A0A096MAC3_POEFO Loading...

ST8 alpha-N-acetyl-neuraminide alpha-2,8-sialyltransferase 3

AlphaFold DB , UniProt , Accession A0A096MAC3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 405 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	45.3	Very low	49.2	Very low	206 Å²	206	135.4 Å²	135.4	100%	1.015	66%	0.656	S	S	*	*				0	-53.2	0	-74.8	178.8	-160.3	0	0	114.3	R3 A4 W5	M1-R3 PolarHBondContact O-N 3.42Å; M1-A4 PolarHBondContact O-N 2.9Å; M1-W5 PolarHBondContact O-N 2.99Å
2	R	38.4	Very low	49.5	Very low	224 Å²	224	129.8 Å²	129.8	85%	0.845	65%	0.648	S	S	*	*	H	α-helix	trans	-58.4	-38	-179	-79.3	-175.7	176.7	-165.3	-1.1	115.5	W5 L6	R2-W5 PolarHBondContact O-N 3.19Å; R2-L6 PolarHBondContact O-N 3.12Å
3	R	42.8	Very low	49.4	Very low	228 Å²	228	127.3 Å²	127.3	86%	0.86	64%	0.638	S	S	*	*	H	α-helix	trans	-69.6	-36.6	178.7	-70	-174.5	-173.2	-178.5	2	113.4	M1 W5 L6 S7	M1-R3 PolarHBondContact O-N 3.42Å; R3-W5 VanDerWaalsContact C-N 3.34Å; R3-L6 PolarHBondContact O-N 2.62Å; R3-S7 PolarHBondContact O-N 2.85Å; R3-S7 VanDerWaalsContact O-N 3.15Å
4	A	48.2	Very low	49.5	Very low	62 Å²	62	131.1 Å²	131.1	51%	0.512	64%	0.641	S	S	.	*	H	α-helix	trans	-70.1	-31.6	176.1	0	0	0	0	0	112.4	M1 S7 A8	M1-A4 PolarHBondContact O-N 2.9Å; A4-S7 PolarHBondContact O-OG 3.37Å; A4-A8 WeakPolarHBondContact O-CB 3.37Å; A4-A8 PolarHBondContact O-N 3.47Å; A4-A8 VanDerWaalsContact O-N 3.1Å
5	W	45.8	Very low	49.6	Very low	177 Å²	177	127.9 Å²	127.9	67%	0.67	63%	0.634	S	S	*	*	H	α-helix	trans	-68.9	-42.2	173.5	-96.8	87.2	0	0	0	112.6	M1 R2 R3 S7 A8 L9	M1-W5 PolarHBondContact O-N 2.99Å; R2-W5 PolarHBondContact O-N 3.19Å; R3-W5 VanDerWaalsContact C-N 3.34Å; W5-S7 VanDerWaalsContact C-N 3.34Å; W5-S7 PolarHBondContact O-N 3.39Å; W5-A8 PolarHBondContact O-N 2.9Å; W5-L9 WeakPolarHBondContact O-CB 3.39Å; W5-L9 PolarHBondContact O-N 2.98Å
6	L	47	Very low	49.7	Very low	105 Å²	105	125.3 Å²	125.3	55%	0.55	62%	0.623	S	S	.	*	H	α-helix	trans	-66.8	-33.7	176.6	-83.1	156.6	0	0	0	112.7	R2 R3 R10	R2-L6 PolarHBondContact O-N 3.12Å; R3-L6 PolarHBondContact O-N 2.62Å; L6-R10 WeakPolarHBondContact O-CG 3.13Å; L6-R10 PolarHBondContact O-N 3.32Å; L6-R10 VanDerWaalsContact O-N 3.14Å
7	S	54.4	Low	49.8	Very low	72 Å²	72	121.4 Å²	121.4	50%	0.503	62%	0.615	S	S	.	*	H	α-helix	trans	-71.8	-40.2	175	63.8	0	0	0	0	112.1	R3 A4 W5 R10 A11	R3-S7 PolarHBondContact O-N 2.85Å; R3-S7 VanDerWaalsContact O-N 3.15Å; A4-S7 PolarHBondContact O-OG 3.37Å; W5-S7 VanDerWaalsContact C-N 3.34Å; W5-S7 PolarHBondContact O-N 3.39Å; S7-R10 PolarHBondContact O-N 2.9Å; S7-A11 WeakPolarHBondContact O-CB 3.45Å; S7-A11 PolarHBondContact O-N 2.8Å
8	A	54.5	Low	49.8	Very low	57 Å²	57	121.8 Å²	121.8	47%	0.471	61%	0.614	S	S	.	*	H	α-helix	trans	-64.9	-40.1	176	0	0	0	0	0	112	A4 W5 A11 A12	A4-A8 WeakPolarHBondContact O-CB 3.37Å; A4-A8 PolarHBondContact O-N 3.47Å; A4-A8 VanDerWaalsContact O-N 3.1Å; W5-A8 PolarHBondContact O-N 2.9Å; A8-A11 PolarHBondContact O-N 3Å; A8-A12 WeakPolarHBondContact O-CB 3.38Å; A8-A12 PolarHBondContact O-N 3.45Å
9	L	48.6	Very low	49.8	Very low	98 Å²	98	119.1 Å²	119.1	51%	0.513	61%	0.613	S	S	.	*	H	α-helix	trans	-65.6	-40.5	176.7	-150.8	89.7	0	0	0	111.9	W5 A12 L13	W5-L9 WeakPolarHBondContact O-CB 3.39Å; W5-L9 PolarHBondContact O-N 2.98Å; L9-A12 PolarHBondContact O-N 3.08Å; L9-L13 HydrophobicContact CD2-CD1 4.23Å; L9-L13 HydrophobicContact CG-CD1 4.17Å; L9-L13 WeakPolarHBondContact O-CB 3.34Å; L9-L13 VanDerWaalsContact O-CG 3.31Å; L9-L13 WeakPolarHBondContact O-CG 3.37Å; L9-L13 PolarHBondContact O-N 3.47Å; L9-L13 VanDerWaalsContact O-N 3.12Å
10	R	55	Low	49.8	Very low	194 Å²	194	120.6 Å²	120.6	73%	0.732	62%	0.621	S	S	*	*	H	α-helix	trans	-67.3	-36.9	175.6	-77.9	-179.3	-179.5	-174.1	-0.3	112.6	L6 S7 R14	L6-R10 WeakPolarHBondContact O-CG 3.13Å; L6-R10 PolarHBondContact O-N 3.32Å; L6-R10 VanDerWaalsContact O-N 3.14Å; S7-R10 PolarHBondContact O-N 2.9Å; R10-R14 PolarHBondContact O-N 2.79Å
11	A	61.2	Low	49.8	Very low	66 Å²	66	120.9 Å²	120.9	55%	0.545	63%	0.628	S	S	.	*	H	α-helix	trans	-67.5	-38.9	175.7	0	0	0	0	0	111.9	S7 A8	S7-A11 WeakPolarHBondContact O-CB 3.45Å; S7-A11 PolarHBondContact O-N 2.8Å; A8-A11 PolarHBondContact O-N 3Å
12	A	52.4	Low	49.9	Very low	68 Å²	68	122 Å²	122	56%	0.562	62%	0.621	S	S	*	*	H	α-helix	trans	-71.4	-28.5	178.5	0	0	0	0	0	113.7	A8 L9	A8-A12 WeakPolarHBondContact O-CB 3.38Å; A8-A12 PolarHBondContact O-N 3.45Å; L9-A12 PolarHBondContact O-N 3.08Å
13	L	48.9	Very low	50.2	Low	98 Å²	98	117.2 Å²	117.2	51%	0.513	61%	0.612	S	S	.	*	H	α-helix	trans	-91.8	-12.4	-178.2	-69.2	169.4	0	0	0	114.1	L9 L16 A17	L9-L13 HydrophobicContact CD2-CD1 4.23Å; L9-L13 HydrophobicContact CG-CD1 4.17Å; L9-L13 WeakPolarHBondContact O-CB 3.34Å; L9-L13 VanDerWaalsContact O-CG 3.31Å; L9-L13 WeakPolarHBondContact O-CG 3.37Å; L9-L13 PolarHBondContact O-N 3.47Å; L9-L13 VanDerWaalsContact O-N 3.12Å; L13-L16 HydrophobicContact CD2-CD1 4.12Å; L13-L16 WeakPolarHBondContact O-CB 3.34Å; L13-L16 PolarHBondContact O-N 3.43Å; L13-A17 PolarHBondContact O-N 3.02Å
14	R	49.9	Very low	50.3	Low	180 Å²	180	110.9 Å²	110.9	68%	0.679	62%	0.617	S	S	*	*	H	α-helix	trans	-61	-44.4	179.9	-127.6	-179.2	-167.4	-161	1.1	114.2	R10 L16 A17 E18	R10-R14 PolarHBondContact O-N 2.79Å; R14-L16 PolarHBondContact O-N 2.91Å; R14-A17 PolarHBondContact O-N 2.89Å; R14-E18 PolarHBondContact O-N 2.88Å
15	P	51.8	Low	50.2	Low	83 Å²	83	109.9 Å²	109.9	54%	0.539	61%	0.613	S	S	.	*	H	α-helix	trans	-65.4	-27.1	177.8	-18.7	31	0	0	0	113.2	A19	P15-A19 WeakPolarHBondContact O-CB 3.43Å; P15-A19 PolarHBondContact O-N 3.39Å; P15-A19 VanDerWaalsContact O-N 3.08Å
16	L	51.6	Low	50.3	Low	86 Å²	86	107.9 Å²	107.9	45%	0.45	63%	0.625	S	S	.	*	H	α-helix	trans	-74	-36.3	179	-92.1	148.4	0	0	0	112.6	L13 R14 L20	L13-L16 HydrophobicContact CD2-CD1 4.12Å; L13-L16 WeakPolarHBondContact O-CB 3.34Å; L13-L16 PolarHBondContact O-N 3.43Å; R14-L16 PolarHBondContact O-N 2.91Å; L16-L20 PolarHBondContact O-N 3.33Å
17	A	51.6	Low	50.4	Low	59 Å²	59	105.7 Å²	105.7	49%	0.488	62%	0.617	S	S	.	*	H	α-helix	trans	-70.3	-37.1	174.1	0	0	0	0	0	111.7	L13 R14 L20 V21	L13-A17 PolarHBondContact O-N 3.02Å; R14-A17 PolarHBondContact O-N 2.89Å; A17-L20 PolarHBondContact O-N 3.35Å; A17-V21 WeakPolarHBondContact O-CG2 3.45Å
18	E	49	Very low	50.5	Low	129 Å²	129	113.3 Å²	113.3	60%	0.603	64%	0.635	S	S	*	*	H	α-helix	trans	-71.7	-31.6	177.6	-72.1	174.6	-179.6	0	0	112.7	R14 L20	R14-E18 PolarHBondContact O-N 2.88Å; E18-L20 VanDerWaalsContact C-N 3.34Å
19	A	50.8	Low	50.3	Low	71 Å²	71	121.3 Å²	121.3	59%	0.587	65%	0.653	S	S	*	*	H	α-helix	trans	-71.4	-24.6	174.8	0	0	0	0	0	113.9	P15	P15-A19 WeakPolarHBondContact O-CB 3.43Å; P15-A19 PolarHBondContact O-N 3.39Å; P15-A19 VanDerWaalsContact O-N 3.08Å
20	L	48.8	Very low	50.3	Low	148 Å²	148	119 Å²	119	78%	0.775	65%	0.653	S	S	*	*	H	α-helix	trans	-83.7	-19.5	178	-81.7	163.3	0	0	0	113.6	L16 A17 E18	L16-L20 PolarHBondContact O-N 3.33Å; A17-L20 PolarHBondContact O-N 3.35Å; E18-L20 VanDerWaalsContact C-N 3.34Å
21	V	50.5	Low	50.1	Low	127 Å²	127	118.9 Å²	118.9	77%	0.77	65%	0.652	S	S	*	*	H	α-helix	trans	-94.7	-16.2	-176.2	175.3	0	0	0	0	112.8	A17	A17-V21 WeakPolarHBondContact O-CG2 3.45Å
22	R	46.1	Very low	49.7	Very low	231 Å²	231	121.1 Å²	121.1	87%	0.872	65%	0.653	S	S	*	*	S	Bend	trans	-100.8	1	-174.4	-88.8	-171	179.6	-160.6	1	117.1
23	D	44.5	Very low	49.7	Very low	122 Å²	122	122.6 Å²	122.6	65%	0.652	65%	0.654	S	S	*	*			trans	-117.1	78.7	-178.7	-132.8	3.3	0	0	0	111.4	G25	D23-G25 PolarHBondContact O-N 3.03Å
24	G	46.5	Very low	50	Low	95 Å²	95	127.8 Å²	127.8	98%	0.979	67%	0.667	S	S	*	*			trans	-75.6	46.7	167.5	0	0	0	0	0	112.6
25	G	45.5	Very low	50.4	Low	41 Å²	41	124 Å²	124	42%	0.423	66%	0.659	S	S	.	*	S	Bend	trans	-153.2	126.6	-177.5	0	0	0	0	0	111.9	D23 P27	D23-G25 PolarHBondContact O-N 3.03Å; G25-P27 WeakPolarHBondContact O-CD 3.44Å
26	C	48.1	Very low	50.6	Low	135 Å²	135	123 Å²	123	91%	0.912	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-60.3	116.5	-174.3	-165.5	0	0	0	0	112.7
27	P	48.2	Very low	51	Low	60 Å²	60	122.5 Å²	122.5	39%	0.39	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-91.4	135.2	177.5	3.6	15.4	0	0	0	111.6	G25 R29	G25-P27 WeakPolarHBondContact O-CD 3.44Å; P27-R29 PolarHBondContact O-N 2.98Å
28	R	56.7	Low	51.6	Low	231 Å²	231	122 Å²	122	87%	0.872	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-50.7	130.3	177.1	-70.4	179.6	176.4	-178.2	-1.5	112.2	G30 R31	R28-G30 PolarHBondContact O-N 3.34Å; R28-R31 PolarHBondContact O-N 3.06Å
29	R	51.1	Low	52.6	Low	225 Å²	225	119.3 Å²	119.3	85%	0.849	65%	0.647	S	S	*	*	H	α-helix	trans	-42	-27.1	-175.5	-156.4	171.3	-174.7	176.9	0.8	116.2	P27 V33	P27-R29 PolarHBondContact O-N 2.98Å; R29-V33 WeakPolarHBondContact O-CG2 3.44Å
30	G	48.5	Very low	53.6	Low	50 Å²	50	117.8 Å²	117.8	52%	0.515	64%	0.639	S	S	.	*	H	α-helix	trans	-75.1	-24	179	0	0	0	0	0	116	R28	R28-G30 PolarHBondContact O-N 3.34Å
31	R	51.2	Low	54.4	Low	192 Å²	192	116 Å²	116	73%	0.725	63%	0.629	S	S	*	*	H	α-helix	trans	-80.3	-37.7	-178.1	-140.5	178.4	-158.4	-177.5	5.2	112	R28 V33 R34 I35	R28-R31 PolarHBondContact O-N 3.06Å; R31-V33 PolarHBondContact O-N 3.38Å; R31-R34 PolarHBondContact O-N 3.07Å; R31-I35 WeakPolarHBondContact O-CG1 2.86Å; R31-I35 PolarHBondContact O-N 3.25Å
32	M	51.3	Low	55.5	Low	112 Å²	112	115 Å²	115	55%	0.552	62%	0.618	S	S	*	*	H	α-helix	trans	-64	-37.5	175.8	-85.6	-169.5	-83.3	0	0	112.9	R34 I35 A36	M32-R34 PolarHBondContact O-N 3.45Å; M32-I35 PolarHBondContact O-N 3.45Å; M32-A36 WeakPolarHBondContact O-CB 3.38Å; M32-A36 PolarHBondContact O-N 3.47Å
33	V	52.9	Low	56.9	Low	99 Å²	99	109.6 Å²	109.6	60%	0.6	61%	0.605	S	S	*	*	H	α-helix	trans	-66.4	-39.4	179.8	176.9	0	0	0	0	111.7	R29 R31 S37	R29-V33 WeakPolarHBondContact O-CG2 3.44Å; R31-V33 PolarHBondContact O-N 3.38Å; V33-S37 VanDerWaalsContact O-CB 3.31Å; V33-S37 WeakPolarHBondContact O-CB 3.38Å; V33-S37 PolarHBondContact O-N 2.92Å
34	R	55.1	Low	58	Low	207 Å²	207	110 Å²	110	78%	0.781	60%	0.601	S	S	*	*	H	α-helix	trans	-68.4	-37.9	177.2	-68.3	-175.9	-174.9	-175	1.4	112.2	R31 M32 A38	R31-R34 PolarHBondContact O-N 3.07Å; M32-R34 PolarHBondContact O-N 3.45Å; R34-A38 WeakPolarHBondContact O-CB 3.3Å; R34-A38 PolarHBondContact O-N 2.78Å
35	I	57.9	Low	59.1	Low	100 Å²	100	108.3 Å²	108.3	51%	0.513	58%	0.575	S	S	.	*	H	α-helix	trans	-68.6	-43.8	176.8	-65.7	168	0	0	0	110.6	R31 M32 S37 A38 L39	R31-I35 WeakPolarHBondContact O-CG1 2.86Å; R31-I35 PolarHBondContact O-N 3.25Å; M32-I35 PolarHBondContact O-N 3.45Å; I35-S37 VanDerWaalsContact C-N 3.33Å; I35-S37 PolarHBondContact O-N 2.86Å; I35-A38 PolarHBondContact O-N 3.02Å; I35-L39 HydrophobicContact CG2-CD1 3.82Å; I35-L39 HydrophobicContact CG2-CG 4.41Å; I35-L39 WeakPolarHBondContact O-CB 3.46Å; I35-L39 VanDerWaalsContact O-CG 3.25Å; I35-L39 WeakPolarHBondContact O-CG 3.45Å; I35-L39 PolarHBondContact O-N 3.25Å
36	A	56.1	Low	60.6	Low	63 Å²	63	109.8 Å²	109.8	52%	0.521	58%	0.576	S	S	.	*	H	α-helix	trans	-63.1	-38.8	176.2	0	0	0	0	0	112.4	M32 L39 G40	M32-A36 WeakPolarHBondContact O-CB 3.38Å; M32-A36 PolarHBondContact O-N 3.47Å; A36-L39 PolarHBondContact O-N 2.78Å; A36-G40 PolarHBondContact O-N 2.88Å
37	S	60.5	Low	61.9	Low	75 Å²	75	105.4 Å²	105.4	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-70	-40.3	177.9	-158.7	0	0	0	0	112.2	V33 I35 G40 L41	V33-S37 VanDerWaalsContact O-CB 3.31Å; V33-S37 WeakPolarHBondContact O-CB 3.38Å; V33-S37 PolarHBondContact O-N 2.92Å; I35-S37 VanDerWaalsContact C-N 3.33Å; I35-S37 PolarHBondContact O-N 2.86Å; S37-G40 PolarHBondContact O-N 3.15Å; S37-L41 PolarHBondContact O-N 2.89Å
38	A	64.5	Low	63	Low	48 Å²	48	106.9 Å²	106.9	40%	0.397	55%	0.553	S	S	.	*	H	α-helix	trans	-65.5	-41.1	173.4	0	0	0	0	0	112.3	R34 I35 G40 L41 I42	R34-A38 WeakPolarHBondContact O-CB 3.3Å; R34-A38 PolarHBondContact O-N 2.78Å; I35-A38 PolarHBondContact O-N 3.02Å; A38-G40 VanDerWaalsContact C-N 3.35Å; A38-L41 PolarHBondContact O-N 2.89Å; A38-I42 VanDerWaalsContact O-CG1 3.29Å; A38-I42 WeakPolarHBondContact O-CG1 3.48Å; A38-I42 PolarHBondContact O-N 2.89Å
39	L	69.6	Low	63.8	Low	74 Å²	74	101.8 Å²	101.8	39%	0.387	54%	0.542	S	S	.	.	H	α-helix	trans	-63.9	-39.9	174.4	-74	167.6	0	0	0	111.7	I35 A36 I42 I43	I35-L39 HydrophobicContact CG2-CD1 3.82Å; I35-L39 HydrophobicContact CG2-CG 4.41Å; I35-L39 WeakPolarHBondContact O-CB 3.46Å; I35-L39 VanDerWaalsContact O-CG 3.25Å; I35-L39 WeakPolarHBondContact O-CG 3.45Å; I35-L39 PolarHBondContact O-N 3.25Å; A36-L39 PolarHBondContact O-N 2.78Å; L39-I42 PolarHBondContact O-N 2.85Å; L39-I43 WeakPolarHBondContact O-CB 3.09Å; L39-I43 WeakPolarHBondContact O-CD1 3.46Å; L39-I43 VanDerWaalsContact O-CG1 3.22Å; L39-I43 WeakPolarHBondContact O-CG1 3.05Å; L39-I43 PolarHBondContact O-N 3.5Å
40	G	72.2	Confident	64.8	Low	39 Å²	39	94.7 Å²	94.7	40%	0.402	52%	0.521	S	S	.	.	H	α-helix	trans	-60.4	-44.2	174.1	0	0	0	0	0	112.9	A36 S37 A38 I43 F44	A36-G40 PolarHBondContact O-N 2.88Å; S37-G40 PolarHBondContact O-N 3.15Å; A38-G40 VanDerWaalsContact C-N 3.35Å; G40-I43 PolarHBondContact O-N 2.77Å; G40-F44 WeakPolarHBondContact O-CB 3.39Å; G40-F44 PolarHBondContact O-N 2.95Å
41	L	65.8	Low	65.6	Low	111 Å²	111	97.7 Å²	97.7	58%	0.581	52%	0.524	S	S	*	.	H	α-helix	trans	-65.2	-38.7	177	-80.8	161.1	0	0	0	112.7	S37 A38 S45	S37-L41 PolarHBondContact O-N 2.89Å; A38-L41 PolarHBondContact O-N 2.89Å; L41-S45 WeakPolarHBondContact O-CB 3.3Å; L41-S45 PolarHBondContact O-N 3.29Å; L41-S45 PolarHBondContact O-OG 3.35Å
42	I	73.8	Confident	66.5	Low	104 Å²	104	92.1 Å²	92.1	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-67.4	-45.9	176.9	-68.4	166.2	0	0	0	110.2	A38 L39 F44 S45 V46	A38-I42 VanDerWaalsContact O-CG1 3.29Å; A38-I42 WeakPolarHBondContact O-CG1 3.48Å; A38-I42 PolarHBondContact O-N 2.89Å; L39-I42 PolarHBondContact O-N 2.85Å; I42-F44 VanDerWaalsContact C-N 3.31Å; I42-F44 PolarHBondContact O-N 3.35Å; I42-S45 PolarHBondContact O-N 2.96Å; I42-V46 HydrophobicContact CG2-CG2 4.43Å; I42-V46 VanDerWaalsContact O-CG2 3.29Å; I42-V46 WeakPolarHBondContact O-CG2 3.27Å; I42-V46 PolarHBondContact O-N 3.11Å
43	I	75	Confident	67	Low	118 Å²	118	92.1 Å²	92.1	61%	0.605	52%	0.517	S	S	*	.	H	α-helix	trans	-61.4	-42.8	177.7	-68.5	165.9	0	0	0	110.5	L39 G40 V46 A47	L39-I43 WeakPolarHBondContact O-CB 3.09Å; L39-I43 WeakPolarHBondContact O-CD1 3.46Å; L39-I43 VanDerWaalsContact O-CG1 3.22Å; L39-I43 WeakPolarHBondContact O-CG1 3.05Å; L39-I43 PolarHBondContact O-N 3.5Å; G40-I43 PolarHBondContact O-N 2.77Å; I43-V46 PolarHBondContact O-N 3.07Å; I43-A47 WeakPolarHBondContact O-CB 3.44Å; I43-A47 PolarHBondContact O-N 3.35Å
44	F	68.5	Low	67.5	Low	130 Å²	130	92.1 Å²	92.1	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-63.3	-43	177	-171.8	-105.3	0	0	0	112.3	G40 I42 A47 L48	G40-F44 WeakPolarHBondContact O-CB 3.39Å; G40-F44 PolarHBondContact O-N 2.95Å; I42-F44 VanDerWaalsContact C-N 3.31Å; I42-F44 PolarHBondContact O-N 3.35Å; F44-A47 PolarHBondContact O-N 3.36Å; F44-L48 HydrophobicContact CD1-CD1 3.88Å; F44-L48 HydrophobicContact CD1-CG 4.48Å; F44-L48 HydrophobicContact CE1-CD1 3.48Å; F44-L48 VanDerWaalsContact CE1-CD1 3.48Å; F44-L48 HydrophobicContact CE1-CG 4.2Å; F44-L48 HydrophobicContact CZ-CD1 4.07Å; F44-L48 HydrophobicContact CZ-CG 4.4Å; F44-L48 WeakPolarHBondContact O-CG 3.41Å; F44-L48 PolarHBondContact O-N 3.37Å
45	S	68.4	Low	67.8	Low	60 Å²	60	85.3 Å²	85.3	42%	0.42	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-40.5	178.1	-58.7	0	0	0	0	112.2	L41 I42 L48 L49	L41-S45 WeakPolarHBondContact O-CB 3.3Å; L41-S45 PolarHBondContact O-N 3.29Å; L41-S45 PolarHBondContact O-OG 3.35Å; I42-S45 PolarHBondContact O-N 2.96Å; S45-L48 PolarHBondContact O-N 3.06Å; S45-L49 WeakPolarHBondContact O-CG 3.45Å; S45-L49 PolarHBondContact O-N 2.66Å
46	V	77.9	Confident	67.8	Low	73 Å²	73	86.9 Å²	86.9	44%	0.442	50%	0.497	S	S	.	.	H	α-helix	trans	-66.2	-39.9	175.3	172.7	0	0	0	0	111	I42 I43 L49 I50	I42-V46 HydrophobicContact CG2-CG2 4.43Å; I42-V46 VanDerWaalsContact O-CG2 3.29Å; I42-V46 WeakPolarHBondContact O-CG2 3.27Å; I42-V46 PolarHBondContact O-N 3.11Å; I43-V46 PolarHBondContact O-N 3.07Å; V46-L49 PolarHBondContact O-N 2.94Å; V46-I50 HydrophobicContact CG1-CD1 3.83Å; V46-I50 HydrophobicContact CG1-CG1 4.45Å; V46-I50 VanDerWaalsContact O-CG1 3.27Å; V46-I50 WeakPolarHBondContact O-CG1 3.2Å; V46-I50 PolarHBondContact O-N 3.14Å
47	A	74.4	Confident	67.4	Low	42 Å²	42	87.7 Å²	87.7	35%	0.347	50%	0.495	S	S	.	.	H	α-helix	trans	-62.8	-42.2	175.9	0	0	0	0	0	112.2	I43 F44 I50 L51	I43-A47 WeakPolarHBondContact O-CB 3.44Å; I43-A47 PolarHBondContact O-N 3.35Å; F44-A47 PolarHBondContact O-N 3.36Å; A47-I50 PolarHBondContact O-N 3.42Å; A47-L51 WeakPolarHBondContact O-CG 3.42Å; A47-L51 PolarHBondContact O-N 3.36Å
48	L	70.7	Confident	66.8	Low	92 Å²	92	87.2 Å²	87.2	48%	0.482	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-41.7	175.5	-74.5	175.2	0	0	0	112.4	F44 S45 L51 S52	F44-L48 HydrophobicContact CD1-CD1 3.88Å; F44-L48 HydrophobicContact CD1-CG 4.48Å; F44-L48 HydrophobicContact CE1-CD1 3.48Å; F44-L48 VanDerWaalsContact CE1-CD1 3.48Å; F44-L48 HydrophobicContact CE1-CG 4.2Å; F44-L48 HydrophobicContact CZ-CD1 4.07Å; F44-L48 HydrophobicContact CZ-CG 4.4Å; F44-L48 WeakPolarHBondContact O-CG 3.41Å; F44-L48 PolarHBondContact O-N 3.37Å; S45-L48 PolarHBondContact O-N 3.06Å; L48-L51 PolarHBondContact O-N 3.4Å; L48-S52 WeakPolarHBondContact O-CB 3.32Å; L48-S52 PolarHBondContact O-N 3.11Å
49	L	73.8	Confident	65.9	Low	123 Å²	123	89.4 Å²	89.4	64%	0.644	50%	0.496	S	S	*	.	H	α-helix	trans	-64.1	-40.5	175.7	-77	167.2	0	0	0	111.9	S45 V46 S52 L53	S45-L49 WeakPolarHBondContact O-CG 3.45Å; S45-L49 PolarHBondContact O-N 2.66Å; V46-L49 PolarHBondContact O-N 2.94Å; L49-S52 PolarHBondContact O-N 2.96Å; L49-L53 WeakPolarHBondContact O-CB 3.45Å; L49-L53 PolarHBondContact O-N 3.29Å
50	I	72.6	Confident	64.5	Low	77 Å²	77	91.6 Å²	91.6	40%	0.395	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-45	175.7	-69.5	167.2	0	0	0	110.6	V46 A47 S52 L53 I54	V46-I50 HydrophobicContact CG1-CD1 3.83Å; V46-I50 HydrophobicContact CG1-CG1 4.45Å; V46-I50 VanDerWaalsContact O-CG1 3.27Å; V46-I50 WeakPolarHBondContact O-CG1 3.2Å; V46-I50 PolarHBondContact O-N 3.14Å; A47-I50 PolarHBondContact O-N 3.42Å; I50-S52 PolarHBondContact O-N 2.92Å; I50-L53 PolarHBondContact O-N 3.07Å; I50-I54 HydrophobicContact CG2-CD1 3.72Å; I50-I54 HydrophobicContact CG2-CG1 4.37Å; I50-I54 VanDerWaalsContact O-CG1 3.26Å; I50-I54 WeakPolarHBondContact O-CG1 3.44Å; I50-I54 PolarHBondContact O-N 3.07Å
51	L	64.7	Low	63	Low	112 Å²	112	97.7 Å²	97.7	59%	0.586	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-41.4	177.1	-73.2	169	0	0	0	111.9	A47 L48 L53 I54 S55	A47-L51 WeakPolarHBondContact O-CG 3.42Å; A47-L51 PolarHBondContact O-N 3.36Å; L48-L51 PolarHBondContact O-N 3.4Å; L51-L53 VanDerWaalsContact C-N 3.34Å; L51-L53 PolarHBondContact O-N 2.97Å; L51-I54 PolarHBondContact O-N 3.3Å; L51-S55 WeakPolarHBondContact O-CB 3.16Å; L51-S55 PolarHBondContact O-N 3.21Å
52	S	70.3	Confident	61.9	Low	76 Å²	76	98.9 Å²	98.9	53%	0.531	53%	0.525	S	S	.	.	H	α-helix	trans	-61.7	-41.4	173.6	-176.9	0	0	0	0	111.8	L48 L49 I50 S55 Y56	L48-S52 WeakPolarHBondContact O-CB 3.32Å; L48-S52 PolarHBondContact O-N 3.11Å; L49-S52 PolarHBondContact O-N 2.96Å; I50-S52 PolarHBondContact O-N 2.92Å; S52-S55 PolarHBondContact O-N 2.79Å; S52-Y56 WeakPolarHBondContact O-CB 3.39Å; S52-Y56 PolarHBondContact O-N 3.27Å
53	L	62.6	Low	60.1	Low	112 Å²	112	101.9 Å²	101.9	59%	0.586	53%	0.534	S	S	*	.	H	α-helix	trans	-70.6	-39	179.5	-157.2	78.9	0	0	0	111.7	L49 I50 L51 S55 Y56 V57	L49-L53 WeakPolarHBondContact O-CB 3.45Å; L49-L53 PolarHBondContact O-N 3.29Å; I50-L53 PolarHBondContact O-N 3.07Å; L51-L53 VanDerWaalsContact C-N 3.34Å; L51-L53 PolarHBondContact O-N 2.97Å; L53-S55 VanDerWaalsContact C-N 3.32Å; L53-Y56 PolarHBondContact O-N 3.26Å; L53-V57 WeakPolarHBondContact O-CB 3.49Å; L53-V57 VanDerWaalsContact O-CG2 3.22Å; L53-V57 WeakPolarHBondContact O-CG2 3.38Å; L53-V57 PolarHBondContact O-N 3.16Å
54	I	64	Low	58	Low	98 Å²	98	102.9 Å²	102.9	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-63.2	-41.2	173.6	-68.8	166.8	0	0	0	110.5	I50 L51 S58	I50-I54 HydrophobicContact CG2-CD1 3.72Å; I50-I54 HydrophobicContact CG2-CG1 4.37Å; I50-I54 VanDerWaalsContact O-CG1 3.26Å; I50-I54 WeakPolarHBondContact O-CG1 3.44Å; I50-I54 PolarHBondContact O-N 3.07Å; L51-I54 PolarHBondContact O-N 3.3Å; I54-S58 WeakPolarHBondContact O-CB 3.17Å; I54-S58 PolarHBondContact O-N 3.38Å; I54-S58 PolarHBondContact O-OG 2.68Å
55	S	60.6	Low	56.4	Low	65 Å²	65	102.9 Å²	102.9	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-49.2	174.6	-173	0	0	0	0	111.2	L51 S52 L53 V57 S58 I59	L51-S55 WeakPolarHBondContact O-CB 3.16Å; L51-S55 PolarHBondContact O-N 3.21Å; S52-S55 PolarHBondContact O-N 2.79Å; L53-S55 VanDerWaalsContact C-N 3.32Å; S55-V57 PolarHBondContact O-N 3.42Å; S55-S58 PolarHBondContact O-N 3.3Å; S55-I59 WeakPolarHBondContact O-CD1 3.26Å; S55-I59 VanDerWaalsContact O-CG1 3.25Å; S55-I59 WeakPolarHBondContact O-CG1 3.08Å; S55-I59 PolarHBondContact O-N 3.38Å
56	Y	57.1	Low	54.9	Low	132 Å²	132	103 Å²	103	52%	0.518	56%	0.564	S	S	.	*	H	α-helix	trans	-60.9	-43.7	178.3	-179.9	-97.2	0	0	0	112.7	S52 L53 I59 K60	S52-Y56 WeakPolarHBondContact O-CB 3.39Å; S52-Y56 PolarHBondContact O-N 3.27Å; L53-Y56 PolarHBondContact O-N 3.26Å; Y56-I59 PolarHBondContact O-N 3.4Å; Y56-K60 HydrophobicContact CE1-CD 4.05Å; Y56-K60 WeakPolarHBondContact O-CB 3.47Å; Y56-K60 PolarHBondContact O-N 2.9Å
57	V	49.5	Very low	52.6	Low	80 Å²	80	105 Å²	105	49%	0.485	58%	0.579	S	S	.	*	H	α-helix	trans	-69.8	-35	178.8	173	0	0	0	0	111.4	L53 S55 K60 K61	L53-V57 WeakPolarHBondContact O-CB 3.49Å; L53-V57 VanDerWaalsContact O-CG2 3.22Å; L53-V57 WeakPolarHBondContact O-CG2 3.38Å; L53-V57 PolarHBondContact O-N 3.16Å; S55-V57 PolarHBondContact O-N 3.42Å; V57-K60 PolarHBondContact O-N 3.44Å; V57-K61 WeakPolarHBondContact O-CB 3.37Å; V57-K61 PolarHBondContact O-N 2.86Å
58	S	46.9	Very low	50.8	Low	66 Å²	66	108.3 Å²	108.3	46%	0.462	60%	0.597	S	S	.	*	H	α-helix	trans	-65.3	-46.3	173.6	-61.7	0	0	0	0	111.1	I54 S55 K60 K61 D62	I54-S58 WeakPolarHBondContact O-CB 3.17Å; I54-S58 PolarHBondContact O-N 3.38Å; I54-S58 PolarHBondContact O-OG 2.68Å; S55-S58 PolarHBondContact O-N 3.3Å; S58-K60 VanDerWaalsContact C-N 3.33Å; S58-K60 PolarHBondContact O-N 3.43Å; S58-K61 PolarHBondContact O-N 2.88Å; S58-D62 PolarHBondContact O-N 3.02Å
59	I	45.9	Very low	49.2	Very low	93 Å²	93	115.6 Å²	115.6	48%	0.477	62%	0.617	S	S	.	*	H	α-helix	trans	-58.5	-44.8	175.3	-67.7	163.6	0	0	0	110.6	S55 Y56 K61 D62 F63	S55-I59 WeakPolarHBondContact O-CD1 3.26Å; S55-I59 VanDerWaalsContact O-CG1 3.25Å; S55-I59 WeakPolarHBondContact O-CG1 3.08Å; S55-I59 PolarHBondContact O-N 3.38Å; Y56-I59 PolarHBondContact O-N 3.4Å; I59-K61 PolarHBondContact O-N 2.68Å; I59-D62 PolarHBondContact O-N 3.24Å; I59-F63 WeakPolarHBondContact O-CD2 3.07Å
60	K	40.6	Very low	47.4	Very low	120 Å²	120	120 Å²	120	52%	0.522	63%	0.627	S	S	.	*	H	α-helix	trans	-73.4	-26.2	-176.6	-153.5	175.2	-174.1	174.9	0	113.4	Y56 V57 S58 D62 F63	Y56-K60 HydrophobicContact CE1-CD 4.05Å; Y56-K60 WeakPolarHBondContact O-CB 3.47Å; Y56-K60 PolarHBondContact O-N 2.9Å; V57-K60 PolarHBondContact O-N 3.44Å; S58-K60 VanDerWaalsContact C-N 3.33Å; S58-K60 PolarHBondContact O-N 3.43Å; K60-D62 VanDerWaalsContact C-N 3.27Å; K60-D62 PolarHBondContact O-N 2.78Å; K60-F63 PolarHBondContact O-N 3.12Å
61	K	39.6	Very low	45.8	Very low	168 Å²	168	118.7 Å²	118.7	73%	0.73	63%	0.633	S	S	*	*	H	α-helix	trans	-71.6	-24	175.5	-149.1	177.3	-176.1	-179.6	0	112.2	V57 S58 I59 F63	V57-K61 WeakPolarHBondContact O-CB 3.37Å; V57-K61 PolarHBondContact O-N 2.86Å; S58-K61 PolarHBondContact O-N 2.88Å; I59-K61 PolarHBondContact O-N 2.68Å; K61-F63 VanDerWaalsContact C-N 3.28Å; K61-F63 PolarHBondContact O-N 3.03Å
62	D	42.2	Very low	44.4	Very low	136 Å²	136	119.9 Å²	119.9	73%	0.727	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-7.4	173.6	-63.8	-28.3	0	0	0	113.5	S58 I59 K60	S58-D62 PolarHBondContact O-N 3.02Å; I59-D62 PolarHBondContact O-N 3.24Å; K60-D62 VanDerWaalsContact C-N 3.27Å; K60-D62 PolarHBondContact O-N 2.78Å
63	F	36.3	Very low	43	Very low	167 Å²	167	123.3 Å²	123.3	73%	0.732	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	6.9	-175.8	-90.9	-85.1	0	0	0	115.5	I59 K60 K61	I59-F63 WeakPolarHBondContact O-CD2 3.07Å; K60-F63 PolarHBondContact O-N 3.12Å; K61-F63 VanDerWaalsContact C-N 3.28Å; K61-F63 PolarHBondContact O-N 3.03Å
64	L	31.8	Very low	41.9	Very low	139 Å²	139	122.2 Å²	122.2	73%	0.728	68%	0.675	S	S	*	*			trans	-107.3	119.1	176	-70.3	173.4	0	0	0	111.3	G66	L64-G66 PolarHBondContact O-N 3.09Å
65	P	34.2	Very low	40.3	Very low	129 Å²	129	120 Å²	120	84%	0.838	68%	0.677	S	S	*	*			trans	-73.8	110.7	173.1	27.7	-29.3	0	0	0	109.9
66	G	38	Very low	38.7	Very low	64 Å²	64	123.6 Å²	123.6	66%	0.66	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-82	150.5	169	0	0	0	0	0	111.8	L64	L64-G66 PolarHBondContact O-N 3.09Å
67	P	29.7	Very low	37.5	Very low	115 Å²	115	127.6 Å²	127.6	75%	0.747	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-74.2	147.8	-178.3	31.7	-33.3	0	0	0	111.1	R69	P67-R69 PolarHBondContact O-N 3.42Å
68	P	36.3	Very low	36.6	Very low	111 Å²	111	132.7 Å²	132.7	72%	0.721	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-71.4	128.9	-178.6	27.5	-31.5	0	0	0	111.1
69	R	37	Very low	35.7	Very low	244 Å²	244	138.2 Å²	138.2	92%	0.921	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-103.1	125.4	166.9	-73.6	-171	-179.1	-173.9	0.2	109.8	P67	P67-R69 PolarHBondContact O-N 3.42Å
70	Y	35.9	Very low	35.1	Very low	215 Å²	215	142.3 Å²	142.3	84%	0.843	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-81.1	132.5	178.7	-73.5	-91.8	0	0	0	111.1
71	G	38.1	Very low	34.5	Very low	51 Å²	51	145.4 Å²	145.4	53%	0.526	78%	0.779	S	S	.	*	P	Polyproline II helix	trans	-95.6	166.9	169.1	0	0	0	0	0	111.9	N73	G71-N73 PolarHBondContact O-N 3.2Å
72	P	35.7	Very low	34	Very low	137 Å²	137	145.3 Å²	145.3	89%	0.89	78%	0.781	S	S	*	*	S	Bend	trans	-70.9	-5.8	-161	-17.1	30.7	0	0	0	116.6
73	N	40.5	Very low	33.6	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	79%	0.787	S	S	*	*	S	Bend	trans	-125.7	103.3	176.6	-72.4	-17.9	0	0	0	108.3	G71 G75	G71-N73 PolarHBondContact O-N 3.2Å; N73-G75 PolarHBondContact O-N 3.12Å
74	G	39.7	Very low	33.7	Very low	88 Å²	88	140.3 Å²	140.3	91%	0.907	78%	0.781	S	S	*	*	S	Bend	trans	-57.5	78.5	-167.9	0	0	0	0	0	116.7
75	G	30.5	Very low	33.8	Very low	53 Å²	53	142.8 Å²	142.8	55%	0.546	79%	0.786	S	S	.	*	S	Bend	trans	-144.4	141.6	161.7	0	0	0	0	0	110.4	N73 R77	N73-G75 PolarHBondContact O-N 3.12Å; G75-R77 PolarHBondContact O-N 3.19Å
76	P	28.5	Very low	33.9	Very low	139 Å²	139	146 Å²	146	90%	0.903	78%	0.782	S	S	*	*			trans	-69.5	107.8	-177.7	25.6	-31.1	0	0	0	111.1	M78	P76-M78 PolarHBondContact O-N 3.13Å
77	R	30.8	Very low	34.1	Very low	217 Å²	217	145.6 Å²	145.6	82%	0.819	77%	0.768	S	S	*	*			trans	-81.8	96	166.5	-115.7	-179.4	168.9	163	-2.7	108.8	G75	G75-R77 PolarHBondContact O-N 3.19Å
78	M	29.9	Very low	34.7	Very low	187 Å²	187	147.5 Å²	147.5	92%	0.921	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-78	118.6	165	-100.1	-173.7	176.2	0	0	109.3	P76 M80	P76-M78 PolarHBondContact O-N 3.13Å; M78-M80 PolarHBondContact O-N 2.91Å
79	Y	29.1	Very low	34.8	Very low	181 Å²	181	147.8 Å²	147.8	71%	0.71	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-72.9	117.3	171	-76.7	-91.4	0	0	0	109.6	F81	Y79-F81 PolarHBondContact O-N 2.98Å
80	M	32.4	Very low	34.9	Very low	180 Å²	180	137.8 Å²	137.8	89%	0.887	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-62.2	116.9	164.2	-76	-177.3	-160.9	0	0	109.2	M78	M78-M80 PolarHBondContact O-N 2.91Å
81	F	28.6	Very low	35.2	Very low	184 Å²	184	131.7 Å²	131.7	81%	0.807	71%	0.712	S	S	*	*			trans	-109.1	129.2	153.1	-81.7	-80.8	0	0	0	109.1	Y79 T83	Y79-F81 PolarHBondContact O-N 2.98Å; F81-T83 PolarHBondContact O-N 2.72Å
82	H	30	Very low	35.1	Very low	166 Å²	166	136 Å²	136	77%	0.769	72%	0.716	S	S	*	*			trans	-59.5	113.9	-170.7	-79	-105.1	0	0	0	112.8
83	T	32.4	Very low	35.2	Very low	140 Å²	140	138.6 Å²	138.6	86%	0.859	71%	0.709	S	S	*	*			trans	-97.3	12	161	47.3	0	0	0	0	112.8	F81 F85	F81-T83 PolarHBondContact O-N 2.72Å; T83-F85 PolarHBondContact O-N 3.16Å
84	G	38.6	Very low	35.2	Very low	59 Å²	59	137.6 Å²	137.6	61%	0.608	70%	0.703	S	S	*	*			trans	-97.4	68.3	-179.5	0	0	0	0	0	112.8
85	F	34.9	Very low	35.2	Very low	191 Å²	191	137 Å²	137	84%	0.838	68%	0.679	S	S	*	*			trans	-161	61.8	159	-135.8	-92.7	0	0	0	111.1	T83 S87	T83-F85 PolarHBondContact O-N 3.16Å; F85-S87 PolarHBondContact O-N 3.37Å
86	R	36.2	Very low	35.4	Very low	197 Å²	197	140.9 Å²	140.9	74%	0.743	70%	0.695	S	S	*	*			trans	-88.7	90.6	152.7	-74.8	-170.3	175.5	-163.6	-0.6	106.4
87	S	42.2	Very low	35.9	Very low	54 Å²	54	139.9 Å²	139.9	38%	0.378	68%	0.682	S	S	.	*			trans	-55.7	149.8	170.2	58.1	0	0	0	0	109.3	F85 L89 A90	F85-S87 PolarHBondContact O-N 3.37Å; S87-L89 PolarHBondContact O-N 2.94Å; S87-A90 PolarHBondContact O-N 3.37Å
88	Q	42.3	Very low	36.5	Very low	156 Å²	156	133.1 Å²	133.1	73%	0.729	66%	0.659	S	S	*	*	H	α-helix	trans	-49.1	-26.2	175.7	-67.5	173	-12.5	0	0	112.9	A90 M91 K92	Q88-A90 PolarHBondContact O-N 3.26Å; Q88-M91 PolarHBondContact O-N 2.01Å; Q88-K92 PolarHBondContact O-N 3.46Å
89	L	38	Very low	37.1	Very low	117 Å²	117	129 Å²	129	61%	0.613	64%	0.639	S	S	*	*	H	α-helix	trans	-59.3	-42.9	173.5	-130	85.8	0	0	0	112.5	S87 M91 K92 Y93	S87-L89 PolarHBondContact O-N 2.94Å; L89-M91 PolarHBondContact O-N 3.2Å; L89-K92 PolarHBondContact O-N 3.21Å; L89-Y93 WeakPolarHBondContact O-CD2 3.47Å; L89-Y93 PolarHBondContact O-N 2.04Å
90	A	38.6	Very low	37.8	Very low	33 Å²	33	123.9 Å²	123.9	27%	0.273	63%	0.628	S	S	.	*	H	α-helix	trans	-69.3	-34	-177	0	0	0	0	0	112.6	S87 Q88 L94	S87-A90 PolarHBondContact O-N 3.37Å; Q88-A90 PolarHBondContact O-N 3.26Å; A90-L94 WeakPolarHBondContact O-CB 3.45Å; A90-L94 WeakPolarHBondContact O-CD1 3.48Å; A90-L94 WeakPolarHBondContact O-CG 2.96Å; A90-L94 PolarHBondContact O-N 3.09Å
91	M	41.4	Very low	38.7	Very low	87 Å²	87	117.6 Å²	117.6	43%	0.429	60%	0.598	S	S	.	*	H	α-helix	trans	-70.1	-35.8	174.9	-76.3	-82.6	-68.8	0	0	112	Q88 L89 Y93 L94 F98	Q88-M91 PolarHBondContact O-N 2.01Å; L89-M91 PolarHBondContact O-N 3.2Å; M91-Y93 PolarHBondContact O-N 2.87Å; M91-L94 PolarHBondContact O-N 2.87Å; M91-F98 HydrophobicContact CB-CE2 4.31Å; M91-F98 HydrophobicContact CB-CZ 4.29Å; M91-F98 HydrophobicContact CE-CD2 4.13Å; M91-F98 HydrophobicContact CE-CE2 3.72Å
92	K	36.7	Very low	39.8	Very low	143 Å²	143	112 Å²	112	62%	0.622	58%	0.581	S	S	*	*	H	α-helix	trans	-63.7	-26.2	177.2	-171.6	179	179.1	-178.5	0	113.7	Q88 L89	Q88-K92 PolarHBondContact O-N 3.46Å; L89-K92 PolarHBondContact O-N 3.21Å
93	Y	38.9	Very low	40.6	Very low	191 Å²	191	107.8 Å²	107.8	75%	0.749	57%	0.571	S	S	*	*	H	α-helix	trans	-100.9	-15.7	-177.9	-82.3	-78.7	0	0	0	114.5	L89 M91	L89-Y93 WeakPolarHBondContact O-CD2 3.47Å; L89-Y93 PolarHBondContact O-N 2.04Å; M91-Y93 PolarHBondContact O-N 2.87Å
94	L	40.1	Very low	41.2	Very low	126 Å²	126	103.3 Å²	103.3	66%	0.66	55%	0.548	S	S	*	.	H	α-helix	trans	-98.9	-9.1	-174.3	-71.1	171.8	0	0	0	114.1	A90 M91	A90-L94 WeakPolarHBondContact O-CB 3.45Å; A90-L94 WeakPolarHBondContact O-CD1 3.48Å; A90-L94 WeakPolarHBondContact O-CG 2.96Å; A90-L94 PolarHBondContact O-N 3.09Å; M91-L94 PolarHBondContact O-N 2.87Å
95	D	39.9	Very low	42.1	Very low	75 Å²	75	100.7 Å²	100.7	40%	0.401	52%	0.52	S	S	.	.			trans	-140.6	105.6	178.9	-172.6	-5	0	0	0	110.2	D97 F98	D95-D97 PolarHBondContact O-N 3.05Å; D95-D97 WeakPolarHBondContact OD1-CB 3.27Å; D95-D97 PolarHBondContact OD1-N 3.03Å; D95-F98 HydrophobicContact CB-CB 4.16Å; D95-F98 WeakPolarHBondContact O-CB 3.45Å; D95-F98 PolarHBondContact O-N 2.72Å
96	P	34.8	Very low	42.9	Very low	135 Å²	135	94.3 Å²	94.3	88%	0.877	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.5	176.9	24.6	-30.1	0	0	0	113.6	F98	P96-F98 VanDerWaalsContact C-N 3.33Å
97	D	37.2	Very low	43.6	Very low	118 Å²	118	91.3 Å²	91.3	63%	0.631	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	1.3	170.8	-69.7	-33.7	0	0	0	113.2	D95 I99	D95-D97 PolarHBondContact O-N 3.05Å; D95-D97 WeakPolarHBondContact OD1-CB 3.27Å; D95-D97 PolarHBondContact OD1-N 3.03Å; D97-I99 PolarHBondContact O-N 3.1Å
98	F	45.3	Very low	44	Very low	75 Å²	75	92.1 Å²	92.1	33%	0.329	49%	0.491	S	S	.	.			trans	-74.7	76.3	173.4	-163.6	-97	0	0	0	110.3	M91 D95 P96	M91-F98 HydrophobicContact CB-CE2 4.31Å; M91-F98 HydrophobicContact CB-CZ 4.29Å; M91-F98 HydrophobicContact CE-CD2 4.13Å; M91-F98 HydrophobicContact CE-CE2 3.72Å; D95-F98 HydrophobicContact CB-CB 4.16Å; D95-F98 WeakPolarHBondContact O-CB 3.45Å; D95-F98 PolarHBondContact O-N 2.72Å; P96-F98 VanDerWaalsContact C-N 3.33Å
99	I	41	Very low	44.6	Very low	101 Å²	101	85.7 Å²	85.7	52%	0.518	46%	0.462	S	S	.	.			trans	-54.5	130.7	160.1	-58.3	172.9	0	0	0	106.2	D97 L101	D97-I99 PolarHBondContact O-N 3.1Å; I99-L101 PolarHBondContact O-N 3.23Å
100	P	43.5	Very low	45.2	Very low	73 Å²	73	87.3 Å²	87.3	47%	0.474	47%	0.466	S	S	.	.			trans	-61.6	94.9	170.2	25.4	-30.9	0	0	0	107.3	S102 S103	P100-S102 PolarHBondContact O-N 3.3Å; P100-S103 PolarHBondContact O-N 2.92Å
101	L	51.6	Low	45.8	Very low	49 Å²	49	88.1 Å²	88.1	26%	0.257	47%	0.466	S	S	.	.	H	α-helix	trans	-49.8	-25.8	-178.6	-127.7	77.6	0	0	0	110.8	I99 S103 L105 W347 F349 F385	I99-L101 PolarHBondContact O-N 3.23Å; L101-S103 PolarHBondContact O-N 3.31Å; L101-L105 HydrophobicContact CB-CD1 3.75Å; L101-L105 HydrophobicContact CD2-CD1 3.38Å; L101-L105 HydrophobicContact CG-CD1 3.41Å; L101-L105 VanDerWaalsContact CG-CD1 3.41Å; L101-L105 HydrophobicContact CG-CG 4.38Å; L101-L105 WeakPolarHBondContact O-CB 3.46Å; L101-L105 WeakPolarHBondContact O-CD1 3.43Å; L101-L105 WeakPolarHBondContact O-CG 3.49Å; L101-L105 PolarHBondContact O-N 3.31Å; L101-W347 HydrophobicContact CD2-CH2 4.45Å; L101-W347 HydrophobicContact CD2-CZ3 4.47Å; L101-F349 HydrophobicContact CD2-CE2 3.7Å; L101-F349 HydrophobicContact CD2-CZ 3.84Å; L101-F385 HydrophobicContact CD2-CD1 4.35Å; L101-F385 HydrophobicContact CD2-CE1 3.91Å
102	S	53.4	Low	46.5	Very low	65 Å²	65	86.2 Å²	86.2	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-59	-44.1	-175.9	60.6	0	0	0	0	115	P100 T106	P100-S102 PolarHBondContact O-N 3.3Å; S102-T106 VanDerWaalsContact O-CB 3.27Å; S102-T106 WeakPolarHBondContact O-CB 3.39Å; S102-T106 PolarHBondContact O-N 3.46Å; S102-T106 PolarHBondContact O-OG1 2.89Å
103	S	45.1	Very low	47.4	Very low	78 Å²	78	84.8 Å²	84.8	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-76.5	-47.6	-174.4	54.5	0	0	0	0	112.1	P100 L101 T106 E107	P100-S103 PolarHBondContact O-N 2.92Å; L101-S103 PolarHBondContact O-N 3.31Å; S103-T106 PolarHBondContact O-N 2.73Å; S103-E107 PolarHBondContact O-N 3.05Å
104	A	46	Very low	49.1	Very low	46 Å²	46	82.1 Å²	82.1	38%	0.38	46%	0.464	S	S	.	.	H	α-helix	trans	-67.6	-40.2	179.9	0	0	0	0	0	112.8	D108	A104-D108 PolarHBondContact O-N 2.65Å
105	L	57.9	Low	51.5	Low	5 Å²	5	78.2 Å²	78.2	3%	0.026	44%	0.441	C	S	.	.	H	α-helix	trans	-63.8	-42.5	173.1	-84.1	157.4	0	0	0	111.2	L101 E107 D108 L109 W347 F385 Y389 L401	L101-L105 HydrophobicContact CB-CD1 3.75Å; L101-L105 HydrophobicContact CD2-CD1 3.38Å; L101-L105 HydrophobicContact CG-CD1 3.41Å; L101-L105 VanDerWaalsContact CG-CD1 3.41Å; L101-L105 HydrophobicContact CG-CG 4.38Å; L101-L105 WeakPolarHBondContact O-CB 3.46Å; L101-L105 WeakPolarHBondContact O-CD1 3.43Å; L101-L105 WeakPolarHBondContact O-CG 3.49Å; L101-L105 PolarHBondContact O-N 3.31Å; L105-E107 VanDerWaalsContact C-N 3.33Å; L105-E107 PolarHBondContact O-N 2.86Å; L105-D108 PolarHBondContact O-N 3.39Å; L105-L109 HydrophobicContact CB-CD1 3.98Å; L105-L109 HydrophobicContact CD2-CD1 4.3Å; L105-L109 HydrophobicContact CD2-CG 4.46Å; L105-L109 WeakPolarHBondContact O-CB 3.01Å; L105-L109 VanDerWaalsContact O-CD1 3.31Å; L105-L109 WeakPolarHBondContact O-CD1 3.3Å; L105-L109 WeakPolarHBondContact O-CG 3.1Å; L105-L109 PolarHBondContact O-N 3.19Å; L105-W347 HydrophobicContact CD1-CH2 3.93Å; L105-W347 HydrophobicContact CD1-CZ3 3.83Å; L105-F385 HydrophobicContact CD2-CZ 4.32Å; L105-Y389 HydrophobicContact CD2-CD2 3.9Å; L105-Y389 HydrophobicContact CD2-CE2 3.4Å; L105-Y389 VanDerWaalsContact CD2-CE2 3.4Å; L105-Y389 HydrophobicContact CG-CE2 4.3Å; L105-L401 HydrophobicContact CD2-CD1 3.76Å
106	T	51.8	Low	54.1	Low	57 Å²	57	84.9 Å²	84.9	35%	0.35	46%	0.46	S	S	.	.	H	α-helix	trans	-63.8	-39.5	-175	-56.9	0	0	0	0	111.9	S102 S103 Q110	S102-T106 VanDerWaalsContact O-CB 3.27Å; S102-T106 WeakPolarHBondContact O-CB 3.39Å; S102-T106 PolarHBondContact O-N 3.46Å; S102-T106 PolarHBondContact O-OG1 2.89Å; S103-T106 PolarHBondContact O-N 2.73Å; T106-Q110 WeakPolarHBondContact O-CB 2.93Å; T106-Q110 WeakPolarHBondContact O-CG 2.98Å; T106-Q110 PolarHBondContact O-N 3.32Å; T106-Q110 VanDerWaalsContact O-N 3.11Å
107	E	49.3	Very low	57.1	Low	134 Å²	134	81 Å²	81	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-71.8	-37.5	-179.5	-161.8	171.1	-175	0	0	112.8	S103 L105 N111	S103-E107 PolarHBondContact O-N 3.05Å; L105-E107 VanDerWaalsContact C-N 3.33Å; L105-E107 PolarHBondContact O-N 2.86Å; E107-N111 PolarHBondContact O-N 2.56Å; E107-N111 PolarHBondContact O-ND2 2.9Å
108	D	50.6	Low	60	Low	70 Å²	70	78.7 Å²	78.7	37%	0.374	42%	0.418	S	S	.	.	H	α-helix	trans	-78.7	-34.3	176.3	-80	-25.1	0	0	0	112.9	A104 L105 Q110 N111 A112 Y389	A104-D108 PolarHBondContact O-N 2.65Å; L105-D108 PolarHBondContact O-N 3.39Å; D108-Q110 VanDerWaalsContact C-N 3.34Å; D108-N111 CarbonylContact O-C 3.54Å; D108-N111 WeakPolarHBondContact O-CA 3.2Å; D108-N111 PolarHBondContact O-N 3.09Å; D108-A112 PolarHBondContact O-N 3.21Å; D108-Y389 WeakPolarHBondContact CB-OH 3.41Å; D108-Y389 VanDerWaalsContact CG-OH 3.31Å; D108-Y389 PolarHBondContact OD2-OH 3.12Å
109	L	55	Low	62.5	Low	22 Å²	22	78.3 Å²	78.3	12%	0.115	43%	0.425	C	S	.	.	H	α-helix	trans	-64.3	-38.9	173.5	-72.9	169.4	0	0	0	111.6	L105 N111 A112 P353 L401	L105-L109 HydrophobicContact CB-CD1 3.98Å; L105-L109 HydrophobicContact CD2-CD1 4.3Å; L105-L109 HydrophobicContact CD2-CG 4.46Å; L105-L109 WeakPolarHBondContact O-CB 3.01Å; L105-L109 VanDerWaalsContact O-CD1 3.31Å; L105-L109 WeakPolarHBondContact O-CD1 3.3Å; L105-L109 WeakPolarHBondContact O-CG 3.1Å; L105-L109 PolarHBondContact O-N 3.19Å; L109-N111 PolarHBondContact O-N 2.98Å; L109-A112 PolarHBondContact O-N 3.17Å; L109-P353 HydrophobicContact CD1-CB 3.83Å; L109-P353 HydrophobicContact CD1-CG 4.3Å; L109-L401 HydrophobicContact CD2-CB 3.31Å; L109-L401 HydrophobicContact CD2-CD1 3.89Å; L109-L401 HydrophobicContact CD2-CG 4.17Å
110	Q	51.3	Low	65.2	Low	151 Å²	151	78.4 Å²	78.4	71%	0.706	43%	0.43	S	S	*	.	H	α-helix	trans	-65.7	-24.5	172.8	-74.8	175.6	6.4	0	0	112.1	T106 D108	T106-Q110 WeakPolarHBondContact O-CB 2.93Å; T106-Q110 WeakPolarHBondContact O-CG 2.98Å; T106-Q110 PolarHBondContact O-N 3.32Å; T106-Q110 VanDerWaalsContact O-N 3.11Å; D108-Q110 VanDerWaalsContact C-N 3.34Å
111	N	51.6	Low	67.8	Low	50 Å²	50	76.3 Å²	76.3	27%	0.267	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	22.8	177.5	-81.8	-43.4	0	0	0	114	E107 D108 L109 S113 K114	E107-N111 PolarHBondContact O-N 2.56Å; E107-N111 PolarHBondContact O-ND2 2.9Å; D108-N111 CarbonylContact O-C 3.54Å; D108-N111 WeakPolarHBondContact O-CA 3.2Å; D108-N111 PolarHBondContact O-N 3.09Å; L109-N111 PolarHBondContact O-N 2.98Å; N111-S113 PolarHBondContact O-N 3.26Å; N111-K114 HydrophobicContact CB-CD 3.98Å; N111-K114 HydrophobicContact CB-CG 4.3Å; N111-K114 PolarHBondContact ND2-NZ 3.34Å; N111-K114 WeakPolarHBondContact O-CB 3.32Å; N111-K114 PolarHBondContact O-N 3.05Å; N111-K114 WeakPolarHBondContact OD1-CE 3.42Å; N111-K114 PolarHBondContact OD1-NZ 3.04Å
112	A	54.9	Low	70	Confident	47 Å²	47	74 Å²	74	39%	0.388	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-53.6	-20.1	178.4	0	0	0	0	0	114.7	D108 L109 K114	D108-A112 PolarHBondContact O-N 3.21Å; L109-A112 PolarHBondContact O-N 3.17Å; A112-K114 VanDerWaalsContact C-N 3.29Å; A112-K114 PolarHBondContact O-N 3.34Å
113	S	56.8	Low	72.1	Confident	112 Å²	112	74.1 Å²	74.1	78%	0.783	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-72.4	-13.4	172.3	58.1	0	0	0	0	114.7	N111	N111-S113 PolarHBondContact O-N 3.26Å
114	K	74.8	Confident	74.6	Confident	136 Å²	136	76 Å²	76	59%	0.591	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-95.4	-12	-178	-65.4	-175.7	-177.7	160.3	0	114.5	N111 A112 R116	N111-K114 HydrophobicContact CB-CD 3.98Å; N111-K114 HydrophobicContact CB-CG 4.3Å; N111-K114 PolarHBondContact ND2-NZ 3.34Å; N111-K114 WeakPolarHBondContact O-CB 3.32Å; N111-K114 PolarHBondContact O-N 3.05Å; N111-K114 WeakPolarHBondContact OD1-CE 3.42Å; N111-K114 PolarHBondContact OD1-NZ 3.04Å; A112-K114 VanDerWaalsContact C-N 3.29Å; A112-K114 PolarHBondContact O-N 3.34Å; K114-R116 PolarHBondContact O-N 3.02Å
115	W	90.8	Very high	77.1	Confident	44 Å²	44	74.3 Å²	74.3	17%	0.167	39%	0.389	C	S	.	.			trans	-61.3	130.3	-179.8	-179.4	82.8	0	0	0	111	H117 Q340 H392 L397 K398	W115-H117 HydrophobicContact CH2-CB 3.6Å; W115-H117 HydrophobicContact CZ2-CB 4.27Å; W115-H117 HydrophobicContact CZ3-CB 4.09Å; W115-Q340 HydrophobicContact CH2-CG 4.33Å; W115-Q340 VanDerWaalsContact CZ3-NE2 3.28Å; W115-H392 AromaticContact CD1-CE1 3.07Å; W115-H392 AromaticContact CD1-ND1 3.2Å; W115-H392 AromaticContact CD1-NE2 3.87Å; W115-H392 VanDerWaalsContact CD1-O 3.25Å; W115-H392 AromaticContact CG-CE1 3.58Å; W115-H392 AromaticContact NE1-CE1 3.71Å; W115-H392 AromaticContact NE1-ND1 3.35Å; W115-H392 PolarHBondContact NE1-ND1 2.98Å; W115-H392 PolarHBondContact NE1-O 2.8Å; W115-H392 VanDerWaalsContact NE1-O 3.07Å; W115-L397 VanDerWaalsContact CZ2-C 3.45Å; W115-L397 WeakPolarHBondContact CZ2-O 3.22Å; W115-L397 PolarHBondContact NE1-O 3.45Å; W115-K398 HydrophobicContact CD2-CB 3.96Å; W115-K398 HydrophobicContact CD2-CD 4.2Å; W115-K398 HydrophobicContact CD2-CG 3.83Å; W115-K398 HydrophobicContact CE3-CB 4.06Å; W115-K398 HydrophobicContact CE3-CD 3.8Å; W115-K398 HydrophobicContact CE3-CG 3.93Å; W115-K398 HydrophobicContact CG-CG 4.27Å; W115-K398 HydrophobicContact CH2-CB 3.86Å; W115-K398 HydrophobicContact CZ2-CB 3.75Å; W115-K398 HydrophobicContact CZ3-CB 4.01Å; W115-K398 HydrophobicContact CZ3-CD 4.13Å; W115-K398 HydrophobicContact CZ3-CG 4.32Å
116	R	94.3	Very high	79	Confident	214 Å²	214	76.2 Å²	76.2	81%	0.808	40%	0.396	S	S	*	.			trans	-128.2	140.2	176.6	-67.2	-174.3	-179.1	-155.7	0.2	110	K114 N118 G395	K114-R116 PolarHBondContact O-N 3.02Å; R116-N118 PolarHBondContact O-N 3.49Å; R116-G395 WeakPolarHBondContact O-CA 3.37Å
117	H	96.7	Very high	81.2	Confident	54 Å²	54	76.8 Å²	76.8	25%	0.25	40%	0.4	C	S	.	.			trans	-73.9	127	176.9	-175.2	43.3	0	0	0	110.5	W115 F122 D339 G395	W115-H117 HydrophobicContact CH2-CB 3.6Å; W115-H117 HydrophobicContact CZ2-CB 4.27Å; W115-H117 HydrophobicContact CZ3-CB 4.09Å; H117-F122 AromaticContact CE1-CD1 3.9Å; H117-F122 AromaticContact CE1-CG 3.87Å; H117-D339 PolarHBondContact NE2-O 3.44Å; H117-G395 PolarHBondContact ND1-O 3.07Å; H117-G395 VanDerWaalsContact ND1-O 3.08Å
118	N	97.7	Very high	83.5	Confident	69 Å²	69	72.6 Å²	72.6	37%	0.369	38%	0.381	S	S	.	.			trans	-97.6	88.8	170.6	-172.3	-16.3	0	0	0	109	R116 T120 A121 F122 E394 G395	R116-N118 PolarHBondContact O-N 3.49Å; N118-T120 VanDerWaalsContact C-N 3.32Å; N118-T120 PolarHBondContact O-N 3.48Å; N118-A121 HydrophobicContact CB-CB 4.15Å; N118-A121 VanDerWaalsContact CG-CB 3.44Å; N118-A121 WeakPolarHBondContact ND2-CB 3.39Å; N118-A121 PolarHBondContact O-N 3.37Å; N118-A121 PolarHBondContact OD1-N 3.35Å; N118-A121 VanDerWaalsContact OD1-N 3.12Å; N118-F122 WeakPolarHBondContact O-CB 3.28Å; N118-F122 PolarHBondContact O-N 3.5Å; N118-E394 WeakPolarHBondContact CB-O 3.35Å; N118-G395 PolarHBondContact N-O 3.36Å
119	S	97.6	Very high	85.8	Confident	67 Å²	67	69.5 Å²	69.5	47%	0.469	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-35.9	-175.7	56	0	0	0	0	112.8	F122 T123	S119-F122 PolarHBondContact O-N 3.49Å; S119-T123 WeakPolarHBondContact O-CB 3.24Å; S119-T123 PolarHBondContact O-N 3.47Å; S119-T123 PolarHBondContact O-OG1 3.24Å
120	T	98.1	Very high	87.8	Confident	104 Å²	104	71.7 Å²	71.7	64%	0.638	38%	0.381	S	S	*	.	H	α-helix	trans	-64.3	-52.1	177.8	-52.9	0	0	0	0	110.9	N118 F122 T123 Q124	N118-T120 VanDerWaalsContact C-N 3.32Å; N118-T120 PolarHBondContact O-N 3.48Å; T120-F122 VanDerWaalsContact C-N 3.3Å; T120-F122 PolarHBondContact O-N 2.62Å; T120-T123 PolarHBondContact O-N 3.01Å; T120-Q124 PolarHBondContact O-N 3.36Å
121	A	97.9	Very high	90	Very high	28 Å²	28	71.5 Å²	71.5	23%	0.231	38%	0.38	C	S	.	.	H	α-helix	trans	-63.7	-37.1	178.6	0	0	0	0	0	111.7	N118 Q124 L125 L396	N118-A121 HydrophobicContact CB-CB 4.15Å; N118-A121 VanDerWaalsContact CG-CB 3.44Å; N118-A121 WeakPolarHBondContact ND2-CB 3.39Å; N118-A121 PolarHBondContact O-N 3.37Å; N118-A121 PolarHBondContact OD1-N 3.35Å; N118-A121 VanDerWaalsContact OD1-N 3.12Å; A121-Q124 PolarHBondContact O-N 3.07Å; A121-L125 WeakPolarHBondContact O-CB 3.05Å; A121-L125 PolarHBondContact O-N 3.33Å; A121-L396 HydrophobicContact CB-CD2 3.59Å; A121-L396 WeakPolarHBondContact O-CD2 3.49Å
122	F	98.4	Very high	92.2	Very high	1 Å²	1	72 Å²	72	0%	0.004	38%	0.381	C	S	.	.	H	α-helix	trans	-67.8	-34.7	176.1	-176.2	-115.7	0	0	0	112.9	H117 N118 S119 T120 L125 R126 C338 D339 I341 L396	H117-F122 AromaticContact CE1-CD1 3.9Å; H117-F122 AromaticContact CE1-CG 3.87Å; N118-F122 WeakPolarHBondContact O-CB 3.28Å; N118-F122 PolarHBondContact O-N 3.5Å; S119-F122 PolarHBondContact O-N 3.49Å; T120-F122 VanDerWaalsContact C-N 3.3Å; T120-F122 PolarHBondContact O-N 2.62Å; F122-L125 HydrophobicContact CD2-CD2 4.02Å; F122-L125 HydrophobicContact CE2-CD2 4.24Å; F122-L125 WeakPolarHBondContact O-CB 3.21Å; F122-L125 PolarHBondContact O-N 3.09Å; F122-R126 VanDerWaalsContact CD1-NH2 3.3Å; F122-R126 PolarHBondContact O-N 3.3Å; F122-C338 VanDerWaalsContact CE1-O 3.3Å; F122-C338 WeakPolarHBondContact CE1-O 3.45Å; F122-D339 WeakPolarHBondContact CD1-O 3.48Å; F122-D339 WeakPolarHBondContact CE1-O 3.47Å; F122-I341 HydrophobicContact CE2-CD1 3.94Å; F122-I341 HydrophobicContact CE2-CG1 4.43Å; F122-I341 HydrophobicContact CZ-CD1 3.64Å; F122-I341 HydrophobicContact CZ-CG1 3.92Å; F122-L396 HydrophobicContact CB-CD2 4.25Å; F122-L396 WeakPolarHBondContact CD2-O 3.48Å
123	T	97.9	Very high	94.2	Very high	68 Å²	68	70.2 Å²	70.2	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-68.5	-38.9	174.2	-59.8	0	0	0	0	111.5	S119 T120 R126 T127	S119-T123 WeakPolarHBondContact O-CB 3.24Å; S119-T123 PolarHBondContact O-N 3.47Å; S119-T123 PolarHBondContact O-OG1 3.24Å; T120-T123 PolarHBondContact O-N 3.01Å; T123-R126 PolarHBondContact O-N 3.17Å; T123-T127 PolarHBondContact O-N 3Å; T123-T127 PolarHBondContact O-OG1 2.94Å
124	Q	97.9	Very high	96.1	Very high	117 Å²	117	68 Å²	68	55%	0.547	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-47.5	172	-177.4	177.2	-13.7	0	0	111.2	T120 A121 R126 T127 E128	T120-Q124 PolarHBondContact O-N 3.36Å; A121-Q124 PolarHBondContact O-N 3.07Å; Q124-R126 VanDerWaalsContact C-N 3.31Å; Q124-R126 PolarHBondContact O-N 3.03Å; Q124-T127 WeakPolarHBondContact O-CA 3.31Å; Q124-T127 WeakPolarHBondContact O-CB 2.95Å; Q124-T127 PolarHBondContact O-N 2.88Å; Q124-E128 PolarHBondContact NE2-OE1 2.92Å; Q124-E128 WeakPolarHBondContact O-CG 3.27Å; Q124-E128 PolarHBondContact O-N 3.41Å
125	L	97.9	Very high	97.2	Very high	10 Å²	10	61.8 Å²	61.8	5%	0.052	32%	0.317	C	S	.	.	H	α-helix	trans	-54.3	-46.2	175.3	-173.1	85.3	0	0	0	112	A121 F122 T127 E128 I129 Y313 Y331 M391 L396	A121-L125 WeakPolarHBondContact O-CB 3.05Å; A121-L125 PolarHBondContact O-N 3.33Å; F122-L125 HydrophobicContact CD2-CD2 4.02Å; F122-L125 HydrophobicContact CE2-CD2 4.24Å; F122-L125 WeakPolarHBondContact O-CB 3.21Å; F122-L125 PolarHBondContact O-N 3.09Å; L125-T127 VanDerWaalsContact C-N 3.29Å; L125-T127 PolarHBondContact O-N 3.18Å; L125-E128 PolarHBondContact O-N 3.34Å; L125-I129 HydrophobicContact CG-CD1 4.29Å; L125-I129 WeakPolarHBondContact O-CG1 3.32Å; L125-I129 PolarHBondContact O-N 3.14Å; L125-Y313 WeakPolarHBondContact CD1-OH 3.33Å; L125-Y331 HydrophobicContact CD2-CE1 4.1Å; L125-Y331 WeakPolarHBondContact CD2-OH 3.47Å; L125-M391 HydrophobicContact CD1-CE 4.14Å; L125-M391 HydrophobicContact CD2-CE 3.68Å; L125-L396 HydrophobicContact CB-CD2 4.37Å; L125-L396 HydrophobicContact CD1-CD1 4.28Å
126	R	97.7	Very high	97.5	Very high	45 Å²	45	61.3 Å²	61.3	17%	0.17	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-42.2	176.1	-176.7	-174.2	-54.4	124.9	20	111.6	F122 T123 Q124 I129 S130 R183 S335 C338	F122-R126 VanDerWaalsContact CD1-NH2 3.3Å; F122-R126 PolarHBondContact O-N 3.3Å; T123-R126 PolarHBondContact O-N 3.17Å; Q124-R126 VanDerWaalsContact C-N 3.31Å; Q124-R126 PolarHBondContact O-N 3.03Å; R126-I129 PolarHBondContact O-N 3.34Å; R126-S130 WeakPolarHBondContact O-CB 3.27Å; R126-S130 PolarHBondContact O-N 3.09Å; R126-R183 VanDerWaalsContact CZ-CZ 3.44Å; R126-S335 WeakPolarHBondContact CD-O 3.27Å; R126-S335 WeakPolarHBondContact CG-O 3.14Å; R126-S335 PolarHBondContact NE-O 3.42Å; R126-C338 PolarHBondContact NH2-O 2.96Å
127	T	97.7	Very high	97.5	Very high	70 Å²	70	59.7 Å²	59.7	43%	0.429	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-45.2	178.4	-55.1	0	0	0	0	110.7	T123 Q124 L125 I129 S130 Q131	T123-T127 PolarHBondContact O-N 3Å; T123-T127 PolarHBondContact O-OG1 2.94Å; Q124-T127 WeakPolarHBondContact O-CA 3.31Å; Q124-T127 WeakPolarHBondContact O-CB 2.95Å; Q124-T127 PolarHBondContact O-N 2.88Å; L125-T127 VanDerWaalsContact C-N 3.29Å; L125-T127 PolarHBondContact O-N 3.18Å; T127-I129 PolarHBondContact O-N 2.91Å; T127-S130 PolarHBondContact O-N 2.95Å; T127-S130 VanDerWaalsContact O-N 3.14Å; T127-S130 PolarHBondContact O-OG 2.86Å; T127-Q131 WeakPolarHBondContact O-CG 3.48Å; T127-Q131 PolarHBondContact O-N 3.49Å; T127-Q131 VanDerWaalsContact O-N 3.16Å
128	E	97.8	Very high	97.6	Very high	46 Å²	46	60.2 Å²	60.2	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-41.7	175.5	-67.4	173.5	-170	0	0	112.4	Q124 L125 S130 Q131 H132 Y313 K317	Q124-E128 PolarHBondContact NE2-OE1 2.92Å; Q124-E128 WeakPolarHBondContact O-CG 3.27Å; Q124-E128 PolarHBondContact O-N 3.41Å; L125-E128 PolarHBondContact O-N 3.34Å; E128-S130 VanDerWaalsContact C-N 3.34Å; E128-Q131 PolarHBondContact O-N 3.1Å; E128-H132 PolarHBondContact O-ND1 3.09Å; E128-Y313 HydrophobicContact CB-CE2 3.96Å; E128-K317 WeakPolarHBondContact OE2-CE 3.09Å; E128-K317 IonicContact OE2-NZ 3.93Å; E128-K317 PolarHBondContact OE2-NZ 2.91Å
129	I	98.1	Very high	97.6	Very high	4 Å²	4	57 Å²	57	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-43.6	174.5	-69	169.7	0	0	0	110.4	L125 R126 T127 Q131 H132 I133 I135 Y313 T332 S335	L125-I129 HydrophobicContact CG-CD1 4.29Å; L125-I129 WeakPolarHBondContact O-CG1 3.32Å; L125-I129 PolarHBondContact O-N 3.14Å; R126-I129 PolarHBondContact O-N 3.34Å; T127-I129 PolarHBondContact O-N 2.91Å; I129-Q131 PolarHBondContact O-N 3.47Å; I129-H132 PolarHBondContact O-N 3.42Å; I129-I133 HydrophobicContact CG2-CG2 4.35Å; I129-I133 PolarHBondContact O-N 3.13Å; I129-I133 VanDerWaalsContact O-N 3.09Å; I129-I135 HydrophobicContact CG2-CD1 3.77Å; I129-Y313 HydrophobicContact CB-CE2 4.46Å; I129-Y313 HydrophobicContact CD1-CE1 3.92Å; I129-Y313 HydrophobicContact CG1-CD1 3.88Å; I129-Y313 HydrophobicContact CG1-CD2 3.92Å; I129-Y313 HydrophobicContact CG1-CE1 3.49Å; I129-Y313 VanDerWaalsContact CG1-CE1 3.49Å; I129-Y313 HydrophobicContact CG1-CE2 3.53Å; I129-Y313 HydrophobicContact CG1-CG 4.09Å; I129-T332 HydrophobicContact CG2-CG2 4.04Å; I129-S335 VanDerWaalsContact CD1-OG 3.27Å; I129-S335 WeakPolarHBondContact CD1-OG 3.25Å
130	S	97.4	Very high	97.6	Very high	69 Å²	69	54 Å²	54	48%	0.483	28%	0.28	S	S	.	.	H	α-helix	trans	-64.3	-25.7	-178.2	75.1	0	0	0	0	113.9	R126 T127 E128 H132	R126-S130 WeakPolarHBondContact O-CB 3.27Å; R126-S130 PolarHBondContact O-N 3.09Å; T127-S130 PolarHBondContact O-N 2.95Å; T127-S130 VanDerWaalsContact O-N 3.14Å; T127-S130 PolarHBondContact O-OG 2.86Å; E128-S130 VanDerWaalsContact C-N 3.34Å; S130-H132 PolarHBondContact O-N 3.14Å
131	Q	97.8	Very high	97.6	Very high	146 Å²	146	50.1 Å²	50.1	68%	0.682	26%	0.255	S	S	*	.	H	α-helix	trans	-68	-22.6	173.2	-69	169.9	-8.4	0	0	112.7	T127 E128 I129	T127-Q131 WeakPolarHBondContact O-CG 3.48Å; T127-Q131 PolarHBondContact O-N 3.49Å; T127-Q131 VanDerWaalsContact O-N 3.16Å; E128-Q131 PolarHBondContact O-N 3.1Å; I129-Q131 PolarHBondContact O-N 3.47Å
132	H	98	Very high	97.7	Very high	60 Å²	60	50.3 Å²	50.3	28%	0.278	25%	0.253	S	S	.	.	H	α-helix	trans	-97.5	-35.1	179.8	-65.7	77.5	0	0	0	112.2	E128 I129 S130 Y309 Y313	E128-H132 PolarHBondContact O-ND1 3.09Å; I129-H132 PolarHBondContact O-N 3.42Å; S130-H132 PolarHBondContact O-N 3.14Å; H132-Y309 WeakPolarHBondContact O-CB 3.34Å; H132-Y313 PolarHBondContact CD2-N 3.39Å; H132-Y313 AromaticContact ND1-CD2 3.79Å
133	I	97.6	Very high	97.6	Very high	10 Å²	10	53.5 Å²	53.5	5%	0.051	27%	0.265	C	S	.	.			trans	-153.4	127.4	-178.2	-177.5	167.9	0	0	0	111.8	I129 I135 N138 I306 I310	I129-I133 HydrophobicContact CG2-CG2 4.35Å; I129-I133 PolarHBondContact O-N 3.13Å; I129-I133 VanDerWaalsContact O-N 3.09Å; I133-I135 HydrophobicContact CG1-CG1 4.35Å; I133-I135 HydrophobicContact CG2-CD1 4.38Å; I133-I135 HydrophobicContact CG2-CG1 3.87Å; I133-I135 PolarHBondContact O-N 2.82Å; I133-N138 HydrophobicContact CD1-CB 3.92Å; I133-N138 HydrophobicContact CG1-CB 4Å; I133-I306 HydrophobicContact CD1-CB 4.03Å; I133-I306 HydrophobicContact CD1-CG2 4.35Å; I133-I310 HydrophobicContact CD1-CD1 4.41Å; I133-I310 HydrophobicContact CD1-CG1 4.13Å; I133-I310 HydrophobicContact CG2-CG1 4.39Å
134	D	96.9	Very high	97.5	Very high	67 Å²	67	56.4 Å²	56.4	36%	0.358	28%	0.278	S	S	.	.			trans	-75	91.4	164.3	-177.5	-23.5	0	0	0	108.6	P136 R137 N138	D134-P136 WeakPolarHBondContact OD1-CD 3.34Å; D134-R137 HydrophobicContact CB-CB 4.33Å; D134-R137 PolarHBondContact O-N 2.76Å; D134-R137 PolarHBondContact OD1-N 2.83Å; D134-R137 WeakPolarHBondContact OD2-CD 3.36Å; D134-R137 VanDerWaalsContact OD2-CG 3.28Å; D134-R137 WeakPolarHBondContact OD2-CG 3.49Å; D134-R137 IonicContact OD2-NE 2.62Å; D134-R137 PolarHBondContact OD2-NE 2.9Å; D134-N138 WeakPolarHBondContact O-CB 3.41Å; D134-N138 PolarHBondContact O-N 3.14Å; D134-N138 PolarHBondContact O-ND2 2.68Å
135	I	97.1	Very high	97.4	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-60.4	-48.8	-178	-63.7	179.5	0	0	0	111.5	I129 I133 R137 N138 F139 T332 L333 S336	I129-I135 HydrophobicContact CG2-CD1 3.77Å; I133-I135 HydrophobicContact CG1-CG1 4.35Å; I133-I135 HydrophobicContact CG2-CD1 4.38Å; I133-I135 HydrophobicContact CG2-CG1 3.87Å; I133-I135 PolarHBondContact O-N 2.82Å; I135-R137 PolarHBondContact O-N 3.12Å; I135-R137 VanDerWaalsContact O-N 3.14Å; I135-N138 CarbonylContact O-C 3.31Å; I135-N138 PolarHBondContact O-N 3.32Å; I135-N138 VanDerWaalsContact O-N 3.12Å; I135-F139 WeakPolarHBondContact O-CA 3.43Å; I135-F139 VanDerWaalsContact O-CB 3.25Å; I135-F139 WeakPolarHBondContact O-CB 3.34Å; I135-F139 PolarHBondContact O-N 2.89Å; I135-T332 HydrophobicContact CD1-CG2 3.9Å; I135-T332 WeakPolarHBondContact CD1-O 3.14Å; I135-L333 HydrophobicContact CG2-CD2 3.7Å; I135-S336 VanDerWaalsContact CG2-OG 3.24Å; I135-S336 WeakPolarHBondContact CG2-OG 3.46Å
136	P	96.3	Very high	97.4	Very high	34 Å²	34	53.4 Å²	53.4	22%	0.221	27%	0.271	C	S	.	.	H	α-helix	trans	-50.3	-39.9	177	-30.8	35.8	0	0	0	114.1	D134 S177 L180	D134-P136 WeakPolarHBondContact OD1-CD 3.34Å; P136-S177 WeakPolarHBondContact O-CB 3.41Å; P136-S177 PolarHBondContact O-OG 2.7Å; P136-L180 HydrophobicContact CB-CD1 4.05Å
137	R	95.9	Very high	97.4	Very high	181 Å²	181	59 Å²	59	68%	0.683	30%	0.297	S	S	*	.	H	α-helix	trans	-82.3	-30.8	177.8	-65.5	-174.6	-171.4	-96.4	-1.2	114.6	D134 I135	D134-R137 HydrophobicContact CB-CB 4.33Å; D134-R137 PolarHBondContact O-N 2.76Å; D134-R137 PolarHBondContact OD1-N 2.83Å; D134-R137 WeakPolarHBondContact OD2-CD 3.36Å; D134-R137 VanDerWaalsContact OD2-CG 3.28Å; D134-R137 WeakPolarHBondContact OD2-CG 3.49Å; D134-R137 IonicContact OD2-NE 2.62Å; D134-R137 PolarHBondContact OD2-NE 2.9Å; I135-R137 PolarHBondContact O-N 3.12Å; I135-R137 VanDerWaalsContact O-N 3.14Å
138	N	96.8	Very high	97.5	Very high	64 Å²	64	58.8 Å²	58.8	34%	0.342	30%	0.295	S	S	.	.	H	α-helix	trans	-98	0.5	-177.3	-70.3	-87.5	0	0	0	113.8	I133 D134 I135 T140 I306	I133-N138 HydrophobicContact CD1-CB 3.92Å; I133-N138 HydrophobicContact CG1-CB 4Å; D134-N138 WeakPolarHBondContact O-CB 3.41Å; D134-N138 PolarHBondContact O-N 3.14Å; D134-N138 PolarHBondContact O-ND2 2.68Å; I135-N138 CarbonylContact O-C 3.31Å; I135-N138 PolarHBondContact O-N 3.32Å; I135-N138 VanDerWaalsContact O-N 3.12Å; N138-T140 PolarHBondContact O-N 2.95Å; N138-I306 HydrophobicContact CB-CG2 4.11Å
139	F	98.1	Very high	97.5	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.009	31%	0.305	C	S	.	.	S	Bend	trans	-58.8	-34.4	-179.8	-178.1	-95.4	0	0	0	112.3	I135 P178 V179 M232 I267 W269 A301 L333	I135-F139 WeakPolarHBondContact O-CA 3.43Å; I135-F139 VanDerWaalsContact O-CB 3.25Å; I135-F139 WeakPolarHBondContact O-CB 3.34Å; I135-F139 PolarHBondContact O-N 2.89Å; F139-P178 HydrophobicContact CD1-CG 3.96Å; F139-P178 HydrophobicContact CE1-CG 3.74Å; F139-V179 HydrophobicContact CB-CG2 3.57Å; F139-V179 HydrophobicContact CD1-CG1 4.14Å; F139-V179 HydrophobicContact CD1-CG2 3.83Å; F139-V179 HydrophobicContact CD2-CG1 4.15Å; F139-V179 HydrophobicContact CD2-CG2 3.76Å; F139-V179 HydrophobicContact CE1-CG1 3.89Å; F139-V179 HydrophobicContact CE1-CG2 4.43Å; F139-V179 HydrophobicContact CE2-CG1 3.9Å; F139-V179 HydrophobicContact CE2-CG2 4.37Å; F139-V179 HydrophobicContact CG-CG1 4.25Å; F139-V179 HydrophobicContact CG-CG2 3.44Å; F139-V179 VanDerWaalsContact CG-CG2 3.44Å; F139-V179 HydrophobicContact CZ-CG1 3.76Å; F139-M232 HydrophobicContact CE2-CE 3.55Å; F139-M232 HydrophobicContact CE2-SD 3.88Å; F139-M232 HydrophobicContact CZ-CE 3.5Å; F139-M232 HydrophobicContact CZ-SD 3.72Å; F139-I267 HydrophobicContact CE1-CD1 4.39Å; F139-I267 HydrophobicContact CE1-CG2 3.99Å; F139-I267 HydrophobicContact CZ-CD1 4.35Å; F139-I267 HydrophobicContact CZ-CG2 4.08Å; F139-W269 AromaticContact CD2-NE1 3.94Å; F139-W269 AromaticContact CE1-CD1 3.55Å; F139-W269 AromaticContact CE1-NE1 3.96Å; F139-W269 AromaticContact CE2-CD1 3.84Å; F139-W269 AromaticContact CE2-NE1 3.83Å; F139-W269 AromaticContact CZ-CD1 3.41Å; F139-W269 VanDerWaalsContact CZ-CD1 3.41Å; F139-W269 HydrophobicContact CZ-CG 4.39Å; F139-W269 AromaticContact CZ-NE1 3.84Å; F139-W269 PolarHBondContact O-NE1 3.4Å; F139-A301 HydrophobicContact CD1-CB 4.16Å; F139-A301 HydrophobicContact CE1-CB 3.66Å; F139-L333 HydrophobicContact CD2-CD1 4.23Å; F139-L333 HydrophobicContact CD2-CD2 4.35Å; F139-L333 HydrophobicContact CE2-CD1 4Å
140	T	98.6	Very high	97.5	Very high	4 Å²	4	61.7 Å²	61.7	3%	0.025	32%	0.32	C	S	.	.	S	Bend	trans	-149.6	147.1	177	-177.8	0	0	0	0	109.3	N138 P174 W302	N138-T140 PolarHBondContact O-N 2.95Å; T140-P174 HydrophobicContact CG2-CG 3.68Å; T140-W302 PolarHBondContact OG1-N 3.39Å
141	L	98.6	Very high	97.5	Very high	23 Å²	23	63.1 Å²	63.1	12%	0.12	32%	0.322	C	S	.	.			trans	-58.7	144.8	158.5	-62.4	171.3	0	0	0	108.7	V146 M152 L173 F273 W302	L141-V146 HydrophobicContact CB-CG1 4.4Å; L141-V146 HydrophobicContact CD1-CG1 4.07Å; L141-V146 HydrophobicContact CD2-CG1 4.09Å; L141-V146 HydrophobicContact CG-CG1 4.42Å; L141-M152 HydrophobicContact CD1-CE 4.13Å; L141-L173 HydrophobicContact CB-CD1 4.02Å; L141-L173 HydrophobicContact CB-CD2 4.05Å; L141-F273 HydrophobicContact CD1-CD2 4.15Å; L141-F273 HydrophobicContact CD1-CE2 3.57Å; L141-F273 HydrophobicContact CD1-CZ 4.45Å; L141-W302 WeakPolarHBondContact CB-O 3.31Å; L141-W302 WeakPolarHBondContact CG-O 3.31Å; L141-W302 PolarHBondContact N-O 2.98Å
142	T	98.3	Very high	97.5	Very high	31 Å²	31	56.8 Å²	56.8	19%	0.19	29%	0.292	C	S	.	.			trans	-112.6	163	172.9	55.5	0	0	0	0	109.9	D144 S145 P174	T142-D144 PolarHBondContact O-N 3.03Å; T142-D144 VanDerWaalsContact O-N 3.13Å; T142-S145 PolarHBondContact N-OG 2.79Å; T142-S145 PolarHBondContact O-N 2.85Å; T142-S145 PolarHBondContact O-OG 2.96Å; T142-S145 WeakPolarHBondContact OG1-CB 3.44Å; T142-S145 PolarHBondContact OG1-N 3.01Å; T142-S145 PolarHBondContact OG1-OG 2.77Å; T142-P174 WeakPolarHBondContact CA-O 3.25Å; T142-P174 WeakPolarHBondContact CB-O 3.43Å
143	R	96.8	Very high	97.5	Very high	69 Å²	69	56.5 Å²	56.5	26%	0.26	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.4	-179.5	-173.3	169	-63.4	160.3	6.5	113.7	R170 S171 L173 P174 E175	R143-R170 HydrophobicContact CG-CG 4.19Å; R143-R170 PolarHBondContact O-NE 2.95Å; R143-R170 PolarHBondContact O-NH2 3.31Å; R143-S171 PolarHBondContact NH2-O 2.77Å; R143-L173 PolarHBondContact NH2-O 3.45Å; R143-P174 PolarHBondContact N-O 3.43Å; R143-P174 VanDerWaalsContact N-O 3.1Å; R143-E175 VanDerWaalsContact CB-OE2 3.27Å; R143-E175 WeakPolarHBondContact CB-OE2 3.44Å; R143-E175 WeakPolarHBondContact CD-OE2 3.25Å; R143-E175 IonicContact CZ-OE1 3.41Å; R143-E175 IonicContact CZ-OE2 3.8Å; R143-E175 IonicContact NE-OE1 2.65Å; R143-E175 IonicContact NE-OE2 3.91Å; R143-E175 VanDerWaalsContact NH1-CD 3.31Å; R143-E175 IonicContact NH1-OE1 3.25Å; R143-E175 PolarHBondContact NH1-OE1 2.96Å; R143-E175 IonicContact NH1-OE2 3.37Å
144	D	96.2	Very high	97.6	Very high	128 Å²	128	56.5 Å²	56.5	68%	0.684	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-17.6	-179	-64.7	-23.7	0	0	0	113.6	T142 V146 R170	T142-D144 PolarHBondContact O-N 3.03Å; T142-D144 VanDerWaalsContact O-N 3.13Å; D144-V146 PolarHBondContact O-N 2.93Å; D144-R170 IonicContact OD1-NH2 3.9Å
145	S	96.7	Very high	97.6	Very high	59 Å²	59	55.4 Å²	55.4	41%	0.413	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-8.7	176.5	69.3	0	0	0	0	114.1	T142	T142-S145 PolarHBondContact N-OG 2.79Å; T142-S145 PolarHBondContact O-N 2.85Å; T142-S145 PolarHBondContact O-OG 2.96Å; T142-S145 WeakPolarHBondContact OG1-CB 3.44Å; T142-S145 PolarHBondContact OG1-N 3.01Å; T142-S145 PolarHBondContact OG1-OG 2.77Å
146	V	97.6	Very high	97.5	Very high	5 Å²	5	57.8 Å²	57.8	3%	0.03	29%	0.293	C	S	.	.			trans	-133.9	151.8	-178.6	-59.2	0	0	0	0	112.6	L141 D144 I165 R170 L173	L141-V146 HydrophobicContact CB-CG1 4.4Å; L141-V146 HydrophobicContact CD1-CG1 4.07Å; L141-V146 HydrophobicContact CD2-CG1 4.09Å; L141-V146 HydrophobicContact CG-CG1 4.42Å; D144-V146 PolarHBondContact O-N 2.93Å; V146-I165 HydrophobicContact CG2-CG2 4.2Å; V146-R170 HydrophobicContact CG2-CG 4.21Å; V146-L173 HydrophobicContact CG1-CD1 4.49Å; V146-L173 HydrophobicContact CG2-CD1 3.4Å; V146-L173 VanDerWaalsContact CG2-CD1 3.4Å
147	K	98.1	Very high	97.5	Very high	164 Å²	164	57.5 Å²	57.5	71%	0.713	29%	0.292	S	S	*	.			trans	-110.8	148.1	173.2	-61.8	-179.1	-177.2	-179.7	0	110.8	G149 Q150	K147-G149 PolarHBondContact O-N 2.94Å; K147-Q150 HydrophobicContact CB-CB 4.46Å; K147-Q150 WeakPolarHBondContact O-CB 3.48Å; K147-Q150 PolarHBondContact O-N 3.2Å; K147-Q150 VanDerWaalsContact O-N 3.09Å
148	V	98.2	Very high	97.5	Very high	64 Å²	64	52 Å²	52	39%	0.388	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	135.5	170.5	179.5	0	0	0	0	108.6	Q150 I165 E167	V148-Q150 VanDerWaalsContact C-N 3.29Å; V148-Q150 PolarHBondContact O-N 3.1Å; V148-I165 WeakPolarHBondContact CA-O 3.34Å; V148-E167 HydrophobicContact CG1-CG 4.15Å; V148-E167 VanDerWaalsContact CG2-CD 3.5Å; V148-E167 HydrophobicContact CG2-CG 4.33Å; V148-E167 WeakPolarHBondContact CG2-OE1 3.41Å; V148-E167 WeakPolarHBondContact CG2-OE2 3.32Å
149	G	98	Very high	97.4	Very high	43 Å²	43	55.7 Å²	55.7	44%	0.443	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-13.1	-172.3	0	0	0	0	0	114.8	K147 L151 S164 I165	K147-G149 PolarHBondContact O-N 2.94Å; G149-L151 PolarHBondContact O-N 2.87Å; G149-S164 PolarHBondContact O-OG 3.21Å; G149-I165 PolarHBondContact N-O 3.12Å
150	Q	98.3	Very high	97.4	Very high	69 Å²	69	62.7 Å²	62.7	32%	0.322	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-56.8	135.2	178.6	-180	175.1	-13.1	0	0	111.5	K147 V148 M152 S164 I165	K147-Q150 HydrophobicContact CB-CB 4.46Å; K147-Q150 WeakPolarHBondContact O-CB 3.48Å; K147-Q150 PolarHBondContact O-N 3.2Å; K147-Q150 VanDerWaalsContact O-N 3.09Å; V148-Q150 VanDerWaalsContact C-N 3.29Å; V148-Q150 PolarHBondContact O-N 3.1Å; Q150-M152 HydrophobicContact CG-SD 4.21Å; Q150-S164 CarbonylContact O-C 3.22Å; Q150-S164 WeakPolarHBondContact O-CA 3.25Å; Q150-I165 HydrophobicContact CB-CB 4.46Å; Q150-I165 HydrophobicContact CB-CG1 4.31Å; Q150-I165 PolarHBondContact O-N 3.5Å
151	L	98.2	Very high	97.4	Very high	99 Å²	99	66.6 Å²	66.6	52%	0.518	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	117.1	177.5	-58.2	-177.2	0	0	0	110.1	G149 V162	G149-L151 PolarHBondContact O-N 2.87Å; L151-V162 HydrophobicContact CB-CB 4.39Å; L151-V162 HydrophobicContact CB-CG1 4.46Å
152	M	98.1	Very high	97.3	Very high	12 Å²	12	68.7 Å²	68.7	6%	0.059	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	137.8	173.6	-58.3	-59.6	-69	0	0	110.2	L141 Q150 V162 Y163 I165 F273	L141-M152 HydrophobicContact CD1-CE 4.13Å; Q150-M152 HydrophobicContact CG-SD 4.21Å; M152-V162 CarbonylContact O-C 3.57Å; M152-V162 VanDerWaalsContact O-CA 3.3Å; M152-V162 WeakPolarHBondContact O-CA 3.31Å; M152-Y163 PolarHBondContact N-O 3.42Å; M152-Y163 PolarHBondContact O-N 3.45Å; M152-I165 HydrophobicContact CG-CD1 3.63Å; M152-I165 HydrophobicContact CG-CG1 3.74Å; M152-I165 HydrophobicContact SD-CG1 4.39Å; M152-F273 HydrophobicContact CB-CD1 3.59Å; M152-F273 HydrophobicContact CB-CE1 3.61Å; M152-F273 HydrophobicContact CB-CG 4.31Å; M152-F273 HydrophobicContact CB-CZ 4.34Å; M152-F273 HydrophobicContact CE-CD2 4.34Å; M152-F273 HydrophobicContact CE-CE2 4.46Å; M152-F273 HydrophobicContact CG-CD1 4.15Å; M152-F273 HydrophobicContact CG-CE1 3.75Å; M152-F273 HydrophobicContact CG-CZ 4Å
153	H	98	Very high	97.3	Very high	54 Å²	54	67.7 Å²	67.7	25%	0.25	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-96.5	173.8	172.2	-65.1	-86.8	0	0	0	110.9	H159 N305	H153-H159 AromaticContact CD2-NE2 3.94Å; H153-H159 AromaticContact CE1-CD2 3.53Å; H153-H159 AromaticContact CE1-NE2 3.54Å; H153-H159 PolarHBondContact CE1-O 3.24Å; H153-H159 VanDerWaalsContact CE1-O 3.24Å; H153-H159 AromaticContact CG-CE1 3.81Å; H153-H159 AromaticContact CG-NE2 3.99Å; H153-H159 AromaticContact ND1-CD2 3.71Å; H153-H159 AromaticContact ND1-CE1 3.88Å; H153-H159 AromaticContact ND1-CG 3.84Å; H153-H159 AromaticContact ND1-ND1 3.94Å; H153-H159 AromaticContact ND1-NE2 3.76Å; H153-H159 PolarHBondContact ND1-O 3.35Å; H153-H159 AromaticContact NE2-NE2 3.67Å; H153-N305 PolarHBondContact O-ND2 3.41Å
154	F	98	Very high	97.4	Very high	10 Å²	10	66.6 Å²	66.6	4%	0.044	35%	0.352	C	S	.	.			trans	-115.7	126.9	-177.2	-61	-91.7	0	0	0	112.1	Y156 S157 A272 F273 F275 H276 A279	F154-Y156 VanDerWaalsContact C-N 3.26Å; F154-Y156 PolarHBondContact O-N 3.24Å; F154-Y156 VanDerWaalsContact O-N 3.14Å; F154-S157 PolarHBondContact O-N 3.2Å; F154-S157 VanDerWaalsContact O-N 3.17Å; F154-A272 WeakPolarHBondContact CE1-O 3.42Å; F154-F273 CarbonylContact C-O 3.57Å; F154-F273 WeakPolarHBondContact CA-O 3.17Å; F154-F275 WeakPolarHBondContact CD1-O 3.39Å; F154-F275 WeakPolarHBondContact CE1-O 3.42Å; F154-H276 HydrophobicContact CD1-CB 4.49Å; F154-H276 HydrophobicContact CD2-CB 3.8Å; F154-H276 HydrophobicContact CE2-CB 4Å; F154-H276 HydrophobicContact CG-CB 4.06Å; F154-H276 HydrophobicContact CZ-CB 4.42Å; F154-A279 HydrophobicContact CZ-CB 3.97Å
155	D	96.9	Very high	97.5	Very high	44 Å²	44	60.6 Å²	60.6	24%	0.235	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-34.6	-172.3	-77.2	-6.1	0	0	0	114.1	F273 F274 N305 I306 M307	D155-F273 PolarHBondContact N-O 3.02Å; D155-F274 HydrophobicContact CB-CD1 4.43Å; D155-N305 VanDerWaalsContact OD1-CA 3.27Å; D155-N305 WeakPolarHBondContact OD1-CA 3.31Å; D155-N305 WeakPolarHBondContact OD1-CB 3.48Å; D155-N305 PolarHBondContact OD1-ND2 2.88Å; D155-I306 PolarHBondContact OD2-N 3.35Å; D155-M307 HydrophobicContact CB-CB 4.06Å; D155-M307 HydrophobicContact CB-CG 4.29Å; D155-M307 WeakPolarHBondContact OD2-CB 3.47Å; D155-M307 VanDerWaalsContact OD2-CG 3.29Å; D155-M307 WeakPolarHBondContact OD2-CG 3.49Å; D155-M307 PolarHBondContact OD2-N 3.42Å
156	Y	95.1	Very high	97.6	Very high	54 Å²	54	59.3 Å²	59.3	21%	0.212	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	23.7	-177	-58.7	-62.9	0	0	0	113.2	F154 F274 F275 M307 R323	F154-Y156 VanDerWaalsContact C-N 3.26Å; F154-Y156 PolarHBondContact O-N 3.24Å; F154-Y156 VanDerWaalsContact O-N 3.14Å; Y156-F274 WeakPolarHBondContact CB-O 3.27Å; Y156-F274 HydrophobicContact CD2-CB 4.09Å; Y156-F274 HydrophobicContact CE2-CB 4.44Å; Y156-F274 HydrophobicContact CE2-CD2 4.39Å; Y156-F274 HydrophobicContact CE2-CG 4.42Å; Y156-F274 PolarHBondContact N-O 3.35Å; Y156-F275 HydrophobicContact CD2-CD1 4.48Å; Y156-F275 AromaticContact CD2-CE1 3.71Å; Y156-F275 HydrophobicContact CD2-CE1 3.71Å; Y156-F275 HydrophobicContact CD2-CE2 4.16Å; Y156-F275 AromaticContact CD2-CZ 3.48Å; Y156-F275 HydrophobicContact CD2-CZ 3.48Å; Y156-F275 VanDerWaalsContact CD2-CZ 3.48Å; Y156-F275 HydrophobicContact CE2-CZ 4.17Å; Y156-F275 AromaticContact CG-CE1 3.92Å; Y156-F275 HydrophobicContact CG-CE1 3.92Å; Y156-F275 HydrophobicContact CG-CZ 4.16Å; Y156-M307 HydrophobicContact CE2-CB 4.35Å; Y156-M307 HydrophobicContact CE2-CG 3.83Å; Y156-M307 WeakPolarHBondContact OH-CE 3.21Å; Y156-M307 WeakPolarHBondContact OH-CG 3.24Å; Y156-R323 HydrophobicContact CD1-CB 4.43Å; Y156-R323 HydrophobicContact CD2-CG 4.46Å; Y156-R323 HydrophobicContact CE1-CB 4.09Å; Y156-R323 HydrophobicContact CE1-CG 4.11Å; Y156-R323 HydrophobicContact CE2-CG 4.01Å
157	S	96.2	Very high	97.6	Very high	28 Å²	28	64.7 Å²	64.7	20%	0.196	34%	0.341	C	S	.	.	S	Bend	trans	-130.7	164.8	177.2	-51.9	0	0	0	0	111.8	F154 H276	F154-S157 PolarHBondContact O-N 3.2Å; F154-S157 VanDerWaalsContact O-N 3.17Å; S157-H276 WeakPolarHBondContact CB-ND1 3.27Å; S157-H276 PolarHBondContact OG-N 3.3Å; S157-H276 PolarHBondContact OG-ND1 3.23Å
158	S	96.6	Very high	97.6	Very high	66 Å²	66	60.4 Å²	60.4	46%	0.462	33%	0.325	S	S	.	.			trans	-57.5	142.7	173.8	177.3	0	0	0	0	111	K160 Y161	S158-K160 PolarHBondContact O-N 2.79Å; S158-Y161 WeakPolarHBondContact O-CD2 3.34Å; S158-Y161 PolarHBondContact O-N 3.43Å; S158-Y161 VanDerWaalsContact O-N 3.09Å
159	H	95.8	Very high	97.6	Very high	141 Å²	141	57.4 Å²	57.4	65%	0.653	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.1	-176.6	-145	74.9	0	0	0	113.9	H153 Y161	H153-H159 AromaticContact CD2-NE2 3.94Å; H153-H159 AromaticContact CE1-CD2 3.53Å; H153-H159 AromaticContact CE1-NE2 3.54Å; H153-H159 PolarHBondContact CE1-O 3.24Å; H153-H159 VanDerWaalsContact CE1-O 3.24Å; H153-H159 AromaticContact CG-CE1 3.81Å; H153-H159 AromaticContact CG-NE2 3.99Å; H153-H159 AromaticContact ND1-CD2 3.71Å; H153-H159 AromaticContact ND1-CE1 3.88Å; H153-H159 AromaticContact ND1-CG 3.84Å; H153-H159 AromaticContact ND1-ND1 3.94Å; H153-H159 AromaticContact ND1-NE2 3.76Å; H153-H159 PolarHBondContact ND1-O 3.35Å; H153-H159 AromaticContact NE2-NE2 3.67Å; H159-Y161 PolarHBondContact O-N 3.17Å
160	K	96.9	Very high	97.6	Very high	150 Å²	150	58.6 Å²	58.6	65%	0.652	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.1	175.2	73	-176.4	-178.6	176.5	0	114.1	S158	S158-K160 PolarHBondContact O-N 2.79Å
161	Y	98.1	Very high	97.6	Very high	85 Å²	85	56.8 Å²	56.8	33%	0.333	29%	0.293	S	S	.	.			trans	-84.6	127.1	179.3	-62.3	-69.9	0	0	0	109.9	S158 H159 H276	S158-Y161 WeakPolarHBondContact O-CD2 3.34Å; S158-Y161 PolarHBondContact O-N 3.43Å; S158-Y161 VanDerWaalsContact O-N 3.09Å; H159-Y161 PolarHBondContact O-N 3.17Å; Y161-H276 HydrophobicContact CD1-CB 3.98Å; Y161-H276 AromaticContact CD1-CD2 3.68Å; Y161-H276 AromaticContact CD1-CG 3.91Å; Y161-H276 HydrophobicContact CD2-CB 3.91Å; Y161-H276 AromaticContact CD2-CG 3.69Å; Y161-H276 AromaticContact CD2-ND1 3.93Å; Y161-H276 AromaticContact CE1-CD2 3.55Å; Y161-H276 AromaticContact CE1-NE2 3.99Å; Y161-H276 AromaticContact CE2-CD2 3.95Å; Y161-H276 AromaticContact CE2-CE1 3.97Å; Y161-H276 AromaticContact CE2-CG 3.94Å; Y161-H276 AromaticContact CE2-ND1 3.96Å; Y161-H276 AromaticContact CE2-NE2 3.98Å; Y161-H276 HydrophobicContact CG-CB 3.54Å; Y161-H276 AromaticContact CG-CD2 3.93Å; Y161-H276 AromaticContact CG-CG 3.68Å; Y161-H276 AromaticContact CZ-CD2 3.69Å; Y161-H276 AromaticContact CZ-NE2 3.7Å
162	V	97.6	Very high	97.6	Very high	68 Å²	68	53 Å²	53	41%	0.412	27%	0.273	S	S	.	.			trans	-132.3	151.3	-178	-65.3	0	0	0	0	111.4	L151 M152	L151-V162 HydrophobicContact CB-CB 4.39Å; L151-V162 HydrophobicContact CB-CG1 4.46Å; M152-V162 CarbonylContact O-C 3.57Å; M152-V162 VanDerWaalsContact O-CA 3.3Å; M152-V162 WeakPolarHBondContact O-CA 3.31Å
163	Y	97.9	Very high	97.6	Very high	9 Å²	9	52.5 Å²	52.5	4%	0.035	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	120.2	169.8	-176.8	-82.4	0	0	0	109.1	M152 I165 F169 F273 A279 T282 R283	M152-Y163 PolarHBondContact N-O 3.42Å; M152-Y163 PolarHBondContact O-N 3.45Å; Y163-I165 HydrophobicContact CD1-CD1 4.18Å; Y163-I165 HydrophobicContact CE1-CD1 4.26Å; Y163-F169 HydrophobicContact CE1-CD2 4.23Å; Y163-F273 AromaticContact CD1-CE1 3.76Å; Y163-F273 HydrophobicContact CD1-CE1 3.76Å; Y163-F273 HydrophobicContact CD1-CZ 4.39Å; Y163-F273 HydrophobicContact CE1-CE1 4.42Å; Y163-F273 HydrophobicContact CG-CE1 4.09Å; Y163-A279 HydrophobicContact CD2-CB 4.23Å; Y163-T282 HydrophobicContact CE2-CG2 4.05Å; Y163-R283 HydrophobicContact CE2-CG 4.06Å
164	S	98.2	Very high	97.6	Very high	47 Å²	47	51.4 Å²	51.4	33%	0.329	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.9	176	-171.9	0	0	0	0	111	G149 Q150 G166	G149-S164 PolarHBondContact O-OG 3.21Å; Q150-S164 CarbonylContact O-C 3.22Å; Q150-S164 WeakPolarHBondContact O-CA 3.25Å; S164-G166 PolarHBondContact O-N 3.39Å
165	I	98.5	Very high	97.6	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	29%	0.289	C	S	.	.			trans	-70.5	113.4	176.1	-60.7	-61.3	0	0	0	109.7	V146 V148 G149 Q150 M152 Y163 F169 R170 F273	V146-I165 HydrophobicContact CG2-CG2 4.2Å; V148-I165 WeakPolarHBondContact CA-O 3.34Å; G149-I165 PolarHBondContact N-O 3.12Å; Q150-I165 HydrophobicContact CB-CB 4.46Å; Q150-I165 HydrophobicContact CB-CG1 4.31Å; Q150-I165 PolarHBondContact O-N 3.5Å; M152-I165 HydrophobicContact CG-CD1 3.63Å; M152-I165 HydrophobicContact CG-CG1 3.74Å; M152-I165 HydrophobicContact SD-CG1 4.39Å; Y163-I165 HydrophobicContact CD1-CD1 4.18Å; Y163-I165 HydrophobicContact CE1-CD1 4.26Å; I165-F169 HydrophobicContact CD1-CD1 3.68Å; I165-F169 HydrophobicContact CD1-CE1 3.75Å; I165-F169 HydrophobicContact CD1-CG 4.27Å; I165-F169 HydrophobicContact CD1-CZ 4.41Å; I165-F169 HydrophobicContact CG2-CD1 4.13Å; I165-R170 HydrophobicContact CG2-CB 4.26Å; I165-F273 HydrophobicContact CD1-CE1 4.33Å; I165-F273 HydrophobicContact CD1-CZ 3.8Å
166	G	98.2	Very high	97.6	Very high	33 Å²	33	58.4 Å²	58.4	34%	0.34	31%	0.306	S	S	.	.			trans	-90.7	168.9	172.2	0	0	0	0	0	113.1	S164 N168 F169 R170	S164-G166 PolarHBondContact O-N 3.39Å; G166-N168 VanDerWaalsContact C-N 3.32Å; G166-N168 PolarHBondContact O-N 3.46Å; G166-F169 PolarHBondContact O-N 3.43Å; G166-R170 PolarHBondContact O-N 3.49Å
167	E	98.1	Very high	97.7	Very high	118 Å²	118	56.3 Å²	56.3	55%	0.551	30%	0.3	S	S	*	.	H	α-helix	trans	-53.8	-47.6	175.4	-69.2	-66.9	175.2	0	0	112.1	V148 F169 R170 S171	V148-E167 HydrophobicContact CG1-CG 4.15Å; V148-E167 VanDerWaalsContact CG2-CD 3.5Å; V148-E167 HydrophobicContact CG2-CG 4.33Å; V148-E167 WeakPolarHBondContact CG2-OE1 3.41Å; V148-E167 WeakPolarHBondContact CG2-OE2 3.32Å; E167-F169 PolarHBondContact O-N 3.3Å; E167-R170 PolarHBondContact O-N 2.89Å; E167-S171 VanDerWaalsContact O-CB 3.3Å; E167-S171 WeakPolarHBondContact O-CB 3.4Å; E167-S171 PolarHBondContact O-N 2.89Å
168	N	98.3	Very high	97.7	Very high	73 Å²	73	56 Å²	56	39%	0.39	30%	0.297	S	S	.	.	H	α-helix	trans	-56.6	-48	179.2	-77.5	0.2	0	0	0	111.9	G166 S171 L172 V286 V290	G166-N168 VanDerWaalsContact C-N 3.32Å; G166-N168 PolarHBondContact O-N 3.46Å; N168-S171 PolarHBondContact O-N 3.35Å; N168-S171 PolarHBondContact O-OG 3.17Å; N168-L172 WeakPolarHBondContact O-CG 3.2Å; N168-L172 PolarHBondContact O-N 2.91Å; N168-V286 HydrophobicContact CB-CG1 3.62Å; N168-V290 HydrophobicContact CB-CG2 3.86Å
169	F	98.6	Very high	97.6	Very high	2 Å²	2	53 Å²	53	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-50.8	177.7	-176.1	-79.5	0	0	0	111	Y163 I165 G166 E167 S171 L172 L173 F273 T282 V286 W302	Y163-F169 HydrophobicContact CE1-CD2 4.23Å; I165-F169 HydrophobicContact CD1-CD1 3.68Å; I165-F169 HydrophobicContact CD1-CE1 3.75Å; I165-F169 HydrophobicContact CD1-CG 4.27Å; I165-F169 HydrophobicContact CD1-CZ 4.41Å; I165-F169 HydrophobicContact CG2-CD1 4.13Å; G166-F169 PolarHBondContact O-N 3.43Å; E167-F169 PolarHBondContact O-N 3.3Å; F169-S171 PolarHBondContact O-N 3.33Å; F169-L172 PolarHBondContact O-N 3.35Å; F169-L173 HydrophobicContact CD1-CD1 4.37Å; F169-L173 HydrophobicContact CD1-CD2 4.39Å; F169-L173 HydrophobicContact CD1-CG 4.35Å; F169-L173 HydrophobicContact CE1-CD1 4.1Å; F169-L173 HydrophobicContact CE1-CD2 3.73Å; F169-L173 HydrophobicContact CE1-CG 4.11Å; F169-L173 HydrophobicContact CZ-CD2 4.28Å; F169-F273 HydrophobicContact CE1-CE2 4.3Å; F169-F273 HydrophobicContact CE1-CZ 4.05Å; F169-F273 HydrophobicContact CE2-CE2 4.39Å; F169-F273 AromaticContact CE2-CZ 3.92Å; F169-F273 HydrophobicContact CE2-CZ 3.92Å; F169-F273 AromaticContact CZ-CE2 3.65Å; F169-F273 HydrophobicContact CZ-CE2 3.65Å; F169-F273 AromaticContact CZ-CZ 3.48Å; F169-F273 HydrophobicContact CZ-CZ 3.48Å; F169-F273 VanDerWaalsContact CZ-CZ 3.48Å; F169-T282 HydrophobicContact CD2-CG2 4.49Å; F169-T282 HydrophobicContact CE2-CG2 4.3Å; F169-V286 HydrophobicContact CB-CG1 4.42Å; F169-V286 HydrophobicContact CB-CG2 4.29Å; F169-V286 HydrophobicContact CD2-CG2 3.63Å; F169-V286 HydrophobicContact CE2-CG2 4.44Å; F169-V286 HydrophobicContact CG-CG2 4.4Å; F169-W302 HydrophobicContact CE2-CD2 4.1Å; F169-W302 AromaticContact CE2-CE3 3.72Å; F169-W302 HydrophobicContact CE2-CE3 3.72Å; F169-W302 HydrophobicContact CE2-CZ3 4Å; F169-W302 HydrophobicContact CZ-CB 4.12Å; F169-W302 HydrophobicContact CZ-CD2 4.08Å; F169-W302 AromaticContact CZ-CE3 3.99Å; F169-W302 HydrophobicContact CZ-CE3 3.99Å; F169-W302 HydrophobicContact CZ-CG 4.17Å
170	R	98.4	Very high	97.6	Very high	68 Å²	68	49.2 Å²	49.2	26%	0.257	26%	0.26	S	S	.	.	H	α-helix	trans	-58.2	-36.3	179.6	-177.9	174.8	179.7	-98.6	-2.8	111.8	R143 D144 V146 I165 G166 E167 L172 L173	R143-R170 HydrophobicContact CG-CG 4.19Å; R143-R170 PolarHBondContact O-NE 2.95Å; R143-R170 PolarHBondContact O-NH2 3.31Å; D144-R170 IonicContact OD1-NH2 3.9Å; V146-R170 HydrophobicContact CG2-CG 4.21Å; I165-R170 HydrophobicContact CG2-CB 4.26Å; G166-R170 PolarHBondContact O-N 3.49Å; E167-R170 PolarHBondContact O-N 2.89Å; R170-L172 PolarHBondContact O-N 3.37Å; R170-L173 WeakPolarHBondContact O-CB 2.99Å; R170-L173 PolarHBondContact O-N 2.95Å
171	S	98.1	Very high	97.5	Very high	30 Å²	30	49.5 Å²	49.5	21%	0.21	27%	0.269	C	S	.	.	H	α-helix	trans	-67.2	-22.6	179.5	89.7	0	0	0	0	113.6	R143 E167 N168 F169 R293	R143-S171 PolarHBondContact NH2-O 2.77Å; E167-S171 VanDerWaalsContact O-CB 3.3Å; E167-S171 WeakPolarHBondContact O-CB 3.4Å; E167-S171 PolarHBondContact O-N 2.89Å; N168-S171 PolarHBondContact O-N 3.35Å; N168-S171 PolarHBondContact O-OG 3.17Å; F169-S171 PolarHBondContact O-N 3.33Å; S171-R293 PolarHBondContact O-NH2 3.02Å; S171-R293 PolarHBondContact OG-NH2 3.04Å
172	L	98.3	Very high	97.4	Very high	20 Å²	20	50.4 Å²	50.4	11%	0.105	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.2	176.7	-63.6	176.9	0	0	0	113.3	N168 F169 R170 V286 F289 V290 L300 W302	N168-L172 WeakPolarHBondContact O-CG 3.2Å; N168-L172 PolarHBondContact O-N 2.91Å; F169-L172 PolarHBondContact O-N 3.35Å; R170-L172 PolarHBondContact O-N 3.37Å; L172-V286 HydrophobicContact CD1-CB 4.23Å; L172-V286 HydrophobicContact CD1-CG1 3.98Å; L172-V286 HydrophobicContact CD1-CG2 4.27Å; L172-F289 HydrophobicContact CD1-CB 3.65Å; L172-F289 HydrophobicContact CD1-CD2 4.45Å; L172-F289 HydrophobicContact CD2-CB 3.79Å; L172-F289 HydrophobicContact CG-CB 4.38Å; L172-V290 HydrophobicContact CD1-CG2 4.25Å; L172-V290 HydrophobicContact CD2-CG2 4.12Å; L172-V290 HydrophobicContact CG-CG2 4.15Å; L172-L300 HydrophobicContact CB-CD1 4.24Å; L172-L300 HydrophobicContact CD2-CD1 4.21Å; L172-W302 HydrophobicContact CD1-CZ2 4.35Å
173	L	98.5	Very high	97.4	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.01	27%	0.273	C	S	.	.	S	Bend	trans	-74.2	142.4	175.9	-61.2	-178.6	0	0	0	110.7	L141 R143 V146 F169 R170 W302	L141-L173 HydrophobicContact CB-CD1 4.02Å; L141-L173 HydrophobicContact CB-CD2 4.05Å; R143-L173 PolarHBondContact NH2-O 3.45Å; V146-L173 HydrophobicContact CG1-CD1 4.49Å; V146-L173 HydrophobicContact CG2-CD1 3.4Å; V146-L173 VanDerWaalsContact CG2-CD1 3.4Å; F169-L173 HydrophobicContact CD1-CD1 4.37Å; F169-L173 HydrophobicContact CD1-CD2 4.39Å; F169-L173 HydrophobicContact CD1-CG 4.35Å; F169-L173 HydrophobicContact CE1-CD1 4.1Å; F169-L173 HydrophobicContact CE1-CD2 3.73Å; F169-L173 HydrophobicContact CE1-CG 4.11Å; F169-L173 HydrophobicContact CZ-CD2 4.28Å; R170-L173 WeakPolarHBondContact O-CB 2.99Å; R170-L173 PolarHBondContact O-N 2.95Å; L173-W302 HydrophobicContact CD2-CB 3.76Å; L173-W302 HydrophobicContact CD2-CG 3.82Å
174	P	97.8	Very high	97.4	Very high	30 Å²	30	54 Å²	54	20%	0.195	28%	0.281	C	S	.	.			trans	-72.2	156.8	173.9	32.8	-36	0	0	0	111	T140 T142 R143 V176	T140-P174 HydrophobicContact CG2-CG 3.68Å; T142-P174 WeakPolarHBondContact CA-O 3.25Å; T142-P174 WeakPolarHBondContact CB-O 3.43Å; R143-P174 PolarHBondContact N-O 3.43Å; R143-P174 VanDerWaalsContact N-O 3.1Å; P174-V176 WeakPolarHBondContact CB-O 3.43Å
175	E	97.1	Very high	97.4	Very high	101 Å²	101	56.1 Å²	56.1	47%	0.472	29%	0.289	S	S	.	.	S	Bend	trans	-71.3	-40.3	172.4	-58.6	-67.4	-159.1	0	0	111.3	R143	R143-E175 VanDerWaalsContact CB-OE2 3.27Å; R143-E175 WeakPolarHBondContact CB-OE2 3.44Å; R143-E175 WeakPolarHBondContact CD-OE2 3.25Å; R143-E175 IonicContact CZ-OE1 3.41Å; R143-E175 IonicContact CZ-OE2 3.8Å; R143-E175 IonicContact NE-OE1 2.65Å; R143-E175 IonicContact NE-OE2 3.91Å; R143-E175 VanDerWaalsContact NH1-CD 3.31Å; R143-E175 IonicContact NH1-OE1 3.25Å; R143-E175 PolarHBondContact NH1-OE1 2.96Å; R143-E175 IonicContact NH1-OE2 3.37Å
176	V	96.8	Very high	97.4	Very high	100 Å²	100	58.2 Å²	58.2	61%	0.606	30%	0.3	S	S	*	.	S	Bend	trans	-130	149.2	179.1	-63.1	0	0	0	0	110.1	P174	P174-V176 WeakPolarHBondContact CB-O 3.43Å
177	S	97.3	Very high	97.4	Very high	10 Å²	10	56.7 Å²	56.7	7%	0.07	28%	0.283	C	S	.	.			trans	-58.8	131.4	177.3	173.2	0	0	0	0	111.1	P136 V179 L180	P136-S177 WeakPolarHBondContact O-CB 3.41Å; P136-S177 PolarHBondContact O-OG 2.7Å; S177-V179 PolarHBondContact O-N 2.99Å; S177-V179 VanDerWaalsContact O-N 3.13Å; S177-V179 WeakPolarHBondContact OG-CG2 3.42Å; S177-L180 VanDerWaalsContact O-CB 3.3Å; S177-L180 WeakPolarHBondContact O-CB 3.3Å; S177-L180 PolarHBondContact O-N 2.97Å; S177-L180 VanDerWaalsContact O-N 3.09Å
178	P	95.8	Very high	97.4	Very high	23 Å²	23	51 Å²	51	15%	0.149	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.5	-177.2	28.2	-35.8	0	0	0	113.3	F139 I267	F139-P178 HydrophobicContact CD1-CG 3.96Å; F139-P178 HydrophobicContact CE1-CG 3.74Å; P178-I267 HydrophobicContact CB-CD1 4.01Å; P178-I267 HydrophobicContact CB-CG1 4.45Å; P178-I267 HydrophobicContact CG-CD1 4.07Å
179	V	96.3	Very high	97.4	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.018	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	2.2	178	-59.3	0	0	0	0	112.8	F139 S177 N181 K182 I267 M337	F139-V179 HydrophobicContact CB-CG2 3.57Å; F139-V179 HydrophobicContact CD1-CG1 4.14Å; F139-V179 HydrophobicContact CD1-CG2 3.83Å; F139-V179 HydrophobicContact CD2-CG1 4.15Å; F139-V179 HydrophobicContact CD2-CG2 3.76Å; F139-V179 HydrophobicContact CE1-CG1 3.89Å; F139-V179 HydrophobicContact CE1-CG2 4.43Å; F139-V179 HydrophobicContact CE2-CG1 3.9Å; F139-V179 HydrophobicContact CE2-CG2 4.37Å; F139-V179 HydrophobicContact CG-CG1 4.25Å; F139-V179 HydrophobicContact CG-CG2 3.44Å; F139-V179 VanDerWaalsContact CG-CG2 3.44Å; F139-V179 HydrophobicContact CZ-CG1 3.76Å; S177-V179 PolarHBondContact O-N 2.99Å; S177-V179 VanDerWaalsContact O-N 3.13Å; S177-V179 WeakPolarHBondContact OG-CG2 3.42Å; V179-N181 PolarHBondContact O-N 3.21Å; V179-K182 WeakPolarHBondContact O-CB 3.49Å; V179-K182 PolarHBondContact O-N 2.94Å; V179-I267 HydrophobicContact CG1-CD1 4.1Å; V179-M337 HydrophobicContact CB-SD 4.23Å; V179-M337 HydrophobicContact CG1-SD 3.79Å
180	L	95.9	Very high	97.4	Very high	61 Å²	61	47.5 Å²	47.5	32%	0.319	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	130.2	177.3	-169.6	66.5	0	0	0	110.2	P136 S177 K182	P136-L180 HydrophobicContact CB-CD1 4.05Å; S177-L180 VanDerWaalsContact O-CB 3.3Å; S177-L180 WeakPolarHBondContact O-CB 3.3Å; S177-L180 PolarHBondContact O-N 2.97Å; S177-L180 VanDerWaalsContact O-N 3.09Å; L180-K182 PolarHBondContact O-N 3.11Å; L180-K182 VanDerWaalsContact O-N 3.13Å
181	N	94.3	Very high	97.4	Very high	155 Å²	155	44.6 Å²	44.6	83%	0.829	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	26.6	-177.2	-55.5	-29.7	0	0	0	113.9	V179	V179-N181 PolarHBondContact O-N 3.21Å
182	K	96.1	Very high	97.4	Very high	105 Å²	105	44 Å²	44	46%	0.457	22%	0.224	S	C	.	.			trans	-96.1	136.1	173.9	-60	-55.7	-178.3	-175.9	0	110.7	V179 L180 Y184	V179-K182 WeakPolarHBondContact O-CB 3.49Å; V179-K182 PolarHBondContact O-N 2.94Å; L180-K182 PolarHBondContact O-N 3.11Å; L180-K182 VanDerWaalsContact O-N 3.13Å; K182-Y184 HydrophobicContact CB-CE2 4.02Å
183	R	96.5	Very high	97.3	Very high	97 Å²	97	43.5 Å²	43.5	37%	0.366	22%	0.222	S	C	.	.			trans	-138.5	130.1	175.8	-159.8	77.9	-170.7	145.7	18.9	108.9	R126 S336 M337 C338 D339	R126-R183 VanDerWaalsContact CZ-CZ 3.44Å; R183-S336 PolarHBondContact NH1-O 2.93Å; R183-M337 CarbonylContact C-O 3.56Å; R183-M337 WeakPolarHBondContact CA-O 3.29Å; R183-C338 PolarHBondContact NH2-O 3.28Å; R183-D339 IonicContact CZ-OD1 3.35Å; R183-D339 IonicContact NE-OD1 2.57Å; R183-D339 PolarHBondContact NE-OD1 3.11Å; R183-D339 VanDerWaalsContact NH2-CA 3.35Å; R183-D339 IonicContact NH2-OD1 3.71Å; R183-D339 PolarHBondContact NH2-OD1 2.94Å
184	Y	98.1	Very high	97.1	Very high	54 Å²	54	43.4 Å²	43.4	21%	0.212	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.3	178.4	-53.9	-72.3	0	0	0	108.3	K182 F210 M337 C338 D339	K182-Y184 HydrophobicContact CB-CE2 4.02Å; Y184-F210 HydrophobicContact CD1-CB 4.14Å; Y184-F210 HydrophobicContact CD1-CD2 4.06Å; Y184-F210 HydrophobicContact CD1-CG 4.49Å; Y184-F210 HydrophobicContact CD2-CB 3.96Å; Y184-F210 AromaticContact CD2-CD2 3.85Å; Y184-F210 HydrophobicContact CD2-CD2 3.85Å; Y184-F210 HydrophobicContact CD2-CE2 4.5Å; Y184-F210 AromaticContact CD2-CG 3.93Å; Y184-F210 HydrophobicContact CD2-CG 3.93Å; Y184-F210 AromaticContact CE1-CD2 3.66Å; Y184-F210 HydrophobicContact CE1-CD2 3.66Å; Y184-F210 HydrophobicContact CE1-CE2 4.29Å; Y184-F210 HydrophobicContact CE1-CG 4.5Å; Y184-F210 HydrophobicContact CE2-CB 4.42Å; Y184-F210 AromaticContact CE2-CD2 3.42Å; Y184-F210 HydrophobicContact CE2-CD2 3.42Å; Y184-F210 VanDerWaalsContact CE2-CD2 3.42Å; Y184-F210 AromaticContact CE2-CE2 3.69Å; Y184-F210 HydrophobicContact CE2-CE2 3.69Å; Y184-F210 AromaticContact CE2-CG 3.94Å; Y184-F210 HydrophobicContact CE2-CG 3.94Å; Y184-F210 HydrophobicContact CE2-CZ 4.4Å; Y184-F210 HydrophobicContact CG-CB 3.81Å; Y184-F210 HydrophobicContact CG-CD2 4.15Å; Y184-F210 HydrophobicContact CG-CG 4.22Å; Y184-F210 AromaticContact CZ-CD2 3.32Å; Y184-F210 AromaticContact CZ-CE2 3.56Å; Y184-F210 WeakPolarHBondContact OH-CE2 3.2Å; Y184-M337 HydrophobicContact CD2-CB 4.21Å; Y184-M337 HydrophobicContact CD2-CG 4.2Å; Y184-M337 HydrophobicContact CD2-SD 4.43Å; Y184-M337 HydrophobicContact CE2-CB 4.37Å; Y184-M337 HydrophobicContact CE2-CG 4.38Å; Y184-M337 HydrophobicContact CE2-SD 4.07Å; Y184-M337 PolarHBondContact N-O 3.04Å; Y184-C338 CarbonylContact O-C 3.54Å; Y184-C338 VanDerWaalsContact O-CA 3.27Å; Y184-C338 WeakPolarHBondContact O-CA 3.38Å; Y184-D339 PolarHBondContact O-N 3.03Å
185	N	97.9	Very high	97	Very high	93 Å²	93	42.6 Å²	42.6	50%	0.497	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-69.8	-178.1	176.9	20	0	0	0	109.8	D209 D339 Q340	N185-D209 VanDerWaalsContact CB-OD2 3.3Å; N185-D209 WeakPolarHBondContact CB-OD2 3.49Å; N185-D209 PolarHBondContact N-OD2 3.25Å; N185-D339 CarbonylContact O-C 3.57Å; N185-D339 WeakPolarHBondContact O-CA 3.44Å; N185-D339 WeakPolarHBondContact O-CB 3.19Å; N185-D339 PolarHBondContact O-N 3.36Å; N185-D339 VanDerWaalsContact O-N 3.15Å; N185-Q340 PolarHBondContact O-N 3.12Å
186	I	98.2	Very high	97	Very high	45 Å²	45	38 Å²	38	23%	0.231	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.5	-177.8	-42.4	-178.3	0	0	0	111.1	Y208 D209 Q340 H342	I186-Y208 HydrophobicContact CB-CD1 3.94Å; I186-Y208 HydrophobicContact CB-CE1 4.46Å; I186-Y208 HydrophobicContact CG2-CD1 3.4Å; I186-Y208 HydrophobicContact CG2-CE1 3.52Å; I186-D209 PolarHBondContact N-OD2 2.79Å; I186-D209 PolarHBondContact O-N 3.13Å; I186-Q340 HydrophobicContact CG1-CB 4.44Å; I186-Q340 HydrophobicContact CG2-CB 4.25Å; I186-Q340 HydrophobicContact CG2-CG 4.34Å; I186-H342 VanDerWaalsContact CG2-CD2 3.44Å; I186-H342 WeakPolarHBondContact CG2-CD2 3.49Å; I186-H342 WeakPolarHBondContact CG2-NE2 3.14Å
187	C	98.8	Very high	96.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	148.3	178.4	-63	0	0	0	0	112.5	F210 L212 C338 Q340 H342	C187-F210 CarbonylContact C-O 3.48Å; C187-F210 VanDerWaalsContact CA-O 3.25Å; C187-F210 WeakPolarHBondContact CA-O 3.39Å; C187-L212 HydrophobicContact CB-CD1 4.3Å; C187-C338 HydrophobicContact CB-CB 3.65Å; C187-C338 WeakPolarHBondContact CB-SG 3.45Å; C187-C338 WeakPolarHBondContact SG-CB 3.42Å; C187-C338 CovalentContact SG-SG 2.01Å; C187-C338 PolarHBondContact SG-SG 3.3Å; C187-Q340 PolarHBondContact N-O 3.06Å; C187-H342 PolarHBondContact O-N 2.86Å
188	A	98.8	Very high	96.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.3	169.2	0	0	0	0	0	110.4	I190 Y208 F210 V211 L212 H342	A188-I190 HydrophobicContact CB-CD1 3.84Å; A188-Y208 HydrophobicContact CB-CD2 3.43Å; A188-Y208 VanDerWaalsContact CB-CD2 3.43Å; A188-Y208 HydrophobicContact CB-CE2 3.96Å; A188-Y208 HydrophobicContact CB-CG 3.84Å; A188-F210 PolarHBondContact N-O 3.25Å; A188-V211 HydrophobicContact CB-CG1 4.48Å; A188-V211 HydrophobicContact CB-CG2 4.26Å; A188-V211 WeakPolarHBondContact O-CA 3.27Å; A188-L212 PolarHBondContact O-N 3.49Å; A188-H342 CarbonylContact C-O 3.51Å; A188-H342 WeakPolarHBondContact CA-O 3.5Å
189	V	98.9	Very high	96.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.9	166.6	-176.2	0	0	0	0	108	L212 M330 A334 I341 H342 L343 Y344 F346	V189-L212 HydrophobicContact CG1-CB 4.49Å; V189-L212 HydrophobicContact CG2-CB 4.32Å; V189-L212 HydrophobicContact CG2-CD1 4Å; V189-M330 HydrophobicContact CG1-CB 3.63Å; V189-A334 HydrophobicContact CG2-CB 3.95Å; V189-I341 HydrophobicContact CG2-CG2 3.92Å; V189-H342 PolarHBondContact N-O 3.31Å; V189-L343 HydrophobicContact CB-CD2 3.59Å; V189-L343 HydrophobicContact CG1-CD2 4.31Å; V189-L343 HydrophobicContact CG2-CD2 4.07Å; V189-Y344 PolarHBondContact O-N 2.87Å; V189-F346 HydrophobicContact CB-CE2 4.34Å; V189-F346 HydrophobicContact CG1-CE2 3.92Å; V189-F346 HydrophobicContact CG1-CZ 3.76Å
190	I	98.8	Very high	96.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	105.6	-175.8	-42.1	-57.5	0	0	0	108.6	A188 L196 I205 V211 L212 R213 C214 Y344	A188-I190 HydrophobicContact CB-CD1 3.84Å; I190-L196 HydrophobicContact CG2-CD1 4.03Å; I190-I205 HydrophobicContact CD1-CD1 3.84Å; I190-I205 HydrophobicContact CD1-CG1 3.99Å; I190-I205 HydrophobicContact CD1-CG2 3.99Å; I190-I205 HydrophobicContact CG1-CG2 4.45Å; I190-V211 HydrophobicContact CD1-CG1 4.46Å; I190-V211 HydrophobicContact CG1-CG1 3.8Å; I190-L212 PolarHBondContact N-O 2.62Å; I190-R213 HydrophobicContact CB-CG 4.28Å; I190-R213 HydrophobicContact CG1-CG 4.34Å; I190-C214 PolarHBondContact O-N 3.29Å; I190-C214 PolarHBondContact O-SG 3.19Å; I190-C214 VanDerWaalsContact O-SG 3.41Å; I190-Y344 HydrophobicContact CD1-CD2 3.81Å; I190-Y344 HydrophobicContact CD1-CG 4.08Å
191	G	98.3	Very high	96.9	Very high	6 Å²	6	42.9 Å²	42.9	6%	0.062	21%	0.211	C	C	.	.			trans	-75	175.8	163.8	0	0	0	0	0	111.2	L196 Y344 G345	G191-L196 WeakPolarHBondContact O-CD1 3.45Å; G191-Y344 PolarHBondContact N-O 2.93Å; G191-G345 CarbonylContact C-O 3.48Å
192	N	97.4	Very high	97.1	Very high	18 Å²	18	35.6 Å²	35.6	10%	0.096	17%	0.173	C	C	.	.			trans	-105.4	6	-168.7	-65	-8.3	0	0	0	113.9	C214 A217 G345 H362 Y363 Y364	N192-C214 PolarHBondContact ND2-O 3.09Å; N192-C214 PolarHBondContact OD1-O 3.46Å; N192-A217 WeakPolarHBondContact OD1-CB 3.31Å; N192-G345 PolarHBondContact N-O 3Å; N192-H362 CarbonylContact O-C 3.52Å; N192-H362 WeakPolarHBondContact O-CA 3.4Å; N192-Y363 HydrophobicContact CB-CE1 4.4Å; N192-Y363 WeakPolarHBondContact O-CD1 3.42Å; N192-Y363 PolarHBondContact O-N 3.32Å; N192-Y364 HydrophobicContact CB-CE1 3.92Å; N192-Y364 PolarHBondContact ND2-OH 2.96Å
193	S	96.1	Very high	97.1	Very high	10 Å²	10	33.9 Å²	33.9	7%	0.07	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-57.7	145.8	-173.5	176.2	0	0	0	0	113.6	I195 L196 G345 W347 Y361	S193-I195 PolarHBondContact O-N 3.42Å; S193-I195 VanDerWaalsContact O-N 3.09Å; S193-I195 PolarHBondContact OG-N 2.57Å; S193-L196 PolarHBondContact O-N 2.9Å; S193-G345 WeakPolarHBondContact CB-O 3.43Å; S193-G345 PolarHBondContact N-O 3.44Å; S193-G345 VanDerWaalsContact N-O 3.09Å; S193-W347 VanDerWaalsContact CB-O 3.25Å; S193-W347 WeakPolarHBondContact CB-O 3.41Å; S193-W347 WeakPolarHBondContact OG-CB 3.22Å; S193-W347 PolarHBondContact OG-O 2.84Å; S193-Y361 WeakPolarHBondContact CA-O 3.21Å
194	G	95.1	Very high	97.2	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-55.8	-18.4	172.2	0	0	0	0	0	115.3	L196 T197 P360 Y361	G194-L196 PolarHBondContact O-N 2.97Å; G194-T197 VanDerWaalsContact O-CB 3.27Å; G194-T197 WeakPolarHBondContact O-CB 3.48Å; G194-T197 PolarHBondContact O-N 2.78Å; G194-T197 PolarHBondContact O-OG1 3.38Å; G194-P360 WeakPolarHBondContact CA-O 3.27Å; G194-Y361 PolarHBondContact N-O 2.93Å; G194-Y361 VanDerWaalsContact N-O 3.1Å
195	I	95.1	Very high	97.2	Very high	13 Å²	13	29.4 Å²	29.4	7%	0.067	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-56.9	-21.8	176.4	-162.7	168.8	0	0	0	113.1	S193 T197 W347 P353 L359 L401	S193-I195 PolarHBondContact O-N 3.42Å; S193-I195 VanDerWaalsContact O-N 3.09Å; S193-I195 PolarHBondContact OG-N 2.57Å; I195-T197 VanDerWaalsContact C-N 3.27Å; I195-T197 PolarHBondContact O-N 3.09Å; I195-W347 HydrophobicContact CB-CB 3.94Å; I195-W347 HydrophobicContact CB-CG 4.23Å; I195-W347 HydrophobicContact CD1-CB 3.78Å; I195-W347 HydrophobicContact CD1-CD2 4.11Å; I195-W347 HydrophobicContact CD1-CG 3.77Å; I195-W347 HydrophobicContact CG1-CB 4.47Å; I195-W347 HydrophobicContact CG2-CB 3.79Å; I195-P353 HydrophobicContact CD1-CG 3.78Å; I195-L359 HydrophobicContact CB-CD1 4.04Å; I195-L359 HydrophobicContact CG1-CD1 4.33Å; I195-L401 HydrophobicContact CD1-CB 4.17Å; I195-L401 HydrophobicContact CD1-CD2 3.83Å
196	L	97.2	Very high	97.1	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.021	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-71.1	-22.6	176.1	-75.1	169.4	0	0	0	113	I190 G191 S193 G194 G198 S199 D225 V226 Y363	I190-L196 HydrophobicContact CG2-CD1 4.03Å; G191-L196 WeakPolarHBondContact O-CD1 3.45Å; S193-L196 PolarHBondContact O-N 2.9Å; G194-L196 PolarHBondContact O-N 2.97Å; L196-G198 PolarHBondContact O-N 2.76Å; L196-G198 VanDerWaalsContact O-N 3.16Å; L196-S199 WeakPolarHBondContact O-CB 3.18Å; L196-S199 PolarHBondContact O-N 2.88Å; L196-S199 PolarHBondContact O-OG 2.93Å; L196-D225 WeakPolarHBondContact O-CB 3.41Å; L196-D225 VanDerWaalsContact O-CG 3.28Å; L196-V226 HydrophobicContact CB-CG1 4Å; L196-V226 HydrophobicContact CD1-CG1 3.83Å; L196-V226 HydrophobicContact CG-CG1 4.33Å; L196-Y363 HydrophobicContact CB-CD1 4.43Å; L196-Y363 HydrophobicContact CB-CG 4.4Å; L196-Y363 HydrophobicContact CD1-CD1 3.83Å; L196-Y363 HydrophobicContact CD1-CE1 4.24Å
197	T	95	Very high	97.1	Very high	70 Å²	70	34.2 Å²	34.2	43%	0.429	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	116.1	-174.9	-47.6	0	0	0	0	110.9	G194 I195 S199	G194-T197 VanDerWaalsContact O-CB 3.27Å; G194-T197 WeakPolarHBondContact O-CB 3.48Å; G194-T197 PolarHBondContact O-N 2.78Å; G194-T197 PolarHBondContact O-OG1 3.38Å; I195-T197 VanDerWaalsContact C-N 3.27Å; I195-T197 PolarHBondContact O-N 3.09Å; T197-S199 VanDerWaalsContact C-N 3.26Å; T197-S199 PolarHBondContact O-N 2.97Å
198	G	94	Very high	97.1	Very high	34 Å²	34	34.9 Å²	34.9	35%	0.351	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	3.1	-177.7	0	0	0	0	0	115.1	L196 R200 D225	L196-G198 PolarHBondContact O-N 2.76Å; L196-G198 VanDerWaalsContact O-N 3.16Å; G198-R200 PolarHBondContact O-N 3.2Å; G198-D225 VanDerWaalsContact C-OD1 3.31Å; G198-D225 WeakPolarHBondContact CA-OD1 3.22Å; G198-D225 PolarHBondContact N-OD1 3.48Å; G198-D225 PolarHBondContact N-OD2 3.45Å
199	S	95.3	Very high	97.1	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.021	20%	0.199	C	C	.	.			trans	-67.3	-20.8	-179	66.7	0	0	0	0	114.2	L196 T197 C201 D225 H403 C404	L196-S199 WeakPolarHBondContact O-CB 3.18Å; L196-S199 PolarHBondContact O-N 2.88Å; L196-S199 PolarHBondContact O-OG 2.93Å; T197-S199 VanDerWaalsContact C-N 3.26Å; T197-S199 PolarHBondContact O-N 2.97Å; S199-C201 PolarHBondContact O-N 3.29Å; S199-C201 VanDerWaalsContact O-N 3.1Å; S199-C201 PolarHBondContact OG-N 2.86Å; S199-D225 PolarHBondContact N-OD1 2.93Å; S199-H403 CarbonylContact O-C 3.56Å; S199-H403 WeakPolarHBondContact O-CA 3.44Å; S199-C404 PolarHBondContact O-N 2.8Å
200	R	97	Very high	97	Very high	191 Å²	191	38.4 Å²	38.4	72%	0.721	20%	0.201	S	C	*	.			trans	57.1	18.9	-175.3	-55	-174.3	-178.6	-157.3	1.7	114.9	G198 G202 K224 D225	G198-R200 PolarHBondContact O-N 3.2Å; R200-G202 PolarHBondContact O-N 3.1Å; R200-G202 VanDerWaalsContact O-N 3.14Å; R200-K224 CarbonylContact C-O 3.03Å; R200-K224 VanDerWaalsContact C-O 3.22Å; R200-K224 VanDerWaalsContact CA-O 3.27Å; R200-K224 WeakPolarHBondContact CA-O 3.41Å; R200-D225 PolarHBondContact N-OD1 2.84Å
201	C	97.8	Very high	97	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.007	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-4.9	-178.4	-70.6	0	0	0	0	115	S199 A203 Q204 I205 D225 Y344 C404	S199-C201 PolarHBondContact O-N 3.29Å; S199-C201 VanDerWaalsContact O-N 3.1Å; S199-C201 PolarHBondContact OG-N 2.86Å; C201-A203 PolarHBondContact O-N 3.03Å; C201-Q204 PolarHBondContact O-N 3.04Å; C201-Q204 VanDerWaalsContact O-N 3.14Å; C201-I205 HydrophobicContact CB-CD1 4.04Å; C201-I205 VanDerWaalsContact O-CG1 3.31Å; C201-I205 WeakPolarHBondContact O-CG1 3.14Å; C201-I205 PolarHBondContact O-N 3.16Å; C201-D225 CarbonylContact C-O 3.44Å; C201-D225 WeakPolarHBondContact CB-O 3.48Å; C201-D225 PolarHBondContact N-O 3.31Å; C201-Y344 HydrophobicContact CB-CD1 4.1Å; C201-Y344 HydrophobicContact CB-CE1 3.96Å; C201-C404 WeakPolarHBondContact CA-SG 3.44Å; C201-C404 HydrophobicContact CB-CB 3.86Å; C201-C404 WeakPolarHBondContact CB-SG 3.4Å; C201-C404 WeakPolarHBondContact SG-CB 3.42Å; C201-C404 PolarHBondContact SG-N 3.46Å; C201-C404 CovalentContact SG-SG 2.04Å; C201-C404 PolarHBondContact SG-SG 3.03Å
202	G	98.1	Very high	97.1	Very high	2 Å²	2	38.1 Å²	38.1	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-58.1	-45.6	-175.8	0	0	0	0	0	113.1	R200 Q204 I205 E206 K223 K224 D225 G227	R200-G202 PolarHBondContact O-N 3.1Å; R200-G202 VanDerWaalsContact O-N 3.14Å; G202-Q204 VanDerWaalsContact C-N 3.28Å; G202-Q204 PolarHBondContact O-N 2.69Å; G202-I205 PolarHBondContact O-N 3.34Å; G202-E206 VanDerWaalsContact O-CG 3.31Å; G202-E206 WeakPolarHBondContact O-CG 3.5Å; G202-E206 PolarHBondContact O-N 2.92Å; G202-E206 VanDerWaalsContact O-N 3.09Å; G202-K223 WeakPolarHBondContact CA-O 3.21Å; G202-K224 WeakPolarHBondContact CA-O 3.4Å; G202-K224 PolarHBondContact N-O 2.85Å; G202-D225 PolarHBondContact N-O 2.85Å; G202-D225 VanDerWaalsContact N-O 3.09Å; G202-G227 VanDerWaalsContact CA-N 3.28Å
203	A	97.9	Very high	97.1	Very high	69 Å²	69	37.4 Å²	37.4	57%	0.57	19%	0.194	S	C	*	.	H	α-helix	trans	-64.7	-32	-179.9	0	0	0	0	0	113	C201	C201-A203 PolarHBondContact O-N 3.03Å
204	Q	96.9	Very high	97.2	Very high	57 Å²	57	37.1 Å²	37.1	27%	0.266	19%	0.192	S	C	.	.	H	α-helix	trans	-74.3	-41.6	173.6	-176	173.3	-11.8	0	0	111.2	C201 G202 E206 K207 Y208 Y344 C404	C201-Q204 PolarHBondContact O-N 3.04Å; C201-Q204 VanDerWaalsContact O-N 3.14Å; G202-Q204 VanDerWaalsContact C-N 3.28Å; G202-Q204 PolarHBondContact O-N 2.69Å; Q204-E206 VanDerWaalsContact C-N 3.27Å; Q204-E206 PolarHBondContact O-N 3.46Å; Q204-K207 WeakPolarHBondContact O-CB 3.34Å; Q204-K207 PolarHBondContact O-N 3.04Å; Q204-K207 VanDerWaalsContact O-N 3.12Å; Q204-Y208 HydrophobicContact CG-CE2 4.29Å; Q204-Y208 PolarHBondContact NE2-OH 2.87Å; Q204-Y208 VanDerWaalsContact NE2-OH 3.16Å; Q204-Y344 PolarHBondContact NE2-OH 3.01Å; Q204-C404 PolarHBondContact OE1-SG 3.45Å
205	I	98.3	Very high	97.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-36.9	-179.5	-70.2	163	0	0	0	111.9	I190 C201 G202 K207 Y208 V211 Y344	I190-I205 HydrophobicContact CD1-CD1 3.84Å; I190-I205 HydrophobicContact CD1-CG1 3.99Å; I190-I205 HydrophobicContact CD1-CG2 3.99Å; I190-I205 HydrophobicContact CG1-CG2 4.45Å; C201-I205 HydrophobicContact CB-CD1 4.04Å; C201-I205 VanDerWaalsContact O-CG1 3.31Å; C201-I205 WeakPolarHBondContact O-CG1 3.14Å; C201-I205 PolarHBondContact O-N 3.16Å; G202-I205 PolarHBondContact O-N 3.34Å; I205-K207 PolarHBondContact O-N 3.28Å; I205-Y208 WeakPolarHBondContact O-CD2 3.25Å; I205-Y208 PolarHBondContact O-N 3.36Å; I205-V211 HydrophobicContact CG2-CG1 4.08Å; I205-V211 HydrophobicContact CG2-CG2 4.18Å; I205-Y344 HydrophobicContact CD1-CD1 4.27Å; I205-Y344 HydrophobicContact CD1-CG 4.21Å; I205-Y344 HydrophobicContact CG1-CD1 4.44Å; I205-Y344 HydrophobicContact CG1-CD2 4.22Å; I205-Y344 HydrophobicContact CG1-CE1 4.42Å; I205-Y344 HydrophobicContact CG1-CE2 4.19Å; I205-Y344 HydrophobicContact CG1-CG 4.34Å
206	E	97.5	Very high	97.4	Very high	73 Å²	73	40.6 Å²	40.6	34%	0.341	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-25.8	177.4	-70.5	-68.6	153.1	0	0	114	G202 Q204 R228 R229	G202-E206 VanDerWaalsContact O-CG 3.31Å; G202-E206 WeakPolarHBondContact O-CG 3.5Å; G202-E206 PolarHBondContact O-N 2.92Å; G202-E206 VanDerWaalsContact O-N 3.09Å; Q204-E206 VanDerWaalsContact C-N 3.27Å; Q204-E206 PolarHBondContact O-N 3.46Å; E206-R228 WeakPolarHBondContact OE1-CA 3.43Å; E206-R228 WeakPolarHBondContact OE1-CB 3.31Å; E206-R228 PolarHBondContact OE1-N 3.33Å; E206-R229 WeakPolarHBondContact O-CD 3.07Å; E206-R229 PolarHBondContact O-NH1 3.02Å; E206-R229 PolarHBondContact OE1-N 3.5Å; E206-R229 VanDerWaalsContact OE2-CB 3.31Å; E206-R229 WeakPolarHBondContact OE2-CB 3.29Å
207	K	97.4	Very high	97.3	Very high	166 Å²	166	41 Å²	41	72%	0.722	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-17.6	-174.8	-62.2	175.9	-176.1	178.2	0	113.7	Q204 I205	Q204-K207 WeakPolarHBondContact O-CB 3.34Å; Q204-K207 PolarHBondContact O-N 3.04Å; Q204-K207 VanDerWaalsContact O-N 3.12Å; I205-K207 PolarHBondContact O-N 3.28Å
208	Y	98.2	Very high	97.4	Very high	15 Å²	15	40.3 Å²	40.3	6%	0.059	21%	0.209	C	C	.	.	S	Bend	trans	-71	148.2	-180	-65.2	-68.3	0	0	0	111.7	I186 A188 Q204 I205 F210 R229 H342 Y344	I186-Y208 HydrophobicContact CB-CD1 3.94Å; I186-Y208 HydrophobicContact CB-CE1 4.46Å; I186-Y208 HydrophobicContact CG2-CD1 3.4Å; I186-Y208 HydrophobicContact CG2-CE1 3.52Å; A188-Y208 HydrophobicContact CB-CD2 3.43Å; A188-Y208 VanDerWaalsContact CB-CD2 3.43Å; A188-Y208 HydrophobicContact CB-CE2 3.96Å; A188-Y208 HydrophobicContact CB-CG 3.84Å; Q204-Y208 HydrophobicContact CG-CE2 4.29Å; Q204-Y208 PolarHBondContact NE2-OH 2.87Å; Q204-Y208 VanDerWaalsContact NE2-OH 3.16Å; I205-Y208 WeakPolarHBondContact O-CD2 3.25Å; I205-Y208 PolarHBondContact O-N 3.36Å; Y208-F210 VanDerWaalsContact C-N 3.32Å; Y208-F210 PolarHBondContact O-N 3.4Å; Y208-R229 PolarHBondContact O-NE 2.72Å; Y208-R229 VanDerWaalsContact O-NE 3.09Å; Y208-R229 PolarHBondContact O-NH1 2.85Å; Y208-R229 VanDerWaalsContact O-NH1 3.12Å; Y208-R229 PolarHBondContact O-NH2 3.39Å; Y208-H342 HydrophobicContact CE1-CB 4.07Å; Y208-H342 AromaticContact CE1-CD2 3.91Å; Y208-H342 AromaticContact CE1-CG 3.71Å; Y208-H342 AromaticContact CE1-ND1 3.81Å; Y208-H342 AromaticContact CZ-CG 3.82Å; Y208-H342 AromaticContact CZ-ND1 3.73Å; Y208-H342 PolarHBondContact OH-ND1 3.47Å; Y208-Y344 AromaticContact CE2-CE2 3.63Å; Y208-Y344 HydrophobicContact CE2-CE2 3.63Å; Y208-Y344 AromaticContact CZ-CE2 3.97Å; Y208-Y344 PolarHBondContact OH-OH 3.05Å
209	D	98.1	Very high	97.5	Very high	67 Å²	67	40 Å²	40	36%	0.358	20%	0.201	S	C	.	.	S	Bend	trans	-66.7	-37	-176.6	-59.4	-51.5	0	0	0	111.9	N185 I186 R229	N185-D209 VanDerWaalsContact CB-OD2 3.3Å; N185-D209 WeakPolarHBondContact CB-OD2 3.49Å; N185-D209 PolarHBondContact N-OD2 3.25Å; I186-D209 PolarHBondContact N-OD2 2.79Å; I186-D209 PolarHBondContact O-N 3.13Å; D209-R229 PolarHBondContact O-NH2 3.22Å
210	F	98.7	Very high	97.4	Very high	7 Å²	7	44.3 Å²	44.3	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	124.5	-178.7	-160.2	-87.8	0	0	0	111.6	Y184 C187 A188 Y208 L212 N231 M232 I267 M337	Y184-F210 HydrophobicContact CD1-CB 4.14Å; Y184-F210 HydrophobicContact CD1-CD2 4.06Å; Y184-F210 HydrophobicContact CD1-CG 4.49Å; Y184-F210 HydrophobicContact CD2-CB 3.96Å; Y184-F210 AromaticContact CD2-CD2 3.85Å; Y184-F210 HydrophobicContact CD2-CD2 3.85Å; Y184-F210 HydrophobicContact CD2-CE2 4.5Å; Y184-F210 AromaticContact CD2-CG 3.93Å; Y184-F210 HydrophobicContact CD2-CG 3.93Å; Y184-F210 AromaticContact CE1-CD2 3.66Å; Y184-F210 HydrophobicContact CE1-CD2 3.66Å; Y184-F210 HydrophobicContact CE1-CE2 4.29Å; Y184-F210 HydrophobicContact CE1-CG 4.5Å; Y184-F210 HydrophobicContact CE2-CB 4.42Å; Y184-F210 AromaticContact CE2-CD2 3.42Å; Y184-F210 HydrophobicContact CE2-CD2 3.42Å; Y184-F210 VanDerWaalsContact CE2-CD2 3.42Å; Y184-F210 AromaticContact CE2-CE2 3.69Å; Y184-F210 HydrophobicContact CE2-CE2 3.69Å; Y184-F210 AromaticContact CE2-CG 3.94Å; Y184-F210 HydrophobicContact CE2-CG 3.94Å; Y184-F210 HydrophobicContact CE2-CZ 4.4Å; Y184-F210 HydrophobicContact CG-CB 3.81Å; Y184-F210 HydrophobicContact CG-CD2 4.15Å; Y184-F210 HydrophobicContact CG-CG 4.22Å; Y184-F210 AromaticContact CZ-CD2 3.32Å; Y184-F210 AromaticContact CZ-CE2 3.56Å; Y184-F210 WeakPolarHBondContact OH-CE2 3.2Å; C187-F210 CarbonylContact C-O 3.48Å; C187-F210 VanDerWaalsContact CA-O 3.25Å; C187-F210 WeakPolarHBondContact CA-O 3.39Å; A188-F210 PolarHBondContact N-O 3.25Å; Y208-F210 VanDerWaalsContact C-N 3.32Å; Y208-F210 PolarHBondContact O-N 3.4Å; F210-L212 HydrophobicContact CD1-CD1 3.6Å; F210-L212 HydrophobicContact CD1-CG 3.9Å; F210-L212 HydrophobicContact CE1-CD1 4.02Å; F210-L212 HydrophobicContact CE1-CD2 4.41Å; F210-L212 HydrophobicContact CE1-CG 3.82Å; F210-N231 WeakPolarHBondContact CA-OD1 3.25Å; F210-N231 HydrophobicContact CD1-CB 3.99Å; F210-N231 HydrophobicContact CD2-CB 3.47Å; F210-N231 VanDerWaalsContact CD2-CB 3.47Å; F210-N231 HydrophobicContact CE1-CB 3.96Å; F210-N231 HydrophobicContact CE2-CB 3.44Å; F210-N231 VanDerWaalsContact CE2-CB 3.44Å; F210-N231 HydrophobicContact CG-CB 3.77Å; F210-N231 HydrophobicContact CZ-CB 3.69Å; F210-M232 HydrophobicContact CE1-CB 3.73Å; F210-M232 HydrophobicContact CZ-CB 3.88Å; F210-I267 HydrophobicContact CZ-CD1 4.43Å; F210-M337 HydrophobicContact CD1-CE 4.45Å; F210-M337 HydrophobicContact CE1-CE 3.95Å
211	V	98.8	Very high	97.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	117.9	-179.6	-177.8	0	0	0	0	110.8	A188 I190 I205 R213 R229 N231 M232	A188-V211 HydrophobicContact CB-CG1 4.48Å; A188-V211 HydrophobicContact CB-CG2 4.26Å; A188-V211 WeakPolarHBondContact O-CA 3.27Å; I190-V211 HydrophobicContact CD1-CG1 4.46Å; I190-V211 HydrophobicContact CG1-CG1 3.8Å; I205-V211 HydrophobicContact CG2-CG1 4.08Å; I205-V211 HydrophobicContact CG2-CG2 4.18Å; V211-R213 HydrophobicContact CG1-CG 4.2Å; V211-R229 HydrophobicContact CB-CG 4.32Å; V211-R229 WeakPolarHBondContact CG1-O 3.35Å; V211-R229 HydrophobicContact CG2-CB 4.21Å; V211-R229 HydrophobicContact CG2-CG 3.84Å; V211-N231 PolarHBondContact N-OD1 3.41Å; V211-N231 PolarHBondContact O-N 2.81Å; V211-M232 PolarHBondContact O-N 3.41Å; V211-M232 VanDerWaalsContact O-N 3.09Å
212	L	98.8	Very high	97.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.8	174.6	-59.1	92.7	0	0	0	110.2	C187 A188 V189 I190 F210 M232 M330 A334 M337	C187-L212 HydrophobicContact CB-CD1 4.3Å; A188-L212 PolarHBondContact O-N 3.49Å; V189-L212 HydrophobicContact CG1-CB 4.49Å; V189-L212 HydrophobicContact CG2-CB 4.32Å; V189-L212 HydrophobicContact CG2-CD1 4Å; I190-L212 PolarHBondContact N-O 2.62Å; F210-L212 HydrophobicContact CD1-CD1 3.6Å; F210-L212 HydrophobicContact CD1-CG 3.9Å; F210-L212 HydrophobicContact CE1-CD1 4.02Å; F210-L212 HydrophobicContact CE1-CD2 4.41Å; F210-L212 HydrophobicContact CE1-CG 3.82Å; L212-M232 CarbonylContact C-O 3.56Å; L212-M232 WeakPolarHBondContact CA-O 3.34Å; L212-M232 HydrophobicContact CD2-SD 3.78Å; L212-M232 HydrophobicContact CG-CB 4.47Å; L212-M232 HydrophobicContact CG-SD 4.39Å; L212-M330 HydrophobicContact CD2-SD 4.29Å; L212-A334 HydrophobicContact CD1-CB 3.99Å; L212-A334 HydrophobicContact CD2-CB 4.11Å; L212-M337 HydrophobicContact CD2-CE 3.77Å
213	R	98.8	Very high	97.3	Very high	4 Å²	4	48 Å²	48	2%	0.015	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	147.1	178.4	-59.7	-172.5	-178.1	-86.4	-3.9	112.4	I190 V211 V226 G227 R229 T230 M232 T233 T234	I190-R213 HydrophobicContact CB-CG 4.28Å; I190-R213 HydrophobicContact CG1-CG 4.34Å; V211-R213 HydrophobicContact CG1-CG 4.2Å; R213-V226 VanDerWaalsContact CZ-O 3.27Å; R213-V226 PolarHBondContact NH1-O 3.41Å; R213-V226 PolarHBondContact NH2-O 3.19Å; R213-G227 PolarHBondContact NH2-O 3.24Å; R213-R229 PolarHBondContact NE-O 3.42Å; R213-R229 VanDerWaalsContact NE-O 3.09Å; R213-R229 PolarHBondContact NH2-O 2.94Å; R213-T230 WeakPolarHBondContact CD-OG1 3.47Å; R213-T230 HydrophobicContact CG-CG2 4.29Å; R213-T230 PolarHBondContact NE-OG1 3.37Å; R213-M232 PolarHBondContact N-O 3.25Å; R213-T233 CarbonylContact O-C 3.54Å; R213-T233 WeakPolarHBondContact O-CA 3.26Å; R213-T233 PolarHBondContact O-OG1 3.09Å; R213-T234 PolarHBondContact O-N 2.67Å
214	C	97.5	Very high	97.3	Very high	4 Å²	4	52.7 Å²	52.7	3%	0.027	25%	0.254	C	S	.	.	S	Bend	trans	-94.8	132.8	-178.3	-57.7	0	0	0	0	112.4	I190 N192 F216 A217 T326	I190-C214 PolarHBondContact O-N 3.29Å; I190-C214 PolarHBondContact O-SG 3.19Å; I190-C214 VanDerWaalsContact O-SG 3.41Å; N192-C214 PolarHBondContact ND2-O 3.09Å; N192-C214 PolarHBondContact OD1-O 3.46Å; C214-F216 PolarHBondContact O-N 3.31Å; C214-A217 WeakPolarHBondContact O-CB 3.33Å; C214-A217 PolarHBondContact O-N 2.53Å; C214-T326 HydrophobicContact CB-CG2 4.1Å
215	N	96.4	Very high	97.4	Very high	54 Å²	54	51 Å²	51	29%	0.289	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	44.4	163.2	-56.7	-43.4	0	0	0	114.5	A217 T234 I239	N215-A217 PolarHBondContact O-N 3.31Å; N215-A217 VanDerWaalsContact O-N 3.11Å; N215-T234 CarbonylContact C-O 3.45Å; N215-T234 WeakPolarHBondContact CA-O 3.37Å; N215-T234 PolarHBondContact N-O 2.99Å; N215-T234 PolarHBondContact N-OG1 3.01Å; N215-T234 PolarHBondContact OD1-OG1 2.8Å; N215-I239 HydrophobicContact CB-CD1 4.41Å
216	F	97.4	Very high	97.4	Very high	32 Å²	32	51 Å²	51	14%	0.14	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	35.9	176.5	-150.6	-109	0	0	0	113.1	C214 T233 T234 F235 I239 Y244 L260 L263 L268	C214-F216 PolarHBondContact O-N 3.31Å; F216-T233 HydrophobicContact CD2-CG2 3.83Å; F216-T233 HydrophobicContact CE2-CG2 4.41Å; F216-T233 PolarHBondContact N-OG1 2.65Å; F216-T234 PolarHBondContact N-O 3.42Å; F216-F235 HydrophobicContact CB-CD2 3.82Å; F216-F235 HydrophobicContact CB-CE2 4.35Å; F216-F235 HydrophobicContact CD1-CD2 4.37Å; F216-F235 HydrophobicContact CD1-CE2 4.26Å; F216-F235 AromaticContact CD2-CD2 3.64Å; F216-F235 HydrophobicContact CD2-CD2 3.64Å; F216-F235 HydrophobicContact CD2-CE2 4.23Å; F216-F235 HydrophobicContact CE2-CD2 4.21Å; F216-F235 AromaticContact CG-CD2 3.71Å; F216-F235 HydrophobicContact CG-CD2 3.71Å; F216-F235 HydrophobicContact CG-CE2 4.05Å; F216-I239 HydrophobicContact CB-CD1 3.83Å; F216-Y244 WeakPolarHBondContact CE1-OH 3.49Å; F216-L260 HydrophobicContact CE2-CD2 4.32Å; F216-L260 HydrophobicContact CZ-CD2 4.4Å; F216-L263 HydrophobicContact CD2-CD1 4.39Å; F216-L263 HydrophobicContact CE2-CD1 3.61Å; F216-L263 HydrophobicContact CE2-CG 4.31Å; F216-L263 HydrophobicContact CZ-CD1 4.44Å; F216-L268 HydrophobicContact CD2-CD1 3.84Å; F216-L268 HydrophobicContact CE2-CD1 3.88Å
217	A	96.6	Very high	97.4	Very high	11 Å²	11	47.6 Å²	47.6	9%	0.091	23%	0.231	C	C	.	.			trans	-63.7	139.9	-174	0	0	0	0	0	111.8	N192 C214 N215 Y363 Y364	N192-A217 WeakPolarHBondContact OD1-CB 3.31Å; C214-A217 WeakPolarHBondContact O-CB 3.33Å; C214-A217 PolarHBondContact O-N 2.53Å; N215-A217 PolarHBondContact O-N 3.31Å; N215-A217 VanDerWaalsContact O-N 3.11Å; A217-Y363 HydrophobicContact CB-CE1 4.42Å; A217-Y363 VanDerWaalsContact CB-OH 3.26Å; A217-Y363 WeakPolarHBondContact CB-OH 3.32Å; A217-Y364 HydrophobicContact CB-CD1 4.35Å; A217-Y364 HydrophobicContact CB-CE1 3.81Å
218	P	96	Very high	97.4	Very high	57 Å²	57	45.2 Å²	45.2	37%	0.37	22%	0.218	S	C	.	.			trans	-69.2	141.7	-175.8	28.9	-36.3	0	0	0	111.8	F222 Y363 Y364	P218-F222 HydrophobicContact CB-CD2 4.29Å; P218-F222 HydrophobicContact CB-CE2 4.25Å; P218-F222 HydrophobicContact CG-CD2 4.1Å; P218-F222 HydrophobicContact CG-CE2 3.83Å; P218-Y363 VanDerWaalsContact O-CE2 3.26Å; P218-Y363 WeakPolarHBondContact O-CE2 3.32Å; P218-Y363 PolarHBondContact O-OH 3.16Å; P218-Y364 HydrophobicContact CG-CD1 3.86Å; P218-Y364 HydrophobicContact CG-CG 3.75Å
219	T	97	Very high	97.4	Very high	28 Å²	28	48.6 Å²	48.6	17%	0.172	23%	0.23	C	C	.	.			trans	-117.3	-32.7	179.9	53.2	0	0	0	0	113.2	I221 F222 K223 V226 G227	T219-I221 PolarHBondContact O-N 2.69Å; T219-F222 CarbonylContact O-C 3.34Å; T219-F222 VanDerWaalsContact O-C 3.31Å; T219-F222 PolarHBondContact O-N 2.85Å; T219-K223 WeakPolarHBondContact O-CA 3.33Å; T219-K223 PolarHBondContact O-N 2.77Å; T219-V226 HydrophobicContact CG2-CG2 4.34Å; T219-G227 VanDerWaalsContact CB-O 3.32Å; T219-G227 WeakPolarHBondContact CB-O 3.46Å
220	E	93.3	Very high	97.4	Very high	93 Å²	93	46.6 Å²	46.6	44%	0.435	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-60.3	-48.7	-162.2	-168.6	53.7	-145.5	0	0	114.1	F222 R228	E220-F222 VanDerWaalsContact C-N 3.32Å; E220-R228 IonicContact OE1-CZ 2.85Å; E220-R228 IonicContact OE1-NE 2.68Å; E220-R228 PolarHBondContact OE1-NE 3.48Å; E220-R228 IonicContact OE1-NH2 3.6Å; E220-R228 PolarHBondContact OE1-NH2 3.24Å; E220-R228 IonicContact OE2-CZ 3.93Å; E220-R228 IonicContact OE2-NE 3.21Å; E220-R228 PolarHBondContact OE2-NE 3.48Å; E220-R228 IonicContact OE2-NH2 3.83Å
221	I	95.3	Very high	97.4	Very high	142 Å²	142	48.3 Å²	48.3	73%	0.728	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-80.2	-16.3	178	67.1	177.6	0	0	0	112.8	T219	T219-I221 PolarHBondContact O-N 2.69Å
222	F	97.3	Very high	97.4	Very high	41 Å²	41	48.3 Å²	48.3	18%	0.18	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-104.9	7.1	-177.5	-55.7	-72	0	0	0	112.7	P218 T219 E220 K224 D225 V226 Y363 Y364	P218-F222 HydrophobicContact CB-CD2 4.29Å; P218-F222 HydrophobicContact CB-CE2 4.25Å; P218-F222 HydrophobicContact CG-CD2 4.1Å; P218-F222 HydrophobicContact CG-CE2 3.83Å; T219-F222 CarbonylContact O-C 3.34Å; T219-F222 VanDerWaalsContact O-C 3.31Å; T219-F222 PolarHBondContact O-N 2.85Å; E220-F222 VanDerWaalsContact C-N 3.32Å; F222-K224 PolarHBondContact O-N 3.24Å; F222-D225 PolarHBondContact O-N 3.06Å; F222-V226 HydrophobicContact CB-CG2 3.82Å; F222-V226 PolarHBondContact O-N 3.12Å; F222-Y363 HydrophobicContact CB-CD2 4.01Å; F222-Y363 HydrophobicContact CB-CE2 3.85Å; F222-Y363 AromaticContact CD1-CD2 4Å; F222-Y363 HydrophobicContact CD1-CD2 4Å; F222-Y363 HydrophobicContact CD1-CE2 4.45Å; F222-Y363 AromaticContact CD2-CD2 3.98Å; F222-Y363 HydrophobicContact CD2-CD2 3.98Å; F222-Y363 AromaticContact CD2-CE2 3.65Å; F222-Y363 HydrophobicContact CD2-CE2 3.65Å; F222-Y363 VanDerWaalsContact CE1-O 3.31Å; F222-Y363 WeakPolarHBondContact CE1-O 3.32Å; F222-Y363 HydrophobicContact CE2-CD2 4.49Å; F222-Y363 HydrophobicContact CE2-CE2 4.34Å; F222-Y363 AromaticContact CG-CD2 3.72Å; F222-Y363 HydrophobicContact CG-CD2 3.72Å; F222-Y363 AromaticContact CG-CE2 3.72Å; F222-Y363 HydrophobicContact CG-CE2 3.72Å; F222-Y364 VanDerWaalsContact CE2-CB 3.4Å; F222-Y364 VanDerWaalsContact CZ-CA 3.42Å
223	K	97.6	Very high	97.4	Very high	87 Å²	87	48.5 Å²	48.5	38%	0.378	23%	0.231	S	C	.	.	H	α-helix	trans	-56	-28.4	-169.2	65.4	-178.3	177.5	179.2	0	114.6	G202 T219 D225 G227 R228	G202-K223 WeakPolarHBondContact CA-O 3.21Å; T219-K223 WeakPolarHBondContact O-CA 3.33Å; T219-K223 PolarHBondContact O-N 2.77Å; K223-D225 PolarHBondContact O-N 3.14Å; K223-G227 VanDerWaalsContact O-CA 3.25Å; K223-G227 WeakPolarHBondContact O-CA 3.17Å; K223-G227 PolarHBondContact O-N 3.25Å; K223-R228 HydrophobicContact CB-CG 3.82Å
224	K	98.1	Very high	97.4	Very high	168 Å²	168	48.3 Å²	48.3	73%	0.73	23%	0.231	S	C	*	.	H	α-helix	trans	-62.5	-36.3	176.4	-69.5	-174.1	177.8	-178.7	0	111.3	R200 G202 F222	R200-K224 CarbonylContact C-O 3.03Å; R200-K224 VanDerWaalsContact C-O 3.22Å; R200-K224 VanDerWaalsContact CA-O 3.27Å; R200-K224 WeakPolarHBondContact CA-O 3.41Å; G202-K224 WeakPolarHBondContact CA-O 3.4Å; G202-K224 PolarHBondContact N-O 2.85Å; F222-K224 PolarHBondContact O-N 3.24Å
225	D	98.3	Very high	97.4	Very high	23 Å²	23	48.1 Å²	48.1	12%	0.123	23%	0.229	C	C	.	.	H	α-helix	trans	-95.3	-39.6	-175.5	-68.9	-28.1	0	0	0	112.3	L196 G198 S199 R200 C201 G202 F222 K223	L196-D225 WeakPolarHBondContact O-CB 3.41Å; L196-D225 VanDerWaalsContact O-CG 3.28Å; G198-D225 VanDerWaalsContact C-OD1 3.31Å; G198-D225 WeakPolarHBondContact CA-OD1 3.22Å; G198-D225 PolarHBondContact N-OD1 3.48Å; G198-D225 PolarHBondContact N-OD2 3.45Å; S199-D225 PolarHBondContact N-OD1 2.93Å; R200-D225 PolarHBondContact N-OD1 2.84Å; C201-D225 CarbonylContact C-O 3.44Å; C201-D225 WeakPolarHBondContact CB-O 3.48Å; C201-D225 PolarHBondContact N-O 3.31Å; G202-D225 PolarHBondContact N-O 2.85Å; G202-D225 VanDerWaalsContact N-O 3.09Å; F222-D225 PolarHBondContact O-N 3.06Å; K223-D225 PolarHBondContact O-N 3.14Å
226	V	98.4	Very high	97.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-116.2	-5.2	-169.9	-49.5	0	0	0	0	114.6	L196 R213 T219 F222 Y363	L196-V226 HydrophobicContact CB-CG1 4Å; L196-V226 HydrophobicContact CD1-CG1 3.83Å; L196-V226 HydrophobicContact CG-CG1 4.33Å; R213-V226 VanDerWaalsContact CZ-O 3.27Å; R213-V226 PolarHBondContact NH1-O 3.41Å; R213-V226 PolarHBondContact NH2-O 3.19Å; T219-V226 HydrophobicContact CG2-CG2 4.34Å; F222-V226 HydrophobicContact CB-CG2 3.82Å; F222-V226 PolarHBondContact O-N 3.12Å; V226-Y363 HydrophobicContact CG1-CD1 4.25Å; V226-Y363 HydrophobicContact CG1-CD2 4.05Å; V226-Y363 HydrophobicContact CG1-CE1 4.17Å; V226-Y363 HydrophobicContact CG1-CE2 3.97Å; V226-Y363 HydrophobicContact CG1-CG 4.19Å; V226-Y363 HydrophobicContact CG2-CE2 4.13Å
227	G	98	Very high	96.9	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.01	22%	0.218	C	C	.	.			trans	69.6	173.8	-173.8	0	0	0	0	0	113.2	G202 R213 T219 K223	G202-G227 VanDerWaalsContact CA-N 3.28Å; R213-G227 PolarHBondContact NH2-O 3.24Å; T219-G227 VanDerWaalsContact CB-O 3.32Å; T219-G227 WeakPolarHBondContact CB-O 3.46Å; K223-G227 VanDerWaalsContact O-CA 3.25Å; K223-G227 WeakPolarHBondContact O-CA 3.17Å; K223-G227 PolarHBondContact O-N 3.25Å
228	R	97.3	Very high	96.5	Very high	115 Å²	115	47.5 Å²	47.5	43%	0.434	23%	0.23	S	C	.	.	S	Bend	trans	-103.6	-34.2	173	-69.7	176.1	166.5	165.4	-4.1	112.8	E206 E220 K223 T230	E206-R228 WeakPolarHBondContact OE1-CA 3.43Å; E206-R228 WeakPolarHBondContact OE1-CB 3.31Å; E206-R228 PolarHBondContact OE1-N 3.33Å; E220-R228 IonicContact OE1-CZ 2.85Å; E220-R228 IonicContact OE1-NE 2.68Å; E220-R228 PolarHBondContact OE1-NE 3.48Å; E220-R228 IonicContact OE1-NH2 3.6Å; E220-R228 PolarHBondContact OE1-NH2 3.24Å; E220-R228 IonicContact OE2-CZ 3.93Å; E220-R228 IonicContact OE2-NE 3.21Å; E220-R228 PolarHBondContact OE2-NE 3.48Å; E220-R228 IonicContact OE2-NH2 3.83Å; K223-R228 HydrophobicContact CB-CG 3.82Å; R228-T230 PolarHBondContact O-N 3.5Å; R228-T230 PolarHBondContact O-OG1 3.32Å; R228-T230 VanDerWaalsContact O-OG1 3.04Å
229	R	97.6	Very high	96.3	Very high	87 Å²	87	45.5 Å²	45.5	33%	0.328	22%	0.216	S	C	.	.			trans	-51.1	127.3	-178.1	-176	171	-173.6	153	-0.6	111.1	E206 Y208 D209 V211 R213 N231	E206-R229 WeakPolarHBondContact O-CD 3.07Å; E206-R229 PolarHBondContact O-NH1 3.02Å; E206-R229 PolarHBondContact OE1-N 3.5Å; E206-R229 VanDerWaalsContact OE2-CB 3.31Å; E206-R229 WeakPolarHBondContact OE2-CB 3.29Å; Y208-R229 PolarHBondContact O-NE 2.72Å; Y208-R229 VanDerWaalsContact O-NE 3.09Å; Y208-R229 PolarHBondContact O-NH1 2.85Å; Y208-R229 VanDerWaalsContact O-NH1 3.12Å; Y208-R229 PolarHBondContact O-NH2 3.39Å; D209-R229 PolarHBondContact O-NH2 3.22Å; V211-R229 HydrophobicContact CB-CG 4.32Å; V211-R229 WeakPolarHBondContact CG1-O 3.35Å; V211-R229 HydrophobicContact CG2-CB 4.21Å; V211-R229 HydrophobicContact CG2-CG 3.84Å; R213-R229 PolarHBondContact NE-O 3.42Å; R213-R229 VanDerWaalsContact NE-O 3.09Å; R213-R229 PolarHBondContact NH2-O 2.94Å; R229-N231 PolarHBondContact NE-OD1 3.44Å
230	T	98.6	Very high	96	Very high	25 Å²	25	44.1 Å²	44.1	15%	0.153	21%	0.207	C	C	.	.			trans	-144.7	113.3	179.9	-55.7	0	0	0	0	107.1	R213 R228 T233 L263 A266	R213-T230 WeakPolarHBondContact CD-OG1 3.47Å; R213-T230 HydrophobicContact CG-CG2 4.29Å; R213-T230 PolarHBondContact NE-OG1 3.37Å; R228-T230 PolarHBondContact O-N 3.5Å; R228-T230 PolarHBondContact O-OG1 3.32Å; R228-T230 VanDerWaalsContact O-OG1 3.04Å; T230-T233 HydrophobicContact CG2-CG2 4.44Å; T230-L263 HydrophobicContact CG2-CD2 4.06Å; T230-A266 VanDerWaalsContact O-CB 3.31Å; T230-A266 WeakPolarHBondContact O-CB 3.44Å
231	N	98.7	Very high	95.9	Very high	42 Å²	42	45.1 Å²	45.1	23%	0.225	21%	0.212	C	C	.	.	S	Bend	trans	-99.3	-26.3	174.5	-62.1	94.7	0	0	0	111	F210 V211 R229 A266 I267	F210-N231 WeakPolarHBondContact CA-OD1 3.25Å; F210-N231 HydrophobicContact CD1-CB 3.99Å; F210-N231 HydrophobicContact CD2-CB 3.47Å; F210-N231 VanDerWaalsContact CD2-CB 3.47Å; F210-N231 HydrophobicContact CE1-CB 3.96Å; F210-N231 HydrophobicContact CE2-CB 3.44Å; F210-N231 VanDerWaalsContact CE2-CB 3.44Å; F210-N231 HydrophobicContact CG-CB 3.77Å; F210-N231 HydrophobicContact CZ-CB 3.69Å; V211-N231 PolarHBondContact N-OD1 3.41Å; V211-N231 PolarHBondContact O-N 2.81Å; R229-N231 PolarHBondContact NE-OD1 3.44Å; N231-A266 CarbonylContact O-C 3.37Å; N231-A266 WeakPolarHBondContact O-CA 3.18Å; N231-A266 WeakPolarHBondContact O-CB 3.48Å; N231-I267 PolarHBondContact O-N 2.9Å
232	M	98.6	Very high	95.5	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	140.3	173.4	179.8	-175.6	173.4	0	0	110.1	F139 F210 V211 L212 R213 I267 W269 M330 L333 M337	F139-M232 HydrophobicContact CE2-CE 3.55Å; F139-M232 HydrophobicContact CE2-SD 3.88Å; F139-M232 HydrophobicContact CZ-CE 3.5Å; F139-M232 HydrophobicContact CZ-SD 3.72Å; F210-M232 HydrophobicContact CE1-CB 3.73Å; F210-M232 HydrophobicContact CZ-CB 3.88Å; V211-M232 PolarHBondContact O-N 3.41Å; V211-M232 VanDerWaalsContact O-N 3.09Å; L212-M232 CarbonylContact C-O 3.56Å; L212-M232 WeakPolarHBondContact CA-O 3.34Å; L212-M232 HydrophobicContact CD2-SD 3.78Å; L212-M232 HydrophobicContact CG-CB 4.47Å; L212-M232 HydrophobicContact CG-SD 4.39Å; R213-M232 PolarHBondContact N-O 3.25Å; M232-I267 CarbonylContact C-O 3.34Å; M232-I267 VanDerWaalsContact CA-O 3.26Å; M232-I267 WeakPolarHBondContact CA-O 3.13Å; M232-I267 HydrophobicContact CB-CB 4.2Å; M232-I267 HydrophobicContact CG-CB 4.08Å; M232-I267 HydrophobicContact CG-CG2 4.24Å; M232-W269 HydrophobicContact CE-CB 3.43Å; M232-W269 VanDerWaalsContact CE-CB 3.43Å; M232-W269 HydrophobicContact CE-CD2 3.96Å; M232-W269 HydrophobicContact CE-CG 3.34Å; M232-W269 HydrophobicContact CG-CB 4.48Å; M232-M330 HydrophobicContact CE-CE 4.2Å; M232-M330 HydrophobicContact CE-SD 3.82Å; M232-L333 HydrophobicContact CE-CD1 3.85Å; M232-M337 HydrophobicContact SD-CE 4.48Å
233	T	98.8	Very high	95.3	Very high	4 Å²	4	49 Å²	49	3%	0.025	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.8	164.5	-169.5	0	0	0	0	111.8	R213 F216 T230 L263 I267 L268 W269	R213-T233 CarbonylContact O-C 3.54Å; R213-T233 WeakPolarHBondContact O-CA 3.26Å; R213-T233 PolarHBondContact O-OG1 3.09Å; F216-T233 HydrophobicContact CD2-CG2 3.83Å; F216-T233 HydrophobicContact CE2-CG2 4.41Å; F216-T233 PolarHBondContact N-OG1 2.65Å; T230-T233 HydrophobicContact CG2-CG2 4.44Å; T233-L263 HydrophobicContact CG2-CD1 3.98Å; T233-L263 HydrophobicContact CG2-CD2 4.22Å; T233-I267 PolarHBondContact N-O 2.93Å; T233-L268 HydrophobicContact CG2-CD1 3.88Å; T233-W269 PolarHBondContact O-N 3.38Å
234	T	98.7	Very high	95.2	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	149.2	172.6	69.4	0	0	0	0	111	R213 N215 F216 W269 T326 M330	R213-T234 PolarHBondContact O-N 2.67Å; N215-T234 CarbonylContact C-O 3.45Å; N215-T234 WeakPolarHBondContact CA-O 3.37Å; N215-T234 PolarHBondContact N-O 2.99Å; N215-T234 PolarHBondContact N-OG1 3.01Å; N215-T234 PolarHBondContact OD1-OG1 2.8Å; F216-T234 PolarHBondContact N-O 3.42Å; T234-W269 CarbonylContact C-O 3.59Å; T234-W269 VanDerWaalsContact CA-O 3.22Å; T234-W269 WeakPolarHBondContact CA-O 3.4Å; T234-W269 HydrophobicContact CG2-CE3 3.78Å; T234-W269 HydrophobicContact CG2-CZ3 4.43Å; T234-T326 HydrophobicContact CG2-CG2 3.88Å; T234-T326 WeakPolarHBondContact OG1-CG2 3.31Å; T234-M330 HydrophobicContact CG2-CE 3.32Å; T234-M330 HydrophobicContact CG2-CG 4.09Å; T234-M330 HydrophobicContact CG2-SD 3.31Å; T234-M330 WeakPolarHBondContact CG2-SD 3.4Å
235	F	98	Very high	95	Very high	0 Å²	0	42 Å²	42	0%	0	19%	0.193	C	C	.	.			trans	-136.4	98	179	-172.9	-86.6	0	0	0	109.7	F216 I239 L240 F256 L268 W269 I270 P271 L285	F216-F235 HydrophobicContact CB-CD2 3.82Å; F216-F235 HydrophobicContact CB-CE2 4.35Å; F216-F235 HydrophobicContact CD1-CD2 4.37Å; F216-F235 HydrophobicContact CD1-CE2 4.26Å; F216-F235 AromaticContact CD2-CD2 3.64Å; F216-F235 HydrophobicContact CD2-CD2 3.64Å; F216-F235 HydrophobicContact CD2-CE2 4.23Å; F216-F235 HydrophobicContact CE2-CD2 4.21Å; F216-F235 AromaticContact CG-CD2 3.71Å; F216-F235 HydrophobicContact CG-CD2 3.71Å; F216-F235 HydrophobicContact CG-CE2 4.05Å; F235-I239 HydrophobicContact CD2-CB 4.46Å; F235-I239 HydrophobicContact CD2-CD1 4.06Å; F235-I239 HydrophobicContact CD2-CG2 4.24Å; F235-I239 HydrophobicContact CE1-CB 4.4Å; F235-I239 HydrophobicContact CE2-CB 3.92Å; F235-I239 HydrophobicContact CE2-CD1 4.34Å; F235-I239 HydrophobicContact CE2-CG2 3.5Å; F235-I239 HydrophobicContact CG-CD1 4.36Å; F235-I239 HydrophobicContact CZ-CB 3.88Å; F235-I239 HydrophobicContact CZ-CG2 3.82Å; F235-L240 HydrophobicContact CE1-CG 4.15Å; F235-L240 HydrophobicContact CZ-CD2 4Å; F235-L240 HydrophobicContact CZ-CG 3.94Å; F235-F256 AromaticContact CE2-CE2 3.7Å; F235-F256 HydrophobicContact CE2-CE2 3.7Å; F235-F256 HydrophobicContact CE2-CZ 4.25Å; F235-F256 AromaticContact CZ-CE2 3.65Å; F235-F256 HydrophobicContact CZ-CE2 3.65Å; F235-F256 AromaticContact CZ-CZ 3.89Å; F235-F256 HydrophobicContact CZ-CZ 3.89Å; F235-L268 HydrophobicContact CB-CD1 3.61Å; F235-L268 HydrophobicContact CB-CG 4Å; F235-L268 HydrophobicContact CD2-CD1 4.15Å; F235-L268 HydrophobicContact CG-CD1 4.14Å; F235-W269 PolarHBondContact N-O 3.5Å; F235-I270 HydrophobicContact CB-CG1 4.11Å; F235-I270 HydrophobicContact CD1-CG1 4.46Å; F235-I270 HydrophobicContact CD1-CG2 4.46Å; F235-I270 WeakPolarHBondContact O-CA 3.4Å; F235-P271 WeakPolarHBondContact O-CD 3.42Å; F235-L285 HydrophobicContact CD1-CD2 4.12Å; F235-L285 HydrophobicContact CE1-CD1 4.15Å; F235-L285 HydrophobicContact CE1-CD2 3.94Å
236	N	93.1	Very high	94.8	Very high	35 Å²	35	43.2 Å²	43.2	19%	0.187	20%	0.2	C	C	.	.			trans	-69.2	128	169.8	-177.5	-45.7	0	0	0	108.4	S238 I239	N236-S238 VanDerWaalsContact CG-OG 3.24Å; N236-S238 PolarHBondContact O-N 3.47Å; N236-S238 WeakPolarHBondContact OD1-CB 3.45Å; N236-S238 PolarHBondContact OD1-N 2.7Å; N236-S238 PolarHBondContact OD1-OG 2.8Å; N236-I239 HydrophobicContact CB-CD1 4.42Å; N236-I239 VanDerWaalsContact O-CB 3.24Å; N236-I239 WeakPolarHBondContact O-CB 3.48Å; N236-I239 WeakPolarHBondContact O-CG1 3.45Å; N236-I239 PolarHBondContact O-N 3.36Å
237	P	90.4	Very high	94.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-31.5	-178.1	-30.9	38	0	0	0	114.8	I239 L240 I270 A272 V281	P237-I239 PolarHBondContact O-N 3.2Å; P237-L240 WeakPolarHBondContact O-CB 3.23Å; P237-L240 PolarHBondContact O-N 3.19Å; P237-I270 HydrophobicContact CG-CG2 4.03Å; P237-A272 HydrophobicContact CG-CB 4.46Å; P237-V281 HydrophobicContact CB-CB 4.37Å; P237-V281 HydrophobicContact CB-CG1 4.22Å; P237-V281 WeakPolarHBondContact O-CG1 3.27Å
238	S	87.2	Confident	94.5	Very high	48 Å²	48	49.6 Å²	49.6	34%	0.336	23%	0.233	S	C	.	.	H	α-helix	trans	-58.7	-13.8	175.1	61.6	0	0	0	0	114.8	N236 L240 E241 K242	N236-S238 VanDerWaalsContact CG-OG 3.24Å; N236-S238 PolarHBondContact O-N 3.47Å; N236-S238 WeakPolarHBondContact OD1-CB 3.45Å; N236-S238 PolarHBondContact OD1-N 2.7Å; N236-S238 PolarHBondContact OD1-OG 2.8Å; S238-L240 VanDerWaalsContact C-N 3.25Å; S238-L240 PolarHBondContact O-N 2.99Å; S238-E241 PolarHBondContact O-N 3Å; S238-K242 WeakPolarHBondContact O-CB 3.28Å; S238-K242 PolarHBondContact O-N 2.86Å
239	I	91.4	Very high	94.5	Very high	15 Å²	15	47 Å²	47	8%	0.077	23%	0.23	C	C	.	.	H	α-helix	trans	-60.8	-36	170.9	-68.8	169.9	0	0	0	110.9	N215 F216 F235 N236 P237 K242 Y243 Y244	N215-I239 HydrophobicContact CB-CD1 4.41Å; F216-I239 HydrophobicContact CB-CD1 3.83Å; F235-I239 HydrophobicContact CD2-CB 4.46Å; F235-I239 HydrophobicContact CD2-CD1 4.06Å; F235-I239 HydrophobicContact CD2-CG2 4.24Å; F235-I239 HydrophobicContact CE1-CB 4.4Å; F235-I239 HydrophobicContact CE2-CB 3.92Å; F235-I239 HydrophobicContact CE2-CD1 4.34Å; F235-I239 HydrophobicContact CE2-CG2 3.5Å; F235-I239 HydrophobicContact CG-CD1 4.36Å; F235-I239 HydrophobicContact CZ-CB 3.88Å; F235-I239 HydrophobicContact CZ-CG2 3.82Å; N236-I239 HydrophobicContact CB-CD1 4.42Å; N236-I239 VanDerWaalsContact O-CB 3.24Å; N236-I239 WeakPolarHBondContact O-CB 3.48Å; N236-I239 WeakPolarHBondContact O-CG1 3.45Å; N236-I239 PolarHBondContact O-N 3.36Å; P237-I239 PolarHBondContact O-N 3.2Å; I239-K242 PolarHBondContact O-N 2.96Å; I239-Y243 HydrophobicContact CB-CD2 4.49Å; I239-Y243 HydrophobicContact CG2-CD2 3.97Å; I239-Y243 WeakPolarHBondContact O-CB 3.43Å; I239-Y243 PolarHBondContact O-N 3.32Å; I239-Y244 HydrophobicContact CG2-CD2 4.36Å; I239-Y244 HydrophobicContact CG2-CE2 4.09Å
240	L	92.3	Very high	94.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-46	176.2	-78	-171.5	0	0	0	111.8	F235 P237 S238 Y244 N245 N246 L247 F256 V281 L285	F235-L240 HydrophobicContact CE1-CG 4.15Å; F235-L240 HydrophobicContact CZ-CD2 4Å; F235-L240 HydrophobicContact CZ-CG 3.94Å; P237-L240 WeakPolarHBondContact O-CB 3.23Å; P237-L240 PolarHBondContact O-N 3.19Å; S238-L240 VanDerWaalsContact C-N 3.25Å; S238-L240 PolarHBondContact O-N 2.99Å; L240-Y244 HydrophobicContact CD2-CD2 4.13Å; L240-Y244 HydrophobicContact CD2-CG 4.31Å; L240-Y244 CarbonylContact O-C 3.14Å; L240-Y244 VanDerWaalsContact O-CA 3.32Å; L240-Y244 WeakPolarHBondContact O-CA 3.29Å; L240-Y244 PolarHBondContact O-N 2.78Å; L240-N245 PolarHBondContact O-N 2.92Å; L240-N246 PolarHBondContact O-N 3.23Å; L240-N246 VanDerWaalsContact O-N 3.11Å; L240-L247 HydrophobicContact CD1-CD1 3.95Å; L240-L247 HydrophobicContact CD1-CG 4.23Å; L240-L247 HydrophobicContact CD2-CD1 4Å; L240-L247 HydrophobicContact CD2-CD2 3.82Å; L240-L247 HydrophobicContact CD2-CG 3.89Å; L240-F256 HydrophobicContact CD2-CD1 4.04Å; L240-F256 HydrophobicContact CD2-CD2 3.88Å; L240-F256 HydrophobicContact CD2-CE1 3.91Å; L240-F256 HydrophobicContact CD2-CE2 3.78Å; L240-F256 HydrophobicContact CD2-CG 4.02Å; L240-F256 HydrophobicContact CD2-CZ 3.78Å; L240-V281 HydrophobicContact CB-CG1 3.65Å; L240-V281 HydrophobicContact CD1-CG1 3.92Å; L240-V281 HydrophobicContact CG-CG1 4.27Å; L240-L285 HydrophobicContact CD1-CB 3.84Å; L240-L285 HydrophobicContact CD1-CD1 3.8Å; L240-L285 HydrophobicContact CD1-CG 4.36Å; L240-L285 HydrophobicContact CG-CD1 4.36Å
241	E	89.6	Confident	94.4	Very high	114 Å²	114	52.3 Å²	52.3	53%	0.533	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-47	177.4	-176.6	-179.9	-172.9	0	0	110.6	S238 N246	S238-E241 PolarHBondContact O-N 3Å; E241-N246 VanDerWaalsContact CA-OD1 3.23Å; E241-N246 WeakPolarHBondContact CA-OD1 3.14Å; E241-N246 WeakPolarHBondContact CB-OD1 3.21Å
242	K	88.8	Confident	94.3	Very high	138 Å²	138	51.6 Å²	51.6	60%	0.6	26%	0.261	S	S	*	.	H	α-helix	trans	-74	-36.2	-172.5	-173.2	173.8	178.2	-165.4	0	114.4	S238 I239	S238-K242 WeakPolarHBondContact O-CB 3.28Å; S238-K242 PolarHBondContact O-N 2.86Å; I239-K242 PolarHBondContact O-N 2.96Å
243	Y	92.6	Very high	94.2	Very high	127 Å²	127	54.4 Å²	54.4	50%	0.498	27%	0.271	S	S	.	.	H	α-helix	trans	-122.8	-14.7	-168.5	-62.8	-73.2	0	0	0	114.7	I239	I239-Y243 HydrophobicContact CB-CD2 4.49Å; I239-Y243 HydrophobicContact CG2-CD2 3.97Å; I239-Y243 WeakPolarHBondContact O-CB 3.43Å; I239-Y243 PolarHBondContact O-N 3.32Å
244	Y	94.7	Very high	94.2	Very high	27 Å²	27	57.9 Å²	57.9	11%	0.106	29%	0.289	C	S	.	.	H	α-helix	trans	-128.7	18.7	-177.9	-59.9	-83.8	0	0	0	112.3	F216 I239 L240 N246 L247 D252 N255 F256 S259	F216-Y244 WeakPolarHBondContact CE1-OH 3.49Å; I239-Y244 HydrophobicContact CG2-CD2 4.36Å; I239-Y244 HydrophobicContact CG2-CE2 4.09Å; L240-Y244 HydrophobicContact CD2-CD2 4.13Å; L240-Y244 HydrophobicContact CD2-CG 4.31Å; L240-Y244 CarbonylContact O-C 3.14Å; L240-Y244 VanDerWaalsContact O-CA 3.32Å; L240-Y244 WeakPolarHBondContact O-CA 3.29Å; L240-Y244 PolarHBondContact O-N 2.78Å; Y244-N246 PolarHBondContact O-N 2.84Å; Y244-L247 PolarHBondContact O-N 3.11Å; Y244-D252 WeakPolarHBondContact O-CB 3.33Å; Y244-N255 HydrophobicContact CD1-CB 4.28Å; Y244-N255 HydrophobicContact CE1-CB 4.25Å; Y244-F256 HydrophobicContact CD1-CB 3.66Å; Y244-F256 HydrophobicContact CD1-CD2 4.17Å; Y244-F256 HydrophobicContact CD1-CG 4.34Å; Y244-F256 HydrophobicContact CD2-CD2 4.02Å; Y244-F256 HydrophobicContact CE1-CB 3.95Å; Y244-F256 HydrophobicContact CE1-CD2 4.08Å; Y244-F256 AromaticContact CE2-CD2 3.93Å; Y244-F256 HydrophobicContact CE2-CD2 3.93Å; Y244-F256 HydrophobicContact CE2-CE2 4.5Å; Y244-F256 HydrophobicContact CG-CB 4.15Å; Y244-F256 HydrophobicContact CG-CD2 4.14Å; Y244-F256 HydrophobicContact CG-CG 4.45Å; Y244-F256 AromaticContact CZ-CD2 3.96Å; Y244-S259 WeakPolarHBondContact OH-CB 3.36Å; Y244-S259 PolarHBondContact OH-OG 3.44Å
245	N	95	Very high	94.1	Very high	79 Å²	79	60.8 Å²	60.8	42%	0.422	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	47.5	43.7	173.1	-174.5	40.9	0	0	0	113	L240 L247 L248 D252	L240-N245 PolarHBondContact O-N 2.92Å; N245-L247 PolarHBondContact O-N 3.41Å; N245-L248 WeakPolarHBondContact O-CB 3.07Å; N245-L248 VanDerWaalsContact O-CG 3.22Å; N245-L248 WeakPolarHBondContact O-CG 3.1Å; N245-L248 PolarHBondContact O-N 2.81Å; N245-L248 VanDerWaalsContact O-N 3.14Å; N245-D252 WeakPolarHBondContact CB-OD2 3.46Å; N245-D252 PolarHBondContact ND2-OD2 3.13Å; N245-D252 VanDerWaalsContact ND2-OD2 3.12Å
246	N	93.2	Very high	94.1	Very high	49 Å²	49	60.8 Å²	60.8	26%	0.262	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	51.6	26.3	-176.8	-66.6	-49.8	0	0	0	115.1	L240 E241 Y244 L248	L240-N246 PolarHBondContact O-N 3.23Å; L240-N246 VanDerWaalsContact O-N 3.11Å; E241-N246 VanDerWaalsContact CA-OD1 3.23Å; E241-N246 WeakPolarHBondContact CA-OD1 3.14Å; E241-N246 WeakPolarHBondContact CB-OD1 3.21Å; Y244-N246 PolarHBondContact O-N 2.84Å; N246-L248 HydrophobicContact CB-CG 4.17Å; N246-L248 PolarHBondContact O-N 3.36Å
247	L	95.3	Very high	94.4	Very high	9 Å²	9	60.7 Å²	60.7	5%	0.047	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	57.8	29	-179.4	-52.3	-177.6	0	0	0	113.5	L240 Y244 N245 T249 R253 F256 T284 F288	L240-L247 HydrophobicContact CD1-CD1 3.95Å; L240-L247 HydrophobicContact CD1-CG 4.23Å; L240-L247 HydrophobicContact CD2-CD1 4Å; L240-L247 HydrophobicContact CD2-CD2 3.82Å; L240-L247 HydrophobicContact CD2-CG 3.89Å; Y244-L247 PolarHBondContact O-N 3.11Å; N245-L247 PolarHBondContact O-N 3.41Å; L247-T249 VanDerWaalsContact C-N 3.34Å; L247-T249 PolarHBondContact O-N 3.41Å; L247-R253 HydrophobicContact CB-CG 3.82Å; L247-R253 WeakPolarHBondContact O-CD 3.34Å; L247-R253 WeakPolarHBondContact O-CG 3.26Å; L247-F256 HydrophobicContact CD1-CD1 3.88Å; L247-F256 HydrophobicContact CD1-CE1 4.27Å; L247-F256 HydrophobicContact CD2-CB 3.6Å; L247-F256 HydrophobicContact CD2-CD1 3.87Å; L247-F256 HydrophobicContact CD2-CG 3.89Å; L247-T284 HydrophobicContact CB-CG2 4.24Å; L247-T284 HydrophobicContact CD1-CG2 4.27Å; L247-T284 HydrophobicContact CG-CG2 4.48Å; L247-F288 HydrophobicContact CD1-CB 3.89Å; L247-F288 HydrophobicContact CD1-CD2 3.73Å; L247-F288 HydrophobicContact CD1-CE2 4.48Å; L247-F288 HydrophobicContact CD1-CG 3.86Å
248	L	95	Very high	94.7	Very high	126 Å²	126	65.1 Å²	65.1	66%	0.66	33%	0.326	S	S	*	.			trans	-69.9	-27.7	-175.2	-69.4	172.6	0	0	0	113.5	N245 N246	N245-L248 WeakPolarHBondContact O-CB 3.07Å; N245-L248 VanDerWaalsContact O-CG 3.22Å; N245-L248 WeakPolarHBondContact O-CG 3.1Å; N245-L248 PolarHBondContact O-N 2.81Å; N245-L248 VanDerWaalsContact O-N 3.14Å; N246-L248 HydrophobicContact CB-CG 4.17Å; N246-L248 PolarHBondContact O-N 3.36Å
249	T	96.8	Very high	95.2	Very high	61 Å²	61	64.1 Å²	64.1	37%	0.374	32%	0.319	S	S	.	.	S	Bend	trans	-113.3	157.6	-178.7	77	0	0	0	0	112.2	L247 Q251 D252 R253	L247-T249 VanDerWaalsContact C-N 3.34Å; L247-T249 PolarHBondContact O-N 3.41Å; T249-Q251 PolarHBondContact O-N 2.82Å; T249-Q251 PolarHBondContact OG1-N 3.21Å; T249-D252 WeakPolarHBondContact CB-OD2 3.15Å; T249-D252 WeakPolarHBondContact CG2-OD2 3.4Å; T249-D252 PolarHBondContact O-N 3.29Å; T249-D252 WeakPolarHBondContact OG1-CB 3.31Å; T249-D252 PolarHBondContact OG1-N 3.03Å; T249-D252 VanDerWaalsContact OG1-N 3.08Å; T249-D252 PolarHBondContact OG1-OD2 2.85Å; T249-R253 WeakPolarHBondContact O-CD 3.37Å; T249-R253 VanDerWaalsContact O-CG 3.27Å; T249-R253 WeakPolarHBondContact O-CG 3.17Å; T249-R253 PolarHBondContact O-N 3.1Å
250	V	96.5	Very high	95.5	Very high	109 Å²	109	63.4 Å²	63.4	66%	0.661	32%	0.316	S	S	*	.	H	α-helix	trans	-57.6	-38.8	173.6	176.8	0	0	0	0	111.1	R253 N254	V250-R253 PolarHBondContact O-N 2.85Å; V250-N254 WeakPolarHBondContact O-CB 3.26Å; V250-N254 VanDerWaalsContact O-CG 3.22Å; V250-N254 PolarHBondContact O-N 2.91Å; V250-N254 PolarHBondContact O-ND2 3.01Å
251	Q	97.3	Very high	95.7	Very high	115 Å²	115	69.9 Å²	69.9	54%	0.537	34%	0.344	S	S	.	.	H	α-helix	trans	-65.4	-43.8	178.2	-173.9	60.2	47.6	0	0	111.7	T249 R253 N254 N255	T249-Q251 PolarHBondContact O-N 2.82Å; T249-Q251 PolarHBondContact OG1-N 3.21Å; Q251-R253 VanDerWaalsContact C-N 3.34Å; Q251-R253 PolarHBondContact O-N 2.8Å; Q251-N254 PolarHBondContact O-N 2.79Å; Q251-N255 PolarHBondContact NE2-OD1 3.01Å; Q251-N255 WeakPolarHBondContact O-CB 3.26Å; Q251-N255 PolarHBondContact O-N 2.94Å; Q251-N255 PolarHBondContact O-ND2 3.4Å; Q251-N255 PolarHBondContact O-OD1 3.06Å
252	D	96.9	Very high	96	Very high	27 Å²	27	71.8 Å²	71.8	14%	0.144	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-42.9	178.6	-66.5	-42	0	0	0	111.6	Y244 N245 T249 N255 F256	Y244-D252 WeakPolarHBondContact O-CB 3.33Å; N245-D252 WeakPolarHBondContact CB-OD2 3.46Å; N245-D252 PolarHBondContact ND2-OD2 3.13Å; N245-D252 VanDerWaalsContact ND2-OD2 3.12Å; T249-D252 WeakPolarHBondContact CB-OD2 3.15Å; T249-D252 WeakPolarHBondContact CG2-OD2 3.4Å; T249-D252 PolarHBondContact O-N 3.29Å; T249-D252 WeakPolarHBondContact OG1-CB 3.31Å; T249-D252 PolarHBondContact OG1-N 3.03Å; T249-D252 VanDerWaalsContact OG1-N 3.08Å; T249-D252 PolarHBondContact OG1-OD2 2.85Å; D252-N255 PolarHBondContact O-N 3.11Å; D252-F256 PolarHBondContact O-N 3.42Å
253	R	97.8	Very high	96.4	Very high	59 Å²	59	66.4 Å²	66.4	22%	0.223	33%	0.328	C	S	.	.	H	α-helix	trans	-61.1	-45.9	175.1	-69.1	165	59	77.3	11.7	111.8	L247 T249 V250 Q251 F256 F257 F288 E291	L247-R253 HydrophobicContact CB-CG 3.82Å; L247-R253 WeakPolarHBondContact O-CD 3.34Å; L247-R253 WeakPolarHBondContact O-CG 3.26Å; T249-R253 WeakPolarHBondContact O-CD 3.37Å; T249-R253 VanDerWaalsContact O-CG 3.27Å; T249-R253 WeakPolarHBondContact O-CG 3.17Å; T249-R253 PolarHBondContact O-N 3.1Å; V250-R253 PolarHBondContact O-N 2.85Å; Q251-R253 VanDerWaalsContact C-N 3.34Å; Q251-R253 PolarHBondContact O-N 2.8Å; R253-F256 PolarHBondContact O-N 3.08Å; R253-F257 WeakPolarHBondContact O-CB 3.18Å; R253-F257 PolarHBondContact O-N 3.31Å; R253-F288 HydrophobicContact CB-CE2 4.43Å; R253-E291 IonicContact CZ-OE1 2.68Å; R253-E291 IonicContact CZ-OE2 3.44Å; R253-E291 IonicContact NH1-OE2 3.34Å; R253-E291 PolarHBondContact NH1-OE2 2.67Å; R253-E291 IonicContact NH2-OE1 2.66Å; R253-E291 PolarHBondContact NH2-OE1 3.44Å; R253-E291 IonicContact NH2-OE2 3.75Å; R253-E291 PolarHBondContact NH2-OE2 3.48Å
254	N	97.9	Very high	96.6	Very high	76 Å²	76	63.8 Å²	63.8	41%	0.406	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-42.9	175.7	-74.8	-17.7	0	0	0	111.9	V250 Q251 F256 F257 L258	V250-N254 WeakPolarHBondContact O-CB 3.26Å; V250-N254 VanDerWaalsContact O-CG 3.22Å; V250-N254 PolarHBondContact O-N 2.91Å; V250-N254 PolarHBondContact O-ND2 3.01Å; Q251-N254 PolarHBondContact O-N 2.79Å; N254-F256 VanDerWaalsContact C-N 3.32Å; N254-F256 PolarHBondContact O-N 2.87Å; N254-F257 PolarHBondContact O-N 3.32Å; N254-L258 WeakPolarHBondContact O-CB 3.44Å; N254-L258 VanDerWaalsContact O-CG 3.25Å; N254-L258 WeakPolarHBondContact O-CG 3.5Å; N254-L258 PolarHBondContact O-N 3.25Å
255	N	97.4	Very high	96.7	Very high	62 Å²	62	70.1 Å²	70.1	33%	0.332	35%	0.346	S	S	.	.	H	α-helix	trans	-60.7	-42.7	177.1	-71.3	-18.5	0	0	0	111.5	Y244 Q251 D252 S259	Y244-N255 HydrophobicContact CD1-CB 4.28Å; Y244-N255 HydrophobicContact CE1-CB 4.25Å; Q251-N255 PolarHBondContact NE2-OD1 3.01Å; Q251-N255 WeakPolarHBondContact O-CB 3.26Å; Q251-N255 PolarHBondContact O-N 2.94Å; Q251-N255 PolarHBondContact O-ND2 3.4Å; Q251-N255 PolarHBondContact O-OD1 3.06Å; D252-N255 PolarHBondContact O-N 3.11Å; N255-S259 WeakPolarHBondContact O-CB 3.41Å; N255-S259 PolarHBondContact O-N 3.45Å; N255-S259 PolarHBondContact O-OG 3.45Å
256	F	97.9	Very high	96.8	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-66.6	-46.7	176.7	-173.7	-126.5	0	0	0	111.5	F235 L240 Y244 L247 D252 R253 N254 L258 S259 L260 L285 F288	F235-F256 AromaticContact CE2-CE2 3.7Å; F235-F256 HydrophobicContact CE2-CE2 3.7Å; F235-F256 HydrophobicContact CE2-CZ 4.25Å; F235-F256 AromaticContact CZ-CE2 3.65Å; F235-F256 HydrophobicContact CZ-CE2 3.65Å; F235-F256 AromaticContact CZ-CZ 3.89Å; F235-F256 HydrophobicContact CZ-CZ 3.89Å; L240-F256 HydrophobicContact CD2-CD1 4.04Å; L240-F256 HydrophobicContact CD2-CD2 3.88Å; L240-F256 HydrophobicContact CD2-CE1 3.91Å; L240-F256 HydrophobicContact CD2-CE2 3.78Å; L240-F256 HydrophobicContact CD2-CG 4.02Å; L240-F256 HydrophobicContact CD2-CZ 3.78Å; Y244-F256 HydrophobicContact CD1-CB 3.66Å; Y244-F256 HydrophobicContact CD1-CD2 4.17Å; Y244-F256 HydrophobicContact CD1-CG 4.34Å; Y244-F256 HydrophobicContact CD2-CD2 4.02Å; Y244-F256 HydrophobicContact CE1-CB 3.95Å; Y244-F256 HydrophobicContact CE1-CD2 4.08Å; Y244-F256 AromaticContact CE2-CD2 3.93Å; Y244-F256 HydrophobicContact CE2-CD2 3.93Å; Y244-F256 HydrophobicContact CE2-CE2 4.5Å; Y244-F256 HydrophobicContact CG-CB 4.15Å; Y244-F256 HydrophobicContact CG-CD2 4.14Å; Y244-F256 HydrophobicContact CG-CG 4.45Å; Y244-F256 AromaticContact CZ-CD2 3.96Å; L247-F256 HydrophobicContact CD1-CD1 3.88Å; L247-F256 HydrophobicContact CD1-CE1 4.27Å; L247-F256 HydrophobicContact CD2-CB 3.6Å; L247-F256 HydrophobicContact CD2-CD1 3.87Å; L247-F256 HydrophobicContact CD2-CG 3.89Å; D252-F256 PolarHBondContact O-N 3.42Å; R253-F256 PolarHBondContact O-N 3.08Å; N254-F256 VanDerWaalsContact C-N 3.32Å; N254-F256 PolarHBondContact O-N 2.87Å; F256-L258 PolarHBondContact O-N 3.14Å; F256-S259 WeakPolarHBondContact O-CB 3.37Å; F256-S259 PolarHBondContact O-N 3.49Å; F256-S259 VanDerWaalsContact O-N 3.1Å; F256-L260 HydrophobicContact CD1-CD1 3.82Å; F256-L260 HydrophobicContact CD2-CD1 4.42Å; F256-L260 HydrophobicContact CD2-CG 4.4Å; F256-L260 HydrophobicContact CE1-CD1 3.47Å; F256-L260 VanDerWaalsContact CE1-CD1 3.47Å; F256-L260 HydrophobicContact CE1-CG 4.33Å; F256-L260 HydrophobicContact CE2-CD1 4.09Å; F256-L260 HydrophobicContact CE2-CD2 4.21Å; F256-L260 HydrophobicContact CE2-CG 4.06Å; F256-L260 HydrophobicContact CG-CD1 4.29Å; F256-L260 HydrophobicContact CZ-CD1 3.61Å; F256-L260 HydrophobicContact CZ-CD2 4.11Å; F256-L260 HydrophobicContact CZ-CG 4.03Å; F256-L260 WeakPolarHBondContact O-CG 3.27Å; F256-L260 PolarHBondContact O-N 3.31Å; F256-L285 HydrophobicContact CE1-CD1 3.73Å; F256-L285 HydrophobicContact CZ-CD1 3.63Å; F256-F288 AromaticContact CD1-CD1 3.81Å; F256-F288 HydrophobicContact CD1-CD1 3.81Å; F256-F288 HydrophobicContact CD1-CD2 4.28Å; F256-F288 AromaticContact CD1-CE1 3.55Å; F256-F288 HydrophobicContact CD1-CE1 3.55Å; F256-F288 HydrophobicContact CD1-CE2 4.02Å; F256-F288 HydrophobicContact CD1-CG 4.18Å; F256-F288 AromaticContact CD1-CZ 3.65Å; F256-F288 HydrophobicContact CD1-CZ 3.65Å; F256-F288 AromaticContact CE1-CD1 3.66Å; F256-F288 HydrophobicContact CE1-CD1 3.66Å; F256-F288 AromaticContact CE1-CE1 3.7Å; F256-F288 HydrophobicContact CE1-CE1 3.7Å; F256-F288 HydrophobicContact CE1-CG 4.25Å; F256-F288 HydrophobicContact CE1-CZ 4.28Å
257	F	98.3	Very high	97.1	Very high	34 Å²	34	64.7 Å²	64.7	15%	0.149	32%	0.318	C	S	.	.	H	α-helix	trans	-55	-48.4	175.3	-176	-90.9	0	0	0	112.2	R253 N254 S259 L260 K261 F288 H292 Q295 L296	R253-F257 WeakPolarHBondContact O-CB 3.18Å; R253-F257 PolarHBondContact O-N 3.31Å; N254-F257 PolarHBondContact O-N 3.32Å; F257-S259 VanDerWaalsContact C-N 3.28Å; F257-S259 PolarHBondContact O-N 2.88Å; F257-L260 PolarHBondContact O-N 2.85Å; F257-K261 HydrophobicContact CE1-CD 4.18Å; F257-K261 WeakPolarHBondContact O-CB 3.38Å; F257-K261 PolarHBondContact O-N 2.77Å; F257-F288 HydrophobicContact CB-CZ 4Å; F257-F288 HydrophobicContact CD2-CZ 4.23Å; F257-H292 HydrophobicContact CD2-CB 4.48Å; F257-H292 AromaticContact CD2-CD2 3.46Å; F257-H292 VanDerWaalsContact CD2-CD2 3.46Å; F257-H292 WeakPolarHBondContact CD2-CD2 3.37Å; F257-H292 HydrophobicContact CE2-CB 4.3Å; F257-H292 AromaticContact CE2-CD2 3.59Å; F257-Q295 HydrophobicContact CE2-CB 4.05Å; F257-Q295 HydrophobicContact CZ-CB 4.2Å; F257-L296 HydrophobicContact CD2-CD1 4.29Å; F257-L296 HydrophobicContact CD2-CD2 4.04Å; F257-L296 HydrophobicContact CD2-CG 4.26Å; F257-L296 HydrophobicContact CE2-CD1 4.33Å; F257-L296 HydrophobicContact CE2-CD2 3.73Å; F257-L296 HydrophobicContact CE2-CG 3.84Å; F257-L296 HydrophobicContact CZ-CD2 3.98Å; F257-L296 HydrophobicContact CZ-CG 4.45Å
258	L	97.4	Very high	97.3	Very high	92 Å²	92	64.2 Å²	64.2	48%	0.482	32%	0.316	S	S	.	.	H	α-helix	trans	-63.7	-35.2	178.1	-71	173.3	0	0	0	112.2	N254 F256 K261 K262	N254-L258 WeakPolarHBondContact O-CB 3.44Å; N254-L258 VanDerWaalsContact O-CG 3.25Å; N254-L258 WeakPolarHBondContact O-CG 3.5Å; N254-L258 PolarHBondContact O-N 3.25Å; F256-L258 PolarHBondContact O-N 3.14Å; L258-K261 PolarHBondContact O-N 2.94Å; L258-K262 WeakPolarHBondContact O-CG 3.26Å; L258-K262 PolarHBondContact O-N 3.02Å
259	S	96.9	Very high	97.5	Very high	27 Å²	27	58.3 Å²	58.3	19%	0.189	28%	0.284	C	S	.	.	H	α-helix	trans	-68.7	-40.4	176.6	-59.5	0	0	0	0	111.7	Y244 N255 F256 F257 K262	Y244-S259 WeakPolarHBondContact OH-CB 3.36Å; Y244-S259 PolarHBondContact OH-OG 3.44Å; N255-S259 WeakPolarHBondContact O-CB 3.41Å; N255-S259 PolarHBondContact O-N 3.45Å; N255-S259 PolarHBondContact O-OG 3.45Å; F256-S259 WeakPolarHBondContact O-CB 3.37Å; F256-S259 PolarHBondContact O-N 3.49Å; F256-S259 VanDerWaalsContact O-N 3.1Å; F257-S259 VanDerWaalsContact C-N 3.28Å; F257-S259 PolarHBondContact O-N 2.88Å; S259-K262 PolarHBondContact O-N 3.39Å
260	L	97.6	Very high	97.5	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-39.8	173.6	-68.3	169.9	0	0	0	112.2	F216 F256 F257 K262 L263 L268 F288 F289 L296	F216-L260 HydrophobicContact CE2-CD2 4.32Å; F216-L260 HydrophobicContact CZ-CD2 4.4Å; F256-L260 HydrophobicContact CD1-CD1 3.82Å; F256-L260 HydrophobicContact CD2-CD1 4.42Å; F256-L260 HydrophobicContact CD2-CG 4.4Å; F256-L260 HydrophobicContact CE1-CD1 3.47Å; F256-L260 VanDerWaalsContact CE1-CD1 3.47Å; F256-L260 HydrophobicContact CE1-CG 4.33Å; F256-L260 HydrophobicContact CE2-CD1 4.09Å; F256-L260 HydrophobicContact CE2-CD2 4.21Å; F256-L260 HydrophobicContact CE2-CG 4.06Å; F256-L260 HydrophobicContact CG-CD1 4.29Å; F256-L260 HydrophobicContact CZ-CD1 3.61Å; F256-L260 HydrophobicContact CZ-CD2 4.11Å; F256-L260 HydrophobicContact CZ-CG 4.03Å; F256-L260 WeakPolarHBondContact O-CG 3.27Å; F256-L260 PolarHBondContact O-N 3.31Å; F257-L260 PolarHBondContact O-N 2.85Å; L260-K262 PolarHBondContact O-N 2.98Å; L260-L263 WeakPolarHBondContact O-CB 3.46Å; L260-L263 PolarHBondContact O-N 3.35Å; L260-L268 HydrophobicContact CD2-CD2 3.56Å; L260-F288 HydrophobicContact CD1-CD1 4.38Å; L260-F288 HydrophobicContact CD1-CE1 3.58Å; L260-F288 HydrophobicContact CD1-CZ 4.33Å; L260-F289 HydrophobicContact CD1-CE1 3.66Å; L260-F289 HydrophobicContact CD1-CZ 4.09Å; L260-F289 HydrophobicContact CD2-CE1 4.36Å; L260-F289 HydrophobicContact CD2-CZ 4.31Å; L260-L296 HydrophobicContact CB-CD1 3.97Å; L260-L296 HydrophobicContact CB-CD2 4Å; L260-L296 HydrophobicContact CD1-CD1 3.78Å
261	K	97.1	Very high	97.6	Very high	135 Å²	135	50.7 Å²	50.7	59%	0.587	24%	0.239	S	C	*	.	H	α-helix	trans	-59.6	-34.4	177.7	-173.1	171.5	-178.3	172.1	0	112.2	F257 L258 L263 D264 L296	F257-K261 HydrophobicContact CE1-CD 4.18Å; F257-K261 WeakPolarHBondContact O-CB 3.38Å; F257-K261 PolarHBondContact O-N 2.77Å; L258-K261 PolarHBondContact O-N 2.94Å; K261-L263 PolarHBondContact O-N 3.34Å; K261-D264 PolarHBondContact O-N 3.04Å; K261-L296 HydrophobicContact CB-CD2 4.17Å
262	K	96.1	Very high	97.6	Very high	155 Å²	155	45.3 Å²	45.3	67%	0.674	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.7	175.8	-72.5	167.8	-175.6	175.7	0	113.8	L258 S259 L260 D264	L258-K262 WeakPolarHBondContact O-CG 3.26Å; L258-K262 PolarHBondContact O-N 3.02Å; S259-K262 PolarHBondContact O-N 3.39Å; L260-K262 PolarHBondContact O-N 2.98Å; K262-D264 PolarHBondContact O-N 3.44Å
263	L	96.8	Very high	97.7	Very high	24 Å²	24	44 Å²	44	13%	0.126	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-13.3	176.1	-68.9	-173.7	0	0	0	113	F216 T230 T233 L260 K261 R265 A266 L268 V298	F216-L263 HydrophobicContact CD2-CD1 4.39Å; F216-L263 HydrophobicContact CE2-CD1 3.61Å; F216-L263 HydrophobicContact CE2-CG 4.31Å; F216-L263 HydrophobicContact CZ-CD1 4.44Å; T230-L263 HydrophobicContact CG2-CD2 4.06Å; T233-L263 HydrophobicContact CG2-CD1 3.98Å; T233-L263 HydrophobicContact CG2-CD2 4.22Å; L260-L263 WeakPolarHBondContact O-CB 3.46Å; L260-L263 PolarHBondContact O-N 3.35Å; K261-L263 PolarHBondContact O-N 3.34Å; L263-R265 PolarHBondContact O-N 2.98Å; L263-R265 VanDerWaalsContact O-N 3.11Å; L263-A266 HydrophobicContact CB-CB 4.13Å; L263-A266 WeakPolarHBondContact O-CB 3.41Å; L263-A266 PolarHBondContact O-N 2.92Å; L263-L268 HydrophobicContact CD1-CD1 3.95Å; L263-V298 HydrophobicContact CB-CG2 4.25Å; L263-V298 HydrophobicContact CD1-CG2 4.08Å
264	D	96.1	Very high	97.6	Very high	73 Å²	73	41.9 Å²	41.9	39%	0.39	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	-115.5	-175.8	-173.9	45.4	0	0	0	111.4	K261 K262 K297 V298	K261-D264 PolarHBondContact O-N 3.04Å; K262-D264 PolarHBondContact O-N 3.44Å; D264-K297 CarbonylContact O-C 3.59Å; D264-K297 WeakPolarHBondContact O-CB 3.35Å; D264-K297 WeakPolarHBondContact OD1-CD 3.3Å; D264-K297 IonicContact OD1-NZ 3.19Å; D264-V298 VanDerWaalsContact O-CA 3.26Å; D264-V298 WeakPolarHBondContact O-CA 3.42Å; D264-V298 PolarHBondContact O-N 3.3Å
265	R	97.1	Very high	97.5	Very high	160 Å²	160	40.1 Å²	40.1	60%	0.604	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	10.2	-178.4	-67.8	-175.5	168.5	114.4	-9.5	114.7	L263 K297 Q299	L263-R265 PolarHBondContact O-N 2.98Å; L263-R265 VanDerWaalsContact O-N 3.11Å; R265-K297 HydrophobicContact CG-CB 4.18Å; R265-Q299 PolarHBondContact O-NE2 3.02Å
266	A	98.4	Very high	97.4	Very high	6 Å²	6	40 Å²	40	5%	0.05	19%	0.185	C	C	.	.			trans	-63.5	158.5	179.4	0	0	0	0	0	112	T230 N231 L263 V298 Q299	T230-A266 VanDerWaalsContact O-CB 3.31Å; T230-A266 WeakPolarHBondContact O-CB 3.44Å; N231-A266 CarbonylContact O-C 3.37Å; N231-A266 WeakPolarHBondContact O-CA 3.18Å; N231-A266 WeakPolarHBondContact O-CB 3.48Å; L263-A266 HydrophobicContact CB-CB 4.13Å; L263-A266 WeakPolarHBondContact O-CB 3.41Å; L263-A266 PolarHBondContact O-N 2.92Å; A266-V298 WeakPolarHBondContact O-CG2 3.22Å; A266-Q299 PolarHBondContact O-N 3.5Å
267	I	98.8	Very high	97.2	Very high	7 Å²	7	44.4 Å²	44.4	4%	0.036	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	122.1	173.3	-60	170.2	0	0	0	109.1	F139 P178 V179 F210 N231 M232 T233 W269 Q299 A301	F139-I267 HydrophobicContact CE1-CD1 4.39Å; F139-I267 HydrophobicContact CE1-CG2 3.99Å; F139-I267 HydrophobicContact CZ-CD1 4.35Å; F139-I267 HydrophobicContact CZ-CG2 4.08Å; P178-I267 HydrophobicContact CB-CD1 4.01Å; P178-I267 HydrophobicContact CB-CG1 4.45Å; P178-I267 HydrophobicContact CG-CD1 4.07Å; V179-I267 HydrophobicContact CG1-CD1 4.1Å; F210-I267 HydrophobicContact CZ-CD1 4.43Å; N231-I267 PolarHBondContact O-N 2.9Å; M232-I267 CarbonylContact C-O 3.34Å; M232-I267 VanDerWaalsContact CA-O 3.26Å; M232-I267 WeakPolarHBondContact CA-O 3.13Å; M232-I267 HydrophobicContact CB-CB 4.2Å; M232-I267 HydrophobicContact CG-CB 4.08Å; M232-I267 HydrophobicContact CG-CG2 4.24Å; T233-I267 PolarHBondContact N-O 2.93Å; I267-W269 HydrophobicContact CG2-CB 4.49Å; I267-Q299 CarbonylContact C-O 3.54Å; I267-Q299 WeakPolarHBondContact CA-O 3.41Å; I267-Q299 HydrophobicContact CG1-CB 4.21Å; I267-A301 HydrophobicContact CG2-CB 3.76Å
268	L	98.8	Very high	96.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	107.9	166.9	-170.5	68.9	0	0	0	108.8	F216 T233 F235 L260 L263 I270 F289 V298 Q299 L300 A301	F216-L268 HydrophobicContact CD2-CD1 3.84Å; F216-L268 HydrophobicContact CE2-CD1 3.88Å; T233-L268 HydrophobicContact CG2-CD1 3.88Å; F235-L268 HydrophobicContact CB-CD1 3.61Å; F235-L268 HydrophobicContact CB-CG 4Å; F235-L268 HydrophobicContact CD2-CD1 4.15Å; F235-L268 HydrophobicContact CG-CD1 4.14Å; L260-L268 HydrophobicContact CD2-CD2 3.56Å; L263-L268 HydrophobicContact CD1-CD1 3.95Å; L268-I270 HydrophobicContact CD2-CD1 4Å; L268-I270 HydrophobicContact CD2-CG1 4.26Å; L268-I270 HydrophobicContact CG-CD1 4.17Å; L268-I270 HydrophobicContact CG-CG1 3.97Å; L268-F289 HydrophobicContact CD2-CE2 4.48Å; L268-F289 HydrophobicContact CD2-CZ 3.71Å; L268-V298 HydrophobicContact CB-CG2 3.68Å; L268-Q299 PolarHBondContact N-O 3.09Å; L268-L300 HydrophobicContact CB-CD2 4.28Å; L268-L300 HydrophobicContact CD2-CD2 4.14Å; L268-A301 PolarHBondContact O-N 3.17Å
269	W	98.8	Very high	96.7	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	108.6	-173.3	-165	87	0	0	0	111.2	F139 M232 T233 T234 F235 I267 P271 F274 A301 P303 I306 L329 M330 L333	F139-W269 AromaticContact CD2-NE1 3.94Å; F139-W269 AromaticContact CE1-CD1 3.55Å; F139-W269 AromaticContact CE1-NE1 3.96Å; F139-W269 AromaticContact CE2-CD1 3.84Å; F139-W269 AromaticContact CE2-NE1 3.83Å; F139-W269 AromaticContact CZ-CD1 3.41Å; F139-W269 VanDerWaalsContact CZ-CD1 3.41Å; F139-W269 HydrophobicContact CZ-CG 4.39Å; F139-W269 AromaticContact CZ-NE1 3.84Å; F139-W269 PolarHBondContact O-NE1 3.4Å; M232-W269 HydrophobicContact CE-CB 3.43Å; M232-W269 VanDerWaalsContact CE-CB 3.43Å; M232-W269 HydrophobicContact CE-CD2 3.96Å; M232-W269 HydrophobicContact CE-CG 3.34Å; M232-W269 HydrophobicContact CG-CB 4.48Å; T233-W269 PolarHBondContact O-N 3.38Å; T234-W269 CarbonylContact C-O 3.59Å; T234-W269 VanDerWaalsContact CA-O 3.22Å; T234-W269 WeakPolarHBondContact CA-O 3.4Å; T234-W269 HydrophobicContact CG2-CE3 3.78Å; T234-W269 HydrophobicContact CG2-CZ3 4.43Å; F235-W269 PolarHBondContact N-O 3.5Å; I267-W269 HydrophobicContact CG2-CB 4.49Å; W269-P271 HydrophobicContact CE3-CB 4.33Å; W269-P271 HydrophobicContact CE3-CG 4.17Å; W269-P271 HydrophobicContact CH2-CB 4.39Å; W269-P271 HydrophobicContact CZ3-CB 3.76Å; W269-P271 HydrophobicContact CZ3-CG 3.88Å; W269-P271 WeakPolarHBondContact O-CD 3.27Å; W269-F274 HydrophobicContact CH2-CE2 4.29Å; W269-F274 AromaticContact CH2-CZ 3.94Å; W269-F274 HydrophobicContact CH2-CZ 3.94Å; W269-F274 HydrophobicContact CZ3-CE2 4.34Å; W269-F274 HydrophobicContact CZ3-CZ 4.39Å; W269-A301 CarbonylContact C-O 3.25Å; W269-A301 WeakPolarHBondContact CA-O 3.48Å; W269-A301 HydrophobicContact CG-CB 4.42Å; W269-P303 HydrophobicContact CD2-CG 4Å; W269-P303 HydrophobicContact CE3-CG 4.12Å; W269-P303 HydrophobicContact CH2-CB 3.77Å; W269-P303 HydrophobicContact CH2-CG 3.45Å; W269-P303 VanDerWaalsContact CH2-CG 3.45Å; W269-P303 HydrophobicContact CZ2-CB 3.27Å; W269-P303 HydrophobicContact CZ2-CG 3.31Å; W269-P303 HydrophobicContact CZ3-CG 3.85Å; W269-I306 HydrophobicContact CH2-CD1 4.06Å; W269-I306 HydrophobicContact CZ2-CD1 3.88Å; W269-L329 HydrophobicContact CH2-CD1 4.45Å; W269-L329 HydrophobicContact CH2-CD2 3.78Å; W269-L329 HydrophobicContact CH2-CG 4.38Å; W269-L329 HydrophobicContact CZ3-CD2 3.85Å; W269-M330 HydrophobicContact CE3-CE 4.18Å; W269-M330 HydrophobicContact CZ3-CE 4.19Å; W269-L333 HydrophobicContact CD2-CD1 4.45Å; W269-L333 HydrophobicContact CH2-CD1 4.35Å; W269-L333 HydrophobicContact CZ2-CD1 3.79Å
270	I	98.6	Very high	96.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.			trans	-113	92.7	-162.8	-54.4	159.8	0	0	0	110.7	F235 P237 L268 A272 L285 F289 L300 A301 W302 P303	F235-I270 HydrophobicContact CB-CG1 4.11Å; F235-I270 HydrophobicContact CD1-CG1 4.46Å; F235-I270 HydrophobicContact CD1-CG2 4.46Å; F235-I270 WeakPolarHBondContact O-CA 3.4Å; P237-I270 HydrophobicContact CG-CG2 4.03Å; L268-I270 HydrophobicContact CD2-CD1 4Å; L268-I270 HydrophobicContact CD2-CG1 4.26Å; L268-I270 HydrophobicContact CG-CD1 4.17Å; L268-I270 HydrophobicContact CG-CG1 3.97Å; I270-A272 VanDerWaalsContact C-N 3.27Å; I270-A272 PolarHBondContact O-N 3.24Å; I270-L285 HydrophobicContact CD1-CD2 4.2Å; I270-L285 HydrophobicContact CG2-CD2 3.83Å; I270-F289 HydrophobicContact CD1-CE2 3.97Å; I270-L300 HydrophobicContact CD1-CD2 4.2Å; I270-A301 PolarHBondContact N-O 2.93Å; I270-W302 HydrophobicContact CB-CD2 4.15Å; I270-W302 HydrophobicContact CB-CE3 3.68Å; I270-W302 HydrophobicContact CB-CH2 4.32Å; I270-W302 HydrophobicContact CB-CZ3 3.78Å; I270-W302 HydrophobicContact CD1-CD2 4.2Å; I270-W302 HydrophobicContact CD1-CE3 4.23Å; I270-W302 HydrophobicContact CD1-CH2 3.55Å; I270-W302 HydrophobicContact CD1-CZ2 3.48Å; I270-W302 VanDerWaalsContact CD1-CZ2 3.48Å; I270-W302 HydrophobicContact CD1-CZ3 3.94Å; I270-W302 HydrophobicContact CG1-CZ3 4.47Å; I270-W302 HydrophobicContact CG2-CE3 3.66Å; I270-W302 HydrophobicContact CG2-CH2 3.99Å; I270-W302 HydrophobicContact CG2-CZ3 3.32Å; I270-P303 WeakPolarHBondContact O-CD 3.42Å
271	P	97.8	Very high	96.5	Very high	11 Å²	11	43.4 Å²	43.4	7%	0.071	21%	0.214	C	C	.	.			trans	-76.3	73.9	179.4	31.9	-36.6	0	0	0	112.7	F235 W269 F273 F274 P303	F235-P271 WeakPolarHBondContact O-CD 3.42Å; W269-P271 HydrophobicContact CE3-CB 4.33Å; W269-P271 HydrophobicContact CE3-CG 4.17Å; W269-P271 HydrophobicContact CH2-CB 4.39Å; W269-P271 HydrophobicContact CZ3-CB 3.76Å; W269-P271 HydrophobicContact CZ3-CG 3.88Å; W269-P271 WeakPolarHBondContact O-CD 3.27Å; P271-F273 VanDerWaalsContact C-N 3.31Å; P271-F273 PolarHBondContact O-N 3.49Å; P271-F274 HydrophobicContact CB-CD1 4.16Å; P271-F274 HydrophobicContact CB-CD2 3.5Å; P271-F274 VanDerWaalsContact CB-CD2 3.5Å; P271-F274 HydrophobicContact CB-CE1 4.15Å; P271-F274 HydrophobicContact CB-CE2 3.49Å; P271-F274 VanDerWaalsContact CB-CE2 3.49Å; P271-F274 HydrophobicContact CB-CG 3.84Å; P271-F274 HydrophobicContact CB-CZ 3.83Å; P271-F274 HydrophobicContact CG-CD2 4.21Å; P271-F274 HydrophobicContact CG-CE2 4.28Å; P271-P303 HydrophobicContact CB-CG 3.91Å
272	A	97.6	Very high	96.5	Very high	1 Å²	1	37 Å²	37	1%	0.008	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-27.5	-179	0	0	0	0	0	113.3	F154 P237 I270 T282 W302	F154-A272 WeakPolarHBondContact CE1-O 3.42Å; P237-A272 HydrophobicContact CG-CB 4.46Å; I270-A272 VanDerWaalsContact C-N 3.27Å; I270-A272 PolarHBondContact O-N 3.24Å; A272-T282 HydrophobicContact CB-CG2 3.87Å; A272-W302 HydrophobicContact CB-CE3 4.18Å; A272-W302 HydrophobicContact CB-CZ3 4.27Å
273	F	97.9	Very high	96.5	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	21.6	-173.5	-52.1	-64.2	0	0	0	113.9	L141 M152 F154 D155 Y163 I165 F169 P271 P303	L141-F273 HydrophobicContact CD1-CD2 4.15Å; L141-F273 HydrophobicContact CD1-CE2 3.57Å; L141-F273 HydrophobicContact CD1-CZ 4.45Å; M152-F273 HydrophobicContact CB-CD1 3.59Å; M152-F273 HydrophobicContact CB-CE1 3.61Å; M152-F273 HydrophobicContact CB-CG 4.31Å; M152-F273 HydrophobicContact CB-CZ 4.34Å; M152-F273 HydrophobicContact CE-CD2 4.34Å; M152-F273 HydrophobicContact CE-CE2 4.46Å; M152-F273 HydrophobicContact CG-CD1 4.15Å; M152-F273 HydrophobicContact CG-CE1 3.75Å; M152-F273 HydrophobicContact CG-CZ 4Å; F154-F273 CarbonylContact C-O 3.57Å; F154-F273 WeakPolarHBondContact CA-O 3.17Å; D155-F273 PolarHBondContact N-O 3.02Å; Y163-F273 AromaticContact CD1-CE1 3.76Å; Y163-F273 HydrophobicContact CD1-CE1 3.76Å; Y163-F273 HydrophobicContact CD1-CZ 4.39Å; Y163-F273 HydrophobicContact CE1-CE1 4.42Å; Y163-F273 HydrophobicContact CG-CE1 4.09Å; I165-F273 HydrophobicContact CD1-CE1 4.33Å; I165-F273 HydrophobicContact CD1-CZ 3.8Å; F169-F273 HydrophobicContact CE1-CE2 4.3Å; F169-F273 HydrophobicContact CE1-CZ 4.05Å; F169-F273 HydrophobicContact CE2-CE2 4.39Å; F169-F273 AromaticContact CE2-CZ 3.92Å; F169-F273 HydrophobicContact CE2-CZ 3.92Å; F169-F273 AromaticContact CZ-CE2 3.65Å; F169-F273 HydrophobicContact CZ-CE2 3.65Å; F169-F273 AromaticContact CZ-CZ 3.48Å; F169-F273 HydrophobicContact CZ-CZ 3.48Å; F169-F273 VanDerWaalsContact CZ-CZ 3.48Å; P271-F273 VanDerWaalsContact C-N 3.31Å; P271-F273 PolarHBondContact O-N 3.49Å; F273-P303 WeakPolarHBondContact CD2-O 3.46Å
274	F	96.7	Very high	96.5	Very high	13 Å²	13	37 Å²	37	6%	0.057	19%	0.186	C	C	.	.	S	Bend	trans	-91.1	-40.3	176.1	-72.9	5.5	0	0	0	112.3	D155 Y156 W269 P271 I306 M307 L329	D155-F274 HydrophobicContact CB-CD1 4.43Å; Y156-F274 WeakPolarHBondContact CB-O 3.27Å; Y156-F274 HydrophobicContact CD2-CB 4.09Å; Y156-F274 HydrophobicContact CE2-CB 4.44Å; Y156-F274 HydrophobicContact CE2-CD2 4.39Å; Y156-F274 HydrophobicContact CE2-CG 4.42Å; Y156-F274 PolarHBondContact N-O 3.35Å; W269-F274 HydrophobicContact CH2-CE2 4.29Å; W269-F274 AromaticContact CH2-CZ 3.94Å; W269-F274 HydrophobicContact CH2-CZ 3.94Å; W269-F274 HydrophobicContact CZ3-CE2 4.34Å; W269-F274 HydrophobicContact CZ3-CZ 4.39Å; P271-F274 HydrophobicContact CB-CD1 4.16Å; P271-F274 HydrophobicContact CB-CD2 3.5Å; P271-F274 VanDerWaalsContact CB-CD2 3.5Å; P271-F274 HydrophobicContact CB-CE1 4.15Å; P271-F274 HydrophobicContact CB-CE2 3.49Å; P271-F274 VanDerWaalsContact CB-CE2 3.49Å; P271-F274 HydrophobicContact CB-CG 3.84Å; P271-F274 HydrophobicContact CB-CZ 3.83Å; P271-F274 HydrophobicContact CG-CD2 4.21Å; P271-F274 HydrophobicContact CG-CE2 4.28Å; F274-I306 HydrophobicContact CE1-CG1 4.12Å; F274-I306 HydrophobicContact CZ-CD1 4.39Å; F274-I306 HydrophobicContact CZ-CG1 4.09Å; F274-M307 HydrophobicContact CD1-CG 4.14Å; F274-M307 HydrophobicContact CD2-CG 4.4Å; F274-M307 HydrophobicContact CE1-CG 3.72Å; F274-M307 HydrophobicContact CE1-SD 4.25Å; F274-M307 HydrophobicContact CE2-CG 4Å; F274-M307 HydrophobicContact CE2-SD 3.82Å; F274-M307 HydrophobicContact CG-CG 4.49Å; F274-M307 HydrophobicContact CZ-CG 3.64Å; F274-M307 HydrophobicContact CZ-SD 3.57Å; F274-M307 VanDerWaalsContact CZ-SD 3.57Å; F274-L329 HydrophobicContact CE2-CD2 3.87Å; F274-L329 HydrophobicContact CZ-CD2 4.33Å
275	F	95.1	Very high	96.6	Very high	39 Å²	39	33.5 Å²	33.5	17%	0.171	17%	0.167	C	C	.	.			trans	-132.1	130.9	-177.6	-54.8	-82.5	0	0	0	111.2	F154 Y156 T277 S278 R323	F154-F275 WeakPolarHBondContact CD1-O 3.39Å; F154-F275 WeakPolarHBondContact CE1-O 3.42Å; Y156-F275 HydrophobicContact CD2-CD1 4.48Å; Y156-F275 AromaticContact CD2-CE1 3.71Å; Y156-F275 HydrophobicContact CD2-CE1 3.71Å; Y156-F275 HydrophobicContact CD2-CE2 4.16Å; Y156-F275 AromaticContact CD2-CZ 3.48Å; Y156-F275 HydrophobicContact CD2-CZ 3.48Å; Y156-F275 VanDerWaalsContact CD2-CZ 3.48Å; Y156-F275 HydrophobicContact CE2-CZ 4.17Å; Y156-F275 AromaticContact CG-CE1 3.92Å; Y156-F275 HydrophobicContact CG-CE1 3.92Å; Y156-F275 HydrophobicContact CG-CZ 4.16Å; F275-T277 PolarHBondContact O-N 3.27Å; F275-T277 VanDerWaalsContact O-N 3.12Å; F275-S278 VanDerWaalsContact O-CB 3.28Å; F275-S278 WeakPolarHBondContact O-CB 3.21Å; F275-S278 PolarHBondContact O-N 3.47Å; F275-S278 PolarHBondContact O-OG 2.84Å; F275-R323 VanDerWaalsContact CZ-CD 3.41Å
276	H	95.6	Very high	96.6	Very high	61 Å²	61	26.1 Å²	26.1	28%	0.282	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-59.4	-26	178.7	72.8	-78.8	0	0	0	113.6	F154 S157 Y161 S278 A279	F154-H276 HydrophobicContact CD1-CB 4.49Å; F154-H276 HydrophobicContact CD2-CB 3.8Å; F154-H276 HydrophobicContact CE2-CB 4Å; F154-H276 HydrophobicContact CG-CB 4.06Å; F154-H276 HydrophobicContact CZ-CB 4.42Å; S157-H276 WeakPolarHBondContact CB-ND1 3.27Å; S157-H276 PolarHBondContact OG-N 3.3Å; S157-H276 PolarHBondContact OG-ND1 3.23Å; Y161-H276 HydrophobicContact CD1-CB 3.98Å; Y161-H276 AromaticContact CD1-CD2 3.68Å; Y161-H276 AromaticContact CD1-CG 3.91Å; Y161-H276 HydrophobicContact CD2-CB 3.91Å; Y161-H276 AromaticContact CD2-CG 3.69Å; Y161-H276 AromaticContact CD2-ND1 3.93Å; Y161-H276 AromaticContact CE1-CD2 3.55Å; Y161-H276 AromaticContact CE1-NE2 3.99Å; Y161-H276 AromaticContact CE2-CD2 3.95Å; Y161-H276 AromaticContact CE2-CE1 3.97Å; Y161-H276 AromaticContact CE2-CG 3.94Å; Y161-H276 AromaticContact CE2-ND1 3.96Å; Y161-H276 AromaticContact CE2-NE2 3.98Å; Y161-H276 HydrophobicContact CG-CB 3.54Å; Y161-H276 AromaticContact CG-CD2 3.93Å; Y161-H276 AromaticContact CG-CG 3.68Å; Y161-H276 AromaticContact CZ-CD2 3.69Å; Y161-H276 AromaticContact CZ-NE2 3.7Å; H276-S278 PolarHBondContact O-N 3.25Å; H276-S278 VanDerWaalsContact O-N 3.11Å; H276-A279 VanDerWaalsContact O-CB 3.23Å; H276-A279 WeakPolarHBondContact O-CB 3.31Å; H276-A279 PolarHBondContact O-N 3.26Å
277	T	93.3	Very high	96.6	Very high	91 Å²	91	29.8 Å²	29.8	56%	0.558	16%	0.159	S	C	*	.	G	3₁₀ helix	trans	-62	-16.2	174.7	56.6	0	0	0	0	113.1	F275 A279	F275-T277 PolarHBondContact O-N 3.27Å; F275-T277 VanDerWaalsContact O-N 3.12Å; T277-A279 VanDerWaalsContact C-N 3.33Å
278	S	92.1	Very high	96.6	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.007	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-80.5	-11.3	175.3	-57.7	0	0	0	0	113.3	F275 H276 T280 V281 T282	F275-S278 VanDerWaalsContact O-CB 3.28Å; F275-S278 WeakPolarHBondContact O-CB 3.21Å; F275-S278 PolarHBondContact O-N 3.47Å; F275-S278 PolarHBondContact O-OG 2.84Å; H276-S278 PolarHBondContact O-N 3.25Å; H276-S278 VanDerWaalsContact O-N 3.11Å; S278-T280 PolarHBondContact O-N 3.5Å; S278-V281 PolarHBondContact O-N 2.92Å; S278-T282 VanDerWaalsContact O-CB 3.23Å; S278-T282 WeakPolarHBondContact O-CB 3.35Å; S278-T282 PolarHBondContact O-N 2.75Å; S278-T282 PolarHBondContact O-OG1 2.79Å
279	A	94.3	Very high	96.6	Very high	23 Å²	23	30 Å²	30	19%	0.19	16%	0.159	C	C	.	.	H	α-helix	trans	-60	-49.4	-167.8	0	0	0	0	0	113.7	F154 Y163 H276 T277	F154-A279 HydrophobicContact CZ-CB 3.97Å; Y163-A279 HydrophobicContact CD2-CB 4.23Å; H276-A279 VanDerWaalsContact O-CB 3.23Å; H276-A279 WeakPolarHBondContact O-CB 3.31Å; H276-A279 PolarHBondContact O-N 3.26Å; T277-A279 VanDerWaalsContact C-N 3.33Å
280	T	94.3	Very high	96.6	Very high	102 Å²	102	31.9 Å²	31.9	63%	0.626	17%	0.171	S	C	*	.	H	α-helix	trans	-66.4	-50.2	179.5	30.2	0	0	0	0	111.4	S278 T282 R283 T284	S278-T280 PolarHBondContact O-N 3.5Å; T280-T282 PolarHBondContact O-N 3.01Å; T280-R283 WeakPolarHBondContact O-CB 3.21Å; T280-R283 PolarHBondContact O-N 2.85Å; T280-T284 PolarHBondContact O-N 3.31Å
281	V	95	Very high	96.5	Very high	8 Å²	8	37 Å²	37	5%	0.048	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-30.5	-179	-175.1	0	0	0	0	112.1	P237 L240 S278 R283 T284 L285	P237-V281 HydrophobicContact CB-CB 4.37Å; P237-V281 HydrophobicContact CB-CG1 4.22Å; P237-V281 WeakPolarHBondContact O-CG1 3.27Å; L240-V281 HydrophobicContact CB-CG1 3.65Å; L240-V281 HydrophobicContact CD1-CG1 3.92Å; L240-V281 HydrophobicContact CG-CG1 4.27Å; S278-V281 PolarHBondContact O-N 2.92Å; V281-R283 VanDerWaalsContact C-N 3.29Å; V281-R283 PolarHBondContact O-N 3.24Å; V281-T284 PolarHBondContact O-N 3.33Å; V281-L285 WeakPolarHBondContact O-CB 3.42Å; V281-L285 PolarHBondContact O-N 3.38Å
282	T	96.8	Very high	96.5	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-35.9	173.7	-62	0	0	0	0	111.6	Y163 F169 A272 S278 T280 L285 V286 W302	Y163-T282 HydrophobicContact CE2-CG2 4.05Å; F169-T282 HydrophobicContact CD2-CG2 4.49Å; F169-T282 HydrophobicContact CE2-CG2 4.3Å; A272-T282 HydrophobicContact CB-CG2 3.87Å; S278-T282 VanDerWaalsContact O-CB 3.23Å; S278-T282 WeakPolarHBondContact O-CB 3.35Å; S278-T282 PolarHBondContact O-N 2.75Å; S278-T282 PolarHBondContact O-OG1 2.79Å; T280-T282 PolarHBondContact O-N 3.01Å; T282-L285 PolarHBondContact O-N 3.24Å; T282-V286 HydrophobicContact CG2-CG2 4.32Å; T282-V286 WeakPolarHBondContact O-CB 3.34Å; T282-V286 WeakPolarHBondContact O-CG2 3.29Å; T282-V286 PolarHBondContact O-N 3.38Å; T282-W302 HydrophobicContact CG2-CZ3 4.31Å
283	R	96.6	Very high	96.4	Very high	127 Å²	127	44.5 Å²	44.5	48%	0.479	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-48.6	176	-61.6	-179.4	-177.2	-80.6	-0.2	110.9	Y163 T280 V281 L285 V286 D287	Y163-R283 HydrophobicContact CE2-CG 4.06Å; T280-R283 WeakPolarHBondContact O-CB 3.21Å; T280-R283 PolarHBondContact O-N 2.85Å; V281-R283 VanDerWaalsContact C-N 3.29Å; V281-R283 PolarHBondContact O-N 3.24Å; R283-L285 VanDerWaalsContact C-N 3.28Å; R283-L285 PolarHBondContact O-N 3.04Å; R283-V286 WeakPolarHBondContact O-CB 3.37Å; R283-V286 PolarHBondContact O-N 3.04Å; R283-V286 VanDerWaalsContact O-N 3.15Å; R283-D287 PolarHBondContact O-N 3.12Å
284	T	96.9	Very high	96.3	Very high	50 Å²	50	48.2 Å²	48.2	31%	0.307	26%	0.261	S	S	.	.	H	α-helix	trans	-56.8	-42	175.2	-51.7	0	0	0	0	112.2	L247 T280 V281 F288	L247-T284 HydrophobicContact CB-CG2 4.24Å; L247-T284 HydrophobicContact CD1-CG2 4.27Å; L247-T284 HydrophobicContact CG-CG2 4.48Å; T280-T284 PolarHBondContact O-N 3.31Å; V281-T284 PolarHBondContact O-N 3.33Å; T284-F288 WeakPolarHBondContact O-CB 3.25Å; T284-F288 PolarHBondContact O-N 3.15Å
285	L	97.6	Very high	96.3	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-42.1	178.1	-174.6	64	0	0	0	112.1	F235 L240 F256 I270 V281 T282 R283 F288 F289 W302	F235-L285 HydrophobicContact CD1-CD2 4.12Å; F235-L285 HydrophobicContact CE1-CD1 4.15Å; F235-L285 HydrophobicContact CE1-CD2 3.94Å; L240-L285 HydrophobicContact CD1-CB 3.84Å; L240-L285 HydrophobicContact CD1-CD1 3.8Å; L240-L285 HydrophobicContact CD1-CG 4.36Å; L240-L285 HydrophobicContact CG-CD1 4.36Å; F256-L285 HydrophobicContact CE1-CD1 3.73Å; F256-L285 HydrophobicContact CZ-CD1 3.63Å; I270-L285 HydrophobicContact CD1-CD2 4.2Å; I270-L285 HydrophobicContact CG2-CD2 3.83Å; V281-L285 WeakPolarHBondContact O-CB 3.42Å; V281-L285 PolarHBondContact O-N 3.38Å; T282-L285 PolarHBondContact O-N 3.24Å; R283-L285 VanDerWaalsContact C-N 3.28Å; R283-L285 PolarHBondContact O-N 3.04Å; L285-F288 PolarHBondContact O-N 2.9Å; L285-F289 HydrophobicContact CD1-CD2 4.03Å; L285-F289 HydrophobicContact CD1-CE2 3.38Å; L285-F289 HydrophobicContact CD1-CZ 3.98Å; L285-F289 HydrophobicContact CD2-CE2 4.19Å; L285-F289 HydrophobicContact CG-CD2 3.93Å; L285-F289 HydrophobicContact CG-CE2 3.56Å; L285-F289 WeakPolarHBondContact O-CD2 3.38Å; L285-F289 PolarHBondContact O-N 3.33Å; L285-F289 VanDerWaalsContact O-N 3.13Å; L285-W302 HydrophobicContact CD2-CH2 3.85Å; L285-W302 HydrophobicContact CD2-CZ3 4.24Å; L285-W302 HydrophobicContact CG-CH2 4.19Å
286	V	98.3	Very high	96.4	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.03	28%	0.283	C	S	.	.	H	α-helix	trans	-61.7	-49.3	175.9	166.3	0	0	0	0	110.7	N168 F169 L172 T282 R283 F288 F289 V290 W302	N168-V286 HydrophobicContact CB-CG1 3.62Å; F169-V286 HydrophobicContact CB-CG1 4.42Å; F169-V286 HydrophobicContact CB-CG2 4.29Å; F169-V286 HydrophobicContact CD2-CG2 3.63Å; F169-V286 HydrophobicContact CE2-CG2 4.44Å; F169-V286 HydrophobicContact CG-CG2 4.4Å; L172-V286 HydrophobicContact CD1-CB 4.23Å; L172-V286 HydrophobicContact CD1-CG1 3.98Å; L172-V286 HydrophobicContact CD1-CG2 4.27Å; T282-V286 HydrophobicContact CG2-CG2 4.32Å; T282-V286 WeakPolarHBondContact O-CB 3.34Å; T282-V286 WeakPolarHBondContact O-CG2 3.29Å; T282-V286 PolarHBondContact O-N 3.38Å; R283-V286 WeakPolarHBondContact O-CB 3.37Å; R283-V286 PolarHBondContact O-N 3.04Å; R283-V286 VanDerWaalsContact O-N 3.15Å; V286-F288 VanDerWaalsContact C-N 3.3Å; V286-F288 PolarHBondContact O-N 3.03Å; V286-F289 PolarHBondContact O-N 3.47Å; V286-F289 VanDerWaalsContact O-N 3.16Å; V286-V290 HydrophobicContact CG1-CG2 4.46Å; V286-V290 WeakPolarHBondContact O-CG2 3.39Å; V286-V290 PolarHBondContact O-N 3.31Å; V286-W302 HydrophobicContact CG2-CH2 4.33Å
287	D	98.1	Very high	96.5	Very high	83 Å²	83	55.8 Å²	55.8	44%	0.444	30%	0.296	S	S	.	.	H	α-helix	trans	-60.3	-42.7	-179.4	-66	-23.8	0	0	0	111	R283 F289 V290 E291	R283-D287 PolarHBondContact O-N 3.12Å; D287-F289 PolarHBondContact O-N 3.22Å; D287-V290 PolarHBondContact O-N 3.48Å; D287-E291 WeakPolarHBondContact O-CB 3.37Å; D287-E291 PolarHBondContact O-N 3.09Å
288	F	98.4	Very high	96.7	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-45.4	175.1	178.6	-87.7	0	0	0	112.5	L247 R253 F256 F257 L260 T284 L285 V286 E291 H292 L296	L247-F288 HydrophobicContact CD1-CB 3.89Å; L247-F288 HydrophobicContact CD1-CD2 3.73Å; L247-F288 HydrophobicContact CD1-CE2 4.48Å; L247-F288 HydrophobicContact CD1-CG 3.86Å; R253-F288 HydrophobicContact CB-CE2 4.43Å; F256-F288 AromaticContact CD1-CD1 3.81Å; F256-F288 HydrophobicContact CD1-CD1 3.81Å; F256-F288 HydrophobicContact CD1-CD2 4.28Å; F256-F288 AromaticContact CD1-CE1 3.55Å; F256-F288 HydrophobicContact CD1-CE1 3.55Å; F256-F288 HydrophobicContact CD1-CE2 4.02Å; F256-F288 HydrophobicContact CD1-CG 4.18Å; F256-F288 AromaticContact CD1-CZ 3.65Å; F256-F288 HydrophobicContact CD1-CZ 3.65Å; F256-F288 AromaticContact CE1-CD1 3.66Å; F256-F288 HydrophobicContact CE1-CD1 3.66Å; F256-F288 AromaticContact CE1-CE1 3.7Å; F256-F288 HydrophobicContact CE1-CE1 3.7Å; F256-F288 HydrophobicContact CE1-CG 4.25Å; F256-F288 HydrophobicContact CE1-CZ 4.28Å; F257-F288 HydrophobicContact CB-CZ 4Å; F257-F288 HydrophobicContact CD2-CZ 4.23Å; L260-F288 HydrophobicContact CD1-CD1 4.38Å; L260-F288 HydrophobicContact CD1-CE1 3.58Å; L260-F288 HydrophobicContact CD1-CZ 4.33Å; T284-F288 WeakPolarHBondContact O-CB 3.25Å; T284-F288 PolarHBondContact O-N 3.15Å; L285-F288 PolarHBondContact O-N 2.9Å; V286-F288 VanDerWaalsContact C-N 3.3Å; V286-F288 PolarHBondContact O-N 3.03Å; F288-E291 PolarHBondContact O-N 2.82Å; F288-H292 AromaticContact CD2-CE1 3.68Å; F288-H292 AromaticContact CD2-ND1 3.77Å; F288-H292 AromaticContact CE2-CE1 3.4Å; F288-H292 WeakPolarHBondContact CE2-CE1 3.22Å; F288-H292 AromaticContact CE2-ND1 3.67Å; F288-H292 AromaticContact CZ-CE1 3.86Å; F288-H292 AromaticContact CZ-ND1 3.79Å; F288-H292 PolarHBondContact O-N 3.5Å; F288-H292 VanDerWaalsContact O-N 3.1Å; F288-H292 PolarHBondContact O-ND1 2.86Å; F288-L296 HydrophobicContact CE1-CD1 4.4Å
289	F	98.4	Very high	97	Very high	10 Å²	10	56.4 Å²	56.4	4%	0.044	29%	0.294	C	S	.	.	H	α-helix	trans	-71.3	-33.1	-179.8	-76.6	-55.3	0	0	0	113.3	L172 L260 L268 I270 L285 V286 D287 R293 L296 V298 L300 W302	L172-F289 HydrophobicContact CD1-CB 3.65Å; L172-F289 HydrophobicContact CD1-CD2 4.45Å; L172-F289 HydrophobicContact CD2-CB 3.79Å; L172-F289 HydrophobicContact CG-CB 4.38Å; L260-F289 HydrophobicContact CD1-CE1 3.66Å; L260-F289 HydrophobicContact CD1-CZ 4.09Å; L260-F289 HydrophobicContact CD2-CE1 4.36Å; L260-F289 HydrophobicContact CD2-CZ 4.31Å; L268-F289 HydrophobicContact CD2-CE2 4.48Å; L268-F289 HydrophobicContact CD2-CZ 3.71Å; I270-F289 HydrophobicContact CD1-CE2 3.97Å; L285-F289 HydrophobicContact CD1-CD2 4.03Å; L285-F289 HydrophobicContact CD1-CE2 3.38Å; L285-F289 HydrophobicContact CD1-CZ 3.98Å; L285-F289 HydrophobicContact CD2-CE2 4.19Å; L285-F289 HydrophobicContact CG-CD2 3.93Å; L285-F289 HydrophobicContact CG-CE2 3.56Å; L285-F289 WeakPolarHBondContact O-CD2 3.38Å; L285-F289 PolarHBondContact O-N 3.33Å; L285-F289 VanDerWaalsContact O-N 3.13Å; V286-F289 PolarHBondContact O-N 3.47Å; V286-F289 VanDerWaalsContact O-N 3.16Å; D287-F289 PolarHBondContact O-N 3.22Å; F289-R293 PolarHBondContact O-N 2.95Å; F289-R293 VanDerWaalsContact O-N 3.15Å; F289-L296 HydrophobicContact CE1-CD1 4.4Å; F289-V298 HydrophobicContact CE1-CG1 4.49Å; F289-L300 HydrophobicContact CB-CD1 4.17Å; F289-L300 HydrophobicContact CD1-CD1 4.04Å; F289-L300 HydrophobicContact CD1-CD2 4.22Å; F289-L300 HydrophobicContact CD2-CD1 3.93Å; F289-L300 HydrophobicContact CD2-CD2 4.4Å; F289-L300 HydrophobicContact CE1-CD1 4.42Å; F289-L300 HydrophobicContact CE1-CD2 3.76Å; F289-L300 HydrophobicContact CE2-CD1 4.29Å; F289-L300 HydrophobicContact CE2-CD2 3.94Å; F289-L300 HydrophobicContact CG-CD1 3.8Å; F289-L300 HydrophobicContact CZ-CD2 3.63Å; F289-W302 HydrophobicContact CD2-CZ2 4.21Å; F289-W302 HydrophobicContact CE2-CZ2 4.37Å
290	V	98.3	Very high	97.2	Very high	41 Å²	41	56.6 Å²	56.6	25%	0.248	29%	0.291	C	S	.	.	H	α-helix	trans	-65.5	-45.1	173.7	169.6	0	0	0	0	110.4	N168 L172 V286 D287 H292 R293	N168-V290 HydrophobicContact CB-CG2 3.86Å; L172-V290 HydrophobicContact CD1-CG2 4.25Å; L172-V290 HydrophobicContact CD2-CG2 4.12Å; L172-V290 HydrophobicContact CG-CG2 4.15Å; V286-V290 HydrophobicContact CG1-CG2 4.46Å; V286-V290 WeakPolarHBondContact O-CG2 3.39Å; V286-V290 PolarHBondContact O-N 3.31Å; D287-V290 PolarHBondContact O-N 3.48Å; V290-H292 VanDerWaalsContact C-N 3.31Å; V290-H292 PolarHBondContact O-N 3.47Å; V290-R293 VanDerWaalsContact O-CB 3.29Å; V290-R293 WeakPolarHBondContact O-CB 3.4Å; V290-R293 PolarHBondContact O-N 2.87Å
291	E	98	Very high	97.4	Very high	107 Å²	107	51.7 Å²	51.7	50%	0.5	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-38.5	177.9	-174.7	-174.5	166.7	0	0	112.8	R253 D287 F288	R253-E291 IonicContact CZ-OE1 2.68Å; R253-E291 IonicContact CZ-OE2 3.44Å; R253-E291 IonicContact NH1-OE2 3.34Å; R253-E291 PolarHBondContact NH1-OE2 2.67Å; R253-E291 IonicContact NH2-OE1 2.66Å; R253-E291 PolarHBondContact NH2-OE1 3.44Å; R253-E291 IonicContact NH2-OE2 3.75Å; R253-E291 PolarHBondContact NH2-OE2 3.48Å; D287-E291 WeakPolarHBondContact O-CB 3.37Å; D287-E291 PolarHBondContact O-N 3.09Å; F288-E291 PolarHBondContact O-N 2.82Å
292	H	97.8	Very high	97.6	Very high	24 Å²	24	51.4 Å²	51.4	11%	0.111	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	20.5	-178.7	-60.3	82	0	0	0	113.1	F257 F288 V290 G294 Q295	F257-H292 HydrophobicContact CD2-CB 4.48Å; F257-H292 AromaticContact CD2-CD2 3.46Å; F257-H292 VanDerWaalsContact CD2-CD2 3.46Å; F257-H292 WeakPolarHBondContact CD2-CD2 3.37Å; F257-H292 HydrophobicContact CE2-CB 4.3Å; F257-H292 AromaticContact CE2-CD2 3.59Å; F288-H292 AromaticContact CD2-CE1 3.68Å; F288-H292 AromaticContact CD2-ND1 3.77Å; F288-H292 AromaticContact CE2-CE1 3.4Å; F288-H292 WeakPolarHBondContact CE2-CE1 3.22Å; F288-H292 AromaticContact CE2-ND1 3.67Å; F288-H292 AromaticContact CZ-CE1 3.86Å; F288-H292 AromaticContact CZ-ND1 3.79Å; F288-H292 PolarHBondContact O-N 3.5Å; F288-H292 VanDerWaalsContact O-N 3.1Å; F288-H292 PolarHBondContact O-ND1 2.86Å; V290-H292 VanDerWaalsContact C-N 3.31Å; V290-H292 PolarHBondContact O-N 3.47Å; H292-G294 PolarHBondContact O-N 3.48Å; H292-Q295 HydrophobicContact CB-CB 4.49Å; H292-Q295 WeakPolarHBondContact O-CB 3.29Å; H292-Q295 PolarHBondContact O-N 3.24Å
293	R	95.4	Very high	97.7	Very high	146 Å²	146	51.3 Å²	51.3	55%	0.551	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	130.7	179.8	177.7	178.3	-95.5	-177	-6.5	110.4	S171 F289 V290 Q295	S171-R293 PolarHBondContact O-NH2 3.02Å; S171-R293 PolarHBondContact OG-NH2 3.04Å; F289-R293 PolarHBondContact O-N 2.95Å; F289-R293 VanDerWaalsContact O-N 3.15Å; V290-R293 VanDerWaalsContact O-CB 3.29Å; V290-R293 WeakPolarHBondContact O-CB 3.4Å; V290-R293 PolarHBondContact O-N 2.87Å; R293-Q295 PolarHBondContact O-N 2.92Å
294	G	95.3	Very high	97.7	Very high	79 Å²	79	45.6 Å²	45.6	81%	0.814	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.2	-8.6	-179.1	0	0	0	0	0	115.1	H292	H292-G294 PolarHBondContact O-N 3.48Å
295	Q	97.6	Very high	97.8	Very high	115 Å²	115	45.4 Å²	45.4	54%	0.537	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-21.3	179.4	-54.8	-178.5	27.9	0	0	113.2	F257 H292 R293	F257-Q295 HydrophobicContact CE2-CB 4.05Å; F257-Q295 HydrophobicContact CZ-CB 4.2Å; H292-Q295 HydrophobicContact CB-CB 4.49Å; H292-Q295 WeakPolarHBondContact O-CB 3.29Å; H292-Q295 PolarHBondContact O-N 3.24Å; R293-Q295 PolarHBondContact O-N 2.92Å
296	L	97.3	Very high	97.8	Very high	28 Å²	28	45.6 Å²	45.6	15%	0.147	24%	0.237	C	C	.	.			trans	-113.7	140.2	179.7	-64.9	169.2	0	0	0	110.3	F257 L260 K261 F288 F289 V298	F257-L296 HydrophobicContact CD2-CD1 4.29Å; F257-L296 HydrophobicContact CD2-CD2 4.04Å; F257-L296 HydrophobicContact CD2-CG 4.26Å; F257-L296 HydrophobicContact CE2-CD1 4.33Å; F257-L296 HydrophobicContact CE2-CD2 3.73Å; F257-L296 HydrophobicContact CE2-CG 3.84Å; F257-L296 HydrophobicContact CZ-CD2 3.98Å; F257-L296 HydrophobicContact CZ-CG 4.45Å; L260-L296 HydrophobicContact CB-CD1 3.97Å; L260-L296 HydrophobicContact CB-CD2 4Å; L260-L296 HydrophobicContact CD1-CD1 3.78Å; K261-L296 HydrophobicContact CB-CD2 4.17Å; F288-L296 HydrophobicContact CE1-CD1 4.4Å; F289-L296 HydrophobicContact CE1-CD1 4.4Å; L296-V298 HydrophobicContact CB-CG1 4.08Å
297	K	97.3	Very high	97.8	Very high	129 Å²	129	45.5 Å²	45.5	56%	0.561	24%	0.237	S	C	*	.			trans	-89	-5.8	176.7	-67.8	175.3	178.6	176.8	0	113.6	D264 R265	D264-K297 CarbonylContact O-C 3.59Å; D264-K297 WeakPolarHBondContact O-CB 3.35Å; D264-K297 WeakPolarHBondContact OD1-CD 3.3Å; D264-K297 IonicContact OD1-NZ 3.19Å; R265-K297 HydrophobicContact CG-CB 4.18Å
298	V	97.9	Very high	97.7	Very high	17 Å²	17	46.4 Å²	46.4	10%	0.103	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-62.2	136.1	-176.3	71	0	0	0	0	109.9	L263 D264 A266 L268 F289 L296 L300	L263-V298 HydrophobicContact CB-CG2 4.25Å; L263-V298 HydrophobicContact CD1-CG2 4.08Å; D264-V298 VanDerWaalsContact O-CA 3.26Å; D264-V298 WeakPolarHBondContact O-CA 3.42Å; D264-V298 PolarHBondContact O-N 3.3Å; A266-V298 WeakPolarHBondContact O-CG2 3.22Å; L268-V298 HydrophobicContact CB-CG2 3.68Å; F289-V298 HydrophobicContact CE1-CG1 4.49Å; L296-V298 HydrophobicContact CB-CG1 4.08Å; V298-L300 HydrophobicContact CG1-CD2 4.09Å
299	Q	98.2	Very high	97.7	Very high	89 Å²	89	51 Å²	51	42%	0.416	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.3	178.2	-64.9	179.7	60.1	0	0	109.1	R265 A266 I267 L268	R265-Q299 PolarHBondContact O-NE2 3.02Å; A266-Q299 PolarHBondContact O-N 3.5Å; I267-Q299 CarbonylContact C-O 3.54Å; I267-Q299 WeakPolarHBondContact CA-O 3.41Å; I267-Q299 HydrophobicContact CG1-CB 4.21Å; L268-Q299 PolarHBondContact N-O 3.09Å
300	L	98.5	Very high	97.6	Very high	26 Å²	26	50.5 Å²	50.5	14%	0.136	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	133.9	179.8	-54.8	-178.9	0	0	0	110.5	L172 L268 I270 F289 V298 W302	L172-L300 HydrophobicContact CB-CD1 4.24Å; L172-L300 HydrophobicContact CD2-CD1 4.21Å; L268-L300 HydrophobicContact CB-CD2 4.28Å; L268-L300 HydrophobicContact CD2-CD2 4.14Å; I270-L300 HydrophobicContact CD1-CD2 4.2Å; F289-L300 HydrophobicContact CB-CD1 4.17Å; F289-L300 HydrophobicContact CD1-CD1 4.04Å; F289-L300 HydrophobicContact CD1-CD2 4.22Å; F289-L300 HydrophobicContact CD2-CD1 3.93Å; F289-L300 HydrophobicContact CD2-CD2 4.4Å; F289-L300 HydrophobicContact CE1-CD1 4.42Å; F289-L300 HydrophobicContact CE1-CD2 3.76Å; F289-L300 HydrophobicContact CE2-CD1 4.29Å; F289-L300 HydrophobicContact CE2-CD2 3.94Å; F289-L300 HydrophobicContact CG-CD1 3.8Å; F289-L300 HydrophobicContact CZ-CD2 3.63Å; V298-L300 HydrophobicContact CG1-CD2 4.09Å; L300-W302 HydrophobicContact CD1-CZ2 4.38Å
301	A	98.6	Very high	97.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.4	173.1	0	0	0	0	0	109.5	F139 I267 L268 W269 I270	F139-A301 HydrophobicContact CD1-CB 4.16Å; F139-A301 HydrophobicContact CE1-CB 3.66Å; I267-A301 HydrophobicContact CG2-CB 3.76Å; L268-A301 PolarHBondContact O-N 3.17Å; W269-A301 CarbonylContact C-O 3.25Å; W269-A301 WeakPolarHBondContact CA-O 3.48Å; W269-A301 HydrophobicContact CG-CB 4.42Å; I270-A301 PolarHBondContact N-O 2.93Å
302	W	98.6	Very high	97.5	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	25%	0.245	C	C	.	.			trans	-125.4	88.1	-172.6	-57.9	87.5	0	0	0	108.9	T140 L141 F169 L172 L173 I270 A272 T282 L285 V286 F289 L300	T140-W302 PolarHBondContact OG1-N 3.39Å; L141-W302 WeakPolarHBondContact CB-O 3.31Å; L141-W302 WeakPolarHBondContact CG-O 3.31Å; L141-W302 PolarHBondContact N-O 2.98Å; F169-W302 HydrophobicContact CE2-CD2 4.1Å; F169-W302 AromaticContact CE2-CE3 3.72Å; F169-W302 HydrophobicContact CE2-CE3 3.72Å; F169-W302 HydrophobicContact CE2-CZ3 4Å; F169-W302 HydrophobicContact CZ-CB 4.12Å; F169-W302 HydrophobicContact CZ-CD2 4.08Å; F169-W302 AromaticContact CZ-CE3 3.99Å; F169-W302 HydrophobicContact CZ-CE3 3.99Å; F169-W302 HydrophobicContact CZ-CG 4.17Å; L172-W302 HydrophobicContact CD1-CZ2 4.35Å; L173-W302 HydrophobicContact CD2-CB 3.76Å; L173-W302 HydrophobicContact CD2-CG 3.82Å; I270-W302 HydrophobicContact CB-CD2 4.15Å; I270-W302 HydrophobicContact CB-CE3 3.68Å; I270-W302 HydrophobicContact CB-CH2 4.32Å; I270-W302 HydrophobicContact CB-CZ3 3.78Å; I270-W302 HydrophobicContact CD1-CD2 4.2Å; I270-W302 HydrophobicContact CD1-CE3 4.23Å; I270-W302 HydrophobicContact CD1-CH2 3.55Å; I270-W302 HydrophobicContact CD1-CZ2 3.48Å; I270-W302 VanDerWaalsContact CD1-CZ2 3.48Å; I270-W302 HydrophobicContact CD1-CZ3 3.94Å; I270-W302 HydrophobicContact CG1-CZ3 4.47Å; I270-W302 HydrophobicContact CG2-CE3 3.66Å; I270-W302 HydrophobicContact CG2-CH2 3.99Å; I270-W302 HydrophobicContact CG2-CZ3 3.32Å; A272-W302 HydrophobicContact CB-CE3 4.18Å; A272-W302 HydrophobicContact CB-CZ3 4.27Å; T282-W302 HydrophobicContact CG2-CZ3 4.31Å; L285-W302 HydrophobicContact CD2-CH2 3.85Å; L285-W302 HydrophobicContact CD2-CZ3 4.24Å; L285-W302 HydrophobicContact CG-CH2 4.19Å; V286-W302 HydrophobicContact CG2-CH2 4.33Å; F289-W302 HydrophobicContact CD2-CZ2 4.21Å; F289-W302 HydrophobicContact CE2-CZ2 4.37Å; L300-W302 HydrophobicContact CD1-CZ2 4.38Å
303	P	98.4	Very high	97.6	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.24	C	C	.	.			trans	-59.7	142.2	177.2	30.9	-41.7	0	0	0	111	W269 I270 P271 F273 I306	W269-P303 HydrophobicContact CD2-CG 4Å; W269-P303 HydrophobicContact CE3-CG 4.12Å; W269-P303 HydrophobicContact CH2-CB 3.77Å; W269-P303 HydrophobicContact CH2-CG 3.45Å; W269-P303 VanDerWaalsContact CH2-CG 3.45Å; W269-P303 HydrophobicContact CZ2-CB 3.27Å; W269-P303 HydrophobicContact CZ2-CG 3.31Å; W269-P303 HydrophobicContact CZ3-CG 3.85Å; I270-P303 WeakPolarHBondContact O-CD 3.42Å; P271-P303 HydrophobicContact CB-CG 3.91Å; F273-P303 WeakPolarHBondContact CD2-O 3.46Å; P303-I306 HydrophobicContact CB-CD1 3.92Å; P303-I306 HydrophobicContact CB-CG1 4.48Å
304	G	97.9	Very high	97.7	Very high	6 Å²	6	40.5 Å²	40.5	6%	0.062	21%	0.214	C	C	.	.			trans	-80.8	-150.1	170.8	0	0	0	0	0	112.4	I306	G304-I306 PolarHBondContact O-N 3.44Å; G304-I306 VanDerWaalsContact O-N 3.08Å
305	N	97.6	Very high	97.8	Very high	47 Å²	47	42 Å²	42	25%	0.251	20%	0.198	S	C	.	.	S	Bend	trans	-79.3	84.1	175.5	-63	108.2	0	0	0	111	H153 D155	H153-N305 PolarHBondContact O-ND2 3.41Å; D155-N305 VanDerWaalsContact OD1-CA 3.27Å; D155-N305 WeakPolarHBondContact OD1-CA 3.31Å; D155-N305 WeakPolarHBondContact OD1-CB 3.48Å; D155-N305 PolarHBondContact OD1-ND2 2.88Å
306	I	98	Very high	97.7	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	19%	0.192	C	C	.	.			trans	-108.4	-15.7	-173.4	64	171.8	0	0	0	113.7	I133 N138 D155 W269 F274 P303 G304 Q308 Y309 I310	I133-I306 HydrophobicContact CD1-CB 4.03Å; I133-I306 HydrophobicContact CD1-CG2 4.35Å; N138-I306 HydrophobicContact CB-CG2 4.11Å; D155-I306 PolarHBondContact OD2-N 3.35Å; W269-I306 HydrophobicContact CH2-CD1 4.06Å; W269-I306 HydrophobicContact CZ2-CD1 3.88Å; F274-I306 HydrophobicContact CE1-CG1 4.12Å; F274-I306 HydrophobicContact CZ-CD1 4.39Å; F274-I306 HydrophobicContact CZ-CG1 4.09Å; P303-I306 HydrophobicContact CB-CD1 3.92Å; P303-I306 HydrophobicContact CB-CG1 4.48Å; G304-I306 PolarHBondContact O-N 3.44Å; G304-I306 VanDerWaalsContact O-N 3.08Å; I306-Q308 VanDerWaalsContact C-N 3.26Å; I306-Q308 PolarHBondContact O-N 3.06Å; I306-Y309 PolarHBondContact O-N 3.3Å; I306-I310 HydrophobicContact CB-CD1 4.45Å; I306-I310 HydrophobicContact CD1-CD1 3.83Å; I306-I310 HydrophobicContact CG1-CD1 4.04Å; I306-I310 PolarHBondContact O-N 3.27Å
307	M	97.4	Very high	97.7	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.015	20%	0.198	C	C	.	.	H	α-helix	trans	-68.9	-25.3	-168.8	-66.2	-52	-57.8	0	0	112.8	D155 Y156 F274 Y309 I310 N311 L324 L329	D155-M307 HydrophobicContact CB-CB 4.06Å; D155-M307 HydrophobicContact CB-CG 4.29Å; D155-M307 WeakPolarHBondContact OD2-CB 3.47Å; D155-M307 VanDerWaalsContact OD2-CG 3.29Å; D155-M307 WeakPolarHBondContact OD2-CG 3.49Å; D155-M307 PolarHBondContact OD2-N 3.42Å; Y156-M307 HydrophobicContact CE2-CB 4.35Å; Y156-M307 HydrophobicContact CE2-CG 3.83Å; Y156-M307 WeakPolarHBondContact OH-CE 3.21Å; Y156-M307 WeakPolarHBondContact OH-CG 3.24Å; F274-M307 HydrophobicContact CD1-CG 4.14Å; F274-M307 HydrophobicContact CD2-CG 4.4Å; F274-M307 HydrophobicContact CE1-CG 3.72Å; F274-M307 HydrophobicContact CE1-SD 4.25Å; F274-M307 HydrophobicContact CE2-CG 4Å; F274-M307 HydrophobicContact CE2-SD 3.82Å; F274-M307 HydrophobicContact CG-CG 4.49Å; F274-M307 HydrophobicContact CZ-CG 3.64Å; F274-M307 HydrophobicContact CZ-SD 3.57Å; F274-M307 VanDerWaalsContact CZ-SD 3.57Å; M307-Y309 VanDerWaalsContact C-N 3.32Å; M307-Y309 PolarHBondContact O-N 2.93Å; M307-I310 HydrophobicContact CE-CB 4.32Å; M307-I310 HydrophobicContact CE-CG2 4.06Å; M307-I310 PolarHBondContact O-N 3.43Å; M307-I310 HydrophobicContact SD-CD1 4.11Å; M307-N311 WeakPolarHBondContact O-CB 3.13Å; M307-N311 PolarHBondContact O-N 3.36Å; M307-N311 PolarHBondContact O-ND2 3Å; M307-N311 PolarHBondContact O-OD1 3.35Å; M307-L324 HydrophobicContact CE-CB 4.18Å; M307-L324 HydrophobicContact CE-CD1 4.19Å; M307-L329 HydrophobicContact CE-CD1 4.5Å; M307-L329 HydrophobicContact SD-CD1 4.04Å; M307-L329 HydrophobicContact SD-CD2 4.2Å
308	Q	96.4	Very high	97.6	Very high	101 Å²	101	43.1 Å²	43.1	47%	0.472	21%	0.208	S	C	.	.	H	α-helix	trans	-58.8	-43.7	174.8	66.9	-174.6	13.1	0	0	112.3	I306 N312	I306-Q308 VanDerWaalsContact C-N 3.26Å; I306-Q308 PolarHBondContact O-N 3.06Å; Q308-N312 WeakPolarHBondContact O-CB 3.36Å; Q308-N312 PolarHBondContact O-N 3.03Å; Q308-N312 PolarHBondContact O-ND2 3.15Å; Q308-N312 PolarHBondContact O-OD1 2.82Å
309	Y	97.8	Very high	97.4	Very high	97 Å²	97	42.5 Å²	42.5	38%	0.38	21%	0.205	S	C	.	.	H	α-helix	trans	-70.5	-43.3	-179.3	-54.5	-70.3	0	0	0	111.4	H132 I306 M307 N312 Y313	H132-Y309 WeakPolarHBondContact O-CB 3.34Å; I306-Y309 PolarHBondContact O-N 3.3Å; M307-Y309 VanDerWaalsContact C-N 3.32Å; M307-Y309 PolarHBondContact O-N 2.93Å; Y309-N312 PolarHBondContact O-N 3.42Å; Y309-Y313 PolarHBondContact O-N 2.93Å
310	I	97.9	Very high	97.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-45	178	-65.5	174.2	0	0	0	110.5	I133 I306 M307 N312 Y313 W314 L324 L329 T332	I133-I310 HydrophobicContact CD1-CD1 4.41Å; I133-I310 HydrophobicContact CD1-CG1 4.13Å; I133-I310 HydrophobicContact CG2-CG1 4.39Å; I306-I310 HydrophobicContact CB-CD1 4.45Å; I306-I310 HydrophobicContact CD1-CD1 3.83Å; I306-I310 HydrophobicContact CG1-CD1 4.04Å; I306-I310 PolarHBondContact O-N 3.27Å; M307-I310 HydrophobicContact CE-CB 4.32Å; M307-I310 HydrophobicContact CE-CG2 4.06Å; M307-I310 PolarHBondContact O-N 3.43Å; M307-I310 HydrophobicContact SD-CD1 4.11Å; I310-N312 VanDerWaalsContact C-N 3.28Å; I310-N312 PolarHBondContact O-N 2.94Å; I310-Y313 PolarHBondContact O-N 3.44Å; I310-W314 PolarHBondContact O-N 2.94Å; I310-W314 VanDerWaalsContact O-N 3.12Å; I310-L324 HydrophobicContact CG2-CD1 3.77Å; I310-L329 HydrophobicContact CD1-CD1 3.37Å; I310-T332 HydrophobicContact CG1-CG2 4.47Å; I310-T332 HydrophobicContact CG2-CG2 4.42Å
311	N	97.1	Very high	96.8	Very high	32 Å²	32	41.7 Å²	41.7	17%	0.171	21%	0.21	C	C	.	.	H	α-helix	trans	-59.6	-40.7	175.6	-70.4	-23.3	0	0	0	111	M307 Y313 W314 K315 L324	M307-N311 WeakPolarHBondContact O-CB 3.13Å; M307-N311 PolarHBondContact O-N 3.36Å; M307-N311 PolarHBondContact O-ND2 3Å; M307-N311 PolarHBondContact O-OD1 3.35Å; N311-Y313 PolarHBondContact O-N 3.1Å; N311-W314 PolarHBondContact O-N 2.88Å; N311-K315 WeakPolarHBondContact O-CB 3.49Å; N311-K315 WeakPolarHBondContact O-CG 3.49Å; N311-K315 PolarHBondContact O-N 3.33Å; N311-L324 WeakPolarHBondContact OD1-CD1 3.32Å
312	N	97.6	Very high	96.4	Very high	74 Å²	74	50.5 Å²	50.5	40%	0.396	25%	0.249	S	C	.	.	H	α-helix	trans	-62.4	-42.8	179.7	-71.6	-11.5	0	0	0	111.9	Q308 Y309 I310 K315 T316	Q308-N312 WeakPolarHBondContact O-CB 3.36Å; Q308-N312 PolarHBondContact O-N 3.03Å; Q308-N312 PolarHBondContact O-ND2 3.15Å; Q308-N312 PolarHBondContact O-OD1 2.82Å; Y309-N312 PolarHBondContact O-N 3.42Å; I310-N312 VanDerWaalsContact C-N 3.28Å; I310-N312 PolarHBondContact O-N 2.94Å; N312-K315 PolarHBondContact O-N 3.27Å; N312-K315 PolarHBondContact OD1-NZ 3.1Å; N312-K315 VanDerWaalsContact OD1-NZ 3.17Å; N312-T316 WeakPolarHBondContact O-CG2 3.06Å; N312-T316 PolarHBondContact O-N 3.39Å
313	Y	98.1	Very high	96	Very high	1 Å²	1	53 Å²	53	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-52.5	173.1	171	-101.9	0	0	0	111.9	L125 E128 I129 H132 Y309 I310 N311 K315 T316 K317	L125-Y313 WeakPolarHBondContact CD1-OH 3.33Å; E128-Y313 HydrophobicContact CB-CE2 3.96Å; I129-Y313 HydrophobicContact CB-CE2 4.46Å; I129-Y313 HydrophobicContact CD1-CE1 3.92Å; I129-Y313 HydrophobicContact CG1-CD1 3.88Å; I129-Y313 HydrophobicContact CG1-CD2 3.92Å; I129-Y313 HydrophobicContact CG1-CE1 3.49Å; I129-Y313 VanDerWaalsContact CG1-CE1 3.49Å; I129-Y313 HydrophobicContact CG1-CE2 3.53Å; I129-Y313 HydrophobicContact CG1-CG 4.09Å; H132-Y313 PolarHBondContact CD2-N 3.39Å; H132-Y313 AromaticContact ND1-CD2 3.79Å; Y309-Y313 PolarHBondContact O-N 2.93Å; I310-Y313 PolarHBondContact O-N 3.44Å; N311-Y313 PolarHBondContact O-N 3.1Å; Y313-K315 VanDerWaalsContact C-N 3.29Å; Y313-K315 PolarHBondContact O-N 3.05Å; Y313-T316 WeakPolarHBondContact O-CB 3.3Å; Y313-T316 PolarHBondContact O-N 2.79Å; Y313-T316 PolarHBondContact O-OG1 3.32Å; Y313-K317 WeakPolarHBondContact OH-CE 3.41Å
314	W	97.9	Very high	95.9	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-67.2	-27.4	-176.6	-71.3	109.2	0	0	0	113.7	I310 N311 T316 K317 L319 L324 I328 Y331 T332 L387 M391	I310-W314 PolarHBondContact O-N 2.94Å; I310-W314 VanDerWaalsContact O-N 3.12Å; N311-W314 PolarHBondContact O-N 2.88Å; W314-T316 VanDerWaalsContact C-N 3.25Å; W314-T316 PolarHBondContact O-N 2.96Å; W314-K317 HydrophobicContact CE3-CB 4.37Å; W314-K317 HydrophobicContact CE3-CG 4.39Å; W314-K317 CarbonylContact O-C 3.44Å; W314-K317 WeakPolarHBondContact O-CA 3.41Å; W314-K317 PolarHBondContact O-N 2.96Å; W314-L319 CarbonylContact C-O 3.59Å; W314-L319 VanDerWaalsContact C-O 3.25Å; W314-L319 HydrophobicContact CB-CB 4.38Å; W314-L319 HydrophobicContact CB-CD2 4.31Å; W314-L319 HydrophobicContact CD2-CD2 4.39Å; W314-L319 HydrophobicContact CE3-CD2 4.16Å; W314-L319 HydrophobicContact CG-CD2 4.47Å; W314-L319 PolarHBondContact O-N 3.39Å; W314-L319 VanDerWaalsContact O-N 3.07Å; W314-L324 HydrophobicContact CB-CD1 4.18Å; W314-L324 HydrophobicContact CB-CD2 4.22Å; W314-L324 VanDerWaalsContact CD1-CD1 3.42Å; W314-L324 HydrophobicContact CG-CD1 4.01Å; W314-L324 HydrophobicContact CG-CD2 4.29Å; W314-I328 HydrophobicContact CD2-CD1 3.7Å; W314-I328 HydrophobicContact CD2-CG1 4.2Å; W314-I328 HydrophobicContact CE3-CD1 3.73Å; W314-I328 HydrophobicContact CE3-CG1 4.48Å; W314-I328 HydrophobicContact CG-CD1 4.41Å; W314-I328 HydrophobicContact CH2-CD1 3.84Å; W314-I328 HydrophobicContact CH2-CG1 3.81Å; W314-I328 HydrophobicContact CZ2-CD1 3.82Å; W314-I328 HydrophobicContact CZ2-CG1 3.48Å; W314-I328 VanDerWaalsContact CZ2-CG1 3.48Å; W314-I328 HydrophobicContact CZ3-CD1 3.79Å; W314-I328 HydrophobicContact CZ3-CG1 4.3Å; W314-Y331 AromaticContact CH2-CD1 3.86Å; W314-Y331 HydrophobicContact CH2-CD1 3.86Å; W314-Y331 HydrophobicContact CH2-CE1 4.02Å; W314-Y331 AromaticContact CZ2-CD1 3.9Å; W314-Y331 HydrophobicContact CZ2-CD1 3.9Å; W314-Y331 HydrophobicContact CZ2-CE1 4.38Å; W314-T332 WeakPolarHBondContact CZ2-OG1 3.48Å; W314-T332 PolarHBondContact NE1-OG1 3.3Å; W314-L387 HydrophobicContact CE3-CD2 3.64Å; W314-L387 HydrophobicContact CZ3-CD2 3.59Å; W314-L387 HydrophobicContact CZ3-CG 4.42Å; W314-M391 HydrophobicContact CH2-CE 4.36Å; W314-M391 HydrophobicContact CH2-SD 4.21Å; W314-M391 HydrophobicContact CZ3-SD 4.14Å
315	K	97	Very high	95.8	Very high	110 Å²	110	53.7 Å²	53.7	48%	0.478	26%	0.262	S	S	.	.	H	α-helix	trans	-59.1	-36.1	170	-75.9	169.2	-168.1	168.5	0	112	N311 N312 Y313 K317 Q318 L319	N311-K315 WeakPolarHBondContact O-CB 3.49Å; N311-K315 WeakPolarHBondContact O-CG 3.49Å; N311-K315 PolarHBondContact O-N 3.33Å; N312-K315 PolarHBondContact O-N 3.27Å; N312-K315 PolarHBondContact OD1-NZ 3.1Å; N312-K315 VanDerWaalsContact OD1-NZ 3.17Å; Y313-K315 VanDerWaalsContact C-N 3.29Å; Y313-K315 PolarHBondContact O-N 3.05Å; K315-K317 PolarHBondContact O-N 3.42Å; K315-Q318 PolarHBondContact O-N 3.43Å; K315-L319 PolarHBondContact N-O 2.88Å
316	T	97.1	Very high	95.7	Very high	68 Å²	68	53.4 Å²	53.4	42%	0.417	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-23.1	175.4	74.9	0	0	0	0	112.7	N312 Y313 W314 Q318	N312-T316 WeakPolarHBondContact O-CG2 3.06Å; N312-T316 PolarHBondContact O-N 3.39Å; Y313-T316 WeakPolarHBondContact O-CB 3.3Å; Y313-T316 PolarHBondContact O-N 2.79Å; Y313-T316 PolarHBondContact O-OG1 3.32Å; W314-T316 VanDerWaalsContact C-N 3.25Å; W314-T316 PolarHBondContact O-N 2.96Å; T316-Q318 VanDerWaalsContact C-N 3.31Å; T316-Q318 PolarHBondContact O-NE2 3.46Å
317	K	96.4	Very high	95.7	Very high	58 Å²	58	53.6 Å²	53.6	25%	0.252	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	22.6	175.6	-51.3	-57.2	-179.3	-178.9	0	112.4	E128 Y313 W314 K315 L319 L387	E128-K317 WeakPolarHBondContact OE2-CE 3.09Å; E128-K317 IonicContact OE2-NZ 3.93Å; E128-K317 PolarHBondContact OE2-NZ 2.91Å; Y313-K317 WeakPolarHBondContact OH-CE 3.41Å; W314-K317 HydrophobicContact CE3-CB 4.37Å; W314-K317 HydrophobicContact CE3-CG 4.39Å; W314-K317 CarbonylContact O-C 3.44Å; W314-K317 WeakPolarHBondContact O-CA 3.41Å; W314-K317 PolarHBondContact O-N 2.96Å; K315-K317 PolarHBondContact O-N 3.42Å; K317-L319 PolarHBondContact O-N 3.16Å; K317-L319 VanDerWaalsContact O-N 3.17Å; K317-L387 HydrophobicContact CB-CD1 4.42Å; K317-L387 HydrophobicContact CB-CD2 3.99Å
318	Q	94.9	Very high	95.7	Very high	169 Å²	169	53.5 Å²	53.5	79%	0.79	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	25.9	178.8	-61.1	72.2	39	0	0	113.6	K315 T316	K315-Q318 PolarHBondContact O-N 3.43Å; T316-Q318 VanDerWaalsContact C-N 3.31Å; T316-Q318 PolarHBondContact O-NE2 3.46Å
319	L	94.5	Very high	95.8	Very high	5 Å²	5	49 Å²	49	3%	0.026	24%	0.243	C	C	.	.			trans	-113.2	102.9	176.6	-179.4	67.8	0	0	0	110	W314 K315 K317 P321 L324 I328 A383 E384 L387	W314-L319 CarbonylContact C-O 3.59Å; W314-L319 VanDerWaalsContact C-O 3.25Å; W314-L319 HydrophobicContact CB-CB 4.38Å; W314-L319 HydrophobicContact CB-CD2 4.31Å; W314-L319 HydrophobicContact CD2-CD2 4.39Å; W314-L319 HydrophobicContact CE3-CD2 4.16Å; W314-L319 HydrophobicContact CG-CD2 4.47Å; W314-L319 PolarHBondContact O-N 3.39Å; W314-L319 VanDerWaalsContact O-N 3.07Å; K315-L319 PolarHBondContact N-O 2.88Å; K317-L319 PolarHBondContact O-N 3.16Å; K317-L319 VanDerWaalsContact O-N 3.17Å; L319-P321 VanDerWaalsContact C-CD 3.46Å; L319-L324 HydrophobicContact CD2-CD2 3.66Å; L319-L324 HydrophobicContact CG-CD2 4.03Å; L319-I328 HydrophobicContact CD2-CD1 3.28Å; L319-A383 HydrophobicContact CD1-CB 4.11Å; L319-E384 HydrophobicContact CD1-CG 3.94Å; L319-E384 HydrophobicContact CD2-CG 3.93Å; L319-L387 HydrophobicContact CB-CD2 4.04Å; L319-L387 HydrophobicContact CD2-CD2 3.94Å
320	S	92.9	Very high	95.8	Very high	81 Å²	81	44.3 Å²	44.3	57%	0.566	23%	0.225	S	C	*	.			trans	-130.2	57.9	-176.2	69.9	0	0	0	0	113.6
321	P	91.3	Very high	95.8	Very high	16 Å²	16	44.3 Å²	44.3	10%	0.104	23%	0.225	C	C	.	.			trans	-68.5	162.5	174.1	30.3	-34.6	0	0	0	111	L319 R323 L324 Q380	L319-P321 VanDerWaalsContact C-CD 3.46Å; P321-R323 PolarHBondContact O-N 3.13Å; P321-L324 HydrophobicContact CG-CD2 3.67Å; P321-L324 HydrophobicContact CG-CG 4.12Å; P321-Q380 HydrophobicContact CB-CB 3.98Å; P321-Q380 HydrophobicContact CB-CG 3.85Å
322	K	89.2	Confident	95.9	Very high	185 Å²	185	42.8 Å²	42.8	80%	0.804	22%	0.217	S	C	*	.	S	Bend	trans	-54	-33.8	165.4	-70.8	-176.2	178.6	177.5	0	111.5
323	R	91.7	Very high	95.9	Very high	53 Å²	53	39.4 Å²	39.4	20%	0.2	20%	0.199	C	C	.	.	S	Bend	trans	-153.3	122.2	179.8	174.5	177.5	56.7	146.7	2.7	111.5	Y156 F275 P321 H379	Y156-R323 HydrophobicContact CD1-CB 4.43Å; Y156-R323 HydrophobicContact CD2-CG 4.46Å; Y156-R323 HydrophobicContact CE1-CB 4.09Å; Y156-R323 HydrophobicContact CE1-CG 4.11Å; Y156-R323 HydrophobicContact CE2-CG 4.01Å; F275-R323 VanDerWaalsContact CZ-CD 3.41Å; P321-R323 PolarHBondContact O-N 3.13Å; R323-H379 PolarHBondContact NE-CE1 3.29Å; R323-H379 PolarHBondContact NH2-CD2 3.5Å; R323-H379 PolarHBondContact NH2-CE1 3.38Å; R323-H379 PolarHBondContact NH2-NE2 3.46Å; R323-H379 PolarHBondContact O-ND1 3.31Å
324	L	95.4	Very high	95.9	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.031	20%	0.199	C	C	.	.			trans	-63.8	146.7	168.8	-69.2	172.1	0	0	0	111.1	M307 I310 N311 W314 L319 P321 I328	M307-L324 HydrophobicContact CE-CB 4.18Å; M307-L324 HydrophobicContact CE-CD1 4.19Å; I310-L324 HydrophobicContact CG2-CD1 3.77Å; N311-L324 WeakPolarHBondContact OD1-CD1 3.32Å; W314-L324 HydrophobicContact CB-CD1 4.18Å; W314-L324 HydrophobicContact CB-CD2 4.22Å; W314-L324 VanDerWaalsContact CD1-CD1 3.42Å; W314-L324 HydrophobicContact CG-CD1 4.01Å; W314-L324 HydrophobicContact CG-CD2 4.29Å; L319-L324 HydrophobicContact CD2-CD2 3.66Å; L319-L324 HydrophobicContact CG-CD2 4.03Å; P321-L324 HydrophobicContact CG-CD2 3.67Å; P321-L324 HydrophobicContact CG-CG 4.12Å; L324-I328 HydrophobicContact CB-CG2 3.78Å; L324-I328 HydrophobicContact CD2-CD1 4.44Å; L324-I328 HydrophobicContact CD2-CG2 3.9Å; L324-I328 HydrophobicContact CG-CG2 4.29Å
325	S	95.6	Very high	95.9	Very high	16 Å²	16	39.3 Å²	39.3	11%	0.112	20%	0.198	C	C	.	.			trans	-70.7	160.5	175.4	80.5	0	0	0	0	112.7	G327 I328 L329 E384	S325-G327 PolarHBondContact O-N 3.38Å; S325-G327 PolarHBondContact OG-N 3.49Å; S325-I328 WeakPolarHBondContact O-CG2 3.33Å; S325-I328 PolarHBondContact OG-N 2.97Å; S325-L329 WeakPolarHBondContact O-CB 3.39Å; S325-L329 PolarHBondContact O-N 3.19Å; S325-E384 WeakPolarHBondContact CB-OE2 3.4Å; S325-E384 PolarHBondContact N-OE1 2.85Å; S325-E384 PolarHBondContact OG-OE2 3.05Å
326	T	96.3	Very high	95.9	Very high	40 Å²	40	35.2 Å²	35.2	25%	0.245	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-31.7	168.6	-51.9	0	0	0	0	111.8	C214 T234 L329 M330	C214-T326 HydrophobicContact CB-CG2 4.1Å; T234-T326 HydrophobicContact CG2-CG2 3.88Å; T234-T326 WeakPolarHBondContact OG1-CG2 3.31Å; T326-L329 WeakPolarHBondContact O-CB 3.37Å; T326-L329 PolarHBondContact O-N 3.38Å; T326-M330 HydrophobicContact CG2-CG 4.3Å; T326-M330 VanDerWaalsContact O-CG 3.29Å; T326-M330 WeakPolarHBondContact O-CG 3.48Å; T326-M330 PolarHBondContact O-N 2.93Å
327	G	97.1	Very high	95.9	Very high	9 Å²	9	32.1 Å²	32.1	9%	0.093	17%	0.165	C	C	.	.	H	α-helix	trans	-64.6	-50	-178	0	0	0	0	0	112.3	S325 L329 M330 Y331	S325-G327 PolarHBondContact O-N 3.38Å; S325-G327 PolarHBondContact OG-N 3.49Å; G327-L329 VanDerWaalsContact C-N 3.32Å; G327-L329 PolarHBondContact O-N 3.24Å; G327-M330 PolarHBondContact O-N 3.15Å; G327-Y331 PolarHBondContact O-N 2.93Å
328	I	97.1	Very high	96	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.6	-30.8	178.7	-159	174.1	0	0	0	112.2	W314 L319 L324 S325 Y331 T332 E384	W314-I328 HydrophobicContact CD2-CD1 3.7Å; W314-I328 HydrophobicContact CD2-CG1 4.2Å; W314-I328 HydrophobicContact CE3-CD1 3.73Å; W314-I328 HydrophobicContact CE3-CG1 4.48Å; W314-I328 HydrophobicContact CG-CD1 4.41Å; W314-I328 HydrophobicContact CH2-CD1 3.84Å; W314-I328 HydrophobicContact CH2-CG1 3.81Å; W314-I328 HydrophobicContact CZ2-CD1 3.82Å; W314-I328 HydrophobicContact CZ2-CG1 3.48Å; W314-I328 VanDerWaalsContact CZ2-CG1 3.48Å; W314-I328 HydrophobicContact CZ3-CD1 3.79Å; W314-I328 HydrophobicContact CZ3-CG1 4.3Å; L319-I328 HydrophobicContact CD2-CD1 3.28Å; L324-I328 HydrophobicContact CB-CG2 3.78Å; L324-I328 HydrophobicContact CD2-CD1 4.44Å; L324-I328 HydrophobicContact CD2-CG2 3.9Å; L324-I328 HydrophobicContact CG-CG2 4.29Å; S325-I328 WeakPolarHBondContact O-CG2 3.33Å; S325-I328 PolarHBondContact OG-N 2.97Å; I328-Y331 PolarHBondContact O-N 2.96Å; I328-T332 PolarHBondContact O-N 3.4Å; I328-T332 PolarHBondContact O-OG1 2.8Å; I328-E384 HydrophobicContact CD1-CG 4.38Å
329	L	98.3	Very high	96.2	Very high	6 Å²	6	24.4 Å²	24.4	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-59.9	-47.7	168.1	172.5	61.1	0	0	0	111.1	W269 F274 M307 I310 S325 T326 G327 Y331 T332 L333	W269-L329 HydrophobicContact CH2-CD1 4.45Å; W269-L329 HydrophobicContact CH2-CD2 3.78Å; W269-L329 HydrophobicContact CH2-CG 4.38Å; W269-L329 HydrophobicContact CZ3-CD2 3.85Å; F274-L329 HydrophobicContact CE2-CD2 3.87Å; F274-L329 HydrophobicContact CZ-CD2 4.33Å; M307-L329 HydrophobicContact CE-CD1 4.5Å; M307-L329 HydrophobicContact SD-CD1 4.04Å; M307-L329 HydrophobicContact SD-CD2 4.2Å; I310-L329 HydrophobicContact CD1-CD1 3.37Å; S325-L329 WeakPolarHBondContact O-CB 3.39Å; S325-L329 PolarHBondContact O-N 3.19Å; T326-L329 WeakPolarHBondContact O-CB 3.37Å; T326-L329 PolarHBondContact O-N 3.38Å; G327-L329 VanDerWaalsContact C-N 3.32Å; G327-L329 PolarHBondContact O-N 3.24Å; L329-Y331 VanDerWaalsContact C-N 3.33Å; L329-Y331 PolarHBondContact O-N 3.31Å; L329-T332 WeakPolarHBondContact O-CA 3.47Å; L329-T332 VanDerWaalsContact O-CB 3.3Å; L329-T332 WeakPolarHBondContact O-CB 3.29Å; L329-T332 PolarHBondContact O-N 3.43Å; L329-T332 VanDerWaalsContact O-N 3.1Å; L329-L333 HydrophobicContact CD1-CG 4.41Å; L329-L333 WeakPolarHBondContact O-CG 3.22Å; L329-L333 PolarHBondContact O-N 3.02Å
330	M	98.4	Very high	96.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-36.9	177	-71.3	-55.1	95.9	0	0	112.8	V189 L212 M232 T234 W269 T326 G327 T332 L333 A334	V189-M330 HydrophobicContact CG1-CB 3.63Å; L212-M330 HydrophobicContact CD2-SD 4.29Å; M232-M330 HydrophobicContact CE-CE 4.2Å; M232-M330 HydrophobicContact CE-SD 3.82Å; T234-M330 HydrophobicContact CG2-CE 3.32Å; T234-M330 HydrophobicContact CG2-CG 4.09Å; T234-M330 HydrophobicContact CG2-SD 3.31Å; T234-M330 WeakPolarHBondContact CG2-SD 3.4Å; W269-M330 HydrophobicContact CE3-CE 4.18Å; W269-M330 HydrophobicContact CZ3-CE 4.19Å; T326-M330 HydrophobicContact CG2-CG 4.3Å; T326-M330 VanDerWaalsContact O-CG 3.29Å; T326-M330 WeakPolarHBondContact O-CG 3.48Å; T326-M330 PolarHBondContact O-N 2.93Å; G327-M330 PolarHBondContact O-N 3.15Å; M330-T332 VanDerWaalsContact C-N 3.33Å; M330-L333 HydrophobicContact CE-CD1 3.34Å; M330-L333 HydrophobicContact CE-CG 4.23Å; M330-L333 PolarHBondContact O-N 3.41Å; M330-L333 HydrophobicContact SD-CD1 4.24Å; M330-A334 VanDerWaalsContact O-CB 3.27Å; M330-A334 WeakPolarHBondContact O-CB 3.38Å; M330-A334 PolarHBondContact O-N 2.65Å
331	Y	98.6	Very high	96.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.5	-45.4	170.6	176.4	-93.7	0	0	0	111.5	L125 W314 G327 I328 L329 L333 A334 S335 I341 L343 M391 L397	L125-Y331 HydrophobicContact CD2-CE1 4.1Å; L125-Y331 WeakPolarHBondContact CD2-OH 3.47Å; W314-Y331 AromaticContact CH2-CD1 3.86Å; W314-Y331 HydrophobicContact CH2-CD1 3.86Å; W314-Y331 HydrophobicContact CH2-CE1 4.02Å; W314-Y331 AromaticContact CZ2-CD1 3.9Å; W314-Y331 HydrophobicContact CZ2-CD1 3.9Å; W314-Y331 HydrophobicContact CZ2-CE1 4.38Å; G327-Y331 PolarHBondContact O-N 2.93Å; I328-Y331 PolarHBondContact O-N 2.96Å; L329-Y331 VanDerWaalsContact C-N 3.33Å; L329-Y331 PolarHBondContact O-N 3.31Å; Y331-L333 PolarHBondContact O-N 3.37Å; Y331-A334 PolarHBondContact O-N 2.91Å; Y331-S335 PolarHBondContact O-N 2.85Å; Y331-I341 HydrophobicContact CD2-CB 4.46Å; Y331-I341 HydrophobicContact CD2-CD1 3.94Å; Y331-I341 HydrophobicContact CD2-CG2 3.89Å; Y331-I341 HydrophobicContact CE2-CB 4.15Å; Y331-I341 HydrophobicContact CE2-CD1 3.71Å; Y331-I341 HydrophobicContact CE2-CG2 4.05Å; Y331-L343 HydrophobicContact CD2-CD2 4.14Å; Y331-M391 HydrophobicContact CE1-CE 3.53Å; Y331-M391 WeakPolarHBondContact OH-CE 3.45Å; Y331-L397 HydrophobicContact CD2-CD2 4.06Å; Y331-L397 HydrophobicContact CE2-CB 3.82Å; Y331-L397 HydrophobicContact CE2-CD2 3.51Å; Y331-L397 HydrophobicContact CE2-CG 4.33Å
332	T	98.5	Very high	97	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-58	-49	177.6	-51.2	0	0	0	0	110.5	I129 I135 I310 W314 I328 L329 M330 S335	I129-T332 HydrophobicContact CG2-CG2 4.04Å; I135-T332 HydrophobicContact CD1-CG2 3.9Å; I135-T332 WeakPolarHBondContact CD1-O 3.14Å; I310-T332 HydrophobicContact CG1-CG2 4.47Å; I310-T332 HydrophobicContact CG2-CG2 4.42Å; W314-T332 WeakPolarHBondContact CZ2-OG1 3.48Å; W314-T332 PolarHBondContact NE1-OG1 3.3Å; I328-T332 PolarHBondContact O-N 3.4Å; I328-T332 PolarHBondContact O-OG1 2.8Å; L329-T332 WeakPolarHBondContact O-CA 3.47Å; L329-T332 VanDerWaalsContact O-CB 3.3Å; L329-T332 WeakPolarHBondContact O-CB 3.29Å; L329-T332 PolarHBondContact O-N 3.43Å; L329-T332 VanDerWaalsContact O-N 3.1Å; M330-T332 VanDerWaalsContact C-N 3.33Å; T332-S335 PolarHBondContact O-N 3.28Å; T332-S335 PolarHBondContact O-OG 2.97Å
333	L	98.4	Very high	97.4	Very high	2 Å²	2	12.9 Å²	12.9	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-62.2	-47.2	177.5	-60.2	-176	0	0	0	112.3	I135 F139 M232 W269 L329 M330 Y331 S335 S336	I135-L333 HydrophobicContact CG2-CD2 3.7Å; F139-L333 HydrophobicContact CD2-CD1 4.23Å; F139-L333 HydrophobicContact CD2-CD2 4.35Å; F139-L333 HydrophobicContact CE2-CD1 4Å; M232-L333 HydrophobicContact CE-CD1 3.85Å; W269-L333 HydrophobicContact CD2-CD1 4.45Å; W269-L333 HydrophobicContact CH2-CD1 4.35Å; W269-L333 HydrophobicContact CZ2-CD1 3.79Å; L329-L333 HydrophobicContact CD1-CG 4.41Å; L329-L333 WeakPolarHBondContact O-CG 3.22Å; L329-L333 PolarHBondContact O-N 3.02Å; M330-L333 HydrophobicContact CE-CD1 3.34Å; M330-L333 HydrophobicContact CE-CG 4.23Å; M330-L333 PolarHBondContact O-N 3.41Å; M330-L333 HydrophobicContact SD-CD1 4.24Å; Y331-L333 PolarHBondContact O-N 3.37Å; L333-S335 VanDerWaalsContact C-N 3.25Å; L333-S335 PolarHBondContact O-N 3.33Å; L333-S336 PolarHBondContact O-N 2.98Å; L333-S336 PolarHBondContact O-OG 3.02Å
334	A	98.5	Very high	97.8	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-58.6	-37.1	178.4	0	0	0	0	0	112	V189 L212 M330 Y331 S336 M337 C338 I341	V189-A334 HydrophobicContact CG2-CB 3.95Å; L212-A334 HydrophobicContact CD1-CB 3.99Å; L212-A334 HydrophobicContact CD2-CB 4.11Å; M330-A334 VanDerWaalsContact O-CB 3.27Å; M330-A334 WeakPolarHBondContact O-CB 3.38Å; M330-A334 PolarHBondContact O-N 2.65Å; Y331-A334 PolarHBondContact O-N 2.91Å; A334-S336 PolarHBondContact O-N 3.32Å; A334-S336 VanDerWaalsContact O-N 3.1Å; A334-M337 PolarHBondContact O-N 2.98Å; A334-C338 WeakPolarHBondContact O-CB 3.43Å; A334-C338 PolarHBondContact O-N 2.64Å; A334-C338 PolarHBondContact O-SG 3.43Å; A334-I341 HydrophobicContact CB-CD1 3.72Å; A334-I341 HydrophobicContact CB-CG1 4.23Å
335	S	98	Very high	97.9	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-57.5	-29.5	-179.1	77.6	0	0	0	0	113.6	R126 I129 Y331 T332 L333	R126-S335 WeakPolarHBondContact CD-O 3.27Å; R126-S335 WeakPolarHBondContact CG-O 3.14Å; R126-S335 PolarHBondContact NE-O 3.42Å; I129-S335 VanDerWaalsContact CD1-OG 3.27Å; I129-S335 WeakPolarHBondContact CD1-OG 3.25Å; Y331-S335 PolarHBondContact O-N 2.85Å; T332-S335 PolarHBondContact O-N 3.28Å; T332-S335 PolarHBondContact O-OG 2.97Å; L333-S335 VanDerWaalsContact C-N 3.25Å; L333-S335 PolarHBondContact O-N 3.33Å
336	S	96.5	Very high	97.9	Very high	25 Å²	25	10.5 Å²	10.5	18%	0.175	6%	0.06	C	C	.	.	H	α-helix	trans	-74.2	-27.7	178.5	69.7	0	0	0	0	114	I135 R183 L333 A334	I135-S336 VanDerWaalsContact CG2-OG 3.24Å; I135-S336 WeakPolarHBondContact CG2-OG 3.46Å; R183-S336 PolarHBondContact NH1-O 2.93Å; L333-S336 PolarHBondContact O-N 2.98Å; L333-S336 PolarHBondContact O-OG 3.02Å; A334-S336 PolarHBondContact O-N 3.32Å; A334-S336 VanDerWaalsContact O-N 3.1Å
337	M	96.8	Very high	97.9	Very high	2 Å²	2	8.9 Å²	8.9	1%	0.01	5%	0.05	C	C	.	.	H	α-helix	trans	-120.1	-4.2	-170.2	61.1	-176.3	168.6	0	0	114.1	V179 R183 Y184 F210 L212 M232 A334	V179-M337 HydrophobicContact CB-SD 4.23Å; V179-M337 HydrophobicContact CG1-SD 3.79Å; R183-M337 CarbonylContact C-O 3.56Å; R183-M337 WeakPolarHBondContact CA-O 3.29Å; Y184-M337 HydrophobicContact CD2-CB 4.21Å; Y184-M337 HydrophobicContact CD2-CG 4.2Å; Y184-M337 HydrophobicContact CD2-SD 4.43Å; Y184-M337 HydrophobicContact CE2-CB 4.37Å; Y184-M337 HydrophobicContact CE2-CG 4.38Å; Y184-M337 HydrophobicContact CE2-SD 4.07Å; Y184-M337 PolarHBondContact N-O 3.04Å; F210-M337 HydrophobicContact CD1-CE 4.45Å; F210-M337 HydrophobicContact CE1-CE 3.95Å; L212-M337 HydrophobicContact CD2-CE 3.77Å; M232-M337 HydrophobicContact SD-CE 4.48Å; A334-M337 PolarHBondContact O-N 2.98Å
338	C	98.4	Very high	97.7	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.2	-176.4	-56.3	0	0	0	0	111.7	F122 R126 R183 Y184 C187 A334 I341	F122-C338 VanDerWaalsContact CE1-O 3.3Å; F122-C338 WeakPolarHBondContact CE1-O 3.45Å; R126-C338 PolarHBondContact NH2-O 2.96Å; R183-C338 PolarHBondContact NH2-O 3.28Å; Y184-C338 CarbonylContact O-C 3.54Å; Y184-C338 VanDerWaalsContact O-CA 3.27Å; Y184-C338 WeakPolarHBondContact O-CA 3.38Å; C187-C338 HydrophobicContact CB-CB 3.65Å; C187-C338 WeakPolarHBondContact CB-SG 3.45Å; C187-C338 WeakPolarHBondContact SG-CB 3.42Å; C187-C338 CovalentContact SG-SG 2.01Å; C187-C338 PolarHBondContact SG-SG 3.3Å; A334-C338 WeakPolarHBondContact O-CB 3.43Å; A334-C338 PolarHBondContact O-N 2.64Å; A334-C338 PolarHBondContact O-SG 3.43Å; C338-I341 HydrophobicContact CB-CG1 3.92Å
339	D	98.2	Very high	97.3	Very high	65 Å²	65	10.4 Å²	10.4	35%	0.348	6%	0.055	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	-31.2	172.4	-62.4	-44.2	0	0	0	111.9	H117 F122 R183 Y184 N185	H117-D339 PolarHBondContact NE2-O 3.44Å; F122-D339 WeakPolarHBondContact CD1-O 3.48Å; F122-D339 WeakPolarHBondContact CE1-O 3.47Å; R183-D339 IonicContact CZ-OD1 3.35Å; R183-D339 IonicContact NE-OD1 2.57Å; R183-D339 PolarHBondContact NE-OD1 3.11Å; R183-D339 VanDerWaalsContact NH2-CA 3.35Å; R183-D339 IonicContact NH2-OD1 3.71Å; R183-D339 PolarHBondContact NH2-OD1 2.94Å; Y184-D339 PolarHBondContact O-N 3.03Å; N185-D339 CarbonylContact O-C 3.57Å; N185-D339 WeakPolarHBondContact O-CA 3.44Å; N185-D339 WeakPolarHBondContact O-CB 3.19Å; N185-D339 PolarHBondContact O-N 3.36Å; N185-D339 VanDerWaalsContact O-N 3.15Å
340	Q	98.3	Very high	96.9	Very high	32 Å²	32	11 Å²	11	15%	0.15	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	142.9	176.7	-174.3	178.8	-12.3	0	0	110.9	W115 N185 I186 C187 H342	W115-Q340 HydrophobicContact CH2-CG 4.33Å; W115-Q340 VanDerWaalsContact CZ3-NE2 3.28Å; N185-Q340 PolarHBondContact O-N 3.12Å; I186-Q340 HydrophobicContact CG1-CB 4.44Å; I186-Q340 HydrophobicContact CG2-CB 4.25Å; I186-Q340 HydrophobicContact CG2-CG 4.34Å; C187-Q340 PolarHBondContact N-O 3.06Å; Q340-H342 PolarHBondContact NE2-NE2 3.38Å
341	I	98.8	Very high	96.4	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.3	-178.2	-59.2	170.7	0	0	0	111.5	F122 V189 Y331 A334 C338 L343 L397 K398	F122-I341 HydrophobicContact CE2-CD1 3.94Å; F122-I341 HydrophobicContact CE2-CG1 4.43Å; F122-I341 HydrophobicContact CZ-CD1 3.64Å; F122-I341 HydrophobicContact CZ-CG1 3.92Å; V189-I341 HydrophobicContact CG2-CG2 3.92Å; Y331-I341 HydrophobicContact CD2-CB 4.46Å; Y331-I341 HydrophobicContact CD2-CD1 3.94Å; Y331-I341 HydrophobicContact CD2-CG2 3.89Å; Y331-I341 HydrophobicContact CE2-CB 4.15Å; Y331-I341 HydrophobicContact CE2-CD1 3.71Å; Y331-I341 HydrophobicContact CE2-CG2 4.05Å; A334-I341 HydrophobicContact CB-CD1 3.72Å; A334-I341 HydrophobicContact CB-CG1 4.23Å; C338-I341 HydrophobicContact CB-CG1 3.92Å; I341-L343 HydrophobicContact CG2-CD2 3.81Å; I341-L397 WeakPolarHBondContact O-CA 3.38Å; I341-K398 PolarHBondContact O-N 3.33Å
342	H	98.6	Very high	95.9	Very high	13 Å²	13	15 Å²	15	6%	0.06	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.5	173.6	-66.8	-131	0	0	0	109.5	I186 C187 A188 V189 Y208 Q340 Y344 K398	I186-H342 VanDerWaalsContact CG2-CD2 3.44Å; I186-H342 WeakPolarHBondContact CG2-CD2 3.49Å; I186-H342 WeakPolarHBondContact CG2-NE2 3.14Å; C187-H342 PolarHBondContact O-N 2.86Å; A188-H342 CarbonylContact C-O 3.51Å; A188-H342 WeakPolarHBondContact CA-O 3.5Å; V189-H342 PolarHBondContact N-O 3.31Å; Y208-H342 HydrophobicContact CE1-CB 4.07Å; Y208-H342 AromaticContact CE1-CD2 3.91Å; Y208-H342 AromaticContact CE1-CG 3.71Å; Y208-H342 AromaticContact CE1-ND1 3.81Å; Y208-H342 AromaticContact CZ-CG 3.82Å; Y208-H342 AromaticContact CZ-ND1 3.73Å; Y208-H342 PolarHBondContact OH-ND1 3.47Å; Q340-H342 PolarHBondContact NE2-NE2 3.38Å; H342-Y344 HydrophobicContact CB-CE2 3.87Å; H342-K398 CarbonylContact C-O 3.55Å; H342-K398 WeakPolarHBondContact CA-O 3.46Å; H342-K398 HydrophobicContact CB-CB 4.41Å; H342-K398 WeakPolarHBondContact ND1-CD 3.23Å
343	L	98.7	Very high	95.2	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	135.2	-179.6	-60.3	-167.4	0	0	0	110.5	V189 Y331 I341 F346 L388 L397 K398 L399 S400	V189-L343 HydrophobicContact CB-CD2 3.59Å; V189-L343 HydrophobicContact CG1-CD2 4.31Å; V189-L343 HydrophobicContact CG2-CD2 4.07Å; Y331-L343 HydrophobicContact CD2-CD2 4.14Å; I341-L343 HydrophobicContact CG2-CD2 3.81Å; L343-F346 HydrophobicContact CB-CD2 3.78Å; L343-F346 HydrophobicContact CB-CE2 4.12Å; L343-F346 HydrophobicContact CB-CG 4.33Å; L343-F346 HydrophobicContact CD1-CD1 4.31Å; L343-F346 HydrophobicContact CD1-CD2 4.31Å; L343-F346 HydrophobicContact CD1-CE1 4.39Å; L343-F346 HydrophobicContact CD1-CE2 4.43Å; L343-F346 HydrophobicContact CD1-CG 4.26Å; L343-F346 HydrophobicContact CD1-CZ 4.46Å; L343-F346 HydrophobicContact CD2-CD2 4.39Å; L343-F346 HydrophobicContact CD2-CE2 3.89Å; L343-F346 HydrophobicContact CD2-CZ 4.09Å; L343-F346 HydrophobicContact CG-CD2 4.4Å; L343-F346 HydrophobicContact CG-CE2 4.38Å; L343-L388 HydrophobicContact CD1-CD1 4.11Å; L343-L388 HydrophobicContact CD1-CD2 3.96Å; L343-L388 HydrophobicContact CD1-CG 4.43Å; L343-L397 HydrophobicContact CD1-CD1 3.78Å; L343-L397 HydrophobicContact CD1-CD2 3.83Å; L343-L397 HydrophobicContact CD1-CG 4.36Å; L343-L397 HydrophobicContact CG-CD1 4.06Å; L343-L397 HydrophobicContact CG-CD2 4.49Å; L343-K398 PolarHBondContact N-O 3.19Å; L343-L399 HydrophobicContact CB-CD1 3.8Å; L343-L399 HydrophobicContact CD1-CD1 4.25Å; L343-S400 WeakPolarHBondContact O-CB 3.41Å; L343-S400 PolarHBondContact O-N 3.45Å; L343-S400 PolarHBondContact O-OG 2.93Å
344	Y	98.6	Very high	94.6	Very high	2 Å²	2	19 Å²	19	1%	0.008	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	142.5	176.3	-70.4	-90.1	0	0	0	109.6	V189 I190 G191 C201 Q204 I205 Y208 H342 F346 S400	V189-Y344 PolarHBondContact O-N 2.87Å; I190-Y344 HydrophobicContact CD1-CD2 3.81Å; I190-Y344 HydrophobicContact CD1-CG 4.08Å; G191-Y344 PolarHBondContact N-O 2.93Å; C201-Y344 HydrophobicContact CB-CD1 4.1Å; C201-Y344 HydrophobicContact CB-CE1 3.96Å; Q204-Y344 PolarHBondContact NE2-OH 3.01Å; I205-Y344 HydrophobicContact CD1-CD1 4.27Å; I205-Y344 HydrophobicContact CD1-CG 4.21Å; I205-Y344 HydrophobicContact CG1-CD1 4.44Å; I205-Y344 HydrophobicContact CG1-CD2 4.22Å; I205-Y344 HydrophobicContact CG1-CE1 4.42Å; I205-Y344 HydrophobicContact CG1-CE2 4.19Å; I205-Y344 HydrophobicContact CG1-CG 4.34Å; Y208-Y344 AromaticContact CE2-CE2 3.63Å; Y208-Y344 HydrophobicContact CE2-CE2 3.63Å; Y208-Y344 AromaticContact CZ-CE2 3.97Å; Y208-Y344 PolarHBondContact OH-OH 3.05Å; H342-Y344 HydrophobicContact CB-CE2 3.87Å; Y344-F346 VanDerWaalsContact C-N 3.32Å; Y344-F346 VanDerWaalsContact O-CD2 3.25Å; Y344-F346 WeakPolarHBondContact O-CD2 3.22Å; Y344-F346 PolarHBondContact O-N 3.26Å; Y344-S400 WeakPolarHBondContact CE1-OG 3.45Å
345	G	97.7	Very high	94	Very high	4 Å²	4	22.8 Å²	22.8	4%	0.041	12%	0.124	C	C	.	.	S	Bend	trans	71.1	25.3	178.5	0	0	0	0	0	114.5	G191 N192 S193	G191-G345 CarbonylContact C-O 3.48Å; N192-G345 PolarHBondContact N-O 3Å; S193-G345 WeakPolarHBondContact CB-O 3.43Å; S193-G345 PolarHBondContact N-O 3.44Å; S193-G345 VanDerWaalsContact N-O 3.09Å
346	F	97.3	Very high	93.4	Very high	20 Å²	20	25.4 Å²	25.4	9%	0.088	15%	0.151	C	C	.	.			trans	-101.9	76.9	173.9	-77.9	-103.8	0	0	0	109.7	V189 L343 Y344 F385 L388 L399	V189-F346 HydrophobicContact CB-CE2 4.34Å; V189-F346 HydrophobicContact CG1-CE2 3.92Å; V189-F346 HydrophobicContact CG1-CZ 3.76Å; L343-F346 HydrophobicContact CB-CD2 3.78Å; L343-F346 HydrophobicContact CB-CE2 4.12Å; L343-F346 HydrophobicContact CB-CG 4.33Å; L343-F346 HydrophobicContact CD1-CD1 4.31Å; L343-F346 HydrophobicContact CD1-CD2 4.31Å; L343-F346 HydrophobicContact CD1-CE1 4.39Å; L343-F346 HydrophobicContact CD1-CE2 4.43Å; L343-F346 HydrophobicContact CD1-CG 4.26Å; L343-F346 HydrophobicContact CD1-CZ 4.46Å; L343-F346 HydrophobicContact CD2-CD2 4.39Å; L343-F346 HydrophobicContact CD2-CE2 3.89Å; L343-F346 HydrophobicContact CD2-CZ 4.09Å; L343-F346 HydrophobicContact CG-CD2 4.4Å; L343-F346 HydrophobicContact CG-CE2 4.38Å; Y344-F346 VanDerWaalsContact C-N 3.32Å; Y344-F346 VanDerWaalsContact O-CD2 3.25Å; Y344-F346 WeakPolarHBondContact O-CD2 3.22Å; Y344-F346 PolarHBondContact O-N 3.26Å; F346-F385 WeakPolarHBondContact O-CD2 3.43Å; F346-F385 WeakPolarHBondContact O-CE2 3.39Å; F346-L388 HydrophobicContact CD1-CD1 3.5Å; F346-L388 VanDerWaalsContact CD1-CD1 3.5Å; F346-L388 HydrophobicContact CE1-CD1 3.95Å; F346-L388 HydrophobicContact CG-CD1 4.4Å; F346-L399 HydrophobicContact CB-CD1 3.7Å
347	W	94.6	Very high	92.9	Very high	6 Å²	6	31.4 Å²	31.4	2%	0.023	17%	0.173	C	C	.	.			trans	-146.7	103.9	179	177.2	-102.5	0	0	0	109.8	L101 L105 S193 I195 F349 W351 P353 F385 L401	L101-W347 HydrophobicContact CD2-CH2 4.45Å; L101-W347 HydrophobicContact CD2-CZ3 4.47Å; L105-W347 HydrophobicContact CD1-CH2 3.93Å; L105-W347 HydrophobicContact CD1-CZ3 3.83Å; S193-W347 VanDerWaalsContact CB-O 3.25Å; S193-W347 WeakPolarHBondContact CB-O 3.41Å; S193-W347 WeakPolarHBondContact OG-CB 3.22Å; S193-W347 PolarHBondContact OG-O 2.84Å; I195-W347 HydrophobicContact CB-CB 3.94Å; I195-W347 HydrophobicContact CB-CG 4.23Å; I195-W347 HydrophobicContact CD1-CB 3.78Å; I195-W347 HydrophobicContact CD1-CD2 4.11Å; I195-W347 HydrophobicContact CD1-CG 3.77Å; I195-W347 HydrophobicContact CG1-CB 4.47Å; I195-W347 HydrophobicContact CG2-CB 3.79Å; W347-F349 VanDerWaalsContact C-N 3.27Å; W347-F349 VanDerWaalsContact CD1-O 3.23Å; W347-F349 HydrophobicContact CD2-CB 4.5Å; W347-F349 AromaticContact CD2-CD2 3.68Å; W347-F349 HydrophobicContact CD2-CD2 3.68Å; W347-F349 AromaticContact CE2-CD2 3.56Å; W347-F349 AromaticContact CE3-CD2 3.75Å; W347-F349 HydrophobicContact CE3-CD2 3.75Å; W347-F349 HydrophobicContact CE3-CE2 4.15Å; W347-F349 HydrophobicContact CG-CD2 4.43Å; W347-F349 AromaticContact CH2-CD2 3.59Å; W347-F349 HydrophobicContact CH2-CD2 3.59Å; W347-F349 HydrophobicContact CH2-CE2 4.11Å; W347-F349 HydrophobicContact CH2-CG 4.47Å; W347-F349 HydrophobicContact CZ2-CB 3.86Å; W347-F349 AromaticContact CZ2-CD2 3.54Å; W347-F349 HydrophobicContact CZ2-CD2 3.54Å; W347-F349 HydrophobicContact CZ2-CE2 4.48Å; W347-F349 HydrophobicContact CZ2-CG 4.09Å; W347-F349 AromaticContact CZ3-CD2 3.7Å; W347-F349 HydrophobicContact CZ3-CD2 3.7Å; W347-F349 AromaticContact CZ3-CE2 3.94Å; W347-F349 HydrophobicContact CZ3-CE2 3.94Å; W347-F349 PolarHBondContact NE1-O 3.49Å; W347-F349 VanDerWaalsContact NE1-O 3.16Å; W347-F349 PolarHBondContact O-N 2.94Å; W347-W351 VanDerWaalsContact CE2-O 3.29Å; W347-W351 AromaticContact CH2-CH2 3.67Å; W347-W351 HydrophobicContact CH2-CH2 3.67Å; W347-W351 AromaticContact CH2-CZ2 3.85Å; W347-W351 HydrophobicContact CH2-CZ2 3.85Å; W347-W351 HydrophobicContact CH2-CZ3 4.14Å; W347-W351 HydrophobicContact CZ2-CD2 4.01Å; W347-W351 AromaticContact CZ2-CE2 3.87Å; W347-W351 HydrophobicContact CZ2-CE3 4.02Å; W347-W351 AromaticContact CZ2-CH2 3.76Å; W347-W351 HydrophobicContact CZ2-CH2 3.76Å; W347-W351 AromaticContact CZ2-CZ2 3.74Å; W347-W351 HydrophobicContact CZ2-CZ2 3.74Å; W347-W351 AromaticContact CZ2-CZ3 3.94Å; W347-W351 HydrophobicContact CZ2-CZ3 3.94Å; W347-W351 WeakPolarHBondContact CZ2-O 3.23Å; W347-W351 PolarHBondContact NE1-O 3.41Å; W347-P353 HydrophobicContact CD2-CG 4.44Å; W347-P353 HydrophobicContact CE3-CG 4.44Å; W347-P353 HydrophobicContact CH2-CB 3.68Å; W347-P353 HydrophobicContact CH2-CG 4.16Å; W347-P353 HydrophobicContact CZ2-CB 3.87Å; W347-P353 HydrophobicContact CZ2-CG 4.11Å; W347-P353 HydrophobicContact CZ3-CB 4.14Å; W347-P353 HydrophobicContact CZ3-CG 4.31Å; W347-F385 HydrophobicContact CE3-CD2 4.48Å; W347-F385 HydrophobicContact CE3-CE1 4.31Å; W347-F385 AromaticContact CE3-CE2 3.67Å; W347-F385 HydrophobicContact CE3-CE2 3.67Å; W347-F385 AromaticContact CE3-CZ 3.58Å; W347-F385 HydrophobicContact CE3-CZ 3.58Å; W347-F385 HydrophobicContact CZ3-CE1 4.01Å; W347-F385 HydrophobicContact CZ3-CE2 4.16Å; W347-F385 AromaticContact CZ3-CZ 3.57Å; W347-F385 HydrophobicContact CZ3-CZ 3.57Å; W347-L401 HydrophobicContact CB-CD2 4.45Å; W347-L401 HydrophobicContact CE3-CD2 4.11Å
348	P	92.9	Very high	92.5	Very high	12 Å²	12	39.3 Å²	39.3	8%	0.078	21%	0.211	C	C	.	.			trans	-92	29	-171.1	38.7	-38.7	0	0	0	113.1	F371 Q376 L381 F385	P348-F371 VanDerWaalsContact O-CZ 3.26Å; P348-F371 WeakPolarHBondContact O-CZ 3.28Å; P348-Q376 PolarHBondContact O-NE2 3.43Å; P348-L381 HydrophobicContact CB-CB 3.6Å; P348-L381 HydrophobicContact CB-CD1 4.38Å; P348-L381 HydrophobicContact CG-CB 4.28Å; P348-F385 HydrophobicContact CG-CB 3.8Å; P348-F385 HydrophobicContact CG-CG 4.28Å
349	F	89.9	Confident	92	Very high	28 Å²	28	40.2 Å²	40.2	12%	0.123	22%	0.215	C	C	.	.	S	Bend	trans	-125	149.5	-176.9	-46.8	-77.4	0	0	0	111.7	L101 W347 W351 P382 F385	L101-F349 HydrophobicContact CD2-CE2 3.7Å; L101-F349 HydrophobicContact CD2-CZ 3.84Å; W347-F349 VanDerWaalsContact C-N 3.27Å; W347-F349 VanDerWaalsContact CD1-O 3.23Å; W347-F349 HydrophobicContact CD2-CB 4.5Å; W347-F349 AromaticContact CD2-CD2 3.68Å; W347-F349 HydrophobicContact CD2-CD2 3.68Å; W347-F349 AromaticContact CE2-CD2 3.56Å; W347-F349 AromaticContact CE3-CD2 3.75Å; W347-F349 HydrophobicContact CE3-CD2 3.75Å; W347-F349 HydrophobicContact CE3-CE2 4.15Å; W347-F349 HydrophobicContact CG-CD2 4.43Å; W347-F349 AromaticContact CH2-CD2 3.59Å; W347-F349 HydrophobicContact CH2-CD2 3.59Å; W347-F349 HydrophobicContact CH2-CE2 4.11Å; W347-F349 HydrophobicContact CH2-CG 4.47Å; W347-F349 HydrophobicContact CZ2-CB 3.86Å; W347-F349 AromaticContact CZ2-CD2 3.54Å; W347-F349 HydrophobicContact CZ2-CD2 3.54Å; W347-F349 HydrophobicContact CZ2-CE2 4.48Å; W347-F349 HydrophobicContact CZ2-CG 4.09Å; W347-F349 AromaticContact CZ3-CD2 3.7Å; W347-F349 HydrophobicContact CZ3-CD2 3.7Å; W347-F349 AromaticContact CZ3-CE2 3.94Å; W347-F349 HydrophobicContact CZ3-CE2 3.94Å; W347-F349 PolarHBondContact NE1-O 3.49Å; W347-F349 VanDerWaalsContact NE1-O 3.16Å; W347-F349 PolarHBondContact O-N 2.94Å; F349-W351 PolarHBondContact O-N 2.87Å; F349-P382 HydrophobicContact CE1-CB 4.12Å; F349-P382 HydrophobicContact CE1-CG 4.27Å; F349-P382 HydrophobicContact CZ-CB 4.24Å; F349-F385 AromaticContact CE2-CD1 3.82Å; F349-F385 HydrophobicContact CE2-CD1 3.82Å; F349-F385 HydrophobicContact CE2-CE1 4.12Å; F349-F385 HydrophobicContact CE2-CG 4.21Å; F349-F385 HydrophobicContact CZ-CD1 4.29Å
350	G	89.3	Confident	91.7	Very high	18 Å²	18	38.3 Å²	38.3	19%	0.186	21%	0.206	C	C	.	.	S	Bend	trans	-84.8	21.2	-175.5	0	0	0	0	0	115.6	E358 L359	G350-E358 WeakPolarHBondContact O-CA 3.35Å; G350-L359 PolarHBondContact O-N 2.68Å
351	W	88.6	Confident	91.2	Very high	71 Å²	71	38.6 Å²	38.6	27%	0.269	21%	0.206	S	C	.	.	B	Isolated β-bridge	trans	-142.1	146.2	-179.4	55.4	-86.9	0	0	0	109.8	W347 F349 P353 K357	W347-W351 VanDerWaalsContact CE2-O 3.29Å; W347-W351 AromaticContact CH2-CH2 3.67Å; W347-W351 HydrophobicContact CH2-CH2 3.67Å; W347-W351 AromaticContact CH2-CZ2 3.85Å; W347-W351 HydrophobicContact CH2-CZ2 3.85Å; W347-W351 HydrophobicContact CH2-CZ3 4.14Å; W347-W351 HydrophobicContact CZ2-CD2 4.01Å; W347-W351 AromaticContact CZ2-CE2 3.87Å; W347-W351 HydrophobicContact CZ2-CE3 4.02Å; W347-W351 AromaticContact CZ2-CH2 3.76Å; W347-W351 HydrophobicContact CZ2-CH2 3.76Å; W347-W351 AromaticContact CZ2-CZ2 3.74Å; W347-W351 HydrophobicContact CZ2-CZ2 3.74Å; W347-W351 AromaticContact CZ2-CZ3 3.94Å; W347-W351 HydrophobicContact CZ2-CZ3 3.94Å; W347-W351 WeakPolarHBondContact CZ2-O 3.23Å; W347-W351 PolarHBondContact NE1-O 3.41Å; F349-W351 PolarHBondContact O-N 2.87Å; W351-P353 HydrophobicContact CZ3-CB 4.23Å; W351-K357 CarbonylContact C-O 3.55Å; W351-K357 VanDerWaalsContact CA-O 3.23Å; W351-K357 WeakPolarHBondContact CA-O 3.5Å
352	D	86.9	Confident	91	Very high	13 Å²	13	40.3 Å²	40.3	7%	0.07	21%	0.214	C	C	.	.			trans	-77.7	129	179.6	179.8	-82.5	0	0	0	110.7	N354 T355 G356 K357 L359	D352-N354 PolarHBondContact O-N 3.34Å; D352-N354 WeakPolarHBondContact OD1-CA 3.36Å; D352-N354 WeakPolarHBondContact OD1-CB 3.37Å; D352-N354 PolarHBondContact OD1-N 3.49Å; D352-T355 VanDerWaalsContact CB-OG1 3.31Å; D352-T355 WeakPolarHBondContact CB-OG1 3.25Å; D352-T355 VanDerWaalsContact CG-OG1 3.29Å; D352-T355 PolarHBondContact OD1-N 3.41Å; D352-T355 PolarHBondContact OD1-OG1 2.95Å; D352-G356 VanDerWaalsContact O-CA 3.28Å; D352-G356 WeakPolarHBondContact O-CA 3.4Å; D352-G356 PolarHBondContact O-N 2.88Å; D352-K357 PolarHBondContact N-O 3.22Å; D352-L359 HydrophobicContact CB-CD1 3.88Å; D352-L359 HydrophobicContact CB-CD2 4.23Å; D352-L359 HydrophobicContact CB-CG 3.91Å
353	P	85.2	Confident	90.9	Very high	10 Å²	10	40 Å²	40	7%	0.065	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-21	-174.4	24.8	-31.7	0	0	0	114.6	L109 I195 W347 W351	L109-P353 HydrophobicContact CD1-CB 3.83Å; L109-P353 HydrophobicContact CD1-CG 4.3Å; I195-P353 HydrophobicContact CD1-CG 3.78Å; W347-P353 HydrophobicContact CD2-CG 4.44Å; W347-P353 HydrophobicContact CE3-CG 4.44Å; W347-P353 HydrophobicContact CH2-CB 3.68Å; W347-P353 HydrophobicContact CH2-CG 4.16Å; W347-P353 HydrophobicContact CZ2-CB 3.87Å; W347-P353 HydrophobicContact CZ2-CG 4.11Å; W347-P353 HydrophobicContact CZ3-CB 4.14Å; W347-P353 HydrophobicContact CZ3-CG 4.31Å; W351-P353 HydrophobicContact CZ3-CB 4.23Å
354	N	84.5	Confident	90.7	Very high	78 Å²	78	42.2 Å²	42.2	42%	0.417	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-34.2	-175.9	-50.5	-78.8	0	0	0	111.9	D352 L401	D352-N354 PolarHBondContact O-N 3.34Å; D352-N354 WeakPolarHBondContact OD1-CA 3.36Å; D352-N354 WeakPolarHBondContact OD1-CB 3.37Å; D352-N354 PolarHBondContact OD1-N 3.49Å; N354-L401 PolarHBondContact ND2-O 3.15Å
355	T	85.6	Confident	90.2	Very high	80 Å²	80	44.2 Å²	44.2	49%	0.491	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-14	-172.1	65.4	0	0	0	0	113.8	D352 K357	D352-T355 VanDerWaalsContact CB-OG1 3.31Å; D352-T355 WeakPolarHBondContact CB-OG1 3.25Å; D352-T355 VanDerWaalsContact CG-OG1 3.29Å; D352-T355 PolarHBondContact OD1-N 3.41Å; D352-T355 PolarHBondContact OD1-OG1 2.95Å; T355-K357 PolarHBondContact O-N 3.39Å; T355-K357 VanDerWaalsContact O-N 3.14Å; T355-K357 PolarHBondContact OG1-N 2.96Å
356	G	85.4	Confident	89.6	Confident	55 Å²	55	52.6 Å²	52.6	57%	0.567	27%	0.267	S	S	*	.			trans	68.8	1.3	-174.8	0	0	0	0	0	114.8	D352	D352-G356 VanDerWaalsContact O-CA 3.28Å; D352-G356 WeakPolarHBondContact O-CA 3.4Å; D352-G356 PolarHBondContact O-N 2.88Å
357	K	87.2	Confident	88.7	Confident	150 Å²	150	62.1 Å²	62.1	65%	0.652	31%	0.309	S	S	*	.			trans	-69.7	151.2	-179.7	-69.6	-178.9	179.6	176.6	0	111.3	W351 D352 T355 L359	W351-K357 CarbonylContact C-O 3.55Å; W351-K357 VanDerWaalsContact CA-O 3.23Å; W351-K357 WeakPolarHBondContact CA-O 3.5Å; D352-K357 PolarHBondContact N-O 3.22Å; T355-K357 PolarHBondContact O-N 3.39Å; T355-K357 VanDerWaalsContact O-N 3.14Å; T355-K357 PolarHBondContact OG1-N 2.96Å; K357-L359 PolarHBondContact O-N 2.66Å
358	E	88.4	Confident	87.5	Confident	169 Å²	169	65.4 Å²	65.4	79%	0.79	35%	0.345	S	S	*	.	B	Isolated β-bridge	trans	-60.6	137.3	175.1	-66.2	-171.9	164.5	0	0	111.6	G350	G350-E358 WeakPolarHBondContact O-CA 3.35Å
359	L	88.3	Confident	86.8	Confident	18 Å²	18	67.8 Å²	67.8	9%	0.094	36%	0.359	C	S	.	.			trans	-115.9	141.5	173.5	-72.8	179.7	0	0	0	110.7	I195 G350 D352 K357	I195-L359 HydrophobicContact CB-CD1 4.04Å; I195-L359 HydrophobicContact CG1-CD1 4.33Å; G350-L359 PolarHBondContact O-N 2.68Å; D352-L359 HydrophobicContact CB-CD1 3.88Å; D352-L359 HydrophobicContact CB-CD2 4.23Å; D352-L359 HydrophobicContact CB-CG 3.91Å; K357-L359 PolarHBondContact O-N 2.66Å
360	P	90.6	Very high	86.1	Confident	25 Å²	25	74.2 Å²	74.2	16%	0.162	39%	0.387	C	S	.	.			trans	-65.6	163.7	166.3	30.4	-33.7	0	0	0	110.5	G194 H362 D365	G194-P360 WeakPolarHBondContact CA-O 3.27Å; P360-H362 WeakPolarHBondContact CB-O 3.37Å; P360-H362 WeakPolarHBondContact CG-O 3.4Å; P360-D365 HydrophobicContact CB-CB 3.95Å
361	Y	89	Confident	85.6	Confident	39 Å²	39	75.7 Å²	75.7	15%	0.153	39%	0.389	C	S	.	.	S	Bend	trans	-68.5	-46.8	176.7	-176	-89.4	0	0	0	110.7	S193 G194 D365 F371 T372 L381	S193-Y361 WeakPolarHBondContact CA-O 3.21Å; G194-Y361 PolarHBondContact N-O 2.93Å; G194-Y361 VanDerWaalsContact N-O 3.1Å; Y361-D365 PolarHBondContact N-OD2 3.46Å; Y361-F371 HydrophobicContact CD2-CD2 4.04Å; Y361-F371 HydrophobicContact CD2-CE1 4.14Å; Y361-F371 AromaticContact CD2-CE2 3.42Å; Y361-F371 HydrophobicContact CD2-CE2 3.42Å; Y361-F371 VanDerWaalsContact CD2-CE2 3.42Å; Y361-F371 AromaticContact CD2-CZ 3.46Å; Y361-F371 HydrophobicContact CD2-CZ 3.46Å; Y361-F371 VanDerWaalsContact CD2-CZ 3.46Å; Y361-F371 HydrophobicContact CE2-CE2 4.27Å; Y361-F371 AromaticContact CE2-CZ 3.97Å; Y361-F371 HydrophobicContact CE2-CZ 3.97Å; Y361-F371 HydrophobicContact CG-CD2 4.47Å; Y361-F371 HydrophobicContact CG-CE2 4.15Å; Y361-T372 HydrophobicContact CG-CG2 4.47Å; Y361-L381 VanDerWaalsContact OH-CD1 3.27Å; Y361-L381 WeakPolarHBondContact OH-CD1 3.38Å
362	H	94.3	Very high	84.8	Confident	36 Å²	36	74.5 Å²	74.5	17%	0.167	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-107.8	149.5	172.4	-51.3	112.6	0	0	0	113.4	N192 P360 Y364 D365	N192-H362 CarbonylContact O-C 3.52Å; N192-H362 WeakPolarHBondContact O-CA 3.4Å; P360-H362 WeakPolarHBondContact CB-O 3.37Å; P360-H362 WeakPolarHBondContact CG-O 3.4Å; H362-Y364 HydrophobicContact CB-CD1 4.12Å; H362-Y364 HydrophobicContact CB-CD2 3.78Å; H362-Y364 HydrophobicContact CB-CE1 3.9Å; H362-Y364 HydrophobicContact CB-CE2 3.5Å; H362-Y364 VanDerWaalsContact CB-CE2 3.5Å; H362-Y364 HydrophobicContact CB-CG 4.08Å; H362-Y364 AromaticContact CD2-CZ 3.63Å; H362-Y364 PolarHBondContact CD2-OH 3.33Å; H362-Y364 AromaticContact CG-CE2 3.51Å; H362-Y364 AromaticContact CG-CZ 3.47Å; H362-Y364 VanDerWaalsContact CG-CZ 3.47Å; H362-Y364 AromaticContact ND1-CE2 3.65Å; H362-Y364 AromaticContact ND1-CZ 3.96Å; H362-Y364 PolarHBondContact NE2-OH 3.34Å; H362-Y364 PolarHBondContact O-N 2.92Å; H362-Y364 VanDerWaalsContact O-N 3.15Å; H362-D365 IonicContact CG-OD1 3.84Å; H362-D365 IonicContact CG-OD2 3.22Å; H362-D365 PolarHBondContact N-OD2 2.86Å; H362-D365 IonicContact ND1-OD1 3.83Å; H362-D365 PolarHBondContact ND1-OD1 3.33Å; H362-D365 IonicContact ND1-OD2 3.93Å; H362-D365 WeakPolarHBondContact O-CB 3.27Å; H362-D365 PolarHBondContact O-N 3.49Å; H362-D365 VanDerWaalsContact O-N 3.12Å
363	Y	95.9	Very high	84	Confident	6 Å²	6	77.9 Å²	77.9	2%	0.024	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.7	173.1	70.5	-102.9	0	0	0	113.6	N192 L196 A217 P218 F222 V226	N192-Y363 HydrophobicContact CB-CE1 4.4Å; N192-Y363 WeakPolarHBondContact O-CD1 3.42Å; N192-Y363 PolarHBondContact O-N 3.32Å; L196-Y363 HydrophobicContact CB-CD1 4.43Å; L196-Y363 HydrophobicContact CB-CG 4.4Å; L196-Y363 HydrophobicContact CD1-CD1 3.83Å; L196-Y363 HydrophobicContact CD1-CE1 4.24Å; A217-Y363 HydrophobicContact CB-CE1 4.42Å; A217-Y363 VanDerWaalsContact CB-OH 3.26Å; A217-Y363 WeakPolarHBondContact CB-OH 3.32Å; P218-Y363 VanDerWaalsContact O-CE2 3.26Å; P218-Y363 WeakPolarHBondContact O-CE2 3.32Å; P218-Y363 PolarHBondContact O-OH 3.16Å; F222-Y363 HydrophobicContact CB-CD2 4.01Å; F222-Y363 HydrophobicContact CB-CE2 3.85Å; F222-Y363 AromaticContact CD1-CD2 4Å; F222-Y363 HydrophobicContact CD1-CD2 4Å; F222-Y363 HydrophobicContact CD1-CE2 4.45Å; F222-Y363 AromaticContact CD2-CD2 3.98Å; F222-Y363 HydrophobicContact CD2-CD2 3.98Å; F222-Y363 AromaticContact CD2-CE2 3.65Å; F222-Y363 HydrophobicContact CD2-CE2 3.65Å; F222-Y363 VanDerWaalsContact CE1-O 3.31Å; F222-Y363 WeakPolarHBondContact CE1-O 3.32Å; F222-Y363 HydrophobicContact CE2-CD2 4.49Å; F222-Y363 HydrophobicContact CE2-CE2 4.34Å; F222-Y363 AromaticContact CG-CD2 3.72Å; F222-Y363 HydrophobicContact CG-CD2 3.72Å; F222-Y363 AromaticContact CG-CE2 3.72Å; F222-Y363 HydrophobicContact CG-CE2 3.72Å; V226-Y363 HydrophobicContact CG1-CD1 4.25Å; V226-Y363 HydrophobicContact CG1-CD2 4.05Å; V226-Y363 HydrophobicContact CG1-CE1 4.17Å; V226-Y363 HydrophobicContact CG1-CE2 3.97Å; V226-Y363 HydrophobicContact CG1-CG 4.19Å; V226-Y363 HydrophobicContact CG2-CE2 4.13Å
364	Y	93.8	Very high	83.1	Confident	46 Å²	46	84.4 Å²	84.4	18%	0.18	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	5.4	178.5	52.9	-104.6	0	0	0	114	N192 A217 P218 F222 H362	N192-Y364 HydrophobicContact CB-CE1 3.92Å; N192-Y364 PolarHBondContact ND2-OH 2.96Å; A217-Y364 HydrophobicContact CB-CD1 4.35Å; A217-Y364 HydrophobicContact CB-CE1 3.81Å; P218-Y364 HydrophobicContact CG-CD1 3.86Å; P218-Y364 HydrophobicContact CG-CG 3.75Å; F222-Y364 VanDerWaalsContact CE2-CB 3.4Å; F222-Y364 VanDerWaalsContact CZ-CA 3.42Å; H362-Y364 HydrophobicContact CB-CD1 4.12Å; H362-Y364 HydrophobicContact CB-CD2 3.78Å; H362-Y364 HydrophobicContact CB-CE1 3.9Å; H362-Y364 HydrophobicContact CB-CE2 3.5Å; H362-Y364 VanDerWaalsContact CB-CE2 3.5Å; H362-Y364 HydrophobicContact CB-CG 4.08Å; H362-Y364 AromaticContact CD2-CZ 3.63Å; H362-Y364 PolarHBondContact CD2-OH 3.33Å; H362-Y364 AromaticContact CG-CE2 3.51Å; H362-Y364 AromaticContact CG-CZ 3.47Å; H362-Y364 VanDerWaalsContact CG-CZ 3.47Å; H362-Y364 AromaticContact ND1-CE2 3.65Å; H362-Y364 AromaticContact ND1-CZ 3.96Å; H362-Y364 PolarHBondContact NE2-OH 3.34Å; H362-Y364 PolarHBondContact O-N 2.92Å; H362-Y364 VanDerWaalsContact O-N 3.15Å
365	D	89.2	Confident	82	Confident	45 Å²	45	86.9 Å²	86.9	24%	0.241	44%	0.441	C	S	.	.	S	Bend	trans	-68.5	151.6	169.7	-67.9	-24.9	0	0	0	109.6	P360 Y361 H362 T369	P360-D365 HydrophobicContact CB-CB 3.95Å; Y361-D365 PolarHBondContact N-OD2 3.46Å; H362-D365 IonicContact CG-OD1 3.84Å; H362-D365 IonicContact CG-OD2 3.22Å; H362-D365 PolarHBondContact N-OD2 2.86Å; H362-D365 IonicContact ND1-OD1 3.83Å; H362-D365 PolarHBondContact ND1-OD1 3.33Å; H362-D365 IonicContact ND1-OD2 3.93Å; H362-D365 WeakPolarHBondContact O-CB 3.27Å; H362-D365 PolarHBondContact O-N 3.49Å; H362-D365 VanDerWaalsContact O-N 3.12Å; D365-T369 HydrophobicContact CB-CG2 4.18Å
366	K	85.4	Confident	80.9	Confident	179 Å²	179	85.9 Å²	85.9	78%	0.778	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-61.8	142.7	177.4	-67.2	-176.5	179.8	-178.9	0	109.9	G368 T369	K366-G368 PolarHBondContact O-N 3.02Å; K366-T369 PolarHBondContact N-OG1 2.89Å; K366-T369 VanDerWaalsContact O-CB 3.22Å; K366-T369 WeakPolarHBondContact O-CB 3.32Å; K366-T369 PolarHBondContact O-N 3.34Å; K366-T369 PolarHBondContact O-OG1 2.83Å
367	K	77.1	Confident	79.8	Confident	220 Å²	220	90.7 Å²	90.7	96%	0.957	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	130.7	176.6	-170.2	178	-179.4	-178.2	0	110.5
368	G	70.1	Confident	79.2	Confident	76 Å²	76	86.2 Å²	86.2	78%	0.784	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	0.8	-176.3	0	0	0	0	0	115.1	K366 K370	K366-G368 PolarHBondContact O-N 3.02Å; G368-K370 PolarHBondContact O-N 3.21Å
369	T	77.6	Confident	78.7	Confident	62 Å²	62	79.3 Å²	79.3	38%	0.38	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-63.6	122.6	170.6	-57.8	0	0	0	0	109.4	D365 K366	D365-T369 HydrophobicContact CB-CG2 4.18Å; K366-T369 PolarHBondContact N-OG1 2.89Å; K366-T369 VanDerWaalsContact O-CB 3.22Å; K366-T369 WeakPolarHBondContact O-CB 3.32Å; K366-T369 PolarHBondContact O-N 3.34Å; K366-T369 PolarHBondContact O-OG1 2.83Å
370	K	75.3	Confident	78.7	Confident	162 Å²	162	82.8 Å²	82.8	70%	0.704	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-68.8	140.3	178.4	-67.7	-169	175.5	-171.3	0	110.9	G368 T372	G368-K370 PolarHBondContact O-N 3.21Å; K370-T372 PolarHBondContact O-N 3Å
371	F	79.1	Confident	78.6	Confident	50 Å²	50	82.5 Å²	82.5	22%	0.219	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-58.3	136.9	173.6	-169	-88.8	0	0	0	111	P348 Y361 T373	P348-F371 VanDerWaalsContact O-CZ 3.26Å; P348-F371 WeakPolarHBondContact O-CZ 3.28Å; Y361-F371 HydrophobicContact CD2-CD2 4.04Å; Y361-F371 HydrophobicContact CD2-CE1 4.14Å; Y361-F371 AromaticContact CD2-CE2 3.42Å; Y361-F371 HydrophobicContact CD2-CE2 3.42Å; Y361-F371 VanDerWaalsContact CD2-CE2 3.42Å; Y361-F371 AromaticContact CD2-CZ 3.46Å; Y361-F371 HydrophobicContact CD2-CZ 3.46Å; Y361-F371 VanDerWaalsContact CD2-CZ 3.46Å; Y361-F371 HydrophobicContact CE2-CE2 4.27Å; Y361-F371 AromaticContact CE2-CZ 3.97Å; Y361-F371 HydrophobicContact CE2-CZ 3.97Å; Y361-F371 HydrophobicContact CG-CD2 4.47Å; Y361-F371 HydrophobicContact CG-CE2 4.15Å; F371-T373 HydrophobicContact CD1-CG2 4.35Å; F371-T373 HydrophobicContact CE1-CG2 4.25Å
372	T	72.9	Confident	78.7	Confident	46 Å²	46	83 Å²	83	28%	0.282	42%	0.415	S	S	.	.			trans	-114.9	132.6	-179.5	175.8	0	0	0	0	111	Y361 K370 K374	Y361-T372 HydrophobicContact CG-CG2 4.47Å; K370-T372 PolarHBondContact O-N 3Å; T372-K374 PolarHBondContact OG1-N 3.05Å
373	T	69.2	Low	78.6	Confident	83 Å²	83	83.2 Å²	83.2	51%	0.509	42%	0.423	S	S	.	.			trans	-96.4	-5.5	178.3	54	0	0	0	0	113.4	F371 W375 Q376	F371-T373 HydrophobicContact CD1-CG2 4.35Å; F371-T373 HydrophobicContact CE1-CG2 4.25Å; T373-W375 PolarHBondContact O-N 3.11Å; T373-Q376 VanDerWaalsContact O-CB 3.27Å; T373-Q376 WeakPolarHBondContact O-CB 3.38Å; T373-Q376 PolarHBondContact O-N 3.46Å
374	K	67.3	Low	78.5	Confident	148 Å²	148	83.1 Å²	83.1	64%	0.643	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-54.3	-31.6	-175.8	-68.2	-171.5	177.4	-172.9	0	113.4	T372 Q376 E377	T372-K374 PolarHBondContact OG1-N 3.05Å; K374-Q376 VanDerWaalsContact C-N 3.32Å; K374-Q376 PolarHBondContact O-N 3.5Å; K374-E377 PolarHBondContact O-N 3.37Å
375	W	61.2	Low	78.6	Confident	130 Å²	130	81.3 Å²	81.3	49%	0.492	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-73.4	-23	179.3	-54.4	107.3	0	0	0	113.7	T373 E377 S378 H379	T373-W375 PolarHBondContact O-N 3.11Å; W375-E377 PolarHBondContact O-N 3.05Å; W375-S378 PolarHBondContact O-N 2.97Å; W375-H379 PolarHBondContact O-N 3.48Å
376	Q	61.3	Low	78.8	Confident	59 Å²	59	84.6 Å²	84.6	28%	0.276	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-70.2	-14.8	177.3	-60.8	174.4	-25.9	0	0	112.2	P348 T373 K374 S378 H379	P348-Q376 PolarHBondContact O-NE2 3.43Å; T373-Q376 VanDerWaalsContact O-CB 3.27Å; T373-Q376 WeakPolarHBondContact O-CB 3.38Å; T373-Q376 PolarHBondContact O-N 3.46Å; K374-Q376 VanDerWaalsContact C-N 3.32Å; K374-Q376 PolarHBondContact O-N 3.5Å; Q376-S378 VanDerWaalsContact C-N 3.27Å; Q376-S378 PolarHBondContact O-N 3.27Å; Q376-H379 CarbonylContact C-O 3.37Å; Q376-H379 VanDerWaalsContact CA-O 3.31Å; Q376-H379 WeakPolarHBondContact CA-O 3.35Å
377	E	63.8	Low	79.3	Confident	155 Å²	155	77.4 Å²	77.4	72%	0.724	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-70.2	-28.1	175.8	-63.1	176	-167.8	0	0	112.1	K374 W375	K374-E377 PolarHBondContact O-N 3.37Å; W375-E377 PolarHBondContact O-N 3.05Å
378	S	72.9	Confident	80.3	Confident	57 Å²	57	67 Å²	67	40%	0.399	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-16.9	179.4	-62.4	0	0	0	0	113.5	W375 Q376	W375-S378 PolarHBondContact O-N 2.97Å; Q376-S378 VanDerWaalsContact C-N 3.27Å; Q376-S378 PolarHBondContact O-N 3.27Å
379	H	77.8	Confident	81.5	Confident	23 Å²	23	65.2 Å²	65.2	11%	0.106	32%	0.322	C	S	.	.			trans	-128.5	137.4	-178.2	-64.9	-68.7	0	0	0	110.4	R323 W375 Q376 L381	R323-H379 PolarHBondContact NE-CE1 3.29Å; R323-H379 PolarHBondContact NH2-CD2 3.5Å; R323-H379 PolarHBondContact NH2-CE1 3.38Å; R323-H379 PolarHBondContact NH2-NE2 3.46Å; R323-H379 PolarHBondContact O-ND1 3.31Å; W375-H379 PolarHBondContact O-N 3.48Å; Q376-H379 CarbonylContact C-O 3.37Å; Q376-H379 VanDerWaalsContact CA-O 3.31Å; Q376-H379 WeakPolarHBondContact CA-O 3.35Å; H379-L381 HydrophobicContact CB-CD1 4.48Å; H379-L381 HydrophobicContact CB-CD2 3.73Å; H379-L381 HydrophobicContact CB-CG 3.69Å; H379-L381 PolarHBondContact O-N 3.01Å; H379-L381 VanDerWaalsContact O-N 3.12Å
380	Q	88.1	Confident	82.3	Confident	92 Å²	92	67.7 Å²	67.7	43%	0.43	33%	0.328	S	S	.	.			trans	-89.2	56.3	171.5	-64.4	178.8	-22.9	0	0	110.9	P321 A383 E384	P321-Q380 HydrophobicContact CB-CB 3.98Å; P321-Q380 HydrophobicContact CB-CG 3.85Å; Q380-A383 HydrophobicContact CB-CB 3.94Å; Q380-A383 WeakPolarHBondContact O-CA 3.23Å; Q380-A383 WeakPolarHBondContact O-CB 3.33Å; Q380-A383 PolarHBondContact O-N 3.44Å; Q380-E384 PolarHBondContact O-N 3.44Å
381	L	90	Very high	83.3	Confident	19 Å²	19	60.3 Å²	60.3	10%	0.099	30%	0.296	C	S	.	.	H	α-helix	trans	-56.4	-39	-174.7	-57.3	178	0	0	0	114.1	P348 Y361 H379 A383 E384 F385	P348-L381 HydrophobicContact CB-CB 3.6Å; P348-L381 HydrophobicContact CB-CD1 4.38Å; P348-L381 HydrophobicContact CG-CB 4.28Å; Y361-L381 VanDerWaalsContact OH-CD1 3.27Å; Y361-L381 WeakPolarHBondContact OH-CD1 3.38Å; H379-L381 HydrophobicContact CB-CD1 4.48Å; H379-L381 HydrophobicContact CB-CD2 3.73Å; H379-L381 HydrophobicContact CB-CG 3.69Å; H379-L381 PolarHBondContact O-N 3.01Å; H379-L381 VanDerWaalsContact O-N 3.12Å; L381-A383 VanDerWaalsContact C-N 3.31Å; L381-A383 PolarHBondContact O-N 2.93Å; L381-E384 PolarHBondContact O-N 2.82Å; L381-F385 WeakPolarHBondContact O-CB 3.38Å; L381-F385 PolarHBondContact O-N 3.26Å
382	P	90.6	Very high	84.1	Confident	48 Å²	48	59.2 Å²	59.2	31%	0.312	29%	0.292	S	S	.	.	H	α-helix	trans	-61.8	-37.1	173.2	-25.5	36.8	0	0	0	113.4	F349 F385 K386	F349-P382 HydrophobicContact CE1-CB 4.12Å; F349-P382 HydrophobicContact CE1-CG 4.27Å; F349-P382 HydrophobicContact CZ-CB 4.24Å; P382-F385 PolarHBondContact O-N 3.33Å; P382-K386 PolarHBondContact O-N 3.4Å
383	A	91.3	Very high	85.1	Confident	41 Å²	41	60.9 Å²	60.9	34%	0.339	30%	0.302	S	S	.	.	H	α-helix	trans	-70.3	-41.4	176.6	0	0	0	0	0	111.4	L319 Q380 L381 F385 K386 L387	L319-A383 HydrophobicContact CD1-CB 4.11Å; Q380-A383 HydrophobicContact CB-CB 3.94Å; Q380-A383 WeakPolarHBondContact O-CA 3.23Å; Q380-A383 WeakPolarHBondContact O-CB 3.33Å; Q380-A383 PolarHBondContact O-N 3.44Å; L381-A383 VanDerWaalsContact C-N 3.31Å; L381-A383 PolarHBondContact O-N 2.93Å; A383-F385 VanDerWaalsContact C-N 3.32Å; A383-F385 PolarHBondContact O-N 3.28Å; A383-K386 PolarHBondContact O-N 3.3Å; A383-L387 PolarHBondContact O-N 3.29Å
384	E	95.6	Very high	86.3	Confident	5 Å²	5	61 Å²	61	2%	0.023	30%	0.297	C	S	.	.	H	α-helix	trans	-57.6	-46.7	171.6	-66.5	-173.7	-161.4	0	0	110.9	L319 S325 I328 Q380 L381 K386 L387 L388	L319-E384 HydrophobicContact CD1-CG 3.94Å; L319-E384 HydrophobicContact CD2-CG 3.93Å; S325-E384 WeakPolarHBondContact CB-OE2 3.4Å; S325-E384 PolarHBondContact N-OE1 2.85Å; S325-E384 PolarHBondContact OG-OE2 3.05Å; I328-E384 HydrophobicContact CD1-CG 4.38Å; Q380-E384 PolarHBondContact O-N 3.44Å; L381-E384 PolarHBondContact O-N 2.82Å; E384-K386 PolarHBondContact O-N 2.94Å; E384-L387 PolarHBondContact O-N 3.27Å; E384-L388 VanDerWaalsContact O-CG 3.29Å; E384-L388 WeakPolarHBondContact O-CG 3.35Å; E384-L388 PolarHBondContact O-N 3.33Å
385	F	95.3	Very high	87.6	Confident	7 Å²	7	54.1 Å²	54.1	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-45.6	177.2	177.1	-92.1	0	0	0	112.2	L101 L105 F346 W347 P348 F349 L381 P382 A383 L387 L388 Y389 L399 L401	L101-F385 HydrophobicContact CD2-CD1 4.35Å; L101-F385 HydrophobicContact CD2-CE1 3.91Å; L105-F385 HydrophobicContact CD2-CZ 4.32Å; F346-F385 WeakPolarHBondContact O-CD2 3.43Å; F346-F385 WeakPolarHBondContact O-CE2 3.39Å; W347-F385 HydrophobicContact CE3-CD2 4.48Å; W347-F385 HydrophobicContact CE3-CE1 4.31Å; W347-F385 AromaticContact CE3-CE2 3.67Å; W347-F385 HydrophobicContact CE3-CE2 3.67Å; W347-F385 AromaticContact CE3-CZ 3.58Å; W347-F385 HydrophobicContact CE3-CZ 3.58Å; W347-F385 HydrophobicContact CZ3-CE1 4.01Å; W347-F385 HydrophobicContact CZ3-CE2 4.16Å; W347-F385 AromaticContact CZ3-CZ 3.57Å; W347-F385 HydrophobicContact CZ3-CZ 3.57Å; P348-F385 HydrophobicContact CG-CB 3.8Å; P348-F385 HydrophobicContact CG-CG 4.28Å; F349-F385 AromaticContact CE2-CD1 3.82Å; F349-F385 HydrophobicContact CE2-CD1 3.82Å; F349-F385 HydrophobicContact CE2-CE1 4.12Å; F349-F385 HydrophobicContact CE2-CG 4.21Å; F349-F385 HydrophobicContact CZ-CD1 4.29Å; L381-F385 WeakPolarHBondContact O-CB 3.38Å; L381-F385 PolarHBondContact O-N 3.26Å; P382-F385 PolarHBondContact O-N 3.33Å; A383-F385 VanDerWaalsContact C-N 3.32Å; A383-F385 PolarHBondContact O-N 3.28Å; F385-L387 VanDerWaalsContact C-N 3.26Å; F385-L387 PolarHBondContact O-N 3.43Å; F385-L388 PolarHBondContact O-N 3.46Å; F385-Y389 HydrophobicContact CZ-CD2 4.39Å; F385-Y389 WeakPolarHBondContact O-CB 3.26Å; F385-Y389 PolarHBondContact O-N 2.64Å; F385-L399 HydrophobicContact CD2-CD2 4.43Å; F385-L399 HydrophobicContact CE2-CD2 3.8Å; F385-L399 HydrophobicContact CZ-CD2 4.23Å; F385-L401 HydrophobicContact CE2-CD1 4.23Å; F385-L401 HydrophobicContact CE2-CD2 4.02Å; F385-L401 HydrophobicContact CZ-CD1 3.94Å; F385-L401 HydrophobicContact CZ-CD2 4.47Å
386	K	93.7	Very high	89.4	Confident	115 Å²	115	48.5 Å²	48.5	50%	0.5	25%	0.247	S	C	.	.	H	α-helix	trans	-56.7	-42.6	177.1	-175.3	177	-179.9	176.6	0	111.2	P382 A383 E384 K390	P382-K386 PolarHBondContact O-N 3.4Å; A383-K386 PolarHBondContact O-N 3.3Å; E384-K386 PolarHBondContact O-N 2.94Å; K386-K390 PolarHBondContact O-N 3.08Å
387	L	96.1	Very high	91.1	Very high	27 Å²	27	45.7 Å²	45.7	14%	0.141	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-47.3	176.1	-178.4	59.6	0	0	0	111.9	W314 K317 L319 A383 E384 F385 Y389 K390 M391	W314-L387 HydrophobicContact CE3-CD2 3.64Å; W314-L387 HydrophobicContact CZ3-CD2 3.59Å; W314-L387 HydrophobicContact CZ3-CG 4.42Å; K317-L387 HydrophobicContact CB-CD1 4.42Å; K317-L387 HydrophobicContact CB-CD2 3.99Å; L319-L387 HydrophobicContact CB-CD2 4.04Å; L319-L387 HydrophobicContact CD2-CD2 3.94Å; A383-L387 PolarHBondContact O-N 3.29Å; E384-L387 PolarHBondContact O-N 3.27Å; F385-L387 VanDerWaalsContact C-N 3.26Å; F385-L387 PolarHBondContact O-N 3.43Å; L387-Y389 VanDerWaalsContact C-N 3.26Å; L387-Y389 PolarHBondContact O-N 3.08Å; L387-K390 WeakPolarHBondContact O-CB 3.22Å; L387-K390 PolarHBondContact O-N 3.5Å; L387-M391 HydrophobicContact CG-SD 4.19Å; L387-M391 VanDerWaalsContact O-CG 3.27Å; L387-M391 WeakPolarHBondContact O-CG 3.31Å; L387-M391 PolarHBondContact O-N 3.14Å
388	L	97.1	Very high	92.7	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-35	177.7	-67.5	173.1	0	0	0	112.2	L343 F346 E384 F385 M391 H392 L397	L343-L388 HydrophobicContact CD1-CD1 4.11Å; L343-L388 HydrophobicContact CD1-CD2 3.96Å; L343-L388 HydrophobicContact CD1-CG 4.43Å; F346-L388 HydrophobicContact CD1-CD1 3.5Å; F346-L388 VanDerWaalsContact CD1-CD1 3.5Å; F346-L388 HydrophobicContact CE1-CD1 3.95Å; F346-L388 HydrophobicContact CG-CD1 4.4Å; E384-L388 VanDerWaalsContact O-CG 3.29Å; E384-L388 WeakPolarHBondContact O-CG 3.35Å; E384-L388 PolarHBondContact O-N 3.33Å; F385-L388 PolarHBondContact O-N 3.46Å; L388-M391 HydrophobicContact CD2-SD 4.28Å; L388-M391 PolarHBondContact O-N 3.45Å; L388-H392 PolarHBondContact O-N 3.31Å; L388-L397 HydrophobicContact CD2-CD2 3.73Å
389	Y	95.1	Very high	93.8	Very high	38 Å²	38	38.6 Å²	38.6	15%	0.149	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-43.7	174.2	-173.5	-95.2	0	0	0	111.7	L105 D108 F385 L387 M391 H392 T393 L399	L105-Y389 HydrophobicContact CD2-CD2 3.9Å; L105-Y389 HydrophobicContact CD2-CE2 3.4Å; L105-Y389 VanDerWaalsContact CD2-CE2 3.4Å; L105-Y389 HydrophobicContact CG-CE2 4.3Å; D108-Y389 WeakPolarHBondContact CB-OH 3.41Å; D108-Y389 VanDerWaalsContact CG-OH 3.31Å; D108-Y389 PolarHBondContact OD2-OH 3.12Å; F385-Y389 HydrophobicContact CZ-CD2 4.39Å; F385-Y389 WeakPolarHBondContact O-CB 3.26Å; F385-Y389 PolarHBondContact O-N 2.64Å; L387-Y389 VanDerWaalsContact C-N 3.26Å; L387-Y389 PolarHBondContact O-N 3.08Å; Y389-M391 VanDerWaalsContact C-N 3.32Å; Y389-M391 PolarHBondContact O-N 3.38Å; Y389-H392 WeakPolarHBondContact O-CA 3.45Å; Y389-H392 VanDerWaalsContact O-CB 3.26Å; Y389-H392 WeakPolarHBondContact O-CB 3.44Å; Y389-H392 PolarHBondContact O-N 3.23Å; Y389-H392 VanDerWaalsContact O-N 3.07Å; Y389-T393 HydrophobicContact CD1-CG2 4.38Å; Y389-T393 HydrophobicContact CE1-CG2 3.98Å; Y389-T393 PolarHBondContact O-N 3.41Å; Y389-T393 VanDerWaalsContact O-N 3.07Å; Y389-L399 HydrophobicContact CD2-CD2 4.16Å
390	K	94.5	Very high	94.6	Very high	114 Å²	114	38.3 Å²	38.3	50%	0.496	20%	0.195	S	C	.	.	H	α-helix	trans	-58.9	-43.9	171.5	177.4	179.2	171.6	-180	0	111.7	K386 L387 H392 T393 E394	K386-K390 PolarHBondContact O-N 3.08Å; L387-K390 WeakPolarHBondContact O-CB 3.22Å; L387-K390 PolarHBondContact O-N 3.5Å; K390-H392 PolarHBondContact O-N 2.99Å; K390-T393 PolarHBondContact O-N 3.1Å; K390-T393 PolarHBondContact O-OG1 3.21Å; K390-E394 WeakPolarHBondContact CE-OE1 3.46Å; K390-E394 IonicContact NZ-OE1 3.85Å; K390-E394 WeakPolarHBondContact O-CG 3.45Å; K390-E394 PolarHBondContact O-N 2.97Å
391	M	96.7	Very high	94.9	Very high	7 Å²	7	34.2 Å²	34.2	3%	0.034	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-29.2	175.8	-66.1	174	75	0	0	112.4	L125 W314 Y331 L387 L388 Y389 G395 L396 L397	L125-M391 HydrophobicContact CD1-CE 4.14Å; L125-M391 HydrophobicContact CD2-CE 3.68Å; W314-M391 HydrophobicContact CH2-CE 4.36Å; W314-M391 HydrophobicContact CH2-SD 4.21Å; W314-M391 HydrophobicContact CZ3-SD 4.14Å; Y331-M391 HydrophobicContact CE1-CE 3.53Å; Y331-M391 WeakPolarHBondContact OH-CE 3.45Å; L387-M391 HydrophobicContact CG-SD 4.19Å; L387-M391 VanDerWaalsContact O-CG 3.27Å; L387-M391 WeakPolarHBondContact O-CG 3.31Å; L387-M391 PolarHBondContact O-N 3.14Å; L388-M391 HydrophobicContact CD2-SD 4.28Å; L388-M391 PolarHBondContact O-N 3.45Å; Y389-M391 VanDerWaalsContact C-N 3.32Å; Y389-M391 PolarHBondContact O-N 3.38Å; M391-G395 PolarHBondContact O-N 3.14Å; M391-L396 HydrophobicContact CB-CB 4.15Å; M391-L396 HydrophobicContact CB-CD1 4.09Å; M391-L396 HydrophobicContact CE-CB 4.4Å; M391-L396 HydrophobicContact CE-CD1 4.1Å; M391-L396 HydrophobicContact CG-CD1 3.98Å; M391-L396 WeakPolarHBondContact O-CB 3.44Å; M391-L396 PolarHBondContact O-N 3.19Å; M391-L397 HydrophobicContact CB-CD2 3.75Å; M391-L397 HydrophobicContact CB-CG 4.01Å; M391-L397 HydrophobicContact CE-CD2 4.17Å; M391-L397 HydrophobicContact SD-CD2 4.27Å
392	H	95.4	Very high	94.8	Very high	27 Å²	27	35.4 Å²	35.4	13%	0.125	19%	0.186	C	C	.	.	H	α-helix	trans	-65.9	-47.7	172.8	170.6	67.4	0	0	0	112.2	W115 L388 Y389 K390 E394 G395 L397 L399	W115-H392 AromaticContact CD1-CE1 3.07Å; W115-H392 AromaticContact CD1-ND1 3.2Å; W115-H392 AromaticContact CD1-NE2 3.87Å; W115-H392 VanDerWaalsContact CD1-O 3.25Å; W115-H392 AromaticContact CG-CE1 3.58Å; W115-H392 AromaticContact NE1-CE1 3.71Å; W115-H392 AromaticContact NE1-ND1 3.35Å; W115-H392 PolarHBondContact NE1-ND1 2.98Å; W115-H392 PolarHBondContact NE1-O 2.8Å; W115-H392 VanDerWaalsContact NE1-O 3.07Å; L388-H392 PolarHBondContact O-N 3.31Å; Y389-H392 WeakPolarHBondContact O-CA 3.45Å; Y389-H392 VanDerWaalsContact O-CB 3.26Å; Y389-H392 WeakPolarHBondContact O-CB 3.44Å; Y389-H392 PolarHBondContact O-N 3.23Å; Y389-H392 VanDerWaalsContact O-N 3.07Å; K390-H392 PolarHBondContact O-N 2.99Å; H392-E394 PolarHBondContact O-N 3.4Å; H392-G395 PolarHBondContact O-N 3.12Å; H392-L397 VanDerWaalsContact CA-O 3.32Å; H392-L397 WeakPolarHBondContact CA-O 3.45Å; H392-L397 HydrophobicContact CB-CD1 3.95Å; H392-L397 PolarHBondContact ND1-O 3.3Å; H392-L399 HydrophobicContact CB-CB 3.84Å; H392-L399 PolarHBondContact ND1-N 3.36Å; H392-L399 VanDerWaalsContact ND1-N 3.11Å
393	T	93.4	Very high	94.8	Very high	82 Å²	82	38.7 Å²	38.7	50%	0.503	20%	0.197	S	C	.	.	H	α-helix	trans	-66.3	-28.8	179	62.5	0	0	0	0	112.3	Y389 K390 G395	Y389-T393 HydrophobicContact CD1-CG2 4.38Å; Y389-T393 HydrophobicContact CE1-CG2 3.98Å; Y389-T393 PolarHBondContact O-N 3.41Å; Y389-T393 VanDerWaalsContact O-N 3.07Å; K390-T393 PolarHBondContact O-N 3.1Å; K390-T393 PolarHBondContact O-OG1 3.21Å; T393-G395 VanDerWaalsContact C-N 3.27Å; T393-G395 PolarHBondContact O-N 3.43Å
394	E	94.7	Very high	94.8	Very high	86 Å²	86	37.7 Å²	37.7	40%	0.402	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-4	173.8	-68.2	170.3	178.7	0	0	113.9	N118 K390 H392 L396	N118-E394 WeakPolarHBondContact CB-O 3.35Å; K390-E394 WeakPolarHBondContact CE-OE1 3.46Å; K390-E394 IonicContact NZ-OE1 3.85Å; K390-E394 WeakPolarHBondContact O-CG 3.45Å; K390-E394 PolarHBondContact O-N 2.97Å; H392-E394 PolarHBondContact O-N 3.4Å; E394-L396 VanDerWaalsContact C-N 3.32Å; E394-L396 HydrophobicContact CB-CD1 4.32Å; E394-L396 HydrophobicContact CB-CG 4.18Å; E394-L396 PolarHBondContact O-N 3.49Å
395	G	95.9	Very high	94	Very high	3 Å²	3	45.4 Å²	45.4	3%	0.031	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	9.4	178.6	0	0	0	0	0	115.2	R116 H117 N118 M391 H392 T393	R116-G395 WeakPolarHBondContact O-CA 3.37Å; H117-G395 PolarHBondContact ND1-O 3.07Å; H117-G395 VanDerWaalsContact ND1-O 3.08Å; N118-G395 PolarHBondContact N-O 3.36Å; M391-G395 PolarHBondContact O-N 3.14Å; H392-G395 PolarHBondContact O-N 3.12Å; T393-G395 VanDerWaalsContact C-N 3.27Å; T393-G395 PolarHBondContact O-N 3.43Å
396	L	97.9	Very high	93.9	Very high	11 Å²	11	47.3 Å²	47.3	6%	0.058	26%	0.262	C	S	.	.	S	Bend	trans	-73.7	-28.7	-179.8	-62.9	174	0	0	0	112.8	A121 F122 L125 M391 E394	A121-L396 HydrophobicContact CB-CD2 3.59Å; A121-L396 WeakPolarHBondContact O-CD2 3.49Å; F122-L396 HydrophobicContact CB-CD2 4.25Å; F122-L396 WeakPolarHBondContact CD2-O 3.48Å; L125-L396 HydrophobicContact CB-CD2 4.37Å; L125-L396 HydrophobicContact CD1-CD1 4.28Å; M391-L396 HydrophobicContact CB-CB 4.15Å; M391-L396 HydrophobicContact CB-CD1 4.09Å; M391-L396 HydrophobicContact CE-CB 4.4Å; M391-L396 HydrophobicContact CE-CD1 4.1Å; M391-L396 HydrophobicContact CG-CD1 3.98Å; M391-L396 WeakPolarHBondContact O-CB 3.44Å; M391-L396 PolarHBondContact O-N 3.19Å; E394-L396 VanDerWaalsContact C-N 3.32Å; E394-L396 HydrophobicContact CB-CD1 4.32Å; E394-L396 HydrophobicContact CB-CG 4.18Å; E394-L396 PolarHBondContact O-N 3.49Å
397	L	97.8	Very high	93.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.25	C	C	.	.	S	Bend	trans	-149.8	157.6	176.7	64.5	83.8	0	0	0	110.1	W115 Y331 I341 L343 L388 M391 H392 L399	W115-L397 VanDerWaalsContact CZ2-C 3.45Å; W115-L397 WeakPolarHBondContact CZ2-O 3.22Å; W115-L397 PolarHBondContact NE1-O 3.45Å; Y331-L397 HydrophobicContact CD2-CD2 4.06Å; Y331-L397 HydrophobicContact CE2-CB 3.82Å; Y331-L397 HydrophobicContact CE2-CD2 3.51Å; Y331-L397 HydrophobicContact CE2-CG 4.33Å; I341-L397 WeakPolarHBondContact O-CA 3.38Å; L343-L397 HydrophobicContact CD1-CD1 3.78Å; L343-L397 HydrophobicContact CD1-CD2 3.83Å; L343-L397 HydrophobicContact CD1-CG 4.36Å; L343-L397 HydrophobicContact CG-CD1 4.06Å; L343-L397 HydrophobicContact CG-CD2 4.49Å; L388-L397 HydrophobicContact CD2-CD2 3.73Å; M391-L397 HydrophobicContact CB-CD2 3.75Å; M391-L397 HydrophobicContact CB-CG 4.01Å; M391-L397 HydrophobicContact CE-CD2 4.17Å; M391-L397 HydrophobicContact SD-CD2 4.27Å; H392-L397 VanDerWaalsContact CA-O 3.32Å; H392-L397 WeakPolarHBondContact CA-O 3.45Å; H392-L397 HydrophobicContact CB-CD1 3.95Å; H392-L397 PolarHBondContact ND1-O 3.3Å; L397-L399 HydrophobicContact CD1-CB 3.84Å
398	K	97.3	Very high	93.8	Very high	53 Å²	53	44.7 Å²	44.7	23%	0.23	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.2	169.8	-168.2	178.7	-176.2	175.6	0	109.7	W115 I341 H342 L343	W115-K398 HydrophobicContact CD2-CB 3.96Å; W115-K398 HydrophobicContact CD2-CD 4.2Å; W115-K398 HydrophobicContact CD2-CG 3.83Å; W115-K398 HydrophobicContact CE3-CB 4.06Å; W115-K398 HydrophobicContact CE3-CD 3.8Å; W115-K398 HydrophobicContact CE3-CG 3.93Å; W115-K398 HydrophobicContact CG-CG 4.27Å; W115-K398 HydrophobicContact CH2-CB 3.86Å; W115-K398 HydrophobicContact CZ2-CB 3.75Å; W115-K398 HydrophobicContact CZ3-CB 4.01Å; W115-K398 HydrophobicContact CZ3-CD 4.13Å; W115-K398 HydrophobicContact CZ3-CG 4.32Å; I341-K398 PolarHBondContact O-N 3.33Å; H342-K398 CarbonylContact C-O 3.55Å; H342-K398 WeakPolarHBondContact CA-O 3.46Å; H342-K398 HydrophobicContact CB-CB 4.41Å; H342-K398 WeakPolarHBondContact ND1-CD 3.23Å; L343-K398 PolarHBondContact N-O 3.19Å
399	L	96.4	Very high	93.6	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.052	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	115	176.3	-176.2	60.3	0	0	0	109.7	L343 F346 F385 Y389 H392 L397 L401	L343-L399 HydrophobicContact CB-CD1 3.8Å; L343-L399 HydrophobicContact CD1-CD1 4.25Å; F346-L399 HydrophobicContact CB-CD1 3.7Å; F385-L399 HydrophobicContact CD2-CD2 4.43Å; F385-L399 HydrophobicContact CE2-CD2 3.8Å; F385-L399 HydrophobicContact CZ-CD2 4.23Å; Y389-L399 HydrophobicContact CD2-CD2 4.16Å; H392-L399 HydrophobicContact CB-CB 3.84Å; H392-L399 PolarHBondContact ND1-N 3.36Å; H392-L399 VanDerWaalsContact ND1-N 3.11Å; L397-L399 HydrophobicContact CD1-CB 3.84Å; L399-L401 HydrophobicContact CD1-CD2 4.4Å; L399-L401 HydrophobicContact CD2-CD1 4.11Å; L399-L401 HydrophobicContact CD2-CD2 4.49Å; L399-L401 HydrophobicContact CD2-CG 4.42Å; L399-L401 HydrophobicContact CG-CD1 4.21Å; L399-L401 HydrophobicContact CG-CD2 4.13Å; L399-L401 HydrophobicContact CG-CG 4.01Å
400	S	94.5	Very high	93.5	Very high	18 Å²	18	47.8 Å²	47.8	13%	0.126	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.8	-178.8	-54.9	0	0	0	0	110.8	L343 Y344	L343-S400 WeakPolarHBondContact O-CB 3.41Å; L343-S400 PolarHBondContact O-N 3.45Å; L343-S400 PolarHBondContact O-OG 2.93Å; Y344-S400 WeakPolarHBondContact CE1-OG 3.45Å
401	L	93.3	Very high	93.4	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	26%	0.264	C	S	.	.			trans	-132.5	10.9	-173.1	-63.9	178.4	0	0	0	112.7	L105 L109 I195 W347 N354 F385 L399	L105-L401 HydrophobicContact CD2-CD1 3.76Å; L109-L401 HydrophobicContact CD2-CB 3.31Å; L109-L401 HydrophobicContact CD2-CD1 3.89Å; L109-L401 HydrophobicContact CD2-CG 4.17Å; I195-L401 HydrophobicContact CD1-CB 4.17Å; I195-L401 HydrophobicContact CD1-CD2 3.83Å; W347-L401 HydrophobicContact CB-CD2 4.45Å; W347-L401 HydrophobicContact CE3-CD2 4.11Å; N354-L401 PolarHBondContact ND2-O 3.15Å; F385-L401 HydrophobicContact CE2-CD1 4.23Å; F385-L401 HydrophobicContact CE2-CD2 4.02Å; F385-L401 HydrophobicContact CZ-CD1 3.94Å; F385-L401 HydrophobicContact CZ-CD2 4.47Å; L399-L401 HydrophobicContact CD1-CD2 4.4Å; L399-L401 HydrophobicContact CD2-CD1 4.11Å; L399-L401 HydrophobicContact CD2-CD2 4.49Å; L399-L401 HydrophobicContact CD2-CG 4.42Å; L399-L401 HydrophobicContact CG-CD1 4.21Å; L399-L401 HydrophobicContact CG-CD2 4.13Å; L399-L401 HydrophobicContact CG-CG 4.01Å
402	S	88.7	Confident	93.2	Very high	45 Å²	45	45.9 Å²	45.9	32%	0.315	28%	0.28	S	S	.	.	S	Bend	trans	-134.4	172	179.4	58.3	0	0	0	0	110.1
403	H	90.5	Very high	93	Very high	117 Å²	117	47.4 Å²	47.4	54%	0.542	29%	0.292	S	S	.	.			trans	-64.6	145.1	175.9	-62.1	-179	0	0	0	110.7	S199	S199-H403 CarbonylContact O-C 3.56Å; S199-H403 WeakPolarHBondContact O-CA 3.44Å
404	C	90.3	Very high	93	Very high	19 Å²	19	44.5 Å²	44.5	13%	0.128	27%	0.274	C	S	.	.			trans	-85.1	151.6	173	-65.3	0	0	0	0	111	S199 C201 Q204	S199-C404 PolarHBondContact O-N 2.8Å; C201-C404 WeakPolarHBondContact CA-SG 3.44Å; C201-C404 HydrophobicContact CB-CB 3.86Å; C201-C404 WeakPolarHBondContact CB-SG 3.4Å; C201-C404 WeakPolarHBondContact SG-CB 3.42Å; C201-C404 PolarHBondContact SG-N 3.46Å; C201-C404 CovalentContact SG-SG 2.04Å; C201-C404 PolarHBondContact SG-SG 3.03Å; Q204-C404 PolarHBondContact OE1-SG 3.45Å
405	A	78.8	Confident	92.9	Very high	167 Å²	167	40.7 Å²	40.7	100%	1.38	26%	0.263	S	S	*	.			trans	-74.5	0	178.7	0	0	0	0	0	112.7

Retrieved 405 of 405 residues in 298 ms (Link to these results)

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