG1 4.26Å; I252-I254 PolarHBondContact O-N 2.91Å; I252-A343 HydrophobicContact CB-CB 4.02Å; I252-A343 HydrophobicContact CG2-CB 3.94Å; I252-L346 HydrophobicContact CD1-CB 3.76Å; I252-L346 HydrophobicContact CD1-CD1 4.1Å
253	Q	97.6	Very high	96.9	Very high	139 Å²	139	56.6 Å²	56.6	65%	0.65	29%	0.29	S	S	*	.			trans	-66.5	132.5	174.9	-178.9	-179.9	-20.1	0	0	110.2	D255	Q253-D255 PolarHBondContact NE2-OD1 3.11Å
254	I	98.5	Very high	96.7	Very high	19 Å²	19	60 Å²	60	10%	0.097	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	118.8	177.1	-53.8	174.2	0	0	0	108.1	V228 W230 V245 L248 I252 I256 L285	V228-I254 HydrophobicContact CB-CG1 4.14Å; V228-I254 HydrophobicContact CB-CG2 4.46Å; V228-I254 HydrophobicContact CG1-CG1 4.15Å; V228-I254 HydrophobicContact CG1-CG2 4.05Å; W230-I254 HydrophobicContact CB-CG2 4.19Å; V245-I254 HydrophobicContact CG1-CD1 3.98Å; L248-I254 HydrophobicContact CB-CD1 3.99Å; L248-I254 HydrophobicContact CD2-CD1 3.79Å; L248-I254 HydrophobicContact CG-CD1 3.8Å; I252-I254 HydrophobicContact CG2-CG1 4.26Å; I252-I254 PolarHBondContact O-N 2.91Å; I254-I256 HydrophobicContact CB-CG1 4.48Å; I254-I256 HydrophobicContact CG2-CG1 3.88Å; I254-I256 PolarHBondContact O-N 3.39Å; I254-L285 HydrophobicContact CD1-CD1 4.23Å; I254-L285 HydrophobicContact CG2-CD1 4.15Å
255	D	97.7	Very high	96.3	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.112	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	110.9	174.6	-75.6	3.7	0	0	0	108.5	K226 V228 A229 W230 Q253 Y257 L263 Y281	K226-D255 IonicContact NZ-OD2 3.77Å; K226-D255 PolarHBondContact NZ-OD2 2.9Å; V228-D255 PolarHBondContact O-N 3.24Å; A229-D255 WeakPolarHBondContact CA-O 3.47Å; W230-D255 PolarHBondContact N-O 2.73Å; Q253-D255 PolarHBondContact NE2-OD1 3.11Å; D255-Y257 HydrophobicContact CB-CE2 4.08Å; D255-L263 HydrophobicContact CB-CD1 3.58Å; D255-Y281 HydrophobicContact CB-CE1 3.77Å; D255-Y281 VanDerWaalsContact CB-OH 3.22Å; D255-Y281 WeakPolarHBondContact CB-OH 2.98Å; D255-Y281 PolarHBondContact OD2-OH 3.39Å
256	I	97.5	Very high	95.8	Very high	31 Å²	31	63.6 Å²	63.6	16%	0.159	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	115	-173.3	-50.5	176.8	0	0	0	109.9	W230 V232 V245 I254 G261 T262 L263	W230-I256 HydrophobicContact CE3-CD1 4.19Å; W230-I256 HydrophobicContact CE3-CG1 4.25Å; W230-I256 HydrophobicContact CE3-CG2 3.84Å; W230-I256 HydrophobicContact CZ3-CG2 4.5Å; W230-I256 CarbonylContact O-C 3.54Å; W230-I256 WeakPolarHBondContact O-CA 3.5Å; V232-I256 HydrophobicContact CG1-CG2 3.58Å; V245-I256 HydrophobicContact CG1-CD1 3.97Å; I254-I256 HydrophobicContact CB-CG1 4.48Å; I254-I256 HydrophobicContact CG2-CG1 3.88Å; I254-I256 PolarHBondContact O-N 3.39Å; I256-G261 WeakPolarHBondContact O-CA 3.4Å; I256-T262 PolarHBondContact O-N 2.9Å; I256-L263 WeakPolarHBondContact O-CB 3.29Å; I256-L263 PolarHBondContact O-N 3.49Å; I256-L263 VanDerWaalsContact O-N 3.07Å
257	Y	95.7	Very high	95	Very high	25 Å²	25	65.5 Å²	65.5	10%	0.098	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	144.2	178.4	-67.1	-98.9	0	0	0	111.7	W230 F231 V232 D255 L263 C265 Y281	W230-Y257 PolarHBondContact O-N 3.39Å; F231-Y257 HydrophobicContact CD1-CG 4.36Å; F231-Y257 HydrophobicContact CD2-CD2 4.06Å; F231-Y257 HydrophobicContact CD2-CG 4.36Å; F231-Y257 HydrophobicContact CE1-CD1 4.32Å; F231-Y257 HydrophobicContact CE1-CD2 4.4Å; F231-Y257 AromaticContact CE1-CG 3.96Å; F231-Y257 HydrophobicContact CE1-CG 3.96Å; F231-Y257 AromaticContact CE2-CD2 3.56Å; F231-Y257 HydrophobicContact CE2-CD2 3.56Å; F231-Y257 HydrophobicContact CE2-CE2 4.06Å; F231-Y257 AromaticContact CE2-CG 3.95Å; F231-Y257 HydrophobicContact CE2-CG 3.95Å; F231-Y257 HydrophobicContact CZ-CD1 4.17Å; F231-Y257 AromaticContact CZ-CD2 3.77Å; F231-Y257 HydrophobicContact CZ-CD2 3.77Å; F231-Y257 HydrophobicContact CZ-CE2 4.2Å; F231-Y257 AromaticContact CZ-CG 3.76Å; F231-Y257 HydrophobicContact CZ-CG 3.76Å; V232-Y257 PolarHBondContact N-O 2.71Å; D255-Y257 HydrophobicContact CB-CE2 4.08Å; Y257-L263 CarbonylContact C-O 3.55Å; Y257-L263 VanDerWaalsContact CA-O 3.31Å; Y257-L263 WeakPolarHBondContact CA-O 3.16Å; Y257-L263 HydrophobicContact CD1-CB 3.52Å; Y257-L263 HydrophobicContact CD1-CD1 4.41Å; Y257-L263 HydrophobicContact CD2-CB 4.31Å; Y257-L263 HydrophobicContact CD2-CD1 4.08Å; Y257-L263 HydrophobicContact CE1-CB 3.7Å; Y257-L263 HydrophobicContact CE1-CD1 3.99Å; Y257-L263 HydrophobicContact CE1-CG 4.46Å; Y257-L263 HydrophobicContact CE2-CB 4.45Å; Y257-L263 HydrophobicContact CE2-CD1 3.62Å; Y257-L263 HydrophobicContact CG-CB 3.86Å; Y257-L263 HydrophobicContact CG-CD1 4.46Å; Y257-C265 HydrophobicContact CD1-CB 4.21Å; Y257-Y281 WeakPolarHBondContact CE2-OH 3.24Å; Y257-Y281 PolarHBondContact OH-OH 2.62Å
258	G	93.6	Very high	94.4	Very high	23 Å²	23	71.2 Å²	71.2	24%	0.237	37%	0.371	C	S	.	.	S	Bend	trans	102	-172.1	176.5	0	0	0	0	0	112.8	V232 C260 G261 L263	V232-G258 CarbonylContact O-C 3.49Å; V232-G258 WeakPolarHBondContact O-CA 3.33Å; G258-C260 PolarHBondContact O-N 3.22Å; G258-C260 VanDerWaalsContact O-N 3.08Å; G258-G261 PolarHBondContact O-N 2.81Å; G258-L263 PolarHBondContact N-O 3.45Å
259	T	93.2	Very high	93.8	Very high	111 Å²	111	73.6 Å²	73.6	68%	0.681	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.8	-169.6	52.8	0	0	0	0	114.6	V232 S233	V232-T259 PolarHBondContact O-N 2.91Å; S233-T259 VanDerWaalsContact CA-OG1 3.26Å; S233-T259 WeakPolarHBondContact CA-OG1 3.11Å; S233-T259 PolarHBondContact O-OG1 3.13Å
260	C	95.9	Very high	93.2	Very high	30 Å²	30	74.3 Å²	74.3	20%	0.203	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	0.8	177.1	-37.6	0	0	0	0	113.4	V232 C235 M242 G258	V232-C260 HydrophobicContact CG1-CB 3.83Å; V232-C260 HydrophobicContact CG2-CB 4.27Å; C235-C260 WeakPolarHBondContact CA-SG 3.21Å; C235-C260 HydrophobicContact CB-CB 3.86Å; C235-C260 WeakPolarHBondContact CB-SG 3.45Å; C235-C260 PolarHBondContact N-SG 2.87Å; C235-C260 WeakPolarHBondContact SG-CA 3.49Å; C235-C260 WeakPolarHBondContact SG-CB 3.14Å; C235-C260 CovalentContact SG-SG 2.04Å; C235-C260 PolarHBondContact SG-SG 3.44Å; M242-C260 HydrophobicContact CE-CB 4.08Å; G258-C260 PolarHBondContact O-N 3.22Å; G258-C260 VanDerWaalsContact O-N 3.08Å
261	G	94.7	Very high	92.5	Very high	27 Å²	27	70 Å²	70	28%	0.278	37%	0.373	S	S	.	.	S	Bend	trans	-121.3	-172	-180	0	0	0	0	0	112.4	I256 G258	I256-G261 WeakPolarHBondContact O-CA 3.4Å; G258-G261 PolarHBondContact O-N 2.81Å
262	T	95.1	Very high	92	Very high	135 Å²	135	72.1 Å²	72.1	83%	0.828	39%	0.386	S	S	*	.	S	Bend	trans	-101.7	-15.8	177.9	54.2	0	0	0	0	112.6	I256	I256-T262 PolarHBondContact O-N 2.9Å
263	L	95.5	Very high	91.6	Very high	57 Å²	57	72.1 Å²	72.1	30%	0.298	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-94.6	145.6	178	-55.9	175.1	0	0	0	110.2	D255 I256 Y257 G258	D255-L263 HydrophobicContact CB-CD1 3.58Å; I256-L263 WeakPolarHBondContact O-CB 3.29Å; I256-L263 PolarHBondContact O-N 3.49Å; I256-L263 VanDerWaalsContact O-N 3.07Å; Y257-L263 CarbonylContact C-O 3.55Å; Y257-L263 VanDerWaalsContact CA-O 3.31Å; Y257-L263 WeakPolarHBondContact CA-O 3.16Å; Y257-L263 HydrophobicContact CD1-CB 3.52Å; Y257-L263 HydrophobicContact CD1-CD1 4.41Å; Y257-L263 HydrophobicContact CD2-CB 4.31Å; Y257-L263 HydrophobicContact CD2-CD1 4.08Å; Y257-L263 HydrophobicContact CE1-CB 3.7Å; Y257-L263 HydrophobicContact CE1-CD1 3.99Å; Y257-L263 HydrophobicContact CE1-CG 4.46Å; Y257-L263 HydrophobicContact CE2-CB 4.45Å; Y257-L263 HydrophobicContact CE2-CD1 3.62Å; Y257-L263 HydrophobicContact CG-CB 3.86Å; Y257-L263 HydrophobicContact CG-CD1 4.46Å; G258-L263 PolarHBondContact N-O 3.45Å
264	T	92.2	Very high	91.1	Very high	113 Å²	113	65.7 Å²	65.7	69%	0.693	36%	0.356	S	S	*	.			trans	-103	135.5	-177.9	-54.5	0	0	0	0	110.3	P266	T264-P266 HydrophobicContact CG2-CG 4.04Å
265	C	90.3	Very high	90.6	Very high	22 Å²	22	66.7 Å²	66.7	15%	0.149	37%	0.365	C	S	.	.			trans	-134.9	100	161.4	176.5	0	0	0	0	107.8	F231 Y257 C273	F231-C265 HydrophobicContact CD1-CB 4.23Å; F231-C265 HydrophobicContact CE1-CB 3.8Å; Y257-C265 HydrophobicContact CD1-CB 4.21Å; C265-C273 VanDerWaalsContact CA-SG 3.53Å; C265-C273 HydrophobicContact CB-CB 3.84Å; C265-C273 WeakPolarHBondContact CB-SG 3.35Å; C265-C273 WeakPolarHBondContact SG-CB 3.17Å; C265-C273 CovalentContact SG-SG 2.03Å; C265-C273 PolarHBondContact SG-SG 2.94Å
266	P	86.9	Confident	90.1	Very high	59 Å²	59	68.7 Å²	68.7	38%	0.383	38%	0.375	S	S	.	.			trans	-64.7	149.6	176.5	-17	31.2	0	0	0	110.9	T264 E268 V269 E270	T264-P266 HydrophobicContact CG2-CG 4.04Å; P266-E268 WeakPolarHBondContact CB-OE2 3.46Å; P266-E268 PolarHBondContact O-N 2.82Å; P266-V269 HydrophobicContact CB-CG2 4.09Å; P266-V269 HydrophobicContact CG-CG2 4.07Å; P266-V269 PolarHBondContact O-N 2.84Å; P266-E270 PolarHBondContact O-N 2.89Å
267	R	81.3	Confident	89.7	Confident	202 Å²	202	67.2 Å²	67.2	76%	0.762	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-65	-32.1	-176.8	-73.8	-174.8	175.4	179.6	-1	112.1	V269 E270	R267-V269 PolarHBondContact O-N 3.37Å; R267-E270 WeakPolarHBondContact O-CB 3.37Å; R267-E270 PolarHBondContact O-N 3.21Å
268	E	84.3	Confident	89.3	Confident	161 Å²	161	67 Å²	67	75%	0.752	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-65	-20.8	-177.9	-55.5	73.9	-159.7	0	0	112.3	P266	P266-E268 WeakPolarHBondContact CB-OE2 3.46Å; P266-E268 PolarHBondContact O-N 2.82Å
269	V	86.3	Confident	89.3	Confident	50 Å²	50	71.8 Å²	71.8	30%	0.303	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-125.9	23	179.7	-62.5	0	0	0	0	111.9	P266 R267 D271 Q272 C273	P266-V269 HydrophobicContact CB-CG2 4.09Å; P266-V269 HydrophobicContact CG-CG2 4.07Å; P266-V269 PolarHBondContact O-N 2.84Å; R267-V269 PolarHBondContact O-N 3.37Å; V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 3.41Å; V269-Q272 HydrophobicContact CB-CB 4.37Å; V269-Q272 HydrophobicContact CB-CG 4.41Å; V269-Q272 WeakPolarHBondContact O-CA 3.4Å; V269-Q272 WeakPolarHBondContact O-CB 3.21Å; V269-Q272 PolarHBondContact O-N 2.92Å; V269-C273 PolarHBondContact O-N 3.11Å; V269-C273 VanDerWaalsContact O-N 3.11Å; V269-C273 PolarHBondContact O-SG 3.15Å
270	E	84.7	Confident	89.5	Confident	66 Å²	66	70 Å²	70	31%	0.308	37%	0.371	S	S	.	.	H	α-helix	trans	-55.2	-45.6	-173.7	-175.9	-177.4	-115.1	0	0	112.3	P266 R267 Q272 C273 F274 R302	P266-E270 PolarHBondContact O-N 2.89Å; R267-E270 WeakPolarHBondContact O-CB 3.37Å; R267-E270 PolarHBondContact O-N 3.21Å; E270-Q272 PolarHBondContact O-N 3.49Å; E270-C273 WeakPolarHBondContact O-CB 3.48Å; E270-C273 PolarHBondContact O-N 3.41Å; E270-F274 VanDerWaalsContact CD-CE2 3.42Å; E270-F274 HydrophobicContact CG-CD2 3.69Å; E270-F274 HydrophobicContact CG-CE2 3.3Å; E270-F274 HydrophobicContact CG-CZ 4.02Å; E270-F274 PolarHBondContact O-N 2.72Å; E270-R302 IonicContact OE2-CZ 2.68Å; E270-R302 VanDerWaalsContact OE2-CZ 3.29Å; E270-R302 IonicContact OE2-NH1 2.76Å; E270-R302 PolarHBondContact OE2-NH1 3.06Å; E270-R302 IonicContact OE2-NH2 3.29Å; E270-R302 PolarHBondContact OE2-NH2 3.34Å
271	D	85.2	Confident	89.6	Confident	85 Å²	85	68.7 Å²	68.7	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-34.2	178.4	-71.8	-24.8	0	0	0	112.2	V269 F274 S275 R302	V269-D271 VanDerWaalsContact C-N 3.32Å; V269-D271 PolarHBondContact O-N 3.41Å; D271-F274 PolarHBondContact O-N 3.36Å; D271-S275 PolarHBondContact O-N 3.47Å; D271-R302 IonicContact OD1-CZ 3.99Å; D271-R302 IonicContact OD1-NH2 3.8Å; D271-R302 PolarHBondContact OD1-NH2 3.47Å
272	Q	88	Confident	89.7	Confident	129 Å²	129	68.1 Å²	68.1	60%	0.603	35%	0.352	S	S	*	.	H	α-helix	trans	-68.2	-41.8	175.9	-57.5	174.7	9.8	0	0	110.5	V269 E270 S275 L276	V269-Q272 HydrophobicContact CB-CB 4.37Å; V269-Q272 HydrophobicContact CB-CG 4.41Å; V269-Q272 WeakPolarHBondContact O-CA 3.4Å; V269-Q272 WeakPolarHBondContact O-CB 3.21Å; V269-Q272 PolarHBondContact O-N 2.92Å; E270-Q272 PolarHBondContact O-N 3.49Å; Q272-S275 WeakPolarHBondContact O-CB 3.15Å; Q272-S275 PolarHBondContact O-N 3.2Å; Q272-S275 PolarHBondContact O-OG 2.98Å; Q272-L276 PolarHBondContact O-N 2.94Å
273	C	89.8	Confident	89.9	Confident	10 Å²	10	61.7 Å²	61.7	7%	0.068	31%	0.312	C	S	.	.	H	α-helix	trans	-63.7	-43	174.8	-51.2	0	0	0	0	112.1	F231 C265 V269 E270 S275 L276	F231-C273 HydrophobicContact CE1-CB 3.65Å; F231-C273 HydrophobicContact CZ-CB 4.05Å; C265-C273 VanDerWaalsContact CA-SG 3.53Å; C265-C273 HydrophobicContact CB-CB 3.84Å; C265-C273 WeakPolarHBondContact CB-SG 3.35Å; C265-C273 WeakPolarHBondContact SG-CB 3.17Å; C265-C273 CovalentContact SG-SG 2.03Å; C265-C273 PolarHBondContact SG-SG 2.94Å; V269-C273 PolarHBondContact O-N 3.11Å; V269-C273 VanDerWaalsContact O-N 3.11Å; V269-C273 PolarHBondContact O-SG 3.15Å; E270-C273 WeakPolarHBondContact O-CB 3.48Å; E270-C273 PolarHBondContact O-N 3.41Å; C273-S275 PolarHBondContact O-N 2.94Å; C273-L276 WeakPolarHBondContact O-CA 3.5Å; C273-L276 WeakPolarHBondContact O-CB 3.32Å; C273-L276 PolarHBondContact O-N 3.44Å
274	F	86.9	Confident	90.1	Very high	4 Å²	4	59 Å²	59	2%	0.018	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-33	177.3	-73.7	-43	0	0	0	111.6	F231 E270 D271 L276 L277 N303 Q307	F231-F274 HydrophobicContact CB-CE1 4.16Å; F231-F274 HydrophobicContact CD1-CD1 4.26Å; F231-F274 AromaticContact CD1-CE1 3.74Å; F231-F274 HydrophobicContact CD1-CE1 3.74Å; F231-F274 HydrophobicContact CD1-CZ 4.4Å; F231-F274 HydrophobicContact CD2-CE1 4.33Å; F231-F274 HydrophobicContact CE1-CD1 4.23Å; F231-F274 HydrophobicContact CE1-CE1 4.17Å; F231-F274 HydrophobicContact CG-CD1 4.48Å; F231-F274 AromaticContact CG-CE1 3.81Å; F231-F274 HydrophobicContact CG-CE1 3.81Å; F231-F274 HydrophobicContact CZ-CD1 4.42Å; E270-F274 VanDerWaalsContact CD-CE2 3.42Å; E270-F274 HydrophobicContact CG-CD2 3.69Å; E270-F274 HydrophobicContact CG-CE2 3.3Å; E270-F274 HydrophobicContact CG-CZ 4.02Å; E270-F274 PolarHBondContact O-N 2.72Å; D271-F274 PolarHBondContact O-N 3.36Å; F274-L276 PolarHBondContact O-N 3.3Å; F274-L277 HydrophobicContact CD1-CD1 3.58Å; F274-L277 HydrophobicContact CD1-CG 4.44Å; F274-L277 HydrophobicContact CE1-CD1 4.24Å; F274-L277 WeakPolarHBondContact O-CB 3.29Å; F274-L277 PolarHBondContact O-N 3.43Å; F274-N303 HydrophobicContact CD1-CB 4.44Å; F274-N303 HydrophobicContact CE1-CB 4Å; F274-N303 HydrophobicContact CZ-CB 4.3Å; F274-N303 VanDerWaalsContact CZ-CG 3.45Å; F274-N303 WeakPolarHBondContact CZ-ND2 3.3Å; F274-N303 WeakPolarHBondContact CZ-OD1 3.31Å; F274-Q307 HydrophobicContact CB-CG 4.24Å; F274-Q307 PolarHBondContact O-OE1 3.25Å
275	S	87.2	Confident	90.4	Very high	39 Å²	39	53.6 Å²	53.6	27%	0.273	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-26.9	171.2	88.3	0	0	0	0	113.3	D271 Q272 C273 L277 G278 K279	D271-S275 PolarHBondContact O-N 3.47Å; Q272-S275 WeakPolarHBondContact O-CB 3.15Å; Q272-S275 PolarHBondContact O-N 3.2Å; Q272-S275 PolarHBondContact O-OG 2.98Å; C273-S275 PolarHBondContact O-N 2.94Å; S275-L277 VanDerWaalsContact C-N 3.32Å; S275-G278 PolarHBondContact O-N 2.91Å; S275-K279 WeakPolarHBondContact O-CG 3.32Å; S275-K279 PolarHBondContact O-N 2.82Å
276	L	87	Confident	90.8	Very high	64 Å²	64	52.6 Å²	52.6	34%	0.335	26%	0.259	S	S	.	.	H	α-helix	trans	-69.6	-29.6	174.1	-56.5	174.5	0	0	0	111.9	Q272 C273 F274 K279 H280	Q272-L276 PolarHBondContact O-N 2.94Å; C273-L276 WeakPolarHBondContact O-CA 3.5Å; C273-L276 WeakPolarHBondContact O-CB 3.32Å; C273-L276 PolarHBondContact O-N 3.44Å; F274-L276 PolarHBondContact O-N 3.3Å; L276-K279 PolarHBondContact O-N 2.81Å; L276-H280 PolarHBondContact O-N 2.65Å
277	L	89	Confident	91.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.4	-54.8	172.7	-69	178.2	0	0	0	110.1	A229 F231 F274 S275 K279 H280 Y281 Y284 N303 Q307 V309	A229-L277 HydrophobicContact CB-CD2 3.27Å; F231-L277 HydrophobicContact CD2-CD1 4.34Å; F231-L277 HydrophobicContact CD2-CD2 4.21Å; F231-L277 HydrophobicContact CE2-CD1 4.06Å; F231-L277 HydrophobicContact CE2-CD2 3.52Å; F231-L277 HydrophobicContact CE2-CG 3.83Å; F231-L277 HydrophobicContact CZ-CD2 4.37Å; F231-L277 HydrophobicContact CZ-CG 4.32Å; F274-L277 HydrophobicContact CD1-CD1 3.58Å; F274-L277 HydrophobicContact CD1-CG 4.44Å; F274-L277 HydrophobicContact CE1-CD1 4.24Å; F274-L277 WeakPolarHBondContact O-CB 3.29Å; F274-L277 PolarHBondContact O-N 3.43Å; S275-L277 VanDerWaalsContact C-N 3.32Å; L277-K279 PolarHBondContact O-N 3.16Å; L277-H280 PolarHBondContact O-N 3.12Å; L277-Y281 HydrophobicContact CD2-CD2 4Å; L277-Y281 HydrophobicContact CD2-CG 4.35Å; L277-Y281 PolarHBondContact O-N 2.99Å; L277-Y284 HydrophobicContact CD1-CD2 3.51Å; L277-Y284 HydrophobicContact CD1-CE2 3.78Å; L277-Y284 HydrophobicContact CD1-CG 4.29Å; L277-Y284 HydrophobicContact CD2-CD2 3.88Å; L277-Y284 HydrophobicContact CG-CD2 4.38Å; L277-N303 VanDerWaalsContact CD1-O 3.25Å; L277-N303 WeakPolarHBondContact CD1-O 3.3Å; L277-Q307 HydrophobicContact CB-CB 4.2Å; L277-Q307 HydrophobicContact CD1-CG 4.49Å; L277-V309 HydrophobicContact CB-CG1 4.17Å; L277-V309 VanDerWaalsContact O-CG1 3.31Å; L277-V309 WeakPolarHBondContact O-CG1 3.18Å
278	G	89.2	Confident	92.1	Very high	21 Å²	21	40.4 Å²	40.4	22%	0.216	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-28.7	-178.5	0	0	0	0	0	114.3	K224 S275 Q307	K224-G278 PolarHBondContact NZ-O 3.36Å; S275-G278 PolarHBondContact O-N 2.91Å; G278-Q307 WeakPolarHBondContact CA-O 3.39Å
279	K	93.1	Very high	92.7	Very high	123 Å²	123	34 Å²	34	54%	0.535	18%	0.176	S	C	.	.	H	α-helix	trans	-81.6	-39.3	179.4	-70.8	171.2	-177.9	170.6	0	113.5	S275 L276 L277	S275-K279 WeakPolarHBondContact O-CG 3.32Å; S275-K279 PolarHBondContact O-N 2.82Å; L276-K279 PolarHBondContact O-N 2.81Å; L277-K279 PolarHBondContact O-N 3.16Å
280	H	96	Very high	93.2	Very high	73 Å²	73	31.7 Å²	31.7	34%	0.338	16%	0.162	S	C	.	.	H	α-helix	trans	-117.3	-28.5	-165.3	-60.9	-58.4	0	0	0	114.8	K224 S225 K226 L276 L277	K224-H280 CarbonylContact C-O 3.58Å; K224-H280 WeakPolarHBondContact CA-O 3.36Å; S225-H280 PolarHBondContact N-O 2.59Å; S225-H280 VanDerWaalsContact N-O 3.13Å; K226-H280 WeakPolarHBondContact CA-O 3.44Å; K226-H280 WeakPolarHBondContact CB-O 3.36Å; K226-H280 HydrophobicContact CD-CB 4.34Å; K226-H280 HydrophobicContact CG-CB 4.45Å; K226-H280 PolarHBondContact N-O 3.41Å; L276-H280 PolarHBondContact O-N 2.65Å; L277-H280 PolarHBondContact O-N 3.12Å
281	Y	98.2	Very high	93.8	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.008	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	144.4	-170.6	-64.4	-91.3	0	0	0	112.2	K224 K226 A229 D255 Y257 L277 V309	K224-Y281 WeakPolarHBondContact CD-O 3.29Å; K224-Y281 WeakPolarHBondContact CE-O 3.42Å; K224-Y281 PolarHBondContact NZ-O 2.96Å; K226-Y281 HydrophobicContact CB-CD1 3.45Å; K226-Y281 VanDerWaalsContact CB-CD1 3.45Å; K226-Y281 HydrophobicContact CB-CE1 3.54Å; K226-Y281 HydrophobicContact CB-CG 4.04Å; K226-Y281 HydrophobicContact CD-CD1 4.15Å; K226-Y281 HydrophobicContact CD-CE1 3.43Å; K226-Y281 VanDerWaalsContact CD-CE1 3.43Å; K226-Y281 HydrophobicContact CD-CE2 3.94Å; K226-Y281 WeakPolarHBondContact CD-OH 3.4Å; K226-Y281 HydrophobicContact CG-CD1 4.48Å; K226-Y281 HydrophobicContact CG-CE1 4.16Å; K226-Y281 PolarHBondContact NZ-OH 3.33Å; K226-Y281 VanDerWaalsContact NZ-OH 3.13Å; K226-Y281 WeakPolarHBondContact O-CA 3.35Å; A229-Y281 HydrophobicContact CB-CD1 3.57Å; A229-Y281 HydrophobicContact CB-CD2 4.03Å; A229-Y281 HydrophobicContact CB-CE1 3.69Å; A229-Y281 HydrophobicContact CB-CE2 4.1Å; A229-Y281 HydrophobicContact CB-CG 3.73Å; D255-Y281 HydrophobicContact CB-CE1 3.77Å; D255-Y281 VanDerWaalsContact CB-OH 3.22Å; D255-Y281 WeakPolarHBondContact CB-OH 2.98Å; D255-Y281 PolarHBondContact OD2-OH 3.39Å; Y257-Y281 WeakPolarHBondContact CE2-OH 3.24Å; Y257-Y281 PolarHBondContact OH-OH 2.62Å; L277-Y281 HydrophobicContact CD2-CD2 4Å; L277-Y281 HydrophobicContact CD2-CG 4.35Å; L277-Y281 PolarHBondContact O-N 2.99Å; Y281-V309 VanDerWaalsContact O-CG1 3.28Å; Y281-V309 WeakPolarHBondContact O-CG1 3.47Å
282	K	98.3	Very high	94.4	Very high	15 Å²	15	25.3 Å²	25.3	7%	0.065	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-36.7	172.7	-74.9	-174.8	-179	173.3	0	112.5	K224 K226 M227 I310 D350 Y356	K224-K282 HydrophobicContact CB-CG 3.9Å; K224-K282 HydrophobicContact CD-CG 4.03Å; K226-K282 PolarHBondContact O-N 2.9Å; M227-K282 PolarHBondContact O-N 3.12Å; K282-I310 PolarHBondContact O-N 3.25Å; K282-D350 HydrophobicContact CD-CB 4.37Å; K282-D350 VanDerWaalsContact CD-OD1 3.28Å; K282-D350 WeakPolarHBondContact CD-OD1 3.05Å; K282-D350 WeakPolarHBondContact CE-OD1 3.18Å; K282-D350 PolarHBondContact NZ-O 2.83Å; K282-D350 IonicContact NZ-OD1 2.83Å; K282-D350 PolarHBondContact NZ-OD1 2.66Å; K282-Y356 HydrophobicContact CB-CE2 3.62Å; K282-Y356 HydrophobicContact CD-CD2 4.39Å; K282-Y356 HydrophobicContact CD-CE2 4.12Å; K282-Y356 HydrophobicContact CG-CE2 3.82Å; K282-Y356 PolarHBondContact O-OH 3.44Å
283	F	98.8	Very high	94.8	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.6	-173.3	-45.9	-74.1	0	0	0	111.7	M227 V228 A229 I310 V312 I331 L346 L349 Y356	M227-F283 HydrophobicContact CB-CD2 4.43Å; M227-F283 WeakPolarHBondContact O-CD2 3.45Å; M227-F283 PolarHBondContact O-N 3.4Å; V228-F283 WeakPolarHBondContact CA-O 3.34Å; V228-F283 HydrophobicContact CG2-CB 4.21Å; V228-F283 HydrophobicContact CG2-CD2 4.17Å; A229-F283 PolarHBondContact N-O 2.9Å; F283-I310 WeakPolarHBondContact CA-O 3.36Å; F283-I310 HydrophobicContact CD1-CB 3.96Å; F283-I310 HydrophobicContact CD1-CD1 4.39Å; F283-I310 HydrophobicContact CD1-CG2 4.43Å; F283-I310 HydrophobicContact CE1-CB 4.43Å; F283-I310 HydrophobicContact CE1-CD1 4Å; F283-V312 HydrophobicContact CB-CG2 4.14Å; F283-I331 HydrophobicContact CD1-CD1 4.36Å; F283-I331 HydrophobicContact CE1-CD1 4.29Å; F283-L346 HydrophobicContact CD1-CD2 3.67Å; F283-L346 HydrophobicContact CD2-CB 4.23Å; F283-L346 HydrophobicContact CD2-CD1 4.49Å; F283-L346 HydrophobicContact CD2-CD2 4.27Å; F283-L346 HydrophobicContact CE1-CD2 3.77Å; F283-L346 HydrophobicContact CE2-CB 3.95Å; F283-L346 HydrophobicContact CE2-CD2 4.36Å; F283-L346 WeakPolarHBondContact CE2-O 3.41Å; F283-L346 HydrophobicContact CG-CD2 3.95Å; F283-L346 HydrophobicContact CZ-CB 4.22Å; F283-L346 HydrophobicContact CZ-CD2 4.14Å; F283-L346 WeakPolarHBondContact CZ-O 3.48Å; F283-L349 HydrophobicContact CE1-CB 4.13Å; F283-L349 HydrophobicContact CE1-CD1 3.93Å; F283-L349 HydrophobicContact CZ-CB 3.79Å; F283-L349 HydrophobicContact CZ-CD1 4.39Å; F283-Y356 HydrophobicContact CE1-CD2 4.29Å; F283-Y356 HydrophobicContact CE1-CE2 4.2Å; F283-Y356 HydrophobicContact CZ-CD2 4.34Å; F283-Y356 HydrophobicContact CZ-CE2 4.4Å
284	Y	98.6	Very high	95	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.2	173.7	174.1	-94.9	0	0	0	110.4	A229 F231 L277 S286 K299 N303 A304 I310 P311 V312	A229-Y284 WeakPolarHBondContact O-CA 3.3Å; F231-Y284 HydrophobicContact CB-CE2 4.12Å; F231-Y284 HydrophobicContact CD2-CD2 4.34Å; F231-Y284 AromaticContact CD2-CE2 3.7Å; F231-Y284 HydrophobicContact CD2-CE2 3.7Å; F231-Y284 HydrophobicContact CG-CE2 4.25Å; L277-Y284 HydrophobicContact CD1-CD2 3.51Å; L277-Y284 HydrophobicContact CD1-CE2 3.78Å; L277-Y284 HydrophobicContact CD1-CG 4.29Å; L277-Y284 HydrophobicContact CD2-CD2 3.88Å; L277-Y284 HydrophobicContact CG-CD2 4.38Å; Y284-S286 VanDerWaalsContact CD1-OG 3.32Å; Y284-S286 WeakPolarHBondContact CD1-OG 3.43Å; Y284-S286 PolarHBondContact O-N 3.33Å; Y284-K299 HydrophobicContact CE1-CB 4.45Å; Y284-K299 WeakPolarHBondContact CE1-O 3.16Å; Y284-N303 HydrophobicContact CD1-CB 4.39Å; Y284-N303 HydrophobicContact CE1-CB 3.67Å; Y284-N303 HydrophobicContact CE2-CB 4.29Å; Y284-N303 PolarHBondContact OH-ND2 2.73Å; Y284-A304 HydrophobicContact CD1-CB 3.9Å; Y284-A304 HydrophobicContact CG-CB 4.43Å; Y284-I310 PolarHBondContact N-O 2.87Å; Y284-P311 CarbonylContact O-C 3.49Å; Y284-P311 WeakPolarHBondContact O-CA 3.45Å; Y284-V312 PolarHBondContact O-N 3.06Å
285	L	98.8	Very high	95.5	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	99.3	176.9	-56.6	-169.9	0	0	0	110.8	V228 A229 W230 V245 L248 I254 F287 V312	V228-L285 HydrophobicContact CG1-CD1 4.15Å; V228-L285 HydrophobicContact CG1-CD2 3.56Å; V228-L285 HydrophobicContact CG1-CG 3.6Å; A229-L285 PolarHBondContact O-N 3.08Å; W230-L285 HydrophobicContact CB-CB 4.01Å; W230-L285 HydrophobicContact CB-CD1 4.01Å; W230-L285 HydrophobicContact CB-CG 4.17Å; W230-L285 HydrophobicContact CD2-CD1 4.44Å; W230-L285 HydrophobicContact CG-CB 3.85Å; W230-L285 HydrophobicContact CG-CD1 4.11Å; W230-L285 HydrophobicContact CG-CG 4.4Å; V245-L285 HydrophobicContact CG1-CD1 4.49Å; V245-L285 HydrophobicContact CG2-CD1 3.65Å; L248-L285 HydrophobicContact CD2-CD1 4.41Å; L248-L285 HydrophobicContact CD2-CD2 4.32Å; I254-L285 HydrophobicContact CD1-CD1 4.23Å; I254-L285 HydrophobicContact CG2-CD1 4.15Å; L285-F287 HydrophobicContact CB-CD1 4.12Å; L285-F287 HydrophobicContact CB-CD2 4.34Å; L285-F287 HydrophobicContact CB-CE1 4.2Å; L285-F287 HydrophobicContact CB-CE2 4.42Å; L285-F287 HydrophobicContact CB-CG 4.21Å; L285-F287 HydrophobicContact CB-CZ 4.35Å; L285-F287 HydrophobicContact CD1-CD2 4.38Å; L285-F287 HydrophobicContact CD1-CE2 3.95Å; L285-F287 HydrophobicContact CD1-CZ 4.18Å; L285-F287 HydrophobicContact CD2-CE1 4.17Å; L285-F287 HydrophobicContact CD2-CZ 3.98Å; L285-F287 HydrophobicContact CG-CZ 4.41Å; L285-F287 PolarHBondContact O-N 3.33Å; L285-V312 HydrophobicContact CD2-CB 3.74Å; L285-V312 HydrophobicContact CD2-CG1 4.04Å; L285-V312 HydrophobicContact CD2-CG2 4.2Å
286	S	98.5	Very high	95.9	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.007	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	56.8	175.2	-56.8	0	0	0	0	111.1	Y284 K299 P311 V312	Y284-S286 VanDerWaalsContact CD1-OG 3.32Å; Y284-S286 WeakPolarHBondContact CD1-OG 3.43Å; Y284-S286 PolarHBondContact O-N 3.33Å; S286-K299 WeakPolarHBondContact CB-O 3.16Å; S286-K299 PolarHBondContact OG-O 2.68Å; S286-P311 VanDerWaalsContact OG-CB 3.29Å; S286-P311 WeakPolarHBondContact OG-CB 3.49Å; S286-V312 PolarHBondContact N-O 3.18Å
287	F	98.7	Very high	96.3	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	116.3	-173.8	-69.3	1.8	0	0	0	112.4	R241 Y244 V245 L285 K299 V312 M314 V333	R241-F287 HydrophobicContact CB-CB 3.86Å; R241-F287 HydrophobicContact CB-CD2 3.92Å; R241-F287 HydrophobicContact CB-CG 4.33Å; R241-F287 PolarHBondContact NH1-O 3.22Å; R241-F287 VanDerWaalsContact NH1-O 3.08Å; Y244-F287 AromaticContact CD1-CE2 3.77Å; Y244-F287 HydrophobicContact CD1-CE2 3.77Å; Y244-F287 AromaticContact CD1-CZ 3.88Å; Y244-F287 HydrophobicContact CD1-CZ 3.88Å; Y244-F287 HydrophobicContact CE1-CE2 4.42Å; Y244-F287 HydrophobicContact CE1-CZ 4.07Å; V245-F287 HydrophobicContact CG2-CD2 3.61Å; V245-F287 HydrophobicContact CG2-CE2 3.45Å; V245-F287 VanDerWaalsContact CG2-CE2 3.45Å; L285-F287 HydrophobicContact CB-CD1 4.12Å; L285-F287 HydrophobicContact CB-CD2 4.34Å; L285-F287 HydrophobicContact CB-CE1 4.2Å; L285-F287 HydrophobicContact CB-CE2 4.42Å; L285-F287 HydrophobicContact CB-CG 4.21Å; L285-F287 HydrophobicContact CB-CZ 4.35Å; L285-F287 HydrophobicContact CD1-CD2 4.38Å; L285-F287 HydrophobicContact CD1-CE2 3.95Å; L285-F287 HydrophobicContact CD1-CZ 4.18Å; L285-F287 HydrophobicContact CD2-CE1 4.17Å; L285-F287 HydrophobicContact CD2-CZ 3.98Å; L285-F287 HydrophobicContact CG-CZ 4.41Å; L285-F287 PolarHBondContact O-N 3.33Å; F287-K299 WeakPolarHBondContact O-CD 3.3Å; F287-V312 WeakPolarHBondContact CD1-O 3.47Å; F287-V312 HydrophobicContact CE1-CG1 4.1Å; F287-V312 VanDerWaalsContact CE1-O 3.27Å; F287-V312 WeakPolarHBondContact CE1-O 3.47Å; F287-V312 HydrophobicContact CZ-CG1 4.49Å; F287-M314 HydrophobicContact CB-CB 4.29Å; F287-M314 HydrophobicContact CD1-CB 3.44Å; F287-M314 VanDerWaalsContact CD1-CB 3.44Å; F287-M314 HydrophobicContact CD2-CB 4.49Å; F287-M314 HydrophobicContact CD2-CE 4.45Å; F287-M314 HydrophobicContact CD2-SD 4.48Å; F287-M314 HydrophobicContact CE1-CB 3.78Å; F287-M314 HydrophobicContact CE2-CE 4.19Å; F287-M314 HydrophobicContact CG-CB 3.83Å; F287-M314 HydrophobicContact CZ-CB 4.43Å; F287-M314 HydrophobicContact CZ-CE 4.36Å; F287-V333 HydrophobicContact CE1-CG1 3.83Å; F287-V333 HydrophobicContact CZ-CG1 3.86Å
288	E	98	Very high	96.5	Very high	5 Å²	5	18.4 Å²	18.4	2%	0.023	10%	0.095	C	C	.	.			trans	-74	155.6	-174.6	-68	-62.6	174.7	0	0	114.2	S239 R241 S290 Y295 T297 K299 M314	S239-E288 WeakPolarHBondContact CB-O 3.27Å; S239-E288 PolarHBondContact OG-O 3.18Å; R241-E288 WeakPolarHBondContact CD-O 3.1Å; E288-S290 PolarHBondContact O-N 3.14Å; E288-Y295 HydrophobicContact CB-CD1 4.15Å; E288-Y295 HydrophobicContact CB-CE1 4.27Å; E288-Y295 HydrophobicContact CG-CD1 4.29Å; E288-T297 VanDerWaalsContact OE1-CB 3.27Å; E288-T297 WeakPolarHBondContact OE1-CB 3.25Å; E288-T297 WeakPolarHBondContact OE1-CG2 3.31Å; E288-T297 PolarHBondContact OE1-N 3.37Å; E288-T297 PolarHBondContact OE1-OG1 3.4Å; E288-T297 VanDerWaalsContact OE2-CG2 3.31Å; E288-T297 WeakPolarHBondContact OE2-CG2 3.15Å; E288-T297 PolarHBondContact OE2-OG1 3.37Å; E288-K299 IonicContact OE2-NZ 3.32Å; E288-K299 PolarHBondContact OE2-NZ 3.13Å; E288-M314 PolarHBondContact N-O 3.46Å
289	N	96.8	Very high	96.8	Very high	27 Å²	27	18.2 Å²	18.2	14%	0.144	9%	0.088	C	C	.	.	S	Bend	trans	-65.4	-28.1	179.4	-69.4	-39	0	0	0	112.8	K238 S239 R241	K238-N289 PolarHBondContact N-O 2.97Å; S239-N289 PolarHBondContact N-O 3.05Å; S239-N289 PolarHBondContact OG-O 2.97Å; R241-N289 PolarHBondContact NH1-OD1 3.41Å; R241-N289 PolarHBondContact NH2-OD1 3.24Å
290	S	96.9	Very high	97	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.007	6%	0.063	C	C	.	.	S	Bend	trans	-145.8	148.1	-176.3	-60.4	0	0	0	0	109.9	E288 C292	E288-S290 PolarHBondContact O-N 3.14Å; S290-C292 WeakPolarHBondContact CB-SG 3.42Å; S290-C292 PolarHBondContact O-N 2.98Å
291	L	97.2	Very high	96.9	Very high	17 Å²	17	9.1 Å²	9.1	9%	0.089	5%	0.047	C	C	.	.			trans	-89.1	94	172.2	-52.6	-176.1	0	0	0	108.5	P240 M314 C405 R408 I410	P240-L291 HydrophobicContact CG-CD1 4.32Å; L291-M314 HydrophobicContact CD2-CG 4Å; L291-C405 WeakPolarHBondContact O-CA 3.43Å; L291-C405 WeakPolarHBondContact O-CB 3.34Å; L291-R408 HydrophobicContact CB-CB 4.14Å; L291-I410 HydrophobicContact CD1-CG2 4.11Å; L291-I410 HydrophobicContact CD2-CG2 4.48Å
292	C	97.2	Very high	96.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.06	C	C	.	.			trans	-131.8	151	-176	-54.1	0	0	0	0	110.5	S290 D294 Y295 G404 C405	S290-C292 WeakPolarHBondContact CB-SG 3.42Å; S290-C292 PolarHBondContact O-N 2.98Å; C292-D294 PolarHBondContact O-N 3.11Å; C292-Y295 PolarHBondContact O-N 2.98Å; C292-G404 CarbonylContact C-O 3.59Å; C292-G404 WeakPolarHBondContact CA-O 3.39Å; C292-C405 HydrophobicContact CB-CB 4.03Å; C292-C405 WeakPolarHBondContact CB-SG 3.48Å; C292-C405 WeakPolarHBondContact SG-CB 3.37Å; C292-C405 CovalentContact SG-SG 2.03Å; C292-C405 PolarHBondContact SG-SG 2.96Å
293	A	95.8	Very high	96.4	Very high	16 Å²	16	12.2 Å²	12.2	13%	0.132	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	131.3	176.3	0	0	0	0	0	110.3	Y187 Y295 E320 G404	Y187-A293 WeakPolarHBondContact CE2-O 3.34Å; A293-Y295 PolarHBondContact O-N 3.44Å; A293-E320 WeakPolarHBondContact CA-OE1 2.87Å; A293-G404 PolarHBondContact N-O 3Å
294	D	95.4	Very high	96.2	Very high	21 Å²	21	12.2 Å²	12.2	11%	0.112	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	4.2	178.4	-57.8	-31.9	0	0	0	116.3	Y187 M189 C292 I296 R323	Y187-D294 HydrophobicContact CD2-CB 4.28Å; Y187-D294 WeakPolarHBondContact CD2-O 3.33Å; M189-D294 WeakPolarHBondContact CB-OD2 3.42Å; M189-D294 HydrophobicContact CG-CB 4.4Å; M189-D294 PolarHBondContact N-OD2 3.06Å; C292-D294 PolarHBondContact O-N 3.11Å; D294-I296 PolarHBondContact O-N 3.24Å; D294-R323 IonicContact OD1-CZ 3.07Å; D294-R323 IonicContact OD1-NH2 2.66Å; D294-R323 PolarHBondContact OD1-NH2 3.14Å; D294-R323 IonicContact OD2-NH2 2.69Å
295	Y	97.4	Very high	96.1	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.008	6%	0.06	C	C	.	.			trans	-77.3	90.8	-178.2	-172	-118.5	0	0	0	110.5	H165 E166 A167 Y187 Y197 E288 C292 A293 T297	H165-Y295 WeakPolarHBondContact O-CE2 3.37Å; E166-Y295 PolarHBondContact OE2-OH 3.28Å; A167-Y295 HydrophobicContact CB-CD1 4.15Å; A167-Y295 HydrophobicContact CB-CD2 4.32Å; A167-Y295 HydrophobicContact CB-CE1 3.98Å; A167-Y295 HydrophobicContact CB-CE2 4.15Å; A167-Y295 HydrophobicContact CB-CG 4.3Å; Y187-Y295 AromaticContact CD1-CD2 3.82Å; Y187-Y295 HydrophobicContact CD1-CD2 3.82Å; Y187-Y295 HydrophobicContact CD1-CE2 4.29Å; Y187-Y295 HydrophobicContact CD2-CD2 4.19Å; Y187-Y295 AromaticContact CE1-CD2 3.39Å; Y187-Y295 HydrophobicContact CE1-CD2 3.39Å; Y187-Y295 AromaticContact CE1-CE2 3.93Å; Y187-Y295 HydrophobicContact CE1-CE2 3.93Å; Y187-Y295 HydrophobicContact CE1-CG 4.4Å; Y187-Y295 VanDerWaalsContact CE2-CA 3.5Å; Y187-Y295 AromaticContact CE2-CD2 3.84Å; Y187-Y295 HydrophobicContact CE2-CD2 3.84Å; Y187-Y295 HydrophobicContact CE2-CG 4.22Å; Y187-Y295 HydrophobicContact CG-CD2 4.2Å; Y187-Y295 AromaticContact CZ-CD2 3.41Å; Y187-Y295 VanDerWaalsContact CZ-CD2 3.41Å; Y187-Y295 AromaticContact CZ-CG 4Å; Y197-Y295 HydrophobicContact CE2-CE2 4.27Å; E288-Y295 HydrophobicContact CB-CD1 4.15Å; E288-Y295 HydrophobicContact CB-CE1 4.27Å; E288-Y295 HydrophobicContact CG-CD1 4.29Å; C292-Y295 PolarHBondContact O-N 2.98Å; A293-Y295 PolarHBondContact O-N 3.44Å; Y295-T297 HydrophobicContact CD1-CG2 4.35Å; Y295-T297 HydrophobicContact CD2-CG2 4.08Å; Y295-T297 HydrophobicContact CE1-CG2 3.9Å; Y295-T297 HydrophobicContact CE2-CG2 3.62Å; Y295-T297 HydrophobicContact CG-CG2 4.45Å
296	I	95.9	Very high	95.8	Very high	13 Å²	13	15 Å²	15	7%	0.067	8%	0.078	C	C	.	.			trans	-128.6	120	-179.6	-58.1	171.1	0	0	0	107.5	D294 L300 F301 A316 C321 V324	D294-I296 PolarHBondContact O-N 3.24Å; I296-L300 HydrophobicContact CG2-CB 3.85Å; I296-L300 HydrophobicContact CG2-CD2 3.36Å; I296-L300 HydrophobicContact CG2-CG 4.22Å; I296-F301 HydrophobicContact CG2-CD2 4.32Å; I296-F301 HydrophobicContact CG2-CE2 3.7Å; I296-A316 HydrophobicContact CD1-CB 3.8Å; I296-A316 HydrophobicContact CG1-CB 3.48Å; I296-A316 VanDerWaalsContact CG1-CB 3.48Å; I296-C321 HydrophobicContact CD1-CB 4.45Å; I296-V324 HydrophobicContact CD1-CG2 3.5Å
297	T	95	Very high	95.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.			trans	-115.6	-167.1	-164.9	71	0	0	0	0	113.3	Y197 E288 Y295 K299 L300	Y197-T297 HydrophobicContact CD2-CG2 4.09Å; Y197-T297 HydrophobicContact CE1-CG2 4.43Å; Y197-T297 HydrophobicContact CE2-CG2 3.84Å; E288-T297 VanDerWaalsContact OE1-CB 3.27Å; E288-T297 WeakPolarHBondContact OE1-CB 3.25Å; E288-T297 WeakPolarHBondContact OE1-CG2 3.31Å; E288-T297 PolarHBondContact OE1-N 3.37Å; E288-T297 PolarHBondContact OE1-OG1 3.4Å; E288-T297 VanDerWaalsContact OE2-CG2 3.31Å; E288-T297 WeakPolarHBondContact OE2-CG2 3.15Å; E288-T297 PolarHBondContact OE2-OG1 3.37Å; Y295-T297 HydrophobicContact CD1-CG2 4.35Å; Y295-T297 HydrophobicContact CD2-CG2 4.08Å; Y295-T297 HydrophobicContact CE1-CG2 3.9Å; Y295-T297 HydrophobicContact CE2-CG2 3.62Å; Y295-T297 HydrophobicContact CG-CG2 4.45Å; T297-K299 PolarHBondContact O-N 3.3Å; T297-K299 PolarHBondContact OG1-N 3.38Å; T297-K299 PolarHBondContact OG1-NZ 3.2Å; T297-L300 PolarHBondContact O-N 3.44Å
298	E	93.3	Very high	95.4	Very high	49 Å²	49	18.8 Å²	18.8	23%	0.229	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-24.1	172	77.1	-67.4	152.9	0	0	114.1	H198 L300 F301 R302 N303	H198-E298 VanDerWaalsContact CE1-CA 3.47Å; H198-E298 WeakPolarHBondContact CE1-CA 3.09Å; E298-L300 VanDerWaalsContact C-N 3.3Å; E298-L300 PolarHBondContact O-N 3.49Å; E298-F301 CarbonylContact O-C 3.57Å; E298-F301 PolarHBondContact O-N 3.19Å; E298-R302 HydrophobicContact CB-CB 4.08Å; E298-R302 PolarHBondContact O-N 2.87Å; E298-N303 PolarHBondContact O-N 2.69Å; E298-N303 PolarHBondContact O-OD1 3.22Å
299	K	95.6	Very high	95.4	Very high	17 Å²	17	18.6 Å²	18.6	7%	0.074	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-36.6	-179.7	-66.6	172.1	-155.5	63.8	0	112.7	Y284 S286 F287 E288 T297	Y284-K299 HydrophobicContact CE1-CB 4.45Å; Y284-K299 WeakPolarHBondContact CE1-O 3.16Å; S286-K299 WeakPolarHBondContact CB-O 3.16Å; S286-K299 PolarHBondContact OG-O 2.68Å; F287-K299 WeakPolarHBondContact O-CD 3.3Å; E288-K299 IonicContact OE2-NZ 3.32Å; E288-K299 PolarHBondContact OE2-NZ 3.13Å; T297-K299 PolarHBondContact O-N 3.3Å; T297-K299 PolarHBondContact OG1-N 3.38Å; T297-K299 PolarHBondContact OG1-NZ 3.2Å
300	L	96.8	Very high	95.5	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.01	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-40.2	177.7	179.9	62.2	0	0	0	111.2	I296 T297 E298 A304 F305 P311 V313 A325 F330	I296-L300 HydrophobicContact CG2-CB 3.85Å; I296-L300 HydrophobicContact CG2-CD2 3.36Å; I296-L300 HydrophobicContact CG2-CG 4.22Å; T297-L300 PolarHBondContact O-N 3.44Å; E298-L300 VanDerWaalsContact C-N 3.3Å; E298-L300 PolarHBondContact O-N 3.49Å; L300-A304 WeakPolarHBondContact O-CB 3.17Å; L300-F305 HydrophobicContact CD1-CE1 4.5Å; L300-F305 HydrophobicContact CD1-CE2 3.78Å; L300-F305 HydrophobicContact CD1-CZ 3.7Å; L300-F305 HydrophobicContact CD2-CE2 4.06Å; L300-F305 HydrophobicContact CG-CD2 4.24Å; L300-F305 HydrophobicContact CG-CE2 3.56Å; L300-F305 HydrophobicContact CG-CZ 4.03Å; L300-F305 VanDerWaalsContact O-CD2 3.25Å; L300-F305 WeakPolarHBondContact O-CD2 3.45Å; L300-F305 WeakPolarHBondContact O-CG 3.09Å; L300-F305 PolarHBondContact O-N 3.08Å; L300-P311 HydrophobicContact CD1-CB 3.57Å; L300-P311 HydrophobicContact CD1-CG 3.5Å; L300-P311 VanDerWaalsContact CD1-CG 3.5Å; L300-V313 HydrophobicContact CD1-CG2 3.65Å; L300-A325 HydrophobicContact CD2-CB 4.26Å; L300-F330 HydrophobicContact CD1-CB 4.43Å
301	F	94.1	Very high	95.6	Very high	3 Å²	3	17.3 Å²	17.3	1%	0.013	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-80.8	-170	-65.5	-90.9	0	0	0	112	H198 I296 E298 N303 A304 F305 S306 V324 I368	H198-F301 HydrophobicContact CB-CB 3.41Å; H198-F301 VanDerWaalsContact CB-CB 3.41Å; H198-F301 HydrophobicContact CB-CD1 3.74Å; H198-F301 HydrophobicContact CB-CD2 3.6Å; H198-F301 HydrophobicContact CB-CE1 4.37Å; H198-F301 HydrophobicContact CB-CE2 4.22Å; H198-F301 HydrophobicContact CB-CG 3.32Å; H198-F301 VanDerWaalsContact CG-CB 3.47Å; H198-F301 AromaticContact CG-CG 3.97Å; H198-F301 WeakPolarHBondContact ND1-CB 3.32Å; I296-F301 HydrophobicContact CG2-CD2 4.32Å; I296-F301 HydrophobicContact CG2-CE2 3.7Å; E298-F301 CarbonylContact O-C 3.57Å; E298-F301 PolarHBondContact O-N 3.19Å; F301-N303 VanDerWaalsContact C-N 3.31Å; F301-N303 PolarHBondContact O-N 3.16Å; F301-A304 CarbonylContact O-C 3.55Å; F301-A304 PolarHBondContact O-N 3.03Å; F301-F305 AromaticContact CD1-CD2 3.76Å; F301-F305 HydrophobicContact CD1-CD2 3.76Å; F301-F305 HydrophobicContact CD1-CE2 4.22Å; F301-F305 HydrophobicContact CE1-CD2 4.22Å; F301-F305 HydrophobicContact CE1-CE2 4.26Å; F301-F305 HydrophobicContact CG-CD2 4.23Å; F301-F305 PolarHBondContact O-N 3.45Å; F301-S306 PolarHBondContact O-N 3.33Å; F301-S306 PolarHBondContact O-OG 2.93Å; F301-V324 HydrophobicContact CZ-CB 4.44Å; F301-V324 HydrophobicContact CZ-CG2 4.17Å; F301-I368 HydrophobicContact CB-CG2 4.32Å; F301-I368 HydrophobicContact CD1-CD1 4.04Å; F301-I368 HydrophobicContact CD1-CG2 3.94Å; F301-I368 HydrophobicContact CE1-CD1 4.31Å
302	R	91.9	Very high	95.6	Very high	74 Å²	74	16.5 Å²	16.5	28%	0.279	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-45.9	-178.6	179.8	-177.2	172.7	-129.6	-1	113.1	E270 D271 E298 Q307	E270-R302 IonicContact OE2-CZ 2.68Å; E270-R302 VanDerWaalsContact OE2-CZ 3.29Å; E270-R302 IonicContact OE2-NH1 2.76Å; E270-R302 PolarHBondContact OE2-NH1 3.06Å; E270-R302 IonicContact OE2-NH2 3.29Å; E270-R302 PolarHBondContact OE2-NH2 3.34Å; D271-R302 IonicContact OD1-CZ 3.99Å; D271-R302 IonicContact OD1-NH2 3.8Å; D271-R302 PolarHBondContact OD1-NH2 3.47Å; E298-R302 HydrophobicContact CB-CB 4.08Å; E298-R302 PolarHBondContact O-N 2.87Å; R302-Q307 WeakPolarHBondContact O-CG 3.38Å; R302-Q307 PolarHBondContact O-NE2 3.17Å; R302-Q307 VanDerWaalsContact O-NE2 3.08Å
303	N	92.9	Very high	95.7	Very high	8 Å²	8	16.8 Å²	16.8	4%	0.043	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-23.9	-172.5	-57.8	7.3	0	0	0	112.4	F274 L277 Y284 E298 F301 Q307	F274-N303 HydrophobicContact CD1-CB 4.44Å; F274-N303 HydrophobicContact CE1-CB 4Å; F274-N303 HydrophobicContact CZ-CB 4.3Å; F274-N303 VanDerWaalsContact CZ-CG 3.45Å; F274-N303 WeakPolarHBondContact CZ-ND2 3.3Å; F274-N303 WeakPolarHBondContact CZ-OD1 3.31Å; L277-N303 VanDerWaalsContact CD1-O 3.25Å; L277-N303 WeakPolarHBondContact CD1-O 3.3Å; Y284-N303 HydrophobicContact CD1-CB 4.39Å; Y284-N303 HydrophobicContact CE1-CB 3.67Å; Y284-N303 HydrophobicContact CE2-CB 4.29Å; Y284-N303 PolarHBondContact OH-ND2 2.73Å; E298-N303 PolarHBondContact O-N 2.69Å; E298-N303 PolarHBondContact O-OD1 3.22Å; F301-N303 VanDerWaalsContact C-N 3.31Å; F301-N303 PolarHBondContact O-N 3.16Å; N303-Q307 VanDerWaalsContact O-CG 3.25Å; N303-Q307 WeakPolarHBondContact O-CG 3.44Å
304	A	96	Very high	95.9	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-71.4	-176.7	0	0	0	0	0	113.5	Y284 L300 F301 S306 Q307 N308 V309 P311	Y284-A304 HydrophobicContact CD1-CB 3.9Å; Y284-A304 HydrophobicContact CG-CB 4.43Å; L300-A304 WeakPolarHBondContact O-CB 3.17Å; F301-A304 CarbonylContact O-C 3.55Å; F301-A304 PolarHBondContact O-N 3.03Å; A304-S306 PolarHBondContact O-N 2.78Å; A304-Q307 CarbonylContact O-C 3.57Å; A304-Q307 WeakPolarHBondContact O-CA 3.36Å; A304-Q307 PolarHBondContact O-N 3.32Å; A304-N308 PolarHBondContact O-N 2.85Å; A304-V309 VanDerWaalsContact CA-CG2 3.49Å; A304-V309 HydrophobicContact CB-CG2 3.92Å; A304-V309 WeakPolarHBondContact O-CG2 3.37Å; A304-V309 PolarHBondContact O-N 3.06Å; A304-P311 HydrophobicContact CB-CB 3.65Å; A304-P311 HydrophobicContact CB-CG 4.15Å
305	F	95.5	Very high	96	Very high	5 Å²	5	15.5 Å²	15.5	2%	0.022	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-55	-48.5	-178.6	-65.6	-37.6	0	0	0	112.8	L300 F301 Q307 N308 P311 A325 P326 S329 F330 W362 I368	L300-F305 HydrophobicContact CD1-CE1 4.5Å; L300-F305 HydrophobicContact CD1-CE2 3.78Å; L300-F305 HydrophobicContact CD1-CZ 3.7Å; L300-F305 HydrophobicContact CD2-CE2 4.06Å; L300-F305 HydrophobicContact CG-CD2 4.24Å; L300-F305 HydrophobicContact CG-CE2 3.56Å; L300-F305 HydrophobicContact CG-CZ 4.03Å; L300-F305 VanDerWaalsContact O-CD2 3.25Å; L300-F305 WeakPolarHBondContact O-CD2 3.45Å; L300-F305 WeakPolarHBondContact O-CG 3.09Å; L300-F305 PolarHBondContact O-N 3.08Å; F301-F305 AromaticContact CD1-CD2 3.76Å; F301-F305 HydrophobicContact CD1-CD2 3.76Å; F301-F305 HydrophobicContact CD1-CE2 4.22Å; F301-F305 HydrophobicContact CE1-CD2 4.22Å; F301-F305 HydrophobicContact CE1-CE2 4.26Å; F301-F305 HydrophobicContact CG-CD2 4.23Å; F301-F305 PolarHBondContact O-N 3.45Å; F305-Q307 PolarHBondContact O-N 3.48Å; F305-Q307 VanDerWaalsContact O-N 3.14Å; F305-N308 PolarHBondContact O-N 2.71Å; F305-P311 HydrophobicContact CD1-CG 4Å; F305-P311 HydrophobicContact CE1-CG 3.38Å; F305-P311 HydrophobicContact CZ-CG 3.78Å; F305-A325 HydrophobicContact CE2-CB 4.1Å; F305-A325 HydrophobicContact CZ-CB 4.05Å; F305-P326 HydrophobicContact CD2-CG 4.49Å; F305-P326 VanDerWaalsContact CE2-CD 3.46Å; F305-P326 HydrophobicContact CE2-CG 4.29Å; F305-P326 HydrophobicContact CZ-CG 4.39Å; F305-S329 WeakPolarHBondContact CE1-OG 3.4Å; F305-S329 WeakPolarHBondContact CZ-OG 3.41Å; F305-F330 HydrophobicContact CZ-CB 4.5Å; F305-W362 HydrophobicContact CB-CH2 4.1Å; F305-W362 HydrophobicContact CB-CZ2 3.97Å; F305-W362 AromaticContact CD1-CZ2 3.89Å; F305-W362 HydrophobicContact CD1-CZ2 3.89Å; F305-W362 HydrophobicContact CG-CZ2 4.1Å; F305-I368 HydrophobicContact CB-CD1 4.31Å; F305-I368 HydrophobicContact CB-CG1 4.15Å; F305-I368 HydrophobicContact CD2-CD1 4.09Å; F305-I368 HydrophobicContact CG-CD1 4.48Å
306	S	92.9	Very high	95.9	Very high	54 Å²	54	15.4 Å²	15.4	38%	0.378	8%	0.08	S	C	.	.	G	3₁₀ helix	trans	-66.9	-15.7	179.3	-50.4	0	0	0	0	113.1	F301 A304	F301-S306 PolarHBondContact O-N 3.33Å; F301-S306 PolarHBondContact O-OG 2.93Å; A304-S306 PolarHBondContact O-N 2.78Å
307	Q	94.2	Very high	96	Very high	39 Å²	39	16.6 Å²	16.6	18%	0.182	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-99	3.4	175.8	-52.1	-49.5	-45.6	0	0	113.3	F274 L277 G278 R302 N303 A304 F305 V309	F274-Q307 HydrophobicContact CB-CG 4.24Å; F274-Q307 PolarHBondContact O-OE1 3.25Å; L277-Q307 HydrophobicContact CB-CB 4.2Å; L277-Q307 HydrophobicContact CD1-CG 4.49Å; G278-Q307 WeakPolarHBondContact CA-O 3.39Å; R302-Q307 WeakPolarHBondContact O-CG 3.38Å; R302-Q307 PolarHBondContact O-NE2 3.17Å; R302-Q307 VanDerWaalsContact O-NE2 3.08Å; N303-Q307 VanDerWaalsContact O-CG 3.25Å; N303-Q307 WeakPolarHBondContact O-CG 3.44Å; A304-Q307 CarbonylContact O-C 3.57Å; A304-Q307 WeakPolarHBondContact O-CA 3.36Å; A304-Q307 PolarHBondContact O-N 3.32Å; F305-Q307 PolarHBondContact O-N 3.48Å; F305-Q307 VanDerWaalsContact O-N 3.14Å; Q307-V309 HydrophobicContact CB-CG2 4.31Å; Q307-V309 PolarHBondContact O-N 3.24Å
308	N	95.1	Very high	96.1	Very high	42 Å²	42	18.4 Å²	18.4	23%	0.225	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	49.3	-176.3	-51.8	-55.7	0	0	0	113	Y220 K224 A304 F305 F360 H363	Y220-N308 HydrophobicContact CD1-CB 3.95Å; Y220-N308 HydrophobicContact CE1-CB 4.09Å; K224-N308 WeakPolarHBondContact CE-O 3.33Å; K224-N308 PolarHBondContact NZ-O 3.02Å; A304-N308 PolarHBondContact O-N 2.85Å; F305-N308 PolarHBondContact O-N 2.71Å; N308-F360 HydrophobicContact CB-CE1 4.38Å; N308-H363 PolarHBondContact OD1-NE2 2.58Å
309	V	97.3	Very high	96.3	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.006	11%	0.113	C	C	.	.			trans	-129	148.8	171.8	-61.1	0	0	0	0	109.7	L277 Y281 A304 Q307 P311	L277-V309 HydrophobicContact CB-CG1 4.17Å; L277-V309 VanDerWaalsContact O-CG1 3.31Å; L277-V309 WeakPolarHBondContact O-CG1 3.18Å; Y281-V309 VanDerWaalsContact O-CG1 3.28Å; Y281-V309 WeakPolarHBondContact O-CG1 3.47Å; A304-V309 VanDerWaalsContact CA-CG2 3.49Å; A304-V309 HydrophobicContact CB-CG2 3.92Å; A304-V309 WeakPolarHBondContact O-CG2 3.37Å; A304-V309 PolarHBondContact O-N 3.06Å; Q307-V309 HydrophobicContact CB-CG2 4.31Å; Q307-V309 PolarHBondContact O-N 3.24Å; V309-P311 VanDerWaalsContact O-CD 3.25Å; V309-P311 WeakPolarHBondContact O-CD 3.34Å
310	I	98.6	Very high	96.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.9	179.4	-56.7	177.3	0	0	0	108.7	K282 F283 Y284 I331 Y356 Y359 F360	K282-I310 PolarHBondContact O-N 3.25Å; F283-I310 WeakPolarHBondContact CA-O 3.36Å; F283-I310 HydrophobicContact CD1-CB 3.96Å; F283-I310 HydrophobicContact CD1-CD1 4.39Å; F283-I310 HydrophobicContact CD1-CG2 4.43Å; F283-I310 HydrophobicContact CE1-CB 4.43Å; F283-I310 HydrophobicContact CE1-CD1 4Å; Y284-I310 PolarHBondContact N-O 2.87Å; I310-I331 HydrophobicContact CG2-CD1 3.73Å; I310-I331 HydrophobicContact CG2-CG1 3.84Å; I310-Y356 HydrophobicContact CD1-CD2 3.48Å; I310-Y356 VanDerWaalsContact CD1-CD2 3.48Å; I310-Y356 HydrophobicContact CD1-CE2 3.38Å; I310-Y356 HydrophobicContact CD1-CG 4.25Å; I310-Y356 HydrophobicContact CG1-CD2 4.48Å; I310-Y356 HydrophobicContact CG1-CE2 3.92Å; I310-Y359 HydrophobicContact CD1-CD1 4.46Å; I310-Y359 HydrophobicContact CD1-CD2 3.85Å; I310-Y359 HydrophobicContact CD1-CG 3.72Å; I310-Y359 HydrophobicContact CG1-CG 4.27Å; I310-Y359 HydrophobicContact CG2-CD1 3.94Å; I310-Y359 HydrophobicContact CG2-CE1 4.44Å; I310-Y359 HydrophobicContact CG2-CG 4.24Å; I310-F360 HydrophobicContact CD1-CE2 3.84Å; I310-F360 HydrophobicContact CD1-CZ 4.45Å; I310-F360 HydrophobicContact CG1-CD2 4.43Å; I310-F360 HydrophobicContact CG1-CE2 3.41Å; I310-F360 VanDerWaalsContact CG1-CE2 3.41Å; I310-F360 HydrophobicContact CG1-CZ 3.55Å
311	P	98.7	Very high	96.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	132	173.8	25.9	-29.4	0	0	0	111.3	Y284 S286 L300 A304 F305 V309 V313 S329 F330 I331	Y284-P311 CarbonylContact O-C 3.49Å; Y284-P311 WeakPolarHBondContact O-CA 3.45Å; S286-P311 VanDerWaalsContact OG-CB 3.29Å; S286-P311 WeakPolarHBondContact OG-CB 3.49Å; L300-P311 HydrophobicContact CD1-CB 3.57Å; L300-P311 HydrophobicContact CD1-CG 3.5Å; L300-P311 VanDerWaalsContact CD1-CG 3.5Å; A304-P311 HydrophobicContact CB-CB 3.65Å; A304-P311 HydrophobicContact CB-CG 4.15Å; F305-P311 HydrophobicContact CD1-CG 4Å; F305-P311 HydrophobicContact CE1-CG 3.38Å; F305-P311 HydrophobicContact CZ-CG 3.78Å; V309-P311 VanDerWaalsContact O-CD 3.25Å; V309-P311 WeakPolarHBondContact O-CD 3.34Å; P311-V313 HydrophobicContact CB-CG2 4.13Å; P311-S329 WeakPolarHBondContact CD-O 3.45Å; P311-F330 HydrophobicContact CG-CB 3.74Å; P311-I331 PolarHBondContact O-N 3.2Å
312	V	98.9	Very high	96.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.1	165.9	-174.6	0	0	0	0	107.6	F283 Y284 L285 S286 F287 I331 V333 L342 L346	F283-V312 HydrophobicContact CB-CG2 4.14Å; Y284-V312 PolarHBondContact O-N 3.06Å; L285-V312 HydrophobicContact CD2-CB 3.74Å; L285-V312 HydrophobicContact CD2-CG1 4.04Å; L285-V312 HydrophobicContact CD2-CG2 4.2Å; S286-V312 PolarHBondContact N-O 3.18Å; F287-V312 WeakPolarHBondContact CD1-O 3.47Å; F287-V312 HydrophobicContact CE1-CG1 4.1Å; F287-V312 VanDerWaalsContact CE1-O 3.27Å; F287-V312 WeakPolarHBondContact CE1-O 3.47Å; F287-V312 HydrophobicContact CZ-CG1 4.49Å; V312-I331 CarbonylContact C-O 3.57Å; V312-I331 VanDerWaalsContact CA-O 3.25Å; V312-I331 WeakPolarHBondContact CA-O 3.4Å; V312-I331 HydrophobicContact CG2-CB 4.46Å; V312-V333 HydrophobicContact CG1-CG1 4.42Å; V312-L342 HydrophobicContact CG1-CD1 4.11Å; V312-L342 HydrophobicContact CG1-CD2 3.9Å; V312-L346 HydrophobicContact CG2-CD1 4.35Å; V312-L346 HydrophobicContact CG2-CD2 4.06Å
313	V	98.8	Very high	96.3	Very high	6 Å²	6	27.5 Å²	27.5	4%	0.036	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.7	-163.7	-175.7	0	0	0	0	111.4	L300 P311 F330 I331 V333	L300-V313 HydrophobicContact CD1-CG2 3.65Å; P311-V313 HydrophobicContact CB-CG2 4.13Å; V313-F330 HydrophobicContact CB-CD2 4.49Å; V313-F330 HydrophobicContact CG2-CB 4.03Å; V313-F330 HydrophobicContact CG2-CD2 4.05Å; V313-F330 HydrophobicContact CG2-CG 4.34Å; V313-I331 PolarHBondContact N-O 3.1Å; V313-V333 WeakPolarHBondContact O-CG1 3.33Å; V313-V333 WeakPolarHBondContact O-CG2 3.42Å; V313-V333 PolarHBondContact O-N 3.15Å
314	M	98.6	Very high	96.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	119.9	164.9	174.1	-173.9	-66.3	0	0	108.2	P240 R241 Y244 F287 E288 L291 V333 I410	P240-M314 HydrophobicContact CG-SD 4.17Å; R241-M314 HydrophobicContact CB-SD 3.98Å; Y244-M314 VanDerWaalsContact CB-CE 3.48Å; Y244-M314 HydrophobicContact CD1-CE 3.79Å; Y244-M314 HydrophobicContact CD2-CE 3.38Å; Y244-M314 HydrophobicContact CE1-CE 4.37Å; Y244-M314 HydrophobicContact CE2-CE 4.02Å; Y244-M314 HydrophobicContact CG-CE 3.26Å; F287-M314 HydrophobicContact CB-CB 4.29Å; F287-M314 HydrophobicContact CD1-CB 3.44Å; F287-M314 VanDerWaalsContact CD1-CB 3.44Å; F287-M314 HydrophobicContact CD2-CB 4.49Å; F287-M314 HydrophobicContact CD2-CE 4.45Å; F287-M314 HydrophobicContact CD2-SD 4.48Å; F287-M314 HydrophobicContact CE1-CB 3.78Å; F287-M314 HydrophobicContact CE2-CE 4.19Å; F287-M314 HydrophobicContact CG-CB 3.83Å; F287-M314 HydrophobicContact CZ-CB 4.43Å; F287-M314 HydrophobicContact CZ-CE 4.36Å; E288-M314 PolarHBondContact N-O 3.46Å; L291-M314 HydrophobicContact CD2-CG 4Å; M314-V333 HydrophobicContact CB-CG1 4.19Å; M314-V333 HydrophobicContact CB-CG2 3.94Å; M314-V333 HydrophobicContact CE-CG1 4.17Å; M314-V333 HydrophobicContact CE-CG2 4.16Å; M314-V333 HydrophobicContact CG-CG2 4.17Å; M314-I410 HydrophobicContact CE-CD1 3.95Å; M314-I410 HydrophobicContact CE-CG2 4.28Å; M314-I410 HydrophobicContact CG-CG2 3.91Å; M314-I410 HydrophobicContact SD-CG2 4.32Å
315	G	97.6	Very high	96.2	Very high	9 Å²	9	28.4 Å²	28.4	9%	0.093	14%	0.144	C	C	.	.	S	Bend	trans	164.3	-108.9	-179.1	0	0	0	0	0	112.4
316	A	96.7	Very high	96.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.008	14%	0.143	C	C	.	.	S	Bend	trans	-54.8	160.2	165.8	0	0	0	0	0	111.4	I296 E320 H332	I296-A316 HydrophobicContact CD1-CB 3.8Å; I296-A316 HydrophobicContact CG1-CB 3.48Å; I296-A316 VanDerWaalsContact CG1-CB 3.48Å; A316-E320 WeakPolarHBondContact CA-OE2 3.4Å; A316-E320 HydrophobicContact CB-CB 3.93Å; A316-E320 WeakPolarHBondContact CB-OE2 3.43Å; A316-H332 PolarHBondContact O-NE2 2.82Å
317	S	97.2	Very high	96.4	Very high	38 Å²	38	26.1 Å²	26.1	27%	0.266	13%	0.128	S	C	.	.			trans	-72.5	163.5	-178.9	76	0	0	0	0	110.9	E319 E320 C321	S317-E319 PolarHBondContact O-N 3.41Å; S317-E320 PolarHBondContact N-OE2 3.45Å; S317-E320 PolarHBondContact O-N 3.22Å; S317-E320 VanDerWaalsContact O-N 3.11Å; S317-E320 VanDerWaalsContact OG-CG 3.29Å; S317-E320 WeakPolarHBondContact OG-CG 3.43Å; S317-E320 PolarHBondContact OG-N 2.81Å; S317-E320 VanDerWaalsContact OG-N 3.16Å; S317-E320 PolarHBondContact OG-OE2 3.39Å; S317-C321 PolarHBondContact O-N 2.81Å; S317-C321 PolarHBondContact O-SG 2.68Å; S317-C321 VanDerWaalsContact O-SG 3.41Å
318	I	97.9	Very high	96.5	Very high	38 Å²	38	28.9 Å²	28.9	20%	0.195	14%	0.141	C	C	.	.	H	α-helix	trans	-52.1	-45	175.1	-64.1	171.7	0	0	0	111	C321 K322 H332 D334 Q335	I318-C321 PolarHBondContact O-N 2.87Å; I318-K322 HydrophobicContact CG2-CD 4.28Å; I318-K322 HydrophobicContact CG2-CG 4.46Å; I318-K322 WeakPolarHBondContact O-CB 3.29Å; I318-K322 WeakPolarHBondContact O-CG 3.48Å; I318-K322 PolarHBondContact O-N 2.77Å; I318-H332 HydrophobicContact CD1-CB 4.36Å; I318-H332 HydrophobicContact CG1-CB 3.73Å; I318-D334 HydrophobicContact CD1-CB 4.24Å; I318-Q335 HydrophobicContact CD1-CG 3.78Å
319	E	96.2	Very high	96.7	Very high	115 Å²	115	27 Å²	27	54%	0.537	13%	0.13	S	C	.	.	H	α-helix	trans	-70.1	-36.5	-178.4	-62.1	-52.6	128.5	0	0	112	S317 K322 R323	S317-E319 PolarHBondContact O-N 3.41Å; E319-K322 PolarHBondContact O-N 3.31Å; E319-K322 IonicContact OE1-NZ 2.94Å; E319-K322 PolarHBondContact OE1-NZ 2.93Å; E319-K322 IonicContact OE2-NZ 3.81Å; E319-R323 WeakPolarHBondContact O-CG 3.4Å; E319-R323 PolarHBondContact O-N 2.85Å
320	E	95.8	Very high	96.7	Very high	22 Å²	22	27.6 Å²	27.6	10%	0.103	13%	0.133	C	C	.	.	H	α-helix	trans	-64.6	-43.5	173.4	-69.6	166.5	163.8	0	0	111.3	A293 A316 S317 R323 R408	A293-E320 WeakPolarHBondContact CA-OE1 2.87Å; A316-E320 WeakPolarHBondContact CA-OE2 3.4Å; A316-E320 HydrophobicContact CB-CB 3.93Å; A316-E320 WeakPolarHBondContact CB-OE2 3.43Å; S317-E320 PolarHBondContact N-OE2 3.45Å; S317-E320 PolarHBondContact O-N 3.22Å; S317-E320 VanDerWaalsContact O-N 3.11Å; S317-E320 VanDerWaalsContact OG-CG 3.29Å; S317-E320 WeakPolarHBondContact OG-CG 3.43Å; S317-E320 PolarHBondContact OG-N 2.81Å; S317-E320 VanDerWaalsContact OG-N 3.16Å; S317-E320 PolarHBondContact OG-OE2 3.39Å; E320-R323 PolarHBondContact O-N 3.36Å; E320-R408 IonicContact OE1-CZ 3.17Å; E320-R408 IonicContact OE1-NH1 3.22Å; E320-R408 PolarHBondContact OE1-NH1 3.43Å; E320-R408 IonicContact OE1-NH2 2.81Å; E320-R408 IonicContact OE2-CZ 3.81Å; E320-R408 IonicContact OE2-NH1 3.9Å; E320-R408 PolarHBondContact OE2-NH1 2.92Å; E320-R408 IonicContact OE2-NH2 3.72Å; E320-R408 PolarHBondContact OE2-NH2 3.24Å
321	C	96.7	Very high	96.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-44.4	174.9	-67.2	0	0	0	0	112.2	I296 S317 I318 R323 V324 A325 F330	I296-C321 HydrophobicContact CD1-CB 4.45Å; S317-C321 PolarHBondContact O-N 2.81Å; S317-C321 PolarHBondContact O-SG 2.68Å; S317-C321 VanDerWaalsContact O-SG 3.41Å; I318-C321 PolarHBondContact O-N 2.87Å; C321-R323 PolarHBondContact O-N 3.38Å; C321-V324 PolarHBondContact O-N 3.48Å; C321-V324 VanDerWaalsContact O-N 3.13Å; C321-A325 WeakPolarHBondContact O-CB 3.38Å; C321-A325 PolarHBondContact O-N 3.07Å; C321-F330 HydrophobicContact CB-CD2 4.4Å; C321-F330 HydrophobicContact CB-CE1 3.89Å; C321-F330 HydrophobicContact CB-CE2 3.67Å; C321-F330 HydrophobicContact CB-CZ 3.37Å
322	K	95.6	Very high	96.8	Very high	64 Å²	64	27.6 Å²	27.6	28%	0.278	13%	0.133	S	C	.	.	H	α-helix	trans	-56.6	-32.6	177.2	-84.6	-179.9	-177.8	172.4	0	113.4	P209 I318 E319 V324 F330	P209-K322 HydrophobicContact CB-CB 4.05Å; P209-K322 WeakPolarHBondContact CB-O 3.39Å; P209-K322 VanDerWaalsContact CG-O 3.3Å; P209-K322 WeakPolarHBondContact CG-O 3.35Å; I318-K322 HydrophobicContact CG2-CD 4.28Å; I318-K322 HydrophobicContact CG2-CG 4.46Å; I318-K322 WeakPolarHBondContact O-CB 3.29Å; I318-K322 WeakPolarHBondContact O-CG 3.48Å; I318-K322 PolarHBondContact O-N 2.77Å; E319-K322 PolarHBondContact O-N 3.31Å; E319-K322 IonicContact OE1-NZ 2.94Å; E319-K322 PolarHBondContact OE1-NZ 2.93Å; E319-K322 IonicContact OE2-NZ 3.81Å; K322-V324 VanDerWaalsContact C-N 3.26Å; K322-V324 PolarHBondContact O-N 3.14Å; K322-F330 HydrophobicContact CG-CE1 4.28Å; K322-F330 HydrophobicContact CG-CZ 4.03Å
323	R	91.9	Very high	96.7	Very high	135 Å²	135	27.7 Å²	27.7	51%	0.509	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.9	179.7	-72	-174.2	-56.5	-169.7	5.4	113.9	D294 E319 E320 C321	D294-R323 IonicContact OD1-CZ 3.07Å; D294-R323 IonicContact OD1-NH2 2.66Å; D294-R323 PolarHBondContact OD1-NH2 3.14Å; D294-R323 IonicContact OD2-NH2 2.69Å; E319-R323 WeakPolarHBondContact O-CG 3.4Å; E319-R323 PolarHBondContact O-N 2.85Å; E320-R323 PolarHBondContact O-N 3.36Å; C321-R323 PolarHBondContact O-N 3.38Å
324	V	91.6	Very high	96.7	Very high	22 Å²	22	29.2 Å²	29.2	13%	0.133	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.5	-22.4	-170.3	-57	0	0	0	0	114	Y200 I296 F301 C321 K322	Y200-V324 WeakPolarHBondContact CB-O 3.28Å; I296-V324 HydrophobicContact CD1-CG2 3.5Å; F301-V324 HydrophobicContact CZ-CB 4.44Å; F301-V324 HydrophobicContact CZ-CG2 4.17Å; C321-V324 PolarHBondContact O-N 3.48Å; C321-V324 VanDerWaalsContact O-N 3.13Å; K322-V324 VanDerWaalsContact C-N 3.26Å; K322-V324 PolarHBondContact O-N 3.14Å
325	A	95	Very high	96.7	Very high	5 Å²	5	33.4 Å²	33.4	4%	0.041	16%	0.161	C	C	.	.	S	Bend	trans	-84.1	157.1	177.7	0	0	0	0	0	110.9	L300 F305 C321 F330	L300-A325 HydrophobicContact CD2-CB 4.26Å; F305-A325 HydrophobicContact CE2-CB 4.1Å; F305-A325 HydrophobicContact CZ-CB 4.05Å; C321-A325 WeakPolarHBondContact O-CB 3.38Å; C321-A325 PolarHBondContact O-N 3.07Å; A325-F330 HydrophobicContact CB-CD1 3.78Å; A325-F330 HydrophobicContact CB-CE1 3.95Å
326	P	96.2	Very high	96.8	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-56.8	147	168.1	-14.1	23.5	0	0	0	111.3	Y200 F305 H328 S329 W362 I368	Y200-P326 HydrophobicContact CD1-CB 4.27Å; Y200-P326 HydrophobicContact CD1-CG 4.45Å; Y200-P326 HydrophobicContact CD2-CB 3.93Å; Y200-P326 HydrophobicContact CD2-CG 3.6Å; Y200-P326 HydrophobicContact CE1-CB 4.22Å; Y200-P326 HydrophobicContact CE2-CB 3.81Å; Y200-P326 HydrophobicContact CE2-CG 3.95Å; Y200-P326 HydrophobicContact CG-CB 4.13Å; Y200-P326 HydrophobicContact CG-CG 3.85Å; F305-P326 HydrophobicContact CD2-CG 4.49Å; F305-P326 VanDerWaalsContact CE2-CD 3.46Å; F305-P326 HydrophobicContact CE2-CG 4.29Å; F305-P326 HydrophobicContact CZ-CG 4.39Å; P326-H328 PolarHBondContact O-N 3.09Å; P326-S329 WeakPolarHBondContact CD-OG 3.33Å; P326-S329 VanDerWaalsContact O-CB 3.25Å; P326-S329 WeakPolarHBondContact O-CB 3.5Å; P326-S329 PolarHBondContact O-N 2.99Å; P326-S329 PolarHBondContact O-OG 2.83Å; P326-W362 HydrophobicContact CB-CB 3.6Å; P326-W362 HydrophobicContact CB-CD2 3.5Å; P326-W362 HydrophobicContact CB-CE3 3.91Å; P326-W362 HydrophobicContact CB-CG 3.36Å; P326-W362 HydrophobicContact CG-CD2 3.59Å; P326-W362 HydrophobicContact CG-CE3 3.75Å; P326-W362 HydrophobicContact CG-CG 4.01Å; P326-W362 HydrophobicContact CG-CH2 4.34Å; P326-W362 HydrophobicContact CG-CZ2 4.18Å; P326-W362 HydrophobicContact CG-CZ3 4.14Å; P326-I368 HydrophobicContact CG-CD1 3.95Å
327	P	95.5	Very high	96.8	Very high	9 Å²	9	40.4 Å²	40.4	6%	0.058	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	137.1	177.5	-27.4	35.9	0	0	0	112.3	G208 T211 Y213 S329	G208-P327 WeakPolarHBondContact O-CG 3.34Å; T211-P327 VanDerWaalsContact O-CB 3.27Å; T211-P327 WeakPolarHBondContact O-CB 2.77Å; Y213-P327 HydrophobicContact CE2-CB 4.14Å; Y213-P327 HydrophobicContact CE2-CG 3.91Å; P327-S329 PolarHBondContact O-N 3.16Å; P327-S329 VanDerWaalsContact O-N 3.12Å
328	H	97.1	Very high	96.8	Very high	98 Å²	98	40 Å²	40	45%	0.454	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	34.6	177.8	-165.8	62.4	0	0	0	115	P326 Y359	P326-H328 PolarHBondContact O-N 3.09Å; H328-Y359 WeakPolarHBondContact O-CA 3.35Å; H328-Y359 WeakPolarHBondContact O-CD1 3.49Å
329	S	98.3	Very high	96.8	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.007	18%	0.18	C	C	.	.			trans	-103.9	-10	-171.5	64.1	0	0	0	0	115.6	F305 P311 P326 P327	F305-S329 WeakPolarHBondContact CE1-OG 3.4Å; F305-S329 WeakPolarHBondContact CZ-OG 3.41Å; P311-S329 WeakPolarHBondContact CD-O 3.45Å; P326-S329 WeakPolarHBondContact CD-OG 3.33Å; P326-S329 VanDerWaalsContact O-CB 3.25Å; P326-S329 WeakPolarHBondContact O-CB 3.5Å; P326-S329 PolarHBondContact O-N 2.99Å; P326-S329 PolarHBondContact O-OG 2.83Å; P327-S329 PolarHBondContact O-N 3.16Å; P327-S329 VanDerWaalsContact O-N 3.12Å
330	F	98.6	Very high	96.9	Very high	15 Å²	15	33.8 Å²	33.8	7%	0.066	16%	0.162	C	C	.	.			trans	-134.3	156.3	-173.6	69.4	-87.7	0	0	0	112.6	L300 F305 P311 V313 C321 K322 A325 H332	L300-F330 HydrophobicContact CD1-CB 4.43Å; F305-F330 HydrophobicContact CZ-CB 4.5Å; P311-F330 HydrophobicContact CG-CB 3.74Å; V313-F330 HydrophobicContact CB-CD2 4.49Å; V313-F330 HydrophobicContact CG2-CB 4.03Å; V313-F330 HydrophobicContact CG2-CD2 4.05Å; V313-F330 HydrophobicContact CG2-CG 4.34Å; C321-F330 HydrophobicContact CB-CD2 4.4Å; C321-F330 HydrophobicContact CB-CE1 3.89Å; C321-F330 HydrophobicContact CB-CE2 3.67Å; C321-F330 HydrophobicContact CB-CZ 3.37Å; K322-F330 HydrophobicContact CG-CE1 4.28Å; K322-F330 HydrophobicContact CG-CZ 4.03Å; A325-F330 HydrophobicContact CB-CD1 3.78Å; A325-F330 HydrophobicContact CB-CE1 3.95Å; F330-H332 HydrophobicContact CD2-CB 4.19Å; F330-H332 HydrophobicContact CE2-CB 3.97Å
331	I	98.9	Very high	97	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.5	171.8	-60.2	170.4	0	0	0	107	F283 I310 P311 V312 V313 F336 L342 Y345 L346 L349 Y359	F283-I331 HydrophobicContact CD1-CD1 4.36Å; F283-I331 HydrophobicContact CE1-CD1 4.29Å; I310-I331 HydrophobicContact CG2-CD1 3.73Å; I310-I331 HydrophobicContact CG2-CG1 3.84Å; P311-I331 PolarHBondContact O-N 3.2Å; V312-I331 CarbonylContact C-O 3.57Å; V312-I331 VanDerWaalsContact CA-O 3.25Å; V312-I331 WeakPolarHBondContact CA-O 3.4Å; V312-I331 HydrophobicContact CG2-CB 4.46Å; V313-I331 PolarHBondContact N-O 3.1Å; I331-F336 HydrophobicContact CG2-CE2 3.5Å; I331-F336 HydrophobicContact CG2-CZ 3.93Å; I331-L342 HydrophobicContact CG2-CD1 3.8Å; I331-Y345 HydrophobicContact CD1-CD1 4.19Å; I331-Y345 HydrophobicContact CD1-CE1 3.9Å; I331-Y345 HydrophobicContact CG1-CE1 4.17Å; I331-Y345 HydrophobicContact CG2-CD1 4.41Å; I331-Y345 HydrophobicContact CG2-CE1 4.5Å; I331-L346 HydrophobicContact CD1-CD2 3.65Å; I331-L349 HydrophobicContact CD1-CD1 3.52Å; I331-Y359 HydrophobicContact CD1-CE1 4.4Å; I331-Y359 HydrophobicContact CG1-CD1 4.41Å; I331-Y359 HydrophobicContact CG1-CE1 3.6Å
332	H	98.8	Very high	97.1	Very high	1 Å²	1	38 Å²	38	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	138	179.2	-166	-84.8	0	0	0	110.8	A316 I318 F330 D334 Q335	A316-H332 PolarHBondContact O-NE2 2.82Å; I318-H332 HydrophobicContact CD1-CB 4.36Å; I318-H332 HydrophobicContact CG1-CB 3.73Å; F330-H332 HydrophobicContact CD2-CB 4.19Å; F330-H332 HydrophobicContact CE2-CB 3.97Å; H332-D334 IonicContact CE1-OD2 3.28Å; H332-D334 PolarHBondContact CE1-OD2 2.96Å; H332-D334 WeakPolarHBondContact ND1-CB 3.34Å; H332-D334 PolarHBondContact ND1-N 2.92Å; H332-D334 VanDerWaalsContact ND1-N 3.15Å; H332-D334 IonicContact ND1-OD2 3.92Å; H332-D334 PolarHBondContact O-N 3.08Å; H332-D334 VanDerWaalsContact O-N 3.15Å; H332-Q335 HydrophobicContact CB-CG 4.19Å; H332-Q335 VanDerWaalsContact O-CB 3.3Å; H332-Q335 WeakPolarHBondContact O-CB 3.31Å; H332-Q335 PolarHBondContact O-N 3.36Å; H332-Q335 PolarHBondContact O-OE1 3.11Å
333	V	98.7	Very high	97.3	Very high	2 Å²	2	35 Å²	35	1%	0.012	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-55.3	-36.2	-178.1	-66.6	0	0	0	0	113	Y244 F287 V312 V313 M314 Q335 F336 L342 I410	Y244-V333 HydrophobicContact CD1-CG1 4.49Å; Y244-V333 HydrophobicContact CE1-CB 4.42Å; Y244-V333 HydrophobicContact CE1-CG1 3.73Å; Y244-V333 HydrophobicContact CE2-CB 4.14Å; Y244-V333 HydrophobicContact CE2-CG1 4.28Å; F287-V333 HydrophobicContact CE1-CG1 3.83Å; F287-V333 HydrophobicContact CZ-CG1 3.86Å; V312-V333 HydrophobicContact CG1-CG1 4.42Å; V313-V333 WeakPolarHBondContact O-CG1 3.33Å; V313-V333 WeakPolarHBondContact O-CG2 3.42Å; V313-V333 PolarHBondContact O-N 3.15Å; M314-V333 HydrophobicContact CB-CG1 4.19Å; M314-V333 HydrophobicContact CB-CG2 3.94Å; M314-V333 HydrophobicContact CE-CG1 4.17Å; M314-V333 HydrophobicContact CE-CG2 4.16Å; M314-V333 HydrophobicContact CG-CG2 4.17Å; V333-Q335 PolarHBondContact O-N 2.81Å; V333-F336 PolarHBondContact O-N 3.11Å; V333-F336 VanDerWaalsContact O-N 3.09Å; V333-L342 HydrophobicContact CG1-CD2 4.16Å; V333-I410 HydrophobicContact CG2-CG2 4.09Å
334	D	98.3	Very high	97.6	Very high	37 Å²	37	32.4 Å²	32.4	20%	0.198	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-72.6	-7.9	-179.2	-65	-22	0	0	0	114.9	I318 H332 F336 I410 R411	I318-D334 HydrophobicContact CD1-CB 4.24Å; H332-D334 IonicContact CE1-OD2 3.28Å; H332-D334 PolarHBondContact CE1-OD2 2.96Å; H332-D334 WeakPolarHBondContact ND1-CB 3.34Å; H332-D334 PolarHBondContact ND1-N 2.92Å; H332-D334 VanDerWaalsContact ND1-N 3.15Å; H332-D334 IonicContact ND1-OD2 3.92Å; H332-D334 PolarHBondContact O-N 3.08Å; H332-D334 VanDerWaalsContact O-N 3.15Å; D334-F336 PolarHBondContact O-N 2.95Å; D334-I410 WeakPolarHBondContact OD1-CA 3.45Å; D334-I410 WeakPolarHBondContact OD1-CB 3.4Å; D334-R411 HydrophobicContact CB-CB 4.1Å; D334-R411 WeakPolarHBondContact O-CD 3.26Å; D334-R411 WeakPolarHBondContact OD1-CB 3.47Å; D334-R411 PolarHBondContact OD1-N 3.2Å
335	Q	98.4	Very high	98	Very high	88 Å²	88	34.5 Å²	34.5	41%	0.411	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-68.4	-15.8	168.3	-66	171.7	-47.6	0	0	111.7	I318 H332 V333	I318-Q335 HydrophobicContact CD1-CG 3.78Å; H332-Q335 HydrophobicContact CB-CG 4.19Å; H332-Q335 VanDerWaalsContact O-CB 3.3Å; H332-Q335 WeakPolarHBondContact O-CB 3.31Å; H332-Q335 PolarHBondContact O-N 3.36Å; H332-Q335 PolarHBondContact O-OE1 3.11Å; V333-Q335 PolarHBondContact O-N 2.81Å
336	F	98.4	Very high	98.2	Very high	27 Å²	27	34.3 Å²	34.3	12%	0.118	17%	0.167	C	C	.	.	S	Bend	trans	-117.7	150.2	-174.9	-52.8	-84.6	0	0	0	111.3	I331 V333 D334 S338 K341 L342 Y345	I331-F336 HydrophobicContact CG2-CE2 3.5Å; I331-F336 HydrophobicContact CG2-CZ 3.93Å; V333-F336 PolarHBondContact O-N 3.11Å; V333-F336 VanDerWaalsContact O-N 3.09Å; D334-F336 PolarHBondContact O-N 2.95Å; F336-S338 VanDerWaalsContact C-N 3.32Å; F336-K341 HydrophobicContact CB-CB 4.19Å; F336-K341 HydrophobicContact CD1-CB 4.36Å; F336-L342 HydrophobicContact CB-CB 4.2Å; F336-L342 HydrophobicContact CD1-CB 4.47Å; F336-L342 HydrophobicContact CD2-CB 3.93Å; F336-L342 HydrophobicContact CD2-CD1 3.7Å; F336-L342 HydrophobicContact CD2-CG 4.36Å; F336-L342 HydrophobicContact CE2-CD1 3.53Å; F336-L342 HydrophobicContact CG-CB 3.91Å; F336-L342 HydrophobicContact CG-CD1 4.41Å; F336-L342 HydrophobicContact CZ-CD1 4.11Å; F336-Y345 AromaticContact CE1-CD1 3.82Å; F336-Y345 HydrophobicContact CE1-CD1 3.82Å; F336-Y345 HydrophobicContact CE1-CD2 4.28Å; F336-Y345 AromaticContact CE1-CG 3.57Å; F336-Y345 HydrophobicContact CE1-CG 3.57Å; F336-Y345 HydrophobicContact CE2-CD1 4.46Å; F336-Y345 AromaticContact CZ-CD1 3.38Å; F336-Y345 HydrophobicContact CZ-CD1 3.38Å; F336-Y345 HydrophobicContact CZ-CE1 4.05Å; F336-Y345 AromaticContact CZ-CG 3.67Å; F336-Y345 HydrophobicContact CZ-CG 3.67Å
337	E	96.8	Very high	98.3	Very high	130 Å²	130	37.2 Å²	37.2	61%	0.607	18%	0.18	S	C	*	.	S	Bend	trans	-73.2	-26.5	177	-68.9	174.3	176.2	0	0	112.8	R411	E337-R411 IonicContact OE1-NH2 2.86Å
338	S	97.3	Very high	98.4	Very high	31 Å²	31	42 Å²	42	22%	0.217	20%	0.198	C	C	.	.	S	Bend	trans	-156.8	161.7	-176.5	64.4	0	0	0	0	112.4	F336 A340 K341 L342	F336-S338 VanDerWaalsContact C-N 3.32Å; S338-A340 PolarHBondContact O-N 2.87Å; S338-K341 PolarHBondContact O-N 2.98Å; S338-K341 VanDerWaalsContact O-N 3.1Å; S338-K341 PolarHBondContact OG-N 3.24Å; S338-L342 PolarHBondContact O-N 3.16Å; S338-L342 VanDerWaalsContact O-N 3.08Å
339	P	98.4	Very high	98.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.013	18%	0.176	C	C	.	.	H	α-helix	trans	-54	-34	169.9	-27.1	34.5	0	0	0	113.4	Y244 E247 L248 L342 A343 W412	Y244-P339 HydrophobicContact CD1-CG 4.45Å; Y244-P339 HydrophobicContact CD2-CG 4.12Å; Y244-P339 HydrophobicContact CE1-CB 4.28Å; Y244-P339 HydrophobicContact CE1-CG 4.16Å; Y244-P339 HydrophobicContact CE2-CG 3.8Å; Y244-P339 HydrophobicContact CG-CG 4.43Å; E247-P339 HydrophobicContact CB-CB 4.39Å; E247-P339 HydrophobicContact CB-CG 4.13Å; E247-P339 HydrophobicContact CG-CB 4.1Å; E247-P339 HydrophobicContact CG-CG 3.88Å; L248-P339 HydrophobicContact CB-CB 4.09Å; L248-P339 HydrophobicContact CD1-CB 4.06Å; L248-P339 WeakPolarHBondContact CD1-O 3.28Å; P339-L342 PolarHBondContact O-N 3.08Å; P339-A343 WeakPolarHBondContact O-CB 3.24Å; P339-A343 PolarHBondContact O-N 3.17Å; P339-W412 VanDerWaalsContact CD-CE2 3.46Å; P339-W412 HydrophobicContact CG-CD2 3.91Å; P339-W412 HydrophobicContact CG-CE3 4.14Å; P339-W412 HydrophobicContact CG-CG 4.44Å; P339-W412 HydrophobicContact CG-CH2 4.17Å; P339-W412 HydrophobicContact CG-CZ2 4Å; P339-W412 HydrophobicContact CG-CZ3 4.25Å
340	A	98.4	Very high	98.5	Very high	20 Å²	20	39.5 Å²	39.5	17%	0.165	19%	0.187	C	C	.	.	H	α-helix	trans	-62.8	-45.2	176	0	0	0	0	0	112.1	Y251 S338 L342 A343 D344	Y251-A340 HydrophobicContact CD1-CB 3.93Å; Y251-A340 HydrophobicContact CD2-CB 3.95Å; Y251-A340 HydrophobicContact CE1-CB 3.78Å; Y251-A340 HydrophobicContact CE2-CB 3.8Å; Y251-A340 HydrophobicContact CG-CB 4.01Å; S338-A340 PolarHBondContact O-N 2.87Å; A340-L342 VanDerWaalsContact C-N 3.35Å; A340-A343 WeakPolarHBondContact O-CB 3.28Å; A340-A343 PolarHBondContact O-N 2.99Å; A340-D344 PolarHBondContact O-N 3.48Å
341	K	98.7	Very high	98.4	Very high	110 Å²	110	48.5 Å²	48.5	48%	0.478	22%	0.221	S	C	.	.	H	α-helix	trans	-67	-35.9	177.2	-69.7	-60.2	-174.5	-173.4	0	112.7	F336 S338 D344 Y345	F336-K341 HydrophobicContact CB-CB 4.19Å; F336-K341 HydrophobicContact CD1-CB 4.36Å; S338-K341 PolarHBondContact O-N 2.98Å; S338-K341 VanDerWaalsContact O-N 3.1Å; S338-K341 PolarHBondContact OG-N 3.24Å; K341-D344 PolarHBondContact O-N 2.82Å; K341-Y345 PolarHBondContact O-N 2.85Å; K341-Y345 VanDerWaalsContact O-N 3.12Å
342	L	98.8	Very high	98.4	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.8	-48.6	169.6	171.9	62.6	0	0	0	110.6	Y244 L248 V312 I331 V333 F336 S338 P339 A340 D344 Y345 L346	Y244-L342 HydrophobicContact CE1-CD2 3.84Å; Y244-L342 WeakPolarHBondContact OH-CD2 3.35Å; L248-L342 HydrophobicContact CD1-CB 4.44Å; L248-L342 HydrophobicContact CD1-CD2 4.11Å; L248-L342 HydrophobicContact CD1-CG 4.26Å; L248-L342 HydrophobicContact CD2-CD2 4.15Å; V312-L342 HydrophobicContact CG1-CD1 4.11Å; V312-L342 HydrophobicContact CG1-CD2 3.9Å; I331-L342 HydrophobicContact CG2-CD1 3.8Å; V333-L342 HydrophobicContact CG1-CD2 4.16Å; F336-L342 HydrophobicContact CB-CB 4.2Å; F336-L342 HydrophobicContact CD1-CB 4.47Å; F336-L342 HydrophobicContact CD2-CB 3.93Å; F336-L342 HydrophobicContact CD2-CD1 3.7Å; F336-L342 HydrophobicContact CD2-CG 4.36Å; F336-L342 HydrophobicContact CE2-CD1 3.53Å; F336-L342 HydrophobicContact CG-CB 3.91Å; F336-L342 HydrophobicContact CG-CD1 4.41Å; F336-L342 HydrophobicContact CZ-CD1 4.11Å; S338-L342 PolarHBondContact O-N 3.16Å; S338-L342 VanDerWaalsContact O-N 3.08Å; P339-L342 PolarHBondContact O-N 3.08Å; A340-L342 VanDerWaalsContact C-N 3.35Å; L342-D344 VanDerWaalsContact C-N 3.32Å; L342-D344 PolarHBondContact O-N 2.79Å; L342-Y345 WeakPolarHBondContact O-CB 3.32Å; L342-Y345 PolarHBondContact O-N 3.38Å; L342-Y345 VanDerWaalsContact O-N 3.09Å; L342-L346 HydrophobicContact CD1-CD1 4.33Å; L342-L346 HydrophobicContact CD1-CD2 4.18Å; L342-L346 HydrophobicContact CD1-CG 4.08Å; L342-L346 HydrophobicContact CG-CD1 4.31Å; L342-L346 HydrophobicContact CG-CG 4.4Å; L342-L346 WeakPolarHBondContact O-CG 3.35Å; L342-L346 PolarHBondContact O-N 3.08Å
343	A	98.9	Very high	98.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.2	-40.6	178.3	0	0	0	0	0	112.9	L248 Y251 I252 P339 A340 Y345 L346 K347	L248-A343 HydrophobicContact CD1-CB 3.95Å; Y251-A343 VanDerWaalsContact CB-CB 3.45Å; I252-A343 HydrophobicContact CB-CB 4.02Å; I252-A343 HydrophobicContact CG2-CB 3.94Å; P339-A343 WeakPolarHBondContact O-CB 3.24Å; P339-A343 PolarHBondContact O-N 3.17Å; A340-A343 WeakPolarHBondContact O-CB 3.28Å; A340-A343 PolarHBondContact O-N 2.99Å; A343-Y345 VanDerWaalsContact C-N 3.31Å; A343-Y345 PolarHBondContact O-N 3.15Å; A343-L346 PolarHBondContact O-N 3.45Å; A343-K347 VanDerWaalsContact O-CG 3.31Å; A343-K347 WeakPolarHBondContact O-CG 3.21Å; A343-K347 PolarHBondContact O-N 3.27Å
344	D	98.8	Very high	98.3	Very high	82 Å²	82	59.5 Å²	59.5	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-59.8	-42.8	174.1	-71	-21	0	0	0	111.5	A340 K341 L342 K347 Y348	A340-D344 PolarHBondContact O-N 3.48Å; K341-D344 PolarHBondContact O-N 2.82Å; L342-D344 VanDerWaalsContact C-N 3.32Å; L342-D344 PolarHBondContact O-N 2.79Å; D344-K347 PolarHBondContact O-N 3.32Å; D344-Y348 PolarHBondContact O-N 2.85Å
345	Y	98.9	Very high	98.3	Very high	66 Å²	66	57.9 Å²	57.9	26%	0.259	27%	0.272	S	S	.	.	H	α-helix	trans	-66.7	-41.3	177.5	-173.4	-110.4	0	0	0	112.8	I331 F336 K341 L342 A343 K347 Y348 L349 Y359	I331-Y345 HydrophobicContact CD1-CD1 4.19Å; I331-Y345 HydrophobicContact CD1-CE1 3.9Å; I331-Y345 HydrophobicContact CG1-CE1 4.17Å; I331-Y345 HydrophobicContact CG2-CD1 4.41Å; I331-Y345 HydrophobicContact CG2-CE1 4.5Å; F336-Y345 AromaticContact CE1-CD1 3.82Å; F336-Y345 HydrophobicContact CE1-CD1 3.82Å; F336-Y345 HydrophobicContact CE1-CD2 4.28Å; F336-Y345 AromaticContact CE1-CG 3.57Å; F336-Y345 HydrophobicContact CE1-CG 3.57Å; F336-Y345 HydrophobicContact CE2-CD1 4.46Å; F336-Y345 AromaticContact CZ-CD1 3.38Å; F336-Y345 HydrophobicContact CZ-CD1 3.38Å; F336-Y345 HydrophobicContact CZ-CE1 4.05Å; F336-Y345 AromaticContact CZ-CG 3.67Å; F336-Y345 HydrophobicContact CZ-CG 3.67Å; K341-Y345 PolarHBondContact O-N 2.85Å; K341-Y345 VanDerWaalsContact O-N 3.12Å; L342-Y345 WeakPolarHBondContact O-CB 3.32Å; L342-Y345 PolarHBondContact O-N 3.38Å; L342-Y345 VanDerWaalsContact O-N 3.09Å; A343-Y345 VanDerWaalsContact C-N 3.31Å; A343-Y345 PolarHBondContact O-N 3.15Å; Y345-K347 VanDerWaalsContact C-N 3.31Å; Y345-K347 PolarHBondContact O-N 2.78Å; Y345-Y348 AromaticContact CD2-CD1 3.98Å; Y345-Y348 HydrophobicContact CD2-CD1 3.98Å; Y345-Y348 AromaticContact CE2-CD1 3.85Å; Y345-Y348 HydrophobicContact CE2-CD1 3.85Å; Y345-Y348 HydrophobicContact CE2-CE1 4.14Å; Y345-Y348 WeakPolarHBondContact O-CB 3.27Å; Y345-Y348 PolarHBondContact O-N 3.16Å; Y345-Y348 VanDerWaalsContact O-N 3.16Å; Y345-L349 HydrophobicContact CD1-CD1 4.02Å; Y345-L349 HydrophobicContact CD1-CG 4.41Å; Y345-L349 HydrophobicContact CE1-CD1 3.5Å; Y345-L349 VanDerWaalsContact CE1-CD1 3.5Å; Y345-L349 HydrophobicContact CE1-CG 4.02Å; Y345-L349 HydrophobicContact CE2-CG 4.48Å; Y345-L349 PolarHBondContact O-N 3.28Å; Y345-Y359 WeakPolarHBondContact CE1-OH 3.06Å; Y345-Y359 PolarHBondContact OH-OH 3.12Å
346	L	98.9	Very high	98.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-38.1	175	-61.2	-175.6	0	0	0	111.7	V228 I252 F283 V312 I331 L342 A343 L349 D350	V228-L346 HydrophobicContact CG2-CD1 3.94Å; I252-L346 HydrophobicContact CD1-CB 3.76Å; I252-L346 HydrophobicContact CD1-CD1 4.1Å; F283-L346 HydrophobicContact CD1-CD2 3.67Å; F283-L346 HydrophobicContact CD2-CB 4.23Å; F283-L346 HydrophobicContact CD2-CD1 4.49Å; F283-L346 HydrophobicContact CD2-CD2 4.27Å; F283-L346 HydrophobicContact CE1-CD2 3.77Å; F283-L346 HydrophobicContact CE2-CB 3.95Å; F283-L346 HydrophobicContact CE2-CD2 4.36Å; F283-L346 WeakPolarHBondContact CE2-O 3.41Å; F283-L346 HydrophobicContact CG-CD2 3.95Å; F283-L346 HydrophobicContact CZ-CB 4.22Å; F283-L346 HydrophobicContact CZ-CD2 4.14Å; F283-L346 WeakPolarHBondContact CZ-O 3.48Å; V312-L346 HydrophobicContact CG2-CD1 4.35Å; V312-L346 HydrophobicContact CG2-CD2 4.06Å; I331-L346 HydrophobicContact CD1-CD2 3.65Å; L342-L346 HydrophobicContact CD1-CD1 4.33Å; L342-L346 HydrophobicContact CD1-CD2 4.18Å; L342-L346 HydrophobicContact CD1-CG 4.08Å; L342-L346 HydrophobicContact CG-CD1 4.31Å; L342-L346 HydrophobicContact CG-CG 4.4Å; L342-L346 WeakPolarHBondContact O-CG 3.35Å; L342-L346 PolarHBondContact O-N 3.08Å; A343-L346 PolarHBondContact O-N 3.45Å; L346-L349 PolarHBondContact O-N 3.23Å; L346-D350 WeakPolarHBondContact O-CB 3.4Å; L346-D350 PolarHBondContact O-N 3.38Å
347	K	98.8	Very high	98.3	Very high	62 Å²	62	53 Å²	53	27%	0.27	25%	0.25	S	C	.	.	H	α-helix	trans	-67.6	-34.4	173	-70.5	169.1	-173.2	169.5	0	112.9	M227 Y251 A343 D344 Y345 R351	M227-K347 HydrophobicContact CE-CB 4.28Å; M227-K347 HydrophobicContact CE-CG 3.75Å; Y251-K347 WeakPolarHBondContact O-CE 3.07Å; Y251-K347 PolarHBondContact O-NZ 2.85Å; A343-K347 VanDerWaalsContact O-CG 3.31Å; A343-K347 WeakPolarHBondContact O-CG 3.21Å; A343-K347 PolarHBondContact O-N 3.27Å; D344-K347 PolarHBondContact O-N 3.32Å; Y345-K347 VanDerWaalsContact C-N 3.31Å; Y345-K347 PolarHBondContact O-N 2.78Å; K347-R351 WeakPolarHBondContact O-CD 3.02Å; K347-R351 VanDerWaalsContact O-CG 3.32Å; K347-R351 WeakPolarHBondContact O-CG 3.26Å; K347-R351 PolarHBondContact O-N 2.84Å
348	Y	98.7	Very high	98.3	Very high	111 Å²	111	51.1 Å²	51.1	44%	0.435	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-51.3	173	158.8	-102.9	0	0	0	110.8	D344 Y345 D350 R351 N352 A355	D344-Y348 PolarHBondContact O-N 2.85Å; Y345-Y348 AromaticContact CD2-CD1 3.98Å; Y345-Y348 HydrophobicContact CD2-CD1 3.98Å; Y345-Y348 AromaticContact CE2-CD1 3.85Å; Y345-Y348 HydrophobicContact CE2-CD1 3.85Å; Y345-Y348 HydrophobicContact CE2-CE1 4.14Å; Y345-Y348 WeakPolarHBondContact O-CB 3.27Å; Y345-Y348 PolarHBondContact O-N 3.16Å; Y345-Y348 VanDerWaalsContact O-N 3.16Å; Y348-D350 VanDerWaalsContact C-N 3.28Å; Y348-D350 PolarHBondContact O-N 3.5Å; Y348-R351 PolarHBondContact O-N 3.14Å; Y348-R351 VanDerWaalsContact O-N 3.09Å; Y348-N352 HydrophobicContact CD2-CB 4.47Å; Y348-N352 HydrophobicContact CE2-CB 4.03Å; Y348-N352 WeakPolarHBondContact O-CB 3.34Å; Y348-N352 PolarHBondContact O-N 3.3Å; Y348-N352 PolarHBondContact OH-ND2 2.87Å; Y348-A355 HydrophobicContact CE1-CB 3.86Å; Y348-A355 WeakPolarHBondContact OH-CB 3.31Å
349	L	98.6	Very high	98.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-37.4	177.6	-69.2	-178.7	0	0	0	111.9	F283 I331 Y345 L346 R351 N352 A355 Y359	F283-L349 HydrophobicContact CE1-CB 4.13Å; F283-L349 HydrophobicContact CE1-CD1 3.93Å; F283-L349 HydrophobicContact CZ-CB 3.79Å; F283-L349 HydrophobicContact CZ-CD1 4.39Å; I331-L349 HydrophobicContact CD1-CD1 3.52Å; Y345-L349 HydrophobicContact CD1-CD1 4.02Å; Y345-L349 HydrophobicContact CD1-CG 4.41Å; Y345-L349 HydrophobicContact CE1-CD1 3.5Å; Y345-L349 VanDerWaalsContact CE1-CD1 3.5Å; Y345-L349 HydrophobicContact CE1-CG 4.02Å; Y345-L349 HydrophobicContact CE2-CG 4.48Å; Y345-L349 PolarHBondContact O-N 3.28Å; L346-L349 PolarHBondContact O-N 3.23Å; L349-R351 PolarHBondContact O-N 2.69Å; L349-N352 CarbonylContact O-C 3.58Å; L349-N352 PolarHBondContact O-N 2.81Å; L349-A355 HydrophobicContact CD2-CB 3.8Å; L349-Y359 HydrophobicContact CD1-CD2 4.36Å; L349-Y359 HydrophobicContact CD1-CE2 3.78Å; L349-Y359 HydrophobicContact CD2-CE2 3.99Å
350	D	97.9	Very high	98.4	Very high	45 Å²	45	50.2 Å²	50.2	24%	0.241	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-35.6	174.9	177.1	64.3	0	0	0	112.9	M227 K282 L346 Y348	M227-D350 HydrophobicContact CE-CB 3.6Å; K282-D350 HydrophobicContact CD-CB 4.37Å; K282-D350 VanDerWaalsContact CD-OD1 3.28Å; K282-D350 WeakPolarHBondContact CD-OD1 3.05Å; K282-D350 WeakPolarHBondContact CE-OD1 3.18Å; K282-D350 PolarHBondContact NZ-O 2.83Å; K282-D350 IonicContact NZ-OD1 2.83Å; K282-D350 PolarHBondContact NZ-OD1 2.66Å; L346-D350 WeakPolarHBondContact O-CB 3.4Å; L346-D350 PolarHBondContact O-N 3.38Å; Y348-D350 VanDerWaalsContact C-N 3.28Å; Y348-D350 PolarHBondContact O-N 3.5Å
351	R	97.8	Very high	98.3	Very high	204 Å²	204	49.6 Å²	49.6	77%	0.77	23%	0.228	S	C	*	.	H	α-helix	trans	-93.6	-11.8	-177.9	-64.5	169.5	-173.9	175.1	-0.2	114.2	K347 Y348 L349	K347-R351 WeakPolarHBondContact O-CD 3.02Å; K347-R351 VanDerWaalsContact O-CG 3.32Å; K347-R351 WeakPolarHBondContact O-CG 3.26Å; K347-R351 PolarHBondContact O-N 2.84Å; Y348-R351 PolarHBondContact O-N 3.14Å; Y348-R351 VanDerWaalsContact O-N 3.09Å; L349-R351 PolarHBondContact O-N 2.69Å
352	N	98.3	Very high	98.2	Very high	52 Å²	52	44.9 Å²	44.9	28%	0.278	21%	0.207	S	C	.	.			trans	-121	92.8	-178.4	-174.8	-18.2	0	0	0	109.8	Y348 L349 T354 A355 Y356	Y348-N352 HydrophobicContact CD2-CB 4.47Å; Y348-N352 HydrophobicContact CE2-CB 4.03Å; Y348-N352 WeakPolarHBondContact O-CB 3.34Å; Y348-N352 PolarHBondContact O-N 3.3Å; Y348-N352 PolarHBondContact OH-ND2 2.87Å; L349-N352 CarbonylContact O-C 3.58Å; L349-N352 PolarHBondContact O-N 2.81Å; N352-T354 VanDerWaalsContact C-N 3.27Å; N352-T354 PolarHBondContact O-N 2.87Å; N352-T354 PolarHBondContact OD1-N 2.93Å; N352-A355 HydrophobicContact CB-CB 4.11Å; N352-A355 PolarHBondContact O-N 2.03Å; N352-A355 PolarHBondContact OD1-N 3.04Å; N352-A355 VanDerWaalsContact OD1-N 3.11Å; N352-Y356 WeakPolarHBondContact O-CB 3.37Å; N352-Y356 PolarHBondContact O-N 3.13Å
353	E	96.8	Very high	97.9	Very high	100 Å²	100	47 Å²	47	47%	0.467	22%	0.216	S	C	.	.	H	α-helix	trans	-61	-35.2	-178.2	-64.1	-167	164.8	0	0	112.7	N219 A221 Y356 N357	N219-E353 PolarHBondContact ND2-OE2 2.86Å; A221-E353 HydrophobicContact CB-CG 4.21Å; E353-Y356 PolarHBondContact O-N 2.91Å; E353-N357 WeakPolarHBondContact O-CB 3.34Å; E353-N357 PolarHBondContact O-N 2.96Å; E353-N357 PolarHBondContact O-ND2 3.22Å
354	T	98.2	Very high	97.6	Very high	82 Å²	82	52 Å²	52	50%	0.503	24%	0.24	S	C	.	.	H	α-helix	trans	-61.1	-53.7	177.4	-56.2	0	0	0	0	110.4	L215 N352 Y356 N357 E358	L215-T354 HydrophobicContact CD1-CG2 3.86Å; N352-T354 VanDerWaalsContact C-N 3.27Å; N352-T354 PolarHBondContact O-N 2.87Å; N352-T354 PolarHBondContact OD1-N 2.93Å; T354-Y356 VanDerWaalsContact C-N 3.29Å; T354-Y356 PolarHBondContact O-N 2.05Å; T354-N357 PolarHBondContact O-N 2.96Å; T354-N357 VanDerWaalsContact O-N 3.14Å; T354-E358 PolarHBondContact O-N 3.36Å
355	A	98.4	Very high	97.3	Very high	4 Å²	4	50.5 Å²	50.5	3%	0.033	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-34.5	179	0	0	0	0	0	112.5	Y348 L349 N352	Y348-A355 HydrophobicContact CE1-CB 3.86Å; Y348-A355 WeakPolarHBondContact OH-CB 3.31Å; L349-A355 HydrophobicContact CD2-CB 3.8Å; N352-A355 HydrophobicContact CB-CB 4.11Å; N352-A355 PolarHBondContact O-N 2.03Å; N352-A355 PolarHBondContact OD1-N 3.04Å; N352-A355 VanDerWaalsContact OD1-N 3.11Å
356	Y	98.6	Very high	96.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.3	-43.1	173.4	177.8	-91.2	0	0	0	112	A221 K224 K282 F283 I310 N352 E353 T354 E358 Y359 F360	A221-Y356 HydrophobicContact CB-CD1 3.74Å; A221-Y356 HydrophobicContact CB-CE1 3.91Å; K224-Y356 WeakPolarHBondContact CD-OH 3.42Å; K282-Y356 HydrophobicContact CB-CE2 3.62Å; K282-Y356 HydrophobicContact CD-CD2 4.39Å; K282-Y356 HydrophobicContact CD-CE2 4.12Å; K282-Y356 HydrophobicContact CG-CE2 3.82Å; K282-Y356 PolarHBondContact O-OH 3.44Å; F283-Y356 HydrophobicContact CE1-CD2 4.29Å; F283-Y356 HydrophobicContact CE1-CE2 4.2Å; F283-Y356 HydrophobicContact CZ-CD2 4.34Å; F283-Y356 HydrophobicContact CZ-CE2 4.4Å; I310-Y356 HydrophobicContact CD1-CD2 3.48Å; I310-Y356 VanDerWaalsContact CD1-CD2 3.48Å; I310-Y356 HydrophobicContact CD1-CE2 3.38Å; I310-Y356 HydrophobicContact CD1-CG 4.25Å; I310-Y356 HydrophobicContact CG1-CD2 4.48Å; I310-Y356 HydrophobicContact CG1-CE2 3.92Å; N352-Y356 WeakPolarHBondContact O-CB 3.37Å; N352-Y356 PolarHBondContact O-N 3.13Å; E353-Y356 PolarHBondContact O-N 2.91Å; T354-Y356 VanDerWaalsContact C-N 3.29Å; T354-Y356 PolarHBondContact O-N 2.05Å; Y356-E358 VanDerWaalsContact C-N 3.3Å; Y356-E358 PolarHBondContact O-N 2.84Å; Y356-Y359 PolarHBondContact O-N 3.18Å; Y356-F360 HydrophobicContact CD1-CD2 4.38Å; Y356-F360 HydrophobicContact CD1-CE2 4.02Å; Y356-F360 HydrophobicContact CE1-CD2 4.02Å; Y356-F360 AromaticContact CE1-CE2 3.36Å; Y356-F360 HydrophobicContact CE1-CE2 3.36Å; Y356-F360 HydrophobicContact CE1-CZ 4.14Å; Y356-F360 HydrophobicContact CE2-CE2 4.14Å; Y356-F360 AromaticContact CZ-CE2 3.43Å; Y356-F360 VanDerWaalsContact CZ-CE2 3.43Å; Y356-F360 AromaticContact CZ-CZ 3.91Å; Y356-F360 WeakPolarHBondContact O-CD2 3.04Å; Y356-F360 WeakPolarHBondContact OH-CZ 3.3Å
357	N	98.2	Very high	96.6	Very high	13 Å²	13	51 Å²	51	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-73.3	-18.5	-177.8	-79.5	-72.6	0	0	0	113.9	L215 P216 R218 N219 Y220 E353 T354 Y359 F360 A361	L215-N357 HydrophobicContact CD2-CB 4.23Å; P216-N357 WeakPolarHBondContact CD-O 3.24Å; P216-N357 HydrophobicContact CG-CB 4.33Å; R218-N357 PolarHBondContact O-OD1 3.18Å; N219-N357 WeakPolarHBondContact CA-OD1 3.21Å; N219-N357 PolarHBondContact OD1-ND2 2.8Å; Y220-N357 PolarHBondContact N-OD1 3.13Å; E353-N357 WeakPolarHBondContact O-CB 3.34Å; E353-N357 PolarHBondContact O-N 2.96Å; E353-N357 PolarHBondContact O-ND2 3.22Å; T354-N357 PolarHBondContact O-N 2.96Å; T354-N357 VanDerWaalsContact O-N 3.14Å; N357-Y359 PolarHBondContact O-N 2.84Å; N357-F360 PolarHBondContact O-N 2.99Å; N357-A361 PolarHBondContact O-N 3.09Å
358	E	97.9	Very high	96	Very high	90 Å²	90	49.3 Å²	49.3	42%	0.421	24%	0.235	S	C	.	.	H	α-helix	trans	-55.9	-34.3	171.2	-68.9	174.6	169.1	0	0	111.7	L215 T354 Y356 F360 A361	L215-E358 HydrophobicContact CD2-CB 4.41Å; L215-E358 HydrophobicContact CD2-CG 3.64Å; T354-E358 PolarHBondContact O-N 3.36Å; Y356-E358 VanDerWaalsContact C-N 3.3Å; Y356-E358 PolarHBondContact O-N 2.84Å; E358-F360 PolarHBondContact O-N 3.43Å; E358-A361 WeakPolarHBondContact O-CB 3.08Å; E358-A361 PolarHBondContact O-N 3.38Å
359	Y	98.4	Very high	94.9	Very high	9 Å²	9	45.5 Å²	45.5	4%	0.035	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-11	178	-73.9	-91.3	0	0	0	114.9	I310 H328 I331 Y345 L349 Y356 N357 W362	I310-Y359 HydrophobicContact CD1-CD1 4.46Å; I310-Y359 HydrophobicContact CD1-CD2 3.85Å; I310-Y359 HydrophobicContact CD1-CG 3.72Å; I310-Y359 HydrophobicContact CG1-CG 4.27Å; I310-Y359 HydrophobicContact CG2-CD1 3.94Å; I310-Y359 HydrophobicContact CG2-CE1 4.44Å; I310-Y359 HydrophobicContact CG2-CG 4.24Å; H328-Y359 WeakPolarHBondContact O-CA 3.35Å; H328-Y359 WeakPolarHBondContact O-CD1 3.49Å; I331-Y359 HydrophobicContact CD1-CE1 4.4Å; I331-Y359 HydrophobicContact CG1-CD1 4.41Å; I331-Y359 HydrophobicContact CG1-CE1 3.6Å; Y345-Y359 WeakPolarHBondContact CE1-OH 3.06Å; Y345-Y359 PolarHBondContact OH-OH 3.12Å; L349-Y359 HydrophobicContact CD1-CD2 4.36Å; L349-Y359 HydrophobicContact CD1-CE2 3.78Å; L349-Y359 HydrophobicContact CD2-CE2 3.99Å; Y356-Y359 PolarHBondContact O-N 3.18Å; N357-Y359 PolarHBondContact O-N 2.84Å; Y359-W362 PolarHBondContact O-NE1 2.78Å
360	F	97.8	Very high	93	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.018	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	5.6	-179.6	-64	-86.8	0	0	0	112.7	P216 Y220 N308 I310 Y356 N357 E358 W362 H363	P216-F360 HydrophobicContact CG-CB 4.19Å; Y220-F360 HydrophobicContact CD1-CB 4.43Å; Y220-F360 AromaticContact CD1-CD1 3.66Å; Y220-F360 HydrophobicContact CD1-CD1 3.66Å; Y220-F360 HydrophobicContact CD1-CE1 4.11Å; Y220-F360 HydrophobicContact CD1-CG 4.06Å; Y220-F360 HydrophobicContact CD2-CB 3.33Å; Y220-F360 HydrophobicContact CD2-CD1 4.1Å; Y220-F360 HydrophobicContact CD2-CD2 4.34Å; Y220-F360 AromaticContact CD2-CG 3.67Å; Y220-F360 HydrophobicContact CD2-CG 3.67Å; Y220-F360 HydrophobicContact CE1-CD1 4.09Å; Y220-F360 HydrophobicContact CE2-CB 3.62Å; Y220-F360 HydrophobicContact CE2-CD1 4.49Å; Y220-F360 HydrophobicContact CE2-CG 4.27Å; Y220-F360 HydrophobicContact CG-CB 3.78Å; Y220-F360 AromaticContact CG-CD1 3.65Å; Y220-F360 HydrophobicContact CG-CD1 3.65Å; Y220-F360 HydrophobicContact CG-CD2 4.06Å; Y220-F360 HydrophobicContact CG-CE1 4.27Å; Y220-F360 AromaticContact CG-CG 3.55Å; Y220-F360 HydrophobicContact CG-CG 3.55Å; N308-F360 HydrophobicContact CB-CE1 4.38Å; I310-F360 HydrophobicContact CD1-CE2 3.84Å; I310-F360 HydrophobicContact CD1-CZ 4.45Å; I310-F360 HydrophobicContact CG1-CD2 4.43Å; I310-F360 HydrophobicContact CG1-CE2 3.41Å; I310-F360 VanDerWaalsContact CG1-CE2 3.41Å; I310-F360 HydrophobicContact CG1-CZ 3.55Å; Y356-F360 HydrophobicContact CD1-CD2 4.38Å; Y356-F360 HydrophobicContact CD1-CE2 4.02Å; Y356-F360 HydrophobicContact CE1-CD2 4.02Å; Y356-F360 AromaticContact CE1-CE2 3.36Å; Y356-F360 HydrophobicContact CE1-CE2 3.36Å; Y356-F360 HydrophobicContact CE1-CZ 4.14Å; Y356-F360 HydrophobicContact CE2-CE2 4.14Å; Y356-F360 AromaticContact CZ-CE2 3.43Å; Y356-F360 VanDerWaalsContact CZ-CE2 3.43Å; Y356-F360 AromaticContact CZ-CZ 3.91Å; Y356-F360 WeakPolarHBondContact O-CD2 3.04Å; Y356-F360 WeakPolarHBondContact OH-CZ 3.3Å; N357-F360 PolarHBondContact O-N 2.99Å; E358-F360 PolarHBondContact O-N 3.43Å; F360-W362 PolarHBondContact O-N 2.88Å; F360-W362 VanDerWaalsContact O-N 3.12Å; F360-H363 AromaticContact CD1-CE1 3.56Å; F360-H363 AromaticContact CD1-ND1 3.92Å; F360-H363 PolarHBondContact O-N 3.4Å; F360-H363 PolarHBondContact O-ND1 2.92Å
361	A	97.2	Very high	91.3	Very high	8 Å²	8	47 Å²	47	7%	0.066	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-61.3	-21.2	179.7	0	0	0	0	0	113.1	K214 N357 E358 H363 H365	K214-A361 VanDerWaalsContact O-CB 3.29Å; K214-A361 WeakPolarHBondContact O-CB 3.35Å; N357-A361 PolarHBondContact O-N 3.09Å; E358-A361 WeakPolarHBondContact O-CB 3.08Å; E358-A361 PolarHBondContact O-N 3.38Å; A361-H363 PolarHBondContact O-N 2.83Å; A361-H365 PolarHBondContact O-CD2 2.63Å; A361-H365 VanDerWaalsContact O-CD2 3.24Å
362	W	95.8	Very high	89.7	Confident	11 Å²	11	40 Å²	40	4%	0.042	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-73.6	-19.8	179.7	66	-93.7	0	0	0	114.7	Y200 Y213 F305 P326 Y359 F360 E364 H365 G366 I368	Y200-W362 HydrophobicContact CD2-CE3 4.41Å; Y200-W362 AromaticContact CE2-CE3 3.93Å; Y200-W362 HydrophobicContact CE2-CE3 3.93Å; Y200-W362 HydrophobicContact CE2-CZ3 4.48Å; Y213-W362 HydrophobicContact CD2-CB 4.12Å; Y213-W362 HydrophobicContact CE2-CB 4.12Å; F305-W362 HydrophobicContact CB-CH2 4.1Å; F305-W362 HydrophobicContact CB-CZ2 3.97Å; F305-W362 AromaticContact CD1-CZ2 3.89Å; F305-W362 HydrophobicContact CD1-CZ2 3.89Å; F305-W362 HydrophobicContact CG-CZ2 4.1Å; P326-W362 HydrophobicContact CB-CB 3.6Å; P326-W362 HydrophobicContact CB-CD2 3.5Å; P326-W362 HydrophobicContact CB-CE3 3.91Å; P326-W362 HydrophobicContact CB-CG 3.36Å; P326-W362 HydrophobicContact CG-CD2 3.59Å; P326-W362 HydrophobicContact CG-CE3 3.75Å; P326-W362 HydrophobicContact CG-CG 4.01Å; P326-W362 HydrophobicContact CG-CH2 4.34Å; P326-W362 HydrophobicContact CG-CZ2 4.18Å; P326-W362 HydrophobicContact CG-CZ3 4.14Å; Y359-W362 PolarHBondContact O-NE1 2.78Å; F360-W362 PolarHBondContact O-N 2.88Å; F360-W362 VanDerWaalsContact O-N 3.12Å; W362-E364 PolarHBondContact O-N 2.76Å; W362-E364 VanDerWaalsContact O-N 3.11Å; W362-H365 PolarHBondContact O-N 2.78Å; W362-G366 PolarHBondContact O-N 2.74Å; W362-I368 HydrophobicContact CH2-CD1 4.06Å; W362-I368 HydrophobicContact CH2-CG1 3.69Å; W362-I368 HydrophobicContact CZ3-CD1 4.08Å; W362-I368 HydrophobicContact CZ3-CG1 3.86Å
363	H	93.9	Very high	88.2	Confident	43 Å²	43	37.8 Å²	37.8	20%	0.199	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-58.8	-26.5	-172.7	-85.9	72	0	0	0	114.8	Y220 N308 F360 A361	Y220-H363 AromaticContact CE1-NE2 3.99Å; Y220-H363 AromaticContact CZ-CD2 3.86Å; Y220-H363 AromaticContact CZ-CG 3.82Å; Y220-H363 WeakPolarHBondContact OH-CB 3.32Å; Y220-H363 PolarHBondContact OH-CD2 2.63Å; Y220-H363 VanDerWaalsContact OH-CG 3.24Å; N308-H363 PolarHBondContact OD1-NE2 2.58Å; F360-H363 AromaticContact CD1-CE1 3.56Å; F360-H363 AromaticContact CD1-ND1 3.92Å; F360-H363 PolarHBondContact O-N 3.4Å; F360-H363 PolarHBondContact O-ND1 2.92Å; A361-H363 PolarHBondContact O-N 2.83Å
364	E	91.1	Very high	87.4	Confident	105 Å²	105	34.5 Å²	34.5	49%	0.491	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-92	1.2	178.7	-62.6	178.5	-172.9	0	0	112.7	S217 W362	S217-E364 WeakPolarHBondContact CB-OE1 3.44Å; S217-E364 PolarHBondContact N-OE1 3.36Å; S217-E364 VanDerWaalsContact N-OE1 3.14Å; S217-E364 PolarHBondContact OG-OE1 3.36Å; W362-E364 PolarHBondContact O-N 2.76Å; W362-E364 VanDerWaalsContact O-N 3.11Å
365	H	93.5	Very high	86.8	Confident	51 Å²	51	30.6 Å²	30.6	24%	0.236	17%	0.166	C	C	.	.	S	Bend	trans	-131.6	9.4	-167	-59.5	-54.6	0	0	0	114.5	Y200 P202 S203 Y213 A361 W362	Y200-H365 PolarHBondContact OH-O 2.83Å; P202-H365 WeakPolarHBondContact CA-O 3.06Å; S203-H365 PolarHBondContact N-O 3.19Å; S203-H365 VanDerWaalsContact OG-C 3.28Å; S203-H365 PolarHBondContact OG-O 3.03Å; Y213-H365 HydrophobicContact CD1-CB 3.94Å; Y213-H365 AromaticContact CD1-CD2 3.12Å; Y213-H365 WeakPolarHBondContact CD1-CD2 3.47Å; Y213-H365 AromaticContact CD1-CG 3.53Å; Y213-H365 AromaticContact CD1-NE2 3.69Å; Y213-H365 HydrophobicContact CD2-CB 4.45Å; Y213-H365 AromaticContact CD2-CD2 3.99Å; Y213-H365 HydrophobicContact CE1-CB 3.55Å; Y213-H365 AromaticContact CE1-CD2 3.71Å; Y213-H365 AromaticContact CE1-CG 3.61Å; Y213-H365 HydrophobicContact CE2-CB 4.1Å; Y213-H365 HydrophobicContact CG-CB 4.38Å; Y213-H365 AromaticContact CG-CD2 3.29Å; A361-H365 PolarHBondContact O-CD2 2.63Å; A361-H365 VanDerWaalsContact O-CD2 3.24Å; W362-H365 PolarHBondContact O-N 2.78Å
366	G	91	Very high	86.3	Confident	6 Å²	6	30.8 Å²	30.8	6%	0.062	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177	176.8	173.5	0	0	0	0	0	112.4	V201 S203 W362	V201-G366 CarbonylContact O-C 3.59Å; V201-G366 WeakPolarHBondContact O-CA 3.06Å; S203-G366 PolarHBondContact OG-N 2.86Å; W362-G366 PolarHBondContact O-N 2.74Å
367	T	90.7	Very high	85.7	Confident	72 Å²	72	31.2 Å²	31.2	44%	0.442	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.8	-174.2	49.7	0	0	0	0	110.8	Y200 V201 A370	Y200-T367 WeakPolarHBondContact CA-O 3.33Å; V201-T367 PolarHBondContact N-O 2.85Å; V201-T367 PolarHBondContact O-N 3.31Å; T367-A370 WeakPolarHBondContact OG1-CB 3.17Å
368	I	88	Confident	85.1	Confident	26 Å²	26	31 Å²	31	13%	0.133	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	142.2	170.7	-56.8	-61.8	0	0	0	108.4	N199 Y200 F301 F305 P326 W362 A370	N199-I368 CarbonylContact O-C 3.59Å; N199-I368 WeakPolarHBondContact O-CA 3.29Å; Y200-I368 HydrophobicContact CD2-CD1 3.92Å; Y200-I368 HydrophobicContact CG-CD1 4.43Å; F301-I368 HydrophobicContact CB-CG2 4.32Å; F301-I368 HydrophobicContact CD1-CD1 4.04Å; F301-I368 HydrophobicContact CD1-CG2 3.94Å; F301-I368 HydrophobicContact CE1-CD1 4.31Å; F305-I368 HydrophobicContact CB-CD1 4.31Å; F305-I368 HydrophobicContact CB-CG1 4.15Å; F305-I368 HydrophobicContact CD2-CD1 4.09Å; F305-I368 HydrophobicContact CG-CD1 4.48Å; P326-I368 HydrophobicContact CG-CD1 3.95Å; W362-I368 HydrophobicContact CH2-CD1 4.06Å; W362-I368 HydrophobicContact CH2-CG1 3.69Å; W362-I368 HydrophobicContact CZ3-CD1 4.08Å; W362-I368 HydrophobicContact CZ3-CG1 3.86Å; I368-A370 PolarHBondContact O-N 2.84Å
369	D	75.2	Confident	84.7	Confident	31 Å²	31	26.7 Å²	26.7	17%	0.166	15%	0.148	C	C	.	.	S	Bend	trans	62.5	17.8	177	-56.3	-23	0	0	0	115.1	L51 H198 N199 W371	L51-D369 HydrophobicContact CD1-CB 4.43Å; L51-D369 WeakPolarHBondContact CD1-O 3.35Å; H198-D369 WeakPolarHBondContact CA-OD1 3Å; H198-D369 WeakPolarHBondContact CB-OD1 3.49Å; H198-D369 IonicContact CD2-OD1 2.85Å; H198-D369 PolarHBondContact CD2-OD1 3.39Å; H198-D369 IonicContact CD2-OD2 3.5Å; H198-D369 PolarHBondContact CD2-OD2 2.89Å; H198-D369 VanDerWaalsContact CD2-OD2 3.22Å; H198-D369 IonicContact CG-OD1 3.87Å; H198-D369 VanDerWaalsContact CG-OD1 3.3Å; H198-D369 IonicContact NE2-OD2 3.69Å; N199-D369 PolarHBondContact O-N 3.21Å; D369-W371 PolarHBondContact O-N 2.91Å
370	A	58.7	Low	84.3	Confident	45 Å²	45	26.2 Å²	26.2	37%	0.372	15%	0.146	S	C	.	.			trans	-57.4	-22.3	-177.7	0	0	0	0	0	113.3	V201 T367 I368	V201-A370 HydrophobicContact CB-CB 3.89Å; V201-A370 HydrophobicContact CG2-CB 3.62Å; T367-A370 WeakPolarHBondContact OG1-CB 3.17Å; I368-A370 PolarHBondContact O-N 2.84Å
371	W	62.3	Low	83.8	Confident	32 Å²	32	27.1 Å²	27.1	12%	0.121	15%	0.151	C	C	.	.			trans	-114.9	128.4	179.8	166.9	65.8	0	0	0	110.1	E77 P196 N199 D369 P373	E77-W371 VanDerWaalsContact C-CE2 3.45Å; E77-W371 WeakPolarHBondContact O-CH2 3.24Å; E77-W371 WeakPolarHBondContact O-CZ2 3.11Å; P196-W371 HydrophobicContact CG-CZ3 3.88Å; N199-W371 HydrophobicContact CB-CE3 4.27Å; N199-W371 PolarHBondContact OD1-O 3.09Å; N199-W371 VanDerWaalsContact OD1-O 3.06Å; D369-W371 PolarHBondContact O-N 2.91Å; W371-P373 VanDerWaalsContact CE2-CA 3.47Å; W371-P373 HydrophobicContact CE3-CG 4.27Å; W371-P373 HydrophobicContact CH2-CB 3.44Å; W371-P373 VanDerWaalsContact CH2-CB 3.44Å; W371-P373 HydrophobicContact CH2-CG 3.67Å; W371-P373 HydrophobicContact CZ2-CB 3.31Å; W371-P373 HydrophobicContact CZ2-CG 3.89Å; W371-P373 HydrophobicContact CZ3-CB 4.16Å; W371-P373 HydrophobicContact CZ3-CG 3.86Å; W371-P373 VanDerWaalsContact O-CD 3.31Å; W371-P373 WeakPolarHBondContact O-CD 3.49Å
372	S	63.1	Low	83.4	Confident	55 Å²	55	26.9 Å²	26.9	39%	0.385	15%	0.149	S	C	.	.			trans	-98	109.4	167.2	-175.4	0	0	0	0	108.2	F37 M374	F37-S372 WeakPolarHBondContact CZ-OG 3.4Å; S372-M374 WeakPolarHBondContact O-CG 3.42Å; S372-M374 PolarHBondContact O-N 2.77Å
373	P	68.4	Low	83.2	Confident	7 Å²	7	26.8 Å²	26.8	5%	0.045	15%	0.15	C	C	.	.			trans	-52.4	137.3	168.7	1.2	-11.2	0	0	0	111.9	F37 N78 L195 W371 P375	F37-P373 HydrophobicContact CE1-CG 3.88Å; F37-P373 HydrophobicContact CZ-CG 3.74Å; N78-P373 VanDerWaalsContact OD1-CB 3.3Å; N78-P373 WeakPolarHBondContact OD1-CB 3.47Å; L195-P373 HydrophobicContact CD1-CB 3.15Å; L195-P373 HydrophobicContact CD1-CG 3.31Å; W371-P373 VanDerWaalsContact CE2-CA 3.47Å; W371-P373 HydrophobicContact CE3-CG 4.27Å; W371-P373 HydrophobicContact CH2-CB 3.44Å; W371-P373 VanDerWaalsContact CH2-CB 3.44Å; W371-P373 HydrophobicContact CH2-CG 3.67Å; W371-P373 HydrophobicContact CZ2-CB 3.31Å; W371-P373 HydrophobicContact CZ2-CG 3.89Å; W371-P373 HydrophobicContact CZ3-CB 4.16Å; W371-P373 HydrophobicContact CZ3-CG 3.86Å; W371-P373 VanDerWaalsContact O-CD 3.31Å; W371-P373 WeakPolarHBondContact O-CD 3.49Å; P373-P375 VanDerWaalsContact O-CD 3.28Å; P373-P375 WeakPolarHBondContact O-CD 3.39Å
374	M	78	Confident	82.9	Confident	31 Å²	31	25.4 Å²	25.4	15%	0.153	14%	0.144	C	C	.	.			trans	-120.1	64.2	179.1	-59.8	-169.1	-170.7	0	0	110.5	Y76 N78 F121 S372 Q376 C377	Y76-M374 HydrophobicContact CD1-CB 4.03Å; Y76-M374 HydrophobicContact CD1-CG 4.15Å; Y76-M374 HydrophobicContact CD1-SD 3.24Å; Y76-M374 WeakPolarHBondContact CD1-SD 3.45Å; Y76-M374 HydrophobicContact CE1-CE 4.42Å; Y76-M374 HydrophobicContact CE1-SD 3.28Å; Y76-M374 WeakPolarHBondContact CE1-SD 3.38Å; Y76-M374 HydrophobicContact CG-SD 4.46Å; N78-M374 PolarHBondContact ND2-O 3.41Å; N78-M374 VanDerWaalsContact ND2-O 3.16Å; F121-M374 HydrophobicContact CD2-SD 3.97Å; F121-M374 HydrophobicContact CE2-CG 4.34Å; F121-M374 HydrophobicContact CE2-SD 3.47Å; F121-M374 WeakPolarHBondContact CE2-SD 3.01Å; F121-M374 HydrophobicContact CZ-SD 4.39Å; S372-M374 WeakPolarHBondContact O-CG 3.42Å; S372-M374 PolarHBondContact O-N 2.77Å; M374-Q376 VanDerWaalsContact CA-OE1 3.24Å; M374-Q376 PolarHBondContact O-N 2.85Å; M374-Q376 VanDerWaalsContact O-N 3.15Å; M374-C377 HydrophobicContact CB-CB 4.45Å; M374-C377 PolarHBondContact O-N 3.16Å; M374-C377 VanDerWaalsContact O-N 3.08Å
375	P	86.8	Confident	82.7	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-53.7	-34.1	-178.9	23.9	-35.5	0	0	0	112.3	N78 I115 I116 I185 I193 L195 P373 C377 V378 I379	N78-P375 WeakPolarHBondContact ND2-CA 3.12Å; I115-P375 HydrophobicContact CD1-CG 3.69Å; I115-P375 HydrophobicContact CG1-CG 4.22Å; I116-P375 HydrophobicContact CG1-CG 4.26Å; I185-P375 HydrophobicContact CD1-CB 4.37Å; I185-P375 HydrophobicContact CG2-CB 4.13Å; I193-P375 HydrophobicContact CG2-CB 4.35Å; L195-P375 HydrophobicContact CD1-CG 4.38Å; L195-P375 HydrophobicContact CD2-CB 4.42Å; L195-P375 HydrophobicContact CD2-CG 4.04Å; P373-P375 VanDerWaalsContact O-CD 3.28Å; P373-P375 WeakPolarHBondContact O-CD 3.39Å; P375-C377 VanDerWaalsContact C-N 3.3Å; P375-C377 PolarHBondContact O-N 3.12Å; P375-V378 PolarHBondContact O-N 3.28Å; P375-V378 VanDerWaalsContact O-N 3.14Å; P375-I379 HydrophobicContact CB-CD1 4.33Å; P375-I379 WeakPolarHBondContact O-CD1 3.3Å; P375-I379 WeakPolarHBondContact O-CG1 3.14Å; P375-I379 PolarHBondContact O-N 3.25Å
376	Q	87.6	Confident	82.4	Confident	7 Å²	7	18.8 Å²	18.8	3%	0.033	12%	0.116	C	C	.	.	H	α-helix	trans	-54.4	-40.3	176.3	65.3	-82.4	26.2	0	0	113.7	I115 I116 F119 F121 M374 I379 C380	I115-Q376 PolarHBondContact O-NE2 3.3Å; I115-Q376 PolarHBondContact O-OE1 3.11Å; I116-Q376 HydrophobicContact CB-CB 4.19Å; I116-Q376 HydrophobicContact CG1-CB 4.18Å; I116-Q376 HydrophobicContact CG2-CB 3.82Å; F119-Q376 HydrophobicContact CD1-CB 3.99Å; F119-Q376 WeakPolarHBondContact CD1-O 3.46Å; F119-Q376 HydrophobicContact CE1-CB 3.64Å; F119-Q376 VanDerWaalsContact CE1-O 3.3Å; F119-Q376 WeakPolarHBondContact CE1-O 3.43Å; F119-Q376 HydrophobicContact CZ-CB 4.29Å; F121-Q376 HydrophobicContact CE2-CG 4.4Å; F121-Q376 HydrophobicContact CZ-CG 4.32Å; M374-Q376 VanDerWaalsContact CA-OE1 3.24Å; M374-Q376 PolarHBondContact O-N 2.85Å; M374-Q376 VanDerWaalsContact O-N 3.15Å; Q376-I379 PolarHBondContact O-N 3.46Å; Q376-C380 WeakPolarHBondContact O-CB 3.49Å; Q376-C380 PolarHBondContact O-N 2.8Å
377	C	85.5	Confident	82.2	Confident	10 Å²	10	23.6 Å²	23.6	7%	0.068	14%	0.136	C	C	.	.	H	α-helix	trans	-70.9	-37.7	179.7	-62.6	0	0	0	0	111.5	Y76 C122 M374 P375 L381	Y76-C377 HydrophobicContact CD1-CB 4.18Å; C122-C377 WeakPolarHBondContact CA-SG 3.41Å; C122-C377 HydrophobicContact CB-CB 3.61Å; C122-C377 WeakPolarHBondContact CB-SG 3.47Å; C122-C377 WeakPolarHBondContact SG-CA 3.49Å; C122-C377 WeakPolarHBondContact SG-CB 3.31Å; C122-C377 CovalentContact SG-SG 2.05Å; C122-C377 PolarHBondContact SG-SG 2.92Å; M374-C377 HydrophobicContact CB-CB 4.45Å; M374-C377 PolarHBondContact O-N 3.16Å; M374-C377 VanDerWaalsContact O-N 3.08Å; P375-C377 VanDerWaalsContact C-N 3.3Å; P375-C377 PolarHBondContact O-N 3.12Å; C377-L381 VanDerWaalsContact O-CB 3.24Å; C377-L381 WeakPolarHBondContact O-CB 3.44Å; C377-L381 PolarHBondContact O-N 3.43Å
378	V	85.4	Confident	81.8	Confident	7 Å²	7	24.8 Å²	24.8	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-70	-42.1	176.7	-177.2	0	0	0	0	110.9	N78 I80 I193 P375 L381 L382	N78-V378 HydrophobicContact CB-CG2 4.19Å; N78-V378 WeakPolarHBondContact ND2-CG2 3.48Å; I80-V378 HydrophobicContact CD1-CB 4.39Å; I80-V378 HydrophobicContact CD1-CG1 3.6Å; I80-V378 HydrophobicContact CD1-CG2 3.86Å; I80-V378 HydrophobicContact CG1-CG1 3.96Å; I80-V378 HydrophobicContact CG1-CG2 4.26Å; I193-V378 HydrophobicContact CD1-CB 3.89Å; I193-V378 HydrophobicContact CD1-CG1 3.45Å; I193-V378 VanDerWaalsContact CD1-CG1 3.45Å; I193-V378 HydrophobicContact CG1-CG1 4.02Å; P375-V378 PolarHBondContact O-N 3.28Å; P375-V378 VanDerWaalsContact O-N 3.14Å; V378-L381 PolarHBondContact O-N 3.26Å; V378-L382 HydrophobicContact CG1-CD1 3.98Å; V378-L382 HydrophobicContact CG1-CG 4.43Å; V378-L382 WeakPolarHBondContact O-CB 3.36Å; V378-L382 VanDerWaalsContact O-CG 3.3Å; V378-L382 WeakPolarHBondContact O-CG 3.46Å; V378-L382 PolarHBondContact O-N 3.47Å
379	I	91.1	Very high	81.6	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-48.8	176.4	-65.7	159.4	0	0	0	110.2	I105 I116 V141 I143 F161 I185 P375 Q376 L381 L382 A383	I105-I379 HydrophobicContact CD1-CG2 3.76Å; I105-I379 HydrophobicContact CG1-CG2 4.26Å; I105-I379 HydrophobicContact CG2-CG2 4.32Å; I116-I379 HydrophobicContact CD1-CD1 3.37Å; I116-I379 HydrophobicContact CG1-CD1 4.2Å; V141-I379 HydrophobicContact CG1-CG2 4.02Å; V141-I379 HydrophobicContact CG2-CG2 4.49Å; I143-I379 HydrophobicContact CD1-CD1 3.89Å; I143-I379 HydrophobicContact CD1-CG2 4.47Å; F161-I379 HydrophobicContact CD1-CG1 4.18Å; F161-I379 HydrophobicContact CE1-CG1 3.82Å; F161-I379 HydrophobicContact CE2-CG2 4.45Å; F161-I379 HydrophobicContact CZ-CB 4.48Å; F161-I379 HydrophobicContact CZ-CG1 4.24Å; F161-I379 HydrophobicContact CZ-CG2 4.26Å; I185-I379 HydrophobicContact CD1-CD1 3.54Å; I185-I379 HydrophobicContact CD1-CG1 3.8Å; P375-I379 HydrophobicContact CB-CD1 4.33Å; P375-I379 WeakPolarHBondContact O-CD1 3.3Å; P375-I379 WeakPolarHBondContact O-CG1 3.14Å; P375-I379 PolarHBondContact O-N 3.25Å; Q376-I379 PolarHBondContact O-N 3.46Å; I379-L381 VanDerWaalsContact C-N 3.32Å; I379-L381 PolarHBondContact O-N 2.9Å; I379-L382 PolarHBondContact O-N 3.02Å; I379-A383 WeakPolarHBondContact O-CB 3.3Å; I379-A383 PolarHBondContact O-N 3.19Å
380	C	89.7	Confident	82	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.5	-41.5	-179.9	-173.3	0	0	0	0	111.3	F119 A124 C127 Q376 L382 A383 H384	F119-C380 HydrophobicContact CD1-CB 3.66Å; F119-C380 HydrophobicContact CE1-CB 3.97Å; A124-C380 PolarHBondContact O-SG 2.99Å; C127-C380 HydrophobicContact CB-CB 3.86Å; C127-C380 WeakPolarHBondContact CB-SG 3.36Å; C127-C380 WeakPolarHBondContact SG-CA 3.44Å; C127-C380 WeakPolarHBondContact SG-CB 3.24Å; C127-C380 CovalentContact SG-SG 2.03Å; C127-C380 PolarHBondContact SG-SG 2.89Å; Q376-C380 WeakPolarHBondContact O-CB 3.49Å; Q376-C380 PolarHBondContact O-N 2.8Å; C380-L382 PolarHBondContact O-N 3.41Å; C380-A383 WeakPolarHBondContact O-CB 3.47Å; C380-A383 PolarHBondContact O-N 3.4Å; C380-H384 PolarHBondContact O-CD2 3.43Å; C380-H384 VanDerWaalsContact O-CD2 3.26Å; C380-H384 PolarHBondContact O-N 3.38Å; C380-H384 VanDerWaalsContact O-N 3.16Å
381	L	85.7	Confident	83.3	Confident	22 Å²	22	35.3 Å²	35.3	12%	0.115	18%	0.184	C	C	.	.	H	α-helix	trans	-57	-50.7	173.4	-178.4	64.4	0	0	0	111.4	L92 F123 A124 C377 V378 I379 A383 H384 T385	L92-L381 HydrophobicContact CD1-CD2 4.27Å; L92-L381 HydrophobicContact CD2-CD1 4.06Å; L92-L381 HydrophobicContact CD2-CD2 4.22Å; L92-L381 HydrophobicContact CD2-CG 4Å; F123-L381 HydrophobicContact CD1-CD1 4.42Å; A124-L381 HydrophobicContact CB-CB 4.48Å; A124-L381 HydrophobicContact CB-CD1 4.34Å; C377-L381 VanDerWaalsContact O-CB 3.24Å; C377-L381 WeakPolarHBondContact O-CB 3.44Å; C377-L381 PolarHBondContact O-N 3.43Å; V378-L381 PolarHBondContact O-N 3.26Å; I379-L381 VanDerWaalsContact C-N 3.32Å; I379-L381 PolarHBondContact O-N 2.9Å; L381-A383 VanDerWaalsContact C-N 3.33Å; L381-A383 PolarHBondContact O-N 2.92Å; L381-H384 PolarHBondContact O-N 3.39Å; L381-H384 VanDerWaalsContact O-N 3.12Å; L381-T385 HydrophobicContact CD1-CG2 3.98Å; L381-T385 HydrophobicContact CG-CG2 4.49Å; L381-T385 WeakPolarHBondContact O-CB 3.2Å; L381-T385 VanDerWaalsContact O-CG2 3.3Å; L381-T385 WeakPolarHBondContact O-CG2 3.39Å; L381-T385 PolarHBondContact O-N 3.31Å; L381-T385 PolarHBondContact O-OG1 3.32Å
382	L	88.8	Confident	84.6	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-36.9	178.8	-71.4	170.3	0	0	0	112.4	L82 F84 L159 F161 Y183 V378 I379 C380 H384 T385 A386 L389	L82-L382 HydrophobicContact CD1-CD1 4.28Å; L82-L382 HydrophobicContact CD1-CD2 3.86Å; F84-L382 HydrophobicContact CZ-CD2 4.28Å; L159-L382 HydrophobicContact CD1-CB 4.41Å; F161-L382 HydrophobicContact CE1-CD1 3.98Å; F161-L382 HydrophobicContact CZ-CB 4.18Å; F161-L382 HydrophobicContact CZ-CD1 3.8Å; Y183-L382 HydrophobicContact CD2-CD1 3.93Å; Y183-L382 HydrophobicContact CE2-CB 4.29Å; Y183-L382 HydrophobicContact CE2-CD1 3.89Å; Y183-L382 HydrophobicContact CE2-CD2 4.25Å; Y183-L382 HydrophobicContact CE2-CG 4.38Å; Y183-L382 HydrophobicContact CG-CD1 4.24Å; V378-L382 HydrophobicContact CG1-CD1 3.98Å; V378-L382 HydrophobicContact CG1-CG 4.43Å; V378-L382 WeakPolarHBondContact O-CB 3.36Å; V378-L382 VanDerWaalsContact O-CG 3.3Å; V378-L382 WeakPolarHBondContact O-CG 3.46Å; V378-L382 PolarHBondContact O-N 3.47Å; I379-L382 PolarHBondContact O-N 3.02Å; C380-L382 PolarHBondContact O-N 3.41Å; L382-H384 PolarHBondContact O-N 3.09Å; L382-T385 PolarHBondContact O-N 3.41Å; L382-A386 WeakPolarHBondContact O-CB 3.45Å; L382-A386 PolarHBondContact O-N 2.8Å; L382-L389 HydrophobicContact CD2-CD1 4.36Å
383	A	92.3	Very high	85.9	Confident	9 Å²	9	37.6 Å²	37.6	7%	0.074	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-35.9	174.6	0	0	0	0	0	112.2	K103 V141 I379 C380 L381	K103-A383 HydrophobicContact CB-CB 3.95Å; K103-A383 HydrophobicContact CD-CB 4.33Å; K103-A383 WeakPolarHBondContact CE-O 3.18Å; K103-A383 HydrophobicContact CG-CB 3.97Å; V141-A383 HydrophobicContact CG2-CB 3.56Å; I379-A383 WeakPolarHBondContact O-CB 3.3Å; I379-A383 PolarHBondContact O-N 3.19Å; C380-A383 WeakPolarHBondContact O-CB 3.47Å; C380-A383 PolarHBondContact O-N 3.4Å; L381-A383 VanDerWaalsContact C-N 3.33Å; L381-A383 PolarHBondContact O-N 2.92Å
384	H	88.6	Confident	87.1	Confident	14 Å²	14	38 Å²	38	7%	0.065	19%	0.191	C	C	.	.	H	α-helix	trans	-83.8	-21.7	178.2	-80.7	-72.1	0	0	0	113.9	V95 A101 K103 D126 C380 L381 L382 H387	V95-H384 HydrophobicContact CG1-CB 4.42Å; A101-H384 PolarHBondContact O-CE1 2.96Å; A101-H384 VanDerWaalsContact O-CE1 3.32Å; K103-H384 WeakPolarHBondContact CG-CE1 3.43Å; K103-H384 WeakPolarHBondContact CG-NE2 3.25Å; D126-H384 PolarHBondContact O-NE2 3.24Å; D126-H384 VanDerWaalsContact O-NE2 3.09Å; C380-H384 PolarHBondContact O-CD2 3.43Å; C380-H384 VanDerWaalsContact O-CD2 3.26Å; C380-H384 PolarHBondContact O-N 3.38Å; C380-H384 VanDerWaalsContact O-N 3.16Å; L381-H384 PolarHBondContact O-N 3.39Å; L381-H384 VanDerWaalsContact O-N 3.12Å; L382-H384 PolarHBondContact O-N 3.09Å; H384-H387 PolarHBondContact O-CE1 3.35Å; H384-H387 PolarHBondContact O-ND1 3.03Å
385	T	85.5	Confident	87.8	Confident	2 Å²	2	40 Å²	40	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-121.4	-21.5	-167.4	63.6	0	0	0	0	115.3	L92 V95 L381 L382 H387 K388	L92-T385 VanDerWaalsContact CD2-CB 3.42Å; L92-T385 HydrophobicContact CD2-CG2 3.34Å; L92-T385 WeakPolarHBondContact CD2-OG1 3.43Å; V95-T385 HydrophobicContact CG2-CG2 3.58Å; L381-T385 HydrophobicContact CD1-CG2 3.98Å; L381-T385 HydrophobicContact CG-CG2 4.49Å; L381-T385 WeakPolarHBondContact O-CB 3.2Å; L381-T385 VanDerWaalsContact O-CG2 3.3Å; L381-T385 WeakPolarHBondContact O-CG2 3.39Å; L381-T385 PolarHBondContact O-N 3.31Å; L381-T385 PolarHBondContact O-OG1 3.32Å; L382-T385 PolarHBondContact O-N 3.41Å; T385-H387 PolarHBondContact O-N 3.03Å; T385-K388 WeakPolarHBondContact O-CB 3.28Å; T385-K388 PolarHBondContact O-N 2.85Å
386	A	88.1	Confident	88.1	Confident	15 Å²	15	44.9 Å²	44.9	12%	0.124	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26	-169.6	0	0	0	0	0	114.5	L159 L382 K388 L389	L159-A386 HydrophobicContact CD1-CB 3.7Å; L159-A386 HydrophobicContact CD2-CB 3.84Å; L159-A386 HydrophobicContact CG-CB 4.31Å; L382-A386 WeakPolarHBondContact O-CB 3.45Å; L382-A386 PolarHBondContact O-N 2.8Å; A386-K388 PolarHBondContact O-N 3.48Å; A386-L389 PolarHBondContact O-N 3.23Å
387	H	86.3	Confident	88.5	Confident	108 Å²	108	44.5 Å²	44.5	50%	0.5	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.6	175.1	67.4	-89.7	0	0	0	113.8	H384 T385	H384-H387 PolarHBondContact O-CE1 3.35Å; H384-H387 PolarHBondContact O-ND1 3.03Å; T385-H387 PolarHBondContact O-N 3.03Å
388	K	83.4	Confident	88.9	Confident	97 Å²	97	45.3 Å²	45.3	42%	0.422	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-26.3	174.4	-55.1	-176.3	178	176.2	0	111.7	T385 A386	T385-K388 WeakPolarHBondContact O-CB 3.28Å; T385-K388 PolarHBondContact O-N 2.85Å; A386-K388 PolarHBondContact O-N 3.48Å
389	L	82.9	Confident	89.3	Confident	17 Å²	17	51.3 Å²	51.3	9%	0.089	26%	0.263	C	S	.	.	S	Bend	trans	-77	162.5	177.3	-55.4	178.2	0	0	0	111	F84 D88 L382 A386	F84-L389 HydrophobicContact CE1-CD1 3.68Å; F84-L389 HydrophobicContact CE1-CD2 4.34Å; F84-L389 HydrophobicContact CZ-CD1 4.39Å; D88-L389 HydrophobicContact CB-CD2 3.88Å; D88-L389 WeakPolarHBondContact OD1-CD2 3.48Å; L382-L389 HydrophobicContact CD2-CD1 4.36Å; A386-L389 PolarHBondContact O-N 3.23Å
390	K	83.1	Confident	89.5	Confident	182 Å²	182	53 Å²	53	79%	0.791	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-58.7	134	167.5	-174.9	-179.9	177.3	-178.3	0	109.3	Y392	K390-Y392 PolarHBondContact O-N 3.48Å
391	P	87	Confident	89.7	Confident	123 Å²	123	53 Å²	53	80%	0.799	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-51.2	126.5	172.5	-28.2	35.2	0	0	0	111.2
392	Y	88.3	Confident	90.1	Very high	80 Å²	80	53.1 Å²	53.1	31%	0.314	27%	0.27	S	S	.	.			trans	-125.2	141.7	-177.3	178.9	-101.9	0	0	0	110.6	L82 N182 Y183 K390 F394	L82-Y392 HydrophobicContact CD2-CD1 4.19Å; L82-Y392 HydrophobicContact CD2-CE1 4.1Å; N182-Y392 PolarHBondContact ND2-O 3.22Å; N182-Y392 WeakPolarHBondContact O-CD1 3.17Å; N182-Y392 WeakPolarHBondContact O-CE1 3Å; Y183-Y392 AromaticContact CD1-CD1 3.88Å; Y183-Y392 HydrophobicContact CD1-CD1 3.88Å; Y183-Y392 HydrophobicContact CD1-CE1 4.15Å; Y183-Y392 AromaticContact CE1-CD1 3.62Å; Y183-Y392 HydrophobicContact CE1-CD1 3.62Å; Y183-Y392 HydrophobicContact CE1-CE1 4.29Å; Y183-Y392 HydrophobicContact CE1-CG 4.47Å; K390-Y392 PolarHBondContact O-N 3.48Å; Y392-F394 HydrophobicContact CE1-CB 4.49Å
393	T	92.2	Very high	90.4	Very high	56 Å²	56	56.6 Å²	56.6	34%	0.344	29%	0.288	S	S	.	.			trans	-140	130.3	174.8	-61.6	0	0	0	0	107.2	N179 I181 P395	N179-T393 VanDerWaalsContact C-CG2 3.42Å; N179-T393 VanDerWaalsContact CA-CG2 3.49Å; N179-T393 HydrophobicContact CB-CG2 4.43Å; I181-T393 CarbonylContact O-C 3.5Å; I181-T393 WeakPolarHBondContact O-CA 3.37Å; I181-T393 WeakPolarHBondContact O-CG2 3.46Å; T393-P395 WeakPolarHBondContact O-CD 3.45Å
394	F	93.5	Very high	90.5	Very high	14 Å²	14	56.5 Å²	56.5	6%	0.061	29%	0.289	C	S	.	.			trans	-65.7	117.6	-179.3	-163.9	-78.3	0	0	0	108.9	I181 T184 Y392 V397 W400	I181-F394 HydrophobicContact CG2-CB 4.38Å; I181-F394 PolarHBondContact O-N 3.22Å; T184-F394 HydrophobicContact CG2-CB 4.43Å; T184-F394 HydrophobicContact CG2-CD1 4.28Å; T184-F394 HydrophobicContact CG2-CD2 3.78Å; T184-F394 HydrophobicContact CG2-CE2 4.07Å; T184-F394 HydrophobicContact CG2-CG 3.89Å; T184-F394 HydrophobicContact CG2-CZ 4.43Å; T184-F394 VanDerWaalsContact OG1-CE2 3.27Å; T184-F394 WeakPolarHBondContact OG1-CE2 3.2Å; Y392-F394 HydrophobicContact CE1-CB 4.49Å; F394-V397 HydrophobicContact CD1-CB 3.94Å; F394-V397 HydrophobicContact CD1-CG2 4Å; F394-W400 HydrophobicContact CE1-CB 4.13Å; F394-W400 AromaticContact CE1-CD2 3.52Å; F394-W400 HydrophobicContact CE1-CD2 3.52Å; F394-W400 AromaticContact CE1-CE2 3.98Å; F394-W400 AromaticContact CE1-CE3 3.75Å; F394-W400 HydrophobicContact CE1-CE3 3.75Å; F394-W400 AromaticContact CE1-CG 3.69Å; F394-W400 HydrophobicContact CE1-CG 3.69Å; F394-W400 HydrophobicContact CE1-CZ3 4.4Å; F394-W400 AromaticContact CZ-CD2 3.72Å; F394-W400 HydrophobicContact CZ-CD2 3.72Å; F394-W400 AromaticContact CZ-CE2 3.66Å; F394-W400 HydrophobicContact CZ-CE3 4.1Å; F394-W400 HydrophobicContact CZ-CG 4.12Å; F394-W400 HydrophobicContact CZ-CH2 4.39Å; F394-W400 HydrophobicContact CZ-CZ2 4.01Å; F394-W400 HydrophobicContact CZ-CZ3 4.42Å; F394-W400 AromaticContact CZ-NE1 3.96Å
395	P	92	Very high	90.9	Very high	75 Å²	75	56.6 Å²	56.6	49%	0.487	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	139.7	-171.9	29.2	-34.7	0	0	0	111.5	T393 V397	T393-P395 WeakPolarHBondContact O-CD 3.45Å; P395-V397 PolarHBondContact O-N 3.41Å
396	N	93.7	Very high	91.4	Very high	101 Å²	101	61.3 Å²	61.3	54%	0.54	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	37.6	172.3	-59.9	-65.3	0	0	0	113.2	E178 S398 K399 W400	E178-N396 VanDerWaalsContact CD-CA 3.49Å; E178-N396 WeakPolarHBondContact OE1-CA 3.27Å; E178-N396 PolarHBondContact OE1-N 3.08Å; E178-N396 VanDerWaalsContact OE2-C 3.28Å; E178-N396 VanDerWaalsContact OE2-CA 3.24Å; E178-N396 WeakPolarHBondContact OE2-CA 3.31Å; N396-S398 PolarHBondContact O-N 3.05Å; N396-S398 VanDerWaalsContact O-N 3.16Å; N396-K399 HydrophobicContact CB-CB 4.39Å; N396-K399 PolarHBondContact O-N 3.48Å; N396-K399 VanDerWaalsContact O-N 3.11Å; N396-W400 WeakPolarHBondContact O-CB 3.3Å; N396-W400 PolarHBondContact O-N 3.45Å
397	V	95	Very high	91.7	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-56.9	-37	-168.7	68.4	0	0	0	0	112.8	I162 A174 L177 E178 I181 T184 F394 P395 W400 W401	I162-V397 HydrophobicContact CD1-CG2 3.9Å; A174-V397 HydrophobicContact CB-CG1 4.38Å; A174-V397 HydrophobicContact CB-CG2 4.2Å; L177-V397 HydrophobicContact CB-CG1 4.44Å; E178-V397 PolarHBondContact OE2-N 3.14Å; I181-V397 HydrophobicContact CB-CG1 4.31Å; I181-V397 HydrophobicContact CB-CG2 4.23Å; I181-V397 HydrophobicContact CG1-CG1 3.97Å; I181-V397 HydrophobicContact CG1-CG2 4.22Å; I181-V397 HydrophobicContact CG2-CG2 4.35Å; T184-V397 HydrophobicContact CG2-CG2 4.08Å; F394-V397 HydrophobicContact CD1-CB 3.94Å; F394-V397 HydrophobicContact CD1-CG2 4Å; P395-V397 PolarHBondContact O-N 3.41Å; V397-W400 HydrophobicContact CG2-CE3 4.25Å; V397-W401 WeakPolarHBondContact O-CB 3.34Å; V397-W401 PolarHBondContact O-N 3.07Å
398	S	94.1	Very high	92.2	Very high	27 Å²	27	62.5 Å²	62.5	19%	0.189	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-51.8	177.7	179.9	0	0	0	0	111.1	A174 D175 N396 W401 N402	A174-S398 WeakPolarHBondContact O-CB 3.46Å; D175-S398 PolarHBondContact OD1-OG 3.14Å; N396-S398 PolarHBondContact O-N 3.05Å; N396-S398 VanDerWaalsContact O-N 3.16Å; S398-W401 PolarHBondContact O-N 3.23Å; S398-N402 WeakPolarHBondContact O-CB 3.42Å; S398-N402 PolarHBondContact O-N 2.77Å; S398-N402 PolarHBondContact O-ND2 3.22Å; S398-N402 PolarHBondContact OG-ND2 3.11Å; S398-N402 VanDerWaalsContact OG-ND2 3.13Å
399	K	94.3	Very high	92.7	Very high	133 Å²	133	65.7 Å²	65.7	58%	0.578	35%	0.353	S	S	*	.	H	α-helix	trans	-63	-48.8	178.6	-172.6	-178	177.9	178.8	0	111.1	N396 W401 D403	N396-K399 HydrophobicContact CB-CB 4.39Å; N396-K399 PolarHBondContact O-N 3.48Å; N396-K399 VanDerWaalsContact O-N 3.11Å; K399-W401 VanDerWaalsContact C-N 3.32Å; K399-W401 PolarHBondContact O-N 3.29Å; K399-D403 VanDerWaalsContact CE-OD2 3.25Å; K399-D403 WeakPolarHBondContact CE-OD2 3.49Å; K399-D403 WeakPolarHBondContact CG-OD2 3.46Å; K399-D403 WeakPolarHBondContact O-CB 3.25Å; K399-D403 PolarHBondContact O-N 2.63Å
400	W	94.4	Very high	93.3	Very high	34 Å²	34	65.4 Å²	65.4	13%	0.129	35%	0.352	C	S	.	.	H	α-helix	trans	-51.4	-51.1	178.3	166.7	79.8	0	0	0	111.3	T184 T186 R188 D190 F394 N396 V397	T184-W400 HydrophobicContact CG2-CH2 4.15Å; T184-W400 HydrophobicContact CG2-CZ3 3.78Å; T186-W400 HydrophobicContact CG2-CH2 4.18Å; R188-W400 HydrophobicContact CB-CZ2 3.99Å; R188-W400 HydrophobicContact CG-CZ2 4.37Å; R188-W400 VanDerWaalsContact CZ-NE1 3.31Å; R188-W400 PolarHBondContact NH1-O 3.35Å; R188-W400 VanDerWaalsContact NH2-CD1 3.35Å; D190-W400 WeakPolarHBondContact OD1-CZ2 3.36Å; D190-W400 PolarHBondContact OD1-NE1 2.86Å; D190-W400 VanDerWaalsContact OD1-NE1 3.08Å; D190-W400 PolarHBondContact OD2-NE1 2.87Å; F394-W400 HydrophobicContact CE1-CB 4.13Å; F394-W400 AromaticContact CE1-CD2 3.52Å; F394-W400 HydrophobicContact CE1-CD2 3.52Å; F394-W400 AromaticContact CE1-CE2 3.98Å; F394-W400 AromaticContact CE1-CE3 3.75Å; F394-W400 HydrophobicContact CE1-CE3 3.75Å; F394-W400 AromaticContact CE1-CG 3.69Å; F394-W400 HydrophobicContact CE1-CG 3.69Å; F394-W400 HydrophobicContact CE1-CZ3 4.4Å; F394-W400 AromaticContact CZ-CD2 3.72Å; F394-W400 HydrophobicContact CZ-CD2 3.72Å; F394-W400 AromaticContact CZ-CE2 3.66Å; F394-W400 HydrophobicContact CZ-CE3 4.1Å; F394-W400 HydrophobicContact CZ-CG 4.12Å; F394-W400 HydrophobicContact CZ-CH2 4.39Å; F394-W400 HydrophobicContact CZ-CZ2 4.01Å; F394-W400 HydrophobicContact CZ-CZ3 4.42Å; F394-W400 AromaticContact CZ-NE1 3.96Å; N396-W400 WeakPolarHBondContact O-CB 3.3Å; N396-W400 PolarHBondContact O-N 3.45Å; V397-W400 HydrophobicContact CG2-CE3 4.25Å
401	W	95.3	Very high	93.9	Very high	1 Å²	1	63 Å²	63	0%	0.004	34%	0.338	C	S	.	.	H	α-helix	trans	-71.1	-56.1	-179.3	-177.5	-108.5	0	0	0	112.3	V164 E166 P168 I171 I173 A174 T186 Y187 R188 V397 S398 K399 D403 G404	V164-W401 HydrophobicContact CB-CH2 4.33Å; V164-W401 HydrophobicContact CB-CZ2 4.17Å; V164-W401 HydrophobicContact CG1-CD2 4.32Å; V164-W401 HydrophobicContact CG1-CE3 4.27Å; V164-W401 HydrophobicContact CG1-CH2 3.4Å; V164-W401 HydrophobicContact CG1-CZ2 3.43Å; V164-W401 VanDerWaalsContact CG1-CZ2 3.43Å; V164-W401 HydrophobicContact CG1-CZ3 3.84Å; V164-W401 HydrophobicContact CG2-CH2 4.03Å; V164-W401 HydrophobicContact CG2-CZ2 3.58Å; E166-W401 WeakPolarHBondContact O-CH2 3.18Å; E166-W401 WeakPolarHBondContact O-CZ2 3.32Å; P168-W401 HydrophobicContact CB-CZ2 4.46Å; P168-W401 WeakPolarHBondContact CB-O 3.46Å; P168-W401 HydrophobicContact CG-CD2 4.01Å; P168-W401 HydrophobicContact CG-CE3 4.42Å; P168-W401 HydrophobicContact CG-CG 4.45Å; P168-W401 HydrophobicContact CG-CH2 4.32Å; P168-W401 HydrophobicContact CG-CZ2 3.91Å; P168-W401 WeakPolarHBondContact CG-O 3.38Å; I171-W401 PolarHBondContact O-NE1 3.24Å; I173-W401 HydrophobicContact CG2-CG 4.37Å; A174-W401 HydrophobicContact CB-CB 4.04Å; A174-W401 HydrophobicContact CB-CG 4.48Å; T186-W401 HydrophobicContact CG2-CE3 4.38Å; T186-W401 HydrophobicContact CG2-CH2 4.41Å; T186-W401 HydrophobicContact CG2-CZ3 3.83Å; Y187-W401 AromaticContact CE1-CH2 3.68Å; Y187-W401 HydrophobicContact CE1-CH2 3.68Å; Y187-W401 HydrophobicContact CE1-CZ3 4.31Å; Y187-W401 AromaticContact CZ-CH2 3.98Å; R188-W401 HydrophobicContact CG-CZ3 4.18Å; V397-W401 WeakPolarHBondContact O-CB 3.34Å; V397-W401 PolarHBondContact O-N 3.07Å; S398-W401 PolarHBondContact O-N 3.23Å; K399-W401 VanDerWaalsContact C-N 3.32Å; K399-W401 PolarHBondContact O-N 3.29Å; W401-D403 VanDerWaalsContact C-N 3.31Å; W401-D403 PolarHBondContact O-N 3.35Å; W401-G404 PolarHBondContact O-N 2.67Å
402	N	93.2	Very high	94.3	Very high	24 Å²	24	59 Å²	59	13%	0.128	31%	0.307	C	S	.	.	H	α-helix	trans	-66.2	-32.5	-171.1	-67.9	-26.6	0	0	0	113.1	D175 S398 G404	D175-N402 PolarHBondContact OD1-ND2 3.04Å; S398-N402 WeakPolarHBondContact O-CB 3.42Å; S398-N402 PolarHBondContact O-N 2.77Å; S398-N402 PolarHBondContact O-ND2 3.22Å; S398-N402 PolarHBondContact OG-ND2 3.11Å; S398-N402 VanDerWaalsContact OG-ND2 3.13Å; N402-G404 PolarHBondContact O-N 3.23Å
403	D	94.9	Very high	94.3	Very high	76 Å²	76	61.2 Å²	61.2	41%	0.406	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-79.3	-3.3	178.4	-67.1	-3.4	0	0	0	112.5	K399 W401 C405 V406	K399-D403 VanDerWaalsContact CE-OD2 3.25Å; K399-D403 WeakPolarHBondContact CE-OD2 3.49Å; K399-D403 WeakPolarHBondContact CG-OD2 3.46Å; K399-D403 WeakPolarHBondContact O-CB 3.25Å; K399-D403 PolarHBondContact O-N 2.63Å; W401-D403 VanDerWaalsContact C-N 3.31Å; W401-D403 PolarHBondContact O-N 3.35Å; D403-C405 PolarHBondContact O-N 3.39Å; D403-V406 HydrophobicContact CB-CB 4.45Å; D403-V406 HydrophobicContact CB-CG2 4.21Å; D403-V406 WeakPolarHBondContact O-CB 3.44Å; D403-V406 PolarHBondContact O-N 3Å
404	G	94.9	Very high	93.7	Very high	8 Å²	8	62 Å²	62	8%	0.082	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-57.7	-17	-176.3	0	0	0	0	0	115	C292 A293 W401 N402 R408	C292-G404 CarbonylContact C-O 3.59Å; C292-G404 WeakPolarHBondContact CA-O 3.39Å; A293-G404 PolarHBondContact N-O 3Å; W401-G404 PolarHBondContact O-N 2.67Å; N402-G404 PolarHBondContact O-N 3.23Å; G404-R408 WeakPolarHBondContact O-CD 3.47Å
405	C	96.4	Very high	92.2	Very high	15 Å²	15	69.5 Å²	69.5	10%	0.101	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-113.1	-5.2	178.3	-40.6	0	0	0	0	113.3	L169 L291 C292 D403 R408	L169-C405 HydrophobicContact CD1-CB 4.06Å; L169-C405 HydrophobicContact CD2-CB 4.48Å; L169-C405 HydrophobicContact CG-CB 4.06Å; L291-C405 WeakPolarHBondContact O-CA 3.43Å; L291-C405 WeakPolarHBondContact O-CB 3.34Å; C292-C405 HydrophobicContact CB-CB 4.03Å; C292-C405 WeakPolarHBondContact CB-SG 3.48Å; C292-C405 WeakPolarHBondContact SG-CB 3.37Å; C292-C405 CovalentContact SG-SG 2.03Å; C292-C405 PolarHBondContact SG-SG 2.96Å; D403-C405 PolarHBondContact O-N 3.39Å; C405-R408 PolarHBondContact O-N 3.23Å
406	V	95.6	Very high	90	Very high	101 Å²	101	76 Å²	76	61%	0.612	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	135.5	-172.7	171.5	0	0	0	0	110.7	D403 R408	D403-V406 HydrophobicContact CB-CB 4.45Å; D403-V406 HydrophobicContact CB-CG2 4.21Å; D403-V406 WeakPolarHBondContact O-CB 3.44Å; D403-V406 PolarHBondContact O-N 3Å; V406-R408 PolarHBondContact O-N 3.34Å; V406-R408 VanDerWaalsContact O-N 3.15Å
407	G	95.3	Very high	89.8	Confident	76 Å²	76	74.8 Å²	74.8	78%	0.784	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	-2.3	177.4	0	0	0	0	0	115.1
408	R	95.7	Very high	89.6	Confident	73 Å²	73	78.7 Å²	78.7	28%	0.275	40%	0.398	S	S	.	.			trans	-81.4	129.2	-178.4	-57.9	-169.4	63.6	104.4	2.6	111	L291 E320 G404 C405 V406	L291-R408 HydrophobicContact CB-CB 4.14Å; E320-R408 IonicContact OE1-CZ 3.17Å; E320-R408 IonicContact OE1-NH1 3.22Å; E320-R408 PolarHBondContact OE1-NH1 3.43Å; E320-R408 IonicContact OE1-NH2 2.81Å; E320-R408 IonicContact OE2-CZ 3.81Å; E320-R408 IonicContact OE2-NH1 3.9Å; E320-R408 PolarHBondContact OE2-NH1 2.92Å; E320-R408 IonicContact OE2-NH2 3.72Å; E320-R408 PolarHBondContact OE2-NH2 3.24Å; G404-R408 WeakPolarHBondContact O-CD 3.47Å; C405-R408 PolarHBondContact O-N 3.23Å; V406-R408 PolarHBondContact O-N 3.34Å; V406-R408 VanDerWaalsContact O-N 3.15Å
409	K	95.5	Very high	89.3	Confident	163 Å²	163	81.6 Å²	81.6	71%	0.709	41%	0.409	S	S	*	.			trans	-148.6	156.4	-180	60.3	-179.6	179.6	177.1	0	109.7
410	I	95.9	Very high	89	Confident	11 Å²	11	78.6 Å²	78.6	6%	0.056	40%	0.4	C	S	.	.			trans	-76.7	159	167.1	60.7	172.8	0	0	0	110.1	P240 Y244 L291 M314 V333 D334 W412	P240-I410 HydrophobicContact CG-CD1 3.83Å; P240-I410 HydrophobicContact CG-CG1 4.14Å; Y244-I410 HydrophobicContact CD2-CD1 3.61Å; Y244-I410 HydrophobicContact CE2-CD1 4.08Å; L291-I410 HydrophobicContact CD1-CG2 4.11Å; L291-I410 HydrophobicContact CD2-CG2 4.48Å; M314-I410 HydrophobicContact CE-CD1 3.95Å; M314-I410 HydrophobicContact CE-CG2 4.28Å; M314-I410 HydrophobicContact CG-CG2 3.91Å; M314-I410 HydrophobicContact SD-CG2 4.32Å; V333-I410 HydrophobicContact CG2-CG2 4.09Å; D334-I410 WeakPolarHBondContact OD1-CA 3.45Å; D334-I410 WeakPolarHBondContact OD1-CB 3.4Å; I410-W412 VanDerWaalsContact C-N 3.33Å; I410-W412 HydrophobicContact CD1-CB 4.32Å; I410-W412 HydrophobicContact CD1-CE3 4.14Å; I410-W412 PolarHBondContact O-N 3.21Å
411	R	95.5	Very high	88.7	Confident	132 Å²	132	81.4 Å²	81.4	50%	0.498	42%	0.416	S	S	.	.	S	Bend	trans	-63.3	-38.2	178.3	179.5	179.4	178	-177.3	-1.9	112.4	D334 E337 N413	D334-R411 HydrophobicContact CB-CB 4.1Å; D334-R411 WeakPolarHBondContact O-CD 3.26Å; D334-R411 WeakPolarHBondContact OD1-CB 3.47Å; D334-R411 PolarHBondContact OD1-N 3.2Å; E337-R411 IonicContact OE1-NH2 2.86Å; R411-N413 PolarHBondContact O-N 3.11Å
412	W	95.4	Very high	88.2	Confident	39 Å²	39	86.7 Å²	86.7	15%	0.148	44%	0.444	C	S	.	.			trans	-70.2	113.6	-177.4	178.3	60.8	0	0	0	110.9	I243 Y244 E247 P339 I410 F414	I243-W412 HydrophobicContact CG2-CH2 4.33Å; I243-W412 HydrophobicContact CG2-CZ3 4.25Å; Y244-W412 HydrophobicContact CD2-CD2 4.33Å; Y244-W412 AromaticContact CD2-CE3 3.5Å; Y244-W412 HydrophobicContact CD2-CE3 3.5Å; Y244-W412 AromaticContact CD2-CZ3 3.93Å; Y244-W412 HydrophobicContact CD2-CZ3 3.93Å; Y244-W412 HydrophobicContact CE2-CB 4.23Å; Y244-W412 HydrophobicContact CE2-CD2 4.37Å; Y244-W412 AromaticContact CE2-CE3 3.98Å; Y244-W412 HydrophobicContact CE2-CE3 3.98Å; Y244-W412 HydrophobicContact CG-CE3 4.44Å; Y244-W412 HydrophobicContact CG-CZ3 4.46Å; E247-W412 HydrophobicContact CB-CH2 3.74Å; E247-W412 HydrophobicContact CB-CZ2 4.17Å; E247-W412 HydrophobicContact CG-CH2 3.88Å; E247-W412 HydrophobicContact CG-CZ2 3.76Å; P339-W412 VanDerWaalsContact CD-CE2 3.46Å; P339-W412 HydrophobicContact CG-CD2 3.91Å; P339-W412 HydrophobicContact CG-CE3 4.14Å; P339-W412 HydrophobicContact CG-CG 4.44Å; P339-W412 HydrophobicContact CG-CH2 4.17Å; P339-W412 HydrophobicContact CG-CZ2 4Å; P339-W412 HydrophobicContact CG-CZ3 4.25Å; I410-W412 VanDerWaalsContact C-N 3.33Å; I410-W412 HydrophobicContact CD1-CB 4.32Å; I410-W412 HydrophobicContact CD1-CE3 4.14Å; I410-W412 PolarHBondContact O-N 3.21Å; W412-F414 HydrophobicContact CE3-CB 4.26Å; W412-F414 HydrophobicContact CE3-CD1 4.27Å; W412-F414 HydrophobicContact CH2-CB 3.71Å; W412-F414 HydrophobicContact CZ2-CB 3.97Å; W412-F414 HydrophobicContact CZ3-CB 3.85Å; W412-F414 HydrophobicContact CZ3-CD1 4.2Å; W412-F414 HydrophobicContact CZ3-CG 4.37Å
413	N	87.6	Confident	87.9	Confident	127 Å²	127	91.2 Å²	91.2	68%	0.679	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-84	117.2	171.7	-66.8	-36.4	0	0	0	109	R411	R411-N413 PolarHBondContact O-N 3.11Å
414	F	80.4	Confident	87.3	Confident	71 Å²	71	92.4 Å²	92.4	31%	0.311	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-92.1	129.3	169.6	54.9	-84.8	0	0	0	109.2	P240 I243 W412 H416	P240-F414 HydrophobicContact CB-CE1 4.08Å; I243-F414 HydrophobicContact CD1-CD2 4.5Å; I243-F414 HydrophobicContact CD1-CE2 4.09Å; I243-F414 HydrophobicContact CD1-CZ 4.4Å; I243-F414 HydrophobicContact CG2-CD2 4.38Å; I243-F414 HydrophobicContact CG2-CG 4.29Å; W412-F414 HydrophobicContact CE3-CB 4.26Å; W412-F414 HydrophobicContact CE3-CD1 4.27Å; W412-F414 HydrophobicContact CH2-CB 3.71Å; W412-F414 HydrophobicContact CZ2-CB 3.97Å; W412-F414 HydrophobicContact CZ3-CB 3.85Å; W412-F414 HydrophobicContact CZ3-CD1 4.2Å; W412-F414 HydrophobicContact CZ3-CG 4.37Å; F414-H416 AromaticContact CD2-CE1 3.99Å; F414-H416 AromaticContact CE2-CE1 3.55Å; F414-H416 AromaticContact CE2-NE2 3.52Å
415	I	61.3	Low	86.7	Confident	172 Å²	172	99.4 Å²	99.4	88%	0.882	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-88.8	125.8	165.4	-57.7	174.8	0	0	0	105.5
416	H	45.9	Very low	85.8	Confident	213 Å²	213	107.1 Å²	107.1	99%	0.986	54%	0.54	S	S	*	.			trans	-62.5	0	-178	-86.4	-60.5	0	0	0	113.3	F414	F414-H416 AromaticContact CD2-CE1 3.99Å; F414-H416 AromaticContact CE2-CE1 3.55Å; F414-H416 AromaticContact CE2-NE2 3.52Å

Retrieved 416 of 416 residues in 149.7 ms (Link to these results)

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