A0A096LXH6_POEFO Loading...

Tumor suppressor candidate 3

AlphaFold DB , UniProt , Accession A0A096LXH6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 336 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	38.5	Very low	46.1	Very low	249 Å²	249	138.5 Å²	138.5	100%	1.227	78%	0.775	S	S	*	*				0	95.3	0	-88.3	168.9	170.3	0	0	108.3
2	A	35.8	Very low	47.3	Very low	101 Å²	101	136 Å²	136	84%	0.835	76%	0.758	S	S	*	*			trans	-91.7	110.9	178.9	0	0	0	0	0	108.6
3	S	35.1	Very low	48.4	Very low	119 Å²	119	135.2 Å²	135.2	83%	0.832	74%	0.744	S	S	*	*			trans	-90.8	100	177.6	-179.1	0	0	0	0	109.2	R5	S3-R5 PolarHBondContact O-N 3.26Å
4	T	41.8	Very low	49.8	Very low	125 Å²	125	136.2 Å²	136.2	77%	0.767	74%	0.738	S	S	*	*			trans	-70.9	107.8	172	29.8	0	0	0	0	110.1	T6	T4-T6 PolarHBondContact O-N 3.31Å
5	R	42.7	Very low	50.9	Low	236 Å²	236	134.6 Å²	134.6	89%	0.891	73%	0.728	S	S	*	*			trans	-70.8	110.7	167.1	-96.6	-178.4	-180	171.9	0.6	109	S3	S3-R5 PolarHBondContact O-N 3.26Å
6	T	46.3	Very low	52.2	Low	129 Å²	129	131.3 Å²	131.3	79%	0.791	71%	0.708	S	S	*	*			trans	-82.9	121.8	170.1	42.4	0	0	0	0	109.7	T4	T4-T6 PolarHBondContact O-N 3.31Å
7	N	46.4	Very low	53.3	Low	117 Å²	117	128.5 Å²	128.5	63%	0.626	70%	0.696	S	S	*	*			trans	-75.6	121.5	179.8	-77.5	-33.9	0	0	0	110.7	I9	N7-I9 PolarHBondContact O-N 3.28Å
8	P	53.6	Low	54	Low	103 Å²	103	127.5 Å²	127.5	67%	0.669	69%	0.69	S	S	*	*	H	α-helix	trans	-72.4	-13.5	-176.3	27.7	-33.8	0	0	0	114.2
9	I	55.9	Low	54.6	Low	122 Å²	122	126.9 Å²	126.9	63%	0.626	69%	0.686	S	S	*	*	H	α-helix	trans	-76.4	-29.7	-175.4	-60.3	167.6	0	0	0	111.9	N7	N7-I9 PolarHBondContact O-N 3.28Å
10	V	54.9	Low	55	Low	100 Å²	100	125.6 Å²	125.6	61%	0.606	68%	0.678	S	S	*	*	H	α-helix	trans	-72.9	-33.3	-178.3	-178	0	0	0	0	111.6	L12 F14	V10-L12 PolarHBondContact O-N 3.37Å; V10-F14 PolarHBondContact O-N 3.38Å
11	N	55.8	Low	55.2	Low	122 Å²	122	125.4 Å²	125.4	65%	0.652	68%	0.676	S	S	*	*	H	α-helix	trans	-69.2	-31.1	178.5	-84.6	-18.1	0	0	0	113	L15	N11-L15 WeakPolarHBondContact O-CB 3.43Å; N11-L15 PolarHBondContact O-N 3.47Å
12	L	60.8	Low	56.2	Low	109 Å²	109	116.6 Å²	116.6	57%	0.571	64%	0.643	S	S	*	*	H	α-helix	trans	-71.9	-42.5	-178.9	-168.9	66	0	0	0	111.7	V10 L15 I16	V10-L12 PolarHBondContact O-N 3.37Å; L12-L15 PolarHBondContact O-N 3.05Å; L12-I16 HydrophobicContact CG-CD1 4.12Å; L12-I16 WeakPolarHBondContact O-CD1 3.27Å; L12-I16 VanDerWaalsContact O-CG1 3.24Å; L12-I16 WeakPolarHBondContact O-CG1 3.38Å; L12-I16 PolarHBondContact O-N 3.19Å
13	H	62.1	Low	57.3	Low	125 Å²	125	117.7 Å²	117.7	58%	0.579	63%	0.633	S	S	*	*	H	α-helix	trans	-66.2	-38.2	175	-78	-68.3	0	0	0	112.3	L15 I16 V17	H13-L15 VanDerWaalsContact C-N 3.34Å; H13-L15 PolarHBondContact O-N 3.49Å; H13-I16 PolarHBondContact O-N 3.36Å; H13-V17 VanDerWaalsContact O-CG2 3.3Å; H13-V17 WeakPolarHBondContact O-CG2 3.24Å; H13-V17 PolarHBondContact O-N 3.02Å
14	F	67.3	Low	58.1	Low	150 Å²	150	117.1 Å²	117.1	66%	0.658	63%	0.628	S	S	*	*	H	α-helix	trans	-64.7	-39.1	176.7	-154.1	-94.5	0	0	0	111.8	V10 L18	V10-F14 PolarHBondContact O-N 3.38Å; F14-L18 WeakPolarHBondContact O-CB 3.43Å; F14-L18 PolarHBondContact O-N 3.24Å
15	L	67	Low	58.5	Low	112 Å²	112	117.1 Å²	117.1	59%	0.586	62%	0.623	S	S	*	*	H	α-helix	trans	-67.6	-39.2	176.8	-155.6	80.2	0	0	0	112.3	N11 L12 H13 L18 L19	N11-L15 WeakPolarHBondContact O-CB 3.43Å; N11-L15 PolarHBondContact O-N 3.47Å; L12-L15 PolarHBondContact O-N 3.05Å; H13-L15 VanDerWaalsContact C-N 3.34Å; H13-L15 PolarHBondContact O-N 3.49Å; L15-L18 PolarHBondContact O-N 3.05Å; L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 PolarHBondContact O-N 2.94Å
16	I	70.6	Confident	58.8	Low	82 Å²	82	111.5 Å²	111.5	42%	0.421	62%	0.616	S	S	.	*	H	α-helix	trans	-68.1	-40	178	-68.2	164.4	0	0	0	111.1	L12 H13 L19 L20	L12-I16 HydrophobicContact CG-CD1 4.12Å; L12-I16 WeakPolarHBondContact O-CD1 3.27Å; L12-I16 VanDerWaalsContact O-CG1 3.24Å; L12-I16 WeakPolarHBondContact O-CG1 3.38Å; L12-I16 PolarHBondContact O-N 3.19Å; H13-I16 PolarHBondContact O-N 3.36Å; I16-L19 PolarHBondContact O-N 3.41Å; I16-L20 HydrophobicContact CG2-CD1 3.89Å; I16-L20 WeakPolarHBondContact O-CB 3.3Å; I16-L20 WeakPolarHBondContact O-CG 3.4Å; I16-L20 PolarHBondContact O-N 3.35Å
17	V	70.8	Confident	58.8	Low	83 Å²	83	115.5 Å²	115.5	50%	0.503	62%	0.623	S	S	.	*	H	α-helix	trans	-66.6	-39.2	175.7	172.4	0	0	0	0	111.1	H13 L19 L20 L21	H13-V17 VanDerWaalsContact O-CG2 3.3Å; H13-V17 WeakPolarHBondContact O-CG2 3.24Å; H13-V17 PolarHBondContact O-N 3.02Å; V17-L19 VanDerWaalsContact C-N 3.34Å; V17-L20 PolarHBondContact O-N 3.37Å; V17-L21 HydrophobicContact CG1-CD1 3.88Å; V17-L21 WeakPolarHBondContact O-CD1 3.38Å; V17-L21 PolarHBondContact O-N 3.05Å
18	L	66.3	Low	58.9	Low	111 Å²	111	111.4 Å²	111.4	58%	0.581	61%	0.609	S	S	*	*	H	α-helix	trans	-65.3	-38.1	175.2	-153.6	86.7	0	0	0	111.9	F14 L15 A22	F14-L18 WeakPolarHBondContact O-CB 3.43Å; F14-L18 PolarHBondContact O-N 3.24Å; L15-L18 PolarHBondContact O-N 3.05Å; L18-A22 WeakPolarHBondContact O-CB 3.44Å; L18-A22 PolarHBondContact O-N 2.96Å
19	L	65.8	Low	58.7	Low	116 Å²	116	109.3 Å²	109.3	61%	0.607	61%	0.605	S	S	*	*	H	α-helix	trans	-68.2	-40.2	176.8	-147.8	90.1	0	0	0	111.6	L15 I16 V17 A22 I23	L15-L19 WeakPolarHBondContact O-CB 3.45Å; L15-L19 PolarHBondContact O-N 2.94Å; I16-L19 PolarHBondContact O-N 3.41Å; V17-L19 VanDerWaalsContact C-N 3.34Å; L19-A22 PolarHBondContact O-N 3.03Å; L19-I23 WeakPolarHBondContact O-CD1 3.47Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.47Å; L19-I23 PolarHBondContact O-N 3.25Å
20	L	63.1	Low	58.7	Low	101 Å²	101	105.9 Å²	105.9	53%	0.529	60%	0.601	S	S	.	*	H	α-helix	trans	-68.5	-37.2	176	-76.8	163.1	0	0	0	112.2	I16 V17 A22 I23 C24	I16-L20 HydrophobicContact CG2-CD1 3.89Å; I16-L20 WeakPolarHBondContact O-CB 3.3Å; I16-L20 WeakPolarHBondContact O-CG 3.4Å; I16-L20 PolarHBondContact O-N 3.35Å; V17-L20 PolarHBondContact O-N 3.37Å; L20-A22 VanDerWaalsContact C-N 3.35Å; L20-I23 PolarHBondContact O-N 3.48Å; L20-C24 PolarHBondContact O-N 2.94Å; L20-C24 PolarHBondContact O-SG 3.4Å
21	L	58.5	Low	59	Low	122 Å²	122	108 Å²	108	64%	0.639	60%	0.604	S	S	*	*	H	α-helix	trans	-67.3	-33.6	172.9	-104.1	106.9	0	0	0	112.8	V17 I23 C24	V17-L21 HydrophobicContact CG1-CD1 3.88Å; V17-L21 WeakPolarHBondContact O-CD1 3.38Å; V17-L21 PolarHBondContact O-N 3.05Å; L21-I23 VanDerWaalsContact C-N 3.33Å; L21-C24 PolarHBondContact O-N 3Å
22	A	59.5	Low	59.3	Low	64 Å²	64	109.3 Å²	109.3	53%	0.529	60%	0.604	S	S	.	*	H	α-helix	trans	-69.7	-29.4	175.9	0	0	0	0	0	112.8	L18 L19 L20	L18-A22 WeakPolarHBondContact O-CB 3.44Å; L18-A22 PolarHBondContact O-N 2.96Å; L19-A22 PolarHBondContact O-N 3.03Å; L20-A22 VanDerWaalsContact C-N 3.35Å
23	I	59.3	Low	59.9	Low	124 Å²	124	111.9 Å²	111.9	64%	0.636	61%	0.61	S	S	*	*	H	α-helix	trans	-77.8	-24.7	176.2	-63.9	161.8	0	0	0	111.6	L19 L20 L21	L19-I23 WeakPolarHBondContact O-CD1 3.47Å; L19-I23 VanDerWaalsContact O-CG1 3.27Å; L19-I23 WeakPolarHBondContact O-CG1 3.47Å; L19-I23 PolarHBondContact O-N 3.25Å; L20-I23 PolarHBondContact O-N 3.48Å; L21-I23 VanDerWaalsContact C-N 3.33Å
24	C	51.3	Low	60.6	Low	106 Å²	106	112.8 Å²	112.8	72%	0.716	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	1.3	179.2	-74	0	0	0	0	115.1	L20 L21 P26	L20-C24 PolarHBondContact O-N 2.94Å; L20-C24 PolarHBondContact O-SG 3.4Å; L21-C24 PolarHBondContact O-N 3Å; C24-P26 WeakPolarHBondContact O-CD 3.35Å
25	L	50.9	Low	61.3	Low	126 Å²	126	111.8 Å²	111.8	66%	0.66	61%	0.61	S	S	*	*	S	Bend	trans	-72	117.8	170.3	-86	158.6	0	0	0	109.6	F27	L25-F27 PolarHBondContact O-N 3.38Å
26	P	47.9	Very low	62.2	Low	117 Å²	117	111.6 Å²	111.6	76%	0.76	61%	0.609	S	S	*	*			trans	-69.2	109.1	178.6	27.6	-31.2	0	0	0	109.2	C24 G28	C24-P26 WeakPolarHBondContact O-CD 3.35Å; P26-G28 PolarHBondContact O-N 2.82Å
27	F	46.6	Very low	63.2	Low	214 Å²	214	111.2 Å²	111.2	94%	0.939	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	32.2	173.4	-134.3	-95.4	0	0	0	113.1	L25	L25-F27 PolarHBondContact O-N 3.38Å
28	G	49.7	Very low	64.1	Low	31 Å²	31	108.9 Å²	108.9	32%	0.32	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100	-5.2	-166.3	0	0	0	0	0	116.6	P26 G30	P26-G28 PolarHBondContact O-N 2.82Å; G28-G30 PolarHBondContact O-N 3.48Å
29	G	48.8	Very low	65.3	Low	58 Å²	58	106.8 Å²	106.8	60%	0.598	59%	0.587	S	S	*	*	H	α-helix	trans	-67.6	-31.7	-174.9	0	0	0	0	0	114.7	K33	G29-K33 PolarHBondContact O-N 3.23Å
30	G	56.7	Low	66.7	Low	51 Å²	51	105.3 Å²	105.3	53%	0.526	58%	0.577	S	S	.	*	H	α-helix	trans	-75.8	-30.1	-176.7	0	0	0	0	0	114.8	G28 K34	G28-G30 PolarHBondContact O-N 3.48Å; G30-K34 WeakPolarHBondContact O-CG 3.26Å; G30-K34 PolarHBondContact O-N 2.85Å
31	Q	60.8	Low	68.1	Low	144 Å²	144	100.8 Å²	100.8	67%	0.673	55%	0.553	S	S	*	*	H	α-helix	trans	-77.2	-46	178.3	-81.3	-177.4	-34	0	0	111.6	K33 K34 E35	Q31-K33 VanDerWaalsContact C-N 3.28Å; Q31-K33 PolarHBondContact O-N 3.49Å; Q31-K34 PolarHBondContact O-N 3.42Å; Q31-K34 VanDerWaalsContact O-N 3.07Å; Q31-E35 PolarHBondContact O-N 3.19Å
32	K	61.8	Low	69.8	Low	150 Å²	150	95.6 Å²	95.6	65%	0.652	53%	0.526	S	S	*	.	H	α-helix	trans	-57.2	-39.5	175.9	-75.4	-174.9	174.9	-177.7	0	112.7	K34 E35 N36	K32-K34 PolarHBondContact O-N 3.28Å; K32-E35 PolarHBondContact O-N 3.23Å; K32-N36 WeakPolarHBondContact O-CB 3.47Å; K32-N36 PolarHBondContact O-N 3.41Å; K32-N36 PolarHBondContact O-ND2 3.01Å; K32-N36 PolarHBondContact O-OD1 3.07Å
33	K	73.4	Confident	71.5	Confident	162 Å²	162	99.2 Å²	99.2	70%	0.704	53%	0.532	S	S	*	.	H	α-helix	trans	-66.4	-35.7	177.5	-167.1	173.6	-177.4	176.3	0	112.9	G29 Q31 L37	G29-K33 PolarHBondContact O-N 3.23Å; Q31-K33 VanDerWaalsContact C-N 3.28Å; Q31-K33 PolarHBondContact O-N 3.49Å; K33-L37 WeakPolarHBondContact O-CB 3.39Å; K33-L37 PolarHBondContact O-N 2.74Å; K33-L37 VanDerWaalsContact O-N 3.15Å
34	K	76.2	Confident	73.2	Confident	144 Å²	144	95.4 Å²	95.4	63%	0.626	51%	0.512	S	S	*	.	H	α-helix	trans	-72.5	-39.1	177.1	-76	178	-179.3	176.3	0	112	G30 Q31 K32 L37 L38	G30-K34 WeakPolarHBondContact O-CG 3.26Å; G30-K34 PolarHBondContact O-N 2.85Å; Q31-K34 PolarHBondContact O-N 3.42Å; Q31-K34 VanDerWaalsContact O-N 3.07Å; K32-K34 PolarHBondContact O-N 3.28Å; K34-L37 PolarHBondContact O-N 3.42Å; K34-L38 WeakPolarHBondContact O-CB 3.48Å; K34-L38 PolarHBondContact O-N 2.7Å
35	E	82.3	Confident	75.3	Confident	129 Å²	129	90.4 Å²	90.4	60%	0.603	48%	0.478	S	S	*	.	H	α-helix	trans	-66.1	-44.7	176.4	-72.3	-179.7	163.9	0	0	111.5	Q31 K32 L37 L38 S39	Q31-E35 PolarHBondContact O-N 3.19Å; K32-E35 PolarHBondContact O-N 3.23Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 2.81Å; E35-L38 WeakPolarHBondContact O-CB 3.3Å; E35-L38 PolarHBondContact O-N 3.48Å; E35-L38 VanDerWaalsContact O-N 3.15Å; E35-S39 PolarHBondContact O-N 3.19Å; E35-S39 PolarHBondContact O-OG 3.21Å
36	N	86.4	Confident	77.3	Confident	108 Å²	108	87.1 Å²	87.1	58%	0.578	46%	0.46	S	S	*	.	H	α-helix	trans	-61.7	-39.9	175.9	-68	-7.7	0	0	0	112.4	K32 L38 S39 E40	K32-N36 WeakPolarHBondContact O-CB 3.47Å; K32-N36 PolarHBondContact O-N 3.41Å; K32-N36 PolarHBondContact O-ND2 3.01Å; K32-N36 PolarHBondContact O-OD1 3.07Å; N36-L38 VanDerWaalsContact C-N 3.34Å; N36-S39 WeakPolarHBondContact CA-OG 3.46Å; N36-S39 PolarHBondContact O-OG 2.96Å; N36-E40 WeakPolarHBondContact O-CB 3.43Å; N36-E40 PolarHBondContact O-N 3.48Å
37	L	90.2	Very high	79.6	Confident	74 Å²	74	85.6 Å²	85.6	39%	0.387	44%	0.443	S	S	.	.	H	α-helix	trans	-71.7	-30.6	177.2	-169.4	130	0	0	0	112.2	K33 K34 E35 K41 P70	K33-L37 WeakPolarHBondContact O-CB 3.39Å; K33-L37 PolarHBondContact O-N 2.74Å; K33-L37 VanDerWaalsContact O-N 3.15Å; K34-L37 PolarHBondContact O-N 3.42Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 2.81Å; L37-K41 HydrophobicContact CD2-CD 3.93Å; L37-K41 VanDerWaalsContact O-CG 3.28Å; L37-K41 WeakPolarHBondContact O-CG 3.37Å; L37-K41 PolarHBondContact O-N 3.03Å; L37-P70 HydrophobicContact CD2-CG 4.13Å
38	L	91.4	Very high	81.9	Confident	35 Å²	35	78.7 Å²	78.7	18%	0.183	41%	0.41	C	S	.	.	H	α-helix	trans	-67.5	-48.2	173.3	178.1	63	0	0	0	110.8	K34 E35 N36 E40 K41 V42 P70 N72	K34-L38 WeakPolarHBondContact O-CB 3.48Å; K34-L38 PolarHBondContact O-N 2.7Å; E35-L38 WeakPolarHBondContact O-CB 3.3Å; E35-L38 PolarHBondContact O-N 3.48Å; E35-L38 VanDerWaalsContact O-N 3.15Å; N36-L38 VanDerWaalsContact C-N 3.34Å; L38-E40 VanDerWaalsContact C-N 3.33Å; L38-E40 PolarHBondContact O-N 2.75Å; L38-K41 PolarHBondContact O-N 3.01Å; L38-V42 HydrophobicContact CD1-CG2 4.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.35Å; L38-V42 PolarHBondContact O-N 3.05Å; L38-P70 HydrophobicContact CB-CB 4.29Å; L38-P70 HydrophobicContact CB-CG 3.84Å; L38-P70 HydrophobicContact CD1-CB 4.23Å; L38-P70 HydrophobicContact CD1-CG 4.35Å; L38-N72 HydrophobicContact CD1-CB 4.43Å; L38-N72 HydrophobicContact CD2-CB 4.12Å
39	S	91.6	Very high	83.9	Confident	67 Å²	67	77.7 Å²	77.7	47%	0.469	40%	0.399	S	S	.	.	H	α-helix	trans	-60.8	-43.6	179.3	55.3	0	0	0	0	111.3	E35 N36 K41 V42 E43	E35-S39 PolarHBondContact O-N 3.19Å; E35-S39 PolarHBondContact O-OG 3.21Å; N36-S39 WeakPolarHBondContact CA-OG 3.46Å; N36-S39 PolarHBondContact O-OG 2.96Å; S39-K41 VanDerWaalsContact C-N 3.34Å; S39-K41 PolarHBondContact O-N 3.42Å; S39-V42 PolarHBondContact O-N 3.44Å; S39-E43 WeakPolarHBondContact O-CB 3.43Å; S39-E43 PolarHBondContact O-N 2.66Å
40	E	93.4	Very high	85.9	Confident	84 Å²	84	78 Å²	78	39%	0.393	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-43	176.5	-166.9	-162.4	146.5	0	0	111.8	N36 L38 E43 Q44 R64	N36-E40 WeakPolarHBondContact O-CB 3.43Å; N36-E40 PolarHBondContact O-N 3.48Å; L38-E40 VanDerWaalsContact C-N 3.33Å; L38-E40 PolarHBondContact O-N 2.75Å; E40-E43 PolarHBondContact O-N 2.89Å; E40-Q44 WeakPolarHBondContact O-CB 3.41Å; E40-Q44 WeakPolarHBondContact O-CG 3.31Å; E40-Q44 PolarHBondContact O-N 3.49Å; E40-Q44 PolarHBondContact OE1-NE2 2.92Å; E40-R64 IonicContact OE1-NH2 3.09Å
41	K	93.6	Very high	87.6	Confident	6 Å²	6	84.1 Å²	84.1	3%	0.026	40%	0.399	C	S	.	.	H	α-helix	trans	-65.3	-40.2	176.9	-74.3	174.7	75.5	-177	0	112.4	L37 L38 S39 M45 R64 F65 A68 P70	L37-K41 HydrophobicContact CD2-CD 3.93Å; L37-K41 VanDerWaalsContact O-CG 3.28Å; L37-K41 WeakPolarHBondContact O-CG 3.37Å; L37-K41 PolarHBondContact O-N 3.03Å; L38-K41 PolarHBondContact O-N 3.01Å; S39-K41 VanDerWaalsContact C-N 3.34Å; S39-K41 PolarHBondContact O-N 3.42Å; K41-M45 WeakPolarHBondContact O-CB 3.32Å; K41-M45 VanDerWaalsContact O-CG 3.23Å; K41-M45 WeakPolarHBondContact O-CG 3.47Å; K41-M45 PolarHBondContact O-N 3.38Å; K41-M45 VanDerWaalsContact O-N 3.08Å; K41-R64 WeakPolarHBondContact CE-O 3.24Å; K41-R64 PolarHBondContact NZ-O 2.94Å; K41-F65 HydrophobicContact CB-CD1 4.33Å; K41-F65 HydrophobicContact CB-CE1 4.25Å; K41-F65 HydrophobicContact CG-CD1 4.36Å; K41-F65 HydrophobicContact CG-CE1 4.14Å; K41-A68 PolarHBondContact NZ-O 3.33Å; K41-P70 PolarHBondContact NZ-O 2.82Å
42	V	94.8	Very high	89.1	Confident	13 Å²	13	85.2 Å²	85.2	8%	0.079	40%	0.397	C	S	.	.	H	α-helix	trans	-67.2	-43.7	178.6	173.9	0	0	0	0	110.1	L38 S39 M45 M46 N72 Y73 N113	L38-V42 HydrophobicContact CD1-CG2 4.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.35Å; L38-V42 PolarHBondContact O-N 3.05Å; S39-V42 PolarHBondContact O-N 3.44Å; V42-M45 PolarHBondContact O-N 3.18Å; V42-M46 HydrophobicContact CG1-CG 4.3Å; V42-M46 WeakPolarHBondContact O-CB 3.48Å; V42-M46 VanDerWaalsContact O-CG 3.26Å; V42-M46 WeakPolarHBondContact O-CG 3.41Å; V42-M46 PolarHBondContact O-N 2.82Å; V42-N72 VanDerWaalsContact CG2-OD1 3.3Å; V42-N72 WeakPolarHBondContact CG2-OD1 3.44Å; V42-Y73 HydrophobicContact CG2-CD1 3.7Å; V42-Y73 HydrophobicContact CG2-CE1 3.75Å; V42-N113 HydrophobicContact CG1-CB 3.96Å
43	E	94.8	Very high	90.6	Very high	140 Å²	140	79 Å²	79	65%	0.654	37%	0.372	S	S	*	.	H	α-helix	trans	-61.4	-45.3	178.2	-171.2	173.8	-172.2	0	0	111.6	S39 E40 M45 M46 E47	S39-E43 WeakPolarHBondContact O-CB 3.43Å; S39-E43 PolarHBondContact O-N 2.66Å; E40-E43 PolarHBondContact O-N 2.89Å; E43-M45 PolarHBondContact O-N 2.76Å; E43-M46 WeakPolarHBondContact O-CB 3.43Å; E43-M46 PolarHBondContact O-N 3.15Å; E43-E47 WeakPolarHBondContact O-CB 3.44Å; E43-E47 PolarHBondContact O-N 3.4Å
44	Q	94.9	Very high	91.7	Very high	45 Å²	45	71.6 Å²	71.6	21%	0.21	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-42.9	174.8	-74.4	171.5	10.5	0	0	112.5	E40 M46 E47 W48 F65	E40-Q44 WeakPolarHBondContact O-CB 3.41Å; E40-Q44 WeakPolarHBondContact O-CG 3.31Å; E40-Q44 PolarHBondContact O-N 3.49Å; E40-Q44 PolarHBondContact OE1-NE2 2.92Å; Q44-M46 VanDerWaalsContact C-N 3.33Å; Q44-E47 PolarHBondContact O-N 3.23Å; Q44-W48 PolarHBondContact O-N 3.22Å; Q44-F65 HydrophobicContact CB-CE1 4.25Å; Q44-F65 VanDerWaalsContact OE1-CZ 3.27Å
45	M	94.3	Very high	92.6	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65	-39.1	176.3	-72.3	-70.2	-69.4	0	0	111.6	K41 V42 E43 W48 S49 I55 M57 F65 F116 T118	K41-M45 WeakPolarHBondContact O-CB 3.32Å; K41-M45 VanDerWaalsContact O-CG 3.23Å; K41-M45 WeakPolarHBondContact O-CG 3.47Å; K41-M45 PolarHBondContact O-N 3.38Å; K41-M45 VanDerWaalsContact O-N 3.08Å; V42-M45 PolarHBondContact O-N 3.18Å; E43-M45 PolarHBondContact O-N 2.76Å; M45-W48 PolarHBondContact O-N 2.95Å; M45-W48 HydrophobicContact SD-CE3 4Å; M45-W48 HydrophobicContact SD-CZ3 4.14Å; M45-S49 VanDerWaalsContact O-CB 3.25Å; M45-S49 WeakPolarHBondContact O-CB 3.3Å; M45-S49 PolarHBondContact O-N 3.15Å; M45-S49 PolarHBondContact O-OG 3.48Å; M45-I55 HydrophobicContact CE-CD1 3.71Å; M45-I55 HydrophobicContact SD-CD1 4.01Å; M45-M57 HydrophobicContact CE-CE 3.97Å; M45-M57 HydrophobicContact SD-CE 3.7Å; M45-F65 HydrophobicContact CG-CD1 3.83Å; M45-F65 HydrophobicContact CG-CE1 4.42Å; M45-F65 HydrophobicContact SD-CB 4.01Å; M45-F65 HydrophobicContact SD-CD1 3.9Å; M45-F65 HydrophobicContact SD-CG 4.03Å; M45-F116 HydrophobicContact CB-CD1 4.08Å; M45-F116 HydrophobicContact CB-CD2 4.33Å; M45-F116 HydrophobicContact CB-CE1 3.79Å; M45-F116 HydrophobicContact CB-CE2 4.04Å; M45-F116 HydrophobicContact CB-CG 4.34Å; M45-F116 HydrophobicContact CB-CZ 3.76Å; M45-F116 HydrophobicContact CE-CB 3.52Å; M45-F116 HydrophobicContact CE-CD1 4.17Å; M45-F116 HydrophobicContact CE-CD2 3.97Å; M45-F116 HydrophobicContact CE-CG 3.63Å; M45-T118 HydrophobicContact CE-CG2 4.23Å
46	M	94.6	Very high	93.3	Very high	57 Å²	57	64.5 Å²	64.5	28%	0.281	31%	0.305	S	S	.	.	H	α-helix	trans	-64.6	-43.2	175	-74.4	-62.2	-63.7	0	0	111.5	V42 E43 Q44 S49 S50 F111 N113 F116	V42-M46 HydrophobicContact CG1-CG 4.3Å; V42-M46 WeakPolarHBondContact O-CB 3.48Å; V42-M46 VanDerWaalsContact O-CG 3.26Å; V42-M46 WeakPolarHBondContact O-CG 3.41Å; V42-M46 PolarHBondContact O-N 2.82Å; E43-M46 WeakPolarHBondContact O-CB 3.43Å; E43-M46 PolarHBondContact O-N 3.15Å; Q44-M46 VanDerWaalsContact C-N 3.33Å; M46-S49 WeakPolarHBondContact CA-OG 3.39Å; M46-S49 PolarHBondContact O-N 3.42Å; M46-S49 PolarHBondContact O-OG 3.44Å; M46-S50 WeakPolarHBondContact O-CB 3.37Å; M46-S50 PolarHBondContact O-N 3.02Å; M46-F111 HydrophobicContact CE-CE1 3.72Å; M46-F111 HydrophobicContact CE-CZ 4Å; M46-F111 HydrophobicContact SD-CZ 4.38Å; M46-N113 HydrophobicContact CE-CB 4.46Å; M46-N113 HydrophobicContact CG-CB 3.98Å; M46-N113 HydrophobicContact SD-CB 3.52Å; M46-N113 VanDerWaalsContact SD-CB 3.52Å; M46-F116 HydrophobicContact CG-CE1 4.17Å; M46-F116 HydrophobicContact CG-CZ 4.06Å; M46-F116 HydrophobicContact SD-CE1 3.61Å; M46-F116 HydrophobicContact SD-CZ 3.78Å
47	E	95.2	Very high	93.7	Very high	86 Å²	86	59.4 Å²	59.4	40%	0.402	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-44.5	176.2	-166.6	-164.6	164.3	0	0	111.7	E43 Q44 S50 R51	E43-E47 WeakPolarHBondContact O-CB 3.44Å; E43-E47 PolarHBondContact O-N 3.4Å; Q44-E47 PolarHBondContact O-N 3.23Å; E47-S50 PolarHBondContact O-N 3.48Å; E47-S50 PolarHBondContact O-OG 3.45Å; E47-R51 PolarHBondContact O-N 3.48Å; E47-R51 IonicContact OE1-CZ 3.56Å; E47-R51 IonicContact OE1-NE 2.7Å; E47-R51 IonicContact OE1-NH2 3.27Å; E47-R51 PolarHBondContact OE1-NH2 2.85Å
48	W	95	Very high	93.9	Very high	68 Å²	68	58.5 Å²	58.5	26%	0.258	27%	0.273	S	S	.	.	H	α-helix	trans	-66.9	-40	175.6	-65.7	-22.1	0	0	0	112.1	Q44 M45 S50 R51 R52 I55 F65	Q44-W48 PolarHBondContact O-N 3.22Å; M45-W48 PolarHBondContact O-N 2.95Å; M45-W48 HydrophobicContact SD-CE3 4Å; M45-W48 HydrophobicContact SD-CZ3 4.14Å; W48-S50 PolarHBondContact O-N 3.13Å; W48-R51 PolarHBondContact O-N 3.29Å; W48-R51 VanDerWaalsContact O-N 3.16Å; W48-R52 PolarHBondContact O-N 2.93Å; W48-I55 HydrophobicContact CB-CD1 3.9Å; W48-I55 HydrophobicContact CB-CG1 3.96Å; W48-I55 HydrophobicContact CB-CG2 4.14Å; W48-I55 HydrophobicContact CD2-CG2 4.4Å; W48-I55 HydrophobicContact CE3-CG2 3.93Å; W48-F65 HydrophobicContact CH2-CD2 4.21Å; W48-F65 HydrophobicContact CH2-CE1 4.24Å; W48-F65 AromaticContact CH2-CE2 3.43Å; W48-F65 HydrophobicContact CH2-CE2 3.43Å; W48-F65 VanDerWaalsContact CH2-CE2 3.43Å; W48-F65 AromaticContact CH2-CZ 3.45Å; W48-F65 HydrophobicContact CH2-CZ 3.45Å; W48-F65 VanDerWaalsContact CH2-CZ 3.45Å; W48-F65 HydrophobicContact CZ3-CD1 4.38Å; W48-F65 AromaticContact CZ3-CD2 3.92Å; W48-F65 HydrophobicContact CZ3-CD2 3.92Å; W48-F65 HydrophobicContact CZ3-CE1 4.05Å; W48-F65 AromaticContact CZ3-CE2 3.59Å; W48-F65 HydrophobicContact CZ3-CE2 3.59Å; W48-F65 HydrophobicContact CZ3-CG 4.32Å; W48-F65 AromaticContact CZ3-CZ 3.66Å; W48-F65 HydrophobicContact CZ3-CZ 3.66Å
49	S	92.6	Very high	94	Very high	10 Å²	10	57 Å²	57	7%	0.07	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-30.2	176.3	80.9	0	0	0	0	111.8	M45 M46 R52 R106	M45-S49 VanDerWaalsContact O-CB 3.25Å; M45-S49 WeakPolarHBondContact O-CB 3.3Å; M45-S49 PolarHBondContact O-N 3.15Å; M45-S49 PolarHBondContact O-OG 3.48Å; M46-S49 WeakPolarHBondContact CA-OG 3.39Å; M46-S49 PolarHBondContact O-N 3.42Å; M46-S49 PolarHBondContact O-OG 3.44Å; S49-R52 CarbonylContact C-O 3.56Å; S49-R52 VanDerWaalsContact CA-O 3.29Å; S49-R52 WeakPolarHBondContact CA-O 3.31Å; S49-R52 CarbonylContact O-C 3.49Å; S49-R106 PolarHBondContact O-NH1 2.9Å
50	S	89.5	Confident	94.1	Very high	64 Å²	64	58.8 Å²	58.8	45%	0.448	27%	0.271	S	S	.	.	H	α-helix	trans	-71.9	-30.1	178.2	87	0	0	0	0	111.9	M46 E47 W48 R106	M46-S50 WeakPolarHBondContact O-CB 3.37Å; M46-S50 PolarHBondContact O-N 3.02Å; E47-S50 PolarHBondContact O-N 3.48Å; E47-S50 PolarHBondContact O-OG 3.45Å; W48-S50 PolarHBondContact O-N 3.13Å; S50-R106 VanDerWaalsContact CA-NH1 3.28Å; S50-R106 VanDerWaalsContact O-CZ 3.23Å; S50-R106 PolarHBondContact O-NH1 3.48Å; S50-R106 PolarHBondContact O-NH2 2.87Å
51	R	92.3	Very high	94.2	Very high	181 Å²	181	58.6 Å²	58.6	68%	0.683	27%	0.268	S	S	*	.	H	α-helix	trans	-84.9	-36	175.9	-59.9	-179.5	-170	-159	3.7	113.1	E47 W48	E47-R51 PolarHBondContact O-N 3.48Å; E47-R51 IonicContact OE1-CZ 3.56Å; E47-R51 IonicContact OE1-NE 2.7Å; E47-R51 IonicContact OE1-NH2 3.27Å; E47-R51 PolarHBondContact OE1-NH2 2.85Å; W48-R51 PolarHBondContact O-N 3.29Å; W48-R51 VanDerWaalsContact O-N 3.16Å
52	R	93.1	Very high	94.3	Very high	166 Å²	166	58.3 Å²	58.3	63%	0.626	27%	0.267	S	S	*	.			trans	-144.2	137.3	-178	-60.6	-174.9	-175.9	-166.9	0.8	110.4	W48 S49 V54	W48-R52 PolarHBondContact O-N 2.93Å; S49-R52 CarbonylContact C-O 3.56Å; S49-R52 VanDerWaalsContact CA-O 3.29Å; S49-R52 WeakPolarHBondContact CA-O 3.31Å; S49-R52 CarbonylContact O-C 3.49Å; R52-V54 VanDerWaalsContact C-N 3.31Å; R52-V54 PolarHBondContact O-N 3.47Å
53	S	92.8	Very high	94.2	Very high	19 Å²	19	62.1 Å²	62.1	13%	0.133	28%	0.28	C	S	.	.	S	Bend	trans	-64.9	-34	176.6	50.6	0	0	0	0	113.3	N103	S53-N103 WeakPolarHBondContact CB-OD1 3.4Å; S53-N103 PolarHBondContact OG-OD1 3.24Å
54	V	96.3	Very high	94.2	Very high	8 Å²	8	61.6 Å²	61.6	5%	0.048	27%	0.272	C	S	.	.	S	Bend	trans	-113.6	121.8	174.4	-174.8	0	0	0	0	110.2	R52 Y98 A102 F117 V119	R52-V54 VanDerWaalsContact C-N 3.31Å; R52-V54 PolarHBondContact O-N 3.47Å; V54-Y98 HydrophobicContact CG1-CD1 4.24Å; V54-Y98 HydrophobicContact CG1-CE1 3.79Å; V54-Y98 HydrophobicContact CG2-CD1 4.11Å; V54-Y98 HydrophobicContact CG2-CE1 4.14Å; V54-A102 HydrophobicContact CG2-CB 3.37Å; V54-F117 HydrophobicContact CG2-CB 4.5Å; V54-V119 HydrophobicContact CG1-CB 3.86Å; V54-V119 HydrophobicContact CG1-CG1 3.78Å
55	I	96.4	Very high	94.2	Very high	9 Å²	9	59.7 Å²	59.7	5%	0.046	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	122.3	-179.5	-52.8	167.3	0	0	0	109.6	M45 W48 M57 F117 T118 V119	M45-I55 HydrophobicContact CE-CD1 3.71Å; M45-I55 HydrophobicContact SD-CD1 4.01Å; W48-I55 HydrophobicContact CB-CD1 3.9Å; W48-I55 HydrophobicContact CB-CG1 3.96Å; W48-I55 HydrophobicContact CB-CG2 4.14Å; W48-I55 HydrophobicContact CD2-CG2 4.4Å; W48-I55 HydrophobicContact CE3-CG2 3.93Å; I55-M57 HydrophobicContact CB-CE 4.01Å; I55-M57 HydrophobicContact CG2-CE 3.49Å; I55-M57 VanDerWaalsContact CG2-CE 3.49Å; I55-M57 HydrophobicContact CG2-SD 3.95Å; I55-F117 PolarHBondContact N-O 2.83Å; I55-T118 HydrophobicContact CB-CG2 4.26Å; I55-T118 CarbonylContact O-C 3.1Å; I55-T118 WeakPolarHBondContact O-CA 3.35Å; I55-V119 PolarHBondContact O-N 3.31Å
56	R	95.6	Very high	94.2	Very high	115 Å²	115	59.7 Å²	59.7	43%	0.434	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	126.7	173.1	-76.5	-164.4	164.5	-161.2	-0.2	111.3	V119 E124	R56-V119 HydrophobicContact CB-CG1 4.32Å; R56-V119 HydrophobicContact CG-CG1 3.62Å; R56-E124 IonicContact NH1-OE1 2.64Å; R56-E124 PolarHBondContact NH1-OE1 2.98Å; R56-E124 VanDerWaalsContact NH1-OE1 3.15Å
57	M	95.1	Very high	94.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	27%	0.265	C	S	.	.			trans	-118.4	132.7	-177.7	-60.6	-61.7	-171.3	0	0	110.3	M45 I55 K61 F65 T118 V119 V120	M45-M57 HydrophobicContact CE-CE 3.97Å; M45-M57 HydrophobicContact SD-CE 3.7Å; I55-M57 HydrophobicContact CB-CE 4.01Å; I55-M57 HydrophobicContact CG2-CE 3.49Å; I55-M57 VanDerWaalsContact CG2-CE 3.49Å; I55-M57 HydrophobicContact CG2-SD 3.95Å; M57-K61 HydrophobicContact CB-CB 4.32Å; M57-K61 HydrophobicContact SD-CB 3.55Å; M57-K61 VanDerWaalsContact SD-CB 3.55Å; M57-K61 HydrophobicContact SD-CD 4.1Å; M57-K61 HydrophobicContact SD-CG 4.4Å; M57-F65 HydrophobicContact CE-CB 4.48Å; M57-T118 HydrophobicContact CE-CG2 3.57Å; M57-T118 HydrophobicContact CG-CG2 4.22Å; M57-V119 PolarHBondContact N-O 2.72Å; M57-V120 HydrophobicContact CB-CG2 3.92Å
58	N	94.6	Very high	93.9	Very high	56 Å²	56	58.1 Å²	58.1	30%	0.299	26%	0.261	S	S	.	.			trans	-90.7	-180	162.4	68.4	-11.6	0	0	0	109.8	D60 K61 F62	N58-D60 VanDerWaalsContact C-N 3.31Å; N58-D60 PolarHBondContact O-N 3.11Å; N58-D60 PolarHBondContact OD1-N 3.49Å; N58-K61 PolarHBondContact O-N 3.36Å; N58-K61 VanDerWaalsContact OD1-CB 3.23Å; N58-K61 WeakPolarHBondContact OD1-CB 2.95Å; N58-K61 WeakPolarHBondContact OD1-CG 3.41Å; N58-K61 PolarHBondContact OD1-N 3.24Å; N58-F62 WeakPolarHBondContact O-CB 3.32Å; N58-F62 PolarHBondContact O-N 3.29Å
59	G	93.3	Very high	93.6	Very high	4 Å²	4	60 Å²	60	4%	0.041	28%	0.282	C	S	.	.	H	α-helix	trans	-54.2	-42.2	178.4	0	0	0	0	0	114.3	F62 R63	G59-F62 PolarHBondContact O-N 3.07Å; G59-R63 WeakPolarHBondContact O-CG 3.44Å; G59-R63 PolarHBondContact O-N 3.21Å
60	D	94.3	Very high	93.6	Very high	103 Å²	103	61.2 Å²	61.2	55%	0.551	29%	0.289	S	S	*	.	H	α-helix	trans	-69.9	-45.9	-179.2	-65	-42.2	0	0	0	113.1	N58 F62 R63 R64	N58-D60 VanDerWaalsContact C-N 3.31Å; N58-D60 PolarHBondContact O-N 3.11Å; N58-D60 PolarHBondContact OD1-N 3.49Å; D60-F62 VanDerWaalsContact C-N 3.31Å; D60-F62 PolarHBondContact O-N 3.37Å; D60-R63 PolarHBondContact O-N 2.9Å; D60-R63 IonicContact OD1-CZ 3.98Å; D60-R63 IonicContact OD1-NE 3.42Å; D60-R63 IonicContact OD1-NH2 3.36Å; D60-R63 PolarHBondContact OD1-NH2 2.8Å; D60-R64 WeakPolarHBondContact O-CB 3.45Å; D60-R64 PolarHBondContact O-N 3.07Å
61	K	95.3	Very high	93.7	Very high	80 Å²	80	59.7 Å²	59.7	35%	0.348	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-41.2	175.8	-71.6	175.7	-179.2	-179.4	0	110.6	M57 N58 R63 R64 F65	M57-K61 HydrophobicContact CB-CB 4.32Å; M57-K61 HydrophobicContact SD-CB 3.55Å; M57-K61 VanDerWaalsContact SD-CB 3.55Å; M57-K61 HydrophobicContact SD-CD 4.1Å; M57-K61 HydrophobicContact SD-CG 4.4Å; N58-K61 PolarHBondContact O-N 3.36Å; N58-K61 VanDerWaalsContact OD1-CB 3.23Å; N58-K61 WeakPolarHBondContact OD1-CB 2.95Å; N58-K61 WeakPolarHBondContact OD1-CG 3.41Å; N58-K61 PolarHBondContact OD1-N 3.24Å; K61-R63 PolarHBondContact O-N 2.92Å; K61-R64 PolarHBondContact O-N 2.77Å; K61-F65 HydrophobicContact CB-CD2 4.28Å; K61-F65 WeakPolarHBondContact O-CD2 3.14Å; K61-F65 PolarHBondContact O-N 3.44Å
62	F	95.4	Very high	93.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-59.7	-47	175.5	-179.8	-94.3	0	0	0	111.4	N58 G59 D60 R64 V66 K67 V77 F79 V120 V128 L132 F143	N58-F62 WeakPolarHBondContact O-CB 3.32Å; N58-F62 PolarHBondContact O-N 3.29Å; G59-F62 PolarHBondContact O-N 3.07Å; D60-F62 VanDerWaalsContact C-N 3.31Å; D60-F62 PolarHBondContact O-N 3.37Å; F62-R64 PolarHBondContact O-N 2.8Å; F62-V66 HydrophobicContact CD2-CB 3.81Å; F62-V66 HydrophobicContact CD2-CG1 4.15Å; F62-V66 HydrophobicContact CD2-CG2 3.75Å; F62-V66 HydrophobicContact CE2-CB 3.83Å; F62-V66 HydrophobicContact CE2-CG1 3.65Å; F62-V66 HydrophobicContact CE2-CG2 4.1Å; F62-V66 HydrophobicContact CG-CB 4.3Å; F62-V66 HydrophobicContact CG-CG2 4.42Å; F62-V66 HydrophobicContact CZ-CB 4.33Å; F62-V66 HydrophobicContact CZ-CG1 4.06Å; F62-V66 WeakPolarHBondContact O-CA 3.21Å; F62-V66 WeakPolarHBondContact O-CB 3.27Å; F62-V66 PolarHBondContact O-N 3.36Å; F62-K67 HydrophobicContact CD1-CG 4.42Å; F62-K67 HydrophobicContact CE1-CD 4.03Å; F62-K67 HydrophobicContact CE1-CG 3.81Å; F62-K67 HydrophobicContact CZ-CG 4.37Å; F62-K67 PolarHBondContact O-N 3.33Å; F62-K67 VanDerWaalsContact O-N 3.12Å; F62-V77 HydrophobicContact CE2-CG1 4.21Å; F62-V77 HydrophobicContact CE2-CG2 4.15Å; F62-F79 HydrophobicContact CE2-CE1 4.18Å; F62-F79 AromaticContact CE2-CZ 3.93Å; F62-F79 HydrophobicContact CE2-CZ 3.93Å; F62-F79 HydrophobicContact CZ-CE1 4.49Å; F62-F79 HydrophobicContact CZ-CZ 4.14Å; F62-V120 HydrophobicContact CD2-CG2 3.85Å; F62-V120 HydrophobicContact CG-CG2 4.46Å; F62-V128 HydrophobicContact CB-CG2 4.13Å; F62-V128 HydrophobicContact CD1-CB 4.34Å; F62-V128 HydrophobicContact CD1-CG1 3.55Å; F62-V128 HydrophobicContact CD1-CG2 3.76Å; F62-V128 HydrophobicContact CD2-CG1 4.31Å; F62-V128 HydrophobicContact CE1-CG1 3.47Å; F62-V128 VanDerWaalsContact CE1-CG1 3.47Å; F62-V128 HydrophobicContact CE1-CG2 4.46Å; F62-V128 HydrophobicContact CE2-CG1 4.24Å; F62-V128 HydrophobicContact CG-CG1 3.99Å; F62-V128 HydrophobicContact CG-CG2 4.07Å; F62-V128 HydrophobicContact CZ-CG1 3.85Å; F62-L132 HydrophobicContact CZ-CD1 4.14Å; F62-F143 HydrophobicContact CE2-CE2 4.18Å; F62-F143 HydrophobicContact CE2-CZ 4.21Å; F62-F143 HydrophobicContact CZ-CE1 4.16Å; F62-F143 HydrophobicContact CZ-CE2 4.19Å; F62-F143 AromaticContact CZ-CZ 3.75Å; F62-F143 HydrophobicContact CZ-CZ 3.75Å
63	R	94.1	Very high	93.8	Very high	93 Å²	93	47 Å²	47	35%	0.351	23%	0.231	S	C	.	.	I	π-helix	trans	-59.2	-45.7	174.8	-78.4	-175.5	-75.4	-84.8	4.2	112.3	G59 D60 K61 K67 A68 D127	G59-R63 WeakPolarHBondContact O-CG 3.44Å; G59-R63 PolarHBondContact O-N 3.21Å; D60-R63 PolarHBondContact O-N 2.9Å; D60-R63 IonicContact OD1-CZ 3.98Å; D60-R63 IonicContact OD1-NE 3.42Å; D60-R63 IonicContact OD1-NH2 3.36Å; D60-R63 PolarHBondContact OD1-NH2 2.8Å; K61-R63 PolarHBondContact O-N 2.92Å; R63-K67 PolarHBondContact O-N 3.01Å; R63-A68 VanDerWaalsContact O-CB 3.27Å; R63-A68 WeakPolarHBondContact O-CB 3.48Å; R63-A68 PolarHBondContact O-N 2.87Å; R63-D127 IonicContact CZ-OD2 3.77Å; R63-D127 IonicContact NH1-OD2 2.8Å; R63-D127 PolarHBondContact NH1-OD2 2.95Å; R63-D127 IonicContact NH2-OD2 3.95Å; R63-D127 PolarHBondContact NH2-OD2 3.46Å
64	R	94	Very high	94	Very high	129 Å²	129	47 Å²	47	49%	0.487	23%	0.232	S	C	.	.	I	π-helix	trans	-71.4	-47	-175.6	-176.2	172.1	175.3	164	-2	113.3	E40 K41 D60 K61 F62	E40-R64 IonicContact OE1-NH2 3.09Å; K41-R64 WeakPolarHBondContact CE-O 3.24Å; K41-R64 PolarHBondContact NZ-O 2.94Å; D60-R64 WeakPolarHBondContact O-CB 3.45Å; D60-R64 PolarHBondContact O-N 3.07Å; K61-R64 PolarHBondContact O-N 2.77Å; F62-R64 PolarHBondContact O-N 2.8Å
65	F	94.6	Very high	94	Very high	5 Å²	5	46.6 Å²	46.6	2%	0.022	23%	0.229	C	C	.	.	I	π-helix	trans	-96.5	-29.2	-172	-63.9	-83.1	0	0	0	113.3	K41 Q44 M45 W48 M57 K61 R71 Y73	K41-F65 HydrophobicContact CB-CD1 4.33Å; K41-F65 HydrophobicContact CB-CE1 4.25Å; K41-F65 HydrophobicContact CG-CD1 4.36Å; K41-F65 HydrophobicContact CG-CE1 4.14Å; Q44-F65 HydrophobicContact CB-CE1 4.25Å; Q44-F65 VanDerWaalsContact OE1-CZ 3.27Å; M45-F65 HydrophobicContact CG-CD1 3.83Å; M45-F65 HydrophobicContact CG-CE1 4.42Å; M45-F65 HydrophobicContact SD-CB 4.01Å; M45-F65 HydrophobicContact SD-CD1 3.9Å; M45-F65 HydrophobicContact SD-CG 4.03Å; W48-F65 HydrophobicContact CH2-CD2 4.21Å; W48-F65 HydrophobicContact CH2-CE1 4.24Å; W48-F65 AromaticContact CH2-CE2 3.43Å; W48-F65 HydrophobicContact CH2-CE2 3.43Å; W48-F65 VanDerWaalsContact CH2-CE2 3.43Å; W48-F65 AromaticContact CH2-CZ 3.45Å; W48-F65 HydrophobicContact CH2-CZ 3.45Å; W48-F65 VanDerWaalsContact CH2-CZ 3.45Å; W48-F65 HydrophobicContact CZ3-CD1 4.38Å; W48-F65 AromaticContact CZ3-CD2 3.92Å; W48-F65 HydrophobicContact CZ3-CD2 3.92Å; W48-F65 HydrophobicContact CZ3-CE1 4.05Å; W48-F65 AromaticContact CZ3-CE2 3.59Å; W48-F65 HydrophobicContact CZ3-CE2 3.59Å; W48-F65 HydrophobicContact CZ3-CG 4.32Å; W48-F65 AromaticContact CZ3-CZ 3.66Å; W48-F65 HydrophobicContact CZ3-CZ 3.66Å; M57-F65 HydrophobicContact CE-CB 4.48Å; K61-F65 HydrophobicContact CB-CD2 4.28Å; K61-F65 WeakPolarHBondContact O-CD2 3.14Å; K61-F65 PolarHBondContact O-N 3.44Å; F65-R71 VanDerWaalsContact O-CD 3.25Å; F65-R71 WeakPolarHBondContact O-CD 3.47Å; F65-Y73 PolarHBondContact O-OH 3.06Å
66	V	94.3	Very high	94	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-101.4	-39.5	-176.4	-170.3	0	0	0	0	112.8	F62 R71 V75 V77 F143	F62-V66 HydrophobicContact CD2-CB 3.81Å; F62-V66 HydrophobicContact CD2-CG1 4.15Å; F62-V66 HydrophobicContact CD2-CG2 3.75Å; F62-V66 HydrophobicContact CE2-CB 3.83Å; F62-V66 HydrophobicContact CE2-CG1 3.65Å; F62-V66 HydrophobicContact CE2-CG2 4.1Å; F62-V66 HydrophobicContact CG-CB 4.3Å; F62-V66 HydrophobicContact CG-CG2 4.42Å; F62-V66 HydrophobicContact CZ-CB 4.33Å; F62-V66 HydrophobicContact CZ-CG1 4.06Å; F62-V66 WeakPolarHBondContact O-CA 3.21Å; F62-V66 WeakPolarHBondContact O-CB 3.27Å; F62-V66 PolarHBondContact O-N 3.36Å; V66-R71 PolarHBondContact O-NE 3.49Å; V66-R71 PolarHBondContact O-NH1 2.89Å; V66-R71 PolarHBondContact O-NH2 3.22Å; V66-V75 HydrophobicContact CG1-CB 4.42Å; V66-V75 HydrophobicContact CG2-CG1 4.06Å; V66-V77 HydrophobicContact CG1-CG2 4.11Å; V66-F143 HydrophobicContact CG1-CB 3.72Å; V66-F143 HydrophobicContact CG1-CD1 3.81Å; V66-F143 HydrophobicContact CG1-CD2 3.66Å; V66-F143 HydrophobicContact CG1-CE1 4.36Å; V66-F143 HydrophobicContact CG1-CE2 4.22Å; V66-F143 HydrophobicContact CG1-CG 3.43Å; V66-F143 VanDerWaalsContact CG1-CG 3.43Å
67	K	91.8	Very high	94.1	Very high	74 Å²	74	40.8 Å²	40.8	32%	0.322	21%	0.207	S	C	.	.	I	π-helix	trans	-97.7	-40	-178.6	-75	-155.6	168.7	173.2	0	115.2	F62 R63 R71 Q131	F62-K67 HydrophobicContact CD1-CG 4.42Å; F62-K67 HydrophobicContact CE1-CD 4.03Å; F62-K67 HydrophobicContact CE1-CG 3.81Å; F62-K67 HydrophobicContact CZ-CG 4.37Å; F62-K67 PolarHBondContact O-N 3.33Å; F62-K67 VanDerWaalsContact O-N 3.12Å; R63-K67 PolarHBondContact O-N 3.01Å; K67-R71 PolarHBondContact O-NH1 2.81Å; K67-Q131 VanDerWaalsContact NZ-CD 3.28Å
68	A	91.9	Very high	94.2	Very high	37 Å²	37	40.8 Å²	40.8	31%	0.306	21%	0.207	S	C	.	.	S	Bend	trans	-73.4	132	-174.5	0	0	0	0	0	111.8	K41 R63 R71	K41-A68 PolarHBondContact NZ-O 3.33Å; R63-A68 VanDerWaalsContact O-CB 3.27Å; R63-A68 WeakPolarHBondContact O-CB 3.48Å; R63-A68 PolarHBondContact O-N 2.87Å; A68-R71 PolarHBondContact O-NH1 2.93Å
69	P	88.8	Confident	94.4	Very high	108 Å²	108	38.1 Å²	38.1	70%	0.701	19%	0.192	S	C	*	.	S	Bend	trans	-71.2	162.2	166.5	32.2	-34.3	0	0	0	110.4
70	P	91.5	Very high	94.5	Very high	34 Å²	34	37.9 Å²	37.9	22%	0.221	19%	0.19	C	C	.	.	P	Polyproline II helix	cis	-77.8	154.1	-7	32.6	-34.5	0	0	0	112.6	L37 L38 K41	L37-P70 HydrophobicContact CD2-CG 4.13Å; L38-P70 HydrophobicContact CB-CB 4.29Å; L38-P70 HydrophobicContact CB-CG 3.84Å; L38-P70 HydrophobicContact CD1-CB 4.23Å; L38-P70 HydrophobicContact CD1-CG 4.35Å; K41-P70 PolarHBondContact NZ-O 2.82Å
71	R	92.7	Very high	94.6	Very high	33 Å²	33	33.6 Å²	33.6	13%	0.125	17%	0.169	C	C	.	.			trans	-144.7	140.1	172	-60.9	-167.9	-55.6	-89.7	6.1	110.6	F65 V66 K67 A68 Y73 P144	F65-R71 VanDerWaalsContact O-CD 3.25Å; F65-R71 WeakPolarHBondContact O-CD 3.47Å; V66-R71 PolarHBondContact O-NE 3.49Å; V66-R71 PolarHBondContact O-NH1 2.89Å; V66-R71 PolarHBondContact O-NH2 3.22Å; K67-R71 PolarHBondContact O-NH1 2.81Å; A68-R71 PolarHBondContact O-NH1 2.93Å; R71-Y73 HydrophobicContact CG-CE2 4.4Å; R71-P144 PolarHBondContact NH2-O 2.8Å; R71-P144 VanDerWaalsContact NH2-O 3.07Å
72	N	93.2	Very high	94.5	Very high	78 Å²	78	31.3 Å²	31.3	42%	0.417	16%	0.16	S	C	.	.			trans	-123.7	11.5	171.3	66.2	-19.7	0	0	0	112.1	L38 V42	L38-N72 HydrophobicContact CD1-CB 4.43Å; L38-N72 HydrophobicContact CD2-CB 4.12Å; V42-N72 VanDerWaalsContact CG2-OD1 3.3Å; V42-N72 WeakPolarHBondContact CG2-OD1 3.44Å
73	Y	94.6	Very high	94.3	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	18%	0.18	C	C	.	.	S	Bend	trans	-124.8	150.1	-179.7	52.2	-96.9	0	0	0	110.8	V42 F65 R71 V75 K114 F116 A145	V42-Y73 HydrophobicContact CG2-CD1 3.7Å; V42-Y73 HydrophobicContact CG2-CE1 3.75Å; F65-Y73 PolarHBondContact O-OH 3.06Å; R71-Y73 HydrophobicContact CG-CE2 4.4Å; Y73-V75 HydrophobicContact CD2-CG2 3.54Å; Y73-V75 HydrophobicContact CE2-CG2 3.6Å; Y73-K114 CarbonylContact C-O 3.53Å; Y73-K114 WeakPolarHBondContact CA-O 3.5Å; Y73-F116 HydrophobicContact CD1-CE2 4.04Å; Y73-F116 AromaticContact CD2-CD2 3.69Å; Y73-F116 HydrophobicContact CD2-CD2 3.69Å; Y73-F116 HydrophobicContact CD2-CE2 4.02Å; Y73-F116 HydrophobicContact CE2-CD2 4.38Å; Y73-F116 AromaticContact CG-CD2 3.77Å; Y73-F116 HydrophobicContact CG-CD2 3.77Å; Y73-F116 AromaticContact CG-CE2 3.65Å; Y73-F116 HydrophobicContact CG-CE2 3.65Å; Y73-A145 VanDerWaalsContact O-CA 3.32Å; Y73-A145 WeakPolarHBondContact O-CA 3.35Å
74	S	95.8	Very high	94.1	Very high	20 Å²	20	35 Å²	35	14%	0.14	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	143.2	168	-77.9	0	0	0	0	110.3	K114 L115 F116 H142 F143	S74-K114 PolarHBondContact N-O 3.36Å; S74-L115 WeakPolarHBondContact O-CA 3.21Å; S74-F116 PolarHBondContact O-N 2.61Å; S74-H142 VanDerWaalsContact CB-NE2 3.31Å; S74-H142 WeakPolarHBondContact CB-NE2 3.29Å; S74-H142 PolarHBondContact OG-NE2 2.85Å; S74-F143 WeakPolarHBondContact CA-O 3.14Å
75	V	96.8	Very high	93.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.5	176.9	-172.1	0	0	0	0	109.1	V66 Y73 V77 F116 T118 F143	V66-V75 HydrophobicContact CG1-CB 4.42Å; V66-V75 HydrophobicContact CG2-CG1 4.06Å; Y73-V75 HydrophobicContact CD2-CG2 3.54Å; Y73-V75 HydrophobicContact CE2-CG2 3.6Å; V75-V77 HydrophobicContact CG1-CG2 3.88Å; V75-F116 WeakPolarHBondContact CA-O 3.37Å; V75-T118 HydrophobicContact CG1-CG2 3.51Å; V75-T118 WeakPolarHBondContact CG1-OG1 3.06Å; V75-F143 HydrophobicContact CB-CB 4.46Å; V75-F143 PolarHBondContact N-O 3.49Å; V75-F143 PolarHBondContact O-N 3.29Å
76	I	97.6	Very high	93.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.3	167.5	-49	-56.7	0	0	0	107.3	Y98 L115 F116 F117 T118 H142 W170 I171	I76-Y98 HydrophobicContact CG2-CE2 3.92Å; I76-Y98 PolarHBondContact O-OH 3.47Å; I76-L115 HydrophobicContact CD1-CD1 4.1Å; I76-L115 HydrophobicContact CG1-CD1 3.79Å; I76-F116 PolarHBondContact N-O 2.97Å; I76-F117 HydrophobicContact CB-CD1 3.98Å; I76-F117 HydrophobicContact CB-CE1 4.08Å; I76-F117 HydrophobicContact CG1-CD1 4.41Å; I76-F117 HydrophobicContact CG1-CE1 4.08Å; I76-F117 HydrophobicContact CG1-CZ 4.48Å; I76-F117 HydrophobicContact CG2-CD1 4.33Å; I76-F117 HydrophobicContact CG2-CE1 4.31Å; I76-T118 PolarHBondContact O-N 3.27Å; I76-T118 PolarHBondContact O-OG1 2.87Å; I76-H142 HydrophobicContact CD1-CB 3.81Å; I76-W170 HydrophobicContact CG2-CZ3 4.14Å; I76-I171 HydrophobicContact CD1-CD1 4.47Å; I76-I171 HydrophobicContact CD1-CG1 3.94Å; I76-I171 HydrophobicContact CG1-CD1 4.08Å; I76-I171 HydrophobicContact CG1-CG1 4.09Å; I76-I171 HydrophobicContact CG2-CD1 4.37Å
77	V	97.3	Very high	93.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.5	-177	-170.6	0	0	0	0	108.2	F62 V66 V75 F79 T118 V120 F140 M141 F143	F62-V77 HydrophobicContact CE2-CG1 4.21Å; F62-V77 HydrophobicContact CE2-CG2 4.15Å; V66-V77 HydrophobicContact CG1-CG2 4.11Å; V75-V77 HydrophobicContact CG1-CG2 3.88Å; V77-F79 HydrophobicContact CB-CE2 4.11Å; V77-F79 HydrophobicContact CB-CZ 4.16Å; V77-F79 HydrophobicContact CG1-CD1 4.27Å; V77-F79 HydrophobicContact CG1-CD2 4.31Å; V77-F79 HydrophobicContact CG1-CE1 3.79Å; V77-F79 HydrophobicContact CG1-CE2 3.86Å; V77-F79 HydrophobicContact CG1-CZ 3.57Å; V77-T118 WeakPolarHBondContact CA-O 3.22Å; V77-T118 WeakPolarHBondContact CG2-OG1 3.33Å; V77-V120 HydrophobicContact CG1-CG2 3.89Å; V77-F140 WeakPolarHBondContact O-CA 3.33Å; V77-M141 PolarHBondContact N-O 3.37Å; V77-M141 PolarHBondContact O-N 2.92Å; V77-F143 HydrophobicContact CB-CD2 4.29Å; V77-F143 HydrophobicContact CB-CE2 4.09Å; V77-F143 HydrophobicContact CG2-CD2 3.47Å; V77-F143 VanDerWaalsContact CG2-CD2 3.47Å; V77-F143 HydrophobicContact CG2-CE2 3.65Å
78	M	97.6	Very high	93.1	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118	164.7	-177.8	-179.1	68.3	0	0	109	T80 N95 Y98 T118 V119 V120 F140	M78-T80 HydrophobicContact CE-CG2 4.06Å; M78-N95 HydrophobicContact CE-CB 3.83Å; M78-N95 WeakPolarHBondContact CE-OD1 3.49Å; M78-N95 HydrophobicContact SD-CB 4.32Å; M78-Y98 HydrophobicContact CB-CD1 3.87Å; M78-Y98 HydrophobicContact CB-CE1 3.65Å; M78-Y98 HydrophobicContact CB-CE2 4.35Å; M78-Y98 HydrophobicContact CB-CG 4.29Å; M78-Y98 HydrophobicContact CE-CD1 3.91Å; M78-Y98 HydrophobicContact CG-CD1 4.5Å; M78-Y98 HydrophobicContact SD-CD1 3.88Å; M78-Y98 HydrophobicContact SD-CG 3.95Å; M78-T118 PolarHBondContact N-O 2.98Å; M78-V119 HydrophobicContact CB-CG2 4.37Å; M78-V119 HydrophobicContact CE-CB 4.15Å; M78-V119 HydrophobicContact CE-CG2 3.37Å; M78-V119 VanDerWaalsContact O-CA 3.3Å; M78-V119 WeakPolarHBondContact O-CA 3.43Å; M78-V119 WeakPolarHBondContact O-CG2 3.33Å; M78-V120 PolarHBondContact O-N 3.26Å; M78-F140 HydrophobicContact CB-CD1 3.79Å; M78-F140 HydrophobicContact CB-CE1 3.73Å; M78-F140 HydrophobicContact CG-CD1 3.82Å; M78-F140 HydrophobicContact CG-CE1 3.4Å; M78-F140 VanDerWaalsContact CG-CE1 3.4Å; M78-F140 HydrophobicContact CG-CZ 4.04Å; M78-F140 HydrophobicContact SD-CD1 4.49Å; M78-F140 HydrophobicContact SD-CE1 3.52Å; M78-F140 VanDerWaalsContact SD-CE1 3.52Å; M78-F140 HydrophobicContact SD-CZ 3.88Å
79	F	96.9	Very high	93	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.9	168.2	-62.6	-75.1	0	0	0	108.3	F62 V77 V120 V128 F129 L132 M134 P138 T139 M141 F143	F62-F79 HydrophobicContact CE2-CE1 4.18Å; F62-F79 AromaticContact CE2-CZ 3.93Å; F62-F79 HydrophobicContact CE2-CZ 3.93Å; F62-F79 HydrophobicContact CZ-CE1 4.49Å; F62-F79 HydrophobicContact CZ-CZ 4.14Å; V77-F79 HydrophobicContact CB-CE2 4.11Å; V77-F79 HydrophobicContact CB-CZ 4.16Å; V77-F79 HydrophobicContact CG1-CD1 4.27Å; V77-F79 HydrophobicContact CG1-CD2 4.31Å; V77-F79 HydrophobicContact CG1-CE1 3.79Å; V77-F79 HydrophobicContact CG1-CE2 3.86Å; V77-F79 HydrophobicContact CG1-CZ 3.57Å; F79-V120 WeakPolarHBondContact CA-O 3.49Å; F79-V120 HydrophobicContact CD1-CB 3.89Å; F79-V120 HydrophobicContact CD1-CG1 4.37Å; F79-V120 HydrophobicContact CD1-CG2 4.42Å; F79-V120 HydrophobicContact CE1-CB 4.07Å; F79-V120 HydrophobicContact CE1-CG2 4.12Å; F79-V128 HydrophobicContact CE1-CG1 3.75Å; F79-V128 HydrophobicContact CZ-CG1 4.47Å; F79-F129 HydrophobicContact CB-CE1 3.93Å; F79-F129 HydrophobicContact CB-CE2 4.42Å; F79-F129 HydrophobicContact CB-CZ 3.69Å; F79-F129 HydrophobicContact CD1-CE2 4.12Å; F79-F129 HydrophobicContact CD1-CZ 4.21Å; F79-F129 HydrophobicContact CG-CZ 4.43Å; F79-L132 HydrophobicContact CE1-CD1 3.81Å; F79-L132 HydrophobicContact CE2-CD1 3.99Å; F79-L132 HydrophobicContact CZ-CD1 3.33Å; F79-M134 HydrophobicContact CB-CE 3.96Å; F79-M134 HydrophobicContact CB-SD 4.21Å; F79-M134 HydrophobicContact CD1-CE 3.34Å; F79-M134 HydrophobicContact CD1-SD 4.39Å; F79-M134 HydrophobicContact CD2-CE 3.68Å; F79-M134 HydrophobicContact CD2-SD 3.64Å; F79-M134 HydrophobicContact CE1-CE 3.66Å; F79-M134 HydrophobicContact CE2-CE 3.95Å; F79-M134 HydrophobicContact CE2-SD 4.08Å; F79-M134 HydrophobicContact CG-CE 3.35Å; F79-M134 HydrophobicContact CG-SD 3.81Å; F79-M134 HydrophobicContact CZ-CE 3.95Å; F79-P138 CarbonylContact O-C 3.54Å; F79-P138 WeakPolarHBondContact O-CA 3.5Å; F79-T139 PolarHBondContact N-O 3.46Å; F79-T139 PolarHBondContact O-N 3.27Å; F79-M141 HydrophobicContact CD2-CG 4.33Å; F79-M141 HydrophobicContact CD2-SD 4.35Å; F79-M141 HydrophobicContact CE2-CB 4.06Å; F79-M141 HydrophobicContact CE2-CG 3.96Å; F79-M141 HydrophobicContact CE2-SD 3.75Å; F79-F143 HydrophobicContact CE2-CE2 4.28Å; F79-F143 HydrophobicContact CZ-CE2 4.18Å; F79-F143 HydrophobicContact CZ-CZ 4.34Å
80	T	96.9	Very high	93	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	172.3	-171.7	-164.1	0	0	0	0	112.3	M78 L82 C91 V119 V120 D121 Y122	M78-T80 HydrophobicContact CE-CG2 4.06Å; T80-L82 HydrophobicContact CG2-CD1 3.93Å; T80-L82 HydrophobicContact CG2-CG 3.76Å; T80-C91 WeakPolarHBondContact OG1-CB 3.49Å; T80-V119 HydrophobicContact CG2-CG2 3.45Å; T80-V119 VanDerWaalsContact CG2-CG2 3.45Å; T80-V120 PolarHBondContact N-O 3.47Å; T80-D121 HydrophobicContact CG2-CB 4.47Å; T80-D121 CarbonylContact O-C 3.43Å; T80-D121 WeakPolarHBondContact O-CA 3.45Å; T80-Y122 PolarHBondContact O-N 2.87Å
81	A	95.6	Very high	93.1	Very high	12 Å²	12	44.6 Å²	44.6	10%	0.099	23%	0.232	C	C	.	.			trans	-140.7	79.6	173.2	0	0	0	0	0	108.6	R86 C88 A137	A81-R86 HydrophobicContact CB-CB 4.31Å; A81-R86 HydrophobicContact CB-CG 4.28Å; A81-C88 WeakPolarHBondContact O-CB 3.37Å; A81-A137 HydrophobicContact CB-CB 4.24Å
82	L	93.4	Very high	93.1	Very high	32 Å²	32	48.9 Å²	48.9	17%	0.168	25%	0.248	C	C	.	.			trans	-85.8	-14.5	-173	-68.1	173.9	0	0	0	113.3	T80 C91 R92 N95 D121	T80-L82 HydrophobicContact CG2-CD1 3.93Å; T80-L82 HydrophobicContact CG2-CG 3.76Å; L82-C91 HydrophobicContact CD2-CB 4.23Å; L82-C91 WeakPolarHBondContact CD2-O 3.26Å; L82-R92 HydrophobicContact CD2-CG 4.22Å; L82-N95 HydrophobicContact CD1-CB 4.28Å; L82-N95 HydrophobicContact CD2-CB 3.91Å; L82-D121 WeakPolarHBondContact CB-OD2 3.46Å; L82-D121 PolarHBondContact N-OD2 3.04Å
83	Q	92.2	Very high	93	Very high	90 Å²	90	49.7 Å²	49.7	42%	0.421	25%	0.249	S	C	.	.	S	Bend	trans	-60.1	133.1	-176	-157.8	64.9	-5.4	0	0	111.1	Q85 R86 D123	Q83-Q85 HydrophobicContact CB-CG 4.01Å; Q83-Q85 VanDerWaalsContact CG-CD 3.43Å; Q83-Q85 HydrophobicContact CG-CG 3.73Å; Q83-Q85 PolarHBondContact O-N 3.19Å; Q83-R86 HydrophobicContact CB-CG 4.48Å; Q83-R86 WeakPolarHBondContact O-CB 3.25Å; Q83-R86 PolarHBondContact O-N 3.14Å; Q83-D123 WeakPolarHBondContact CB-OD2 3.45Å
84	P	88.6	Confident	93	Very high	82 Å²	82	49.6 Å²	49.6	53%	0.532	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-55.8	-31.9	-173	-28	35	0	0	0	114.4	R86 Q87	P84-R86 PolarHBondContact O-N 3.45Å; P84-Q87 WeakPolarHBondContact O-CG 3.27Å; P84-Q87 PolarHBondContact O-N 2.87Å
85	Q	89.7	Confident	93	Very high	130 Å²	130	50.1 Å²	50.1	61%	0.607	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-58.7	-24.8	175.9	67	-156.9	18.1	0	0	114.2	Q83 D123	Q83-Q85 HydrophobicContact CB-CG 4.01Å; Q83-Q85 VanDerWaalsContact CG-CD 3.43Å; Q83-Q85 HydrophobicContact CG-CG 3.73Å; Q83-Q85 PolarHBondContact O-N 3.19Å; Q85-D123 VanDerWaalsContact NE2-CG 3.35Å; Q85-D123 PolarHBondContact NE2-OD2 3.25Å
86	R	87.6	Confident	92.9	Very high	124 Å²	124	56.2 Å²	56.2	47%	0.468	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-87.5	-15.4	-179.5	-59.7	-65.4	-179	-172.3	-3.4	113.4	A81 Q83 P84 C88 D123	A81-R86 HydrophobicContact CB-CB 4.31Å; A81-R86 HydrophobicContact CB-CG 4.28Å; Q83-R86 HydrophobicContact CB-CG 4.48Å; Q83-R86 WeakPolarHBondContact O-CB 3.25Å; Q83-R86 PolarHBondContact O-N 3.14Å; P84-R86 PolarHBondContact O-N 3.45Å; R86-C88 PolarHBondContact O-N 3.27Å; R86-D123 IonicContact CZ-OD1 3.4Å; R86-D123 IonicContact NE-OD1 2.82Å; R86-D123 PolarHBondContact NE-OD1 3.07Å; R86-D123 IonicContact NE-OD2 2.77Å; R86-D123 IonicContact NH2-OD1 3.23Å; R86-D123 PolarHBondContact NH2-OD1 3.07Å
87	Q	87.1	Confident	92.7	Very high	169 Å²	169	57.9 Å²	57.9	79%	0.79	29%	0.286	S	S	*	.			trans	48.4	30.6	179.3	-60.8	-175.1	-18.7	0	0	114.9	P84 S89	P84-Q87 WeakPolarHBondContact O-CG 3.27Å; P84-Q87 PolarHBondContact O-N 2.87Å; Q87-S89 PolarHBondContact O-N 3.19Å; Q87-S89 VanDerWaalsContact O-N 3.15Å
88	C	89.9	Confident	92.7	Very high	29 Å²	29	58 Å²	58	20%	0.196	29%	0.287	C	S	.	.			trans	-79.7	97.9	-179	-174.2	0	0	0	0	111.6	A81 R86 C91 R92	A81-C88 WeakPolarHBondContact O-CB 3.37Å; R86-C88 PolarHBondContact O-N 3.27Å; C88-C91 HydrophobicContact CB-CB 3.62Å; C88-C91 WeakPolarHBondContact CB-SG 3.28Å; C88-C91 WeakPolarHBondContact SG-CB 3.4Å; C88-C91 PolarHBondContact SG-N 2.85Å; C88-C91 CovalentContact SG-SG 2.04Å; C88-C91 PolarHBondContact SG-SG 2.99Å; C88-R92 PolarHBondContact O-N 3.36Å
89	S	88.6	Confident	92.6	Very high	77 Å²	77	60.9 Å²	60.9	54%	0.538	30%	0.3	S	S	.	.	H	α-helix	trans	-66.3	-43.7	177.9	55.2	0	0	0	0	112.6	Q87 C91 R92 Q93	Q87-S89 PolarHBondContact O-N 3.19Å; Q87-S89 VanDerWaalsContact O-N 3.15Å; S89-C91 VanDerWaalsContact C-N 3.28Å; S89-C91 PolarHBondContact O-N 3.08Å; S89-R92 PolarHBondContact O-N 3.09Å; S89-R92 VanDerWaalsContact O-N 3.14Å; S89-Q93 PolarHBondContact O-N 3.32Å
90	V	90.2	Very high	92.4	Very high	59 Å²	59	62 Å²	62	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-39	179	-175.1	0	0	0	0	111.1	R92 Q93 A94 P138 F162	V90-R92 VanDerWaalsContact C-N 3.31Å; V90-R92 PolarHBondContact O-N 3.09Å; V90-Q93 PolarHBondContact O-N 3.08Å; V90-A94 WeakPolarHBondContact O-CB 3.26Å; V90-A94 PolarHBondContact O-N 3.34Å; V90-P138 HydrophobicContact CG1-CG 4.05Å; V90-F162 HydrophobicContact CG1-CE1 3.97Å
91	C	93.8	Very high	92.4	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-38.4	177.3	-58.7	0	0	0	0	112.4	T80 L82 C88 S89 N95	T80-C91 WeakPolarHBondContact OG1-CB 3.49Å; L82-C91 HydrophobicContact CD2-CB 4.23Å; L82-C91 WeakPolarHBondContact CD2-O 3.26Å; C88-C91 HydrophobicContact CB-CB 3.62Å; C88-C91 WeakPolarHBondContact CB-SG 3.28Å; C88-C91 WeakPolarHBondContact SG-CB 3.4Å; C88-C91 PolarHBondContact SG-N 2.85Å; C88-C91 CovalentContact SG-SG 2.04Å; C88-C91 PolarHBondContact SG-SG 2.99Å; S89-C91 VanDerWaalsContact C-N 3.28Å; S89-C91 PolarHBondContact O-N 3.08Å; C91-N95 VanDerWaalsContact O-CB 3.22Å; C91-N95 WeakPolarHBondContact O-CB 3.4Å; C91-N95 PolarHBondContact O-N 3.39Å
92	R	92.4	Very high	92.4	Very high	122 Å²	122	61.5 Å²	61.5	46%	0.46	30%	0.303	S	S	.	.	H	α-helix	trans	-67.6	-49.5	178.5	-70.2	179.8	178.5	174.3	-0.3	111.2	L82 C88 S89 V90 A94 N95 E96	L82-R92 HydrophobicContact CD2-CG 4.22Å; C88-R92 PolarHBondContact O-N 3.36Å; S89-R92 PolarHBondContact O-N 3.09Å; S89-R92 VanDerWaalsContact O-N 3.14Å; V90-R92 VanDerWaalsContact C-N 3.31Å; V90-R92 PolarHBondContact O-N 3.09Å; R92-A94 PolarHBondContact O-N 3.5Å; R92-N95 PolarHBondContact O-N 3.4Å; R92-E96 PolarHBondContact O-N 3Å
93	Q	90.9	Very high	92.4	Very high	95 Å²	95	62.9 Å²	62.9	44%	0.444	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-44.3	178.6	-66.2	178.8	-11.4	0	0	111.7	S89 V90 N95 E96 E97 F162	S89-Q93 PolarHBondContact O-N 3.32Å; V90-Q93 PolarHBondContact O-N 3.08Å; Q93-N95 VanDerWaalsContact C-N 3.31Å; Q93-N95 PolarHBondContact O-N 3.15Å; Q93-E96 PolarHBondContact O-N 3.39Å; Q93-E97 PolarHBondContact O-N 3.02Å; Q93-F162 HydrophobicContact CB-CE2 3.75Å; Q93-F162 HydrophobicContact CB-CZ 4.06Å
94	A	94.8	Very high	92.5	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.2	-36.3	176.8	0	0	0	0	0	112.2	V90 R92 Y98 P138 F140 F162	V90-A94 WeakPolarHBondContact O-CB 3.26Å; V90-A94 PolarHBondContact O-N 3.34Å; R92-A94 PolarHBondContact O-N 3.5Å; A94-Y98 VanDerWaalsContact O-CB 3.28Å; A94-Y98 WeakPolarHBondContact O-CB 3.49Å; A94-Y98 PolarHBondContact O-N 2.91Å; A94-P138 HydrophobicContact CB-CB 4.24Å; A94-P138 HydrophobicContact CB-CG 3.71Å; A94-F140 HydrophobicContact CB-CE2 4.39Å; A94-F140 HydrophobicContact CB-CZ 4.03Å; A94-F162 HydrophobicContact CB-CB 4.23Å; A94-F162 HydrophobicContact CB-CD2 4.12Å; A94-F162 HydrophobicContact CB-CG 4.04Å
95	N	95.6	Very high	92.8	Very high	31 Å²	31	55.4 Å²	55.4	17%	0.166	27%	0.269	C	S	.	.	H	α-helix	trans	-65.9	-38.5	174.3	173.6	76.6	0	0	0	112	M78 L82 C91 R92 Q93 Y98 Q99	M78-N95 HydrophobicContact CE-CB 3.83Å; M78-N95 WeakPolarHBondContact CE-OD1 3.49Å; M78-N95 HydrophobicContact SD-CB 4.32Å; L82-N95 HydrophobicContact CD1-CB 4.28Å; L82-N95 HydrophobicContact CD2-CB 3.91Å; C91-N95 VanDerWaalsContact O-CB 3.22Å; C91-N95 WeakPolarHBondContact O-CB 3.4Å; C91-N95 PolarHBondContact O-N 3.39Å; R92-N95 PolarHBondContact O-N 3.4Å; Q93-N95 VanDerWaalsContact C-N 3.31Å; Q93-N95 PolarHBondContact O-N 3.15Å; N95-Y98 PolarHBondContact O-N 2.85Å; N95-Q99 WeakPolarHBondContact O-CB 3.42Å; N95-Q99 WeakPolarHBondContact O-CG 3.23Å; N95-Q99 PolarHBondContact O-N 3.13Å
96	E	93.5	Very high	92.9	Very high	127 Å²	127	53.2 Å²	53.2	59%	0.593	26%	0.255	S	S	*	.	H	α-helix	trans	-60.1	-48.6	175.5	-71.4	169.9	-172.1	0	0	111.6	R92 Q93 Y98 Q99 V100	R92-E96 PolarHBondContact O-N 3Å; Q93-E96 PolarHBondContact O-N 3.39Å; E96-Y98 PolarHBondContact O-N 3.44Å; E96-Q99 PolarHBondContact O-N 2.83Å; E96-V100 WeakPolarHBondContact O-CG2 3.41Å; E96-V100 PolarHBondContact O-N 2.61Å
97	E	94.4	Very high	93	Very high	37 Å²	37	56.2 Å²	56.2	17%	0.173	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-41.7	175.7	-69.3	-69.2	136.6	0	0	111.7	Q93 Q99 V100 L101 F162 S164 R183	Q93-E97 PolarHBondContact O-N 3.02Å; E97-Q99 VanDerWaalsContact C-N 3.32Å; E97-Q99 PolarHBondContact O-N 2.93Å; E97-V100 PolarHBondContact O-N 3.41Å; E97-L101 PolarHBondContact O-N 3.12Å; E97-F162 WeakPolarHBondContact CB-O 3.21Å; E97-F162 HydrophobicContact CG-CD2 4.22Å; E97-F162 WeakPolarHBondContact CG-O 3.41Å; E97-S164 WeakPolarHBondContact CA-OG 3.1Å; E97-S164 PolarHBondContact O-OG 3.16Å; E97-S164 WeakPolarHBondContact OE2-CB 3.31Å; E97-S164 PolarHBondContact OE2-N 2.97Å; E97-S164 PolarHBondContact OE2-OG 2.68Å; E97-R183 IonicContact OE1-CZ 3.55Å; E97-R183 IonicContact OE1-NH1 3.44Å; E97-R183 PolarHBondContact OE1-NH1 2.86Å; E97-R183 IonicContact OE1-NH2 2.76Å; E97-R183 IonicContact OE2-CZ 2.72Å; E97-R183 IonicContact OE2-NH1 3.15Å; E97-R183 PolarHBondContact OE2-NH1 2.92Å; E97-R183 IonicContact OE2-NH2 2.92Å; E97-R183 PolarHBondContact OE2-NH2 3.01Å
98	Y	96.5	Very high	93.2	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-63.9	-36.3	177.6	-169	-116.6	0	0	0	113	V54 I76 M78 A94 N95 E96 L101 A102 F117 T118 F140	V54-Y98 HydrophobicContact CG1-CD1 4.24Å; V54-Y98 HydrophobicContact CG1-CE1 3.79Å; V54-Y98 HydrophobicContact CG2-CD1 4.11Å; V54-Y98 HydrophobicContact CG2-CE1 4.14Å; I76-Y98 HydrophobicContact CG2-CE2 3.92Å; I76-Y98 PolarHBondContact O-OH 3.47Å; M78-Y98 HydrophobicContact CB-CD1 3.87Å; M78-Y98 HydrophobicContact CB-CE1 3.65Å; M78-Y98 HydrophobicContact CB-CE2 4.35Å; M78-Y98 HydrophobicContact CB-CG 4.29Å; M78-Y98 HydrophobicContact CE-CD1 3.91Å; M78-Y98 HydrophobicContact CG-CD1 4.5Å; M78-Y98 HydrophobicContact SD-CD1 3.88Å; M78-Y98 HydrophobicContact SD-CG 3.95Å; A94-Y98 VanDerWaalsContact O-CB 3.28Å; A94-Y98 WeakPolarHBondContact O-CB 3.49Å; A94-Y98 PolarHBondContact O-N 2.91Å; N95-Y98 PolarHBondContact O-N 2.85Å; E96-Y98 PolarHBondContact O-N 3.44Å; Y98-L101 HydrophobicContact CD2-CD2 4.39Å; Y98-L101 PolarHBondContact O-N 3.26Å; Y98-A102 WeakPolarHBondContact O-CB 3.33Å; Y98-A102 PolarHBondContact O-N 2.9Å; Y98-F117 AromaticContact CE2-CD1 3.69Å; Y98-F117 HydrophobicContact CE2-CD1 3.69Å; Y98-F117 HydrophobicContact CE2-CE1 4.23Å; Y98-F117 AromaticContact CZ-CD1 3.73Å; Y98-T118 WeakPolarHBondContact CE1-O 3.48Å; Y98-T118 PolarHBondContact OH-N 2.76Å; Y98-T118 PolarHBondContact OH-O 3.09Å; Y98-F140 AromaticContact CD2-CD1 3.91Å; Y98-F140 HydrophobicContact CD2-CD1 3.91Å; Y98-F140 AromaticContact CD2-CE1 3.53Å; Y98-F140 HydrophobicContact CD2-CE1 3.53Å; Y98-F140 HydrophobicContact CE2-CD1 4.03Å; Y98-F140 HydrophobicContact CE2-CE1 4.1Å; Y98-F140 AromaticContact CG-CE1 3.85Å; Y98-F140 HydrophobicContact CG-CE1 3.85Å
99	Q	95.3	Very high	93	Very high	62 Å²	62	54.4 Å²	54.4	29%	0.29	27%	0.274	S	S	.	.	H	α-helix	trans	-66.6	-42.5	174.3	-69.8	-74.9	-11.5	0	0	111.4	N95 E96 E97 L101 A102 N103	N95-Q99 WeakPolarHBondContact O-CB 3.42Å; N95-Q99 WeakPolarHBondContact O-CG 3.23Å; N95-Q99 PolarHBondContact O-N 3.13Å; E96-Q99 PolarHBondContact O-N 2.83Å; E97-Q99 VanDerWaalsContact C-N 3.32Å; E97-Q99 PolarHBondContact O-N 2.93Å; Q99-L101 VanDerWaalsContact C-N 3.33Å; Q99-L101 PolarHBondContact O-N 3.34Å; Q99-A102 PolarHBondContact O-N 2.8Å; Q99-N103 VanDerWaalsContact O-CB 3.31Å; Q99-N103 WeakPolarHBondContact O-CB 3.37Å; Q99-N103 PolarHBondContact O-N 2.96Å; Q99-N103 PolarHBondContact O-ND2 3.16Å; Q99-N103 VanDerWaalsContact O-ND2 3.12Å
100	V	94.4	Very high	92.9	Very high	23 Å²	23	53.1 Å²	53.1	14%	0.139	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-46	175.5	171.5	0	0	0	0	110.6	E96 E97 N103 S104 V181 R183	E96-V100 WeakPolarHBondContact O-CG2 3.41Å; E96-V100 PolarHBondContact O-N 2.61Å; E97-V100 PolarHBondContact O-N 3.41Å; V100-N103 PolarHBondContact O-N 2.92Å; V100-S104 WeakPolarHBondContact O-CB 3.45Å; V100-S104 PolarHBondContact O-N 2.8Å; V100-S104 PolarHBondContact O-OG 2.92Å; V100-V181 HydrophobicContact CG1-CG1 3.87Å; V100-R183 HydrophobicContact CG1-CG 4.14Å
101	L	95.5	Very high	92.9	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-50	175.7	176.1	65.7	0	0	0	112.5	E97 Y98 Q99 N103 S104 W105 F117 L167 A168 I171 I179 V181	E97-L101 PolarHBondContact O-N 3.12Å; Y98-L101 HydrophobicContact CD2-CD2 4.39Å; Y98-L101 PolarHBondContact O-N 3.26Å; Q99-L101 VanDerWaalsContact C-N 3.33Å; Q99-L101 PolarHBondContact O-N 3.34Å; L101-N103 PolarHBondContact O-N 2.96Å; L101-S104 WeakPolarHBondContact O-CB 3.28Å; L101-S104 PolarHBondContact O-N 2.83Å; L101-W105 PolarHBondContact O-N 2.95Å; L101-F117 HydrophobicContact CD2-CE1 3.83Å; L101-F117 HydrophobicContact CD2-CZ 4.46Å; L101-F117 HydrophobicContact CG-CE1 4.03Å; L101-F117 HydrophobicContact CG-CZ 4.29Å; L101-L167 HydrophobicContact CD2-CB 3.64Å; L101-L167 HydrophobicContact CD2-CD1 4.29Å; L101-A168 HydrophobicContact CD1-CB 3.71Å; L101-I171 HydrophobicContact CD2-CD1 3.74Å; L101-I179 HydrophobicContact CD1-CB 4.4Å; L101-I179 HydrophobicContact CD1-CD1 4.32Å; L101-I179 HydrophobicContact CD1-CG2 4Å; L101-V181 HydrophobicContact CD1-CG2 4.07Å
102	A	95.4	Very high	92.8	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-37.5	-178.4	0	0	0	0	0	112.4	V54 Y98 Q99 W105 R106 F117	V54-A102 HydrophobicContact CG2-CB 3.37Å; Y98-A102 WeakPolarHBondContact O-CB 3.33Å; Y98-A102 PolarHBondContact O-N 2.9Å; Q99-A102 PolarHBondContact O-N 2.8Å; A102-W105 PolarHBondContact O-N 3.35Å; A102-R106 PolarHBondContact O-N 3.2Å; A102-F117 HydrophobicContact CB-CB 3.9Å; A102-F117 HydrophobicContact CB-CD1 4.28Å; A102-F117 HydrophobicContact CB-CD2 4.28Å; A102-F117 HydrophobicContact CB-CG 3.89Å
103	N	94.1	Very high	92.7	Very high	61 Å²	61	52.8 Å²	52.8	33%	0.326	27%	0.273	S	S	.	.	H	α-helix	trans	-64.2	-43.4	172.3	-73.2	-29.8	0	0	0	111	S53 Q99 V100 L101 W105 R106 Y107	S53-N103 WeakPolarHBondContact CB-OD1 3.4Å; S53-N103 PolarHBondContact OG-OD1 3.24Å; Q99-N103 VanDerWaalsContact O-CB 3.31Å; Q99-N103 WeakPolarHBondContact O-CB 3.37Å; Q99-N103 PolarHBondContact O-N 2.96Å; Q99-N103 PolarHBondContact O-ND2 3.16Å; Q99-N103 VanDerWaalsContact O-ND2 3.12Å; V100-N103 PolarHBondContact O-N 2.92Å; L101-N103 PolarHBondContact O-N 2.96Å; N103-W105 VanDerWaalsContact C-N 3.27Å; N103-W105 PolarHBondContact O-N 3.47Å; N103-R106 WeakPolarHBondContact O-CB 3.37Å; N103-R106 PolarHBondContact O-N 2.71Å; N103-R106 VanDerWaalsContact O-N 3.15Å; N103-Y107 WeakPolarHBondContact O-CD2 3.48Å; N103-Y107 PolarHBondContact O-N 3.05Å; N103-Y107 VanDerWaalsContact O-N 3.08Å
104	S	93.8	Very high	92.8	Very high	8 Å²	8	54.8 Å²	54.8	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-39.6	176.7	-57.8	0	0	0	0	111.8	V100 L101 S108 R180 F182	V100-S104 WeakPolarHBondContact O-CB 3.45Å; V100-S104 PolarHBondContact O-N 2.8Å; V100-S104 PolarHBondContact O-OG 2.92Å; L101-S104 WeakPolarHBondContact O-CB 3.28Å; L101-S104 PolarHBondContact O-N 2.83Å; S104-S108 WeakPolarHBondContact O-CB 3.07Å; S104-S108 PolarHBondContact O-N 3.47Å; S104-S108 VanDerWaalsContact O-N 3.09Å; S104-R180 WeakPolarHBondContact CB-O 3.02Å; S104-F182 PolarHBondContact OG-N 3.31Å; S104-F182 PolarHBondContact OG-O 3.15Å
105	W	94.6	Very high	92.8	Very high	7 Å²	7	54.9 Å²	54.9	3%	0.027	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-46.3	173.2	174.5	-122.1	0	0	0	112.6	L101 A102 N103 Y107 S108 A110 F111 S112 L115 F117 V177 I179	L101-W105 PolarHBondContact O-N 2.95Å; A102-W105 PolarHBondContact O-N 3.35Å; N103-W105 VanDerWaalsContact C-N 3.27Å; N103-W105 PolarHBondContact O-N 3.47Å; W105-Y107 VanDerWaalsContact C-N 3.27Å; W105-Y107 PolarHBondContact O-N 3.4Å; W105-S108 VanDerWaalsContact O-CB 3.28Å; W105-S108 WeakPolarHBondContact O-CB 3.44Å; W105-S108 PolarHBondContact O-N 3.21Å; W105-S108 VanDerWaalsContact O-N 3.09Å; W105-A110 WeakPolarHBondContact CH2-O 3.49Å; W105-A110 HydrophobicContact CZ3-CB 4.04Å; W105-A110 VanDerWaalsContact CZ3-O 3.31Å; W105-A110 WeakPolarHBondContact CZ3-O 3.47Å; W105-F111 AromaticContact CD1-CD2 3.88Å; W105-F111 HydrophobicContact CD2-CD2 4.25Å; W105-F111 AromaticContact CE2-CD2 3.82Å; W105-F111 HydrophobicContact CG-CD2 4.33Å; W105-F111 HydrophobicContact CZ2-CD2 4.34Å; W105-F111 AromaticContact NE1-CD2 3.58Å; W105-F111 AromaticContact NE1-CE2 3.76Å; W105-S112 VanDerWaalsContact CZ2-N 3.3Å; W105-L115 HydrophobicContact CD2-CD2 4.49Å; W105-L115 HydrophobicContact CZ2-CB 3.88Å; W105-L115 HydrophobicContact CZ2-CD2 4.34Å; W105-L115 PolarHBondContact NE1-O 2.89Å; W105-L115 VanDerWaalsContact NE1-O 3.14Å; W105-F117 HydrophobicContact CB-CD2 4.32Å; W105-F117 HydrophobicContact CB-CE2 3.67Å; W105-F117 HydrophobicContact CB-CZ 4.41Å; W105-F117 AromaticContact CD1-CD2 3.68Å; W105-F117 AromaticContact CD1-CE2 3.43Å; W105-F117 VanDerWaalsContact CD1-CE2 3.43Å; W105-F117 HydrophobicContact CD2-CE2 4.45Å; W105-F117 HydrophobicContact CG-CD2 4.21Å; W105-F117 AromaticContact CG-CE2 3.57Å; W105-F117 HydrophobicContact CG-CE2 3.57Å; W105-V177 HydrophobicContact CE3-CG1 4.17Å; W105-V177 HydrophobicContact CH2-CG1 3.37Å; W105-V177 HydrophobicContact CZ2-CG1 4.27Å; W105-V177 HydrophobicContact CZ3-CG1 3.32Å; W105-I179 HydrophobicContact CB-CD1 4.27Å; W105-I179 HydrophobicContact CB-CG2 4.23Å; W105-I179 HydrophobicContact CD2-CD1 4.41Å; W105-I179 HydrophobicContact CD2-CG1 4.49Å; W105-I179 HydrophobicContact CE3-CD1 4.22Å; W105-I179 HydrophobicContact CE3-CG1 3.82Å; W105-I179 HydrophobicContact CG-CD1 4.48Å; W105-I179 HydrophobicContact CZ3-CG1 4.36Å
106	R	92.1	Very high	92.9	Very high	84 Å²	84	53.5 Å²	53.5	32%	0.317	27%	0.273	S	S	.	.	H	α-helix	trans	-57.8	-39.2	179.7	179	-171.4	170.2	89.8	-1	112.6	S49 S50 A102 N103	S49-R106 PolarHBondContact O-NH1 2.9Å; S50-R106 VanDerWaalsContact CA-NH1 3.28Å; S50-R106 VanDerWaalsContact O-CZ 3.23Å; S50-R106 PolarHBondContact O-NH1 3.48Å; S50-R106 PolarHBondContact O-NH2 2.87Å; A102-R106 PolarHBondContact O-N 3.2Å; N103-R106 WeakPolarHBondContact O-CB 3.37Å; N103-R106 PolarHBondContact O-N 2.71Å; N103-R106 VanDerWaalsContact O-N 3.15Å
107	Y	90.2	Very high	93.1	Very high	187 Å²	187	47.6 Å²	47.6	73%	0.733	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	2	179.7	-65.9	-70.4	0	0	0	113.6	N103 W105	N103-Y107 WeakPolarHBondContact O-CD2 3.48Å; N103-Y107 PolarHBondContact O-N 3.05Å; N103-Y107 VanDerWaalsContact O-N 3.08Å; W105-Y107 VanDerWaalsContact C-N 3.27Å; W105-Y107 PolarHBondContact O-N 3.4Å
108	S	90.4	Very high	93.2	Very high	26 Å²	26	45.9 Å²	45.9	18%	0.182	24%	0.237	C	C	.	.	S	Bend	trans	-74.2	142.6	178.6	-175.3	0	0	0	0	111.1	S104 W105 A110 F111	S104-S108 WeakPolarHBondContact O-CB 3.07Å; S104-S108 PolarHBondContact O-N 3.47Å; S104-S108 VanDerWaalsContact O-N 3.09Å; W105-S108 VanDerWaalsContact O-CB 3.28Å; W105-S108 WeakPolarHBondContact O-CB 3.44Å; W105-S108 PolarHBondContact O-N 3.21Å; W105-S108 VanDerWaalsContact O-N 3.09Å; S108-A110 PolarHBondContact O-N 2.85Å; S108-A110 PolarHBondContact OG-N 3.46Å; S108-F111 VanDerWaalsContact O-CB 3.24Å; S108-F111 WeakPolarHBondContact O-CB 3.2Å; S108-F111 PolarHBondContact O-N 3.45Å; S108-F111 VanDerWaalsContact O-N 3.11Å
109	S	87.1	Confident	93.2	Very high	133 Å²	133	46.1 Å²	46.1	93%	0.93	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.9	169.5	56.2	0	0	0	0	112.9	F111	S109-F111 VanDerWaalsContact C-N 3.27Å; S109-F111 PolarHBondContact O-N 3.36Å
110	A	86.1	Confident	93.3	Very high	50 Å²	50	43.2 Å²	43.2	41%	0.413	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	2.3	176.1	0	0	0	0	0	113.7	W105 S108 S112	W105-A110 WeakPolarHBondContact CH2-O 3.49Å; W105-A110 HydrophobicContact CZ3-CB 4.04Å; W105-A110 VanDerWaalsContact CZ3-O 3.31Å; W105-A110 WeakPolarHBondContact CZ3-O 3.47Å; S108-A110 PolarHBondContact O-N 2.85Å; S108-A110 PolarHBondContact OG-N 3.46Å; A110-S112 PolarHBondContact O-N 3.47Å
111	F	90.2	Very high	93.4	Very high	74 Å²	74	42.5 Å²	42.5	33%	0.325	22%	0.221	S	C	.	.			trans	-53.5	131.3	-177.9	179.1	-104	0	0	0	111.9	M46 W105 S108 S109	M46-F111 HydrophobicContact CE-CE1 3.72Å; M46-F111 HydrophobicContact CE-CZ 4Å; M46-F111 HydrophobicContact SD-CZ 4.38Å; W105-F111 AromaticContact CD1-CD2 3.88Å; W105-F111 HydrophobicContact CD2-CD2 4.25Å; W105-F111 AromaticContact CE2-CD2 3.82Å; W105-F111 HydrophobicContact CG-CD2 4.33Å; W105-F111 HydrophobicContact CZ2-CD2 4.34Å; W105-F111 AromaticContact NE1-CD2 3.58Å; W105-F111 AromaticContact NE1-CE2 3.76Å; S108-F111 VanDerWaalsContact O-CB 3.24Å; S108-F111 WeakPolarHBondContact O-CB 3.2Å; S108-F111 PolarHBondContact O-N 3.45Å; S108-F111 VanDerWaalsContact O-N 3.11Å; S109-F111 VanDerWaalsContact C-N 3.27Å; S109-F111 PolarHBondContact O-N 3.36Å
112	S	90.7	Very high	93.4	Very high	33 Å²	33	46.3 Å²	46.3	23%	0.231	24%	0.236	C	C	.	.			trans	-148.3	160.9	-178.3	70.7	0	0	0	0	112.1	W105 A110 K114	W105-S112 VanDerWaalsContact CZ2-N 3.3Å; A110-S112 PolarHBondContact O-N 3.47Å; S112-K114 PolarHBondContact O-N 2.98Å; S112-K114 VanDerWaalsContact O-N 3.13Å; S112-K114 PolarHBondContact OG-N 2.99Å
113	N	92.3	Very high	93.3	Very high	68 Å²	68	49.1 Å²	49.1	36%	0.364	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	11.9	174.4	67.3	-6.7	0	0	0	114	V42 M46 F116	V42-N113 HydrophobicContact CG1-CB 3.96Å; M46-N113 HydrophobicContact CE-CB 4.46Å; M46-N113 HydrophobicContact CG-CB 3.98Å; M46-N113 HydrophobicContact SD-CB 3.52Å; M46-N113 VanDerWaalsContact SD-CB 3.52Å; N113-F116 HydrophobicContact CB-CZ 4.24Å; N113-F116 WeakPolarHBondContact O-CE2 3.35Å; N113-F116 WeakPolarHBondContact O-CZ 3.44Å
114	K	92.4	Very high	93.3	Very high	136 Å²	136	50.4 Å²	50.4	59%	0.591	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-12.3	-179.5	-62.6	-176.8	-178.1	176.7	0	113.1	Y73 S74 S112	Y73-K114 CarbonylContact C-O 3.53Å; Y73-K114 WeakPolarHBondContact CA-O 3.5Å; S74-K114 PolarHBondContact N-O 3.36Å; S112-K114 PolarHBondContact O-N 2.98Å; S112-K114 VanDerWaalsContact O-N 3.13Å; S112-K114 PolarHBondContact OG-N 2.99Å
115	L	94.9	Very high	93.2	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	123.9	-177.6	-174.6	68.2	0	0	0	110.9	S74 I76 W105 F117 I171 T175 V177 I179	S74-L115 WeakPolarHBondContact O-CA 3.21Å; I76-L115 HydrophobicContact CD1-CD1 4.1Å; I76-L115 HydrophobicContact CG1-CD1 3.79Å; W105-L115 HydrophobicContact CD2-CD2 4.49Å; W105-L115 HydrophobicContact CZ2-CB 3.88Å; W105-L115 HydrophobicContact CZ2-CD2 4.34Å; W105-L115 PolarHBondContact NE1-O 2.89Å; W105-L115 VanDerWaalsContact NE1-O 3.14Å; L115-F117 HydrophobicContact CD2-CE2 3.97Å; L115-F117 HydrophobicContact CD2-CZ 4.09Å; L115-F117 HydrophobicContact CG-CE2 4.21Å; L115-I171 HydrophobicContact CD2-CG2 3.91Å; L115-T175 HydrophobicContact CD1-CG2 4.25Å; L115-V177 HydrophobicContact CD2-CB 4.24Å; L115-V177 HydrophobicContact CD2-CG1 3.98Å; L115-I179 HydrophobicContact CD2-CD1 3.95Å
116	F	96.5	Very high	93.2	Very high	3 Å²	3	51.3 Å²	51.3	1%	0.013	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.7	178.6	-61.4	-76.9	0	0	0	111.9	M45 M46 Y73 S74 V75 I76 N113	M45-F116 HydrophobicContact CB-CD1 4.08Å; M45-F116 HydrophobicContact CB-CD2 4.33Å; M45-F116 HydrophobicContact CB-CE1 3.79Å; M45-F116 HydrophobicContact CB-CE2 4.04Å; M45-F116 HydrophobicContact CB-CG 4.34Å; M45-F116 HydrophobicContact CB-CZ 3.76Å; M45-F116 HydrophobicContact CE-CB 3.52Å; M45-F116 HydrophobicContact CE-CD1 4.17Å; M45-F116 HydrophobicContact CE-CD2 3.97Å; M45-F116 HydrophobicContact CE-CG 3.63Å; M46-F116 HydrophobicContact CG-CE1 4.17Å; M46-F116 HydrophobicContact CG-CZ 4.06Å; M46-F116 HydrophobicContact SD-CE1 3.61Å; M46-F116 HydrophobicContact SD-CZ 3.78Å; Y73-F116 HydrophobicContact CD1-CE2 4.04Å; Y73-F116 AromaticContact CD2-CD2 3.69Å; Y73-F116 HydrophobicContact CD2-CD2 3.69Å; Y73-F116 HydrophobicContact CD2-CE2 4.02Å; Y73-F116 HydrophobicContact CE2-CD2 4.38Å; Y73-F116 AromaticContact CG-CD2 3.77Å; Y73-F116 HydrophobicContact CG-CD2 3.77Å; Y73-F116 AromaticContact CG-CE2 3.65Å; Y73-F116 HydrophobicContact CG-CE2 3.65Å; S74-F116 PolarHBondContact O-N 2.61Å; V75-F116 WeakPolarHBondContact CA-O 3.37Å; I76-F116 PolarHBondContact N-O 2.97Å; N113-F116 HydrophobicContact CB-CZ 4.24Å; N113-F116 WeakPolarHBondContact O-CE2 3.35Å; N113-F116 WeakPolarHBondContact O-CZ 3.44Å
117	F	97.4	Very high	93.3	Very high	3 Å²	3	50.2 Å²	50.2	1%	0.013	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.9	176.6	-70	-90.5	0	0	0	110.3	V54 I55 I76 Y98 L101 A102 W105 L115 I171 I179	V54-F117 HydrophobicContact CG2-CB 4.5Å; I55-F117 PolarHBondContact N-O 2.83Å; I76-F117 HydrophobicContact CB-CD1 3.98Å; I76-F117 HydrophobicContact CB-CE1 4.08Å; I76-F117 HydrophobicContact CG1-CD1 4.41Å; I76-F117 HydrophobicContact CG1-CE1 4.08Å; I76-F117 HydrophobicContact CG1-CZ 4.48Å; I76-F117 HydrophobicContact CG2-CD1 4.33Å; I76-F117 HydrophobicContact CG2-CE1 4.31Å; Y98-F117 AromaticContact CE2-CD1 3.69Å; Y98-F117 HydrophobicContact CE2-CD1 3.69Å; Y98-F117 HydrophobicContact CE2-CE1 4.23Å; Y98-F117 AromaticContact CZ-CD1 3.73Å; L101-F117 HydrophobicContact CD2-CE1 3.83Å; L101-F117 HydrophobicContact CD2-CZ 4.46Å; L101-F117 HydrophobicContact CG-CE1 4.03Å; L101-F117 HydrophobicContact CG-CZ 4.29Å; A102-F117 HydrophobicContact CB-CB 3.9Å; A102-F117 HydrophobicContact CB-CD1 4.28Å; A102-F117 HydrophobicContact CB-CD2 4.28Å; A102-F117 HydrophobicContact CB-CG 3.89Å; W105-F117 HydrophobicContact CB-CD2 4.32Å; W105-F117 HydrophobicContact CB-CE2 3.67Å; W105-F117 HydrophobicContact CB-CZ 4.41Å; W105-F117 AromaticContact CD1-CD2 3.68Å; W105-F117 AromaticContact CD1-CE2 3.43Å; W105-F117 VanDerWaalsContact CD1-CE2 3.43Å; W105-F117 HydrophobicContact CD2-CE2 4.45Å; W105-F117 HydrophobicContact CG-CD2 4.21Å; W105-F117 AromaticContact CG-CE2 3.57Å; W105-F117 HydrophobicContact CG-CE2 3.57Å; L115-F117 HydrophobicContact CD2-CE2 3.97Å; L115-F117 HydrophobicContact CD2-CZ 4.09Å; L115-F117 HydrophobicContact CG-CE2 4.21Å; F117-I171 HydrophobicContact CE1-CD1 3.68Å; F117-I171 HydrophobicContact CZ-CD1 3.92Å; F117-I179 HydrophobicContact CE2-CD1 4.11Å; F117-I179 HydrophobicContact CZ-CD1 3.59Å
118	T	97.4	Very high	93.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	159	-176	66.1	0	0	0	0	111.3	M45 I55 M57 V75 I76 V77 M78 Y98	M45-T118 HydrophobicContact CE-CG2 4.23Å; I55-T118 HydrophobicContact CB-CG2 4.26Å; I55-T118 CarbonylContact O-C 3.1Å; I55-T118 WeakPolarHBondContact O-CA 3.35Å; M57-T118 HydrophobicContact CE-CG2 3.57Å; M57-T118 HydrophobicContact CG-CG2 4.22Å; V75-T118 HydrophobicContact CG1-CG2 3.51Å; V75-T118 WeakPolarHBondContact CG1-OG1 3.06Å; I76-T118 PolarHBondContact O-N 3.27Å; I76-T118 PolarHBondContact O-OG1 2.87Å; V77-T118 WeakPolarHBondContact CA-O 3.22Å; V77-T118 WeakPolarHBondContact CG2-OG1 3.33Å; M78-T118 PolarHBondContact N-O 2.98Å; Y98-T118 WeakPolarHBondContact CE1-O 3.48Å; Y98-T118 PolarHBondContact OH-N 2.76Å; Y98-T118 PolarHBondContact OH-O 3.09Å
119	V	97.5	Very high	93.7	Very high	7 Å²	7	40.3 Å²	40.3	4%	0.042	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	139.3	175	65.4	0	0	0	0	109.9	V54 I55 R56 M57 M78 T80	V54-V119 HydrophobicContact CG1-CB 3.86Å; V54-V119 HydrophobicContact CG1-CG1 3.78Å; I55-V119 PolarHBondContact O-N 3.31Å; R56-V119 HydrophobicContact CB-CG1 4.32Å; R56-V119 HydrophobicContact CG-CG1 3.62Å; M57-V119 PolarHBondContact N-O 2.72Å; M78-V119 HydrophobicContact CB-CG2 4.37Å; M78-V119 HydrophobicContact CE-CB 4.15Å; M78-V119 HydrophobicContact CE-CG2 3.37Å; M78-V119 VanDerWaalsContact O-CA 3.3Å; M78-V119 WeakPolarHBondContact O-CA 3.43Å; M78-V119 WeakPolarHBondContact O-CG2 3.33Å; T80-V119 HydrophobicContact CG2-CG2 3.45Å; T80-V119 VanDerWaalsContact CG2-CG2 3.45Å
120	V	97.2	Very high	94	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	116.3	172	-178.5	0	0	0	0	107.2	M57 F62 V77 M78 F79 T80 V128 F129	M57-V120 HydrophobicContact CB-CG2 3.92Å; F62-V120 HydrophobicContact CD2-CG2 3.85Å; F62-V120 HydrophobicContact CG-CG2 4.46Å; V77-V120 HydrophobicContact CG1-CG2 3.89Å; M78-V120 PolarHBondContact O-N 3.26Å; F79-V120 WeakPolarHBondContact CA-O 3.49Å; F79-V120 HydrophobicContact CD1-CB 3.89Å; F79-V120 HydrophobicContact CD1-CG1 4.37Å; F79-V120 HydrophobicContact CD1-CG2 4.42Å; F79-V120 HydrophobicContact CE1-CB 4.07Å; F79-V120 HydrophobicContact CE1-CG2 4.12Å; T80-V120 PolarHBondContact N-O 3.47Å; V120-V128 HydrophobicContact CG1-CB 4.42Å; V120-F129 HydrophobicContact CG1-CE2 4.14Å
121	D	96.3	Very high	94.3	Very high	9 Å²	9	43.7 Å²	43.7	5%	0.048	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	141.3	173.2	-162.4	-73.3	0	0	0	110.1	T80 L82 D123 E124 G125	T80-D121 HydrophobicContact CG2-CB 4.47Å; T80-D121 CarbonylContact O-C 3.43Å; T80-D121 WeakPolarHBondContact O-CA 3.45Å; L82-D121 WeakPolarHBondContact CB-OD2 3.46Å; L82-D121 PolarHBondContact N-OD2 3.04Å; D121-D123 VanDerWaalsContact C-N 3.26Å; D121-D123 PolarHBondContact O-N 3.35Å; D121-D123 PolarHBondContact OD1-N 2.96Å; D121-E124 HydrophobicContact CB-CB 4.31Å; D121-E124 HydrophobicContact CB-CG 4.27Å; D121-E124 PolarHBondContact O-N 2.82Å; D121-E124 VanDerWaalsContact O-N 3.11Å; D121-G125 PolarHBondContact O-N 2.83Å
122	Y	94.8	Very high	94.4	Very high	81 Å²	81	42.3 Å²	42.3	32%	0.318	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-41.7	178	179.8	-96.5	0	0	0	112.4	T80 E124 G125 A126 F129	T80-Y122 PolarHBondContact O-N 2.87Å; Y122-E124 VanDerWaalsContact C-N 3.28Å; Y122-E124 PolarHBondContact O-N 2.76Å; Y122-G125 PolarHBondContact O-N 3.37Å; Y122-A126 HydrophobicContact CE2-CB 4.31Å; Y122-A126 WeakPolarHBondContact O-CA 3.39Å; Y122-A126 WeakPolarHBondContact O-CB 3.37Å; Y122-A126 PolarHBondContact O-N 3.05Å; Y122-F129 VanDerWaalsContact CA-CE2 3.45Å; Y122-F129 HydrophobicContact CD2-CB 3.98Å; Y122-F129 AromaticContact CD2-CD1 3.82Å; Y122-F129 HydrophobicContact CD2-CD1 3.82Å; Y122-F129 AromaticContact CD2-CD2 3.92Å; Y122-F129 HydrophobicContact CD2-CD2 3.92Å; Y122-F129 HydrophobicContact CD2-CE1 4.23Å; Y122-F129 HydrophobicContact CD2-CE2 4.33Å; Y122-F129 AromaticContact CD2-CG 3.65Å; Y122-F129 HydrophobicContact CD2-CG 3.65Å; Y122-F129 HydrophobicContact CD2-CZ 4.45Å; Y122-F129 HydrophobicContact CE2-CB 4.13Å; Y122-F129 HydrophobicContact CE2-CG 4.3Å
123	D	93.4	Very high	94.5	Very high	59 Å²	59	47 Å²	47	32%	0.316	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-19	-177.8	-67.8	-42.9	0	0	0	112.2	Q83 Q85 R86 D121	Q83-D123 WeakPolarHBondContact CB-OD2 3.45Å; Q85-D123 VanDerWaalsContact NE2-CG 3.35Å; Q85-D123 PolarHBondContact NE2-OD2 3.25Å; R86-D123 IonicContact CZ-OD1 3.4Å; R86-D123 IonicContact NE-OD1 2.82Å; R86-D123 PolarHBondContact NE-OD1 3.07Å; R86-D123 IonicContact NE-OD2 2.77Å; R86-D123 IonicContact NH2-OD1 3.23Å; R86-D123 PolarHBondContact NH2-OD1 3.07Å; D121-D123 VanDerWaalsContact C-N 3.26Å; D121-D123 PolarHBondContact O-N 3.35Å; D121-D123 PolarHBondContact OD1-N 2.96Å
124	E	93.6	Very high	94.4	Very high	89 Å²	89	45 Å²	45	42%	0.416	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-13.6	175.7	-64.6	-178.5	-161.4	0	0	113.5	R56 D121 Y122	R56-E124 IonicContact NH1-OE1 2.64Å; R56-E124 PolarHBondContact NH1-OE1 2.98Å; R56-E124 VanDerWaalsContact NH1-OE1 3.15Å; D121-E124 HydrophobicContact CB-CB 4.31Å; D121-E124 HydrophobicContact CB-CG 4.27Å; D121-E124 PolarHBondContact O-N 2.82Å; D121-E124 VanDerWaalsContact O-N 3.11Å; Y122-E124 VanDerWaalsContact C-N 3.28Å; Y122-E124 PolarHBondContact O-N 2.76Å
125	G	92.8	Very high	94.2	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.01	23%	0.232	C	C	.	.			trans	-154.6	39.3	-168.8	0	0	0	0	0	114.5	D121 Y122 D127 V128 F129	D121-G125 PolarHBondContact O-N 2.83Å; Y122-G125 PolarHBondContact O-N 3.37Å; G125-D127 WeakPolarHBondContact CA-OD1 3.35Å; G125-D127 PolarHBondContact O-N 3.33Å; G125-D127 VanDerWaalsContact O-N 3.15Å; G125-V128 WeakPolarHBondContact O-CB 3.25Å; G125-V128 PolarHBondContact O-N 2.95Å; G125-F129 WeakPolarHBondContact O-CD2 3.44Å; G125-F129 PolarHBondContact O-N 3.42Å
126	A	93.4	Very high	93.8	Very high	32 Å²	32	49.4 Å²	49.4	26%	0.264	26%	0.258	S	S	.	.	H	α-helix	trans	-54.8	-32.9	-178.6	0	0	0	0	0	113.2	Y122 V128 F129 Q130	Y122-A126 HydrophobicContact CE2-CB 4.31Å; Y122-A126 WeakPolarHBondContact O-CA 3.39Å; Y122-A126 WeakPolarHBondContact O-CB 3.37Å; Y122-A126 PolarHBondContact O-N 3.05Å; A126-V128 VanDerWaalsContact C-N 3.3Å; A126-V128 PolarHBondContact O-N 3.23Å; A126-F129 PolarHBondContact O-N 2.81Å; A126-Q130 WeakPolarHBondContact O-CG 3.17Å; A126-Q130 PolarHBondContact O-N 3.27Å
127	D	94.8	Very high	93.6	Very high	61 Å²	61	50.9 Å²	50.9	33%	0.326	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-36	174.3	62.6	-32.6	0	0	0	112.9	R63 G125 Q131	R63-D127 IonicContact CZ-OD2 3.77Å; R63-D127 IonicContact NH1-OD2 2.8Å; R63-D127 PolarHBondContact NH1-OD2 2.95Å; R63-D127 IonicContact NH2-OD2 3.95Å; R63-D127 PolarHBondContact NH2-OD2 3.46Å; G125-D127 WeakPolarHBondContact CA-OD1 3.35Å; G125-D127 PolarHBondContact O-N 3.33Å; G125-D127 VanDerWaalsContact O-N 3.15Å; D127-Q131 WeakPolarHBondContact O-CB 3.29Å; D127-Q131 PolarHBondContact O-N 2.64Å
128	V	94.9	Very high	93.5	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69.3	-39.6	175.8	-178.3	0	0	0	0	111.2	F62 F79 V120 G125 A126 Q131 L132	F62-V128 HydrophobicContact CB-CG2 4.13Å; F62-V128 HydrophobicContact CD1-CB 4.34Å; F62-V128 HydrophobicContact CD1-CG1 3.55Å; F62-V128 HydrophobicContact CD1-CG2 3.76Å; F62-V128 HydrophobicContact CD2-CG1 4.31Å; F62-V128 HydrophobicContact CE1-CG1 3.47Å; F62-V128 VanDerWaalsContact CE1-CG1 3.47Å; F62-V128 HydrophobicContact CE1-CG2 4.46Å; F62-V128 HydrophobicContact CE2-CG1 4.24Å; F62-V128 HydrophobicContact CG-CG1 3.99Å; F62-V128 HydrophobicContact CG-CG2 4.07Å; F62-V128 HydrophobicContact CZ-CG1 3.85Å; F79-V128 HydrophobicContact CE1-CG1 3.75Å; F79-V128 HydrophobicContact CZ-CG1 4.47Å; V120-V128 HydrophobicContact CG1-CB 4.42Å; G125-V128 WeakPolarHBondContact O-CB 3.25Å; G125-V128 PolarHBondContact O-N 2.95Å; A126-V128 VanDerWaalsContact C-N 3.3Å; A126-V128 PolarHBondContact O-N 3.23Å; V128-Q131 PolarHBondContact O-N 2.97Å; V128-L132 HydrophobicContact CG1-CD1 3.93Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; V128-L132 WeakPolarHBondContact O-CG 3.49Å; V128-L132 PolarHBondContact O-N 3.5Å
129	F	94.8	Very high	93.4	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-44.2	176.7	-80.8	-106	0	0	0	111.4	F79 V120 Y122 G125 A126 L132 N133 M134 A137	F79-F129 HydrophobicContact CB-CE1 3.93Å; F79-F129 HydrophobicContact CB-CE2 4.42Å; F79-F129 HydrophobicContact CB-CZ 3.69Å; F79-F129 HydrophobicContact CD1-CE2 4.12Å; F79-F129 HydrophobicContact CD1-CZ 4.21Å; F79-F129 HydrophobicContact CG-CZ 4.43Å; V120-F129 HydrophobicContact CG1-CE2 4.14Å; Y122-F129 VanDerWaalsContact CA-CE2 3.45Å; Y122-F129 HydrophobicContact CD2-CB 3.98Å; Y122-F129 AromaticContact CD2-CD1 3.82Å; Y122-F129 HydrophobicContact CD2-CD1 3.82Å; Y122-F129 AromaticContact CD2-CD2 3.92Å; Y122-F129 HydrophobicContact CD2-CD2 3.92Å; Y122-F129 HydrophobicContact CD2-CE1 4.23Å; Y122-F129 HydrophobicContact CD2-CE2 4.33Å; Y122-F129 AromaticContact CD2-CG 3.65Å; Y122-F129 HydrophobicContact CD2-CG 3.65Å; Y122-F129 HydrophobicContact CD2-CZ 4.45Å; Y122-F129 HydrophobicContact CE2-CB 4.13Å; Y122-F129 HydrophobicContact CE2-CG 4.3Å; G125-F129 WeakPolarHBondContact O-CD2 3.44Å; G125-F129 PolarHBondContact O-N 3.42Å; A126-F129 PolarHBondContact O-N 2.81Å; F129-L132 PolarHBondContact O-N 2.95Å; F129-N133 PolarHBondContact O-N 2.97Å; F129-M134 HydrophobicContact CD1-CB 3.98Å; F129-M134 HydrophobicContact CD1-CE 3.92Å; F129-M134 HydrophobicContact CE1-CE 4.28Å; F129-M134 HydrophobicContact CG-CE 4.07Å; F129-M134 PolarHBondContact O-N 2.88Å; F129-A137 HydrophobicContact CE1-CB 4.48Å
130	Q	93.6	Very high	93.4	Very high	145 Å²	145	52 Å²	52	68%	0.678	28%	0.277	S	S	*	.	H	α-helix	trans	-62.6	-45	174.2	-69.2	177.3	0.9	0	0	111.6	A126 L132 N133	A126-Q130 WeakPolarHBondContact O-CG 3.17Å; A126-Q130 PolarHBondContact O-N 3.27Å; Q130-L132 PolarHBondContact O-N 2.7Å; Q130-N133 PolarHBondContact O-N 2.93Å; Q130-N133 VanDerWaalsContact O-N 3.07Å
131	Q	92.3	Very high	93.4	Very high	108 Å²	108	53 Å²	53	51%	0.505	28%	0.282	S	S	.	.	H	α-helix	trans	-63.5	-29	-179.6	-165.9	-175.4	50.2	0	0	113.2	K67 D127 V128	K67-Q131 VanDerWaalsContact NZ-CD 3.28Å; D127-Q131 WeakPolarHBondContact O-CB 3.29Å; D127-Q131 PolarHBondContact O-N 2.64Å; V128-Q131 PolarHBondContact O-N 2.97Å
132	L	91.4	Very high	93.4	Very high	45 Å²	45	52.8 Å²	52.8	24%	0.236	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	3.3	178	-66.4	173.4	0	0	0	113	F62 F79 V128 F129 Q130 M134 F143	F62-L132 HydrophobicContact CZ-CD1 4.14Å; F79-L132 HydrophobicContact CE1-CD1 3.81Å; F79-L132 HydrophobicContact CE2-CD1 3.99Å; F79-L132 HydrophobicContact CZ-CD1 3.33Å; V128-L132 HydrophobicContact CG1-CD1 3.93Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; V128-L132 WeakPolarHBondContact O-CG 3.49Å; V128-L132 PolarHBondContact O-N 3.5Å; F129-L132 PolarHBondContact O-N 2.95Å; Q130-L132 PolarHBondContact O-N 2.7Å; L132-M134 VanDerWaalsContact C-N 3.29Å; L132-M134 HydrophobicContact CB-CE 3.83Å; L132-M134 HydrophobicContact CB-CG 4.01Å; L132-M134 HydrophobicContact CB-SD 4.26Å; L132-M134 HydrophobicContact CD1-CE 3.71Å; L132-M134 HydrophobicContact CD1-SD 4.47Å; L132-M134 HydrophobicContact CG-CE 4.4Å; L132-M134 PolarHBondContact O-N 3.46Å; L132-F143 HydrophobicContact CD1-CZ 4.3Å
133	N	92.5	Very high	93.5	Very high	133 Å²	133	49.2 Å²	49.2	71%	0.711	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	44.1	-177.7	-162.7	29.1	0	0	0	112.9	F129 Q130	F129-N133 PolarHBondContact O-N 2.97Å; Q130-N133 PolarHBondContact O-N 2.93Å; Q130-N133 VanDerWaalsContact O-N 3.07Å
134	M	90.6	Very high	93.6	Very high	24 Å²	24	47.5 Å²	47.5	12%	0.118	26%	0.259	C	S	.	.			trans	-98.5	117.7	179.5	-66.9	-174.8	-59.6	0	0	110.6	F79 F129 L132 T139 M141	F79-M134 HydrophobicContact CB-CE 3.96Å; F79-M134 HydrophobicContact CB-SD 4.21Å; F79-M134 HydrophobicContact CD1-CE 3.34Å; F79-M134 HydrophobicContact CD1-SD 4.39Å; F79-M134 HydrophobicContact CD2-CE 3.68Å; F79-M134 HydrophobicContact CD2-SD 3.64Å; F79-M134 HydrophobicContact CE1-CE 3.66Å; F79-M134 HydrophobicContact CE2-CE 3.95Å; F79-M134 HydrophobicContact CE2-SD 4.08Å; F79-M134 HydrophobicContact CG-CE 3.35Å; F79-M134 HydrophobicContact CG-SD 3.81Å; F79-M134 HydrophobicContact CZ-CE 3.95Å; F129-M134 HydrophobicContact CD1-CB 3.98Å; F129-M134 HydrophobicContact CD1-CE 3.92Å; F129-M134 HydrophobicContact CE1-CE 4.28Å; F129-M134 HydrophobicContact CG-CE 4.07Å; F129-M134 PolarHBondContact O-N 2.88Å; L132-M134 VanDerWaalsContact C-N 3.29Å; L132-M134 HydrophobicContact CB-CE 3.83Å; L132-M134 HydrophobicContact CB-CG 4.01Å; L132-M134 HydrophobicContact CB-SD 4.26Å; L132-M134 HydrophobicContact CD1-CE 3.71Å; L132-M134 HydrophobicContact CD1-SD 4.47Å; L132-M134 HydrophobicContact CG-CE 4.4Å; L132-M134 PolarHBondContact O-N 3.46Å; M134-T139 HydrophobicContact SD-CG2 4.35Å; M134-M141 HydrophobicContact SD-SD 4.36Å
135	N	88	Confident	93.5	Very high	152 Å²	152	44.5 Å²	44.5	81%	0.813	25%	0.25	S	C	*	.			trans	-101.3	-2.8	-179.6	-60.2	-21.1	0	0	0	113
136	S	87.4	Confident	93.3	Very high	80 Å²	80	53.2 Å²	53.2	56%	0.559	29%	0.287	S	S	*	.	S	Bend	trans	-144	151.4	-174.8	58.7	0	0	0	0	112.1
137	A	92.2	Very high	93	Very high	33 Å²	33	54.5 Å²	54.5	27%	0.273	30%	0.304	S	S	.	.	S	Bend	trans	-128.6	153.5	173.1	0	0	0	0	0	109.7	A81 F129	A81-A137 HydrophobicContact CB-CB 4.24Å; F129-A137 HydrophobicContact CE1-CB 4.48Å
138	P	95.3	Very high	92.7	Very high	7 Å²	7	60.4 Å²	60.4	5%	0.045	33%	0.327	C	S	.	.			cis	-83.4	154.5	-2.3	32.9	-32.4	0	0	0	113.2	F79 V90 A94 L157	F79-P138 CarbonylContact O-C 3.54Å; F79-P138 WeakPolarHBondContact O-CA 3.5Å; V90-P138 HydrophobicContact CG1-CG 4.05Å; A94-P138 HydrophobicContact CB-CB 4.24Å; A94-P138 HydrophobicContact CB-CG 3.71Å; P138-L157 HydrophobicContact CG-CD2 3.88Å; P138-L157 VanDerWaalsContact O-CD2 3.29Å; P138-L157 WeakPolarHBondContact O-CD2 3.33Å
139	T	95.5	Very high	92.6	Very high	26 Å²	26	62.6 Å²	62.6	16%	0.16	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	135.1	171.9	-59	0	0	0	0	109.8	F79 M134 M141 T154	F79-T139 PolarHBondContact N-O 3.46Å; F79-T139 PolarHBondContact O-N 3.27Å; M134-T139 HydrophobicContact SD-CG2 4.35Å; T139-M141 HydrophobicContact CG2-CG 4.1Å; T139-T154 HydrophobicContact CG2-CG2 4.07Å
140	F	96.8	Very high	92.5	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.1	175.5	-56.3	-88.6	0	0	0	110.4	V77 M78 A94 Y98 F155 L157 F162 L167 W170	V77-F140 WeakPolarHBondContact O-CA 3.33Å; M78-F140 HydrophobicContact CB-CD1 3.79Å; M78-F140 HydrophobicContact CB-CE1 3.73Å; M78-F140 HydrophobicContact CG-CD1 3.82Å; M78-F140 HydrophobicContact CG-CE1 3.4Å; M78-F140 VanDerWaalsContact CG-CE1 3.4Å; M78-F140 HydrophobicContact CG-CZ 4.04Å; M78-F140 HydrophobicContact SD-CD1 4.49Å; M78-F140 HydrophobicContact SD-CE1 3.52Å; M78-F140 VanDerWaalsContact SD-CE1 3.52Å; M78-F140 HydrophobicContact SD-CZ 3.88Å; A94-F140 HydrophobicContact CB-CE2 4.39Å; A94-F140 HydrophobicContact CB-CZ 4.03Å; Y98-F140 AromaticContact CD2-CD1 3.91Å; Y98-F140 HydrophobicContact CD2-CD1 3.91Å; Y98-F140 AromaticContact CD2-CE1 3.53Å; Y98-F140 HydrophobicContact CD2-CE1 3.53Å; Y98-F140 HydrophobicContact CE2-CD1 4.03Å; Y98-F140 HydrophobicContact CE2-CE1 4.1Å; Y98-F140 AromaticContact CG-CE1 3.85Å; Y98-F140 HydrophobicContact CG-CE1 3.85Å; F140-F155 HydrophobicContact CB-CB 3.86Å; F140-F155 HydrophobicContact CD2-CD1 4.04Å; F140-F155 PolarHBondContact O-N 3.22Å; F140-L157 HydrophobicContact CD2-CD1 4.39Å; F140-L157 HydrophobicContact CE2-CD1 4.02Å; F140-F162 HydrophobicContact CE2-CB 4.24Å; F140-L167 HydrophobicContact CB-CD2 4.43Å; F140-L167 HydrophobicContact CD1-CD2 4.37Å; F140-L167 HydrophobicContact CD2-CD2 4.01Å; F140-L167 HydrophobicContact CE1-CD1 4.21Å; F140-L167 HydrophobicContact CE2-CD1 4.49Å; F140-L167 HydrophobicContact CE2-CD2 4.32Å; F140-L167 HydrophobicContact CG-CD2 4.03Å; F140-L167 HydrophobicContact CZ-CD1 4.13Å; F140-W170 HydrophobicContact CB-CH2 4.49Å; F140-W170 HydrophobicContact CB-CZ3 4.34Å
141	M	96.4	Very high	92.3	Very high	22 Å²	22	74 Å²	74	11%	0.108	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.1	178.2	-62.1	-174.4	65.5	0	0	112.2	V77 F79 M134 T139 F143 P149 D153 T154	V77-M141 PolarHBondContact N-O 3.37Å; V77-M141 PolarHBondContact O-N 2.92Å; F79-M141 HydrophobicContact CD2-CG 4.33Å; F79-M141 HydrophobicContact CD2-SD 4.35Å; F79-M141 HydrophobicContact CE2-CB 4.06Å; F79-M141 HydrophobicContact CE2-CG 3.96Å; F79-M141 HydrophobicContact CE2-SD 3.75Å; M134-M141 HydrophobicContact SD-SD 4.36Å; T139-M141 HydrophobicContact CG2-CG 4.1Å; M141-F143 HydrophobicContact CB-CD2 4.45Å; M141-F143 HydrophobicContact CB-CE2 3.85Å; M141-F143 HydrophobicContact CE-CZ 4.37Å; M141-P149 HydrophobicContact CE-CB 4.35Å; M141-D153 CarbonylContact C-O 3.49Å; M141-D153 WeakPolarHBondContact CA-O 3.37Å; M141-T154 HydrophobicContact CG-CG2 4.28Å
142	H	97.3	Very high	92.2	Very high	5 Å²	5	71.3 Å²	71.3	2%	0.023	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	126.3	171.2	165.5	-122.1	0	0	0	109.8	S74 I76 D153 W170 T175	S74-H142 VanDerWaalsContact CB-NE2 3.31Å; S74-H142 WeakPolarHBondContact CB-NE2 3.29Å; S74-H142 PolarHBondContact OG-NE2 2.85Å; I76-H142 HydrophobicContact CD1-CB 3.81Å; H142-D153 HydrophobicContact CB-CB 4.09Å; H142-D153 IonicContact CE1-OD1 3.5Å; H142-D153 IonicContact CG-OD1 2.81Å; H142-D153 PolarHBondContact N-O 3.38Å; H142-D153 IonicContact ND1-OD1 3.68Å; H142-D153 PolarHBondContact ND1-OD1 2.98Å; H142-D153 WeakPolarHBondContact O-CB 3.2Å; H142-W170 HydrophobicContact CB-CH2 3.88Å; H142-W170 HydrophobicContact CB-CZ2 3.89Å; H142-T175 WeakPolarHBondContact NE2-CG2 3.26Å
143	F	96.4	Very high	92.4	Very high	6 Å²	6	69.4 Å²	69.4	3%	0.026	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	109.4	171.6	-71	-94.8	0	0	0	108.7	F62 V66 S74 V75 V77 F79 L132 M141 P149	F62-F143 HydrophobicContact CE2-CE2 4.18Å; F62-F143 HydrophobicContact CE2-CZ 4.21Å; F62-F143 HydrophobicContact CZ-CE1 4.16Å; F62-F143 HydrophobicContact CZ-CE2 4.19Å; F62-F143 AromaticContact CZ-CZ 3.75Å; F62-F143 HydrophobicContact CZ-CZ 3.75Å; V66-F143 HydrophobicContact CG1-CB 3.72Å; V66-F143 HydrophobicContact CG1-CD1 3.81Å; V66-F143 HydrophobicContact CG1-CD2 3.66Å; V66-F143 HydrophobicContact CG1-CE1 4.36Å; V66-F143 HydrophobicContact CG1-CE2 4.22Å; V66-F143 HydrophobicContact CG1-CG 3.43Å; V66-F143 VanDerWaalsContact CG1-CG 3.43Å; S74-F143 WeakPolarHBondContact CA-O 3.14Å; V75-F143 HydrophobicContact CB-CB 4.46Å; V75-F143 PolarHBondContact N-O 3.49Å; V75-F143 PolarHBondContact O-N 3.29Å; V77-F143 HydrophobicContact CB-CD2 4.29Å; V77-F143 HydrophobicContact CB-CE2 4.09Å; V77-F143 HydrophobicContact CG2-CD2 3.47Å; V77-F143 VanDerWaalsContact CG2-CD2 3.47Å; V77-F143 HydrophobicContact CG2-CE2 3.65Å; F79-F143 HydrophobicContact CE2-CE2 4.28Å; F79-F143 HydrophobicContact CZ-CE2 4.18Å; F79-F143 HydrophobicContact CZ-CZ 4.34Å; L132-F143 HydrophobicContact CD1-CZ 4.3Å; M141-F143 HydrophobicContact CB-CD2 4.45Å; M141-F143 HydrophobicContact CB-CE2 3.85Å; M141-F143 HydrophobicContact CE-CZ 4.37Å; F143-P149 HydrophobicContact CD1-CG 3.44Å; F143-P149 VanDerWaalsContact CD1-CG 3.44Å; F143-P149 HydrophobicContact CE1-CG 3.53Å; F143-P149 HydrophobicContact CG-CG 4.14Å; F143-P149 HydrophobicContact CZ-CG 4.3Å
144	P	95.3	Very high	92.5	Very high	22 Å²	22	65.9 Å²	65.9	14%	0.143	35%	0.351	C	S	.	.			trans	-68.4	156.9	179.6	28	-34.4	0	0	0	111.4	R71 K146	R71-P144 PolarHBondContact NH2-O 2.8Å; R71-P144 VanDerWaalsContact NH2-O 3.07Å; P144-K146 WeakPolarHBondContact CG-O 3.48Å; P144-K146 PolarHBondContact O-N 3.4Å
145	A	91.1	Very high	92.7	Very high	27 Å²	27	65.2 Å²	65.2	22%	0.223	35%	0.348	C	S	.	.	S	Bend	trans	-56.4	-34.7	175.2	0	0	0	0	0	112.5	Y73	Y73-A145 VanDerWaalsContact O-CA 3.32Å; Y73-A145 WeakPolarHBondContact O-CA 3.35Å
146	K	88.6	Confident	92.9	Very high	183 Å²	183	61.1 Å²	61.1	80%	0.796	33%	0.326	S	S	*	.	S	Bend	trans	-127.2	138.4	179.7	-63.3	-179	-178.6	177.2	0	110.8	P144	P144-K146 WeakPolarHBondContact CG-O 3.48Å; P144-K146 PolarHBondContact O-N 3.4Å
147	G	88.1	Confident	93	Very high	59 Å²	59	58.9 Å²	58.9	61%	0.608	31%	0.307	S	S	*	.	S	Bend	trans	83.5	-171.7	176.7	0	0	0	0	0	114.4
148	K	88.8	Confident	92.7	Very high	186 Å²	186	66.4 Å²	66.4	81%	0.809	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-94	152.6	176	-64.8	-178.4	-178.2	178.5	0	109.9	K150	K148-K150 PolarHBondContact O-N 2.81Å
149	P	91.3	Very high	92.4	Very high	46 Å²	46	75 Å²	75	30%	0.299	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-55.4	136.6	171.1	-23.1	33.2	0	0	0	111.6	M141 F143 D153	M141-P149 HydrophobicContact CE-CB 4.35Å; F143-P149 HydrophobicContact CD1-CG 3.44Å; F143-P149 VanDerWaalsContact CD1-CG 3.44Å; F143-P149 HydrophobicContact CE1-CG 3.53Å; F143-P149 HydrophobicContact CG-CG 4.14Å; F143-P149 HydrophobicContact CZ-CG 4.3Å; P149-D153 HydrophobicContact CB-CB 3.97Å
150	K	93.1	Very high	92.1	Very high	152 Å²	152	76.7 Å²	76.7	66%	0.661	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-86.9	169.9	171.2	-60	-179.2	178.4	-179.6	0	109.7	K148 A152 D153	K148-K150 PolarHBondContact O-N 2.81Å; K150-A152 VanDerWaalsContact C-N 3.25Å; K150-A152 PolarHBondContact O-N 3.47Å; K150-D153 WeakPolarHBondContact CB-OD2 3.45Å; K150-D153 PolarHBondContact N-OD2 2.96Å; K150-D153 WeakPolarHBondContact O-CA 3.48Å; K150-D153 VanDerWaalsContact O-CB 3.27Å; K150-D153 WeakPolarHBondContact O-CB 3.21Å; K150-D153 PolarHBondContact O-N 3.48Å
151	R	89.1	Confident	91.8	Very high	239 Å²	239	77.9 Å²	77.9	90%	0.902	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-57.2	-36.8	178	-170.2	175.1	176.9	169.7	-0.8	113.4	D153 T154	R151-D153 PolarHBondContact O-N 3.34Å; R151-T154 PolarHBondContact O-N 2.93Å
152	A	92	Very high	91.6	Very high	51 Å²	51	79.2 Å²	79.2	42%	0.421	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-74.1	-9.9	176.4	0	0	0	0	0	114	K150 W170 R174	K150-A152 VanDerWaalsContact C-N 3.25Å; K150-A152 PolarHBondContact O-N 3.47Å; A152-W170 PolarHBondContact O-NE1 3.23Å; A152-R174 WeakPolarHBondContact O-CD 3.27Å; A152-R174 PolarHBondContact O-NE 2.56Å
153	D	94.7	Very high	91.4	Very high	4 Å²	4	80.7 Å²	80.7	2%	0.021	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-83.4	0.8	172	-64.3	-49.2	0	0	0	112.6	M141 H142 P149 K150 R151 W170 R174	M141-D153 CarbonylContact C-O 3.49Å; M141-D153 WeakPolarHBondContact CA-O 3.37Å; H142-D153 HydrophobicContact CB-CB 4.09Å; H142-D153 IonicContact CE1-OD1 3.5Å; H142-D153 IonicContact CG-OD1 2.81Å; H142-D153 PolarHBondContact N-O 3.38Å; H142-D153 IonicContact ND1-OD1 3.68Å; H142-D153 PolarHBondContact ND1-OD1 2.98Å; H142-D153 WeakPolarHBondContact O-CB 3.2Å; P149-D153 HydrophobicContact CB-CB 3.97Å; K150-D153 WeakPolarHBondContact CB-OD2 3.45Å; K150-D153 PolarHBondContact N-OD2 2.96Å; K150-D153 WeakPolarHBondContact O-CA 3.48Å; K150-D153 VanDerWaalsContact O-CB 3.27Å; K150-D153 WeakPolarHBondContact O-CB 3.21Å; K150-D153 PolarHBondContact O-N 3.48Å; R151-D153 PolarHBondContact O-N 3.34Å; D153-W170 WeakPolarHBondContact O-CZ2 3.22Å; D153-R174 IonicContact OD1-CZ 3.17Å; D153-R174 IonicContact OD1-NE 2.7Å; D153-R174 PolarHBondContact OD1-NE 3.07Å; D153-R174 IonicContact OD1-NH2 2.81Å; D153-R174 PolarHBondContact OD1-NH2 3.4Å; D153-R174 IonicContact OD2-NH2 3.03Å; D153-R174 PolarHBondContact OD2-NH2 2.85Å
154	T	94.9	Very high	91.3	Very high	60 Å²	60	80.4 Å²	80.4	37%	0.368	41%	0.405	S	S	.	.	B	Isolated β-bridge	trans	-103	124.8	164.7	-57.6	0	0	0	0	108.4	T139 M141 R151	T139-T154 HydrophobicContact CG2-CG2 4.07Å; M141-T154 HydrophobicContact CG-CG2 4.28Å; R151-T154 PolarHBondContact O-N 2.93Å
155	F	95.1	Very high	91.2	Very high	10 Å²	10	83 Å²	83	4%	0.044	42%	0.416	C	S	.	.			trans	-74.9	134	-179.6	-177.4	-106.6	0	0	0	111.4	F140 L157 I160 G161 Q166 L167 W170	F140-F155 HydrophobicContact CB-CB 3.86Å; F140-F155 HydrophobicContact CD2-CD1 4.04Å; F140-F155 PolarHBondContact O-N 3.22Å; F155-L157 VanDerWaalsContact C-N 3.34Å; F155-L157 HydrophobicContact CD1-CB 4.43Å; F155-L157 HydrophobicContact CE1-CD1 4.35Å; F155-L157 PolarHBondContact O-N 2.89Å; F155-I160 HydrophobicContact CE2-CB 4.47Å; F155-I160 HydrophobicContact CE2-CD1 4.04Å; F155-I160 HydrophobicContact CE2-CG2 4.29Å; F155-I160 HydrophobicContact CZ-CB 3.96Å; F155-I160 HydrophobicContact CZ-CD1 4.36Å; F155-I160 HydrophobicContact CZ-CG2 3.86Å; F155-G161 WeakPolarHBondContact CE1-O 3.3Å; F155-G161 WeakPolarHBondContact CZ-O 3.37Å; F155-Q166 HydrophobicContact CZ-CB 4.39Å; F155-L167 HydrophobicContact CD1-CD2 3.71Å; F155-L167 HydrophobicContact CD2-CD2 4.1Å; F155-L167 HydrophobicContact CE1-CD2 3.64Å; F155-L167 HydrophobicContact CE1-CG 4.5Å; F155-L167 HydrophobicContact CE2-CD2 4.04Å; F155-L167 HydrophobicContact CG-CD2 3.93Å; F155-L167 HydrophobicContact CZ-CD2 3.81Å; F155-L167 HydrophobicContact CZ-CG 4.43Å; F155-W170 HydrophobicContact CB-CD2 4.09Å; F155-W170 HydrophobicContact CB-CE3 4.2Å; F155-W170 HydrophobicContact CB-CH2 4.24Å; F155-W170 HydrophobicContact CB-CZ2 4.12Å; F155-W170 HydrophobicContact CB-CZ3 4.28Å; F155-W170 HydrophobicContact CD2-CB 3.77Å; F155-W170 AromaticContact CD2-CD2 3.65Å; F155-W170 HydrophobicContact CD2-CD2 3.65Å; F155-W170 AromaticContact CD2-CE3 3.97Å; F155-W170 HydrophobicContact CD2-CE3 3.97Å; F155-W170 AromaticContact CD2-CG 3.55Å; F155-W170 HydrophobicContact CD2-CG 3.55Å; F155-W170 HydrophobicContact CE2-CB 3.88Å; F155-W170 HydrophobicContact CE2-CG 4.18Å; F155-W170 HydrophobicContact CG-CD2 4.28Å; F155-W170 HydrophobicContact CG-CE3 4.36Å
156	D	91.4	Very high	91.4	Very high	66 Å²	66	85.8 Å²	85.8	35%	0.353	42%	0.424	S	S	.	.			trans	-82.6	78.8	179.7	-175.4	2.3	0	0	0	111.1	Q158 R159 I160	D156-Q158 VanDerWaalsContact C-N 3.31Å; D156-Q158 PolarHBondContact O-N 2.95Å; D156-R159 WeakPolarHBondContact OD1-CB 3.39Å; D156-R159 PolarHBondContact OD1-N 3.07Å; D156-R159 WeakPolarHBondContact OD2-CB 3.4Å; D156-R159 IonicContact OD2-CZ 3.69Å; D156-R159 IonicContact OD2-NE 2.75Å; D156-R159 PolarHBondContact OD2-NE 3.29Å; D156-I160 HydrophobicContact CB-CD1 4.15Å; D156-I160 HydrophobicContact CB-CG1 4.48Å; D156-I160 WeakPolarHBondContact O-CB 3.28Å; D156-I160 WeakPolarHBondContact O-CG1 3.45Å; D156-I160 PolarHBondContact O-N 2.68Å; D156-I160 VanDerWaalsContact O-N 3.13Å
157	L	90.1	Very high	91.7	Very high	33 Å²	33	77.1 Å²	77.1	17%	0.173	39%	0.386	C	S	.	.	H	α-helix	trans	-58.9	-40.3	-177.6	-175.4	69.6	0	0	0	112.9	P138 F140 F155 R159 G161 F162	P138-L157 HydrophobicContact CG-CD2 3.88Å; P138-L157 VanDerWaalsContact O-CD2 3.29Å; P138-L157 WeakPolarHBondContact O-CD2 3.33Å; F140-L157 HydrophobicContact CD2-CD1 4.39Å; F140-L157 HydrophobicContact CE2-CD1 4.02Å; F155-L157 VanDerWaalsContact C-N 3.34Å; F155-L157 HydrophobicContact CD1-CB 4.43Å; F155-L157 HydrophobicContact CE1-CD1 4.35Å; F155-L157 PolarHBondContact O-N 2.89Å; L157-R159 PolarHBondContact O-N 3.12Å; L157-G161 WeakPolarHBondContact O-CA 3.12Å; L157-G161 PolarHBondContact O-N 3.44Å; L157-F162 HydrophobicContact CD1-CB 3.55Å; L157-F162 HydrophobicContact CD1-CD1 3.63Å; L157-F162 HydrophobicContact CD1-CG 4.06Å; L157-F162 HydrophobicContact CG-CD1 4.48Å
158	Q	85.8	Confident	92.1	Very high	191 Å²	191	74.7 Å²	74.7	89%	0.893	36%	0.36	S	S	*	.	H	α-helix	trans	-69.8	-35	-171.9	-68.5	175.8	-14.3	0	0	111.9	D156	D156-Q158 VanDerWaalsContact C-N 3.31Å; D156-Q158 PolarHBondContact O-N 2.95Å
159	R	88	Confident	92.4	Very high	188 Å²	188	72 Å²	72	71%	0.709	35%	0.349	S	S	*	.	H	α-helix	trans	-89.1	-38.5	-178.6	-168.7	178.7	65.4	93.8	3.5	113.4	D156 L157	D156-R159 WeakPolarHBondContact OD1-CB 3.39Å; D156-R159 PolarHBondContact OD1-N 3.07Å; D156-R159 WeakPolarHBondContact OD2-CB 3.4Å; D156-R159 IonicContact OD2-CZ 3.69Å; D156-R159 IonicContact OD2-NE 2.75Å; D156-R159 PolarHBondContact OD2-NE 3.29Å; L157-R159 PolarHBondContact O-N 3.12Å
160	I	89.7	Confident	92.6	Very high	61 Å²	61	71 Å²	71	31%	0.313	34%	0.339	S	S	.	.	H	α-helix	trans	-97.7	-28.5	-169.6	-54.1	172.7	0	0	0	111.7	F155 D156 Q166	F155-I160 HydrophobicContact CE2-CB 4.47Å; F155-I160 HydrophobicContact CE2-CD1 4.04Å; F155-I160 HydrophobicContact CE2-CG2 4.29Å; F155-I160 HydrophobicContact CZ-CB 3.96Å; F155-I160 HydrophobicContact CZ-CD1 4.36Å; F155-I160 HydrophobicContact CZ-CG2 3.86Å; D156-I160 HydrophobicContact CB-CD1 4.15Å; D156-I160 HydrophobicContact CB-CG1 4.48Å; D156-I160 WeakPolarHBondContact O-CB 3.28Å; D156-I160 WeakPolarHBondContact O-CG1 3.45Å; D156-I160 PolarHBondContact O-N 2.68Å; D156-I160 VanDerWaalsContact O-N 3.13Å; I160-Q166 HydrophobicContact CG2-CB 3.75Å; I160-Q166 HydrophobicContact CG2-CG 3.9Å
161	G	90.7	Very high	92.8	Very high	25 Å²	25	63.9 Å²	63.9	26%	0.258	31%	0.308	S	S	.	.			trans	78.5	176.5	-167.3	0	0	0	0	0	112.4	F155 L157	F155-G161 WeakPolarHBondContact CE1-O 3.3Å; F155-G161 WeakPolarHBondContact CZ-O 3.37Å; L157-G161 WeakPolarHBondContact O-CA 3.12Å; L157-G161 PolarHBondContact O-N 3.44Å
162	F	92.4	Very high	93	Very high	49 Å²	49	53.5 Å²	53.5	22%	0.215	27%	0.273	C	S	.	.			trans	-110.1	26	-170.8	43.6	-91.7	0	0	0	114	V90 Q93 A94 E97 F140 L157 S164	V90-F162 HydrophobicContact CG1-CE1 3.97Å; Q93-F162 HydrophobicContact CB-CE2 3.75Å; Q93-F162 HydrophobicContact CB-CZ 4.06Å; A94-F162 HydrophobicContact CB-CB 4.23Å; A94-F162 HydrophobicContact CB-CD2 4.12Å; A94-F162 HydrophobicContact CB-CG 4.04Å; E97-F162 WeakPolarHBondContact CB-O 3.21Å; E97-F162 HydrophobicContact CG-CD2 4.22Å; E97-F162 WeakPolarHBondContact CG-O 3.41Å; F140-F162 HydrophobicContact CE2-CB 4.24Å; L157-F162 HydrophobicContact CD1-CB 3.55Å; L157-F162 HydrophobicContact CD1-CD1 3.63Å; L157-F162 HydrophobicContact CD1-CG 4.06Å; L157-F162 HydrophobicContact CG-CD1 4.48Å; F162-S164 PolarHBondContact O-N 3.24Å
163	A	93.4	Very high	93.2	Very high	36 Å²	36	56.7 Å²	56.7	30%	0.298	28%	0.283	S	S	.	.			trans	-61.7	137	174.8	0	0	0	0	0	110.8	E165 Q166 L167	A163-E165 PolarHBondContact O-N 3.06Å; A163-E165 VanDerWaalsContact O-N 3.16Å; A163-Q166 HydrophobicContact CB-CG 4.19Å; A163-Q166 WeakPolarHBondContact O-CB 3.4Å; A163-Q166 PolarHBondContact O-N 2.92Å; A163-L167 PolarHBondContact O-N 2.04Å
164	S	93.5	Very high	93.1	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-51.6	-39.3	-178.3	-59.4	0	0	0	0	112.7	E97 F162 L167 A168	E97-S164 WeakPolarHBondContact CA-OG 3.1Å; E97-S164 PolarHBondContact O-OG 3.16Å; E97-S164 WeakPolarHBondContact OE2-CB 3.31Å; E97-S164 PolarHBondContact OE2-N 2.97Å; E97-S164 PolarHBondContact OE2-OG 2.68Å; F162-S164 PolarHBondContact O-N 3.24Å; S164-L167 PolarHBondContact O-N 2.86Å; S164-A168 WeakPolarHBondContact O-CB 3.07Å; S164-A168 PolarHBondContact O-N 2.99Å
165	E	93.7	Very high	93	Very high	78 Å²	78	58.8 Å²	58.8	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-67.9	-36.4	-179.9	-61.2	79.3	-176	0	0	112	A163 A168 K169 V181 R183	A163-E165 PolarHBondContact O-N 3.06Å; A163-E165 VanDerWaalsContact O-N 3.16Å; E165-A168 PolarHBondContact O-N 3.42Å; E165-K169 WeakPolarHBondContact O-CB 3.38Å; E165-K169 PolarHBondContact O-N 3.33Å; E165-V181 HydrophobicContact CG-CB 4.32Å; E165-V181 HydrophobicContact CG-CG2 4.39Å; E165-R183 VanDerWaalsContact CD-NH2 3.33Å; E165-R183 IonicContact OE1-CZ 2.83Å; E165-R183 IonicContact OE1-NE 3.6Å; E165-R183 PolarHBondContact OE1-NE 3.25Å; E165-R183 IonicContact OE1-NH2 3.94Å; E165-R183 PolarHBondContact OE1-NH2 3.01Å; E165-R183 VanDerWaalsContact OE1-NH2 3.09Å; E165-R183 IonicContact OE2-CZ 2.68Å; E165-R183 IonicContact OE2-NE 3.72Å; E165-R183 IonicContact OE2-NH2 3.72Å; E165-R183 PolarHBondContact OE2-NH2 3.41Å
166	Q	95.2	Very high	92.9	Very high	84 Å²	84	65.4 Å²	65.4	39%	0.393	32%	0.323	S	S	.	.	H	α-helix	trans	-72.2	-40.1	176.8	-61.5	-58.9	-31.9	0	0	111.1	F155 I160 A163 A168 K169 W170	F155-Q166 HydrophobicContact CZ-CB 4.39Å; I160-Q166 HydrophobicContact CG2-CB 3.75Å; I160-Q166 HydrophobicContact CG2-CG 3.9Å; A163-Q166 HydrophobicContact CB-CG 4.19Å; A163-Q166 WeakPolarHBondContact O-CB 3.4Å; A163-Q166 PolarHBondContact O-N 2.92Å; Q166-A168 VanDerWaalsContact C-N 3.34Å; Q166-K169 PolarHBondContact O-N 3.15Å; Q166-W170 WeakPolarHBondContact O-CB 3.46Å; Q166-W170 PolarHBondContact O-N 2.97Å
167	L	95.8	Very high	92.9	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-62.4	-42.5	172.5	-70.1	173.6	0	0	0	111.2	L101 F140 F155 A163 S164 W170 I171	L101-L167 HydrophobicContact CD2-CB 3.64Å; L101-L167 HydrophobicContact CD2-CD1 4.29Å; F140-L167 HydrophobicContact CB-CD2 4.43Å; F140-L167 HydrophobicContact CD1-CD2 4.37Å; F140-L167 HydrophobicContact CD2-CD2 4.01Å; F140-L167 HydrophobicContact CE1-CD1 4.21Å; F140-L167 HydrophobicContact CE2-CD1 4.49Å; F140-L167 HydrophobicContact CE2-CD2 4.32Å; F140-L167 HydrophobicContact CG-CD2 4.03Å; F140-L167 HydrophobicContact CZ-CD1 4.13Å; F155-L167 HydrophobicContact CD1-CD2 3.71Å; F155-L167 HydrophobicContact CD2-CD2 4.1Å; F155-L167 HydrophobicContact CE1-CD2 3.64Å; F155-L167 HydrophobicContact CE1-CG 4.5Å; F155-L167 HydrophobicContact CE2-CD2 4.04Å; F155-L167 HydrophobicContact CG-CD2 3.93Å; F155-L167 HydrophobicContact CZ-CD2 3.81Å; F155-L167 HydrophobicContact CZ-CG 4.43Å; A163-L167 PolarHBondContact O-N 2.04Å; S164-L167 PolarHBondContact O-N 2.86Å; L167-W170 HydrophobicContact CD2-CE3 4.46Å; L167-W170 PolarHBondContact O-N 3.41Å; L167-I171 WeakPolarHBondContact O-CB 3.5Å; L167-I171 WeakPolarHBondContact O-CD1 3.17Å; L167-I171 VanDerWaalsContact O-CG1 3.26Å; L167-I171 WeakPolarHBondContact O-CG1 3.34Å; L167-I171 PolarHBondContact O-N 2.89Å
168	A	95.4	Very high	93	Very high	7 Å²	7	68.9 Å²	68.9	6%	0.058	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-44	175.7	0	0	0	0	0	112	L101 S164 E165 Q166 I171 A172 I179 V181	L101-A168 HydrophobicContact CD1-CB 3.71Å; S164-A168 WeakPolarHBondContact O-CB 3.07Å; S164-A168 PolarHBondContact O-N 2.99Å; E165-A168 PolarHBondContact O-N 3.42Å; Q166-A168 VanDerWaalsContact C-N 3.34Å; A168-I171 PolarHBondContact O-N 3.2Å; A168-A172 PolarHBondContact O-N 3.4Å; A168-I179 HydrophobicContact CB-CB 4.3Å; A168-V181 HydrophobicContact CB-CG2 3.83Å
169	K	95.4	Very high	93.4	Very high	131 Å²	131	60.5 Å²	60.5	57%	0.57	30%	0.299	S	S	*	.	H	α-helix	trans	-62.2	-47	176.6	-174.3	176.8	179.8	178.7	0	111.7	E165 Q166 I171 A172 D173	E165-K169 WeakPolarHBondContact O-CB 3.38Å; E165-K169 PolarHBondContact O-N 3.33Å; Q166-K169 PolarHBondContact O-N 3.15Å; K169-I171 VanDerWaalsContact C-N 3.34Å; K169-I171 PolarHBondContact O-N 3.11Å; K169-A172 WeakPolarHBondContact O-CB 3.48Å; K169-A172 PolarHBondContact O-N 2.96Å; K169-D173 VanDerWaalsContact O-CG 3.31Å; K169-D173 PolarHBondContact O-N 3.36Å
170	W	96.2	Very high	93.6	Very high	25 Å²	25	61.8 Å²	61.8	10%	0.095	30%	0.304	C	S	.	.	H	α-helix	trans	-60.1	-43.4	175.3	167	70.7	0	0	0	111.9	I76 F140 H142 A152 D153 F155 Q166 L167 A172 D173 R174	I76-W170 HydrophobicContact CG2-CZ3 4.14Å; F140-W170 HydrophobicContact CB-CH2 4.49Å; F140-W170 HydrophobicContact CB-CZ3 4.34Å; H142-W170 HydrophobicContact CB-CH2 3.88Å; H142-W170 HydrophobicContact CB-CZ2 3.89Å; A152-W170 PolarHBondContact O-NE1 3.23Å; D153-W170 WeakPolarHBondContact O-CZ2 3.22Å; F155-W170 HydrophobicContact CB-CD2 4.09Å; F155-W170 HydrophobicContact CB-CE3 4.2Å; F155-W170 HydrophobicContact CB-CH2 4.24Å; F155-W170 HydrophobicContact CB-CZ2 4.12Å; F155-W170 HydrophobicContact CB-CZ3 4.28Å; F155-W170 HydrophobicContact CD2-CB 3.77Å; F155-W170 AromaticContact CD2-CD2 3.65Å; F155-W170 HydrophobicContact CD2-CD2 3.65Å; F155-W170 AromaticContact CD2-CE3 3.97Å; F155-W170 HydrophobicContact CD2-CE3 3.97Å; F155-W170 AromaticContact CD2-CG 3.55Å; F155-W170 HydrophobicContact CD2-CG 3.55Å; F155-W170 HydrophobicContact CE2-CB 3.88Å; F155-W170 HydrophobicContact CE2-CG 4.18Å; F155-W170 HydrophobicContact CG-CD2 4.28Å; F155-W170 HydrophobicContact CG-CE3 4.36Å; Q166-W170 WeakPolarHBondContact O-CB 3.46Å; Q166-W170 PolarHBondContact O-N 2.97Å; L167-W170 HydrophobicContact CD2-CE3 4.46Å; L167-W170 PolarHBondContact O-N 3.41Å; W170-A172 VanDerWaalsContact C-N 3.31Å; W170-A172 PolarHBondContact O-N 3.5Å; W170-D173 PolarHBondContact O-N 3.23Å; W170-R174 HydrophobicContact CZ2-CG 4.47Å; W170-R174 VanDerWaalsContact O-CG 3.3Å; W170-R174 WeakPolarHBondContact O-CG 3.43Å; W170-R174 PolarHBondContact O-N 3.04Å
171	I	95.6	Very high	93.7	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-41.5	175.8	-71.6	159.9	0	0	0	111.1	I76 L101 L115 F117 L167 A168 K169 D173 R174 T175 I179	I76-I171 HydrophobicContact CD1-CD1 4.47Å; I76-I171 HydrophobicContact CD1-CG1 3.94Å; I76-I171 HydrophobicContact CG1-CD1 4.08Å; I76-I171 HydrophobicContact CG1-CG1 4.09Å; I76-I171 HydrophobicContact CG2-CD1 4.37Å; L101-I171 HydrophobicContact CD2-CD1 3.74Å; L115-I171 HydrophobicContact CD2-CG2 3.91Å; F117-I171 HydrophobicContact CE1-CD1 3.68Å; F117-I171 HydrophobicContact CZ-CD1 3.92Å; L167-I171 WeakPolarHBondContact O-CB 3.5Å; L167-I171 WeakPolarHBondContact O-CD1 3.17Å; L167-I171 VanDerWaalsContact O-CG1 3.26Å; L167-I171 WeakPolarHBondContact O-CG1 3.34Å; L167-I171 PolarHBondContact O-N 2.89Å; A168-I171 PolarHBondContact O-N 3.2Å; K169-I171 VanDerWaalsContact C-N 3.34Å; K169-I171 PolarHBondContact O-N 3.11Å; I171-D173 VanDerWaalsContact C-N 3.35Å; I171-D173 PolarHBondContact O-N 3.43Å; I171-R174 PolarHBondContact O-N 3.23Å; I171-T175 HydrophobicContact CG2-CG2 4.42Å; I171-T175 WeakPolarHBondContact CG2-OG1 3.35Å; I171-T175 WeakPolarHBondContact O-CB 3.44Å; I171-T175 PolarHBondContact O-N 3.05Å; I171-T175 PolarHBondContact O-OG1 3.43Å; I171-I179 HydrophobicContact CD1-CD1 4.48Å; I171-I179 HydrophobicContact CG2-CD1 4.08Å
172	A	95.1	Very high	93.5	Very high	22 Å²	22	66.8 Å²	66.8	18%	0.182	32%	0.32	C	S	.	.	H	α-helix	trans	-60.2	-45.5	175.4	0	0	0	0	0	111.1	A168 K169 W170 R174 T175 D176 V177 Q178	A168-A172 PolarHBondContact O-N 3.4Å; K169-A172 WeakPolarHBondContact O-CB 3.48Å; K169-A172 PolarHBondContact O-N 2.96Å; W170-A172 VanDerWaalsContact C-N 3.31Å; W170-A172 PolarHBondContact O-N 3.5Å; A172-R174 PolarHBondContact O-N 3.45Å; A172-T175 PolarHBondContact O-N 3.14Å; A172-D176 VanDerWaalsContact O-CA 3.26Å; A172-D176 WeakPolarHBondContact O-CA 3.23Å; A172-D176 PolarHBondContact O-N 2.98Å; A172-V177 WeakPolarHBondContact CA-O 3.31Å; A172-Q178 HydrophobicContact CB-CG 4.35Å
173	D	94.9	Very high	93.1	Very high	118 Å²	118	69.6 Å²	69.6	63%	0.631	33%	0.329	S	S	*	.	H	α-helix	trans	-62.8	-27.5	177.5	-64.2	-22.1	0	0	0	113.1	K169 W170 I171	K169-D173 VanDerWaalsContact O-CG 3.31Å; K169-D173 PolarHBondContact O-N 3.36Å; W170-D173 PolarHBondContact O-N 3.23Å; I171-D173 VanDerWaalsContact C-N 3.35Å; I171-D173 PolarHBondContact O-N 3.43Å
174	R	93.8	Very high	92.4	Very high	78 Å²	78	72 Å²	72	29%	0.294	34%	0.341	S	S	.	.	H	α-helix	trans	-94.3	-30.3	-178.6	-60.2	-45.9	-66.3	165.1	-2.6	114.5	A152 D153 W170 I171 A172	A152-R174 WeakPolarHBondContact O-CD 3.27Å; A152-R174 PolarHBondContact O-NE 2.56Å; D153-R174 IonicContact OD1-CZ 3.17Å; D153-R174 IonicContact OD1-NE 2.7Å; D153-R174 PolarHBondContact OD1-NE 3.07Å; D153-R174 IonicContact OD1-NH2 2.81Å; D153-R174 PolarHBondContact OD1-NH2 3.4Å; D153-R174 IonicContact OD2-NH2 3.03Å; D153-R174 PolarHBondContact OD2-NH2 2.85Å; W170-R174 HydrophobicContact CZ2-CG 4.47Å; W170-R174 VanDerWaalsContact O-CG 3.3Å; W170-R174 WeakPolarHBondContact O-CG 3.43Å; W170-R174 PolarHBondContact O-N 3.04Å; I171-R174 PolarHBondContact O-N 3.23Å; A172-R174 PolarHBondContact O-N 3.45Å
175	T	92.5	Very high	91.3	Very high	29 Å²	29	75.3 Å²	75.3	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-124	-7.2	-168.1	66.6	0	0	0	0	114.1	L115 H142 I171 A172 V177	L115-T175 HydrophobicContact CD1-CG2 4.25Å; H142-T175 WeakPolarHBondContact NE2-CG2 3.26Å; I171-T175 HydrophobicContact CG2-CG2 4.42Å; I171-T175 WeakPolarHBondContact CG2-OG1 3.35Å; I171-T175 WeakPolarHBondContact O-CB 3.44Å; I171-T175 PolarHBondContact O-N 3.05Å; I171-T175 PolarHBondContact O-OG1 3.43Å; A172-T175 PolarHBondContact O-N 3.14Å; T175-V177 PolarHBondContact O-N 3.26Å; T175-V177 WeakPolarHBondContact OG1-CB 3.43Å; T175-V177 PolarHBondContact OG1-N 3.38Å
176	D	92.4	Very high	90.4	Very high	149 Å²	149	77.4 Å²	77.4	80%	0.797	38%	0.377	S	S	*	.	S	Bend	trans	61.3	13.3	-172.4	-158	38.4	0	0	0	113.8	A172	A172-D176 VanDerWaalsContact O-CA 3.26Å; A172-D176 WeakPolarHBondContact O-CA 3.23Å; A172-D176 PolarHBondContact O-N 2.98Å
177	V	92.1	Very high	89.5	Confident	27 Å²	27	80.5 Å²	80.5	16%	0.164	39%	0.386	C	S	.	.			trans	-96.8	112.5	177.1	-180	0	0	0	0	109.6	W105 L115 A172 T175 I179	W105-V177 HydrophobicContact CE3-CG1 4.17Å; W105-V177 HydrophobicContact CH2-CG1 3.37Å; W105-V177 HydrophobicContact CZ2-CG1 4.27Å; W105-V177 HydrophobicContact CZ3-CG1 3.32Å; L115-V177 HydrophobicContact CD2-CB 4.24Å; L115-V177 HydrophobicContact CD2-CG1 3.98Å; A172-V177 WeakPolarHBondContact CA-O 3.31Å; T175-V177 PolarHBondContact O-N 3.26Å; T175-V177 WeakPolarHBondContact OG1-CB 3.43Å; T175-V177 PolarHBondContact OG1-N 3.38Å; V177-I179 HydrophobicContact CG1-CG1 4.21Å
178	Q	92.1	Very high	88.7	Confident	146 Å²	146	83.8 Å²	83.8	68%	0.682	41%	0.409	S	S	*	.			trans	-86.2	118.2	176.7	-63.8	-172	0.7	0	0	111.3	A172	A172-Q178 HydrophobicContact CB-CG 4.35Å
179	I	93.4	Very high	88	Confident	14 Å²	14	85.6 Å²	85.6	7%	0.072	43%	0.429	C	S	.	.			trans	-108.1	118.8	178.5	-53	173.7	0	0	0	108.7	L101 W105 L115 F117 A168 I171 V177	L101-I179 HydrophobicContact CD1-CB 4.4Å; L101-I179 HydrophobicContact CD1-CD1 4.32Å; L101-I179 HydrophobicContact CD1-CG2 4Å; W105-I179 HydrophobicContact CB-CD1 4.27Å; W105-I179 HydrophobicContact CB-CG2 4.23Å; W105-I179 HydrophobicContact CD2-CD1 4.41Å; W105-I179 HydrophobicContact CD2-CG1 4.49Å; W105-I179 HydrophobicContact CE3-CD1 4.22Å; W105-I179 HydrophobicContact CE3-CG1 3.82Å; W105-I179 HydrophobicContact CG-CD1 4.48Å; W105-I179 HydrophobicContact CZ3-CG1 4.36Å; L115-I179 HydrophobicContact CD2-CD1 3.95Å; F117-I179 HydrophobicContact CE2-CD1 4.11Å; F117-I179 HydrophobicContact CZ-CD1 3.59Å; A168-I179 HydrophobicContact CB-CB 4.3Å; I171-I179 HydrophobicContact CD1-CD1 4.48Å; I171-I179 HydrophobicContact CG2-CD1 4.08Å; V177-I179 HydrophobicContact CG1-CG1 4.21Å
180	R	91.6	Very high	87.4	Confident	215 Å²	215	83.3 Å²	83.3	81%	0.811	43%	0.425	S	S	*	.			trans	-84.3	115.7	171	-65.8	-175.4	-178.8	-171.5	0.5	108.7	S104	S104-R180 WeakPolarHBondContact CB-O 3.02Å
181	V	92.1	Very high	87	Confident	35 Å²	35	86.8 Å²	86.8	21%	0.212	45%	0.445	C	S	.	.			trans	-76.5	126.1	-178.9	-179.1	0	0	0	0	109.9	V100 L101 E165 A168 R183	V100-V181 HydrophobicContact CG1-CG1 3.87Å; L101-V181 HydrophobicContact CD1-CG2 4.07Å; E165-V181 HydrophobicContact CG-CB 4.32Å; E165-V181 HydrophobicContact CG-CG2 4.39Å; A168-V181 HydrophobicContact CB-CG2 3.83Å; V181-R183 HydrophobicContact CG1-CG 4.44Å
182	F	87.9	Confident	86.6	Confident	156 Å²	156	89.5 Å²	89.5	68%	0.684	47%	0.468	S	S	*	.			trans	-114.8	114	172.1	-170.2	-92.5	0	0	0	109.3	S104	S104-F182 PolarHBondContact OG-N 3.31Å; S104-F182 PolarHBondContact OG-O 3.15Å
183	R	83.9	Confident	86.2	Confident	109 Å²	109	93.8 Å²	93.8	41%	0.411	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-83.7	121.8	178.5	-67.9	178.6	176.1	-91.6	-4.8	108.9	E97 V100 E165 V181	E97-R183 IonicContact OE1-CZ 3.55Å; E97-R183 IonicContact OE1-NH1 3.44Å; E97-R183 PolarHBondContact OE1-NH1 2.86Å; E97-R183 IonicContact OE1-NH2 2.76Å; E97-R183 IonicContact OE2-CZ 2.72Å; E97-R183 IonicContact OE2-NH1 3.15Å; E97-R183 PolarHBondContact OE2-NH1 2.92Å; E97-R183 IonicContact OE2-NH2 2.92Å; E97-R183 PolarHBondContact OE2-NH2 3.01Å; V100-R183 HydrophobicContact CG1-CG 4.14Å; E165-R183 VanDerWaalsContact CD-NH2 3.33Å; E165-R183 IonicContact OE1-CZ 2.83Å; E165-R183 IonicContact OE1-NE 3.6Å; E165-R183 PolarHBondContact OE1-NE 3.25Å; E165-R183 IonicContact OE1-NH2 3.94Å; E165-R183 PolarHBondContact OE1-NH2 3.01Å; E165-R183 VanDerWaalsContact OE1-NH2 3.09Å; E165-R183 IonicContact OE2-CZ 2.68Å; E165-R183 IonicContact OE2-NE 3.72Å; E165-R183 IonicContact OE2-NH2 3.72Å; E165-R183 PolarHBondContact OE2-NH2 3.41Å; V181-R183 HydrophobicContact CG1-CG 4.44Å
184	P	77.5	Confident	86	Confident	85 Å²	85	91.1 Å²	91.1	55%	0.552	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-62.2	133.9	175.1	25.8	-32.1	0	0	0	109.2	N186	P184-N186 PolarHBondContact O-N 3.43Å
185	P	71.8	Confident	86	Confident	71 Å²	71	92.8 Å²	92.8	46%	0.461	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-60.1	125.4	177.3	21.9	-30.9	0	0	0	109.8	Y187	P185-Y187 HydrophobicContact CB-CE1 4.43Å; P185-Y187 HydrophobicContact CB-CE2 4.16Å; P185-Y187 HydrophobicContact CG-CD2 4.44Å; P185-Y187 HydrophobicContact CG-CE1 4.42Å; P185-Y187 HydrophobicContact CG-CE2 3.59Å; P185-Y187 WeakPolarHBondContact CG-OH 3.3Å; P185-Y187 WeakPolarHBondContact O-CD2 3.49Å; P185-Y187 PolarHBondContact O-N 3.1Å
186	N	73.7	Confident	85.9	Confident	121 Å²	121	96.3 Å²	96.3	65%	0.647	51%	0.512	S	S	*	.			trans	-78.9	91.7	177.2	-172.6	-6	0	0	0	109.9	P184 S188	P184-N186 PolarHBondContact O-N 3.43Å; N186-S188 VanDerWaalsContact CG-OG 3.3Å; N186-S188 PolarHBondContact ND2-OG 3.37Å; N186-S188 PolarHBondContact O-N 3.03Å; N186-S188 VanDerWaalsContact OD1-CB 3.27Å; N186-S188 WeakPolarHBondContact OD1-CB 3.47Å; N186-S188 PolarHBondContact OD1-N 3.1Å; N186-S188 PolarHBondContact OD1-OG 2.81Å
187	Y	76.8	Confident	85.9	Confident	149 Å²	149	93.6 Å²	93.6	58%	0.584	50%	0.501	S	S	*	.	H	α-helix	trans	-69.7	-11.2	178.3	-63.9	-74.1	0	0	0	114	P185 G189 T190 I191	P185-Y187 HydrophobicContact CB-CE1 4.43Å; P185-Y187 HydrophobicContact CB-CE2 4.16Å; P185-Y187 HydrophobicContact CG-CD2 4.44Å; P185-Y187 HydrophobicContact CG-CE1 4.42Å; P185-Y187 HydrophobicContact CG-CE2 3.59Å; P185-Y187 WeakPolarHBondContact CG-OH 3.3Å; P185-Y187 WeakPolarHBondContact O-CD2 3.49Å; P185-Y187 PolarHBondContact O-N 3.1Å; Y187-G189 VanDerWaalsContact C-N 3.29Å; Y187-G189 PolarHBondContact O-N 3.42Å; Y187-T190 VanDerWaalsContact CA-OG1 3.26Å; Y187-T190 WeakPolarHBondContact CA-OG1 3.48Å; Y187-T190 PolarHBondContact O-N 3.15Å; Y187-T190 PolarHBondContact O-OG1 2.81Å; Y187-I191 WeakPolarHBondContact O-CB 3.18Å; Y187-I191 WeakPolarHBondContact O-CD1 3.28Å; Y187-I191 WeakPolarHBondContact O-CG1 3.31Å; Y187-I191 PolarHBondContact O-N 2.87Å
188	S	79.4	Confident	86	Confident	72 Å²	72	96.3 Å²	96.3	50%	0.503	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-40.8	-179.9	68.2	0	0	0	0	111.7	N186 A192	N186-S188 VanDerWaalsContact CG-OG 3.3Å; N186-S188 PolarHBondContact ND2-OG 3.37Å; N186-S188 PolarHBondContact O-N 3.03Å; N186-S188 VanDerWaalsContact OD1-CB 3.27Å; N186-S188 WeakPolarHBondContact OD1-CB 3.47Å; N186-S188 PolarHBondContact OD1-N 3.1Å; N186-S188 PolarHBondContact OD1-OG 2.81Å; S188-A192 WeakPolarHBondContact O-CB 3.32Å; S188-A192 PolarHBondContact O-N 3.48Å
189	G	79.8	Confident	85.9	Confident	45 Å²	45	95.3 Å²	95.3	46%	0.464	52%	0.52	S	S	.	.	H	α-helix	trans	-66.3	-43.2	176.6	0	0	0	0	0	112.3	Y187 A192 L193	Y187-G189 VanDerWaalsContact C-N 3.29Å; Y187-G189 PolarHBondContact O-N 3.42Å; G189-A192 PolarHBondContact O-N 3.4Å; G189-L193 VanDerWaalsContact O-CB 3.31Å; G189-L193 WeakPolarHBondContact O-CB 3.35Å; G189-L193 PolarHBondContact O-N 2.8Å
190	T	82.9	Confident	85.6	Confident	82 Å²	82	98 Å²	98	50%	0.503	54%	0.537	S	S	.	.	H	α-helix	trans	-68.2	-38.1	178.1	52.5	0	0	0	0	112.3	Y187 A194	Y187-T190 VanDerWaalsContact CA-OG1 3.26Å; Y187-T190 WeakPolarHBondContact CA-OG1 3.48Å; Y187-T190 PolarHBondContact O-N 3.15Å; Y187-T190 PolarHBondContact O-OG1 2.81Å; T190-A194 VanDerWaalsContact O-CB 3.28Å; T190-A194 WeakPolarHBondContact O-CB 3.22Å; T190-A194 PolarHBondContact O-N 3.36Å
191	I	88.8	Confident	85.4	Confident	99 Å²	99	89.5 Å²	89.5	51%	0.508	52%	0.516	S	S	.	.	H	α-helix	trans	-69	-44.2	176.7	-68.6	165.7	0	0	0	110.1	Y187 L193 A194 L195	Y187-I191 WeakPolarHBondContact O-CB 3.18Å; Y187-I191 WeakPolarHBondContact O-CD1 3.28Å; Y187-I191 WeakPolarHBondContact O-CG1 3.31Å; Y187-I191 PolarHBondContact O-N 2.87Å; I191-L193 VanDerWaalsContact C-N 3.32Å; I191-L193 PolarHBondContact O-N 2.88Å; I191-A194 PolarHBondContact O-N 3.25Å; I191-L195 HydrophobicContact CG2-CD1 4.01Å; I191-L195 HydrophobicContact CG2-CG 4.43Å; I191-L195 WeakPolarHBondContact O-CB 3.43Å; I191-L195 WeakPolarHBondContact O-CG 3.28Å; I191-L195 PolarHBondContact O-N 2.91Å
192	A	86.2	Confident	85.2	Confident	58 Å²	58	89.4 Å²	89.4	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-61.1	-42.4	175.8	0	0	0	0	0	111.6	S188 G189 L195 L196	S188-A192 WeakPolarHBondContact O-CB 3.32Å; S188-A192 PolarHBondContact O-N 3.48Å; G189-A192 PolarHBondContact O-N 3.4Å; A192-L195 PolarHBondContact O-N 3.48Å; A192-L196 WeakPolarHBondContact O-CB 3.08Å; A192-L196 PolarHBondContact O-N 2.98Å
193	L	87.2	Confident	85	Confident	112 Å²	112	87.4 Å²	87.4	59%	0.586	52%	0.518	S	S	*	.	H	α-helix	trans	-63.3	-47.3	174.5	-176.5	65.8	0	0	0	111.4	G189 I191 L195 L196 V197	G189-L193 VanDerWaalsContact O-CB 3.31Å; G189-L193 WeakPolarHBondContact O-CB 3.35Å; G189-L193 PolarHBondContact O-N 2.8Å; I191-L193 VanDerWaalsContact C-N 3.32Å; I191-L193 PolarHBondContact O-N 2.88Å; L193-L195 VanDerWaalsContact C-N 3.32Å; L193-L195 PolarHBondContact O-N 2.96Å; L193-L196 PolarHBondContact O-N 3.43Å; L193-L196 VanDerWaalsContact O-N 3.17Å; L193-V197 HydrophobicContact CD1-CG2 4.46Å; L193-V197 WeakPolarHBondContact O-CG2 3.18Å; L193-V197 PolarHBondContact O-N 3.13Å
194	A	91.1	Very high	85	Confident	61 Å²	61	85.9 Å²	85.9	50%	0.504	52%	0.517	S	S	.	.	H	α-helix	trans	-60.7	-41.3	178.2	0	0	0	0	0	112.1	T190 I191 V197 S198	T190-A194 VanDerWaalsContact O-CB 3.28Å; T190-A194 WeakPolarHBondContact O-CB 3.22Å; T190-A194 PolarHBondContact O-N 3.36Å; I191-A194 PolarHBondContact O-N 3.25Å; A194-V197 PolarHBondContact O-N 2.82Å; A194-S198 VanDerWaalsContact O-CB 3.26Å; A194-S198 WeakPolarHBondContact O-CB 3.4Å; A194-S198 PolarHBondContact O-N 3.3Å
195	L	92.3	Very high	85.3	Confident	113 Å²	113	90.1 Å²	90.1	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-63.5	-43	173.8	-77.7	171.2	0	0	0	111.8	I191 A192 L193 S198 L199	I191-L195 HydrophobicContact CG2-CD1 4.01Å; I191-L195 HydrophobicContact CG2-CG 4.43Å; I191-L195 WeakPolarHBondContact O-CB 3.43Å; I191-L195 WeakPolarHBondContact O-CG 3.28Å; I191-L195 PolarHBondContact O-N 2.91Å; A192-L195 PolarHBondContact O-N 3.48Å; L193-L195 VanDerWaalsContact C-N 3.32Å; L193-L195 PolarHBondContact O-N 2.96Å; L195-S198 PolarHBondContact O-N 3.3Å; L195-L199 VanDerWaalsContact O-CB 3.28Å; L195-L199 WeakPolarHBondContact O-CB 3.39Å; L195-L199 PolarHBondContact O-N 3.12Å
196	L	91.4	Very high	85.7	Confident	104 Å²	104	93.7 Å²	93.7	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-63.3	-45.8	177.6	-172.5	150.3	0	0	0	111.1	A192 L193 L199 V200	A192-L196 WeakPolarHBondContact O-CB 3.08Å; A192-L196 PolarHBondContact O-N 2.98Å; L193-L196 PolarHBondContact O-N 3.43Å; L193-L196 VanDerWaalsContact O-N 3.17Å; L196-L199 PolarHBondContact O-N 2.85Å; L196-V200 HydrophobicContact CD2-CG2 4.07Å; L196-V200 WeakPolarHBondContact O-CB 3.46Å; L196-V200 VanDerWaalsContact O-CG2 3.25Å; L196-V200 WeakPolarHBondContact O-CG2 3.21Å; L196-V200 PolarHBondContact O-N 2.96Å
197	V	93	Very high	85.9	Confident	91 Å²	91	95 Å²	95	55%	0.552	53%	0.534	S	S	*	.	H	α-helix	trans	-63.6	-42.2	176.8	175.7	0	0	0	0	111.1	L193 A194 G201	L193-V197 HydrophobicContact CD1-CG2 4.46Å; L193-V197 WeakPolarHBondContact O-CG2 3.18Å; L193-V197 PolarHBondContact O-N 3.13Å; A194-V197 PolarHBondContact O-N 2.82Å; V197-G201 PolarHBondContact O-N 3.22Å
198	S	92.6	Very high	85.9	Confident	85 Å²	85	96.3 Å²	96.3	59%	0.594	54%	0.538	S	S	*	.	H	α-helix	trans	-63.1	-43.2	176.4	-176.9	0	0	0	0	112	A194 L195 G202	A194-S198 VanDerWaalsContact O-CB 3.26Å; A194-S198 WeakPolarHBondContact O-CB 3.4Å; A194-S198 PolarHBondContact O-N 3.3Å; L195-S198 PolarHBondContact O-N 3.3Å; S198-G202 PolarHBondContact O-N 2.77Å
199	L	90.3	Very high	85.6	Confident	124 Å²	124	100.8 Å²	100.8	65%	0.649	56%	0.556	S	S	*	*	H	α-helix	trans	-64.3	-49.2	177.4	-175.2	76.2	0	0	0	111.4	L195 L196 G202 L203	L195-L199 VanDerWaalsContact O-CB 3.28Å; L195-L199 WeakPolarHBondContact O-CB 3.39Å; L195-L199 PolarHBondContact O-N 3.12Å; L196-L199 PolarHBondContact O-N 2.85Å; L199-G202 PolarHBondContact O-N 2.72Å; L199-L203 WeakPolarHBondContact O-CB 3.08Å; L199-L203 PolarHBondContact O-N 3.42Å
200	V	87.9	Confident	85.1	Confident	72 Å²	72	102.1 Å²	102.1	44%	0.436	55%	0.553	S	S	.	*	H	α-helix	trans	-63.4	-46	178.9	172.6	0	0	0	0	110.2	L196 G202 L203 L204	L196-V200 HydrophobicContact CD2-CG2 4.07Å; L196-V200 WeakPolarHBondContact O-CB 3.46Å; L196-V200 VanDerWaalsContact O-CG2 3.25Å; L196-V200 WeakPolarHBondContact O-CG2 3.21Å; L196-V200 PolarHBondContact O-N 2.96Å; V200-G202 PolarHBondContact O-N 2.79Å; V200-L203 PolarHBondContact O-N 3.17Å; V200-L204 HydrophobicContact CG1-CD1 3.93Å; V200-L204 HydrophobicContact CG1-CG 4.42Å; V200-L204 WeakPolarHBondContact O-CB 3.27Å; V200-L204 VanDerWaalsContact O-CG 3.23Å; V200-L204 WeakPolarHBondContact O-CG 3.28Å; V200-L204 PolarHBondContact O-N 3.21Å
201	G	87.5	Confident	84.6	Confident	36 Å²	36	101 Å²	101	37%	0.371	54%	0.543	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176.4	0	0	0	0	0	112.7	V197 L204 Y205	V197-G201 PolarHBondContact O-N 3.22Å; G201-L204 PolarHBondContact O-N 2.92Å; G201-Y205 WeakPolarHBondContact O-CB 3.47Å; G201-Y205 PolarHBondContact O-N 2.86Å
202	G	87.6	Confident	83.9	Confident	32 Å²	32	103.4 Å²	103.4	33%	0.33	55%	0.552	S	S	.	*	H	α-helix	trans	-63.8	-43	175.3	0	0	0	0	0	112.5	S198 L199 V200 Y205 L206	S198-G202 PolarHBondContact O-N 2.77Å; L199-G202 PolarHBondContact O-N 2.72Å; V200-G202 PolarHBondContact O-N 2.79Å; G202-Y205 PolarHBondContact O-N 3.23Å; G202-L206 WeakPolarHBondContact O-CB 3.38Å; G202-L206 VanDerWaalsContact O-CG 3.31Å; G202-L206 WeakPolarHBondContact O-CG 3.48Å; G202-L206 PolarHBondContact O-N 2.92Å
203	L	83.6	Confident	83.2	Confident	115 Å²	115	108.2 Å²	108.2	60%	0.602	56%	0.563	S	S	*	*	H	α-helix	trans	-64.6	-42.2	177.3	-156.4	111.1	0	0	0	111.4	L199 V200 R207	L199-L203 WeakPolarHBondContact O-CB 3.08Å; L199-L203 PolarHBondContact O-N 3.42Å; V200-L203 PolarHBondContact O-N 3.17Å; L203-R207 WeakPolarHBondContact O-CB 3.11Å; L203-R207 PolarHBondContact O-N 3.09Å
204	L	83.2	Confident	82.8	Confident	76 Å²	76	105.9 Å²	105.9	40%	0.398	55%	0.55	S	S	.	*	H	α-helix	trans	-65.2	-38.5	175.2	-71.8	173.5	0	0	0	112.4	V200 G201 R207 R208 L211 I214	V200-L204 HydrophobicContact CG1-CD1 3.93Å; V200-L204 HydrophobicContact CG1-CG 4.42Å; V200-L204 WeakPolarHBondContact O-CB 3.27Å; V200-L204 VanDerWaalsContact O-CG 3.23Å; V200-L204 WeakPolarHBondContact O-CG 3.28Å; V200-L204 PolarHBondContact O-N 3.21Å; G201-L204 PolarHBondContact O-N 2.92Å; L204-R207 CarbonylContact O-C 3.52Å; L204-R208 WeakPolarHBondContact O-CA 3.27Å; L204-R208 PolarHBondContact O-N 3.25Å; L204-L211 HydrophobicContact CD2-CD2 4.25Å; L204-I214 HydrophobicContact CD2-CD1 3.45Å; L204-I214 VanDerWaalsContact CD2-CD1 3.45Å; L204-I214 HydrophobicContact CD2-CG1 4.48Å
205	Y	83.5	Confident	82.4	Confident	175 Å²	175	111.8 Å²	111.8	69%	0.686	56%	0.561	S	S	*	*	H	α-helix	trans	-66.7	-46.8	176.3	-178.1	-98	0	0	0	111.8	G201 G202 R207 R208	G201-Y205 WeakPolarHBondContact O-CB 3.47Å; G201-Y205 PolarHBondContact O-N 2.86Å; G202-Y205 PolarHBondContact O-N 3.23Å; Y205-R207 VanDerWaalsContact C-N 3.34Å; Y205-R207 PolarHBondContact O-N 3.03Å; Y205-R208 WeakPolarHBondContact O-CB 3.28Å; Y205-R208 PolarHBondContact O-N 2.92Å
206	L	80.6	Confident	82.1	Confident	146 Å²	146	109.6 Å²	109.6	76%	0.764	55%	0.55	S	S	*	.	H	α-helix	trans	-67.5	-32.5	178.7	-69.8	172.8	0	0	0	112.8	G202	G202-L206 WeakPolarHBondContact O-CB 3.38Å; G202-L206 VanDerWaalsContact O-CG 3.31Å; G202-L206 WeakPolarHBondContact O-CG 3.48Å; G202-L206 PolarHBondContact O-N 2.92Å
207	R	78.8	Confident	82	Confident	149 Å²	149	113.3 Å²	113.3	56%	0.562	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	20.9	176.9	-71.8	-76.2	-173	162.8	-2.2	113.3	L203 L204 Y205 N209 N210	L203-R207 WeakPolarHBondContact O-CB 3.11Å; L203-R207 PolarHBondContact O-N 3.09Å; L204-R207 CarbonylContact O-C 3.52Å; Y205-R207 VanDerWaalsContact C-N 3.34Å; Y205-R207 PolarHBondContact O-N 3.03Å; R207-N209 PolarHBondContact O-N 3.24Å; R207-N210 PolarHBondContact NH1-ND2 3.06Å; R207-N210 CarbonylContact O-C 3.51Å; R207-N210 VanDerWaalsContact O-C 3.29Å; R207-N210 PolarHBondContact O-N 3.23Å
208	R	75.7	Confident	81.7	Confident	175 Å²	175	113.4 Å²	113.4	66%	0.66	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-32	-177	-177.2	172.6	-173.9	163	2.5	114.1	L204 Y205 L211	L204-R208 WeakPolarHBondContact O-CA 3.27Å; L204-R208 PolarHBondContact O-N 3.25Å; Y205-R208 WeakPolarHBondContact O-CB 3.28Å; Y205-R208 PolarHBondContact O-N 2.92Å; R208-L211 WeakPolarHBondContact O-CG 3.4Å
209	N	73	Confident	81.4	Confident	167 Å²	167	110.4 Å²	110.4	89%	0.893	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.8	179.7	-70.6	23.3	0	0	0	113.8	R207	R207-N209 PolarHBondContact O-N 3.24Å
210	N	70.2	Confident	81.4	Confident	73 Å²	73	111.6 Å²	111.6	39%	0.39	54%	0.541	S	S	.	.			trans	-133.5	66.5	-179.4	-171.8	-1.5	0	0	0	110.1	R207 E212	R207-N210 PolarHBondContact NH1-ND2 3.06Å; R207-N210 CarbonylContact O-C 3.51Å; R207-N210 VanDerWaalsContact O-C 3.29Å; R207-N210 PolarHBondContact O-N 3.23Å; N210-E212 VanDerWaalsContact C-N 3.26Å
211	L	72.5	Confident	81.5	Confident	58 Å²	58	110.7 Å²	110.7	30%	0.304	54%	0.541	S	S	.	.			trans	-88.1	14	178	-60.2	172.7	0	0	0	112.7	L204 R208 F213 I214 Y215	L204-L211 HydrophobicContact CD2-CD2 4.25Å; R208-L211 WeakPolarHBondContact O-CG 3.4Å; L211-F213 PolarHBondContact O-N 3.43Å; L211-F213 VanDerWaalsContact O-N 3.13Å; L211-I214 HydrophobicContact CB-CD1 4.33Å; L211-I214 HydrophobicContact CD2-CD1 3.73Å; L211-I214 WeakPolarHBondContact O-CB 3.37Å; L211-I214 PolarHBondContact O-N 3.29Å; L211-Y215 HydrophobicContact CB-CE2 4.29Å; L211-Y215 WeakPolarHBondContact O-CD2 3.35Å
212	E	74.3	Confident	81.6	Confident	150 Å²	150	114.7 Å²	114.7	70%	0.701	55%	0.551	S	S	*	*	H	α-helix	trans	-56.7	-31.9	-178.4	-66.1	-175.9	171.6	0	0	112.3	N210 I214 Y215 N216	N210-E212 VanDerWaalsContact C-N 3.26Å; E212-I214 VanDerWaalsContact C-N 3.29Å; E212-I214 PolarHBondContact O-N 2.94Å; E212-Y215 PolarHBondContact O-N 3.33Å; E212-N216 PolarHBondContact O-N 2.91Å; E212-N216 VanDerWaalsContact O-N 3.16Å
213	F	71.4	Confident	81.7	Confident	158 Å²	158	115.5 Å²	115.5	69%	0.693	56%	0.555	S	S	*	*	H	α-helix	trans	-58.9	-36	174	178	-99.1	0	0	0	113.2	L211 N216	L211-F213 PolarHBondContact O-N 3.43Å; L211-F213 VanDerWaalsContact O-N 3.13Å; F213-N216 WeakPolarHBondContact O-CB 3.48Å; F213-N216 PolarHBondContact O-N 3.17Å
214	I	78.6	Confident	82.2	Confident	64 Å²	64	112.7 Å²	112.7	33%	0.328	55%	0.548	S	S	.	.	H	α-helix	trans	-73.7	-30.3	179.7	-58.8	178	0	0	0	111	L204 L211 E212 N216 W220	L204-I214 HydrophobicContact CD2-CD1 3.45Å; L204-I214 VanDerWaalsContact CD2-CD1 3.45Å; L204-I214 HydrophobicContact CD2-CG1 4.48Å; L211-I214 HydrophobicContact CB-CD1 4.33Å; L211-I214 HydrophobicContact CD2-CD1 3.73Å; L211-I214 WeakPolarHBondContact O-CB 3.37Å; L211-I214 PolarHBondContact O-N 3.29Å; E212-I214 VanDerWaalsContact C-N 3.29Å; E212-I214 PolarHBondContact O-N 2.94Å; I214-N216 VanDerWaalsContact C-N 3.3Å; I214-W220 HydrophobicContact CG2-CZ2 4.38Å; I214-W220 PolarHBondContact O-NE1 3.48Å
215	Y	81.4	Confident	82.7	Confident	184 Å²	184	112 Å²	112	72%	0.722	55%	0.545	S	S	*	.	H	α-helix	trans	-85.1	-7.3	177.6	-65.6	-74.8	0	0	0	112.9	L211 E212 K217	L211-Y215 HydrophobicContact CB-CE2 4.29Å; L211-Y215 WeakPolarHBondContact O-CD2 3.35Å; E212-Y215 PolarHBondContact O-N 3.33Å; Y215-K217 PolarHBondContact O-N 3.46Å
216	N	86.9	Confident	83.1	Confident	68 Å²	68	107.5 Å²	107.5	36%	0.364	54%	0.538	S	S	.	.			trans	-72.6	98.1	-179.3	-172.8	7.1	0	0	0	112	E212 F213 I214 T218 G219 W220	E212-N216 PolarHBondContact O-N 2.91Å; E212-N216 VanDerWaalsContact O-N 3.16Å; F213-N216 WeakPolarHBondContact O-CB 3.48Å; F213-N216 PolarHBondContact O-N 3.17Å; I214-N216 VanDerWaalsContact C-N 3.3Å; N216-T218 PolarHBondContact ND2-OG1 3.37Å; N216-T218 PolarHBondContact O-N 2.84Å; N216-T218 PolarHBondContact OD1-N 3.28Å; N216-T218 PolarHBondContact OD1-OG1 2.88Å; N216-G219 PolarHBondContact O-N 2.81Å; N216-G219 VanDerWaalsContact O-N 3.13Å; N216-W220 VanDerWaalsContact O-CD1 3.27Å; N216-W220 PolarHBondContact O-N 2.87Å
217	K	88.6	Confident	83.7	Confident	181 Å²	181	104.7 Å²	104.7	79%	0.787	53%	0.526	S	S	*	.	H	α-helix	trans	-57.1	-34.7	178.4	-64.3	-178.8	-178.2	178.1	0	113.1	Y215 A221	Y215-K217 PolarHBondContact O-N 3.46Å; K217-A221 WeakPolarHBondContact O-CB 3.49Å; K217-A221 PolarHBondContact O-N 3.47Å
218	T	87.7	Confident	84.4	Confident	93 Å²	93	101.2 Å²	101.2	57%	0.571	52%	0.522	S	S	*	.	H	α-helix	trans	-72.6	-35.8	179.6	61.7	0	0	0	0	111.5	N216 A221 M222	N216-T218 PolarHBondContact ND2-OG1 3.37Å; N216-T218 PolarHBondContact O-N 2.84Å; N216-T218 PolarHBondContact OD1-N 3.28Å; N216-T218 PolarHBondContact OD1-OG1 2.88Å; T218-A221 PolarHBondContact O-N 3.42Å; T218-M222 WeakPolarHBondContact O-CG 3.27Å; T218-M222 PolarHBondContact O-N 3.39Å
219	G	86.7	Confident	85.3	Confident	23 Å²	23	94.1 Å²	94.1	24%	0.237	50%	0.496	C	S	.	.	H	α-helix	trans	-59.4	-46.9	172.9	0	0	0	0	0	112.2	N216 M222 A223	N216-G219 PolarHBondContact O-N 2.81Å; N216-G219 VanDerWaalsContact O-N 3.13Å; G219-M222 PolarHBondContact O-N 3.29Å; G219-A223 WeakPolarHBondContact O-CB 3.37Å; G219-A223 PolarHBondContact O-N 2.98Å
220	W	89.7	Confident	86.2	Confident	149 Å²	149	87.4 Å²	87.4	56%	0.564	46%	0.464	S	S	*	.	H	α-helix	trans	-65.4	-39	175.5	-72	107.4	0	0	0	113.2	I214 N216 A223 A224	I214-W220 HydrophobicContact CG2-CZ2 4.38Å; I214-W220 PolarHBondContact O-NE1 3.48Å; N216-W220 VanDerWaalsContact O-CD1 3.27Å; N216-W220 PolarHBondContact O-N 2.87Å; W220-A223 PolarHBondContact O-N 3.3Å; W220-A224 WeakPolarHBondContact O-CB 3.36Å; W220-A224 PolarHBondContact O-N 3.21Å
221	A	90.1	Very high	87.2	Confident	52 Å²	52	89.6 Å²	89.6	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-61.7	-44.6	175.3	0	0	0	0	0	111.6	K217 T218 A224 L225	K217-A221 WeakPolarHBondContact O-CB 3.49Å; K217-A221 PolarHBondContact O-N 3.47Å; T218-A221 PolarHBondContact O-N 3.42Å; A221-A224 PolarHBondContact O-N 3.16Å; A221-L225 WeakPolarHBondContact O-CG 3.37Å; A221-L225 PolarHBondContact O-N 3.3Å
222	M	89.5	Confident	88.2	Confident	120 Å²	120	90.9 Å²	90.9	59%	0.591	48%	0.484	S	S	*	.	H	α-helix	trans	-63.8	-44.1	175.7	-71.7	-61.3	-66.1	0	0	112	T218 G219 A224 L225 C226	T218-M222 WeakPolarHBondContact O-CG 3.27Å; T218-M222 PolarHBondContact O-N 3.39Å; G219-M222 PolarHBondContact O-N 3.29Å; M222-A224 PolarHBondContact O-N 2.91Å; M222-L225 PolarHBondContact O-N 3.39Å; M222-C226 PolarHBondContact O-N 3.14Å; M222-C226 PolarHBondContact O-SG 2.77Å; M222-C226 VanDerWaalsContact O-SG 3.34Å
223	A	90.3	Very high	89	Confident	50 Å²	50	84 Å²	84	41%	0.413	45%	0.451	S	S	.	.	H	α-helix	trans	-61.4	-43.6	176.7	0	0	0	0	0	112	G219 W220 C226 V227	G219-A223 WeakPolarHBondContact O-CB 3.37Å; G219-A223 PolarHBondContact O-N 2.98Å; W220-A223 PolarHBondContact O-N 3.3Å; A223-C226 WeakPolarHBondContact O-CB 3.36Å; A223-C226 PolarHBondContact O-N 3.42Å; A223-V227 WeakPolarHBondContact O-CG2 3.48Å; A223-V227 PolarHBondContact O-N 2.88Å; A223-V227 VanDerWaalsContact O-N 3.13Å
224	A	93.6	Very high	89.9	Confident	55 Å²	55	77.2 Å²	77.2	46%	0.455	43%	0.427	S	S	.	.	H	α-helix	trans	-62.1	-43.9	176.4	0	0	0	0	0	111.8	W220 A221 M222 C226 V227 V228	W220-A224 WeakPolarHBondContact O-CB 3.36Å; W220-A224 PolarHBondContact O-N 3.21Å; A221-A224 PolarHBondContact O-N 3.16Å; M222-A224 PolarHBondContact O-N 2.91Å; A224-C226 PolarHBondContact O-N 3.34Å; A224-V227 PolarHBondContact O-N 2.67Å; A224-V228 WeakPolarHBondContact O-CG2 3.45Å; A224-V228 PolarHBondContact O-N 3.36Å
225	L	93.1	Very high	90.5	Very high	63 Å²	63	76.5 Å²	76.5	33%	0.33	42%	0.422	S	S	.	.	H	α-helix	trans	-61	-43.2	175.6	-75.3	173.9	0	0	0	112.1	A221 M222 V227 V228 F229 T281	A221-L225 WeakPolarHBondContact O-CG 3.37Å; A221-L225 PolarHBondContact O-N 3.3Å; M222-L225 PolarHBondContact O-N 3.39Å; L225-V227 VanDerWaalsContact C-N 3.31Å; L225-V227 PolarHBondContact O-N 2.94Å; L225-V228 PolarHBondContact O-N 3.2Å; L225-F229 HydrophobicContact CB-CD2 4.46Å; L225-F229 HydrophobicContact CB-CE2 3.93Å; L225-F229 HydrophobicContact CB-CZ 4.29Å; L225-F229 HydrophobicContact CD2-CZ 4.05Å; L225-F229 WeakPolarHBondContact O-CD2 3.39Å; L225-F229 WeakPolarHBondContact O-CG 3.46Å; L225-F229 PolarHBondContact O-N 3.23Å; L225-T281 HydrophobicContact CD2-CG2 4.43Å
226	C	92	Very high	90.8	Very high	79 Å²	79	73 Å²	73	53%	0.534	41%	0.414	S	S	.	.	H	α-helix	trans	-57	-43.7	175.3	-72.5	0	0	0	0	112.2	M222 A223 A224 A230	M222-C226 PolarHBondContact O-N 3.14Å; M222-C226 PolarHBondContact O-SG 2.77Å; M222-C226 VanDerWaalsContact O-SG 3.34Å; A223-C226 WeakPolarHBondContact O-CB 3.36Å; A223-C226 PolarHBondContact O-N 3.42Å; A224-C226 PolarHBondContact O-N 3.34Å; C226-A230 WeakPolarHBondContact O-CB 3.26Å; C226-A230 PolarHBondContact O-N 3.47Å
227	V	93.4	Very high	90.9	Very high	87 Å²	87	72.9 Å²	72.9	53%	0.527	41%	0.408	S	S	.	.	H	α-helix	trans	-64.4	-46.5	176.7	174.5	0	0	0	0	110.9	A223 A224 L225 F229 A230 M231	A223-V227 WeakPolarHBondContact O-CG2 3.48Å; A223-V227 PolarHBondContact O-N 2.88Å; A223-V227 VanDerWaalsContact O-N 3.13Å; A224-V227 PolarHBondContact O-N 2.67Å; L225-V227 VanDerWaalsContact C-N 3.31Å; L225-V227 PolarHBondContact O-N 2.94Å; V227-F229 PolarHBondContact O-N 3.21Å; V227-A230 PolarHBondContact O-N 3.33Å; V227-M231 HydrophobicContact CG1-CG 4.29Å; V227-M231 WeakPolarHBondContact O-CB 3.48Å; V227-M231 VanDerWaalsContact O-CG 3.27Å; V227-M231 WeakPolarHBondContact O-CG 3.4Å; V227-M231 PolarHBondContact O-N 2.74Å
228	V	94.6	Very high	91	Very high	77 Å²	77	64.8 Å²	64.8	47%	0.467	37%	0.373	S	S	.	.	H	α-helix	trans	-60.2	-44.2	178.8	171.6	0	0	0	0	111.2	A224 L225 M231 T232	A224-V228 WeakPolarHBondContact O-CG2 3.45Å; A224-V228 PolarHBondContact O-N 3.36Å; L225-V228 PolarHBondContact O-N 3.2Å; V228-M231 PolarHBondContact O-N 3.37Å; V228-T232 HydrophobicContact CG1-CG2 4.25Å; V228-T232 WeakPolarHBondContact O-CB 3.46Å; V228-T232 VanDerWaalsContact O-CG2 3.28Å; V228-T232 WeakPolarHBondContact O-CG2 3.34Å; V228-T232 PolarHBondContact O-N 2.85Å; V228-T232 PolarHBondContact O-OG1 3.28Å
229	F	94.5	Very high	90.8	Very high	25 Å²	25	67.8 Å²	67.8	11%	0.11	38%	0.381	C	S	.	.	H	α-helix	trans	-67.7	-37.8	178.2	-58.9	-36.4	0	0	0	112.9	L225 V227 M231 T232 S233 L274 N277 A278 T281	L225-F229 HydrophobicContact CB-CD2 4.46Å; L225-F229 HydrophobicContact CB-CE2 3.93Å; L225-F229 HydrophobicContact CB-CZ 4.29Å; L225-F229 HydrophobicContact CD2-CZ 4.05Å; L225-F229 WeakPolarHBondContact O-CD2 3.39Å; L225-F229 WeakPolarHBondContact O-CG 3.46Å; L225-F229 PolarHBondContact O-N 3.23Å; V227-F229 PolarHBondContact O-N 3.21Å; F229-M231 VanDerWaalsContact C-N 3.35Å; F229-T232 WeakPolarHBondContact CA-OG1 3.45Å; F229-T232 PolarHBondContact O-OG1 2.8Å; F229-S233 VanDerWaalsContact O-CB 3.26Å; F229-S233 WeakPolarHBondContact O-CB 3.44Å; F229-S233 PolarHBondContact O-N 3.41Å; F229-S233 VanDerWaalsContact O-N 3.09Å; F229-S233 PolarHBondContact O-OG 3.5Å; F229-L274 HydrophobicContact CB-CD1 4.44Å; F229-L274 HydrophobicContact CB-CG 4.01Å; F229-N277 HydrophobicContact CD1-CB 4.27Å; F229-A278 HydrophobicContact CD2-CB 4.02Å; F229-A278 HydrophobicContact CE2-CB 3.85Å; F229-A278 HydrophobicContact CZ-CB 4.34Å; F229-T281 HydrophobicContact CE1-CG2 4.36Å; F229-T281 WeakPolarHBondContact CE1-OG1 3.29Å; F229-T281 HydrophobicContact CZ-CG2 3.93Å
230	A	91	Very high	90.6	Very high	27 Å²	27	71.9 Å²	71.9	22%	0.223	40%	0.396	C	S	.	.	H	α-helix	trans	-62.1	-43.7	173.6	0	0	0	0	0	111.4	C226 V227 S233 Q235	C226-A230 WeakPolarHBondContact O-CB 3.26Å; C226-A230 PolarHBondContact O-N 3.47Å; V227-A230 PolarHBondContact O-N 3.33Å; A230-S233 PolarHBondContact O-OG 3.14Å; A230-Q235 VanDerWaalsContact O-CB 3.28Å; A230-Q235 WeakPolarHBondContact O-CB 3.36Å; A230-Q235 VanDerWaalsContact O-CG 3.27Å; A230-Q235 WeakPolarHBondContact O-CG 3.14Å
231	M	91.8	Very high	90.1	Very high	118 Å²	118	71.9 Å²	71.9	58%	0.581	40%	0.396	S	S	*	.	H	α-helix	trans	-73.5	-35.4	-177.6	-66	-60.8	148	0	0	112.9	V227 V228 F229	V227-M231 HydrophobicContact CG1-CG 4.29Å; V227-M231 WeakPolarHBondContact O-CB 3.48Å; V227-M231 VanDerWaalsContact O-CG 3.27Å; V227-M231 WeakPolarHBondContact O-CG 3.4Å; V227-M231 PolarHBondContact O-N 2.74Å; V228-M231 PolarHBondContact O-N 3.37Å; F229-M231 VanDerWaalsContact C-N 3.35Å
232	T	92.5	Very high	89.8	Confident	86 Å²	86	72.3 Å²	72.3	53%	0.528	41%	0.405	S	S	.	.	H	α-helix	trans	-81.4	-20.1	-179.4	53.3	0	0	0	0	114.1	V228 F229 G234	V228-T232 HydrophobicContact CG1-CG2 4.25Å; V228-T232 WeakPolarHBondContact O-CB 3.46Å; V228-T232 VanDerWaalsContact O-CG2 3.28Å; V228-T232 WeakPolarHBondContact O-CG2 3.34Å; V228-T232 PolarHBondContact O-N 2.85Å; V228-T232 PolarHBondContact O-OG1 3.28Å; F229-T232 WeakPolarHBondContact CA-OG1 3.45Å; F229-T232 PolarHBondContact O-OG1 2.8Å; T232-G234 VanDerWaalsContact C-N 3.29Å; T232-G234 PolarHBondContact O-N 3.41Å
233	S	92.4	Very high	89.6	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.028	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-4.8	178.5	54.8	0	0	0	0	114.9	F229 A230 Q265 S270	F229-S233 VanDerWaalsContact O-CB 3.26Å; F229-S233 WeakPolarHBondContact O-CB 3.44Å; F229-S233 PolarHBondContact O-N 3.41Å; F229-S233 VanDerWaalsContact O-N 3.09Å; F229-S233 PolarHBondContact O-OG 3.5Å; A230-S233 PolarHBondContact O-OG 3.14Å; S233-Q265 PolarHBondContact O-NE2 3.24Å; S233-S270 VanDerWaalsContact CB-O 3.27Å; S233-S270 WeakPolarHBondContact CB-O 2.99Å
234	G	89.4	Confident	89.3	Confident	17 Å²	17	69.1 Å²	69.1	18%	0.175	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	15.7	-179.1	0	0	0	0	0	114.8	T232 M236 W237 N238	T232-G234 VanDerWaalsContact C-N 3.29Å; T232-G234 PolarHBondContact O-N 3.41Å; G234-M236 PolarHBondContact O-N 3.42Å; G234-W237 VanDerWaalsContact O-CB 3.31Å; G234-W237 WeakPolarHBondContact O-CB 3.29Å; G234-W237 PolarHBondContact O-N 3.21Å; G234-N238 PolarHBondContact O-N 2.99Å
235	Q	90.6	Very high	88.9	Confident	49 Å²	49	73 Å²	73	23%	0.229	39%	0.393	C	S	.	.	H	α-helix	trans	-58.6	-34.9	178.4	-68.5	-65.9	-10.8	0	0	113.3	A230 W237 N238 H239	A230-Q235 VanDerWaalsContact O-CB 3.28Å; A230-Q235 WeakPolarHBondContact O-CB 3.36Å; A230-Q235 VanDerWaalsContact O-CG 3.27Å; A230-Q235 WeakPolarHBondContact O-CG 3.14Å; Q235-W237 VanDerWaalsContact C-N 3.3Å; Q235-W237 PolarHBondContact O-N 2.96Å; Q235-N238 WeakPolarHBondContact O-CB 3.5Å; Q235-N238 PolarHBondContact O-N 2.98Å; Q235-H239 PolarHBondContact O-N 2.73Å
236	M	89.5	Confident	88.5	Confident	111 Å²	111	71.3 Å²	71.3	55%	0.547	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-35.9	176.6	-165.3	62.9	164.9	0	0	112	G234 H239 I240	G234-M236 PolarHBondContact O-N 3.42Å; M236-H239 PolarHBondContact O-N 2.81Å; M236-I240 HydrophobicContact CG-CD1 4.15Å; M236-I240 VanDerWaalsContact O-CG1 3.3Å; M236-I240 WeakPolarHBondContact O-CG1 3.21Å; M236-I240 PolarHBondContact O-N 2.88Å; M236-I240 VanDerWaalsContact O-N 3.1Å
237	W	88.7	Confident	87.9	Confident	64 Å²	64	72.3 Å²	72.3	24%	0.242	39%	0.385	C	S	.	.	H	α-helix	trans	-63.3	-43.9	174.9	-172.9	108.4	0	0	0	110.7	G234 Q235 I240 R241 P243 A264 Q265	G234-W237 VanDerWaalsContact O-CB 3.31Å; G234-W237 WeakPolarHBondContact O-CB 3.29Å; G234-W237 PolarHBondContact O-N 3.21Å; Q235-W237 VanDerWaalsContact C-N 3.3Å; Q235-W237 PolarHBondContact O-N 2.96Å; W237-I240 PolarHBondContact O-N 3.48Å; W237-R241 HydrophobicContact CZ3-CB 4.48Å; W237-R241 VanDerWaalsContact NE1-CZ 3.31Å; W237-R241 VanDerWaalsContact NE1-NH1 3.2Å; W237-R241 PolarHBondContact O-N 3.37Å; W237-R241 VanDerWaalsContact O-N 3.1Å; W237-P243 HydrophobicContact CE3-CG 4.37Å; W237-P243 HydrophobicContact CZ3-CB 3.97Å; W237-P243 HydrophobicContact CZ3-CG 3.75Å; W237-A264 HydrophobicContact CH2-CB 4.21Å; W237-A264 HydrophobicContact CZ2-CB 4.49Å; W237-Q265 HydrophobicContact CE3-CB 4.02Å; W237-Q265 HydrophobicContact CH2-CB 4.36Å; W237-Q265 HydrophobicContact CZ3-CB 3.89Å; W237-Q265 WeakPolarHBondContact CZ3-O 3.25Å
238	N	89.3	Confident	87.1	Confident	11 Å²	11	75.1 Å²	75.1	6%	0.059	39%	0.39	C	S	.	.	H	α-helix	trans	-63	-43.4	175.9	-63.1	-22.5	0	0	0	112.1	G234 Q235 I240 R241 G242 P243 S270	G234-N238 PolarHBondContact O-N 2.99Å; Q235-N238 WeakPolarHBondContact O-CB 3.5Å; Q235-N238 PolarHBondContact O-N 2.98Å; N238-I240 VanDerWaalsContact C-N 3.3Å; N238-I240 PolarHBondContact O-N 3.32Å; N238-R241 PolarHBondContact O-N 2.98Å; N238-G242 WeakPolarHBondContact O-CA 3.39Å; N238-G242 PolarHBondContact O-N 3.32Å; N238-P243 HydrophobicContact CB-CG 4.27Å; N238-P243 WeakPolarHBondContact O-CD 3.27Å; N238-S270 WeakPolarHBondContact ND2-CB 3.46Å; N238-S270 PolarHBondContact ND2-OG 3.47Å
239	H	84.4	Confident	86.1	Confident	157 Å²	157	74.5 Å²	74.5	73%	0.727	38%	0.384	S	S	*	.	H	α-helix	trans	-61.3	-40.1	-179.4	-179.1	-89.5	0	0	0	111.8	Q235 M236	Q235-H239 PolarHBondContact O-N 2.73Å; M236-H239 PolarHBondContact O-N 2.81Å
240	I	81.6	Confident	84.7	Confident	108 Å²	108	78.9 Å²	78.9	55%	0.554	42%	0.415	S	S	*	.	H	α-helix	trans	-73.5	-43.1	-179.1	-65.7	167	0	0	0	111.9	M236 W237 N238	M236-I240 HydrophobicContact CG-CD1 4.15Å; M236-I240 VanDerWaalsContact O-CG1 3.3Å; M236-I240 WeakPolarHBondContact O-CG1 3.21Å; M236-I240 PolarHBondContact O-N 2.88Å; M236-I240 VanDerWaalsContact O-N 3.1Å; W237-I240 PolarHBondContact O-N 3.48Å; N238-I240 VanDerWaalsContact C-N 3.3Å; N238-I240 PolarHBondContact O-N 3.32Å
241	R	79.5	Confident	83.6	Confident	150 Å²	150	85.8 Å²	85.8	57%	0.566	44%	0.442	S	S	*	.	H	α-helix	trans	-98.5	-17.7	-170.1	-73.6	136.3	167.5	137.1	-3.9	114.7	W237 N238	W237-R241 HydrophobicContact CZ3-CB 4.48Å; W237-R241 VanDerWaalsContact NE1-CZ 3.31Å; W237-R241 VanDerWaalsContact NE1-NH1 3.2Å; W237-R241 PolarHBondContact O-N 3.37Å; W237-R241 VanDerWaalsContact O-N 3.1Å; N238-R241 PolarHBondContact O-N 2.98Å
242	G	83.2	Confident	82.6	Confident	61 Å²	61	85.5 Å²	85.5	63%	0.629	44%	0.444	S	S	*	.			trans	56.2	51	179.5	0	0	0	0	0	114.7	N238	N238-G242 WeakPolarHBondContact O-CA 3.39Å; N238-G242 PolarHBondContact O-N 3.32Å
243	P	86.2	Confident	81.7	Confident	25 Å²	25	84.1 Å²	84.1	16%	0.162	45%	0.446	C	S	.	.			trans	-65.4	159.1	178.4	34.6	-40.8	0	0	0	111.7	W237 N238 Q265 V267	W237-P243 HydrophobicContact CE3-CG 4.37Å; W237-P243 HydrophobicContact CZ3-CB 3.97Å; W237-P243 HydrophobicContact CZ3-CG 3.75Å; N238-P243 HydrophobicContact CB-CG 4.27Å; N238-P243 WeakPolarHBondContact O-CD 3.27Å; P243-Q265 VanDerWaalsContact CB-O 3.27Å; P243-Q265 WeakPolarHBondContact CB-O 3.23Å; P243-Q265 WeakPolarHBondContact CG-O 3.4Å; P243-V267 HydrophobicContact CG-CG2 3.95Å
244	P	84.9	Confident	80.7	Confident	77 Å²	77	90.7 Å²	90.7	50%	0.5	48%	0.476	S	S	.	.			trans	-64.8	157.8	171.6	28.9	-34.6	0	0	0	111.6	F266 V267	P244-F266 HydrophobicContact CG-CD1 4.15Å; P244-F266 HydrophobicContact CG-CE1 4.03Å; P244-V267 PolarHBondContact O-N 3.43Å
245	Y	84.9	Confident	80	Confident	137 Å²	137	92.4 Å²	92.4	54%	0.537	48%	0.483	S	S	.	.	S	Bend	trans	-68.2	-41.8	-177.4	-173.9	-91.3	0	0	0	113.4	V267 A268	Y245-V267 HydrophobicContact CD2-CB 3.79Å; Y245-V267 HydrophobicContact CD2-CG1 3.84Å; Y245-V267 HydrophobicContact CE2-CB 4.41Å; Y245-V267 HydrophobicContact CE2-CG1 4.14Å; Y245-V267 HydrophobicContact CG-CB 4.48Å; Y245-A268 HydrophobicContact CD1-CB 4.19Å; Y245-A268 HydrophobicContact CE1-CB 3.79Å; Y245-A268 HydrophobicContact CE2-CB 4.45Å; Y245-A268 VanDerWaalsContact O-CB 3.29Å; Y245-A268 WeakPolarHBondContact O-CB 3.2Å; Y245-A268 PolarHBondContact O-N 2.93Å
246	A	84.9	Confident	79.5	Confident	27 Å²	27	92.8 Å²	92.8	22%	0.223	49%	0.492	C	S	.	.			trans	-155	160.6	174.6	0	0	0	0	0	108.8	V255 Y257	A246-V255 HydrophobicContact CB-CG1 3.66Å; A246-Y257 HydrophobicContact CB-CD1 4.14Å; A246-Y257 HydrophobicContact CB-CE1 4.43Å
247	H	79.5	Confident	79.3	Confident	100 Å²	100	93.5 Å²	93.5	46%	0.463	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.1	177.6	-168.9	79.8	0	0	0	110.5	S256 F266	H247-S256 PolarHBondContact N-O 3.41Å; H247-S256 PolarHBondContact O-N 3.33Å; H247-F266 HydrophobicContact CB-CE1 3.84Å; H247-F266 HydrophobicContact CB-CE2 4.12Å; H247-F266 HydrophobicContact CB-CZ 3.35Å
248	K	76.4	Confident	79.1	Confident	147 Å²	147	92.6 Å²	92.6	64%	0.639	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.2	174.4	-59.9	-164.8	177.2	179	0	108.6	P250 V255	K248-P250 VanDerWaalsContact O-CD 3.29Å; K248-P250 WeakPolarHBondContact O-CD 3.38Å; K248-V255 HydrophobicContact CD-CG2 4.35Å; K248-V255 HydrophobicContact CG-CG2 4.08Å
249	N	73.3	Confident	78.8	Confident	63 Å²	63	94.6 Å²	94.6	34%	0.337	50%	0.497	S	S	.	.			trans	-66.6	119.5	176	-172.7	-17.4	0	0	0	109.1	Q251 N252 G253 Q254	N249-Q251 PolarHBondContact O-N 3.48Å; N249-Q251 VanDerWaalsContact O-N 3.16Å; N249-Q251 PolarHBondContact OD1-N 2.88Å; N249-Q251 VanDerWaalsContact OD1-N 3.16Å; N249-N252 PolarHBondContact O-N 3.24Å; N249-G253 WeakPolarHBondContact O-CA 3.26Å; N249-G253 PolarHBondContact O-N 2.72Å; N249-Q254 PolarHBondContact N-O 2.92Å
250	P	64.4	Low	78.6	Confident	118 Å²	118	90 Å²	90	77%	0.766	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.4	-177.2	-22.4	33.1	0	0	0	114.2	K248	K248-P250 VanDerWaalsContact O-CD 3.29Å; K248-P250 WeakPolarHBondContact O-CD 3.38Å
251	Q	67.8	Low	78.6	Confident	171 Å²	171	87.1 Å²	87.1	80%	0.799	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-35.6	-174.9	-65.8	176.7	-14.9	0	0	112.9	N249	N249-Q251 PolarHBondContact O-N 3.48Å; N249-Q251 VanDerWaalsContact O-N 3.16Å; N249-Q251 PolarHBondContact OD1-N 2.88Å; N249-Q251 VanDerWaalsContact OD1-N 3.16Å
252	N	70.9	Confident	78.6	Confident	113 Å²	113	82.9 Å²	82.9	60%	0.604	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	-6.3	-173.4	-68.5	-1.2	0	0	0	113.7	N249 Q254	N249-N252 PolarHBondContact O-N 3.24Å; N252-Q254 HydrophobicContact CB-CG 4.48Å; N252-Q254 PolarHBondContact O-N 3.13Å
253	G	72.8	Confident	78.5	Confident	56 Å²	56	87.5 Å²	87.5	58%	0.577	48%	0.48	S	S	*	.			trans	67.7	-5.2	-177.6	0	0	0	0	0	115.3	N249	N249-G253 WeakPolarHBondContact O-CA 3.26Å; N249-G253 PolarHBondContact O-N 2.72Å
254	Q	71.6	Confident	78.4	Confident	142 Å²	142	87.6 Å²	87.6	66%	0.664	48%	0.484	S	S	*	.			trans	-72.8	137.9	-179.9	-67.3	-175.4	-7.3	0	0	111.4	N249 N252	N249-Q254 PolarHBondContact N-O 2.92Å; N252-Q254 HydrophobicContact CB-CG 4.48Å; N252-Q254 PolarHBondContact O-N 3.13Å
255	V	75.6	Confident	78.5	Confident	54 Å²	54	85.7 Å²	85.7	33%	0.327	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	115	177.9	-170.5	0	0	0	0	108.8	A246 K248 Y257	A246-V255 HydrophobicContact CB-CG1 3.66Å; K248-V255 HydrophobicContact CD-CG2 4.35Å; K248-V255 HydrophobicContact CG-CG2 4.08Å; V255-Y257 HydrophobicContact CB-CE2 4.25Å; V255-Y257 HydrophobicContact CG1-CE1 4.1Å; V255-Y257 HydrophobicContact CG1-CE2 4.25Å
256	S	80.6	Confident	78.7	Confident	57 Å²	57	79.9 Å²	79.9	40%	0.399	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	119.3	170.3	-164.1	0	0	0	0	109.9	H247 I258	H247-S256 PolarHBondContact N-O 3.41Å; H247-S256 PolarHBondContact O-N 3.33Å; S256-I258 PolarHBondContact OG-O 3.49Å
257	Y	83.9	Confident	78.9	Confident	125 Å²	125	80.1 Å²	80.1	49%	0.49	44%	0.444	S	S	.	.	S	Bend	trans	-87.5	-11.3	175.4	-62.1	-81.6	0	0	0	112.9	A246 V255 A268 E269	A246-Y257 HydrophobicContact CB-CD1 4.14Å; A246-Y257 HydrophobicContact CB-CE1 4.43Å; V255-Y257 HydrophobicContact CB-CE2 4.25Å; V255-Y257 HydrophobicContact CG1-CE1 4.1Å; V255-Y257 HydrophobicContact CG1-CE2 4.25Å; Y257-A268 HydrophobicContact CD1-CB 4.01Å; Y257-E269 WeakPolarHBondContact O-CG 3.35Å
258	I	84.3	Confident	79.5	Confident	46 Å²	46	75.5 Å²	75.5	24%	0.236	42%	0.423	C	S	.	.	S	Bend	trans	-120.9	134.7	177.9	-58.1	165.7	0	0	0	109.4	S256 E269 I321	S256-I258 PolarHBondContact OG-O 3.49Å; I258-E269 HydrophobicContact CB-CG 4.22Å; I258-E269 HydrophobicContact CG1-CG 4.11Å; I258-E269 HydrophobicContact CG2-CG 4.3Å; I258-I321 HydrophobicContact CD1-CG1 4.28Å; I258-I321 HydrophobicContact CD1-CG2 4.1Å
259	H	83.5	Confident	80.2	Confident	52 Å²	52	69 Å²	69	24%	0.241	40%	0.396	C	S	.	.			trans	-81.3	130.3	179.2	-165.9	-80.4	0	0	0	109.8	S261 F266 E269	H259-S261 VanDerWaalsContact C-N 3.27Å; H259-S261 PolarHBondContact ND1-N 3.39Å; H259-S261 VanDerWaalsContact ND1-N 3.12Å; H259-S261 PolarHBondContact ND1-O 2.87Å; H259-S261 PolarHBondContact O-N 2.9Å; H259-F266 VanDerWaalsContact CA-CE2 3.47Å; H259-F266 HydrophobicContact CB-CD2 3.78Å; H259-F266 HydrophobicContact CB-CE2 3.65Å; H259-F266 HydrophobicContact CB-CG 4.35Å; H259-F266 HydrophobicContact CB-CZ 4.11Å; H259-F266 AromaticContact CD2-CE1 3.67Å; H259-F266 AromaticContact CD2-CE2 3.87Å; H259-F266 AromaticContact CD2-CZ 3.39Å; H259-F266 WeakPolarHBondContact CD2-CZ 3.48Å; H259-E269 WeakPolarHBondContact CA-OE1 3.18Å; H259-E269 WeakPolarHBondContact CB-OE1 3.33Å; H259-E269 PolarHBondContact N-OE1 3.03Å
260	G	80.3	Confident	81.1	Confident	60 Å²	60	66 Å²	66	62%	0.619	38%	0.379	S	S	*	.	S	Bend	trans	-74.7	-9.3	-175	0	0	0	0	0	115.5
261	S	81.8	Confident	82.4	Confident	48 Å²	48	64.3 Å²	64.3	34%	0.336	36%	0.361	S	S	.	.	S	Bend	trans	-105.6	142.5	174.4	177.3	0	0	0	0	111.5	H259 Q263 A264 K325	H259-S261 VanDerWaalsContact C-N 3.27Å; H259-S261 PolarHBondContact ND1-N 3.39Å; H259-S261 VanDerWaalsContact ND1-N 3.12Å; H259-S261 PolarHBondContact ND1-O 2.87Å; H259-S261 PolarHBondContact O-N 2.9Å; S261-Q263 VanDerWaalsContact C-N 3.25Å; S261-Q263 PolarHBondContact O-N 3.36Å; S261-Q263 PolarHBondContact OG-N 2.83Å; S261-A264 VanDerWaalsContact O-O 3.09Å; S261-K325 WeakPolarHBondContact O-CE 3.49Å
262	S	80.2	Confident	83.6	Confident	62 Å²	62	58.7 Å²	58.7	43%	0.434	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.7	175	56.8	0	0	0	0	114.3
263	Q	81.1	Confident	84.7	Confident	157 Å²	157	55.2 Å²	55.2	73%	0.734	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-10.2	-176.5	-64.8	-67.7	-26.5	0	0	113.7	S261	S261-Q263 VanDerWaalsContact C-N 3.25Å; S261-Q263 PolarHBondContact O-N 3.36Å; S261-Q263 PolarHBondContact OG-N 2.83Å
264	A	83.3	Confident	85.7	Confident	28 Å²	28	54.8 Å²	54.8	23%	0.231	30%	0.301	C	S	.	.			trans	-136.4	160.1	-178.1	0	0	0	0	0	111.8	W237 S261 K325	W237-A264 HydrophobicContact CH2-CB 4.21Å; W237-A264 HydrophobicContact CZ2-CB 4.49Å; S261-A264 VanDerWaalsContact O-O 3.09Å; A264-K325 WeakPolarHBondContact O-CE 2.93Å; A264-K325 PolarHBondContact O-NZ 3.48Å
265	Q	86.8	Confident	86.8	Confident	37 Å²	37	53.6 Å²	53.6	17%	0.173	30%	0.299	C	S	.	.			trans	-146.2	140.3	-173.6	179.2	162.6	-28.5	0	0	109.7	S233 W237 P243 E269 S270	S233-Q265 PolarHBondContact O-NE2 3.24Å; W237-Q265 HydrophobicContact CE3-CB 4.02Å; W237-Q265 HydrophobicContact CH2-CB 4.36Å; W237-Q265 HydrophobicContact CZ3-CB 3.89Å; W237-Q265 WeakPolarHBondContact CZ3-O 3.25Å; P243-Q265 VanDerWaalsContact CB-O 3.27Å; P243-Q265 WeakPolarHBondContact CB-O 3.23Å; P243-Q265 WeakPolarHBondContact CG-O 3.4Å; Q265-E269 HydrophobicContact CG-CB 4Å; Q265-S270 PolarHBondContact NE2-OG 2.89Å
266	F	89.8	Confident	87.7	Confident	14 Å²	14	51.5 Å²	51.5	6%	0.061	29%	0.285	C	S	.	.			trans	-87	158.4	169.7	-63.5	-52.5	0	0	0	112.2	P244 H247 H259 A268 E269 S270	P244-F266 HydrophobicContact CG-CD1 4.15Å; P244-F266 HydrophobicContact CG-CE1 4.03Å; H247-F266 HydrophobicContact CB-CE1 3.84Å; H247-F266 HydrophobicContact CB-CE2 4.12Å; H247-F266 HydrophobicContact CB-CZ 3.35Å; H259-F266 VanDerWaalsContact CA-CE2 3.47Å; H259-F266 HydrophobicContact CB-CD2 3.78Å; H259-F266 HydrophobicContact CB-CE2 3.65Å; H259-F266 HydrophobicContact CB-CG 4.35Å; H259-F266 HydrophobicContact CB-CZ 4.11Å; H259-F266 AromaticContact CD2-CE1 3.67Å; H259-F266 AromaticContact CD2-CE2 3.87Å; H259-F266 AromaticContact CD2-CZ 3.39Å; H259-F266 WeakPolarHBondContact CD2-CZ 3.48Å; F266-A268 VanDerWaalsContact C-N 3.28Å; F266-A268 PolarHBondContact O-N 2.73Å; F266-E269 HydrophobicContact CB-CG 4.19Å; F266-E269 WeakPolarHBondContact CD2-OE1 3.45Å; F266-E269 PolarHBondContact N-OE1 3.45Å; F266-E269 WeakPolarHBondContact O-CB 3.35Å; F266-E269 PolarHBondContact O-N 3.46Å; F266-S270 PolarHBondContact O-OG 3.42Å
267	V	90.1	Very high	88.3	Confident	32 Å²	32	50.7 Å²	50.7	19%	0.194	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-39.3	175.3	-176.9	0	0	0	0	110.7	P243 P244 Y245 E269 S270 H271	P243-V267 HydrophobicContact CG-CG2 3.95Å; P244-V267 PolarHBondContact O-N 3.43Å; Y245-V267 HydrophobicContact CD2-CB 3.79Å; Y245-V267 HydrophobicContact CD2-CG1 3.84Å; Y245-V267 HydrophobicContact CE2-CB 4.41Å; Y245-V267 HydrophobicContact CE2-CG1 4.14Å; Y245-V267 HydrophobicContact CG-CB 4.48Å; V267-E269 VanDerWaalsContact C-N 3.34Å; V267-E269 PolarHBondContact O-N 3.16Å; V267-S270 WeakPolarHBondContact O-CB 3.41Å; V267-S270 PolarHBondContact O-N 3.28Å; V267-H271 PolarHBondContact O-ND1 2.79Å
268	A	90.1	Very high	88.8	Confident	4 Å²	4	46 Å²	46	3%	0.033	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-41.2	176.7	0	0	0	0	0	112.8	Y245 Y257 F266 S270 H271 I272	Y245-A268 HydrophobicContact CD1-CB 4.19Å; Y245-A268 HydrophobicContact CE1-CB 3.79Å; Y245-A268 HydrophobicContact CE2-CB 4.45Å; Y245-A268 VanDerWaalsContact O-CB 3.29Å; Y245-A268 WeakPolarHBondContact O-CB 3.2Å; Y245-A268 PolarHBondContact O-N 2.93Å; Y257-A268 HydrophobicContact CD1-CB 4.01Å; F266-A268 VanDerWaalsContact C-N 3.28Å; F266-A268 PolarHBondContact O-N 2.73Å; A268-S270 PolarHBondContact O-N 3.07Å; A268-H271 PolarHBondContact O-N 2.92Å; A268-H271 VanDerWaalsContact O-N 3.14Å; A268-I272 WeakPolarHBondContact O-CG1 3.41Å; A268-I272 PolarHBondContact O-N 3.07Å; A268-I272 VanDerWaalsContact O-N 3.12Å
269	E	91.1	Very high	89.4	Confident	11 Å²	11	44.6 Å²	44.6	5%	0.051	26%	0.259	C	S	.	.	H	α-helix	trans	-55.2	-40.7	177	-68.9	175	-128	0	0	112.2	Y257 I258 H259 Q265 F266 V267 H271 I272 I273 K325	Y257-E269 WeakPolarHBondContact O-CG 3.35Å; I258-E269 HydrophobicContact CB-CG 4.22Å; I258-E269 HydrophobicContact CG1-CG 4.11Å; I258-E269 HydrophobicContact CG2-CG 4.3Å; H259-E269 WeakPolarHBondContact CA-OE1 3.18Å; H259-E269 WeakPolarHBondContact CB-OE1 3.33Å; H259-E269 PolarHBondContact N-OE1 3.03Å; Q265-E269 HydrophobicContact CG-CB 4Å; F266-E269 HydrophobicContact CB-CG 4.19Å; F266-E269 WeakPolarHBondContact CD2-OE1 3.45Å; F266-E269 PolarHBondContact N-OE1 3.45Å; F266-E269 WeakPolarHBondContact O-CB 3.35Å; F266-E269 PolarHBondContact O-N 3.46Å; V267-E269 VanDerWaalsContact C-N 3.34Å; V267-E269 PolarHBondContact O-N 3.16Å; E269-H271 VanDerWaalsContact C-N 3.28Å; E269-H271 PolarHBondContact O-N 3.1Å; E269-I272 WeakPolarHBondContact O-CB 3.28Å; E269-I272 PolarHBondContact O-N 3.23Å; E269-I272 VanDerWaalsContact O-N 3.14Å; E269-I273 WeakPolarHBondContact O-CG1 3.31Å; E269-I273 PolarHBondContact O-N 3.37Å; E269-K325 IonicContact OE2-NZ 3.68Å; E269-K325 PolarHBondContact OE2-NZ 3.01Å
270	S	92.3	Very high	89.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.9	-35.1	-175.6	-46.6	0	0	0	0	111.2	S233 N238 Q265 F266 V267 A268 L274	S233-S270 VanDerWaalsContact CB-O 3.27Å; S233-S270 WeakPolarHBondContact CB-O 2.99Å; N238-S270 WeakPolarHBondContact ND2-CB 3.46Å; N238-S270 PolarHBondContact ND2-OG 3.47Å; Q265-S270 PolarHBondContact NE2-OG 2.89Å; F266-S270 PolarHBondContact O-OG 3.42Å; V267-S270 WeakPolarHBondContact O-CB 3.41Å; V267-S270 PolarHBondContact O-N 3.28Å; A268-S270 PolarHBondContact O-N 3.07Å; S270-L274 WeakPolarHBondContact O-CB 3.45Å; S270-L274 PolarHBondContact O-N 2.97Å
271	H	92.6	Very high	90.6	Very high	82 Å²	82	42.7 Å²	42.7	38%	0.38	24%	0.238	S	C	.	.	H	α-helix	trans	-69.4	-39.3	174.4	-64.5	77.9	0	0	0	111.2	V267 A268 E269 L274 L275	V267-H271 PolarHBondContact O-ND1 2.79Å; A268-H271 PolarHBondContact O-N 2.92Å; A268-H271 VanDerWaalsContact O-N 3.14Å; E269-H271 VanDerWaalsContact C-N 3.28Å; E269-H271 PolarHBondContact O-N 3.1Å; H271-L274 PolarHBondContact O-N 2.81Å; H271-L275 WeakPolarHBondContact O-CG 3.31Å; H271-L275 PolarHBondContact O-N 2.93Å
272	I	92.8	Very high	91.2	Very high	52 Å²	52	46 Å²	46	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-52.7	175.3	-64.4	164.8	0	0	0	109.8	A268 E269 L274 L275 L276 I321	A268-I272 WeakPolarHBondContact O-CG1 3.41Å; A268-I272 PolarHBondContact O-N 3.07Å; A268-I272 VanDerWaalsContact O-N 3.12Å; E269-I272 WeakPolarHBondContact O-CB 3.28Å; E269-I272 PolarHBondContact O-N 3.23Å; E269-I272 VanDerWaalsContact O-N 3.14Å; I272-L274 VanDerWaalsContact C-N 3.29Å; I272-L274 PolarHBondContact O-N 2.93Å; I272-L275 PolarHBondContact O-N 3.3Å; I272-L275 VanDerWaalsContact O-N 3.15Å; I272-L276 HydrophobicContact CG2-CD1 4.06Å; I272-L276 HydrophobicContact CG2-CG 4.39Å; I272-L276 VanDerWaalsContact O-CG 3.31Å; I272-L276 WeakPolarHBondContact O-CG 3.36Å; I272-L276 PolarHBondContact O-N 3.22Å; I272-I321 HydrophobicContact CG2-CD1 4.06Å
273	I	93.7	Very high	91.9	Very high	41 Å²	41	43 Å²	43	21%	0.21	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-38.3	179.6	-61.9	-56.5	0	0	0	111.7	E269 L276 N277 I321	E269-I273 WeakPolarHBondContact O-CG1 3.31Å; E269-I273 PolarHBondContact O-N 3.37Å; I273-L276 HydrophobicContact CD1-CD1 4.42Å; I273-L276 PolarHBondContact O-N 2.95Å; I273-N277 WeakPolarHBondContact CG2-ND2 3.36Å; I273-N277 WeakPolarHBondContact O-CB 3.36Å; I273-N277 PolarHBondContact O-N 3.3Å; I273-N277 PolarHBondContact O-ND2 3.35Å; I273-I321 HydrophobicContact CD1-CG2 4.43Å
274	L	94.6	Very high	92.5	Very high	46 Å²	46	40.7 Å²	40.7	24%	0.241	22%	0.219	C	C	.	.	H	α-helix	trans	-58.3	-48.8	174.4	-175.7	151	0	0	0	111.5	F229 S270 H271 I272 N277 A278	F229-L274 HydrophobicContact CB-CD1 4.44Å; F229-L274 HydrophobicContact CB-CG 4.01Å; S270-L274 WeakPolarHBondContact O-CB 3.45Å; S270-L274 PolarHBondContact O-N 2.97Å; H271-L274 PolarHBondContact O-N 2.81Å; I272-L274 VanDerWaalsContact C-N 3.29Å; I272-L274 PolarHBondContact O-N 2.93Å; L274-N277 PolarHBondContact O-N 3.47Å; L274-A278 WeakPolarHBondContact O-CB 3.36Å; L274-A278 PolarHBondContact O-N 2.97Å
275	L	94.3	Very high	93	Very high	118 Å²	118	43.2 Å²	43.2	62%	0.618	23%	0.232	S	C	*	.	H	α-helix	trans	-64.6	-39.1	178.7	-70.7	174.1	0	0	0	112.2	H271 I272 A278 A279	H271-L275 WeakPolarHBondContact O-CG 3.31Å; H271-L275 PolarHBondContact O-N 2.93Å; I272-L275 PolarHBondContact O-N 3.3Å; I272-L275 VanDerWaalsContact O-N 3.15Å; L275-A278 PolarHBondContact O-N 2.92Å; L275-A279 WeakPolarHBondContact O-CB 3.46Å; L275-A279 PolarHBondContact O-N 2.99Å
276	L	94.4	Very high	93.3	Very high	9 Å²	9	43.6 Å²	43.6	5%	0.047	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-45.6	177.5	-64.6	-179.9	0	0	0	112.3	I272 I273 A278 A279 I280 F314 F317 L318 I321	I272-L276 HydrophobicContact CG2-CD1 4.06Å; I272-L276 HydrophobicContact CG2-CG 4.39Å; I272-L276 VanDerWaalsContact O-CG 3.31Å; I272-L276 WeakPolarHBondContact O-CG 3.36Å; I272-L276 PolarHBondContact O-N 3.22Å; I273-L276 HydrophobicContact CD1-CD1 4.42Å; I273-L276 PolarHBondContact O-N 2.95Å; L276-A278 VanDerWaalsContact C-N 3.32Å; L276-A278 PolarHBondContact O-N 2.95Å; L276-A279 PolarHBondContact O-N 3.47Å; L276-I280 VanDerWaalsContact O-CG1 3.31Å; L276-I280 WeakPolarHBondContact O-CG1 3.46Å; L276-I280 PolarHBondContact O-N 3.45Å; L276-F314 HydrophobicContact CD2-CD1 3.63Å; L276-F314 HydrophobicContact CD2-CE1 4.23Å; L276-F317 HydrophobicContact CD1-CD1 3.96Å; L276-F317 HydrophobicContact CD1-CE1 4.2Å; L276-F317 HydrophobicContact CD2-CD1 3.48Å; L276-F317 VanDerWaalsContact CD2-CD1 3.48Å; L276-F317 HydrophobicContact CD2-CE1 3.93Å; L276-F317 HydrophobicContact CG-CD1 4.38Å; L276-L318 HydrophobicContact CB-CD1 4.45Å; L276-L318 HydrophobicContact CD1-CB 4.39Å; L276-I321 HydrophobicContact CD1-CD1 3.69Å
277	N	94.4	Very high	93.5	Very high	40 Å²	40	45 Å²	45	21%	0.214	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-38.9	176.4	-74.7	-30.6	0	0	0	111.8	F229 I273 L274 T281	F229-N277 HydrophobicContact CD1-CB 4.27Å; I273-N277 WeakPolarHBondContact CG2-ND2 3.36Å; I273-N277 WeakPolarHBondContact O-CB 3.36Å; I273-N277 PolarHBondContact O-N 3.3Å; I273-N277 PolarHBondContact O-ND2 3.35Å; L274-N277 PolarHBondContact O-N 3.47Å; N277-T281 WeakPolarHBondContact O-CB 3.49Å; N277-T281 PolarHBondContact O-N 3.12Å; N277-T281 PolarHBondContact O-OG1 2.74Å
278	A	94.6	Very high	93.6	Very high	28 Å²	28	48.6 Å²	48.6	23%	0.231	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-44.1	175.1	0	0	0	0	0	111.7	F229 L274 L275 L276 T281 M282	F229-A278 HydrophobicContact CD2-CB 4.02Å; F229-A278 HydrophobicContact CE2-CB 3.85Å; F229-A278 HydrophobicContact CZ-CB 4.34Å; L274-A278 WeakPolarHBondContact O-CB 3.36Å; L274-A278 PolarHBondContact O-N 2.97Å; L275-A278 PolarHBondContact O-N 2.92Å; L276-A278 VanDerWaalsContact C-N 3.32Å; L276-A278 PolarHBondContact O-N 2.95Å; A278-T281 PolarHBondContact O-N 3.14Å; A278-M282 WeakPolarHBondContact O-CB 3.46Å; A278-M282 PolarHBondContact O-N 2.98Å
279	A	94.9	Very high	93.6	Very high	15 Å²	15	53.4 Å²	53.4	12%	0.124	28%	0.282	C	S	.	.	H	α-helix	trans	-59.8	-55	175.3	0	0	0	0	0	110.7	L275 L276 T281 M282 G283 L310 F314	L275-A279 WeakPolarHBondContact O-CB 3.46Å; L275-A279 PolarHBondContact O-N 2.99Å; L276-A279 PolarHBondContact O-N 3.47Å; A279-T281 VanDerWaalsContact C-N 3.26Å; A279-T281 PolarHBondContact O-N 2.91Å; A279-M282 WeakPolarHBondContact O-CA 3.38Å; A279-M282 WeakPolarHBondContact O-CB 3.45Å; A279-M282 PolarHBondContact O-N 3.41Å; A279-G283 PolarHBondContact O-N 3.34Å; A279-L310 HydrophobicContact CB-CD2 4.01Å; A279-L310 WeakPolarHBondContact O-CD2 3.35Å; A279-F314 HydrophobicContact CB-CB 4.34Å; A279-F314 HydrophobicContact CB-CD1 3.97Å; A279-F314 HydrophobicContact CB-CD2 3.8Å; A279-F314 HydrophobicContact CB-CE1 4.17Å; A279-F314 HydrophobicContact CB-CE2 4Å; A279-F314 HydrophobicContact CB-CG 3.77Å; A279-F314 HydrophobicContact CB-CZ 4.17Å
280	I	95.3	Very high	93.6	Very high	27 Å²	27	53.1 Å²	53.1	14%	0.138	28%	0.282	C	S	.	.	H	α-helix	trans	-55.3	-43.6	179.9	-65.7	164.3	0	0	0	111.3	L276 G283 M284 F314 F315 L318	L276-I280 VanDerWaalsContact O-CG1 3.31Å; L276-I280 WeakPolarHBondContact O-CG1 3.46Å; L276-I280 PolarHBondContact O-N 3.45Å; I280-G283 PolarHBondContact O-N 2.95Å; I280-M284 PolarHBondContact O-N 3.15Å; I280-F314 HydrophobicContact CD1-CB 4.46Å; I280-F314 HydrophobicContact CG1-CB 3.75Å; I280-F315 HydrophobicContact CD1-CB 4.3Å; I280-F315 HydrophobicContact CD1-CD2 4.43Å; I280-L318 HydrophobicContact CD1-CD1 4.04Å
281	T	94.9	Very high	93.4	Very high	45 Å²	45	56.9 Å²	56.9	28%	0.276	31%	0.313	S	S	.	.	H	α-helix	trans	-64.2	-41.5	178.2	-53.9	0	0	0	0	111.6	L225 F229 N277 A278 A279 G283 M284 V285	L225-T281 HydrophobicContact CD2-CG2 4.43Å; F229-T281 HydrophobicContact CE1-CG2 4.36Å; F229-T281 WeakPolarHBondContact CE1-OG1 3.29Å; F229-T281 HydrophobicContact CZ-CG2 3.93Å; N277-T281 WeakPolarHBondContact O-CB 3.49Å; N277-T281 PolarHBondContact O-N 3.12Å; N277-T281 PolarHBondContact O-OG1 2.74Å; A278-T281 PolarHBondContact O-N 3.14Å; A279-T281 VanDerWaalsContact C-N 3.26Å; A279-T281 PolarHBondContact O-N 2.91Å; T281-G283 VanDerWaalsContact C-N 3.32Å; T281-G283 PolarHBondContact O-N 2.9Å; T281-M284 PolarHBondContact O-N 3.05Å; T281-V285 WeakPolarHBondContact O-CG2 3.36Å; T281-V285 PolarHBondContact O-N 3.46Å
282	M	94.3	Very high	93.2	Very high	118 Å²	118	57.6 Å²	57.6	58%	0.581	32%	0.323	S	S	*	.	H	α-helix	trans	-59.7	-43.5	173.6	-176	-174.7	-66	0	0	111.3	A278 A279 M284 V285 L286	A278-M282 WeakPolarHBondContact O-CB 3.46Å; A278-M282 PolarHBondContact O-N 2.98Å; A279-M282 WeakPolarHBondContact O-CA 3.38Å; A279-M282 WeakPolarHBondContact O-CB 3.45Å; A279-M282 PolarHBondContact O-N 3.41Å; M282-M284 VanDerWaalsContact C-N 3.32Å; M282-M284 PolarHBondContact O-N 3.38Å; M282-V285 PolarHBondContact O-N 2.93Å; M282-L286 WeakPolarHBondContact O-CG 3.49Å; M282-L286 PolarHBondContact O-N 3.34Å
283	G	94.8	Very high	92.9	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.2	-43.1	174.3	0	0	0	0	0	112.6	A279 I280 T281 L286 L287	A279-G283 PolarHBondContact O-N 3.34Å; I280-G283 PolarHBondContact O-N 2.95Å; T281-G283 VanDerWaalsContact C-N 3.32Å; T281-G283 PolarHBondContact O-N 2.9Å; G283-L286 PolarHBondContact O-N 3.44Å; G283-L287 WeakPolarHBondContact O-CG 3.31Å; G283-L287 PolarHBondContact O-N 2.98Å
284	M	94.3	Very high	92.3	Very high	108 Å²	108	65.3 Å²	65.3	53%	0.532	36%	0.359	S	S	.	.	H	α-helix	trans	-66.2	-38.4	175.6	-72.8	-61.5	-70	0	0	113.2	I280 T281 M282 L287 N288 V311	I280-M284 PolarHBondContact O-N 3.15Å; T281-M284 PolarHBondContact O-N 3.05Å; M282-M284 VanDerWaalsContact C-N 3.32Å; M282-M284 PolarHBondContact O-N 3.38Å; M284-L287 PolarHBondContact O-N 3.38Å; M284-L287 HydrophobicContact SD-CD1 4.13Å; M284-N288 PolarHBondContact O-N 3.01Å; M284-V311 HydrophobicContact CG-CG2 3.98Å; M284-V311 HydrophobicContact SD-CG2 4Å
285	V	93.3	Very high	91.5	Very high	81 Å²	81	65.2 Å²	65.2	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-63.3	-45.1	175.1	171.2	0	0	0	0	110.6	T281 M282 L287 N288 E289	T281-V285 WeakPolarHBondContact O-CG2 3.36Å; T281-V285 PolarHBondContact O-N 3.46Å; M282-V285 PolarHBondContact O-N 2.93Å; V285-L287 VanDerWaalsContact C-N 3.31Å; V285-L287 PolarHBondContact O-N 3.19Å; V285-N288 PolarHBondContact O-N 3.31Å; V285-E289 WeakPolarHBondContact O-CB 3.41Å; V285-E289 PolarHBondContact O-N 3.13Å
286	L	93.4	Very high	91.2	Very high	44 Å²	44	64.2 Å²	64.2	23%	0.23	36%	0.364	C	S	.	.	H	α-helix	trans	-60.7	-39.6	176.4	-69.1	175.3	0	0	0	112.1	M282 G283 E289 A290 I303 V306	M282-L286 WeakPolarHBondContact O-CG 3.49Å; M282-L286 PolarHBondContact O-N 3.34Å; G283-L286 PolarHBondContact O-N 3.44Å; L286-E289 PolarHBondContact O-N 3Å; L286-A290 WeakPolarHBondContact O-CB 3.46Å; L286-A290 PolarHBondContact O-N 2.95Å; L286-I303 HydrophobicContact CB-CG2 4.05Å; L286-I303 HydrophobicContact CD2-CG2 4.16Å; L286-I303 WeakPolarHBondContact O-CG2 3.34Å; L286-V306 HydrophobicContact CD1-CG1 4.32Å
287	L	93.5	Very high	90.8	Very high	43 Å²	43	68.9 Å²	68.9	23%	0.225	39%	0.393	C	S	.	.	H	α-helix	trans	-63.6	-42.8	175.2	-73.2	172.7	0	0	0	112.1	G283 M284 V285 A290 A291 C304 L308 V311	G283-L287 WeakPolarHBondContact O-CG 3.31Å; G283-L287 PolarHBondContact O-N 2.98Å; M284-L287 PolarHBondContact O-N 3.38Å; M284-L287 HydrophobicContact SD-CD1 4.13Å; V285-L287 VanDerWaalsContact C-N 3.31Å; V285-L287 PolarHBondContact O-N 3.19Å; L287-A290 PolarHBondContact O-N 3.25Å; L287-A291 PolarHBondContact O-N 3.38Å; L287-C304 WeakPolarHBondContact CD2-O 3.33Å; L287-L308 HydrophobicContact CD2-CB 4.16Å; L287-V311 HydrophobicContact CD1-CG2 4.16Å
288	N	93.1	Very high	90.4	Very high	108 Å²	108	69.1 Å²	69.1	58%	0.578	41%	0.405	S	S	*	.	H	α-helix	trans	-67.9	-38.6	178	-169.2	34.7	0	0	0	112	M284 V285 A291 T292	M284-N288 PolarHBondContact O-N 3.01Å; V285-N288 PolarHBondContact O-N 3.31Å; N288-A291 PolarHBondContact O-N 3.16Å; N288-T292 PolarHBondContact O-N 2.92Å; N288-T292 PolarHBondContact O-OG1 3.22Å
289	E	90.2	Very high	90	Very high	106 Å²	106	74 Å²	74	50%	0.495	42%	0.421	S	S	.	.	H	α-helix	trans	-65.9	-41.1	174.6	-170	173.5	178.2	0	0	111.2	V285 L286 A291 T292 S293	V285-E289 WeakPolarHBondContact O-CB 3.41Å; V285-E289 PolarHBondContact O-N 3.13Å; L286-E289 PolarHBondContact O-N 3Å; E289-A291 VanDerWaalsContact C-N 3.27Å; E289-A291 PolarHBondContact O-N 3.19Å; E289-T292 PolarHBondContact O-N 3.33Å; E289-S293 WeakPolarHBondContact O-CB 3.49Å; E289-S293 PolarHBondContact O-N 3.05Å
290	A	90.4	Very high	89.7	Confident	5 Å²	5	78.2 Å²	78.2	4%	0.041	43%	0.433	C	S	.	.	H	α-helix	trans	-62.7	-32.8	172.5	0	0	0	0	0	112.5	L286 L287 R300 I303 C304	L286-A290 WeakPolarHBondContact O-CB 3.46Å; L286-A290 PolarHBondContact O-N 2.95Å; L287-A290 PolarHBondContact O-N 3.25Å; A290-R300 HydrophobicContact CB-CG 4.23Å; A290-R300 WeakPolarHBondContact O-CD 3.33Å; A290-R300 WeakPolarHBondContact O-CG 3.44Å; A290-I303 HydrophobicContact CB-CB 4.24Å; A290-I303 HydrophobicContact CB-CG2 3.96Å; A290-C304 HydrophobicContact CB-CB 3.87Å
291	A	88.4	Confident	89.4	Confident	79 Å²	79	85.7 Å²	85.7	65%	0.653	46%	0.46	S	S	*	.	H	α-helix	trans	-74.1	-36.9	177.4	0	0	0	0	0	113	L287 N288 E289	L287-A291 PolarHBondContact O-N 3.38Å; N288-A291 PolarHBondContact O-N 3.16Å; E289-A291 VanDerWaalsContact C-N 3.27Å; E289-A291 PolarHBondContact O-N 3.19Å
292	T	87.8	Confident	89.3	Confident	96 Å²	96	88.8 Å²	88.8	59%	0.589	47%	0.474	S	S	*	.	H	α-helix	trans	-93.6	-17.6	-173.9	52.7	0	0	0	0	114.1	N288 E289 K294	N288-T292 PolarHBondContact O-N 2.92Å; N288-T292 PolarHBondContact O-OG1 3.22Å; E289-T292 PolarHBondContact O-N 3.33Å; T292-K294 PolarHBondContact O-N 3.13Å
293	S	85.9	Confident	89.1	Confident	46 Å²	46	85.8 Å²	85.8	32%	0.322	46%	0.459	S	S	.	.			trans	-67.8	129.5	-179.9	-177.3	0	0	0	0	112.6	E289 G295 R300	E289-S293 WeakPolarHBondContact O-CB 3.49Å; E289-S293 PolarHBondContact O-N 3.05Å; S293-G295 PolarHBondContact OG-N 3.33Å; S293-R300 WeakPolarHBondContact O-CD 3.26Å
294	K	81.1	Confident	89.1	Confident	210 Å²	210	88.3 Å²	88.3	91%	0.913	48%	0.477	S	S	*	.			trans	-91.4	8.1	175.5	-61.4	-175.7	-178.8	-179.5	0	113.6	T292	T292-K294 PolarHBondContact O-N 3.13Å
295	G	78.9	Confident	89	Confident	43 Å²	43	88.6 Å²	88.6	44%	0.443	48%	0.48	S	S	.	.	S	Bend	trans	-79	-166.2	-177	0	0	0	0	0	114.7	S293 V297	S293-G295 PolarHBondContact OG-N 3.33Å; G295-V297 PolarHBondContact O-N 2.96Å
296	D	86.6	Confident	89.1	Confident	98 Å²	98	88.5 Å²	88.5	52%	0.524	48%	0.479	S	S	.	.			trans	-52.8	131.6	179.7	-64.4	-41.8	0	0	0	112.8	G298 K299 R300	D296-G298 PolarHBondContact O-N 2.86Å; D296-K299 HydrophobicContact CB-CB 4.43Å; D296-K299 HydrophobicContact CB-CD 4.23Å; D296-K299 HydrophobicContact CB-CG 4.28Å; D296-K299 PolarHBondContact O-N 3.03Å; D296-K299 IonicContact OD2-NZ 3.52Å; D296-K299 PolarHBondContact OD2-NZ 3.32Å; D296-R300 PolarHBondContact O-N 2.86Å; D296-R300 VanDerWaalsContact O-N 3.11Å
297	V	86.3	Confident	89.1	Confident	106 Å²	106	86.4 Å²	86.4	64%	0.642	47%	0.468	S	S	*	.	H	α-helix	trans	-57.4	-36.9	-179.8	-176.9	0	0	0	0	111.7	G295 R300 R301	G295-V297 PolarHBondContact O-N 2.96Å; V297-R300 PolarHBondContact O-N 3.47Å; V297-R301 WeakPolarHBondContact O-CB 3.29Å; V297-R301 PolarHBondContact O-N 3.46Å
298	G	87.4	Confident	89.1	Confident	46 Å²	46	88.9 Å²	88.9	47%	0.474	48%	0.481	S	S	.	.	H	α-helix	trans	-62.8	-48.4	178.3	0	0	0	0	0	113.1	D296 R300 R301 I302	D296-G298 PolarHBondContact O-N 2.86Å; G298-R300 VanDerWaalsContact C-N 3.34Å; G298-R300 PolarHBondContact O-N 2.93Å; G298-R301 PolarHBondContact O-N 3.39Å; G298-I302 WeakPolarHBondContact O-CG1 3.48Å; G298-I302 PolarHBondContact O-N 3.39Å
299	K	86.3	Confident	89.2	Confident	131 Å²	131	85.5 Å²	85.5	57%	0.57	47%	0.471	S	S	*	.	H	α-helix	trans	-63.3	-42.8	178.2	-68.7	175.2	-175.5	147.1	0	111.1	D296 R301 I302 I303	D296-K299 HydrophobicContact CB-CB 4.43Å; D296-K299 HydrophobicContact CB-CD 4.23Å; D296-K299 HydrophobicContact CB-CG 4.28Å; D296-K299 PolarHBondContact O-N 3.03Å; D296-K299 IonicContact OD2-NZ 3.52Å; D296-K299 PolarHBondContact OD2-NZ 3.32Å; K299-R301 VanDerWaalsContact C-N 3.32Å; K299-R301 PolarHBondContact O-N 3.02Å; K299-I302 PolarHBondContact O-N 3.03Å; K299-I303 WeakPolarHBondContact O-CG1 3.31Å; K299-I303 PolarHBondContact O-N 3.46Å
300	R	88.5	Confident	89.3	Confident	102 Å²	102	81.9 Å²	81.9	39%	0.385	46%	0.456	S	S	.	.	H	α-helix	trans	-60.8	-40.6	178.6	-156.4	174.3	77.9	-178.9	-1	112.5	A290 S293 D296 V297 G298 I303 C304	A290-R300 HydrophobicContact CB-CG 4.23Å; A290-R300 WeakPolarHBondContact O-CD 3.33Å; A290-R300 WeakPolarHBondContact O-CG 3.44Å; S293-R300 WeakPolarHBondContact O-CD 3.26Å; D296-R300 PolarHBondContact O-N 2.86Å; D296-R300 VanDerWaalsContact O-N 3.11Å; V297-R300 PolarHBondContact O-N 3.47Å; G298-R300 VanDerWaalsContact C-N 3.34Å; G298-R300 PolarHBondContact O-N 2.93Å; R300-I303 PolarHBondContact O-N 2.96Å; R300-C304 WeakPolarHBondContact O-CB 3.33Å; R300-C304 PolarHBondContact O-N 2.96Å
301	R	89	Confident	89.5	Confident	185 Å²	185	83.1 Å²	83.1	70%	0.698	46%	0.462	S	S	*	.	H	α-helix	trans	-64.2	-42.1	176.9	-169.2	174.8	-175.6	174.4	1	111.8	V297 G298 K299 C304 L305	V297-R301 WeakPolarHBondContact O-CB 3.29Å; V297-R301 PolarHBondContact O-N 3.46Å; G298-R301 PolarHBondContact O-N 3.39Å; K299-R301 VanDerWaalsContact C-N 3.32Å; K299-R301 PolarHBondContact O-N 3.02Å; R301-C304 PolarHBondContact O-N 3.42Å; R301-L305 HydrophobicContact CG-CD1 4.31Å; R301-L305 WeakPolarHBondContact O-CG 3.48Å; R301-L305 PolarHBondContact O-N 3.22Å
302	I	91.5	Very high	89.8	Confident	110 Å²	110	81.4 Å²	81.4	56%	0.564	44%	0.444	S	S	*	.	H	α-helix	trans	-64.3	-48.5	177.7	-64.8	167	0	0	0	110.5	G298 K299 C304 L305 V306	G298-I302 WeakPolarHBondContact O-CG1 3.48Å; G298-I302 PolarHBondContact O-N 3.39Å; K299-I302 PolarHBondContact O-N 3.03Å; I302-C304 VanDerWaalsContact C-N 3.3Å; I302-C304 PolarHBondContact O-N 3.2Å; I302-L305 PolarHBondContact O-N 2.93Å; I302-V306 HydrophobicContact CG2-CG2 4.3Å; I302-V306 WeakPolarHBondContact O-CG2 3.2Å; I302-V306 PolarHBondContact O-N 3.02Å
303	I	91.6	Very high	90.1	Very high	54 Å²	54	82.1 Å²	82.1	28%	0.277	44%	0.439	S	S	.	.	H	α-helix	trans	-59.7	-42.8	179.4	-63.7	166.4	0	0	0	110.8	L286 A290 K299 R300 V306 G307	L286-I303 HydrophobicContact CB-CG2 4.05Å; L286-I303 HydrophobicContact CD2-CG2 4.16Å; L286-I303 WeakPolarHBondContact O-CG2 3.34Å; A290-I303 HydrophobicContact CB-CB 4.24Å; A290-I303 HydrophobicContact CB-CG2 3.96Å; K299-I303 WeakPolarHBondContact O-CG1 3.31Å; K299-I303 PolarHBondContact O-N 3.46Å; R300-I303 PolarHBondContact O-N 2.96Å; I303-V306 PolarHBondContact O-N 3.5Å; I303-G307 PolarHBondContact O-N 2.94Å
304	C	92.9	Very high	90.5	Very high	54 Å²	54	83 Å²	83	37%	0.365	44%	0.437	S	S	.	.	H	α-helix	trans	-62.1	-46.3	176.9	-174.4	0	0	0	0	112.2	L287 A290 R300 R301 I302 V306 G307 L308	L287-C304 WeakPolarHBondContact CD2-O 3.33Å; A290-C304 HydrophobicContact CB-CB 3.87Å; R300-C304 WeakPolarHBondContact O-CB 3.33Å; R300-C304 PolarHBondContact O-N 2.96Å; R301-C304 PolarHBondContact O-N 3.42Å; I302-C304 VanDerWaalsContact C-N 3.3Å; I302-C304 PolarHBondContact O-N 3.2Å; C304-V306 PolarHBondContact O-N 3.41Å; C304-G307 PolarHBondContact O-N 3.06Å; C304-L308 WeakPolarHBondContact O-CB 3.37Å; C304-L308 PolarHBondContact O-N 3.02Å
305	L	93.3	Very high	91.1	Very high	113 Å²	113	77.4 Å²	77.4	59%	0.592	41%	0.413	S	S	*	.	H	α-helix	trans	-63.4	-42.7	178.4	-74	172.6	0	0	0	112.2	R301 I302 G309	R301-L305 HydrophobicContact CG-CD1 4.31Å; R301-L305 WeakPolarHBondContact O-CG 3.48Å; R301-L305 PolarHBondContact O-N 3.22Å; I302-L305 PolarHBondContact O-N 2.93Å; L305-G309 PolarHBondContact O-N 3.37Å
306	V	94.4	Very high	91.8	Very high	80 Å²	80	75.4 Å²	75.4	49%	0.485	39%	0.392	S	S	.	.	H	α-helix	trans	-64	-47.4	176.3	172.7	0	0	0	0	110.5	L286 I302 I303 C304 L308 G309 L310	L286-V306 HydrophobicContact CD1-CG1 4.32Å; I302-V306 HydrophobicContact CG2-CG2 4.3Å; I302-V306 WeakPolarHBondContact O-CG2 3.2Å; I302-V306 PolarHBondContact O-N 3.02Å; I303-V306 PolarHBondContact O-N 3.5Å; C304-V306 PolarHBondContact O-N 3.41Å; V306-L308 PolarHBondContact O-N 3.35Å; V306-G309 PolarHBondContact O-N 2.98Å; V306-L310 VanDerWaalsContact O-CB 3.3Å; V306-L310 WeakPolarHBondContact O-CB 3.36Å; V306-L310 PolarHBondContact O-N 2.82Å
307	G	93.6	Very high	92	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-59.3	-45.4	177.9	0	0	0	0	0	112.4	I303 C304 L310 V311	I303-G307 PolarHBondContact O-N 2.94Å; C304-G307 PolarHBondContact O-N 3.06Å; G307-L310 PolarHBondContact O-N 3.45Å; G307-V311 WeakPolarHBondContact O-CG2 3.48Å; G307-V311 PolarHBondContact O-N 2.87Å
308	L	94.9	Very high	92.3	Very high	95 Å²	95	71.2 Å²	71.2	50%	0.497	36%	0.362	S	S	.	.	H	α-helix	trans	-64.2	-46.5	177.9	-172.6	131.3	0	0	0	111.7	L287 C304 V306 L310 V311 V312	L287-L308 HydrophobicContact CD2-CB 4.16Å; C304-L308 WeakPolarHBondContact O-CB 3.37Å; C304-L308 PolarHBondContact O-N 3.02Å; V306-L308 PolarHBondContact O-N 3.35Å; L308-L310 VanDerWaalsContact C-N 3.29Å; L308-L310 PolarHBondContact O-N 3.22Å; L308-V311 PolarHBondContact O-N 3.19Å; L308-V312 HydrophobicContact CD2-CG2 4.29Å; L308-V312 HydrophobicContact CG-CG2 4.38Å; L308-V312 VanDerWaalsContact O-CB 3.29Å; L308-V312 WeakPolarHBondContact O-CB 3.37Å; L308-V312 VanDerWaalsContact O-CG2 3.26Å; L308-V312 WeakPolarHBondContact O-CG2 3.33Å; L308-V312 PolarHBondContact O-N 3.02Å
309	G	93.9	Very high	92.4	Very high	36 Å²	36	70.2 Å²	70.2	37%	0.371	35%	0.346	S	S	.	.	H	α-helix	trans	-59.7	-40.8	177.2	0	0	0	0	0	112.3	L305 V306 F313	L305-G309 PolarHBondContact O-N 3.37Å; V306-G309 PolarHBondContact O-N 2.98Å; G309-F313 WeakPolarHBondContact O-CB 3.45Å; G309-F313 PolarHBondContact O-N 3.4Å
310	L	93.6	Very high	92.5	Very high	31 Å²	31	65 Å²	65	16%	0.162	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-50.3	178.8	-159.4	162.4	0	0	0	111	A279 V306 G307 L308 V312 F313 F314	A279-L310 HydrophobicContact CB-CD2 4.01Å; A279-L310 WeakPolarHBondContact O-CD2 3.35Å; V306-L310 VanDerWaalsContact O-CB 3.3Å; V306-L310 WeakPolarHBondContact O-CB 3.36Å; V306-L310 PolarHBondContact O-N 2.82Å; G307-L310 PolarHBondContact O-N 3.45Å; L308-L310 VanDerWaalsContact C-N 3.29Å; L308-L310 PolarHBondContact O-N 3.22Å; L310-V312 PolarHBondContact O-N 3.39Å; L310-F313 PolarHBondContact O-N 3.36Å; L310-F314 HydrophobicContact CD2-CD2 3.52Å; L310-F314 HydrophobicContact CD2-CE2 3.98Å; L310-F314 HydrophobicContact CD2-CG 4.48Å; L310-F314 HydrophobicContact CG-CD2 3.77Å; L310-F314 HydrophobicContact CG-CE2 3.87Å; L310-F314 WeakPolarHBondContact O-CB 3.41Å; L310-F314 VanDerWaalsContact O-CD2 3.31Å; L310-F314 WeakPolarHBondContact O-CD2 2.86Å; L310-F314 PolarHBondContact O-N 2.96Å
311	V	94.8	Very high	92.5	Very high	30 Å²	30	61.1 Å²	61.1	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-50.6	177.1	173.6	0	0	0	0	110.7	M284 L287 G307 L308 F313 F315	M284-V311 HydrophobicContact CG-CG2 3.98Å; M284-V311 HydrophobicContact SD-CG2 4Å; L287-V311 HydrophobicContact CD1-CG2 4.16Å; G307-V311 WeakPolarHBondContact O-CG2 3.48Å; G307-V311 PolarHBondContact O-N 2.87Å; L308-V311 PolarHBondContact O-N 3.19Å; V311-F313 PolarHBondContact O-N 2.86Å; V311-F315 WeakPolarHBondContact O-CB 3.37Å; V311-F315 PolarHBondContact O-N 3.23Å
312	V	94.5	Very high	92.5	Very high	44 Å²	44	56.9 Å²	56.9	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-60.7	-46.3	-176.8	162.2	0	0	0	0	112	L308 L310 S316 F333 L334	L308-V312 HydrophobicContact CD2-CG2 4.29Å; L308-V312 HydrophobicContact CG-CG2 4.38Å; L308-V312 VanDerWaalsContact O-CB 3.29Å; L308-V312 WeakPolarHBondContact O-CB 3.37Å; L308-V312 VanDerWaalsContact O-CG2 3.26Å; L308-V312 WeakPolarHBondContact O-CG2 3.33Å; L308-V312 PolarHBondContact O-N 3.02Å; L310-V312 PolarHBondContact O-N 3.39Å; V312-S316 WeakPolarHBondContact O-CB 3.43Å; V312-S316 PolarHBondContact O-N 3.44Å; V312-S316 VanDerWaalsContact O-N 3.1Å; V312-F333 HydrophobicContact CB-CE1 4.35Å; V312-F333 HydrophobicContact CG1-CE1 3.87Å; V312-F333 HydrophobicContact CG2-CE1 4.28Å; V312-L334 HydrophobicContact CG1-CD1 3.26Å; V312-L334 HydrophobicContact CG1-CG 4.45Å
313	F	94.1	Very high	92.3	Very high	111 Å²	111	55.4 Å²	55.4	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-68	-53.9	-178.5	178.7	-98.2	0	0	0	112.2	G309 L310 V311 S316 F317 I335	G309-F313 WeakPolarHBondContact O-CB 3.45Å; G309-F313 PolarHBondContact O-N 3.4Å; L310-F313 PolarHBondContact O-N 3.36Å; V311-F313 PolarHBondContact O-N 2.86Å; F313-S316 WeakPolarHBondContact O-CB 3.36Å; F313-S316 PolarHBondContact O-N 2.94Å; F313-F317 PolarHBondContact O-N 3.38Å; F313-I335 HydrophobicContact CD2-CD1 4.39Å; F313-I335 HydrophobicContact CE2-CD1 4.01Å
314	F	94.2	Very high	91.9	Very high	64 Å²	64	56.3 Å²	56.3	28%	0.281	30%	0.298	S	S	.	.	H	α-helix	trans	-71.7	-32.9	-175.2	-75.4	-75.4	0	0	0	112.5	L276 A279 I280 L310 S316 F317 L318	L276-F314 HydrophobicContact CD2-CD1 3.63Å; L276-F314 HydrophobicContact CD2-CE1 4.23Å; A279-F314 HydrophobicContact CB-CB 4.34Å; A279-F314 HydrophobicContact CB-CD1 3.97Å; A279-F314 HydrophobicContact CB-CD2 3.8Å; A279-F314 HydrophobicContact CB-CE1 4.17Å; A279-F314 HydrophobicContact CB-CE2 4Å; A279-F314 HydrophobicContact CB-CG 3.77Å; A279-F314 HydrophobicContact CB-CZ 4.17Å; I280-F314 HydrophobicContact CD1-CB 4.46Å; I280-F314 HydrophobicContact CG1-CB 3.75Å; L310-F314 HydrophobicContact CD2-CD2 3.52Å; L310-F314 HydrophobicContact CD2-CE2 3.98Å; L310-F314 HydrophobicContact CD2-CG 4.48Å; L310-F314 HydrophobicContact CG-CD2 3.77Å; L310-F314 HydrophobicContact CG-CE2 3.87Å; L310-F314 WeakPolarHBondContact O-CB 3.41Å; L310-F314 VanDerWaalsContact O-CD2 3.31Å; L310-F314 WeakPolarHBondContact O-CD2 2.86Å; L310-F314 PolarHBondContact O-N 2.96Å; F314-S316 VanDerWaalsContact C-N 3.35Å; F314-F317 PolarHBondContact O-N 2.94Å; F314-L318 WeakPolarHBondContact O-CB 3.35Å; F314-L318 PolarHBondContact O-N 3.48Å
315	F	93.3	Very high	91.7	Very high	93 Å²	93	55.4 Å²	55.4	41%	0.408	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-40.3	171.4	-174.9	-106.3	0	0	0	111.5	I280 V311 F317 L318 L319	I280-F315 HydrophobicContact CD1-CB 4.3Å; I280-F315 HydrophobicContact CD1-CD2 4.43Å; V311-F315 WeakPolarHBondContact O-CB 3.37Å; V311-F315 PolarHBondContact O-N 3.23Å; F315-F317 VanDerWaalsContact C-N 3.31Å; F315-F317 PolarHBondContact O-N 2.93Å; F315-L318 PolarHBondContact O-N 3.48Å; F315-L319 HydrophobicContact CD1-CD1 3.89Å; F315-L319 HydrophobicContact CE1-CD1 3.47Å; F315-L319 VanDerWaalsContact CE1-CD1 3.47Å; F315-L319 HydrophobicContact CE1-CG 4.25Å; F315-L319 HydrophobicContact CZ-CD1 4.01Å; F315-L319 HydrophobicContact CZ-CG 4.38Å; F315-L319 PolarHBondContact O-N 2.79Å
316	S	92.3	Very high	91.2	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.8	-39.4	173.5	-170.5	0	0	0	0	112.4	V312 F313 F314 L319 S320 L334 I335	V312-S316 WeakPolarHBondContact O-CB 3.43Å; V312-S316 PolarHBondContact O-N 3.44Å; V312-S316 VanDerWaalsContact O-N 3.1Å; F313-S316 WeakPolarHBondContact O-CB 3.36Å; F313-S316 PolarHBondContact O-N 2.94Å; F314-S316 VanDerWaalsContact C-N 3.35Å; S316-L319 PolarHBondContact O-N 3.01Å; S316-S320 PolarHBondContact O-N 3.37Å; S316-L334 WeakPolarHBondContact OG-CA 3.33Å; S316-L334 WeakPolarHBondContact OG-CB 3.44Å; S316-L334 PolarHBondContact OG-N 3.2Å; S316-I335 PolarHBondContact OG-N 3.47Å
317	F	91.9	Very high	90.4	Very high	78 Å²	78	59.6 Å²	59.6	34%	0.342	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-38.5	179.2	-175.1	-128.7	0	0	0	111.7	L276 F313 F314 F315 L319 S320 I321 I335	L276-F317 HydrophobicContact CD1-CD1 3.96Å; L276-F317 HydrophobicContact CD1-CE1 4.2Å; L276-F317 HydrophobicContact CD2-CD1 3.48Å; L276-F317 VanDerWaalsContact CD2-CD1 3.48Å; L276-F317 HydrophobicContact CD2-CE1 3.93Å; L276-F317 HydrophobicContact CG-CD1 4.38Å; F313-F317 PolarHBondContact O-N 3.38Å; F314-F317 PolarHBondContact O-N 2.94Å; F315-F317 VanDerWaalsContact C-N 3.31Å; F315-F317 PolarHBondContact O-N 2.93Å; F317-L319 VanDerWaalsContact C-N 3.35Å; F317-L319 PolarHBondContact O-N 2.88Å; F317-S320 PolarHBondContact O-N 3.48Å; F317-I321 HydrophobicContact CD1-CD1 4.31Å; F317-I321 HydrophobicContact CE1-CD1 3.89Å; F317-I321 HydrophobicContact CE2-CD1 4.33Å; F317-I321 HydrophobicContact CE2-CG1 4.4Å; F317-I321 HydrophobicContact CZ-CD1 3.9Å; F317-I321 HydrophobicContact CZ-CG1 4.42Å; F317-I321 PolarHBondContact O-N 3.37Å; F317-I335 HydrophobicContact CB-CD1 4.42Å
318	L	91.4	Very high	89.7	Confident	39 Å²	39	62.7 Å²	62.7	20%	0.204	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-43.2	172.8	-175.2	149.9	0	0	0	111.7	L276 I280 F314 F315 I321 F322	L276-L318 HydrophobicContact CB-CD1 4.45Å; L276-L318 HydrophobicContact CD1-CB 4.39Å; I280-L318 HydrophobicContact CD1-CD1 4.04Å; F314-L318 WeakPolarHBondContact O-CB 3.35Å; F314-L318 PolarHBondContact O-N 3.48Å; F315-L318 PolarHBondContact O-N 3.48Å; L318-I321 PolarHBondContact O-N 3Å; L318-F322 WeakPolarHBondContact O-CB 3.3Å; L318-F322 PolarHBondContact O-N 3.22Å
319	L	89.6	Confident	89.1	Confident	24 Å²	24	61.5 Å²	61.5	13%	0.126	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-39.5	175.8	-79.7	170.5	0	0	0	113	F315 S316 F317 F322 R323 Y329 F333	F315-L319 HydrophobicContact CD1-CD1 3.89Å; F315-L319 HydrophobicContact CE1-CD1 3.47Å; F315-L319 VanDerWaalsContact CE1-CD1 3.47Å; F315-L319 HydrophobicContact CE1-CG 4.25Å; F315-L319 HydrophobicContact CZ-CD1 4.01Å; F315-L319 HydrophobicContact CZ-CG 4.38Å; F315-L319 PolarHBondContact O-N 2.79Å; S316-L319 PolarHBondContact O-N 3.01Å; F317-L319 VanDerWaalsContact C-N 3.35Å; F317-L319 PolarHBondContact O-N 2.88Å; L319-F322 PolarHBondContact O-N 3.38Å; L319-R323 WeakPolarHBondContact O-CB 3Å; L319-R323 PolarHBondContact O-N 3.5Å; L319-Y329 HydrophobicContact CD2-CE1 3.95Å; L319-F333 HydrophobicContact CD1-CB 3.96Å
320	S	89.4	Confident	88.5	Confident	23 Å²	23	64.1 Å²	64.1	16%	0.161	33%	0.326	C	S	.	.	H	α-helix	trans	-61.8	-45.1	175.5	173.4	0	0	0	0	111.3	S316 F317 F322 R323 S324 K336	S316-S320 PolarHBondContact O-N 3.37Å; F317-S320 PolarHBondContact O-N 3.48Å; S320-F322 PolarHBondContact O-N 2.86Å; S320-R323 PolarHBondContact O-N 3.46Å; S320-S324 PolarHBondContact O-N 3.03Å; S320-K336 PolarHBondContact OG-O 2.82Å
321	I	88.7	Confident	87.8	Confident	19 Å²	19	70.3 Å²	70.3	10%	0.097	35%	0.348	C	S	.	.	H	α-helix	trans	-61.3	-45.3	174.1	-67.7	172.9	0	0	0	111.1	I258 I272 I273 L276 F317 L318 R323 S324 K325	I258-I321 HydrophobicContact CD1-CG1 4.28Å; I258-I321 HydrophobicContact CD1-CG2 4.1Å; I272-I321 HydrophobicContact CG2-CD1 4.06Å; I273-I321 HydrophobicContact CD1-CG2 4.43Å; L276-I321 HydrophobicContact CD1-CD1 3.69Å; F317-I321 HydrophobicContact CD1-CD1 4.31Å; F317-I321 HydrophobicContact CE1-CD1 3.89Å; F317-I321 HydrophobicContact CE2-CD1 4.33Å; F317-I321 HydrophobicContact CE2-CG1 4.4Å; F317-I321 HydrophobicContact CZ-CD1 3.9Å; F317-I321 HydrophobicContact CZ-CG1 4.42Å; F317-I321 PolarHBondContact O-N 3.37Å; L318-I321 PolarHBondContact O-N 3Å; I321-R323 VanDerWaalsContact C-N 3.32Å; I321-R323 PolarHBondContact O-N 2.92Å; I321-S324 WeakPolarHBondContact O-CB 3.42Å; I321-S324 PolarHBondContact O-N 3.33Å; I321-K325 PolarHBondContact O-N 3.4Å; I321-K325 VanDerWaalsContact O-N 3.14Å
322	F	88.6	Confident	86.9	Confident	97 Å²	97	71.8 Å²	71.8	43%	0.425	36%	0.36	S	S	.	.	H	α-helix	trans	-59.9	-43.2	179.3	-178.5	-101.4	0	0	0	111.8	L318 L319 S320 K325 Y326 Y329	L318-F322 WeakPolarHBondContact O-CB 3.3Å; L318-F322 PolarHBondContact O-N 3.22Å; L319-F322 PolarHBondContact O-N 3.38Å; S320-F322 PolarHBondContact O-N 2.86Å; F322-K325 PolarHBondContact O-N 3.45Å; F322-Y326 PolarHBondContact O-N 3.22Å; F322-Y329 HydrophobicContact CD1-CD1 4.18Å; F322-Y329 HydrophobicContact CD1-CD2 4.25Å; F322-Y329 HydrophobicContact CD1-CE1 4.47Å; F322-Y329 HydrophobicContact CD1-CG 4.05Å; F322-Y329 HydrophobicContact CE1-CD1 4.41Å; F322-Y329 AromaticContact CE1-CD2 3.67Å; F322-Y329 HydrophobicContact CE1-CD2 3.67Å; F322-Y329 HydrophobicContact CE1-CE2 4.02Å; F322-Y329 AromaticContact CE1-CG 3.87Å; F322-Y329 HydrophobicContact CE1-CG 3.87Å
323	R	87.1	Confident	85.9	Confident	79 Å²	79	75 Å²	75	30%	0.298	37%	0.371	S	S	.	.	H	α-helix	trans	-65.9	-40.6	177.4	-173.1	-175.1	-175.5	-174.1	6.8	112.7	L319 S320 I321 K325 Y326 H327 K336	L319-R323 WeakPolarHBondContact O-CB 3Å; L319-R323 PolarHBondContact O-N 3.5Å; S320-R323 PolarHBondContact O-N 3.46Å; I321-R323 VanDerWaalsContact C-N 3.32Å; I321-R323 PolarHBondContact O-N 2.92Å; R323-K325 PolarHBondContact O-N 3.4Å; R323-Y326 CarbonylContact O-C 3.29Å; R323-Y326 PolarHBondContact O-N 2.87Å; R323-Y326 VanDerWaalsContact O-O 3.09Å; R323-H327 PolarHBondContact O-N 3.2Å; R323-K336 PolarHBondContact NH1-OXT 3.37Å
324	S	84.5	Confident	85	Confident	73 Å²	73	75.3 Å²	75.3	51%	0.51	38%	0.377	S	S	.	.	H	α-helix	trans	-57.5	-36.5	174	-178.9	0	0	0	0	111.6	S320 I321 H327	S320-S324 PolarHBondContact O-N 3.03Å; I321-S324 WeakPolarHBondContact O-CB 3.42Å; I321-S324 PolarHBondContact O-N 3.33Å; S324-H327 PolarHBondContact O-CE1 3.42Å
325	K	86.8	Confident	84	Confident	34 Å²	34	75.1 Å²	75.1	15%	0.148	38%	0.378	C	S	.	.	H	α-helix	trans	-80.8	-34.3	176.7	-159	167.5	-171.7	171.7	0	113.1	S261 A264 E269 I321 F322 R323	S261-K325 WeakPolarHBondContact O-CE 3.49Å; A264-K325 WeakPolarHBondContact O-CE 2.93Å; A264-K325 PolarHBondContact O-NZ 3.48Å; E269-K325 IonicContact OE2-NZ 3.68Å; E269-K325 PolarHBondContact OE2-NZ 3.01Å; I321-K325 PolarHBondContact O-N 3.4Å; I321-K325 VanDerWaalsContact O-N 3.14Å; F322-K325 PolarHBondContact O-N 3.45Å; R323-K325 PolarHBondContact O-N 3.4Å
326	Y	84.1	Confident	82.7	Confident	126 Å²	126	79.5 Å²	79.5	49%	0.494	40%	0.397	S	S	.	.			trans	-117.7	84.6	-179.5	-150.9	-92	0	0	0	110.9	F322 R323 G328 Y329	F322-Y326 PolarHBondContact O-N 3.22Å; R323-Y326 CarbonylContact O-C 3.29Å; R323-Y326 PolarHBondContact O-N 2.87Å; R323-Y326 VanDerWaalsContact O-O 3.09Å; Y326-G328 PolarHBondContact O-N 3.11Å; Y326-Y329 WeakPolarHBondContact O-CB 3.32Å; Y326-Y329 PolarHBondContact O-N 3.19Å
327	H	77.9	Confident	82.2	Confident	156 Å²	156	83.5 Å²	83.5	72%	0.722	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-22	-172.7	-67.8	71.5	0	0	0	114.3	R323 S324 Y329	R323-H327 PolarHBondContact O-N 3.2Å; S324-H327 PolarHBondContact O-CE1 3.42Å; H327-Y329 VanDerWaalsContact C-N 3.35Å
328	G	78.2	Confident	81.7	Confident	65 Å²	65	83.7 Å²	83.7	67%	0.67	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	0.2	177	0	0	0	0	0	115.4	Y326 P330	Y326-G328 PolarHBondContact O-N 3.11Å; G328-P330 WeakPolarHBondContact O-CD 3.1Å
329	Y	83.1	Confident	81.1	Confident	69 Å²	69	86.2 Å²	86.2	27%	0.271	43%	0.433	S	S	.	.			trans	-78.8	120.9	-177.5	-168.1	-105.5	0	0	0	111.7	L319 F322 Y326 H327 Y331	L319-Y329 HydrophobicContact CD2-CE1 3.95Å; F322-Y329 HydrophobicContact CD1-CD1 4.18Å; F322-Y329 HydrophobicContact CD1-CD2 4.25Å; F322-Y329 HydrophobicContact CD1-CE1 4.47Å; F322-Y329 HydrophobicContact CD1-CG 4.05Å; F322-Y329 HydrophobicContact CE1-CD1 4.41Å; F322-Y329 AromaticContact CE1-CD2 3.67Å; F322-Y329 HydrophobicContact CE1-CD2 3.67Å; F322-Y329 HydrophobicContact CE1-CE2 4.02Å; F322-Y329 AromaticContact CE1-CG 3.87Å; F322-Y329 HydrophobicContact CE1-CG 3.87Å; Y326-Y329 WeakPolarHBondContact O-CB 3.32Å; Y326-Y329 PolarHBondContact O-N 3.19Å; H327-Y329 VanDerWaalsContact C-N 3.35Å; Y329-Y331 WeakPolarHBondContact CD1-O 3.48Å; Y329-Y331 HydrophobicContact CE1-CD2 4.33Å; Y329-Y331 VanDerWaalsContact CE1-O 3.28Å; Y329-Y331 WeakPolarHBondContact CE1-O 3.33Å; Y329-Y331 HydrophobicContact CE2-CD2 4.18Å; Y329-Y331 AromaticContact CZ-CD2 3.9Å
330	P	79.6	Confident	80.6	Confident	92 Å²	92	89.9 Å²	89.9	60%	0.597	45%	0.451	S	S	*	.			trans	-88.8	-15.7	-168.1	33.2	-35	0	0	0	114.8	G328	G328-P330 WeakPolarHBondContact O-CD 3.1Å
331	Y	80.6	Confident	80.1	Confident	160 Å²	160	94.1 Å²	94.1	63%	0.627	47%	0.469	S	S	*	.			trans	-96.5	139.3	-172.1	-53.9	-70.5	0	0	0	112.3	Y329	Y329-Y331 WeakPolarHBondContact CD1-O 3.48Å; Y329-Y331 HydrophobicContact CE1-CD2 4.33Å; Y329-Y331 VanDerWaalsContact CE1-O 3.28Å; Y329-Y331 WeakPolarHBondContact CE1-O 3.33Å; Y329-Y331 HydrophobicContact CE2-CD2 4.18Å; Y329-Y331 AromaticContact CZ-CD2 3.9Å
332	S	74.7	Confident	79.5	Confident	61 Å²	61	99.1 Å²	99.1	43%	0.427	49%	0.494	S	S	.	.			trans	-132.8	146	171	63	0	0	0	0	109.6
333	F	74.7	Confident	78.8	Confident	111 Å²	111	99.2 Å²	99.2	49%	0.487	50%	0.499	S	S	.	.	S	Bend	trans	-95.6	-78.4	179.1	-162.6	-127.9	0	0	0	112.2	V312 L319	V312-F333 HydrophobicContact CB-CE1 4.35Å; V312-F333 HydrophobicContact CG1-CE1 3.87Å; V312-F333 HydrophobicContact CG2-CE1 4.28Å; L319-F333 HydrophobicContact CD1-CB 3.96Å
334	L	74.8	Confident	78.2	Confident	119 Å²	119	100.8 Å²	100.8	62%	0.623	51%	0.514	S	S	*	.	S	Bend	trans	-119.9	-38.6	178.3	-66.4	175.2	0	0	0	113.3	V312 S316	V312-L334 HydrophobicContact CG1-CD1 3.26Å; V312-L334 HydrophobicContact CG1-CG 4.45Å; S316-L334 WeakPolarHBondContact OG-CA 3.33Å; S316-L334 WeakPolarHBondContact OG-CB 3.44Å; S316-L334 PolarHBondContact OG-N 3.2Å
335	I	72.2	Confident	77.7	Confident	59 Å²	59	103.1 Å²	103.1	30%	0.303	51%	0.514	S	S	.	.			trans	-104.8	131.6	-179.8	-57.2	170.5	0	0	0	107.4	F313 S316 F317	F313-I335 HydrophobicContact CD2-CD1 4.39Å; F313-I335 HydrophobicContact CE2-CD1 4.01Å; S316-I335 PolarHBondContact OG-N 3.47Å; F317-I335 HydrophobicContact CB-CD1 4.42Å
336	K	65.7	Low	76.9	Confident	185 Å²	185	109.4 Å²	109.4	80%	0.804	55%	0.548	S	S	*	.			trans	-79	0	-178.2	-90.2	-174.9	178.4	174.8	0	113.8	S320 R323	S320-K336 PolarHBondContact OG-O 2.82Å; R323-K336 PolarHBondContact NH1-OXT 3.37Å

Retrieved 336 of 336 residues in 77.8 ms (Link to these results)

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