A0A023ILP6_RAT Loading...

Major histocompatibility complex, class II, DM beta, isoform CRA_a

AlphaFold DB (Q6MGA7), UniProt , Accession A0A023ILP6, Species RAT (Rattus norvegicus, Rat), Gene RT1-DMb, Length 261 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	52	Low	59.2	Low	211 Å²	211	109.8 Å²	109.8	100%	1.039	62%	0.62	S	S	*	*				0	-30.2	0	-74.6	-162.5	-88.5	0	0	115.4
2	A	55.5	Low	59.2	Low	89 Å²	89	107.5 Å²	107.5	74%	0.736	62%	0.616	S	S	*	*			trans	-78.6	-19.5	-179.8	0	0	0	0	0	115.3	P6	A2-P6 WeakPolarHBondContact O-CD 3.43Å
3	A	58.3	Low	59.2	Low	76 Å²	76	110.1 Å²	110.1	63%	0.628	63%	0.625	S	S	*	*	S	Bend	trans	-85.2	-18.2	-173.4	0	0	0	0	0	115.1	P6	A3-P6 WeakPolarHBondContact O-CD 3.49Å
4	L	58.4	Low	59.1	Low	117 Å²	117	106.6 Å²	106.6	61%	0.613	63%	0.625	S	S	*	*	H	α-helix	trans	-77.5	-25.8	179.9	-97.5	147.3	0	0	0	113.1	L8	L4-L8 PolarHBondContact O-N 2.75Å
5	W	56.4	Low	58.7	Low	188 Å²	188	104.3 Å²	104.3	71%	0.712	62%	0.616	S	S	*	*	H	α-helix	trans	-67.6	-45.9	-176.2	-140.4	-12.1	0	0	0	114.5	L7 L8 L9	W5-L7 VanDerWaalsContact C-N 3.26Å; W5-L7 PolarHBondContact O-N 3.07Å; W5-L8 PolarHBondContact O-N 3.35Å; W5-L9 HydrophobicContact CG-CD1 4.45Å; W5-L9 PolarHBondContact O-N 3.34Å; W5-L9 VanDerWaalsContact O-N 3.14Å
6	P	65	Low	58.5	Low	80 Å²	80	109.5 Å²	109.5	52%	0.519	64%	0.638	S	S	.	*	H	α-helix	trans	-65.8	-27	178.7	21.6	-31	0	0	0	113.3	A2 A3 A10	A2-P6 WeakPolarHBondContact O-CD 3.43Å; A3-P6 WeakPolarHBondContact O-CD 3.49Å; P6-A10 WeakPolarHBondContact O-CB 3.44Å; P6-A10 PolarHBondContact O-N 3.39Å
7	L	60.9	Low	58.3	Low	86 Å²	86	106.1 Å²	106.1	45%	0.45	63%	0.632	S	S	.	*	H	α-helix	trans	-72	-41.9	178.7	-128	104.4	0	0	0	112.2	W5 L9 A10 L11	W5-L7 VanDerWaalsContact C-N 3.26Å; W5-L7 PolarHBondContact O-N 3.07Å; L7-L9 VanDerWaalsContact C-N 3.33Å; L7-A10 PolarHBondContact O-N 3.39Å; L7-L11 PolarHBondContact O-N 3.03Å
8	L	61.4	Low	58.6	Low	107 Å²	107	107.1 Å²	107.1	56%	0.56	65%	0.653	S	S	*	*	H	α-helix	trans	-66.9	-35.5	174.9	-74.1	166.1	0	0	0	111.8	L4 W5 S12	L4-L8 PolarHBondContact O-N 2.75Å; W5-L8 PolarHBondContact O-N 3.35Å; L8-S12 PolarHBondContact O-N 3.47Å
9	L	60.8	Low	59.2	Low	84 Å²	84	103.9 Å²	103.9	44%	0.44	65%	0.645	S	S	.	*	H	α-helix	trans	-67.6	-43	175.4	-99.8	133.1	0	0	0	112.3	W5 L7 L11 S12 L13	W5-L9 HydrophobicContact CG-CD1 4.45Å; W5-L9 PolarHBondContact O-N 3.34Å; W5-L9 VanDerWaalsContact O-N 3.14Å; L7-L9 VanDerWaalsContact C-N 3.33Å; L9-L11 VanDerWaalsContact C-N 3.28Å; L9-L11 PolarHBondContact O-N 3.44Å; L9-S12 PolarHBondContact O-N 3.41Å; L9-S12 PolarHBondContact O-OG 3.32Å; L9-L13 HydrophobicContact CD2-CD1 4.1Å; L9-L13 PolarHBondContact O-N 3.14Å
10	A	62.5	Low	60.4	Low	75 Å²	75	102.1 Å²	102.1	62%	0.62	65%	0.647	S	S	*	*	H	α-helix	trans	-62.5	-34.6	178.2	0	0	0	0	0	112.8	P6 L7 S12	P6-A10 WeakPolarHBondContact O-CB 3.44Å; P6-A10 PolarHBondContact O-N 3.39Å; L7-A10 PolarHBondContact O-N 3.39Å; A10-S12 VanDerWaalsContact C-N 3.28Å; A10-S12 PolarHBondContact O-N 3.3Å
11	L	60.3	Low	61.9	Low	95 Å²	95	102.8 Å²	102.8	50%	0.497	64%	0.64	S	S	.	*	H	α-helix	trans	-70.8	-22.2	175.4	-76.8	159.4	0	0	0	113.3	L7 L9 F46	L7-L11 PolarHBondContact O-N 3.03Å; L9-L11 VanDerWaalsContact C-N 3.28Å; L9-L11 PolarHBondContact O-N 3.44Å; L11-F46 HydrophobicContact CD2-CE2 3.91Å; L11-F46 HydrophobicContact CD2-CZ 4.08Å
12	S	59.4	Low	63.9	Low	82 Å²	82	96.5 Å²	96.5	57%	0.573	61%	0.614	S	S	*	*	H	α-helix	trans	-89	-23.4	-177.9	71.3	0	0	0	0	114.8	L8 L9 A10	L8-S12 PolarHBondContact O-N 3.47Å; L9-S12 PolarHBondContact O-N 3.41Å; L9-S12 PolarHBondContact O-OG 3.32Å; A10-S12 VanDerWaalsContact C-N 3.28Å; A10-S12 PolarHBondContact O-N 3.3Å
13	L	58.9	Low	65.8	Low	141 Å²	141	95 Å²	95	74%	0.738	60%	0.602	S	S	*	*	S	Bend	trans	-93.1	1.6	-170.2	-80.7	152.3	0	0	0	114.6	L9	L9-L13 HydrophobicContact CD2-CD1 4.1Å; L9-L13 PolarHBondContact O-N 3.14Å
14	G	57.1	Low	67.6	Low	61 Å²	61	95.1 Å²	95.1	63%	0.629	59%	0.589	S	S	*	*	S	Bend	trans	-104.8	1.2	-168.7	0	0	0	0	0	118
15	C	53.7	Low	69.5	Low	72 Å²	72	94.1 Å²	94.1	49%	0.486	59%	0.588	S	S	.	*			trans	-132.2	104.5	-171.6	-69.2	0	0	0	0	112.9	G17	C15-G17 VanDerWaalsContact C-N 3.29Å
16	I	55.9	Low	71.5	Confident	188 Å²	188	90.4 Å²	90.4	96%	0.964	58%	0.578	S	S	*	*			trans	-90.1	7.7	171.7	-61.1	168.3	0	0	0	111.2
17	G	55.3	Low	73	Confident	52 Å²	52	89.1 Å²	89.1	54%	0.536	57%	0.571	S	S	.	*	S	Bend	trans	-98.3	156.8	168.4	0	0	0	0	0	110.7	C15 G19	C15-G17 VanDerWaalsContact C-N 3.29Å; G17-G19 PolarHBondContact O-N 2.75Å
18	A	63.4	Low	74.8	Confident	123 Å²	123	88 Å²	88	100%	1.017	57%	0.568	S	S	*	*	S	Bend	trans	-62.6	17.5	172.1	0	0	0	0	0	114.6
19	G	69.1	Low	76.5	Confident	48 Å²	48	85.5 Å²	85.5	50%	0.495	56%	0.559	S	S	.	*			trans	-87	104	171.8	0	0	0	0	0	109.9	G17	G17-G19 PolarHBondContact O-N 2.75Å
20	G	84.3	Confident	78.3	Confident	66 Å²	66	86.6 Å²	86.6	68%	0.68	57%	0.565	S	S	*	*			trans	-96.9	126.4	166.5	0	0	0	0	0	109.7
21	F	91.1	Very high	80	Confident	117 Å²	117	84.2 Å²	84.2	51%	0.513	54%	0.541	S	S	.	.			trans	-83.6	153	166.8	-63.3	-70.2	0	0	0	110.1	F46 N47	F21-F46 HydrophobicContact CB-CE1 4.2Å; F21-F46 HydrophobicContact CB-CE2 3.82Å; F21-F46 HydrophobicContact CB-CZ 3.45Å; F21-F46 VanDerWaalsContact CB-CZ 3.45Å; F21-F46 AromaticContact CD1-CE1 3.96Å; F21-F46 HydrophobicContact CD1-CE1 3.96Å; F21-F46 AromaticContact CD1-CZ 4Å; F21-F46 HydrophobicContact CD1-CZ 4Å; F21-F46 HydrophobicContact CD2-CZ 4.1Å; F21-F46 HydrophobicContact CG-CE1 4.04Å; F21-F46 HydrophobicContact CG-CE2 4.45Å; F21-F46 AromaticContact CG-CZ 3.59Å; F21-F46 HydrophobicContact CG-CZ 3.59Å; F21-N47 HydrophobicContact CD1-CB 3.97Å
22	V	94.1	Very high	81.7	Confident	79 Å²	79	81.8 Å²	81.8	48%	0.479	53%	0.529	S	S	.	.			trans	-125.3	126.5	177.1	-176.8	0	0	0	0	109.2	H24 N47	V22-H24 VanDerWaalsContact CG1-CE1 3.49Å; V22-H24 WeakPolarHBondContact CG1-CE1 3.49Å; V22-N47 PolarHBondContact O-N 3.27Å
23	A	95.6	Very high	83.4	Confident	59 Å²	59	83.2 Å²	83.2	49%	0.488	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	142.7	170.2	0	0	0	0	0	109.9	S45 F46	A23-S45 CarbonylContact C-O 3.56Å; A23-S45 WeakPolarHBondContact CA-O 3.34Å; A23-F46 HydrophobicContact CB-CD2 4.19Å
24	H	96.9	Very high	85.1	Confident	77 Å²	77	83.9 Å²	83.9	36%	0.356	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.3	171.9	-59.7	72.3	0	0	0	108.7	V22 I44 S45	V22-H24 VanDerWaalsContact CG1-CE1 3.49Å; V22-H24 WeakPolarHBondContact CG1-CE1 3.49Å; H24-I44 WeakPolarHBondContact O-CA 3.38Å; H24-S45 PolarHBondContact N-O 3.08Å; H24-S45 PolarHBondContact O-N 3.3Å
25	V	97.4	Very high	86.9	Confident	97 Å²	97	81.5 Å²	81.5	59%	0.588	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.2	95.2	165.2	-179.5	0	0	0	0	104.9	Y42	V25-Y42 HydrophobicContact CG1-CE2 3.8Å; V25-Y42 VanDerWaalsContact CG1-OH 3.29Å; V25-Y42 WeakPolarHBondContact CG1-OH 3.47Å
26	E	97.9	Very high	89	Confident	109 Å²	109	81.3 Å²	81.3	51%	0.509	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.6	-169.4	-174	168.1	-153.5	0	0	109.7	T28 Y42 C43	E26-T28 HydrophobicContact CG-CG2 4.02Å; E26-Y42 CarbonylContact O-C 3.48Å; E26-Y42 WeakPolarHBondContact O-CA 3.3Å; E26-C43 PolarHBondContact N-O 3.15Å; E26-C43 PolarHBondContact O-N 2.94Å
27	S	97.6	Very high	90.9	Very high	54 Å²	54	74 Å²	74	38%	0.378	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.3	172.6	-47.1	0	0	0	0	107.7	T41 Y42	S27-T41 CarbonylContact C-O 3.58Å; S27-T41 VanDerWaalsContact CA-O 3.27Å; S27-T41 WeakPolarHBondContact CA-O 3.34Å; S27-Y42 WeakPolarHBondContact OG-CD2 3.27Å
28	T	98.2	Very high	92.9	Very high	61 Å²	61	77.2 Å²	77.2	37%	0.374	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.2	178.7	76.8	0	0	0	0	109.8	E26 F40 T41	E26-T28 HydrophobicContact CG-CG2 4.02Å; T28-F40 WeakPolarHBondContact O-CA 3.43Å; T28-F40 WeakPolarHBondContact O-CD2 3.32Å; T28-T41 PolarHBondContact N-O 3.49Å; T28-T41 PolarHBondContact O-N 2.91Å; T28-T41 PolarHBondContact OG1-OG1 3.19Å
29	C	97.9	Very high	94.5	Very high	55 Å²	55	75.4 Å²	75.4	37%	0.372	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	121.2	174.6	-64	0	0	0	0	107.3	L31 C97	C29-L31 HydrophobicContact CB-CD1 3.65Å; C29-C97 HydrophobicContact CB-CB 3.66Å; C29-C97 WeakPolarHBondContact CB-SG 3.3Å; C29-C97 WeakPolarHBondContact SG-CB 3.41Å; C29-C97 CovalentContact SG-SG 2.03Å; C29-C97 PolarHBondContact SG-SG 3.22Å
30	L	97.9	Very high	95.9	Very high	108 Å²	108	74 Å²	74	57%	0.565	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.1	168.7	-167.6	83.9	0	0	0	107.7	M38 D39	L30-M38 HydrophobicContact CB-CB 4.47Å; L30-M38 HydrophobicContact CD2-CB 3.91Å; L30-M38 HydrophobicContact CG-CB 4.35Å; L30-M38 PolarHBondContact O-N 3.07Å; L30-D39 HydrophobicContact CB-CB 3.87Å; L30-D39 HydrophobicContact CD2-CB 4.2Å; L30-D39 PolarHBondContact N-O 3.24Å; L30-D39 PolarHBondContact O-N 3.11Å
31	L	97.7	Very high	96.5	Very high	24 Å²	24	73 Å²	73	13%	0.126	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	153.2	175.9	-50	85.4	0	0	0	109.9	C29 T36 T101 W105	C29-L31 HydrophobicContact CB-CD1 3.65Å; L31-T36 VanDerWaalsContact CA-O 3.24Å; L31-T36 WeakPolarHBondContact CA-O 3.1Å; L31-T36 WeakPolarHBondContact CB-O 3.45Å; L31-T101 HydrophobicContact CD1-CG2 4.38Å; L31-T101 HydrophobicContact CD2-CG2 4.32Å; L31-T101 WeakPolarHBondContact CD2-OG1 3.49Å; L31-W105 HydrophobicContact CB-CH2 4.14Å; L31-W105 HydrophobicContact CB-CZ2 3.52Å; L31-W105 HydrophobicContact CD1-CH2 3.71Å; L31-W105 HydrophobicContact CD1-CZ2 4.01Å; L31-W105 HydrophobicContact CD1-CZ3 4.06Å; L31-W105 HydrophobicContact CD2-CD2 4.4Å; L31-W105 HydrophobicContact CD2-CZ2 4.49Å; L31-W105 HydrophobicContact CG-CH2 4.41Å; L31-W105 HydrophobicContact CG-CZ2 4.21Å
32	D	96.8	Very high	96.9	Very high	44 Å²	44	68.3 Å²	68.3	24%	0.235	38%	0.382	C	S	.	.			trans	-79.8	-177.8	170.8	66	13.9	0	0	0	112.3	E34 G35 T36 M38 W105	D32-E34 PolarHBondContact O-N 3.35Å; D32-E34 WeakPolarHBondContact OD1-CA 3.43Å; D32-E34 PolarHBondContact OD1-N 2.94Å; D32-E34 VanDerWaalsContact OD1-N 3.12Å; D32-G35 PolarHBondContact O-N 2.9Å; D32-G35 PolarHBondContact OD1-N 3.47Å; D32-T36 PolarHBondContact N-O 3.48Å; D32-T36 VanDerWaalsContact N-O 3.13Å; D32-T36 WeakPolarHBondContact OD1-CB 3.35Å; D32-T36 PolarHBondContact OD1-N 3.07Å; D32-T36 PolarHBondContact OD1-OG1 3.38Å; D32-T36 WeakPolarHBondContact OD2-CB 3.29Å; D32-T36 PolarHBondContact OD2-OG1 3.3Å; D32-M38 HydrophobicContact CB-CG 4.43Å; D32-W105 PolarHBondContact O-NE1 2.95Å
33	D	95.1	Very high	97.1	Very high	112 Å²	112	65.4 Å²	65.4	60%	0.599	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-27.2	-179	-71.2	-32.7	0	0	0	112.4	G35	D33-G35 VanDerWaalsContact C-N 3.33Å
34	E	95.3	Very high	97.2	Very high	155 Å²	155	63.3 Å²	63.3	72%	0.724	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.7	176.2	-65.9	73.6	-159.9	0	0	113.4	D32	D32-E34 PolarHBondContact O-N 3.35Å; D32-E34 WeakPolarHBondContact OD1-CA 3.43Å; D32-E34 PolarHBondContact OD1-N 2.94Å; D32-E34 VanDerWaalsContact OD1-N 3.12Å
35	G	94.9	Very high	97.2	Very high	11 Å²	11	60.3 Å²	60.3	11%	0.113	33%	0.333	C	S	.	.			trans	86.1	17.7	-177.3	0	0	0	0	0	114.3	D32 D33	D32-G35 PolarHBondContact O-N 2.9Å; D32-G35 PolarHBondContact OD1-N 3.47Å; D33-G35 VanDerWaalsContact C-N 3.33Å
36	T	96.6	Very high	97.1	Very high	69 Å²	69	57.3 Å²	57.3	42%	0.423	31%	0.312	S	S	.	.			trans	-73.5	126.1	169.5	-41.2	0	0	0	0	109.1	L31 D32 M38	L31-T36 VanDerWaalsContact CA-O 3.24Å; L31-T36 WeakPolarHBondContact CA-O 3.1Å; L31-T36 WeakPolarHBondContact CB-O 3.45Å; D32-T36 PolarHBondContact N-O 3.48Å; D32-T36 VanDerWaalsContact N-O 3.13Å; D32-T36 WeakPolarHBondContact OD1-CB 3.35Å; D32-T36 PolarHBondContact OD1-N 3.07Å; D32-T36 PolarHBondContact OD1-OG1 3.38Å; D32-T36 WeakPolarHBondContact OD2-CB 3.29Å; D32-T36 PolarHBondContact OD2-OG1 3.3Å; T36-M38 PolarHBondContact O-N 2.94Å
37	P	96.9	Very high	96.9	Very high	34 Å²	34	56.3 Å²	56.3	22%	0.221	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	122.3	176.7	31.2	-34.5	0	0	0	110	L94 C97	P37-L94 HydrophobicContact CB-CB 4.08Å; P37-L94 HydrophobicContact CB-CD2 3.92Å; P37-L94 WeakPolarHBondContact CB-O 3.45Å; P37-L94 HydrophobicContact CG-CB 4.1Å; P37-L94 VanDerWaalsContact CG-O 3.31Å; P37-L94 WeakPolarHBondContact CG-O 3.08Å; P37-C97 HydrophobicContact CB-CB 4.39Å
38	M	96.5	Very high	96.7	Very high	120 Å²	120	62.9 Å²	62.9	59%	0.591	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	-35.6	-176.7	-63.9	-60.2	-71.5	0	0	112.3	L30 D32 T36	L30-M38 HydrophobicContact CB-CB 4.47Å; L30-M38 HydrophobicContact CD2-CB 3.91Å; L30-M38 HydrophobicContact CG-CB 4.35Å; L30-M38 PolarHBondContact O-N 3.07Å; D32-M38 HydrophobicContact CB-CG 4.43Å; T36-M38 PolarHBondContact O-N 2.94Å
39	D	97.1	Very high	96.6	Very high	85 Å²	85	62.3 Å²	62.3	46%	0.455	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	154.4	178.8	-165.8	14.8	0	0	0	110.8	L30	L30-D39 HydrophobicContact CB-CB 3.87Å; L30-D39 HydrophobicContact CD2-CB 4.2Å; L30-D39 PolarHBondContact N-O 3.24Å; L30-D39 PolarHBondContact O-N 3.11Å
40	F	97.9	Very high	96.6	Very high	18 Å²	18	63.2 Å²	63.2	8%	0.079	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	126.6	178.6	169.7	-103.3	0	0	0	110.8	T28 L90 L94 C97	T28-F40 WeakPolarHBondContact O-CA 3.43Å; T28-F40 WeakPolarHBondContact O-CD2 3.32Å; F40-L90 HydrophobicContact CE1-CB 4.44Å; F40-L90 HydrophobicContact CE1-CD2 3.89Å; F40-L90 HydrophobicContact CZ-CD2 3.78Å; F40-L94 HydrophobicContact CB-CD2 3.67Å; F40-L94 HydrophobicContact CB-CG 4.11Å; F40-C97 VanDerWaalsContact CD2-SG 3.54Å
41	T	97.9	Very high	96.5	Very high	44 Å²	44	58 Å²	58	27%	0.27	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	150.5	174.2	74.4	0	0	0	0	111.4	S27 T28	S27-T41 CarbonylContact C-O 3.58Å; S27-T41 VanDerWaalsContact CA-O 3.27Å; S27-T41 WeakPolarHBondContact CA-O 3.34Å; T28-T41 PolarHBondContact N-O 3.49Å; T28-T41 PolarHBondContact O-N 2.91Å; T28-T41 PolarHBondContact OG1-OG1 3.19Å
42	Y	98.3	Very high	96.5	Very high	20 Å²	20	56.9 Å²	56.9	8%	0.078	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	115.2	172.3	176.2	-88.8	0	0	0	108.4	V25 E26 S27 I44 C53 W54 I61 L86 L90	V25-Y42 HydrophobicContact CG1-CE2 3.8Å; V25-Y42 VanDerWaalsContact CG1-OH 3.29Å; V25-Y42 WeakPolarHBondContact CG1-OH 3.47Å; E26-Y42 CarbonylContact O-C 3.48Å; E26-Y42 WeakPolarHBondContact O-CA 3.3Å; S27-Y42 WeakPolarHBondContact OG-CD2 3.27Å; Y42-I44 HydrophobicContact CD1-CD1 4.11Å; Y42-I44 HydrophobicContact CE1-CD1 3.67Å; Y42-I44 HydrophobicContact CE1-CG1 4.41Å; Y42-C53 CarbonylContact O-C 3.39Å; Y42-C53 VanDerWaalsContact O-CA 3.3Å; Y42-C53 WeakPolarHBondContact O-CA 3.33Å; Y42-W54 PolarHBondContact O-N 3.25Å; Y42-I61 HydrophobicContact CD1-CD1 4.27Å; Y42-I61 HydrophobicContact CE1-CD1 4.11Å; Y42-L86 HydrophobicContact CE1-CD1 4.39Å; Y42-L86 HydrophobicContact CE2-CD1 4.49Å; Y42-L90 HydrophobicContact CD1-CD1 3.79Å; Y42-L90 HydrophobicContact CD1-CD2 3.99Å; Y42-L90 HydrophobicContact CD2-CD2 3.63Å; Y42-L90 HydrophobicContact CE1-CD1 4.26Å; Y42-L90 HydrophobicContact CE2-CD2 4.34Å; Y42-L90 HydrophobicContact CG-CD1 4.13Å; Y42-L90 HydrophobicContact CG-CD2 3.45Å; Y42-L90 VanDerWaalsContact CG-CD2 3.45Å; Y42-L90 HydrophobicContact CG-CG 4.45Å
43	C	98.2	Very high	96.6	Very high	17 Å²	17	55.8 Å²	55.8	12%	0.115	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.2	-171.3	-66.5	0	0	0	0	112.2	E26 L50 A52 C53	E26-C43 PolarHBondContact N-O 3.15Å; E26-C43 PolarHBondContact O-N 2.94Å; C43-L50 HydrophobicContact CB-CD1 3.76Å; C43-A52 CarbonylContact C-O 3.53Å; C43-A52 WeakPolarHBondContact CA-O 3.41Å; C43-C53 HydrophobicContact CB-CB 4.19Å; C43-C53 WeakPolarHBondContact CB-SG 3.27Å; C43-C53 WeakPolarHBondContact SG-CB 3.18Å; C43-C53 CovalentContact SG-SG 2.04Å; C43-C53 PolarHBondContact SG-SG 2.83Å
44	I	97.6	Very high	96.7	Very high	16 Å²	16	51.3 Å²	51.3	8%	0.082	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126.6	178.1	-56.6	84.8	0	0	0	107.9	H24 Y42 L51 A52 I61 I76 L80	H24-I44 WeakPolarHBondContact O-CA 3.38Å; Y42-I44 HydrophobicContact CD1-CD1 4.11Å; Y42-I44 HydrophobicContact CE1-CD1 3.67Å; Y42-I44 HydrophobicContact CE1-CG1 4.41Å; I44-L51 WeakPolarHBondContact O-CA 3.4Å; I44-L51 WeakPolarHBondContact O-CB 3.22Å; I44-L51 PolarHBondContact O-N 2.91Å; I44-A52 PolarHBondContact N-O 2.74Å; I44-A52 PolarHBondContact O-N 2.79Å; I44-I61 HydrophobicContact CD1-CG2 4.36Å; I44-I76 HydrophobicContact CG2-CG2 4.32Å; I44-L80 HydrophobicContact CD1-CD1 3.46Å; I44-L80 VanDerWaalsContact CD1-CD1 3.46Å; I44-L80 HydrophobicContact CG1-CD1 3.86Å
45	S	97.1	Very high	96.9	Very high	14 Å²	14	45.9 Å²	45.9	10%	0.098	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.8	178.2	-48.3	0	0	0	0	110.6	A23 H24 D49 L50	A23-S45 CarbonylContact C-O 3.56Å; A23-S45 WeakPolarHBondContact CA-O 3.34Å; H24-S45 PolarHBondContact N-O 3.08Å; H24-S45 PolarHBondContact O-N 3.3Å; S45-D49 CarbonylContact C-O 3.52Å; S45-D49 WeakPolarHBondContact CA-O 3.49Å; S45-D49 WeakPolarHBondContact CB-O 3.39Å; S45-L50 VanDerWaalsContact OG-CD1 3.29Å; S45-L50 WeakPolarHBondContact OG-CD1 3.33Å
46	F	95.5	Very high	96.9	Very high	33 Å²	33	49.6 Å²	49.6	15%	0.145	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129	175.4	-175.8	-100.2	0	0	0	110.1	L11 F21 A23 K48 D49 L51	L11-F46 HydrophobicContact CD2-CE2 3.91Å; L11-F46 HydrophobicContact CD2-CZ 4.08Å; F21-F46 HydrophobicContact CB-CE1 4.2Å; F21-F46 HydrophobicContact CB-CE2 3.82Å; F21-F46 HydrophobicContact CB-CZ 3.45Å; F21-F46 VanDerWaalsContact CB-CZ 3.45Å; F21-F46 AromaticContact CD1-CE1 3.96Å; F21-F46 HydrophobicContact CD1-CE1 3.96Å; F21-F46 AromaticContact CD1-CZ 4Å; F21-F46 HydrophobicContact CD1-CZ 4Å; F21-F46 HydrophobicContact CD2-CZ 4.1Å; F21-F46 HydrophobicContact CG-CE1 4.04Å; F21-F46 HydrophobicContact CG-CE2 4.45Å; F21-F46 AromaticContact CG-CZ 3.59Å; F21-F46 HydrophobicContact CG-CZ 3.59Å; A23-F46 HydrophobicContact CB-CD2 4.19Å; F46-K48 PolarHBondContact O-N 2.89Å; F46-D49 PolarHBondContact N-O 3.17Å; F46-D49 WeakPolarHBondContact O-CA 3.47Å; F46-D49 VanDerWaalsContact O-CB 3.22Å; F46-D49 WeakPolarHBondContact O-CB 3.34Å; F46-D49 PolarHBondContact O-N 3.37Å; F46-L51 HydrophobicContact CB-CD1 3.59Å; F46-L51 HydrophobicContact CB-CG 4.14Å
47	N	93.4	Very high	96.8	Very high	88 Å²	88	55.3 Å²	55.3	47%	0.471	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	40	-178.8	-162.2	42.1	0	0	0	113.7	F21 V22 D49	F21-N47 HydrophobicContact CD1-CB 3.97Å; V22-N47 PolarHBondContact O-N 3.27Å; N47-D49 PolarHBondContact O-N 3.43Å
48	K	94.4	Very high	96.7	Very high	193 Å²	193	59.5 Å²	59.5	84%	0.839	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	10.8	-172.5	-59.2	-173.3	171.8	-172.9	0	115.7	F46	F46-K48 PolarHBondContact O-N 2.89Å
49	D	95.4	Very high	96.7	Very high	48 Å²	48	54.6 Å²	54.6	26%	0.257	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.1	173.7	-157.9	-15.5	0	0	0	110.2	S45 F46 N47 L51 L69	S45-D49 CarbonylContact C-O 3.52Å; S45-D49 WeakPolarHBondContact CA-O 3.49Å; S45-D49 WeakPolarHBondContact CB-O 3.39Å; F46-D49 PolarHBondContact N-O 3.17Å; F46-D49 WeakPolarHBondContact O-CA 3.47Å; F46-D49 VanDerWaalsContact O-CB 3.22Å; F46-D49 WeakPolarHBondContact O-CB 3.34Å; F46-D49 PolarHBondContact O-N 3.37Å; N47-D49 PolarHBondContact O-N 3.43Å; D49-L51 PolarHBondContact O-N 3.13Å; D49-L69 HydrophobicContact CB-CD1 4.04Å
50	L	97.5	Very high	96.7	Very high	74 Å²	74	55.3 Å²	55.3	39%	0.387	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	102.1	-173.3	179.1	67.3	0	0	0	109.8	C43 S45 C64 E65	C43-L50 HydrophobicContact CB-CD1 3.76Å; S45-L50 VanDerWaalsContact OG-CD1 3.29Å; S45-L50 WeakPolarHBondContact OG-CD1 3.33Å; L50-C64 HydrophobicContact CD2-CB 4.36Å; L50-C64 HydrophobicContact CG-CB 4.29Å; L50-E65 VanDerWaalsContact O-CB 3.28Å; L50-E65 WeakPolarHBondContact O-CB 3.22Å; L50-E65 PolarHBondContact O-N 2.99Å
51	L	97.2	Very high	96.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-54	-170.1	-59	-173.4	0	0	0	113.1	I44 F46 D49 C64 E65 L69 L72 A73 I76	I44-L51 WeakPolarHBondContact O-CA 3.4Å; I44-L51 WeakPolarHBondContact O-CB 3.22Å; I44-L51 PolarHBondContact O-N 2.91Å; F46-L51 HydrophobicContact CB-CD1 3.59Å; F46-L51 HydrophobicContact CB-CG 4.14Å; D49-L51 PolarHBondContact O-N 3.13Å; L51-C64 PolarHBondContact O-N 3.27Å; L51-E65 HydrophobicContact CD2-CB 4.2Å; L51-E65 HydrophobicContact CD2-CG 4.26Å; L51-E65 PolarHBondContact O-N 2.78Å; L51-L69 HydrophobicContact CD2-CB 3.8Å; L51-L69 HydrophobicContact CD2-CD1 3.94Å; L51-L72 HydrophobicContact CD1-CD2 3.87Å; L51-L72 HydrophobicContact CD1-CG 4.04Å; L51-A73 HydrophobicContact CB-CB 4.12Å; L51-A73 WeakPolarHBondContact O-CB 3.07Å; L51-I76 HydrophobicContact CD1-CD1 3.53Å
52	A	97.8	Very high	96.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	147.2	-172.5	0	0	0	0	0	111.7	C43 I44 I61 V62 S77	C43-A52 CarbonylContact C-O 3.53Å; C43-A52 WeakPolarHBondContact CA-O 3.41Å; I44-A52 PolarHBondContact N-O 2.74Å; I44-A52 PolarHBondContact O-N 2.79Å; A52-I61 HydrophobicContact CB-CG2 3.81Å; A52-V62 CarbonylContact C-O 3.52Å; A52-V62 VanDerWaalsContact CA-O 3.22Å; A52-V62 WeakPolarHBondContact CA-O 3.2Å; A52-V62 WeakPolarHBondContact CB-O 3.49Å; A52-S77 WeakPolarHBondContact CB-OG 3.48Å
53	C	98.3	Very high	96.6	Very high	20 Å²	20	54.3 Å²	54.3	14%	0.135	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	152	179.8	-70.3	0	0	0	0	111.6	Y42 C43 D55 I61 V62	Y42-C53 CarbonylContact O-C 3.39Å; Y42-C53 VanDerWaalsContact O-CA 3.3Å; Y42-C53 WeakPolarHBondContact O-CA 3.33Å; C43-C53 HydrophobicContact CB-CB 4.19Å; C43-C53 WeakPolarHBondContact CB-SG 3.27Å; C43-C53 WeakPolarHBondContact SG-CB 3.18Å; C43-C53 CovalentContact SG-SG 2.04Å; C43-C53 PolarHBondContact SG-SG 2.83Å; C53-D55 PolarHBondContact O-N 2.93Å; C53-I61 CarbonylContact O-C 3.55Å; C53-I61 WeakPolarHBondContact O-CA 3.25Å; C53-V62 PolarHBondContact N-O 3.19Å; C53-V62 PolarHBondContact O-N 3.44Å
54	W	98.2	Very high	96.5	Very high	19 Å²	19	55.7 Å²	55.7	7%	0.072	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	123.6	168.9	173.9	-108.4	0	0	0	110.4	Y42 G59 I61 I87 L90 K91	Y42-W54 PolarHBondContact O-N 3.25Å; W54-G59 VanDerWaalsContact CH2-O 3.25Å; W54-G59 WeakPolarHBondContact CH2-O 3.31Å; W54-G59 WeakPolarHBondContact CZ3-O 3.36Å; W54-I61 HydrophobicContact CB-CG1 4.47Å; W54-I61 HydrophobicContact CE3-CG1 3.94Å; W54-I87 HydrophobicContact CE3-CD1 4.44Å; W54-I87 HydrophobicContact CH2-CG2 4.15Å; W54-I87 HydrophobicContact CZ3-CD1 3.79Å; W54-I87 HydrophobicContact CZ3-CG2 4.16Å; W54-L90 HydrophobicContact CB-CD1 4.18Å; W54-L90 HydrophobicContact CD2-CB 3.63Å; W54-L90 HydrophobicContact CD2-CD1 3.87Å; W54-L90 HydrophobicContact CD2-CG 4.35Å; W54-L90 HydrophobicContact CE3-CB 3.82Å; W54-L90 HydrophobicContact CE3-CD1 3.57Å; W54-L90 HydrophobicContact CE3-CG 4.35Å; W54-L90 HydrophobicContact CG-CB 4.13Å; W54-L90 HydrophobicContact CG-CD1 4.14Å; W54-L90 HydrophobicContact CH2-CB 4.15Å; W54-L90 HydrophobicContact CZ2-CB 4Å; W54-L90 HydrophobicContact CZ3-CB 4.08Å; W54-L90 HydrophobicContact CZ3-CD1 4.23Å; W54-K91 HydrophobicContact CH2-CG 3.83Å; W54-K91 HydrophobicContact CZ2-CG 3.9Å
55	D	97.6	Very high	96.2	Very high	40 Å²	40	56.8 Å²	56.8	21%	0.214	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	111.3	169.6	-170.6	-36.9	0	0	0	108.8	C53 E57 E58 G59 Q60 V62	C53-D55 PolarHBondContact O-N 2.93Å; D55-E57 VanDerWaalsContact C-N 3.3Å; D55-E57 PolarHBondContact O-N 2.76Å; D55-E57 WeakPolarHBondContact OD1-CA 2.98Å; D55-E57 WeakPolarHBondContact OD1-CB 3.4Å; D55-E57 PolarHBondContact OD1-N 2.81Å; D55-E58 HydrophobicContact CB-CB 4.2Å; D55-E58 HydrophobicContact CB-CG 4.49Å; D55-E58 PolarHBondContact OD1-N 2.88Å; D55-E58 VanDerWaalsContact OD1-N 3.16Å; D55-G59 WeakPolarHBondContact O-CA 3.36Å; D55-G59 PolarHBondContact O-N 3.09Å; D55-Q60 PolarHBondContact N-O 3.28Å; D55-Q60 PolarHBondContact O-N 2.92Å; D55-V62 HydrophobicContact CB-CG1 3.89Å; D55-V62 HydrophobicContact CB-CG2 3.89Å
56	P	95.6	Very high	96	Very high	89 Å²	89	64.1 Å²	64.1	58%	0.578	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-24.5	179.8	28.6	-33.8	0	0	0	113.4
57	E	94.9	Very high	96	Very high	190 Å²	190	64.6 Å²	64.6	89%	0.888	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-43.8	179.3	-60.5	-171.3	176	0	0	110.9	D55 G59	D55-E57 VanDerWaalsContact C-N 3.3Å; D55-E57 PolarHBondContact O-N 2.76Å; D55-E57 WeakPolarHBondContact OD1-CA 2.98Å; D55-E57 WeakPolarHBondContact OD1-CB 3.4Å; D55-E57 PolarHBondContact OD1-N 2.81Å; E57-G59 VanDerWaalsContact C-N 3.33Å
58	E	94.7	Very high	96	Very high	122 Å²	122	67.4 Å²	67.4	57%	0.57	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.7	175.1	-63.2	-164.5	179	0	0	112.6	D55 Q60 V62	D55-E58 HydrophobicContact CB-CB 4.2Å; D55-E58 HydrophobicContact CB-CG 4.49Å; D55-E58 PolarHBondContact OD1-N 2.88Å; D55-E58 VanDerWaalsContact OD1-N 3.16Å; E58-Q60 VanDerWaalsContact C-N 3.27Å; E58-Q60 PolarHBondContact O-N 2.9Å; E58-V62 VanDerWaalsContact OE2-CG1 3.31Å; E58-V62 WeakPolarHBondContact OE2-CG1 3.35Å
59	G	96.1	Very high	96	Very high	17 Å²	17	60.5 Å²	60.5	18%	0.175	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	30.5	-174.9	0	0	0	0	0	112.6	W54 D55 E57	W54-G59 VanDerWaalsContact CH2-O 3.25Å; W54-G59 WeakPolarHBondContact CH2-O 3.31Å; W54-G59 WeakPolarHBondContact CZ3-O 3.36Å; D55-G59 WeakPolarHBondContact O-CA 3.36Å; D55-G59 PolarHBondContact O-N 3.09Å; E57-G59 VanDerWaalsContact C-N 3.33Å
60	Q	97.1	Very high	96.1	Very high	100 Å²	100	61.2 Å²	61.2	47%	0.467	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	159.3	-177.1	-62.9	-173.8	26	0	0	110.9	D55 E58	D55-Q60 PolarHBondContact N-O 3.28Å; D55-Q60 PolarHBondContact O-N 2.92Å; E58-Q60 VanDerWaalsContact C-N 3.27Å; E58-Q60 PolarHBondContact O-N 2.9Å
61	I	97.9	Very high	96	Very high	2 Å²	2	66 Å²	66	1%	0.01	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.6	167.3	-62.8	168.1	0	0	0	107.9	Y42 I44 A52 C53 W54 S77 L80 N81 L86 I87 L90	Y42-I61 HydrophobicContact CD1-CD1 4.27Å; Y42-I61 HydrophobicContact CE1-CD1 4.11Å; I44-I61 HydrophobicContact CD1-CG2 4.36Å; A52-I61 HydrophobicContact CB-CG2 3.81Å; C53-I61 CarbonylContact O-C 3.55Å; C53-I61 WeakPolarHBondContact O-CA 3.25Å; W54-I61 HydrophobicContact CB-CG1 4.47Å; W54-I61 HydrophobicContact CE3-CG1 3.94Å; I61-S77 WeakPolarHBondContact O-CB 3.22Å; I61-L80 HydrophobicContact CD1-CB 3.52Å; I61-L80 HydrophobicContact CD1-CD1 3.91Å; I61-L80 HydrophobicContact CD1-CG 4.35Å; I61-N81 PolarHBondContact N-OD1 3.25Å; I61-N81 PolarHBondContact O-ND2 3.12Å; I61-L86 HydrophobicContact CD1-CD2 3.99Å; I61-I87 HydrophobicContact CD1-CD1 4.44Å; I61-I87 HydrophobicContact CG1-CD1 4.46Å; I61-L90 HydrophobicContact CD1-CD1 3.81Å; I61-L90 HydrophobicContact CG1-CD1 3.99Å
62	V	97.6	Very high	95.9	Very high	29 Å²	29	68.9 Å²	68.9	18%	0.176	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	144.2	-176.2	-59.4	0	0	0	0	111.1	A52 C53 D55 E58	A52-V62 CarbonylContact C-O 3.52Å; A52-V62 VanDerWaalsContact CA-O 3.22Å; A52-V62 WeakPolarHBondContact CA-O 3.2Å; A52-V62 WeakPolarHBondContact CB-O 3.49Å; C53-V62 PolarHBondContact N-O 3.19Å; C53-V62 PolarHBondContact O-N 3.44Å; D55-V62 HydrophobicContact CB-CG1 3.89Å; D55-V62 HydrophobicContact CB-CG2 3.89Å; E58-V62 VanDerWaalsContact OE2-CG1 3.31Å; E58-V62 WeakPolarHBondContact OE2-CG1 3.35Å
63	P	97.5	Very high	95.9	Very high	29 Å²	29	68.9 Å²	68.9	19%	0.188	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	135.2	171.8	-22.1	33.5	0	0	0	112.4	Y66 F70 A73 E74	P63-Y66 PolarHBondContact O-OH 3.23Å; P63-F70 HydrophobicContact CB-CE2 4.49Å; P63-A73 HydrophobicContact CB-CB 4.01Å; P63-E74 HydrophobicContact CG-CG 4.1Å
64	C	95.4	Very high	95.8	Very high	46 Å²	46	71.6 Å²	71.6	31%	0.311	37%	0.371	S	S	.	.			trans	-109.3	-29.4	175.1	-57.9	0	0	0	0	112.7	L50 L51 Y66	L50-C64 HydrophobicContact CD2-CB 4.36Å; L50-C64 HydrophobicContact CG-CB 4.29Å; L51-C64 PolarHBondContact O-N 3.27Å; C64-Y66 WeakPolarHBondContact O-CD2 3.41Å; C64-Y66 WeakPolarHBondContact O-CE2 3.39Å
65	E	91.3	Very high	95.7	Very high	40 Å²	40	76.1 Å²	76.1	19%	0.187	39%	0.391	C	S	.	.			trans	-89.9	114.6	-179.1	172.2	50.2	-151.7	0	0	111.1	L50 L51 G67 L69 F70 A73	L50-E65 VanDerWaalsContact O-CB 3.28Å; L50-E65 WeakPolarHBondContact O-CB 3.22Å; L50-E65 PolarHBondContact O-N 2.99Å; L51-E65 HydrophobicContact CD2-CB 4.2Å; L51-E65 HydrophobicContact CD2-CG 4.26Å; L51-E65 PolarHBondContact O-N 2.78Å; E65-G67 WeakPolarHBondContact OE1-CA 3.33Å; E65-G67 PolarHBondContact OE1-N 3.46Å; E65-L69 HydrophobicContact CG-CB 3.96Å; E65-F70 VanDerWaalsContact O-CA 3.27Å; E65-F70 WeakPolarHBondContact O-CA 3.3Å; E65-F70 VanDerWaalsContact O-CD2 3.31Å; E65-F70 WeakPolarHBondContact O-CD2 3.39Å; E65-A73 HydrophobicContact CB-CB 4.41Å
66	Y	92.4	Very high	95.6	Very high	167 Å²	167	75.6 Å²	75.6	66%	0.655	39%	0.389	S	S	*	.			trans	-107.2	9	-178.1	-64.4	-84.1	0	0	0	113.8	P63 C64 F70	P63-Y66 PolarHBondContact O-OH 3.23Å; C64-Y66 WeakPolarHBondContact O-CD2 3.41Å; C64-Y66 WeakPolarHBondContact O-CE2 3.39Å; Y66-F70 AromaticContact CD1-CD2 3.64Å; Y66-F70 HydrophobicContact CD1-CD2 3.64Å; Y66-F70 AromaticContact CD1-CE2 3.5Å; Y66-F70 HydrophobicContact CD1-CE2 3.5Å; Y66-F70 VanDerWaalsContact CD1-CE2 3.5Å; Y66-F70 HydrophobicContact CD1-CZ 4.49Å; Y66-F70 HydrophobicContact CE1-CD2 4.2Å; Y66-F70 AromaticContact CE1-CE2 3.67Å; Y66-F70 HydrophobicContact CE1-CE2 3.67Å; Y66-F70 HydrophobicContact CG-CD2 4.32Å
67	G	95.2	Very high	95.7	Very high	44 Å²	44	71.5 Å²	71.5	45%	0.454	36%	0.362	S	S	.	.	S	Bend	trans	-94.2	-134.3	177.1	0	0	0	0	0	113	E65 L69 F70	E65-G67 WeakPolarHBondContact OE1-CA 3.33Å; E65-G67 PolarHBondContact OE1-N 3.46Å; G67-L69 PolarHBondContact O-N 3.05Å; G67-F70 WeakPolarHBondContact O-CB 3.36Å; G67-F70 PolarHBondContact O-N 3.39Å
68	V	94.9	Very high	95.8	Very high	146 Å²	146	66.9 Å²	66.9	89%	0.885	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-32.4	-170.5	178.4	0	0	0	0	111.7
69	L	94.6	Very high	95.8	Very high	48 Å²	48	64.4 Å²	64.4	25%	0.251	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	10.7	-177.3	-58.9	-178.1	0	0	0	113.5	D49 L51 E65 G67 K71 L72 A73	D49-L69 HydrophobicContact CB-CD1 4.04Å; L51-L69 HydrophobicContact CD2-CB 3.8Å; L51-L69 HydrophobicContact CD2-CD1 3.94Å; E65-L69 HydrophobicContact CG-CB 3.96Å; G67-L69 PolarHBondContact O-N 3.05Å; L69-K71 VanDerWaalsContact C-N 3.34Å; L69-K71 PolarHBondContact O-N 3.31Å; L69-L72 HydrophobicContact CB-CB 4.5Å; L69-L72 HydrophobicContact CD2-CD2 4.43Å; L69-L72 WeakPolarHBondContact O-CA 3.31Å; L69-L72 VanDerWaalsContact O-CB 3.3Å; L69-L72 WeakPolarHBondContact O-CB 3.21Å; L69-L72 PolarHBondContact O-N 2.94Å; L69-A73 PolarHBondContact O-N 2.99Å
70	F	96.1	Very high	95.9	Very high	63 Å²	63	65 Å²	65	28%	0.276	33%	0.332	S	S	.	.	H	α-helix	trans	-53	-46.1	-178.6	175.9	-109.2	0	0	0	113.8	P63 E65 Y66 G67 L72 A73 E74	P63-F70 HydrophobicContact CB-CE2 4.49Å; E65-F70 VanDerWaalsContact O-CA 3.27Å; E65-F70 WeakPolarHBondContact O-CA 3.3Å; E65-F70 VanDerWaalsContact O-CD2 3.31Å; E65-F70 WeakPolarHBondContact O-CD2 3.39Å; Y66-F70 AromaticContact CD1-CD2 3.64Å; Y66-F70 HydrophobicContact CD1-CD2 3.64Å; Y66-F70 AromaticContact CD1-CE2 3.5Å; Y66-F70 HydrophobicContact CD1-CE2 3.5Å; Y66-F70 VanDerWaalsContact CD1-CE2 3.5Å; Y66-F70 HydrophobicContact CD1-CZ 4.49Å; Y66-F70 HydrophobicContact CE1-CD2 4.2Å; Y66-F70 AromaticContact CE1-CE2 3.67Å; Y66-F70 HydrophobicContact CE1-CE2 3.67Å; Y66-F70 HydrophobicContact CG-CD2 4.32Å; G67-F70 WeakPolarHBondContact O-CB 3.36Å; G67-F70 PolarHBondContact O-N 3.39Å; F70-L72 PolarHBondContact O-N 3.33Å; F70-A73 WeakPolarHBondContact O-CB 3.29Å; F70-A73 PolarHBondContact O-N 2.82Å; F70-A73 VanDerWaalsContact O-N 3.09Å; F70-E74 HydrophobicContact CD1-CG 4.43Å; F70-E74 HydrophobicContact CD2-CG 4.35Å; F70-E74 HydrophobicContact CE1-CG 3.9Å; F70-E74 WeakPolarHBondContact CE1-OE2 3.46Å; F70-E74 HydrophobicContact CE2-CG 3.82Å; F70-E74 HydrophobicContact CZ-CG 3.57Å; F70-E74 PolarHBondContact O-N 3.32Å
71	K	96	Very high	95.9	Very high	174 Å²	174	62.2 Å²	62.2	76%	0.757	32%	0.321	S	S	*	.	H	α-helix	trans	-60.7	-33.5	177.1	-70.5	-172.4	177.7	-178.4	0	112.9	L69 F75	L69-K71 VanDerWaalsContact C-N 3.34Å; L69-K71 PolarHBondContact O-N 3.31Å; K71-F75 VanDerWaalsContact O-CB 3.27Å; K71-F75 WeakPolarHBondContact O-CB 3.28Å; K71-F75 PolarHBondContact O-N 3.49Å
72	L	95.1	Very high	95.8	Very high	61 Å²	61	70.1 Å²	70.1	32%	0.319	36%	0.355	S	S	.	.	H	α-helix	trans	-72.6	-41.9	176.2	-179.5	64	0	0	0	110.4	L51 L69 F70 F75 I76	L51-L72 HydrophobicContact CD1-CD2 3.87Å; L51-L72 HydrophobicContact CD1-CG 4.04Å; L69-L72 HydrophobicContact CB-CB 4.5Å; L69-L72 HydrophobicContact CD2-CD2 4.43Å; L69-L72 WeakPolarHBondContact O-CA 3.31Å; L69-L72 VanDerWaalsContact O-CB 3.3Å; L69-L72 WeakPolarHBondContact O-CB 3.21Å; L69-L72 PolarHBondContact O-N 2.94Å; F70-L72 PolarHBondContact O-N 3.33Å; L72-F75 PolarHBondContact O-N 2.89Å; L72-I76 HydrophobicContact CD1-CD1 4.04Å; L72-I76 HydrophobicContact CD1-CG1 4.28Å; L72-I76 HydrophobicContact CG-CD1 3.96Å; L72-I76 WeakPolarHBondContact O-CB 3.22Å; L72-I76 WeakPolarHBondContact O-CG1 3.42Å; L72-I76 PolarHBondContact O-N 2.93Å
73	A	97.1	Very high	95.8	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-59.6	-46.5	174.6	0	0	0	0	0	112.2	L51 P63 E65 L69 F70 I76 S77	L51-A73 HydrophobicContact CB-CB 4.12Å; L51-A73 WeakPolarHBondContact O-CB 3.07Å; P63-A73 HydrophobicContact CB-CB 4.01Å; E65-A73 HydrophobicContact CB-CB 4.41Å; L69-A73 PolarHBondContact O-N 2.99Å; F70-A73 WeakPolarHBondContact O-CB 3.29Å; F70-A73 PolarHBondContact O-N 2.82Å; F70-A73 VanDerWaalsContact O-N 3.09Å; A73-I76 PolarHBondContact O-N 2.81Å; A73-S77 WeakPolarHBondContact O-CB 3.18Å; A73-S77 PolarHBondContact O-N 2.8Å; A73-S77 PolarHBondContact O-OG 3.23Å
74	E	97.1	Very high	95.7	Very high	78 Å²	78	80.2 Å²	80.2	36%	0.364	40%	0.398	S	S	.	.	H	α-helix	trans	-60.5	-46	173.4	-73.9	-170.3	109.8	0	0	111.9	P63 F70 I76 S77 N78	P63-E74 HydrophobicContact CG-CG 4.1Å; F70-E74 HydrophobicContact CD1-CG 4.43Å; F70-E74 HydrophobicContact CD2-CG 4.35Å; F70-E74 HydrophobicContact CE1-CG 3.9Å; F70-E74 WeakPolarHBondContact CE1-OE2 3.46Å; F70-E74 HydrophobicContact CE2-CG 3.82Å; F70-E74 HydrophobicContact CZ-CG 3.57Å; F70-E74 PolarHBondContact O-N 3.32Å; E74-I76 PolarHBondContact O-N 2.76Å; E74-S77 PolarHBondContact O-N 2.95Å; E74-N78 VanDerWaalsContact O-CB 3.3Å; E74-N78 WeakPolarHBondContact O-CB 3.5Å; E74-N78 VanDerWaalsContact O-CG 3.26Å; E74-N78 PolarHBondContact O-N 2.84Å; E74-N78 PolarHBondContact O-ND2 3.42Å
75	F	96.2	Very high	95.7	Very high	113 Å²	113	80.5 Å²	80.5	50%	0.496	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-45.8	179.9	178.7	-104	0	0	0	112	K71 L72 I79	K71-F75 VanDerWaalsContact O-CB 3.27Å; K71-F75 WeakPolarHBondContact O-CB 3.28Å; K71-F75 PolarHBondContact O-N 3.49Å; L72-F75 PolarHBondContact O-N 2.89Å; F75-I79 HydrophobicContact CD1-CD1 3.79Å; F75-I79 HydrophobicContact CD2-CD1 4.34Å; F75-I79 HydrophobicContact CE1-CD1 3.27Å; F75-I79 HydrophobicContact CE2-CD1 3.89Å; F75-I79 HydrophobicContact CG-CD1 4.32Å; F75-I79 HydrophobicContact CZ-CD1 3.34Å; F75-I79 HydrophobicContact CZ-CG1 4.46Å; F75-I79 WeakPolarHBondContact O-CG1 3.27Å; F75-I79 PolarHBondContact O-N 2.79Å
76	I	95.2	Very high	96	Very high	30 Å²	30	79.6 Å²	79.6	15%	0.154	41%	0.405	C	S	.	.	H	α-helix	trans	-64.7	-48.6	178	-71.6	173.5	0	0	0	110.7	I44 L51 L72 A73 E74 N78 I79 L80	I44-I76 HydrophobicContact CG2-CG2 4.32Å; L51-I76 HydrophobicContact CD1-CD1 3.53Å; L72-I76 HydrophobicContact CD1-CD1 4.04Å; L72-I76 HydrophobicContact CD1-CG1 4.28Å; L72-I76 HydrophobicContact CG-CD1 3.96Å; L72-I76 WeakPolarHBondContact O-CB 3.22Å; L72-I76 WeakPolarHBondContact O-CG1 3.42Å; L72-I76 PolarHBondContact O-N 2.93Å; A73-I76 PolarHBondContact O-N 2.81Å; E74-I76 PolarHBondContact O-N 2.76Å; I76-N78 VanDerWaalsContact C-N 3.3Å; I76-N78 PolarHBondContact O-N 3.41Å; I76-I79 PolarHBondContact O-N 3.25Å; I76-I79 VanDerWaalsContact O-N 3.11Å; I76-L80 HydrophobicContact CG2-CD1 3.64Å; I76-L80 HydrophobicContact CG2-CG 4.19Å; I76-L80 WeakPolarHBondContact O-CG 3.41Å; I76-L80 PolarHBondContact O-N 2.93Å
77	S	97	Very high	96.2	Very high	3 Å²	3	72.5 Å²	72.5	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-55.3	-47.5	178.2	-57.6	0	0	0	0	111	A52 I61 A73 E74 I79 L80 N81	A52-S77 WeakPolarHBondContact CB-OG 3.48Å; I61-S77 WeakPolarHBondContact O-CB 3.22Å; A73-S77 WeakPolarHBondContact O-CB 3.18Å; A73-S77 PolarHBondContact O-N 2.8Å; A73-S77 PolarHBondContact O-OG 3.23Å; E74-S77 PolarHBondContact O-N 2.95Å; S77-I79 VanDerWaalsContact C-N 3.35Å; S77-I79 PolarHBondContact O-N 3.03Å; S77-L80 PolarHBondContact O-N 3.07Å; S77-N81 WeakPolarHBondContact O-CB 3.45Å; S77-N81 VanDerWaalsContact O-CG 3.24Å; S77-N81 PolarHBondContact O-N 3.28Å; S77-N81 PolarHBondContact O-ND2 3.33Å
78	N	96.7	Very high	96.3	Very high	93 Å²	93	75.2 Å²	75.2	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-34.9	177.9	-78	-43.5	0	0	0	114	E74 I76 K82	E74-N78 VanDerWaalsContact O-CB 3.3Å; E74-N78 WeakPolarHBondContact O-CB 3.5Å; E74-N78 VanDerWaalsContact O-CG 3.26Å; E74-N78 PolarHBondContact O-N 2.84Å; E74-N78 PolarHBondContact O-ND2 3.42Å; I76-N78 VanDerWaalsContact C-N 3.3Å; I76-N78 PolarHBondContact O-N 3.41Å; N78-K82 WeakPolarHBondContact O-CD 3.07Å; N78-K82 WeakPolarHBondContact O-CG 3.07Å
79	I	96.1	Very high	96.4	Very high	70 Å²	70	74.3 Å²	74.3	36%	0.359	36%	0.359	S	S	.	.	H	α-helix	trans	-70.4	-47.4	175.9	-74.6	173.3	0	0	0	110.3	F75 I76 S77 N81 K82	F75-I79 HydrophobicContact CD1-CD1 3.79Å; F75-I79 HydrophobicContact CD2-CD1 4.34Å; F75-I79 HydrophobicContact CE1-CD1 3.27Å; F75-I79 HydrophobicContact CE2-CD1 3.89Å; F75-I79 HydrophobicContact CG-CD1 4.32Å; F75-I79 HydrophobicContact CZ-CD1 3.34Å; F75-I79 HydrophobicContact CZ-CG1 4.46Å; F75-I79 WeakPolarHBondContact O-CG1 3.27Å; F75-I79 PolarHBondContact O-N 2.79Å; I76-I79 PolarHBondContact O-N 3.25Å; I76-I79 VanDerWaalsContact O-N 3.11Å; S77-I79 VanDerWaalsContact C-N 3.35Å; S77-I79 PolarHBondContact O-N 3.03Å; I79-N81 VanDerWaalsContact C-N 3.35Å; I79-N81 PolarHBondContact O-N 3.33Å; I79-K82 PolarHBondContact O-N 2.83Å
80	L	96.9	Very high	96.5	Very high	28 Å²	28	72.1 Å²	72.1	15%	0.147	35%	0.348	C	S	.	.	H	α-helix	trans	-69.2	-35.3	-175.5	-62.7	176.5	0	0	0	111.8	I44 I61 I76 S77 K82 E83 L86	I44-L80 HydrophobicContact CD1-CD1 3.46Å; I44-L80 VanDerWaalsContact CD1-CD1 3.46Å; I44-L80 HydrophobicContact CG1-CD1 3.86Å; I61-L80 HydrophobicContact CD1-CB 3.52Å; I61-L80 HydrophobicContact CD1-CD1 3.91Å; I61-L80 HydrophobicContact CD1-CG 4.35Å; I76-L80 HydrophobicContact CG2-CD1 3.64Å; I76-L80 HydrophobicContact CG2-CG 4.19Å; I76-L80 WeakPolarHBondContact O-CG 3.41Å; I76-L80 PolarHBondContact O-N 2.93Å; S77-L80 PolarHBondContact O-N 3.07Å; L80-K82 PolarHBondContact O-N 3.18Å; L80-E83 PolarHBondContact O-N 2.96Å; L80-E83 VanDerWaalsContact O-N 3.08Å; L80-L86 HydrophobicContact CB-CD2 3.92Å; L80-L86 HydrophobicContact CD2-CD2 3.82Å; L80-L86 HydrophobicContact CG-CD2 4.36Å
81	N	97.5	Very high	96.6	Very high	43 Å²	43	75 Å²	75	23%	0.23	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.3	174.3	-73	-26.1	0	0	0	114	I61 S77 I79 I87	I61-N81 PolarHBondContact N-OD1 3.25Å; I61-N81 PolarHBondContact O-ND2 3.12Å; S77-N81 WeakPolarHBondContact O-CB 3.45Å; S77-N81 VanDerWaalsContact O-CG 3.24Å; S77-N81 PolarHBondContact O-N 3.28Å; S77-N81 PolarHBondContact O-ND2 3.33Å; I79-N81 VanDerWaalsContact C-N 3.35Å; I79-N81 PolarHBondContact O-N 3.33Å; N81-I87 WeakPolarHBondContact OD1-CD1 3.36Å
82	K	97.1	Very high	96.6	Very high	168 Å²	168	70.9 Å²	70.9	73%	0.73	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-13.9	173.9	-69.7	171.6	-175.4	179.2	0	113.3	N78 I79 L80 E84	N78-K82 WeakPolarHBondContact O-CD 3.07Å; N78-K82 WeakPolarHBondContact O-CG 3.07Å; I79-K82 PolarHBondContact O-N 2.83Å; L80-K82 PolarHBondContact O-N 3.18Å; K82-E84 PolarHBondContact O-N 2.95Å
83	E	96.5	Very high	96.7	Very high	101 Å²	101	68 Å²	68	47%	0.472	33%	0.332	S	S	.	.			trans	-87.4	91.5	179.6	-173.1	74.9	-168.4	0	0	109.7	L80 G85 L86 I87	L80-E83 PolarHBondContact O-N 2.96Å; L80-E83 VanDerWaalsContact O-N 3.08Å; E83-G85 PolarHBondContact O-N 2.82Å; E83-G85 VanDerWaalsContact O-N 3.17Å; E83-L86 HydrophobicContact CB-CB 4.03Å; E83-L86 HydrophobicContact CG-CB 3.85Å; E83-L86 WeakPolarHBondContact O-CB 3.42Å; E83-L86 PolarHBondContact O-N 2.04Å; E83-I87 PolarHBondContact O-N 3.05Å; E83-I87 VanDerWaalsContact O-N 3.13Å
84	E	95.4	Very high	96.7	Very high	169 Å²	169	71.8 Å²	71.8	79%	0.79	35%	0.352	S	S	*	.	H	α-helix	trans	-53.7	-39.7	-175.9	-64.9	-178.8	177.1	0	0	113.2	K82 L86 I87 Q88	K82-E84 PolarHBondContact O-N 2.95Å; E84-L86 VanDerWaalsContact C-N 3.33Å; E84-L86 PolarHBondContact O-N 2.84Å; E84-I87 PolarHBondContact O-N 2.91Å; E84-Q88 WeakPolarHBondContact O-CB 3.44Å; E84-Q88 PolarHBondContact O-N 3.46Å
85	G	96.4	Very high	96.6	Very high	51 Å²	51	74.1 Å²	74.1	53%	0.526	36%	0.363	S	S	.	.	H	α-helix	trans	-64.7	-34.7	178.8	0	0	0	0	0	113.4	E83 R89	E83-G85 PolarHBondContact O-N 2.82Å; E83-G85 VanDerWaalsContact O-N 3.17Å; G85-R89 WeakPolarHBondContact O-CB 3.47Å; G85-R89 PolarHBondContact O-N 3.16Å; G85-R89 VanDerWaalsContact O-N 3.15Å
86	L	96.6	Very high	96.6	Very high	22 Å²	22	72.4 Å²	72.4	12%	0.115	36%	0.359	C	S	.	.	H	α-helix	trans	-68.9	-51.1	174.6	175	62.5	0	0	0	110	Y42 I61 L80 E83 E84 Q88 R89 L90	Y42-L86 HydrophobicContact CE1-CD1 4.39Å; Y42-L86 HydrophobicContact CE2-CD1 4.49Å; I61-L86 HydrophobicContact CD1-CD2 3.99Å; L80-L86 HydrophobicContact CB-CD2 3.92Å; L80-L86 HydrophobicContact CD2-CD2 3.82Å; L80-L86 HydrophobicContact CG-CD2 4.36Å; E83-L86 HydrophobicContact CB-CB 4.03Å; E83-L86 HydrophobicContact CG-CB 3.85Å; E83-L86 WeakPolarHBondContact O-CB 3.42Å; E83-L86 PolarHBondContact O-N 2.04Å; E84-L86 VanDerWaalsContact C-N 3.33Å; E84-L86 PolarHBondContact O-N 2.84Å; L86-Q88 VanDerWaalsContact C-N 3.28Å; L86-Q88 PolarHBondContact O-N 3.24Å; L86-R89 WeakPolarHBondContact O-CB 3.31Å; L86-R89 PolarHBondContact O-N 3.34Å; L86-L90 HydrophobicContact CD1-CD1 4.1Å; L86-L90 HydrophobicContact CD1-CD2 4.35Å; L86-L90 HydrophobicContact CD1-CG 4.08Å; L86-L90 HydrophobicContact CG-CD1 4.07Å; L86-L90 HydrophobicContact CG-CG 4.39Å; L86-L90 WeakPolarHBondContact O-CG 3.36Å; L86-L90 PolarHBondContact O-N 3.48Å
87	I	97.3	Very high	96.8	Very high	18 Å²	18	71.1 Å²	71.1	9%	0.092	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-41	-178.9	-60.8	-62.6	0	0	0	111.1	W54 I61 N81 E83 E84 R89 L90 K91	W54-I87 HydrophobicContact CE3-CD1 4.44Å; W54-I87 HydrophobicContact CH2-CG2 4.15Å; W54-I87 HydrophobicContact CZ3-CD1 3.79Å; W54-I87 HydrophobicContact CZ3-CG2 4.16Å; I61-I87 HydrophobicContact CD1-CD1 4.44Å; I61-I87 HydrophobicContact CG1-CD1 4.46Å; N81-I87 WeakPolarHBondContact OD1-CD1 3.36Å; E83-I87 PolarHBondContact O-N 3.05Å; E83-I87 VanDerWaalsContact O-N 3.13Å; E84-I87 PolarHBondContact O-N 2.91Å; I87-R89 VanDerWaalsContact C-N 3.34Å; I87-R89 PolarHBondContact O-N 2.74Å; I87-L90 PolarHBondContact O-N 3.43Å; I87-K91 HydrophobicContact CG2-CD 4.41Å; I87-K91 WeakPolarHBondContact O-CG 3.41Å; I87-K91 PolarHBondContact O-N 3.49Å
88	Q	96.6	Very high	96.7	Very high	101 Å²	101	72.8 Å²	72.8	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-65	-37	176.2	-171.3	56.3	40.4	0	0	112.6	E84 L86 N92	E84-Q88 WeakPolarHBondContact O-CB 3.44Å; E84-Q88 PolarHBondContact O-N 3.46Å; L86-Q88 VanDerWaalsContact C-N 3.28Å; L86-Q88 PolarHBondContact O-N 3.24Å; Q88-N92 PolarHBondContact O-N 3.01Å
89	R	96.6	Very high	96.7	Very high	126 Å²	126	72.4 Å²	72.4	48%	0.475	37%	0.365	S	S	.	.	H	α-helix	trans	-64.2	-45.4	173.7	173.8	-177.1	150.1	-162.1	-11	111.3	G85 L86 I87 N92 G93	G85-R89 WeakPolarHBondContact O-CB 3.47Å; G85-R89 PolarHBondContact O-N 3.16Å; G85-R89 VanDerWaalsContact O-N 3.15Å; L86-R89 WeakPolarHBondContact O-CB 3.31Å; L86-R89 PolarHBondContact O-N 3.34Å; I87-R89 VanDerWaalsContact C-N 3.34Å; I87-R89 PolarHBondContact O-N 2.74Å; R89-N92 CarbonylContact O-C 3.59Å; R89-N92 PolarHBondContact O-N 2.81Å; R89-N92 VanDerWaalsContact O-N 3.12Å; R89-G93 PolarHBondContact O-N 3.02Å
90	L	97.5	Very high	96.8	Very high	3 Å²	3	75.2 Å²	75.2	2%	0.016	38%	0.376	C	S	.	.	H	α-helix	trans	-66.7	-37.6	-178.5	-61.7	179.6	0	0	0	112.4	F40 Y42 W54 I61 L86 I87 N92 G93	F40-L90 HydrophobicContact CE1-CB 4.44Å; F40-L90 HydrophobicContact CE1-CD2 3.89Å; F40-L90 HydrophobicContact CZ-CD2 3.78Å; Y42-L90 HydrophobicContact CD1-CD1 3.79Å; Y42-L90 HydrophobicContact CD1-CD2 3.99Å; Y42-L90 HydrophobicContact CD2-CD2 3.63Å; Y42-L90 HydrophobicContact CE1-CD1 4.26Å; Y42-L90 HydrophobicContact CE2-CD2 4.34Å; Y42-L90 HydrophobicContact CG-CD1 4.13Å; Y42-L90 HydrophobicContact CG-CD2 3.45Å; Y42-L90 VanDerWaalsContact CG-CD2 3.45Å; Y42-L90 HydrophobicContact CG-CG 4.45Å; W54-L90 HydrophobicContact CB-CD1 4.18Å; W54-L90 HydrophobicContact CD2-CB 3.63Å; W54-L90 HydrophobicContact CD2-CD1 3.87Å; W54-L90 HydrophobicContact CD2-CG 4.35Å; W54-L90 HydrophobicContact CE3-CB 3.82Å; W54-L90 HydrophobicContact CE3-CD1 3.57Å; W54-L90 HydrophobicContact CE3-CG 4.35Å; W54-L90 HydrophobicContact CG-CB 4.13Å; W54-L90 HydrophobicContact CG-CD1 4.14Å; W54-L90 HydrophobicContact CH2-CB 4.15Å; W54-L90 HydrophobicContact CZ2-CB 4Å; W54-L90 HydrophobicContact CZ3-CB 4.08Å; W54-L90 HydrophobicContact CZ3-CD1 4.23Å; I61-L90 HydrophobicContact CD1-CD1 3.81Å; I61-L90 HydrophobicContact CG1-CD1 3.99Å; L86-L90 HydrophobicContact CD1-CD1 4.1Å; L86-L90 HydrophobicContact CD1-CD2 4.35Å; L86-L90 HydrophobicContact CD1-CG 4.08Å; L86-L90 HydrophobicContact CG-CD1 4.07Å; L86-L90 HydrophobicContact CG-CG 4.39Å; L86-L90 WeakPolarHBondContact O-CG 3.36Å; L86-L90 PolarHBondContact O-N 3.48Å; I87-L90 PolarHBondContact O-N 3.43Å; L90-N92 PolarHBondContact O-N 3.49Å; L90-G93 PolarHBondContact O-N 2.93Å
91	K	96.7	Very high	96.8	Very high	123 Å²	123	74.5 Å²	74.5	54%	0.535	37%	0.373	S	S	.	.	H	α-helix	trans	-56.9	-33.6	171	-75.7	178	178	179.6	0	113	W54 I87	W54-K91 HydrophobicContact CH2-CG 3.83Å; W54-K91 HydrophobicContact CZ2-CG 3.9Å; I87-K91 HydrophobicContact CG2-CD 4.41Å; I87-K91 WeakPolarHBondContact O-CG 3.41Å; I87-K91 PolarHBondContact O-N 3.49Å
92	N	96.8	Very high	96.7	Very high	88 Å²	88	79 Å²	79	47%	0.471	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	9.7	177.4	-68.9	-18.8	0	0	0	113	Q88 R89 L90 L94 Q95 D96	Q88-N92 PolarHBondContact O-N 3.01Å; R89-N92 CarbonylContact O-C 3.59Å; R89-N92 PolarHBondContact O-N 2.81Å; R89-N92 VanDerWaalsContact O-N 3.12Å; L90-N92 PolarHBondContact O-N 3.49Å; N92-L94 PolarHBondContact O-N 3.39Å; N92-Q95 PolarHBondContact O-N 3.48Å; N92-Q95 VanDerWaalsContact O-N 3.07Å; N92-D96 PolarHBondContact O-N 3.21Å
93	G	96.9	Very high	96.8	Very high	1 Å²	1	75.7 Å²	75.7	1%	0.01	39%	0.388	C	S	.	.	H	α-helix	trans	-55.9	-44.1	-168.9	0	0	0	0	0	114.2	R89 L90 Q95 D96 C97	R89-G93 PolarHBondContact O-N 3.02Å; L90-G93 PolarHBondContact O-N 2.93Å; G93-Q95 PolarHBondContact O-N 3.38Å; G93-D96 WeakPolarHBondContact O-CB 3.43Å; G93-D96 PolarHBondContact O-N 2.85Å; G93-C97 PolarHBondContact O-N 3.23Å; G93-C97 PolarHBondContact O-SG 3.18Å
94	L	96.6	Very high	96.8	Very high	79 Å²	79	75 Å²	75	41%	0.414	38%	0.384	S	S	.	.	H	α-helix	trans	-60.5	-44.5	176.9	-67.8	170.9	0	0	0	112.2	P37 F40 N92 D96 C97 S98	P37-L94 HydrophobicContact CB-CB 4.08Å; P37-L94 HydrophobicContact CB-CD2 3.92Å; P37-L94 WeakPolarHBondContact CB-O 3.45Å; P37-L94 HydrophobicContact CG-CB 4.1Å; P37-L94 VanDerWaalsContact CG-O 3.31Å; P37-L94 WeakPolarHBondContact CG-O 3.08Å; F40-L94 HydrophobicContact CB-CD2 3.67Å; F40-L94 HydrophobicContact CB-CG 4.11Å; N92-L94 PolarHBondContact O-N 3.39Å; L94-D96 VanDerWaalsContact C-N 3.34Å; L94-C97 WeakPolarHBondContact O-CB 3.02Å; L94-C97 PolarHBondContact O-N 3.44Å; L94-S98 PolarHBondContact O-N 2.66Å
95	Q	96.3	Very high	96.9	Very high	127 Å²	127	69.6 Å²	69.6	59%	0.593	36%	0.356	S	S	*	.	H	α-helix	trans	-67.1	-37.4	177.6	-176.3	59.8	56.7	0	0	111.6	N92 G93 S98 T99	N92-Q95 PolarHBondContact O-N 3.48Å; N92-Q95 VanDerWaalsContact O-N 3.07Å; G93-Q95 PolarHBondContact O-N 3.38Å; Q95-S98 PolarHBondContact O-N 2.98Å; Q95-T99 PolarHBondContact NE2-OG1 2.88Å; Q95-T99 WeakPolarHBondContact O-CB 3.38Å; Q95-T99 PolarHBondContact O-N 3.03Å; Q95-T99 PolarHBondContact O-OG1 3.36Å
96	D	96.8	Very high	96.9	Very high	77 Å²	77	72.3 Å²	72.3	41%	0.412	36%	0.359	S	S	.	.	H	α-helix	trans	-63.6	-44.7	175.2	-168.6	42.3	0	0	0	110.9	N92 G93 L94 S98 T99 H100	N92-D96 PolarHBondContact O-N 3.21Å; G93-D96 WeakPolarHBondContact O-CB 3.43Å; G93-D96 PolarHBondContact O-N 2.85Å; L94-D96 VanDerWaalsContact C-N 3.34Å; D96-S98 PolarHBondContact O-N 2.93Å; D96-T99 PolarHBondContact O-N 3.1Å; D96-H100 WeakPolarHBondContact O-CB 3.33Å; D96-H100 PolarHBondContact O-N 3.38Å
97	C	97.6	Very high	96.9	Very high	3 Å²	3	74.6 Å²	74.6	2%	0.02	38%	0.381	C	S	.	.	H	α-helix	trans	-53.2	-52.7	174.8	-66.9	0	0	0	0	111.4	C29 P37 F40 G93 L94 T99 H100 T101	C29-C97 HydrophobicContact CB-CB 3.66Å; C29-C97 WeakPolarHBondContact CB-SG 3.3Å; C29-C97 WeakPolarHBondContact SG-CB 3.41Å; C29-C97 CovalentContact SG-SG 2.03Å; C29-C97 PolarHBondContact SG-SG 3.22Å; P37-C97 HydrophobicContact CB-CB 4.39Å; F40-C97 VanDerWaalsContact CD2-SG 3.54Å; G93-C97 PolarHBondContact O-N 3.23Å; G93-C97 PolarHBondContact O-SG 3.18Å; L94-C97 WeakPolarHBondContact O-CB 3.02Å; L94-C97 PolarHBondContact O-N 3.44Å; C97-T99 PolarHBondContact O-N 3.03Å; C97-H100 PolarHBondContact O-N 2.79Å; C97-T101 WeakPolarHBondContact O-CG2 3.41Å; C97-T101 PolarHBondContact O-N 3.34Å; C97-T101 PolarHBondContact O-OG1 2.03Å
98	S	96	Very high	96.9	Very high	37 Å²	37	76.2 Å²	76.2	26%	0.259	39%	0.389	S	S	.	.	H	α-helix	trans	-61.3	-45.5	179.7	-176.4	0	0	0	0	111.9	L94 Q95 D96 H100 T101 Q102	L94-S98 PolarHBondContact O-N 2.66Å; Q95-S98 PolarHBondContact O-N 2.98Å; D96-S98 PolarHBondContact O-N 2.93Å; S98-H100 PolarHBondContact O-N 3.13Å; S98-T101 PolarHBondContact O-OG1 3.19Å; S98-Q102 WeakPolarHBondContact O-CB 3.37Å; S98-Q102 PolarHBondContact O-N 3.46Å
99	T	97.2	Very high	96.8	Very high	85 Å²	85	73.5 Å²	73.5	52%	0.521	38%	0.379	S	S	.	.	H	α-helix	trans	-65.2	-41.7	-178.8	-52.4	0	0	0	0	111.7	Q95 D96 C97	Q95-T99 PolarHBondContact NE2-OG1 2.88Å; Q95-T99 WeakPolarHBondContact O-CB 3.38Å; Q95-T99 PolarHBondContact O-N 3.03Å; Q95-T99 PolarHBondContact O-OG1 3.36Å; D96-T99 PolarHBondContact O-N 3.1Å; C97-T99 PolarHBondContact O-N 3.03Å
100	H	97.2	Very high	96.7	Very high	130 Å²	130	73.7 Å²	73.7	60%	0.602	39%	0.386	S	S	*	.	H	α-helix	trans	-71.8	-38.8	-177.3	-179.4	-97.2	0	0	0	112.4	D96 C97 S98 P103 F104	D96-H100 WeakPolarHBondContact O-CB 3.33Å; D96-H100 PolarHBondContact O-N 3.38Å; C97-H100 PolarHBondContact O-N 2.79Å; S98-H100 PolarHBondContact O-N 3.13Å; H100-P103 WeakPolarHBondContact O-CD 3.32Å; H100-F104 WeakPolarHBondContact O-CE1 3.38Å
101	T	97.4	Very high	96.7	Very high	12 Å²	12	76.4 Å²	76.4	7%	0.074	40%	0.396	C	S	.	.	H	α-helix	trans	-83.5	-22	-178.9	61.1	0	0	0	0	113.6	L31 C97 S98 P103 F104 W105	L31-T101 HydrophobicContact CD1-CG2 4.38Å; L31-T101 HydrophobicContact CD2-CG2 4.32Å; L31-T101 WeakPolarHBondContact CD2-OG1 3.49Å; C97-T101 WeakPolarHBondContact O-CG2 3.41Å; C97-T101 PolarHBondContact O-N 3.34Å; C97-T101 PolarHBondContact O-OG1 2.03Å; S98-T101 PolarHBondContact O-OG1 3.19Å; T101-P103 VanDerWaalsContact C-N 3.3Å; T101-P103 WeakPolarHBondContact O-CD 3.49Å; T101-F104 HydrophobicContact CG2-CE2 4.2Å; T101-F104 HydrophobicContact CG2-CZ 4.12Å; T101-F104 PolarHBondContact O-N 2.97Å; T101-W105 HydrophobicContact CG2-CE3 3.84Å; T101-W105 HydrophobicContact CG2-CZ3 4.08Å; T101-W105 WeakPolarHBondContact O-CB 3.28Å; T101-W105 PolarHBondContact O-N 2.95Å
102	Q	96.2	Very high	96.8	Very high	139 Å²	139	73.2 Å²	73.2	65%	0.65	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.6	-45.8	-176.1	-167.6	-75.7	-32.3	0	0	114.7	S98 F104	S98-Q102 WeakPolarHBondContact O-CB 3.37Å; S98-Q102 PolarHBondContact O-N 3.46Å; Q102-F104 PolarHBondContact O-N 3.49Å
103	P	97.3	Very high	96.8	Very high	98 Å²	98	75.5 Å²	75.5	64%	0.636	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.2	-174.3	-23.5	35.4	0	0	0	114.8	H100 T101	H100-P103 WeakPolarHBondContact O-CD 3.32Å; T101-P103 VanDerWaalsContact C-N 3.3Å; T101-P103 WeakPolarHBondContact O-CD 3.49Å
104	F	97.1	Very high	96.8	Very high	86 Å²	86	79.5 Å²	79.5	38%	0.377	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-14.4	-173.1	56.5	-101.1	0	0	0	114.1	H100 T101 Q102 N106 A107 L108	H100-F104 WeakPolarHBondContact O-CE1 3.38Å; T101-F104 HydrophobicContact CG2-CE2 4.2Å; T101-F104 HydrophobicContact CG2-CZ 4.12Å; T101-F104 PolarHBondContact O-N 2.97Å; Q102-F104 PolarHBondContact O-N 3.49Å; F104-N106 PolarHBondContact O-N 2.61Å; F104-A107 WeakPolarHBondContact O-CB 3.45Å; F104-A107 PolarHBondContact O-N 3.44Å; F104-L108 HydrophobicContact CD2-CD1 3.62Å; F104-L108 HydrophobicContact CD2-CG 4.2Å; F104-L108 HydrophobicContact CE2-CD1 4.08Å; F104-L108 WeakPolarHBondContact O-CG 3.24Å; F104-L108 PolarHBondContact O-N 2.87Å; F104-L108 VanDerWaalsContact O-N 3.1Å
105	W	97.5	Very high	96.9	Very high	56 Å²	56	76 Å²	76	21%	0.212	40%	0.395	C	S	.	.	H	α-helix	trans	-55.3	-52.1	-171.9	-162.4	-107.9	0	0	0	112.9	L31 D32 T101 A107 L108 T109	L31-W105 HydrophobicContact CB-CH2 4.14Å; L31-W105 HydrophobicContact CB-CZ2 3.52Å; L31-W105 HydrophobicContact CD1-CH2 3.71Å; L31-W105 HydrophobicContact CD1-CZ2 4.01Å; L31-W105 HydrophobicContact CD1-CZ3 4.06Å; L31-W105 HydrophobicContact CD2-CD2 4.4Å; L31-W105 HydrophobicContact CD2-CZ2 4.49Å; L31-W105 HydrophobicContact CG-CH2 4.41Å; L31-W105 HydrophobicContact CG-CZ2 4.21Å; D32-W105 PolarHBondContact O-NE1 2.95Å; T101-W105 HydrophobicContact CG2-CE3 3.84Å; T101-W105 HydrophobicContact CG2-CZ3 4.08Å; T101-W105 WeakPolarHBondContact O-CB 3.28Å; T101-W105 PolarHBondContact O-N 2.95Å; W105-A107 PolarHBondContact O-N 2.94Å; W105-L108 WeakPolarHBondContact O-CB 3.41Å; W105-L108 PolarHBondContact O-N 3.21Å; W105-T109 HydrophobicContact CG-CG2 4.46Å; W105-T109 PolarHBondContact O-N 3.03Å; W105-T109 PolarHBondContact O-OG1 2.97Å
106	N	95.9	Very high	97	Very high	108 Å²	108	72.8 Å²	72.8	58%	0.578	39%	0.387	S	S	*	.	H	α-helix	trans	-58	-36.1	178.6	-172.4	39.1	0	0	0	112.6	F104 L108 T109 H110	F104-N106 PolarHBondContact O-N 2.61Å; N106-L108 VanDerWaalsContact C-N 3.32Å; N106-T109 PolarHBondContact O-OG1 3.38Å; N106-H110 WeakPolarHBondContact O-CB 3.4Å; N106-H110 PolarHBondContact O-N 3.28Å; N106-H110 PolarHBondContact O-ND1 3.13Å; N106-H110 PolarHBondContact OD1-CE1 3.45Å; N106-H110 PolarHBondContact OD1-ND1 3.3Å
107	A	96.8	Very high	97	Very high	70 Å²	70	70.7 Å²	70.7	58%	0.579	38%	0.376	S	S	*	.	H	α-helix	trans	-71.7	-27.1	177.8	0	0	0	0	0	112.5	F104 W105 R111	F104-A107 WeakPolarHBondContact O-CB 3.45Å; F104-A107 PolarHBondContact O-N 3.44Å; W105-A107 PolarHBondContact O-N 2.94Å; A107-R111 WeakPolarHBondContact O-CB 3.33Å; A107-R111 PolarHBondContact O-N 2.8Å
108	L	97	Very high	97	Very high	52 Å²	52	76 Å²	76	27%	0.272	40%	0.401	S	S	.	.	H	α-helix	trans	-81.8	-43.8	177.5	-63.3	-173.8	0	0	0	112.3	F104 W105 N106 H110 R111 W172	F104-L108 HydrophobicContact CD2-CD1 3.62Å; F104-L108 HydrophobicContact CD2-CG 4.2Å; F104-L108 HydrophobicContact CE2-CD1 4.08Å; F104-L108 WeakPolarHBondContact O-CG 3.24Å; F104-L108 PolarHBondContact O-N 2.87Å; F104-L108 VanDerWaalsContact O-N 3.1Å; W105-L108 WeakPolarHBondContact O-CB 3.41Å; W105-L108 PolarHBondContact O-N 3.21Å; N106-L108 VanDerWaalsContact C-N 3.32Å; L108-H110 VanDerWaalsContact C-N 3.31Å; L108-H110 PolarHBondContact O-N 3.33Å; L108-R111 VanDerWaalsContact O-CB 3.23Å; L108-R111 WeakPolarHBondContact O-CB 3.49Å; L108-R111 PolarHBondContact O-N 2.85Å; L108-R111 VanDerWaalsContact O-N 3.13Å; L108-W172 HydrophobicContact CD1-CH2 4.37Å; L108-W172 HydrophobicContact CD2-CH2 3.76Å; L108-W172 HydrophobicContact CD2-CZ3 3.72Å
109	T	95.9	Very high	97	Very high	43 Å²	43	75.2 Å²	75.2	26%	0.264	39%	0.394	S	S	.	.	H	α-helix	trans	-65.4	-35.8	-179.1	54.8	0	0	0	0	111.6	W105 N106	W105-T109 HydrophobicContact CG-CG2 4.46Å; W105-T109 PolarHBondContact O-N 3.03Å; W105-T109 PolarHBondContact O-OG1 2.97Å; N106-T109 PolarHBondContact O-OG1 3.38Å
110	H	94.9	Very high	96.8	Very high	131 Å²	131	72.7 Å²	72.7	61%	0.606	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	1.9	175.6	-62.8	81.8	0	0	0	113.7	N106 L108 T112	N106-H110 WeakPolarHBondContact O-CB 3.4Å; N106-H110 PolarHBondContact O-N 3.28Å; N106-H110 PolarHBondContact O-ND1 3.13Å; N106-H110 PolarHBondContact OD1-CE1 3.45Å; N106-H110 PolarHBondContact OD1-ND1 3.3Å; L108-H110 VanDerWaalsContact C-N 3.31Å; L108-H110 PolarHBondContact O-N 3.33Å; H110-T112 PolarHBondContact O-N 2.98Å
111	R	97.1	Very high	96.7	Very high	60 Å²	60	71.8 Å²	71.8	23%	0.226	38%	0.378	C	S	.	.			trans	-68	120	-178.7	-172	170.8	-178.1	-91.8	8	109.2	A107 L108 Y141 W172	A107-R111 WeakPolarHBondContact O-CB 3.33Å; A107-R111 PolarHBondContact O-N 2.8Å; L108-R111 VanDerWaalsContact O-CB 3.23Å; L108-R111 WeakPolarHBondContact O-CB 3.49Å; L108-R111 PolarHBondContact O-N 2.85Å; L108-R111 VanDerWaalsContact O-N 3.13Å; R111-Y141 HydrophobicContact CB-CD1 4.24Å; R111-Y141 HydrophobicContact CB-CE1 3.96Å; R111-Y141 HydrophobicContact CG-CD1 4.03Å; R111-Y141 HydrophobicContact CG-CE1 4.1Å; R111-Y141 WeakPolarHBondContact O-CD1 3.48Å; R111-Y141 WeakPolarHBondContact O-CE1 3.36Å; R111-W172 VanDerWaalsContact NH1-CB 3.26Å; R111-W172 PolarHBondContact NH1-O 3.19Å
112	T	97.6	Very high	96.6	Very high	56 Å²	56	73.1 Å²	73.1	34%	0.344	39%	0.386	S	S	.	.			trans	-130.9	153.5	170.5	61.3	0	0	0	0	112.3	H110 Y141	H110-T112 PolarHBondContact O-N 2.98Å; T112-Y141 CarbonylContact C-O 3.56Å; T112-Y141 VanDerWaalsContact CA-O 3.23Å; T112-Y141 WeakPolarHBondContact CA-O 3.49Å
113	R	97.6	Very high	96.6	Very high	136 Å²	136	70 Å²	70	51%	0.513	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-135.2	127.8	168.3	-69.6	-67.5	-178.7	-102	8.1	108.4	G139 F140 Y141 H196	R113-G139 WeakPolarHBondContact CB-O 3.48Å; R113-F140 VanDerWaalsContact O-CA 3.23Å; R113-F140 WeakPolarHBondContact O-CA 3.34Å; R113-F140 WeakPolarHBondContact O-CB 3.35Å; R113-Y141 PolarHBondContact N-O 3.12Å; R113-Y141 PolarHBondContact O-N 3.38Å; R113-Y141 VanDerWaalsContact O-N 3.14Å; R113-H196 PolarHBondContact O-CE1 3.33Å; R113-H196 VanDerWaalsContact O-CE1 3.26Å
114	T	97.6	Very high	96.4	Very high	84 Å²	84	68.1 Å²	68.1	52%	0.515	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-70.7	134.5	-178.9	52.2	0	0	0	0	110.6	G198	T114-G198 VanDerWaalsContact CG2-O 3.23Å; T114-G198 WeakPolarHBondContact CG2-O 3.42Å
115	P	97.7	Very high	96.3	Very high	7 Å²	7	67.7 Å²	67.7	5%	0.045	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-67.2	140.1	176.1	20.2	-24.5	0	0	0	112	V117 V137 F140 V194 H196 I203	P115-V117 HydrophobicContact CB-CG2 4.42Å; P115-V137 HydrophobicContact CB-CG1 3.58Å; P115-V137 HydrophobicContact CG-CG1 4.5Å; P115-F140 HydrophobicContact CB-CB 3.74Å; P115-F140 HydrophobicContact CB-CD1 3.95Å; P115-F140 HydrophobicContact CB-CG 4.12Å; P115-F140 HydrophobicContact CG-CB 4.24Å; P115-V194 HydrophobicContact CB-CG1 4.49Å; P115-V194 HydrophobicContact CG-CG1 4.04Å; P115-H196 HydrophobicContact CG-CB 3.76Å; P115-I203 HydrophobicContact CG-CD1 3.75Å; P115-I203 WeakPolarHBondContact O-CD1 3.08Å
116	S	97.9	Very high	96	Very high	59 Å²	59	72.4 Å²	72.4	41%	0.413	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	137.9	159.3	-65.7	0	0	0	0	109	V137 W138	S116-V137 WeakPolarHBondContact O-CA 3.43Å; S116-W138 VanDerWaalsContact CB-CE2 3.45Å; S116-W138 PolarHBondContact N-O 2.83Å; S116-W138 PolarHBondContact O-N 2.99Å
117	V	97.5	Very high	95.9	Very high	32 Å²	32	69.4 Å²	69.4	19%	0.194	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.8	-174	-173.8	0	0	0	0	110.1	P115 C135 Y136 V137 V194 I203 A205	P115-V117 HydrophobicContact CB-CG2 4.42Å; V117-C135 VanDerWaalsContact CG1-SG 3.58Å; V117-Y136 WeakPolarHBondContact CA-O 3.23Å; V117-V137 HydrophobicContact CG1-CG2 4.43Å; V117-V137 HydrophobicContact CG2-CG1 4.31Å; V117-V137 HydrophobicContact CG2-CG2 4.43Å; V117-V194 HydrophobicContact CB-CG2 4.48Å; V117-V194 HydrophobicContact CG1-CG2 3.89Å; V117-V194 HydrophobicContact CG2-CB 4.04Å; V117-V194 HydrophobicContact CG2-CG1 4.33Å; V117-V194 HydrophobicContact CG2-CG2 3.7Å; V117-I203 HydrophobicContact CB-CG2 3.98Å; V117-I203 HydrophobicContact CG2-CB 4.25Å; V117-I203 HydrophobicContact CG2-CG2 3.66Å; V117-A205 HydrophobicContact CB-CB 4.46Å; V117-A205 HydrophobicContact CG1-CB 3.73Å
118	Q	96.9	Very high	95.8	Very high	114 Å²	114	78.1 Å²	78.1	53%	0.533	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	136.2	173.3	-177.1	176.2	8.8	0	0	110.7	Y136 W138	Q118-Y136 PolarHBondContact N-O 2.92Å; Q118-Y136 PolarHBondContact O-N 2.73Å; Q118-W138 HydrophobicContact CB-CH2 3.6Å; Q118-W138 HydrophobicContact CB-CZ3 3.7Å
119	V	96.2	Very high	95.7	Very high	21 Å²	21	79 Å²	79	13%	0.127	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.9	173.9	-179.4	0	0	0	0	109.1	L133 A134 C135 W149 C192 A205 W207	V119-L133 HydrophobicContact CG1-CB 4.24Å; V119-L133 HydrophobicContact CG1-CD1 4.23Å; V119-A134 WeakPolarHBondContact CA-O 3.44Å; V119-C135 HydrophobicContact CG2-CB 4.16Å; V119-W149 HydrophobicContact CG1-CH2 3.96Å; V119-W149 HydrophobicContact CG1-CZ3 4.14Å; V119-W149 HydrophobicContact CG2-CH2 4.28Å; V119-W149 HydrophobicContact CG2-CZ3 4.41Å; V119-C192 HydrophobicContact CG2-CB 3.54Å; V119-A205 HydrophobicContact CG2-CB 3.7Å; V119-W207 HydrophobicContact CB-CB 4.38Å; V119-W207 HydrophobicContact CG1-CB 3.67Å; V119-W207 HydrophobicContact CG1-CG 4.19Å
120	A	94.6	Very high	95.6	Very high	32 Å²	32	80.7 Å²	80.7	26%	0.264	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	159.8	173.7	0	0	0	0	0	111	L133 A134 Y136	A120-L133 WeakPolarHBondContact O-CA 3.39Å; A120-A134 PolarHBondContact N-O 2.85Å; A120-A134 PolarHBondContact O-N 3.06Å; A120-Y136 HydrophobicContact CB-CE2 4.27Å
121	Q	94.8	Very high	95.6	Very high	111 Å²	111	75.2 Å²	75.2	52%	0.519	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	140.3	170.6	-176.2	174	0.2	0	0	110	V131 M132 L133	Q121-V131 HydrophobicContact CG-CG1 4.08Å; Q121-M132 CarbonylContact C-O 3.6Å; Q121-M132 WeakPolarHBondContact CA-O 3.19Å; Q121-L133 HydrophobicContact CB-CD2 4.45Å
122	T	94.7	Very high	95.5	Very high	40 Å²	40	72.3 Å²	72.3	25%	0.245	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	169.5	173.4	-171.2	0	0	0	0	110.3	P124 M132 A134 Y179	T122-P124 WeakPolarHBondContact O-CD 3.23Å; T122-M132 HydrophobicContact CG2-CB 4.09Å; T122-M132 HydrophobicContact CG2-CG 3.76Å; T122-M132 HydrophobicContact CG2-SD 4.05Å; T122-M132 PolarHBondContact N-O 2.95Å; T122-A134 HydrophobicContact CG2-CB 4.07Å; T122-Y179 HydrophobicContact CG2-CD1 4.23Å; T122-Y179 HydrophobicContact CG2-CE1 4.15Å
123	A	95.2	Very high	95.5	Very high	73 Å²	73	69.7 Å²	69.7	60%	0.603	37%	0.366	S	S	*	.			trans	-61	124.9	172.4	0	0	0	0	0	109.8
124	P	94.2	Very high	95.4	Very high	59 Å²	59	63.2 Å²	63.2	38%	0.383	34%	0.342	S	S	.	.			trans	-60.8	140.3	175.9	-23.1	33.7	0	0	0	111.8	T122 T127 M132	T122-P124 WeakPolarHBondContact O-CD 3.23Å; P124-T127 HydrophobicContact CB-CG2 3.94Å; P124-M132 HydrophobicContact CB-CB 4.21Å; P124-M132 HydrophobicContact CG-CB 4.22Å
125	F	93.9	Very high	95.3	Very high	78 Å²	78	59.2 Å²	59.2	34%	0.342	32%	0.317	S	S	.	.			trans	-136.5	149.7	173.1	58.9	-96.6	0	0	0	109.6	T127 M132 H159 Y179	F125-T127 PolarHBondContact O-N 2.82Å; F125-M132 HydrophobicContact CD1-CE 4.12Å; F125-M132 HydrophobicContact CD1-SD 3.38Å; F125-M132 WeakPolarHBondContact CD1-SD 3.35Å; F125-M132 HydrophobicContact CD2-CE 4.35Å; F125-M132 HydrophobicContact CE1-CE 4.12Å; F125-M132 HydrophobicContact CE1-SD 3.12Å; F125-M132 WeakPolarHBondContact CE1-SD 3.33Å; F125-M132 HydrophobicContact CE2-CE 4.33Å; F125-M132 HydrophobicContact CE2-SD 4.3Å; F125-M132 HydrophobicContact CG-CE 4.24Å; F125-M132 HydrophobicContact CG-SD 4.09Å; F125-M132 HydrophobicContact CZ-CE 4.2Å; F125-M132 HydrophobicContact CZ-SD 3.62Å; F125-M132 VanDerWaalsContact O-CE 3.26Å; F125-M132 WeakPolarHBondContact O-CE 3.34Å; F125-H159 AromaticContact CE2-CD2 3.97Å; F125-H159 PolarHBondContact O-NE2 3.24Å; F125-Y179 HydrophobicContact CE1-CD1 4.07Å; F125-Y179 HydrophobicContact CE1-CD2 4.26Å; F125-Y179 HydrophobicContact CE1-CE1 4.03Å; F125-Y179 HydrophobicContact CE1-CE2 4.17Å; F125-Y179 HydrophobicContact CE1-CG 4.19Å; F125-Y179 HydrophobicContact CZ-CD1 4.12Å; F125-Y179 AromaticContact CZ-CD2 3.56Å; F125-Y179 HydrophobicContact CZ-CD2 3.56Å; F125-Y179 HydrophobicContact CZ-CE1 4.3Å; F125-Y179 AromaticContact CZ-CE2 3.71Å; F125-Y179 HydrophobicContact CZ-CE2 3.71Å; F125-Y179 AromaticContact CZ-CG 3.76Å; F125-Y179 HydrophobicContact CZ-CG 3.76Å
126	N	92.9	Very high	95.3	Very high	154 Å²	154	62.9 Å²	62.9	82%	0.824	33%	0.331	S	S	*	.	S	Bend	trans	49.2	28.8	177.2	-60.8	-24.9	0	0	0	115.5	H159	N126-H159 PolarHBondContact O-CE1 2.9Å
127	T	93.3	Very high	95.2	Very high	46 Å²	46	60.1 Å²	60.1	28%	0.282	31%	0.311	S	S	.	.			trans	-145.4	158.3	-179.2	-170.7	0	0	0	0	111	P124 F125 E129 M132 A181	P124-T127 HydrophobicContact CB-CG2 3.94Å; F125-T127 PolarHBondContact O-N 2.82Å; T127-E129 HydrophobicContact CG2-CB 4.15Å; T127-E129 WeakPolarHBondContact OG1-CG 3.11Å; T127-E129 PolarHBondContact OG1-N 2.98Å; T127-M132 HydrophobicContact CG2-CE 3.71Å; T127-A181 HydrophobicContact CG2-CB 3.98Å
128	R	94.5	Very high	95.2	Very high	252 Å²	252	63 Å²	63	95%	0.951	32%	0.319	S	S	*	.			trans	-94.6	-7.5	169.8	-62.6	-179.2	-176.9	171.2	0.9	112.4
129	E	94.8	Very high	95.2	Very high	71 Å²	71	58.8 Å²	58.8	33%	0.332	31%	0.306	S	S	.	.			trans	-65.6	139.8	179.5	-63	-61.9	150.8	0	0	110.9	T127 V131 A181 T183	T127-E129 HydrophobicContact CG2-CB 4.15Å; T127-E129 WeakPolarHBondContact OG1-CG 3.11Å; T127-E129 PolarHBondContact OG1-N 2.98Å; E129-V131 VanDerWaalsContact C-N 3.3Å; E129-V131 PolarHBondContact O-N 2.78Å; E129-A181 HydrophobicContact CB-CB 3.99Å; E129-A181 HydrophobicContact CG-CB 3.86Å; E129-T183 WeakPolarHBondContact OE2-CB 3.47Å; E129-T183 PolarHBondContact OE2-N 3.48Å; E129-T183 PolarHBondContact OE2-OG1 2.95Å
130	P	94.5	Very high	95.3	Very high	79 Å²	79	57.8 Å²	57.8	51%	0.513	30%	0.299	S	S	.	.	S	Bend	trans	-72.9	-23.3	-175.7	30.2	-36	0	0	0	113	T183	P130-T183 WeakPolarHBondContact CD-OG1 3.26Å; P130-T183 HydrophobicContact CG-CG2 4.27Å
131	V	94.6	Very high	95.5	Very high	15 Å²	15	58.4 Å²	58.4	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	140	-177.1	176.6	0	0	0	0	110	Q121 E129 L133 L182 P184 W207	Q121-V131 HydrophobicContact CG-CG1 4.08Å; E129-V131 VanDerWaalsContact C-N 3.3Å; E129-V131 PolarHBondContact O-N 2.78Å; V131-L133 HydrophobicContact CG1-CD2 4.18Å; V131-L182 HydrophobicContact CB-CD1 4.02Å; V131-L182 HydrophobicContact CB-CG 4.42Å; V131-L182 HydrophobicContact CG1-CD1 4.04Å; V131-L182 HydrophobicContact CG1-CG 4.37Å; V131-L182 PolarHBondContact N-O 2.88Å; V131-L182 PolarHBondContact O-N 3.45Å; V131-L182 VanDerWaalsContact O-O 3.09Å; V131-P184 HydrophobicContact CB-CG 4.43Å; V131-P184 HydrophobicContact CG2-CG 3.84Å; V131-W207 HydrophobicContact CG1-CH2 4.12Å; V131-W207 HydrophobicContact CG1-CZ2 4.37Å
132	M	95.3	Very high	95.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.3	170.1	-176.8	170.7	-76.8	0	0	109.7	Q121 T122 P124 F125 T127 H159 Y179 L180 A181	Q121-M132 CarbonylContact C-O 3.6Å; Q121-M132 WeakPolarHBondContact CA-O 3.19Å; T122-M132 HydrophobicContact CG2-CB 4.09Å; T122-M132 HydrophobicContact CG2-CG 3.76Å; T122-M132 HydrophobicContact CG2-SD 4.05Å; T122-M132 PolarHBondContact N-O 2.95Å; P124-M132 HydrophobicContact CB-CB 4.21Å; P124-M132 HydrophobicContact CG-CB 4.22Å; F125-M132 HydrophobicContact CD1-CE 4.12Å; F125-M132 HydrophobicContact CD1-SD 3.38Å; F125-M132 WeakPolarHBondContact CD1-SD 3.35Å; F125-M132 HydrophobicContact CD2-CE 4.35Å; F125-M132 HydrophobicContact CE1-CE 4.12Å; F125-M132 HydrophobicContact CE1-SD 3.12Å; F125-M132 WeakPolarHBondContact CE1-SD 3.33Å; F125-M132 HydrophobicContact CE2-CE 4.33Å; F125-M132 HydrophobicContact CE2-SD 4.3Å; F125-M132 HydrophobicContact CG-CE 4.24Å; F125-M132 HydrophobicContact CG-SD 4.09Å; F125-M132 HydrophobicContact CZ-CE 4.2Å; F125-M132 HydrophobicContact CZ-SD 3.62Å; F125-M132 VanDerWaalsContact O-CE 3.26Å; F125-M132 WeakPolarHBondContact O-CE 3.34Å; T127-M132 HydrophobicContact CG2-CE 3.71Å; M132-H159 VanDerWaalsContact CE-CD2 3.46Å; M132-H159 WeakPolarHBondContact CE-CD2 3.33Å; M132-Y179 HydrophobicContact CG-CD1 4.47Å; M132-Y179 HydrophobicContact SD-CD1 4.26Å; M132-Y179 HydrophobicContact SD-CG 4.5Å; M132-L180 WeakPolarHBondContact CA-O 3.27Å; M132-A181 HydrophobicContact CE-CB 4.17Å
133	L	95.9	Very high	95.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	142.7	170.7	-56.4	-177.3	0	0	0	110.1	V119 A120 Q121 V131 W149 Y179 L180 L182 Y190 W207	V119-L133 HydrophobicContact CG1-CB 4.24Å; V119-L133 HydrophobicContact CG1-CD1 4.23Å; A120-L133 WeakPolarHBondContact O-CA 3.39Å; Q121-L133 HydrophobicContact CB-CD2 4.45Å; V131-L133 HydrophobicContact CG1-CD2 4.18Å; L133-W149 HydrophobicContact CB-CH2 3.72Å; L133-W149 HydrophobicContact CB-CZ2 4.46Å; L133-W149 HydrophobicContact CB-CZ3 4.18Å; L133-W149 HydrophobicContact CD1-CH2 4.4Å; L133-W149 HydrophobicContact CD1-CZ3 4.03Å; L133-Y179 CarbonylContact O-C 3.57Å; L133-Y179 VanDerWaalsContact O-CA 3.26Å; L133-Y179 WeakPolarHBondContact O-CA 3.38Å; L133-L180 HydrophobicContact CB-CB 4.46Å; L133-L180 PolarHBondContact N-O 3.19Å; L133-L180 PolarHBondContact O-N 2.86Å; L133-L182 HydrophobicContact CD1-CD2 3.55Å; L133-L182 HydrophobicContact CG-CD2 3.67Å; L133-Y190 HydrophobicContact CD1-CG 4.22Å; L133-W207 HydrophobicContact CD1-CB 4.06Å; L133-W207 HydrophobicContact CD1-CD2 3.73Å; L133-W207 HydrophobicContact CD1-CE3 3.56Å; L133-W207 HydrophobicContact CD1-CG 3.95Å; L133-W207 HydrophobicContact CD1-CZ3 4.21Å; L133-W207 HydrophobicContact CD2-CD2 3.46Å; L133-W207 VanDerWaalsContact CD2-CD2 3.46Å; L133-W207 VanDerWaalsContact CD2-CE2 3.42Å; L133-W207 HydrophobicContact CD2-CE3 3.88Å; L133-W207 HydrophobicContact CD2-CG 3.82Å; L133-W207 HydrophobicContact CD2-CH2 4.19Å; L133-W207 HydrophobicContact CD2-CZ2 3.82Å; L133-W207 HydrophobicContact CD2-CZ3 4.2Å; L133-W207 HydrophobicContact CG-CD2 4.23Å; L133-W207 HydrophobicContact CG-CE3 4.27Å
134	A	95.7	Very high	95.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.9	168.5	0	0	0	0	0	108.3	V119 A120 T122 Y136 V177 S178 Y179	V119-A134 WeakPolarHBondContact CA-O 3.44Å; A120-A134 PolarHBondContact N-O 2.85Å; A120-A134 PolarHBondContact O-N 3.06Å; T122-A134 HydrophobicContact CG2-CB 4.07Å; A134-Y136 HydrophobicContact CB-CD2 4.26Å; A134-Y136 HydrophobicContact CB-CE1 4.15Å; A134-Y136 HydrophobicContact CB-CE2 3.55Å; A134-Y136 VanDerWaalsContact CB-CZ 3.49Å; A134-V177 HydrophobicContact CB-CG2 4.12Å; A134-S178 WeakPolarHBondContact CA-O 3.41Å; A134-Y179 HydrophobicContact CB-CD1 3.75Å; A134-Y179 HydrophobicContact CB-CE1 3.59Å
135	C	96.3	Very high	95.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	103.8	167.5	-176.4	0	0	0	0	108.1	V117 V119 W149 V177 S178 C192	V117-C135 VanDerWaalsContact CG1-SG 3.58Å; V119-C135 HydrophobicContact CG2-CB 4.16Å; C135-W149 HydrophobicContact CB-CH2 3.63Å; C135-W149 HydrophobicContact CB-CZ2 3.39Å; C135-V177 WeakPolarHBondContact O-CA 3.38Å; C135-S178 PolarHBondContact N-O 3.42Å; C135-S178 PolarHBondContact O-N 3.26Å; C135-S178 VanDerWaalsContact O-N 3.08Å; C135-C192 HydrophobicContact CB-CB 3.64Å; C135-C192 WeakPolarHBondContact CB-SG 3.23Å; C135-C192 WeakPolarHBondContact SG-CB 3.43Å; C135-C192 CovalentContact SG-SG 2.02Å; C135-C192 PolarHBondContact SG-SG 3.14Å
136	Y	96.6	Very high	95.7	Very high	84 Å²	84	55 Å²	55	33%	0.329	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	127.7	175.4	-57	-80.6	0	0	0	108.4	V117 Q118 A120 A134 W138 V177	V117-Y136 WeakPolarHBondContact CA-O 3.23Å; Q118-Y136 PolarHBondContact N-O 2.92Å; Q118-Y136 PolarHBondContact O-N 2.73Å; A120-Y136 HydrophobicContact CB-CE2 4.27Å; A134-Y136 HydrophobicContact CB-CD2 4.26Å; A134-Y136 HydrophobicContact CB-CE1 4.15Å; A134-Y136 HydrophobicContact CB-CE2 3.55Å; A134-Y136 VanDerWaalsContact CB-CZ 3.49Å; Y136-W138 WeakPolarHBondContact O-CZ3 3.32Å; Y136-V177 HydrophobicContact CD1-CB 4.35Å; Y136-V177 HydrophobicContact CD1-CG2 3.85Å; Y136-V177 HydrophobicContact CE1-CG2 3.95Å
137	V	97	Very high	95.8	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.5	178.2	-172.7	0	0	0	0	107.4	P115 S116 V117 F140 V145 V147 Q175 T176 V194	P115-V137 HydrophobicContact CB-CG1 3.58Å; P115-V137 HydrophobicContact CG-CG1 4.5Å; S116-V137 WeakPolarHBondContact O-CA 3.43Å; V117-V137 HydrophobicContact CG1-CG2 4.43Å; V117-V137 HydrophobicContact CG2-CG1 4.31Å; V117-V137 HydrophobicContact CG2-CG2 4.43Å; V137-F140 HydrophobicContact CB-CE1 4.31Å; V137-F140 HydrophobicContact CG1-CD1 3.86Å; V137-F140 HydrophobicContact CG1-CE1 3.75Å; V137-V145 HydrophobicContact CG1-CG2 4.37Å; V137-V147 HydrophobicContact CG2-CG2 4.02Å; V137-Q175 CarbonylContact O-C 3.44Å; V137-Q175 VanDerWaalsContact O-CA 3.27Å; V137-Q175 WeakPolarHBondContact O-CA 3.17Å; V137-T176 HydrophobicContact CB-CG2 4Å; V137-T176 PolarHBondContact N-O 3.19Å; V137-T176 PolarHBondContact O-N 3.35Å; V137-T176 VanDerWaalsContact O-O 3.08Å; V137-V194 HydrophobicContact CG1-CG1 3.88Å; V137-V194 HydrophobicContact CG2-CG1 4.47Å; V137-V194 HydrophobicContact CG2-CG2 3.73Å
138	W	97.7	Very high	95.8	Very high	94 Å²	94	49.1 Å²	49.1	36%	0.356	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	166.3	-173.8	70.5	93.6	0	0	0	113.3	S116 Q118 Y136 F140 Q175	S116-W138 VanDerWaalsContact CB-CE2 3.45Å; S116-W138 PolarHBondContact N-O 2.83Å; S116-W138 PolarHBondContact O-N 2.99Å; Q118-W138 HydrophobicContact CB-CH2 3.6Å; Q118-W138 HydrophobicContact CB-CZ3 3.7Å; Y136-W138 WeakPolarHBondContact O-CZ3 3.32Å; W138-F140 VanDerWaalsContact C-N 3.29Å; W138-F140 PolarHBondContact O-N 3.3Å; W138-Q175 HydrophobicContact CB-CB 3.9Å
139	G	97.4	Very high	95.9	Very high	24 Å²	24	37.1 Å²	37.1	25%	0.247	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.7	15.8	173.8	0	0	0	0	0	114.2	R113 Y174	R113-G139 WeakPolarHBondContact CB-O 3.48Å; G139-Y174 PolarHBondContact N-O 2.97Å
140	F	97.9	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	159.6	-176.9	61.1	-87.3	0	0	0	113	R113 P115 V137 W138 P142 V145 A166 T173 Y174 T176 H196	R113-F140 VanDerWaalsContact O-CA 3.23Å; R113-F140 WeakPolarHBondContact O-CA 3.34Å; R113-F140 WeakPolarHBondContact O-CB 3.35Å; P115-F140 HydrophobicContact CB-CB 3.74Å; P115-F140 HydrophobicContact CB-CD1 3.95Å; P115-F140 HydrophobicContact CB-CG 4.12Å; P115-F140 HydrophobicContact CG-CB 4.24Å; V137-F140 HydrophobicContact CB-CE1 4.31Å; V137-F140 HydrophobicContact CG1-CD1 3.86Å; V137-F140 HydrophobicContact CG1-CE1 3.75Å; W138-F140 VanDerWaalsContact C-N 3.29Å; W138-F140 PolarHBondContact O-N 3.3Å; F140-P142 WeakPolarHBondContact CD2-O 3.4Å; F140-V145 HydrophobicContact CD2-CB 4.4Å; F140-V145 HydrophobicContact CE2-CB 3.85Å; F140-V145 HydrophobicContact CE2-CG1 3.68Å; F140-V145 HydrophobicContact CZ-CB 4.15Å; F140-V145 HydrophobicContact CZ-CG1 3.61Å; F140-A166 HydrophobicContact CE2-CB 4.03Å; F140-A166 HydrophobicContact CZ-CB 3.77Å; F140-T173 CarbonylContact O-C 3.53Å; F140-T173 WeakPolarHBondContact O-CA 3.4Å; F140-Y174 WeakPolarHBondContact CD1-O 3.46Å; F140-Y174 WeakPolarHBondContact CE1-O 3.12Å; F140-Y174 PolarHBondContact O-N 3.37Å; F140-T176 HydrophobicContact CE1-CG2 4.42Å; F140-T176 HydrophobicContact CZ-CG2 4.22Å; F140-H196 AromaticContact CD2-CD2 3.69Å; F140-H196 AromaticContact CD2-NE2 3.59Å
141	Y	98	Very high	96.1	Very high	46 Å²	46	34.3 Å²	34.3	18%	0.18	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-157.7	135.6	174	-178.6	-85.1	0	0	0	108.4	R111 T112 R113 W172 Y174 H196	R111-Y141 HydrophobicContact CB-CD1 4.24Å; R111-Y141 HydrophobicContact CB-CE1 3.96Å; R111-Y141 HydrophobicContact CG-CD1 4.03Å; R111-Y141 HydrophobicContact CG-CE1 4.1Å; R111-Y141 WeakPolarHBondContact O-CD1 3.48Å; R111-Y141 WeakPolarHBondContact O-CE1 3.36Å; T112-Y141 CarbonylContact C-O 3.56Å; T112-Y141 VanDerWaalsContact CA-O 3.23Å; T112-Y141 WeakPolarHBondContact CA-O 3.49Å; R113-Y141 PolarHBondContact N-O 3.12Å; R113-Y141 PolarHBondContact O-N 3.38Å; R113-Y141 VanDerWaalsContact O-N 3.14Å; Y141-W172 WeakPolarHBondContact CB-O 3.26Å; Y141-W172 HydrophobicContact CD2-CB 4.49Å; Y141-W172 WeakPolarHBondContact CD2-O 3.5Å; Y141-W172 HydrophobicContact CE2-CE3 4.07Å; Y141-Y174 HydrophobicContact CD2-CD2 4.15Å; Y141-Y174 AromaticContact CD2-CE2 3.8Å; Y141-Y174 HydrophobicContact CD2-CE2 3.8Å; Y141-Y174 HydrophobicContact CE2-CE2 4.11Å; Y141-H196 PolarHBondContact O-CE1 3.37Å
142	P	96.9	Very high	96.1	Very high	43 Å²	43	37.6 Å²	37.6	28%	0.279	20%	0.2	S	C	.	.	S	Bend	cis	-73	-179.9	2.4	31.8	-37.6	0	0	0	113.4	F140 D144 H196 S197	F140-P142 WeakPolarHBondContact CD2-O 3.4Å; P142-D144 VanDerWaalsContact C-N 3.28Å; P142-D144 PolarHBondContact O-N 2.91Å; P142-H196 PolarHBondContact O-NE2 3.43Å; P142-S197 WeakPolarHBondContact CD-OG 3.38Å
143	A	96.6	Very high	96.1	Very high	33 Å²	33	40.5 Å²	40.5	27%	0.273	23%	0.23	S	C	.	.	S	Bend	trans	-66.5	-23.7	-174.8	0	0	0	0	0	114.9	V145 A166 Y174	A143-V145 PolarHBondContact O-N 3.19Å; A143-A166 HydrophobicContact CB-CB 4.45Å; A143-A166 WeakPolarHBondContact O-CB 3.23Å; A143-Y174 HydrophobicContact CB-CD1 3.58Å; A143-Y174 HydrophobicContact CB-CD2 3.94Å; A143-Y174 HydrophobicContact CB-CE1 3.46Å; A143-Y174 VanDerWaalsContact CB-CE1 3.46Å; A143-Y174 HydrophobicContact CB-CE2 3.84Å; A143-Y174 HydrophobicContact CB-CG 3.82Å
144	D	94.7	Very high	96.1	Very high	121 Å²	121	47.6 Å²	47.6	65%	0.647	26%	0.263	S	S	*	.			trans	-68.3	119.4	-176.9	-175.8	34.5	0	0	0	110.9	P142 H196	P142-D144 VanDerWaalsContact C-N 3.28Å; P142-D144 PolarHBondContact O-N 2.91Å; D144-H196 PolarHBondContact O-CD2 2.9Å
145	V	94.6	Very high	96.1	Very high	26 Å²	26	53.8 Å²	53.8	16%	0.158	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	135.7	-175.9	65	0	0	0	0	110	V137 F140 A143 V147 T176 V194 H196	V137-V145 HydrophobicContact CG1-CG2 4.37Å; F140-V145 HydrophobicContact CD2-CB 4.4Å; F140-V145 HydrophobicContact CE2-CB 3.85Å; F140-V145 HydrophobicContact CE2-CG1 3.68Å; F140-V145 HydrophobicContact CZ-CB 4.15Å; F140-V145 HydrophobicContact CZ-CG1 3.61Å; A143-V145 PolarHBondContact O-N 3.19Å; V145-V147 HydrophobicContact CG2-CG2 4.23Å; V145-T176 HydrophobicContact CG1-CG2 3.86Å; V145-V194 HydrophobicContact CG2-CG1 3.71Å; V145-H196 HydrophobicContact CG2-CB 4.41Å
146	T	94.1	Very high	96.1	Very high	67 Å²	67	56 Å²	56	41%	0.411	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127.2	175.2	-66.7	0	0	0	0	109.8	V148 V194 Q195	T146-V148 HydrophobicContact CG2-CG1 4.09Å; T146-V194 CarbonylContact O-C 3.54Å; T146-V194 WeakPolarHBondContact O-CA 3.38Å; T146-Q195 PolarHBondContact N-O 3.17Å; T146-Q195 PolarHBondContact O-N 3.41Å
147	V	94.7	Very high	95.8	Very high	33 Å²	33	57.2 Å²	57.2	20%	0.2	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	116.3	-179.9	-174.1	0	0	0	0	109.6	V137 V145 T176 C192 V193 V194	V137-V147 HydrophobicContact CG2-CG2 4.02Å; V145-V147 HydrophobicContact CG2-CG2 4.23Å; V147-T176 HydrophobicContact CG2-CG2 4.33Å; V147-C192 VanDerWaalsContact CG1-SG 3.54Å; V147-V193 WeakPolarHBondContact CA-O 3.24Å; V147-V194 HydrophobicContact CG1-CG2 4.32Å; V147-V194 HydrophobicContact CG2-CG2 4.29Å
148	V	94.9	Very high	95.6	Very high	42 Å²	42	58.8 Å²	58.8	26%	0.255	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	156.3	178.7	-57.2	0	0	0	0	111.2	T146 V193	T146-V148 HydrophobicContact CG2-CG1 4.09Å; V148-V193 HydrophobicContact CG2-CB 3.73Å; V148-V193 HydrophobicContact CG2-CG1 4.32Å; V148-V193 PolarHBondContact N-O 2.94Å; V148-V193 PolarHBondContact O-N 3.1Å
149	W	96.4	Very high	95.1	Very high	1 Å²	1	57 Å²	57	0%	0.004	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.7	177.6	-71.5	95.5	0	0	0	110.9	V119 L133 C135 V156 S178 L180 T191 C192	V119-W149 HydrophobicContact CG1-CH2 3.96Å; V119-W149 HydrophobicContact CG1-CZ3 4.14Å; V119-W149 HydrophobicContact CG2-CH2 4.28Å; V119-W149 HydrophobicContact CG2-CZ3 4.41Å; L133-W149 HydrophobicContact CB-CH2 3.72Å; L133-W149 HydrophobicContact CB-CZ2 4.46Å; L133-W149 HydrophobicContact CB-CZ3 4.18Å; L133-W149 HydrophobicContact CD1-CH2 4.4Å; L133-W149 HydrophobicContact CD1-CZ3 4.03Å; C135-W149 HydrophobicContact CB-CH2 3.63Å; C135-W149 HydrophobicContact CB-CZ2 3.39Å; W149-V156 HydrophobicContact CB-CG2 3.6Å; W149-V156 PolarHBondContact O-N 2.8Å; W149-S178 PolarHBondContact NE1-OG 3.33Å; W149-L180 HydrophobicContact CB-CD1 4.37Å; W149-L180 HydrophobicContact CB-CD2 4.19Å; W149-L180 HydrophobicContact CD2-CB 3.71Å; W149-L180 HydrophobicContact CD2-CD2 3.89Å; W149-L180 HydrophobicContact CD2-CG 4.31Å; W149-L180 HydrophobicContact CE3-CB 4.08Å; W149-L180 HydrophobicContact CE3-CD2 3.68Å; W149-L180 HydrophobicContact CG-CB 4.08Å; W149-L180 HydrophobicContact CG-CD1 4.35Å; W149-L180 HydrophobicContact CG-CD2 4.13Å; W149-L180 HydrophobicContact CG-CG 4.42Å; W149-L180 HydrophobicContact CH2-CB 4.32Å; W149-L180 HydrophobicContact CZ2-CB 3.98Å; W149-L180 HydrophobicContact CZ3-CB 4.37Å; W149-L180 HydrophobicContact CZ3-CD2 4.3Å; W149-T191 CarbonylContact C-O 3.53Å; W149-T191 WeakPolarHBondContact CA-O 3.41Å; W149-C192 HydrophobicContact CE3-CB 4.14Å; W149-C192 HydrophobicContact CH2-CB 4.14Å; W149-C192 HydrophobicContact CZ3-CB 3.92Å
150	M	96.9	Very high	93.9	Very high	25 Å²	25	57.4 Å²	57.4	12%	0.123	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.5	170.1	-59.8	176.7	-172.7	0	0	110.5	Q154 L155 Y190 T191 V193	M150-Q154 CarbonylContact C-O 3.44Å; M150-Q154 WeakPolarHBondContact CA-O 3.39Å; M150-L155 HydrophobicContact CE-CD1 4.11Å; M150-L155 HydrophobicContact CG-CD1 4.47Å; M150-Y190 CarbonylContact O-C 3.55Å; M150-Y190 WeakPolarHBondContact O-CA 3.49Å; M150-T191 PolarHBondContact N-O 2.82Å; M150-T191 PolarHBondContact O-N 2.84Å; M150-V193 HydrophobicContact CE-CB 4.3Å; M150-V193 HydrophobicContact CE-CG2 3.62Å; M150-V193 HydrophobicContact CG-CG2 4.26Å; M150-V193 HydrophobicContact SD-CG2 3.84Å
151	K	96.5	Very high	92	Very high	65 Å²	65	64 Å²	64	28%	0.283	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.9	166.6	-178.7	-175.7	-178	175.5	0	108	G153 Q154 V156 D188 Y190	K151-G153 PolarHBondContact O-N 2.96Å; K151-G153 VanDerWaalsContact O-N 3.14Å; K151-Q154 PolarHBondContact N-O 3.48Å; K151-Q154 PolarHBondContact O-N 2.92Å; K151-V156 HydrophobicContact CB-CG1 3.61Å; K151-V156 HydrophobicContact CB-CG2 4.47Å; K151-D188 WeakPolarHBondContact CE-OD1 3.33Å; K151-D188 WeakPolarHBondContact CE-OD2 3.33Å; K151-D188 IonicContact NZ-OD1 3.53Å; K151-D188 IonicContact NZ-OD2 2.88Å; K151-D188 PolarHBondContact NZ-OD2 2.89Å; K151-Y190 HydrophobicContact CB-CD1 4.14Å; K151-Y190 HydrophobicContact CB-CE1 4.06Å; K151-Y190 HydrophobicContact CD-CE1 3.88Å; K151-Y190 HydrophobicContact CG-CD1 4.16Å; K151-Y190 HydrophobicContact CG-CE1 3.74Å
152	N	95.1	Very high	90.2	Very high	85 Å²	85	70.2 Å²	70.2	46%	0.455	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	38.5	-179.5	-56.4	-30.9	0	0	0	112.8	Q154 D188 I189	N152-Q154 VanDerWaalsContact C-N 3.32Å; N152-Q154 PolarHBondContact O-N 3.1Å; N152-D188 PolarHBondContact ND2-OD1 2.85Å; N152-D188 WeakPolarHBondContact OD1-CA 3.47Å; N152-I189 PolarHBondContact N-O 3.41Å; N152-I189 PolarHBondContact OD1-N 2.84Å
153	G	94.4	Very high	88.5	Confident	60 Å²	60	77.2 Å²	77.2	62%	0.619	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-5.7	-178.3	0	0	0	0	0	116	K151	K151-G153 PolarHBondContact O-N 2.96Å; K151-G153 VanDerWaalsContact O-N 3.14Å
154	Q	96.7	Very high	87.1	Confident	149 Å²	149	79.9 Å²	79.9	70%	0.696	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	138.5	176.8	-63.2	-175.8	-10.5	0	0	111.2	M150 K151 N152	M150-Q154 CarbonylContact C-O 3.44Å; M150-Q154 WeakPolarHBondContact CA-O 3.39Å; K151-Q154 PolarHBondContact N-O 3.48Å; K151-Q154 PolarHBondContact O-N 2.92Å; N152-Q154 VanDerWaalsContact C-N 3.32Å; N152-Q154 PolarHBondContact O-N 3.1Å
155	L	95.8	Very high	86.5	Confident	130 Å²	130	80.7 Å²	80.7	68%	0.681	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61	137.7	177.4	-117.1	89.1	0	0	0	111.1	M150	M150-L155 HydrophobicContact CE-CD1 4.11Å; M150-L155 HydrophobicContact CG-CD1 4.47Å
156	V	94.6	Very high	86.5	Confident	48 Å²	48	79.8 Å²	79.8	29%	0.291	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	148.3	174.2	-63.3	0	0	0	0	111.1	W149 K151 L180	W149-V156 HydrophobicContact CB-CG2 3.6Å; W149-V156 PolarHBondContact O-N 2.8Å; K151-V156 HydrophobicContact CB-CG1 3.61Å; K151-V156 HydrophobicContact CB-CG2 4.47Å; V156-L180 HydrophobicContact CG2-CD1 3.92Å; V156-L180 HydrophobicContact CG2-CD2 4.17Å
157	T	92	Very high	86.6	Confident	109 Å²	109	82 Å²	82	67%	0.669	44%	0.439	S	S	*	.			trans	-71.1	132	-179.7	-47.2	0	0	0	0	110.7	L180	T157-L180 WeakPolarHBondContact O-CD1 3.49Å
158	S	91.4	Very high	86.7	Confident	33 Å²	33	83.7 Å²	83.7	23%	0.231	45%	0.45	C	S	.	.			trans	-66.9	159.4	173.7	80	0	0	0	0	111.6	S160	S158-S160 PolarHBondContact O-N 3.09Å; S158-S160 PolarHBondContact OG-O 3.35Å; S158-S160 VanDerWaalsContact OG-O 3.1Å
159	H	87.5	Confident	86.9	Confident	58 Å²	58	84.7 Å²	84.7	27%	0.269	45%	0.454	S	S	.	.	S	Bend	trans	-69.6	-20.4	179.3	-173.1	58.2	0	0	0	113	F125 N126 M132 Y179 A181	F125-H159 AromaticContact CE2-CD2 3.97Å; F125-H159 PolarHBondContact O-NE2 3.24Å; N126-H159 PolarHBondContact O-CE1 2.9Å; M132-H159 VanDerWaalsContact CE-CD2 3.46Å; M132-H159 WeakPolarHBondContact CE-CD2 3.33Å; H159-Y179 WeakPolarHBondContact CB-O 3.38Å; H159-Y179 PolarHBondContact N-O 3.41Å; H159-A181 HydrophobicContact CB-CB 4.18Å
160	S	71.4	Confident	86.9	Confident	31 Å²	31	88.1 Å²	88.1	22%	0.217	49%	0.49	C	S	.	.			trans	-123.3	105.7	179.5	62	0	0	0	0	111.3	S158 K162	S158-S160 PolarHBondContact O-N 3.09Å; S158-S160 PolarHBondContact OG-O 3.35Å; S158-S160 VanDerWaalsContact OG-O 3.1Å; S160-K162 PolarHBondContact O-N 2.99Å; S160-K162 VanDerWaalsContact O-N 3.15Å
161	N	58.9	Low	86.9	Confident	139 Å²	139	91.6 Å²	91.6	74%	0.743	51%	0.509	S	S	*	.			trans	-71.7	1.8	176.7	-70.7	-12.6	0	0	0	114.6	E163	N161-E163 PolarHBondContact O-N 2.93Å
162	K	60	Low	86.9	Confident	176 Å²	176	94.6 Å²	94.6	77%	0.765	52%	0.519	S	S	*	.	S	Bend	trans	-82.1	118.4	174.9	-66.5	-169.5	178.4	-173.8	0	107.5	S160 K164	S160-K162 PolarHBondContact O-N 2.99Å; S160-K162 VanDerWaalsContact O-N 3.15Å; K162-K164 VanDerWaalsContact C-N 3.28Å; K162-K164 PolarHBondContact O-N 3.02Å
163	E	61	Low	87	Confident	191 Å²	191	91.6 Å²	91.6	89%	0.893	50%	0.504	S	S	*	.			trans	-49.6	98.7	162	-71.9	176	-179.2	0	0	107.4	N161 T165	N161-E163 PolarHBondContact O-N 2.93Å; E163-T165 PolarHBondContact O-N 2.85Å
164	K	67.9	Low	87.2	Confident	88 Å²	88	91.6 Å²	91.6	38%	0.383	49%	0.485	S	S	.	.			trans	-77.8	109.9	178.9	-77.4	-172.8	-171.6	174.1	0	107	K162 A166 V177	K162-K164 VanDerWaalsContact C-N 3.28Å; K162-K164 PolarHBondContact O-N 3.02Å; K164-A166 PolarHBondContact O-N 2.02Å; K164-V177 WeakPolarHBondContact CD-O 3.36Å; K164-V177 PolarHBondContact NZ-O 3.2Å
165	T	82.7	Confident	87.2	Confident	138 Å²	138	88.7 Å²	88.7	85%	0.847	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-53.8	130.9	166	-44	0	0	0	0	108.9	E163 Q167	E163-T165 PolarHBondContact O-N 2.85Å; T165-Q167 PolarHBondContact O-N 3.08Å
166	A	94	Very high	87.2	Confident	8 Å²	8	83.6 Å²	83.6	7%	0.066	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-63.1	134.5	177.8	0	0	0	0	0	110.3	F140 A143 K164 P168 Y174 Q175	F140-A166 HydrophobicContact CE2-CB 4.03Å; F140-A166 HydrophobicContact CZ-CB 3.77Å; A143-A166 HydrophobicContact CB-CB 4.45Å; A143-A166 WeakPolarHBondContact O-CB 3.23Å; K164-A166 PolarHBondContact O-N 2.02Å; A166-P168 WeakPolarHBondContact O-CD 3.34Å; A166-Y174 HydrophobicContact CB-CD1 4.03Å; A166-Y174 HydrophobicContact CB-CG 4.36Å; A166-Q175 CarbonylContact C-O 3.56Å
167	Q	96.1	Very high	87.3	Confident	113 Å²	113	82.7 Å²	82.7	53%	0.528	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	124.8	178.3	175.2	60.7	53.7	0	0	109.6	T165 Y174 Q175	T165-Q167 PolarHBondContact O-N 3.08Å; Q167-Y174 WeakPolarHBondContact O-CA 3.26Å; Q167-Q175 HydrophobicContact CB-CG 4.07Å; Q167-Q175 HydrophobicContact CG-CG 4.46Å; Q167-Q175 PolarHBondContact N-O 3.35Å; Q167-Q175 PolarHBondContact O-N 2.97Å
168	P	97.4	Very high	87.4	Confident	68 Å²	68	78.1 Å²	78.1	44%	0.442	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	137.8	170.6	27	-34.6	0	0	0	111.3	A166 Y174	A166-P168 WeakPolarHBondContact O-CD 3.34Å; P168-Y174 HydrophobicContact CB-CD1 4.12Å; P168-Y174 HydrophobicContact CB-CE1 3.72Å; P168-Y174 HydrophobicContact CG-CE1 4.47Å
169	N	97.5	Very high	87.6	Confident	63 Å²	63	78.6 Å²	78.6	34%	0.337	41%	0.41	S	S	.	.			trans	-91.1	-12.7	175.8	-66.2	-29.6	0	0	0	113.4	D171 T173 Q175	N169-D171 VanDerWaalsContact C-N 3.27Å; N169-D171 VanDerWaalsContact CB-OD1 3.28Å; N169-D171 WeakPolarHBondContact CB-OD1 3.36Å; N169-D171 PolarHBondContact O-N 2.87Å; N169-T173 WeakPolarHBondContact CB-O 3.03Å; N169-T173 PolarHBondContact N-O 2.81Å; N169-T173 PolarHBondContact ND2-OG1 3.15Å; N169-Q175 VanDerWaalsContact OD1-CD 3.28Å; N169-Q175 WeakPolarHBondContact OD1-CG 3Å; N169-Q175 PolarHBondContact OD1-NE2 2.82Å
170	G	96.8	Very high	88	Confident	73 Å²	73	76.2 Å²	76.2	75%	0.753	40%	0.399	S	S	*	.	S	Bend	trans	83.9	-8.2	-177.4	0	0	0	0	0	114.9
171	D	97.3	Very high	89.2	Confident	98 Å²	98	75.8 Å²	75.8	52%	0.524	40%	0.397	S	S	.	.	S	Bend	trans	-102	20.7	176	67.2	-5.5	0	0	0	112.7	N169 T173	N169-D171 VanDerWaalsContact C-N 3.27Å; N169-D171 VanDerWaalsContact CB-OD1 3.28Å; N169-D171 WeakPolarHBondContact CB-OD1 3.36Å; N169-D171 PolarHBondContact O-N 2.87Å; D171-T173 VanDerWaalsContact C-N 3.29Å; D171-T173 PolarHBondContact O-N 3.44Å; D171-T173 WeakPolarHBondContact OD1-CB 3.45Å; D171-T173 PolarHBondContact OD1-N 3.33Å; D171-T173 PolarHBondContact OD1-OG1 2.94Å; D171-T173 PolarHBondContact OD2-OG1 2.95Å
172	W	96.5	Very high	90.9	Very high	128 Å²	128	69.6 Å²	69.6	49%	0.485	36%	0.364	S	S	.	.	S	Bend	trans	62.8	29	-171.5	-59.2	55.3	0	0	0	114.8	L108 R111 Y141	L108-W172 HydrophobicContact CD1-CH2 4.37Å; L108-W172 HydrophobicContact CD2-CH2 3.76Å; L108-W172 HydrophobicContact CD2-CZ3 3.72Å; R111-W172 VanDerWaalsContact NH1-CB 3.26Å; R111-W172 PolarHBondContact NH1-O 3.19Å; Y141-W172 WeakPolarHBondContact CB-O 3.26Å; Y141-W172 HydrophobicContact CD2-CB 4.49Å; Y141-W172 WeakPolarHBondContact CD2-O 3.5Å; Y141-W172 HydrophobicContact CE2-CE3 4.07Å
173	T	97.9	Very high	92.5	Very high	23 Å²	23	65.1 Å²	65.1	14%	0.141	35%	0.352	C	S	.	.			trans	-122.8	160.9	165	72.1	0	0	0	0	111	F140 N169 D171	F140-T173 CarbonylContact O-C 3.53Å; F140-T173 WeakPolarHBondContact O-CA 3.4Å; N169-T173 WeakPolarHBondContact CB-O 3.03Å; N169-T173 PolarHBondContact N-O 2.81Å; N169-T173 PolarHBondContact ND2-OG1 3.15Å; D171-T173 VanDerWaalsContact C-N 3.29Å; D171-T173 PolarHBondContact O-N 3.44Å; D171-T173 WeakPolarHBondContact OD1-CB 3.45Å; D171-T173 PolarHBondContact OD1-N 3.33Å; D171-T173 PolarHBondContact OD1-OG1 2.94Å; D171-T173 PolarHBondContact OD2-OG1 2.95Å
174	Y	98.1	Very high	94	Very high	59 Å²	59	58.1 Å²	58.1	23%	0.231	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	161	179	-69.4	-95.8	0	0	0	110.9	G139 F140 Y141 A143 A166 Q167 P168	G139-Y174 PolarHBondContact N-O 2.97Å; F140-Y174 WeakPolarHBondContact CD1-O 3.46Å; F140-Y174 WeakPolarHBondContact CE1-O 3.12Å; F140-Y174 PolarHBondContact O-N 3.37Å; Y141-Y174 HydrophobicContact CD2-CD2 4.15Å; Y141-Y174 AromaticContact CD2-CE2 3.8Å; Y141-Y174 HydrophobicContact CD2-CE2 3.8Å; Y141-Y174 HydrophobicContact CE2-CE2 4.11Å; A143-Y174 HydrophobicContact CB-CD1 3.58Å; A143-Y174 HydrophobicContact CB-CD2 3.94Å; A143-Y174 HydrophobicContact CB-CE1 3.46Å; A143-Y174 VanDerWaalsContact CB-CE1 3.46Å; A143-Y174 HydrophobicContact CB-CE2 3.84Å; A143-Y174 HydrophobicContact CB-CG 3.82Å; A166-Y174 HydrophobicContact CB-CD1 4.03Å; A166-Y174 HydrophobicContact CB-CG 4.36Å; Q167-Y174 WeakPolarHBondContact O-CA 3.26Å; P168-Y174 HydrophobicContact CB-CD1 4.12Å; P168-Y174 HydrophobicContact CB-CE1 3.72Å; P168-Y174 HydrophobicContact CG-CE1 4.47Å
175	Q	97.3	Very high	95.1	Very high	88 Å²	88	56.8 Å²	56.8	41%	0.411	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	151.3	172.6	62.6	-179.6	-25.7	0	0	111.8	V137 W138 A166 Q167 N169	V137-Q175 CarbonylContact O-C 3.44Å; V137-Q175 VanDerWaalsContact O-CA 3.27Å; V137-Q175 WeakPolarHBondContact O-CA 3.17Å; W138-Q175 HydrophobicContact CB-CB 3.9Å; A166-Q175 CarbonylContact C-O 3.56Å; Q167-Q175 HydrophobicContact CB-CG 4.07Å; Q167-Q175 HydrophobicContact CG-CG 4.46Å; Q167-Q175 PolarHBondContact N-O 3.35Å; Q167-Q175 PolarHBondContact O-N 2.97Å; N169-Q175 VanDerWaalsContact OD1-CD 3.28Å; N169-Q175 WeakPolarHBondContact OD1-CG 3Å; N169-Q175 PolarHBondContact OD1-NE2 2.82Å
176	T	95.7	Very high	95.3	Very high	23 Å²	23	58.2 Å²	58.2	14%	0.141	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	165.6	173.1	-168	0	0	0	0	110.5	V137 F140 V145 V147	V137-T176 HydrophobicContact CB-CG2 4Å; V137-T176 PolarHBondContact N-O 3.19Å; V137-T176 PolarHBondContact O-N 3.35Å; V137-T176 VanDerWaalsContact O-O 3.08Å; F140-T176 HydrophobicContact CE1-CG2 4.42Å; F140-T176 HydrophobicContact CZ-CG2 4.22Å; V145-T176 HydrophobicContact CG1-CG2 3.86Å; V147-T176 HydrophobicContact CG2-CG2 4.33Å
177	V	95.2	Very high	95	Very high	30 Å²	30	68 Å²	68	18%	0.182	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	124.6	178	62	0	0	0	0	111.1	A134 C135 Y136 K164 Y179	A134-V177 HydrophobicContact CB-CG2 4.12Å; C135-V177 WeakPolarHBondContact O-CA 3.38Å; Y136-V177 HydrophobicContact CD1-CB 4.35Å; Y136-V177 HydrophobicContact CD1-CG2 3.85Å; Y136-V177 HydrophobicContact CE1-CG2 3.95Å; K164-V177 WeakPolarHBondContact CD-O 3.36Å; K164-V177 PolarHBondContact NZ-O 3.2Å; V177-Y179 HydrophobicContact CG1-CE2 3.94Å; V177-Y179 HydrophobicContact CG2-CD1 4.38Å; V177-Y179 HydrophobicContact CG2-CE1 3.76Å; V177-Y179 HydrophobicContact CG2-CE2 4.22Å
178	S	95.2	Very high	94.9	Very high	12 Å²	12	63.2 Å²	63.2	8%	0.084	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	143.6	173.7	-174.7	0	0	0	0	110.2	A134 C135 W149	A134-S178 WeakPolarHBondContact CA-O 3.41Å; C135-S178 PolarHBondContact N-O 3.42Å; C135-S178 PolarHBondContact O-N 3.26Å; C135-S178 VanDerWaalsContact O-N 3.08Å; W149-S178 PolarHBondContact NE1-OG 3.33Å
179	Y	95.5	Very high	94.8	Very high	43 Å²	43	63.6 Å²	63.6	17%	0.169	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	145	-177.3	-61.5	-73.9	0	0	0	111.4	T122 F125 M132 L133 A134 H159 V177	T122-Y179 HydrophobicContact CG2-CD1 4.23Å; T122-Y179 HydrophobicContact CG2-CE1 4.15Å; F125-Y179 HydrophobicContact CE1-CD1 4.07Å; F125-Y179 HydrophobicContact CE1-CD2 4.26Å; F125-Y179 HydrophobicContact CE1-CE1 4.03Å; F125-Y179 HydrophobicContact CE1-CE2 4.17Å; F125-Y179 HydrophobicContact CE1-CG 4.19Å; F125-Y179 HydrophobicContact CZ-CD1 4.12Å; F125-Y179 AromaticContact CZ-CD2 3.56Å; F125-Y179 HydrophobicContact CZ-CD2 3.56Å; F125-Y179 HydrophobicContact CZ-CE1 4.3Å; F125-Y179 AromaticContact CZ-CE2 3.71Å; F125-Y179 HydrophobicContact CZ-CE2 3.71Å; F125-Y179 AromaticContact CZ-CG 3.76Å; F125-Y179 HydrophobicContact CZ-CG 3.76Å; M132-Y179 HydrophobicContact CG-CD1 4.47Å; M132-Y179 HydrophobicContact SD-CD1 4.26Å; M132-Y179 HydrophobicContact SD-CG 4.5Å; L133-Y179 CarbonylContact O-C 3.57Å; L133-Y179 VanDerWaalsContact O-CA 3.26Å; L133-Y179 WeakPolarHBondContact O-CA 3.38Å; A134-Y179 HydrophobicContact CB-CD1 3.75Å; A134-Y179 HydrophobicContact CB-CE1 3.59Å; H159-Y179 WeakPolarHBondContact CB-O 3.38Å; H159-Y179 PolarHBondContact N-O 3.41Å; V177-Y179 HydrophobicContact CG1-CE2 3.94Å; V177-Y179 HydrophobicContact CG2-CD1 4.38Å; V177-Y179 HydrophobicContact CG2-CE1 3.76Å; V177-Y179 HydrophobicContact CG2-CE2 4.22Å
180	L	95.8	Very high	94.7	Very high	8 Å²	8	61 Å²	61	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	118.3	172.9	-178.5	68.1	0	0	0	109.3	M132 L133 W149 V156 T157 L182 Y190	M132-L180 WeakPolarHBondContact CA-O 3.27Å; L133-L180 HydrophobicContact CB-CB 4.46Å; L133-L180 PolarHBondContact N-O 3.19Å; L133-L180 PolarHBondContact O-N 2.86Å; W149-L180 HydrophobicContact CB-CD1 4.37Å; W149-L180 HydrophobicContact CB-CD2 4.19Å; W149-L180 HydrophobicContact CD2-CB 3.71Å; W149-L180 HydrophobicContact CD2-CD2 3.89Å; W149-L180 HydrophobicContact CD2-CG 4.31Å; W149-L180 HydrophobicContact CE3-CB 4.08Å; W149-L180 HydrophobicContact CE3-CD2 3.68Å; W149-L180 HydrophobicContact CG-CB 4.08Å; W149-L180 HydrophobicContact CG-CD1 4.35Å; W149-L180 HydrophobicContact CG-CD2 4.13Å; W149-L180 HydrophobicContact CG-CG 4.42Å; W149-L180 HydrophobicContact CH2-CB 4.32Å; W149-L180 HydrophobicContact CZ2-CB 3.98Å; W149-L180 HydrophobicContact CZ3-CB 4.37Å; W149-L180 HydrophobicContact CZ3-CD2 4.3Å; V156-L180 HydrophobicContact CG2-CD1 3.92Å; V156-L180 HydrophobicContact CG2-CD2 4.17Å; T157-L180 WeakPolarHBondContact O-CD1 3.49Å; L180-L182 HydrophobicContact CD2-CD2 3.8Å; L180-L182 HydrophobicContact CG-CD2 4.03Å; L180-Y190 HydrophobicContact CD2-CD1 3.64Å; L180-Y190 HydrophobicContact CD2-CE1 4.21Å; L180-Y190 HydrophobicContact CD2-CG 4.47Å
181	A	95.7	Very high	94.7	Very high	22 Å²	22	58.1 Å²	58.1	18%	0.182	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.5	173.1	0	0	0	0	0	109	T127 E129 M132 H159	T127-A181 HydrophobicContact CG2-CB 3.98Å; E129-A181 HydrophobicContact CB-CB 3.99Å; E129-A181 HydrophobicContact CG-CB 3.86Å; M132-A181 HydrophobicContact CE-CB 4.17Å; H159-A181 HydrophobicContact CB-CB 4.18Å
182	L	94.9	Very high	94.7	Very high	9 Å²	9	53.4 Å²	53.4	5%	0.047	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	156.8	-173.6	63.7	93.5	0	0	0	113.6	V131 L133 L180 P184 Y190 W207	V131-L182 HydrophobicContact CB-CD1 4.02Å; V131-L182 HydrophobicContact CB-CG 4.42Å; V131-L182 HydrophobicContact CG1-CD1 4.04Å; V131-L182 HydrophobicContact CG1-CG 4.37Å; V131-L182 PolarHBondContact N-O 2.88Å; V131-L182 PolarHBondContact O-N 3.45Å; V131-L182 VanDerWaalsContact O-O 3.09Å; L133-L182 HydrophobicContact CD1-CD2 3.55Å; L133-L182 HydrophobicContact CG-CD2 3.67Å; L180-L182 HydrophobicContact CD2-CD2 3.8Å; L180-L182 HydrophobicContact CG-CD2 4.03Å; L182-P184 HydrophobicContact CD1-CB 3.72Å; L182-P184 HydrophobicContact CD1-CG 4.16Å; L182-Y190 HydrophobicContact CB-CE1 4.13Å; L182-Y190 HydrophobicContact CD1-CE1 4.43Å; L182-Y190 HydrophobicContact CD1-CE2 3.88Å; L182-Y190 HydrophobicContact CD2-CD1 3.76Å; L182-Y190 HydrophobicContact CD2-CD2 4.19Å; L182-Y190 HydrophobicContact CD2-CE1 3.64Å; L182-Y190 HydrophobicContact CD2-CE2 4.08Å; L182-Y190 HydrophobicContact CD2-CG 4Å; L182-Y190 HydrophobicContact CG-CE1 4.29Å; L182-W207 HydrophobicContact CD1-CH2 4.46Å; L182-W207 HydrophobicContact CD1-CZ3 4.14Å
183	T	94.6	Very high	94.7	Very high	83 Å²	83	47.5 Å²	47.5	51%	0.509	23%	0.233	S	C	.	.			trans	-103.4	111.2	162.6	-65.9	0	0	0	0	108.3	E129 P130	E129-T183 WeakPolarHBondContact OE2-CB 3.47Å; E129-T183 PolarHBondContact OE2-N 3.48Å; E129-T183 PolarHBondContact OE2-OG1 2.95Å; P130-T183 WeakPolarHBondContact CD-OG1 3.26Å; P130-T183 HydrophobicContact CG-CG2 4.27Å
184	P	91.6	Very high	94.6	Very high	43 Å²	43	46.5 Å²	46.5	28%	0.279	23%	0.227	S	C	.	.			trans	-78.7	138	-171.7	29.2	-31.8	0	0	0	112.5	V131 L182 W207 P209	V131-P184 HydrophobicContact CB-CG 4.43Å; V131-P184 HydrophobicContact CG2-CG 3.84Å; L182-P184 HydrophobicContact CD1-CB 3.72Å; L182-P184 HydrophobicContact CD1-CG 4.16Å; P184-W207 HydrophobicContact CB-CH2 4.11Å; P184-W207 HydrophobicContact CB-CZ3 4.27Å; P184-P209 HydrophobicContact CB-CB 3.88Å; P184-P209 HydrophobicContact CB-CG 3.4Å
185	S	92.2	Very high	94.5	Very high	61 Å²	61	48.6 Å²	48.6	43%	0.427	24%	0.239	S	C	.	.			trans	-103.8	147.3	164.3	-44.9	0	0	0	0	110.3	W187 D188 P209	S185-W187 PolarHBondContact O-N 3.07Å; S185-D188 WeakPolarHBondContact CB-OD2 3.4Å; S185-D188 PolarHBondContact N-OD2 2.83Å; S185-D188 WeakPolarHBondContact O-CB 3.41Å; S185-D188 PolarHBondContact O-N 2.89Å; S185-D188 PolarHBondContact OG-OD2 2.86Å; S185-P209 WeakPolarHBondContact O-CG 3.42Å
186	Y	86.2	Confident	94.5	Very high	168 Å²	168	45 Å²	45	66%	0.659	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-27	-173.1	-172.8	-98.9	0	0	0	115
187	W	88.3	Confident	94.4	Very high	212 Å²	212	47.7 Å²	47.7	80%	0.803	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.8	1.9	-178.9	-52.3	111.9	0	0	0	114.3	S185	S185-W187 PolarHBondContact O-N 3.07Å
188	D	93.1	Very high	94.3	Very high	14 Å²	14	46.9 Å²	46.9	8%	0.075	24%	0.24	C	C	.	.			trans	-76.4	133.5	-179.8	-74.8	-30.7	0	0	0	110.7	K151 N152 S185 Y190 P209	K151-D188 WeakPolarHBondContact CE-OD1 3.33Å; K151-D188 WeakPolarHBondContact CE-OD2 3.33Å; K151-D188 IonicContact NZ-OD1 3.53Å; K151-D188 IonicContact NZ-OD2 2.88Å; K151-D188 PolarHBondContact NZ-OD2 2.89Å; N152-D188 PolarHBondContact ND2-OD1 2.85Å; N152-D188 WeakPolarHBondContact OD1-CA 3.47Å; S185-D188 WeakPolarHBondContact CB-OD2 3.4Å; S185-D188 PolarHBondContact N-OD2 2.83Å; S185-D188 WeakPolarHBondContact O-CB 3.41Å; S185-D188 PolarHBondContact O-N 2.89Å; S185-D188 PolarHBondContact OG-OD2 2.86Å; D188-Y190 HydrophobicContact CB-CD2 4.26Å; D188-Y190 HydrophobicContact CB-CE2 3.54Å; D188-Y190 PolarHBondContact OD2-OH 2.81Å; D188-P209 WeakPolarHBondContact O-CD 3.29Å
189	I	94.5	Very high	94.2	Very high	76 Å²	76	47.9 Å²	47.9	39%	0.39	25%	0.245	S	C	.	.			trans	-111.6	120.3	171	-54	176.8	0	0	0	107.5	N152 N206 T208	N152-I189 PolarHBondContact N-O 3.41Å; N152-I189 PolarHBondContact OD1-N 2.84Å; I189-N206 HydrophobicContact CG2-CB 4.39Å; I189-T208 HydrophobicContact CB-CG2 4.44Å; I189-T208 HydrophobicContact CG1-CG2 3.99Å; I189-T208 HydrophobicContact CG2-CG2 4.28Å
190	Y	96.3	Very high	94.1	Very high	7 Å²	7	51.8 Å²	51.8	3%	0.027	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.1	174.2	-63.1	-88.7	0	0	0	109	L133 M150 K151 L180 L182 D188 N206 W207	L133-Y190 HydrophobicContact CD1-CG 4.22Å; M150-Y190 CarbonylContact O-C 3.55Å; M150-Y190 WeakPolarHBondContact O-CA 3.49Å; K151-Y190 HydrophobicContact CB-CD1 4.14Å; K151-Y190 HydrophobicContact CB-CE1 4.06Å; K151-Y190 HydrophobicContact CD-CE1 3.88Å; K151-Y190 HydrophobicContact CG-CD1 4.16Å; K151-Y190 HydrophobicContact CG-CE1 3.74Å; L180-Y190 HydrophobicContact CD2-CD1 3.64Å; L180-Y190 HydrophobicContact CD2-CE1 4.21Å; L180-Y190 HydrophobicContact CD2-CG 4.47Å; L182-Y190 HydrophobicContact CB-CE1 4.13Å; L182-Y190 HydrophobicContact CD1-CE1 4.43Å; L182-Y190 HydrophobicContact CD1-CE2 3.88Å; L182-Y190 HydrophobicContact CD2-CD1 3.76Å; L182-Y190 HydrophobicContact CD2-CD2 4.19Å; L182-Y190 HydrophobicContact CD2-CE1 3.64Å; L182-Y190 HydrophobicContact CD2-CE2 4.08Å; L182-Y190 HydrophobicContact CD2-CG 4Å; L182-Y190 HydrophobicContact CG-CE1 4.29Å; D188-Y190 HydrophobicContact CB-CD2 4.26Å; D188-Y190 HydrophobicContact CB-CE2 3.54Å; D188-Y190 PolarHBondContact OD2-OH 2.81Å; Y190-N206 CarbonylContact O-C 3.58Å; Y190-N206 WeakPolarHBondContact O-CA 3.42Å; Y190-W207 AromaticContact CD2-CE3 3.59Å; Y190-W207 HydrophobicContact CD2-CE3 3.59Å; Y190-W207 AromaticContact CD2-CZ3 3.67Å; Y190-W207 HydrophobicContact CD2-CZ3 3.67Å; Y190-W207 HydrophobicContact CE2-CE3 4.33Å; Y190-W207 AromaticContact CE2-CZ3 3.95Å; Y190-W207 HydrophobicContact CE2-CZ3 3.95Å; Y190-W207 HydrophobicContact CG-CE3 4.26Å; Y190-W207 PolarHBondContact N-O 2.67Å; Y190-W207 PolarHBondContact O-N 2.83Å
191	T	97.3	Very high	94.1	Very high	13 Å²	13	58.3 Å²	58.3	8%	0.08	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	124.8	-178.8	-54	0	0	0	0	109.4	W149 M150 V193 R204 A205 N206	W149-T191 CarbonylContact C-O 3.53Å; W149-T191 WeakPolarHBondContact CA-O 3.41Å; M150-T191 PolarHBondContact N-O 2.82Å; M150-T191 PolarHBondContact O-N 2.84Å; T191-V193 HydrophobicContact CG2-CG2 3.77Å; T191-R204 HydrophobicContact CG2-CB 3.92Å; T191-R204 HydrophobicContact CG2-CG 4.4Å; T191-A205 WeakPolarHBondContact CA-O 3.4Å; T191-N206 WeakPolarHBondContact CB-OD1 3.36Å; T191-N206 WeakPolarHBondContact CG2-OD1 3.32Å; T191-N206 PolarHBondContact OG1-OD1 3.34Å
192	C	96.5	Very high	94.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.5	161.8	-179.1	0	0	0	0	108.5	V119 C135 V147 W149 R204 A205	V119-C192 HydrophobicContact CG2-CB 3.54Å; C135-C192 HydrophobicContact CB-CB 3.64Å; C135-C192 WeakPolarHBondContact CB-SG 3.23Å; C135-C192 WeakPolarHBondContact SG-CB 3.43Å; C135-C192 CovalentContact SG-SG 2.02Å; C135-C192 PolarHBondContact SG-SG 3.14Å; V147-C192 VanDerWaalsContact CG1-SG 3.54Å; W149-C192 HydrophobicContact CE3-CB 4.14Å; W149-C192 HydrophobicContact CH2-CB 4.14Å; W149-C192 HydrophobicContact CZ3-CB 3.92Å; C192-R204 WeakPolarHBondContact O-CA 3.37Å; C192-A205 PolarHBondContact N-O 2.93Å; C192-A205 PolarHBondContact O-N 3.43Å
193	V	96.8	Very high	94.3	Very high	4 Å²	4	60.9 Å²	60.9	2%	0.024	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.1	177.1	-176.1	0	0	0	0	108.6	V147 V148 M150 T191 P202 I203 R204	V147-V193 WeakPolarHBondContact CA-O 3.24Å; V148-V193 HydrophobicContact CG2-CB 3.73Å; V148-V193 HydrophobicContact CG2-CG1 4.32Å; V148-V193 PolarHBondContact N-O 2.94Å; V148-V193 PolarHBondContact O-N 3.1Å; M150-V193 HydrophobicContact CE-CB 4.3Å; M150-V193 HydrophobicContact CE-CG2 3.62Å; M150-V193 HydrophobicContact CG-CG2 4.26Å; M150-V193 HydrophobicContact SD-CG2 3.84Å; T191-V193 HydrophobicContact CG2-CG2 3.77Å; V193-P202 HydrophobicContact CG1-CB 3.73Å; V193-I203 CarbonylContact C-O 3.58Å; V193-I203 WeakPolarHBondContact CA-O 3.17Å; V193-R204 HydrophobicContact CG1-CG 4.43Å; V193-R204 HydrophobicContact CG2-CG 4.18Å
194	V	96.2	Very high	94.4	Very high	2 Å²	2	63.9 Å²	63.9	1%	0.012	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.9	-176.7	-178.8	0	0	0	0	108.9	P115 V117 V137 V145 T146 V147 P202 I203	P115-V194 HydrophobicContact CB-CG1 4.49Å; P115-V194 HydrophobicContact CG-CG1 4.04Å; V117-V194 HydrophobicContact CB-CG2 4.48Å; V117-V194 HydrophobicContact CG1-CG2 3.89Å; V117-V194 HydrophobicContact CG2-CB 4.04Å; V117-V194 HydrophobicContact CG2-CG1 4.33Å; V117-V194 HydrophobicContact CG2-CG2 3.7Å; V137-V194 HydrophobicContact CG1-CG1 3.88Å; V137-V194 HydrophobicContact CG2-CG1 4.47Å; V137-V194 HydrophobicContact CG2-CG2 3.73Å; V145-V194 HydrophobicContact CG2-CG1 3.71Å; T146-V194 CarbonylContact O-C 3.54Å; T146-V194 WeakPolarHBondContact O-CA 3.38Å; V147-V194 HydrophobicContact CG1-CG2 4.32Å; V147-V194 HydrophobicContact CG2-CG2 4.29Å; V194-P202 CarbonylContact O-C 3.6Å; V194-P202 WeakPolarHBondContact O-CA 3.35Å; V194-I203 HydrophobicContact CB-CB 4.42Å; V194-I203 PolarHBondContact N-O 2.72Å; V194-I203 PolarHBondContact O-N 3.47Å
195	Q	96	Very high	94.6	Very high	103 Å²	103	62.6 Å²	62.6	48%	0.481	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	131.2	172.6	-67.3	178.9	-45.9	0	0	109	T146 P202	T146-Q195 PolarHBondContact N-O 3.17Å; T146-Q195 PolarHBondContact O-N 3.41Å; Q195-P202 HydrophobicContact CG-CB 3.97Å; Q195-P202 HydrophobicContact CG-CG 4.03Å
196	H	96.4	Very high	94.8	Very high	12 Å²	12	64.8 Å²	64.8	6%	0.056	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	139.1	-175.4	-179.2	-95.1	0	0	0	109.1	R113 P115 F140 Y141 P142 D144 V145 G198 T199	R113-H196 PolarHBondContact O-CE1 3.33Å; R113-H196 VanDerWaalsContact O-CE1 3.26Å; P115-H196 HydrophobicContact CG-CB 3.76Å; F140-H196 AromaticContact CD2-CD2 3.69Å; F140-H196 AromaticContact CD2-NE2 3.59Å; Y141-H196 PolarHBondContact O-CE1 3.37Å; P142-H196 PolarHBondContact O-NE2 3.43Å; D144-H196 PolarHBondContact O-CD2 2.9Å; V145-H196 HydrophobicContact CG2-CB 4.41Å; H196-G198 PolarHBondContact CE1-N 3.48Å; H196-G198 WeakPolarHBondContact ND1-CA 3.34Å; H196-G198 PolarHBondContact ND1-N 2.94Å; H196-G198 PolarHBondContact O-N 2.88Å; H196-G198 VanDerWaalsContact O-N 3.1Å; H196-T199 PolarHBondContact O-N 3.35Å
197	S	94.7	Very high	95.2	Very high	80 Å²	80	58.8 Å²	58.8	56%	0.559	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.4	-176.6	56.6	0	0	0	0	114.2	P142 T199	P142-S197 WeakPolarHBondContact CD-OG 3.38Å; S197-T199 VanDerWaalsContact C-N 3.28Å; S197-T199 PolarHBondContact O-N 2.7Å
198	G	92.7	Very high	95.4	Very high	13 Å²	13	52.6 Å²	52.6	13%	0.134	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-9.2	174	0	0	0	0	0	114.8	T114 H196	T114-G198 VanDerWaalsContact CG2-O 3.23Å; T114-G198 WeakPolarHBondContact CG2-O 3.42Å; H196-G198 PolarHBondContact CE1-N 3.48Å; H196-G198 WeakPolarHBondContact ND1-CA 3.34Å; H196-G198 PolarHBondContact ND1-N 2.94Å; H196-G198 PolarHBondContact O-N 2.88Å; H196-G198 VanDerWaalsContact O-N 3.1Å
199	T	93.7	Very high	95.2	Very high	32 Å²	32	53 Å²	53	20%	0.196	29%	0.286	C	S	.	.			trans	-127.6	123.3	177.8	-42.6	0	0	0	0	109.9	H196 S197 E201 I203	H196-T199 PolarHBondContact O-N 3.35Å; S197-T199 VanDerWaalsContact C-N 3.28Å; S197-T199 PolarHBondContact O-N 2.7Å; T199-E201 VanDerWaalsContact C-N 3.26Å; T199-E201 WeakPolarHBondContact CG2-O 3.34Å; T199-E201 PolarHBondContact O-N 2.86Å; T199-I203 HydrophobicContact CG2-CD1 4.17Å; T199-I203 HydrophobicContact CG2-CG1 4.11Å
200	P	93.6	Very high	94.6	Very high	126 Å²	126	52.5 Å²	52.5	82%	0.818	30%	0.299	S	S	*	.	S	Bend	trans	-64.5	-33.2	-177.9	25.2	-33.9	0	0	0	112.4
201	E	95.6	Very high	93.5	Very high	144 Å²	144	56.5 Å²	56.5	67%	0.673	32%	0.321	S	S	*	.	S	Bend	trans	-109.7	145.8	-180	-66.6	-61.3	152.2	0	0	111.3	T199 I203	T199-E201 VanDerWaalsContact C-N 3.26Å; T199-E201 WeakPolarHBondContact CG2-O 3.34Å; T199-E201 PolarHBondContact O-N 2.86Å; E201-I203 PolarHBondContact O-N 2.91Å
202	P	96.4	Very high	92.4	Very high	40 Å²	40	58.2 Å²	58.2	26%	0.26	33%	0.333	S	S	.	.			trans	-62.5	132.1	176.6	-20.1	31.1	0	0	0	112.4	V193 V194 Q195	V193-P202 HydrophobicContact CG1-CB 3.73Å; V194-P202 CarbonylContact O-C 3.6Å; V194-P202 WeakPolarHBondContact O-CA 3.35Å; Q195-P202 HydrophobicContact CG-CB 3.97Å; Q195-P202 HydrophobicContact CG-CG 4.03Å
203	I	97.3	Very high	91.4	Very high	45 Å²	45	63.3 Å²	63.3	23%	0.231	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	131.2	175	-65.5	161.1	0	0	0	109	P115 V117 V193 V194 T199 E201	P115-I203 HydrophobicContact CG-CD1 3.75Å; P115-I203 WeakPolarHBondContact O-CD1 3.08Å; V117-I203 HydrophobicContact CB-CG2 3.98Å; V117-I203 HydrophobicContact CG2-CB 4.25Å; V117-I203 HydrophobicContact CG2-CG2 3.66Å; V193-I203 CarbonylContact C-O 3.58Å; V193-I203 WeakPolarHBondContact CA-O 3.17Å; V194-I203 HydrophobicContact CB-CB 4.42Å; V194-I203 PolarHBondContact N-O 2.72Å; V194-I203 PolarHBondContact O-N 3.47Å; T199-I203 HydrophobicContact CG2-CD1 4.17Å; T199-I203 HydrophobicContact CG2-CG1 4.11Å; E201-I203 PolarHBondContact O-N 2.91Å
204	R	97.2	Very high	90.6	Very high	147 Å²	147	68.8 Å²	68.8	56%	0.555	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.9	-177.5	-60.4	-178.1	178.6	-103.5	1.4	110.4	T191 C192 V193	T191-R204 HydrophobicContact CG2-CB 3.92Å; T191-R204 HydrophobicContact CG2-CG 4.4Å; C192-R204 WeakPolarHBondContact O-CA 3.37Å; V193-R204 HydrophobicContact CG1-CG 4.43Å; V193-R204 HydrophobicContact CG2-CG 4.18Å
205	A	96.8	Very high	89.9	Confident	16 Å²	16	73.2 Å²	73.2	13%	0.132	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.9	175.4	0	0	0	0	0	109.8	V117 V119 T191 C192	V117-A205 HydrophobicContact CB-CB 4.46Å; V117-A205 HydrophobicContact CG1-CB 3.73Å; V119-A205 HydrophobicContact CG2-CB 3.7Å; T191-A205 WeakPolarHBondContact CA-O 3.4Å; C192-A205 PolarHBondContact N-O 2.93Å; C192-A205 PolarHBondContact O-N 3.43Å
206	N	95.4	Very high	89.2	Confident	106 Å²	106	71.7 Å²	71.7	57%	0.567	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	149.1	-176.9	-66	-22.9	0	0	0	111.8	I189 Y190 T191	I189-N206 HydrophobicContact CG2-CB 4.39Å; Y190-N206 CarbonylContact O-C 3.58Å; Y190-N206 WeakPolarHBondContact O-CA 3.42Å; T191-N206 WeakPolarHBondContact CB-OD1 3.36Å; T191-N206 WeakPolarHBondContact CG2-OD1 3.32Å; T191-N206 PolarHBondContact OG1-OD1 3.34Å
207	W	94.9	Very high	88.9	Confident	43 Å²	43	75.2 Å²	75.2	16%	0.163	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.7	169.2	-178.9	92	0	0	0	109.3	V119 V131 L133 L182 P184 Y190 P209	V119-W207 HydrophobicContact CB-CB 4.38Å; V119-W207 HydrophobicContact CG1-CB 3.67Å; V119-W207 HydrophobicContact CG1-CG 4.19Å; V131-W207 HydrophobicContact CG1-CH2 4.12Å; V131-W207 HydrophobicContact CG1-CZ2 4.37Å; L133-W207 HydrophobicContact CD1-CB 4.06Å; L133-W207 HydrophobicContact CD1-CD2 3.73Å; L133-W207 HydrophobicContact CD1-CE3 3.56Å; L133-W207 HydrophobicContact CD1-CG 3.95Å; L133-W207 HydrophobicContact CD1-CZ3 4.21Å; L133-W207 HydrophobicContact CD2-CD2 3.46Å; L133-W207 VanDerWaalsContact CD2-CD2 3.46Å; L133-W207 VanDerWaalsContact CD2-CE2 3.42Å; L133-W207 HydrophobicContact CD2-CE3 3.88Å; L133-W207 HydrophobicContact CD2-CG 3.82Å; L133-W207 HydrophobicContact CD2-CH2 4.19Å; L133-W207 HydrophobicContact CD2-CZ2 3.82Å; L133-W207 HydrophobicContact CD2-CZ3 4.2Å; L133-W207 HydrophobicContact CG-CD2 4.23Å; L133-W207 HydrophobicContact CG-CE3 4.27Å; L182-W207 HydrophobicContact CD1-CH2 4.46Å; L182-W207 HydrophobicContact CD1-CZ3 4.14Å; P184-W207 HydrophobicContact CB-CH2 4.11Å; P184-W207 HydrophobicContact CB-CZ3 4.27Å; Y190-W207 AromaticContact CD2-CE3 3.59Å; Y190-W207 HydrophobicContact CD2-CE3 3.59Å; Y190-W207 AromaticContact CD2-CZ3 3.67Å; Y190-W207 HydrophobicContact CD2-CZ3 3.67Å; Y190-W207 HydrophobicContact CE2-CE3 4.33Å; Y190-W207 AromaticContact CE2-CZ3 3.95Å; Y190-W207 HydrophobicContact CE2-CZ3 3.95Å; Y190-W207 HydrophobicContact CG-CE3 4.26Å; Y190-W207 PolarHBondContact N-O 2.67Å; Y190-W207 PolarHBondContact O-N 2.83Å; W207-P209 HydrophobicContact CE3-CG 4.45Å; W207-P209 HydrophobicContact CH2-CB 4.24Å; W207-P209 HydrophobicContact CH2-CG 3.85Å; W207-P209 HydrophobicContact CZ3-CB 4.44Å; W207-P209 HydrophobicContact CZ3-CG 3.6Å
208	T	93	Very high	88.6	Confident	82 Å²	82	78 Å²	78	50%	0.503	44%	0.437	S	S	.	.			trans	-124.3	139.9	177.9	53.2	0	0	0	0	109.7	I189 G210	I189-T208 HydrophobicContact CB-CG2 4.44Å; I189-T208 HydrophobicContact CG1-CG2 3.99Å; I189-T208 HydrophobicContact CG2-CG2 4.28Å; T208-G210 PolarHBondContact O-N 3.36Å
209	P	87.3	Confident	88.5	Confident	22 Å²	22	81.1 Å²	81.1	14%	0.143	45%	0.453	C	S	.	.	S	Bend	trans	-60.4	130.5	171.1	-25.3	38.1	0	0	0	111.1	P184 S185 D188 W207	P184-P209 HydrophobicContact CB-CB 3.88Å; P184-P209 HydrophobicContact CB-CG 3.4Å; S185-P209 WeakPolarHBondContact O-CG 3.42Å; D188-P209 WeakPolarHBondContact O-CD 3.29Å; W207-P209 HydrophobicContact CE3-CG 4.45Å; W207-P209 HydrophobicContact CH2-CB 4.24Å; W207-P209 HydrophobicContact CH2-CG 3.85Å; W207-P209 HydrophobicContact CZ3-CB 4.44Å; W207-P209 HydrophobicContact CZ3-CG 3.6Å
210	G	82.3	Confident	88.4	Confident	65 Å²	65	82.7 Å²	82.7	67%	0.67	47%	0.465	S	S	*	.	S	Bend	trans	141.1	-173.9	177.6	0	0	0	0	0	113.6	T208	T208-G210 PolarHBondContact O-N 3.36Å
211	L	73.2	Confident	88.4	Confident	91 Å²	91	80.6 Å²	80.6	48%	0.476	45%	0.45	S	S	.	.			trans	-77.2	139.9	174.1	-69.4	163.1	0	0	0	109.3	Q215 T216 V219	L211-Q215 HydrophobicContact CB-CB 3.82Å; L211-Q215 HydrophobicContact CD2-CB 3.83Å; L211-Q215 HydrophobicContact CD2-CG 4.47Å; L211-Q215 HydrophobicContact CG-CB 4.34Å; L211-T216 WeakPolarHBondContact CB-OG1 3.14Å; L211-T216 PolarHBondContact O-OG1 3.2Å; L211-V219 HydrophobicContact CD1-CB 4.28Å; L211-V219 HydrophobicContact CD1-CG2 3.81Å
212	S	74.1	Confident	88.2	Confident	49 Å²	49	76.9 Å²	76.9	34%	0.343	44%	0.44	S	S	.	.			trans	-57.7	155.1	169.8	62	0	0	0	0	110.2	I214 Q215 T216	S212-I214 PolarHBondContact O-N 3.35Å; S212-Q215 CarbonylContact O-C 3.48Å; S212-Q215 WeakPolarHBondContact O-CA 3.44Å; S212-Q215 WeakPolarHBondContact O-CB 3.33Å; S212-Q215 PolarHBondContact O-N 2.91Å; S212-Q215 WeakPolarHBondContact OG-CB 3.43Å; S212-Q215 VanDerWaalsContact OG-CD 3.31Å; S212-Q215 VanDerWaalsContact OG-CG 3.26Å; S212-Q215 WeakPolarHBondContact OG-CG 3.44Å; S212-Q215 PolarHBondContact OG-N 2.89Å; S212-Q215 PolarHBondContact OG-OE1 3.48Å; S212-T216 PolarHBondContact O-N 2.8Å; S212-T216 PolarHBondContact O-OG1 3.23Å
213	P	76.5	Confident	88.2	Confident	108 Å²	108	77.8 Å²	77.8	70%	0.701	45%	0.451	S	S	*	.	H	α-helix	trans	-51.2	-39.3	-179.2	-28.6	34.9	0	0	0	113.4	T216 V217	P213-T216 PolarHBondContact O-N 3.49Å; P213-V217 WeakPolarHBondContact O-CG2 3.19Å; P213-V217 PolarHBondContact O-N 3.32Å
214	I	79.5	Confident	88.1	Confident	119 Å²	119	78.7 Å²	78.7	61%	0.61	47%	0.465	S	S	*	.	H	α-helix	trans	-63.5	-43.2	176.2	-61.5	171.4	0	0	0	111.1	S212 V217 K218	S212-I214 PolarHBondContact O-N 3.35Å; I214-V217 PolarHBondContact O-N 2.92Å; I214-K218 HydrophobicContact CG2-CD 4.48Å; I214-K218 WeakPolarHBondContact O-CG 3.3Å; I214-K218 PolarHBondContact O-N 3.43Å
215	Q	81.8	Confident	88	Confident	94 Å²	94	76.1 Å²	76.1	44%	0.439	47%	0.466	S	S	.	.	H	α-helix	trans	-69.2	-38.6	177	-74.1	170	-46.7	0	0	111.8	L211 S212 V217 K218 V219	L211-Q215 HydrophobicContact CB-CB 3.82Å; L211-Q215 HydrophobicContact CD2-CB 3.83Å; L211-Q215 HydrophobicContact CD2-CG 4.47Å; L211-Q215 HydrophobicContact CG-CB 4.34Å; S212-Q215 CarbonylContact O-C 3.48Å; S212-Q215 WeakPolarHBondContact O-CA 3.44Å; S212-Q215 WeakPolarHBondContact O-CB 3.33Å; S212-Q215 PolarHBondContact O-N 2.91Å; S212-Q215 WeakPolarHBondContact OG-CB 3.43Å; S212-Q215 VanDerWaalsContact OG-CD 3.31Å; S212-Q215 VanDerWaalsContact OG-CG 3.26Å; S212-Q215 WeakPolarHBondContact OG-CG 3.44Å; S212-Q215 PolarHBondContact OG-N 2.89Å; S212-Q215 PolarHBondContact OG-OE1 3.48Å; Q215-V217 VanDerWaalsContact C-N 3.33Å; Q215-V217 PolarHBondContact O-N 2.83Å; Q215-K218 PolarHBondContact O-N 2.85Å; Q215-V219 WeakPolarHBondContact O-CB 3.46Å; Q215-V219 WeakPolarHBondContact O-CG2 3.33Å; Q215-V219 PolarHBondContact O-N 2.96Å
216	T	81.4	Confident	88	Confident	71 Å²	71	81.6 Å²	81.6	44%	0.436	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-42.4	174.6	-56.9	0	0	0	0	111.2	L211 S212 P213 V219 S220	L211-T216 WeakPolarHBondContact CB-OG1 3.14Å; L211-T216 PolarHBondContact O-OG1 3.2Å; S212-T216 PolarHBondContact O-N 2.8Å; S212-T216 PolarHBondContact O-OG1 3.23Å; P213-T216 PolarHBondContact O-N 3.49Å; T216-V219 PolarHBondContact O-N 2.97Å; T216-S220 WeakPolarHBondContact O-CB 3.33Å; T216-S220 PolarHBondContact O-N 3.24Å; T216-S220 PolarHBondContact O-OG 2.6Å
217	V	89	Confident	88	Confident	86 Å²	86	78 Å²	78	52%	0.521	48%	0.481	S	S	.	.	H	α-helix	trans	-63.1	-46	172.5	172.8	0	0	0	0	110.9	P213 I214 Q215 V219 S220 V221	P213-V217 WeakPolarHBondContact O-CG2 3.19Å; P213-V217 PolarHBondContact O-N 3.32Å; I214-V217 PolarHBondContact O-N 2.92Å; Q215-V217 VanDerWaalsContact C-N 3.33Å; Q215-V217 PolarHBondContact O-N 2.83Å; V217-V219 PolarHBondContact O-N 3.41Å; V217-S220 WeakPolarHBondContact CA-OG 3.45Å; V217-S220 PolarHBondContact O-N 2.9Å; V217-S220 PolarHBondContact O-OG 2.74Å; V217-V221 HydrophobicContact CG1-CG2 4.19Å; V217-V221 WeakPolarHBondContact O-CB 3.46Å; V217-V221 VanDerWaalsContact O-CG2 3.24Å; V217-V221 WeakPolarHBondContact O-CG2 3.29Å; V217-V221 PolarHBondContact O-N 2.84Å
218	K	89.1	Confident	88.1	Confident	139 Å²	139	81.2 Å²	81.2	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-60.2	-45.2	177.4	-76.3	-179.7	176.9	-173.6	0	112.4	I214 Q215 S222	I214-K218 HydrophobicContact CG2-CD 4.48Å; I214-K218 WeakPolarHBondContact O-CG 3.3Å; I214-K218 PolarHBondContact O-N 3.43Å; Q215-K218 PolarHBondContact O-N 2.85Å; K218-S222 VanDerWaalsContact O-CB 3.29Å; K218-S222 WeakPolarHBondContact O-CB 3.34Å; K218-S222 PolarHBondContact O-N 3.01Å; K218-S222 PolarHBondContact O-OG 2.99Å
219	V	91.1	Very high	88.3	Confident	79 Å²	79	79.1 Å²	79.1	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-66.6	-43	179.6	170.8	0	0	0	0	110.7	L211 Q215 T216 V217 S222 A223	L211-V219 HydrophobicContact CD1-CB 4.28Å; L211-V219 HydrophobicContact CD1-CG2 3.81Å; Q215-V219 WeakPolarHBondContact O-CB 3.46Å; Q215-V219 WeakPolarHBondContact O-CG2 3.33Å; Q215-V219 PolarHBondContact O-N 2.96Å; T216-V219 PolarHBondContact O-N 2.97Å; V217-V219 PolarHBondContact O-N 3.41Å; V219-S222 PolarHBondContact O-N 3.38Å; V219-A223 VanDerWaalsContact O-CB 3.3Å; V219-A223 WeakPolarHBondContact O-CB 3.33Å; V219-A223 PolarHBondContact O-N 3.33Å
220	S	90.4	Very high	88.7	Confident	64 Å²	64	84.7 Å²	84.7	45%	0.448	52%	0.517	S	S	.	.	H	α-helix	trans	-65.4	-43.2	177.2	56.9	0	0	0	0	112.7	T216 V217 S222 A223 A224	T216-S220 WeakPolarHBondContact O-CB 3.33Å; T216-S220 PolarHBondContact O-N 3.24Å; T216-S220 PolarHBondContact O-OG 2.6Å; V217-S220 WeakPolarHBondContact CA-OG 3.45Å; V217-S220 PolarHBondContact O-N 2.9Å; V217-S220 PolarHBondContact O-OG 2.74Å; S220-S222 VanDerWaalsContact C-N 3.35Å; S220-S222 PolarHBondContact O-N 3.3Å; S220-A223 PolarHBondContact O-N 2.91Å; S220-A224 WeakPolarHBondContact O-CB 3.47Å; S220-A224 PolarHBondContact O-N 2.86Å
221	V	93.6	Very high	89.4	Confident	82 Å²	82	86.2 Å²	86.2	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-42.7	174.1	171.2	0	0	0	0	111	V217 A224 T225	V217-V221 HydrophobicContact CG1-CG2 4.19Å; V217-V221 WeakPolarHBondContact O-CB 3.46Å; V217-V221 VanDerWaalsContact O-CG2 3.24Å; V217-V221 WeakPolarHBondContact O-CG2 3.29Å; V217-V221 PolarHBondContact O-N 2.84Å; V221-A224 PolarHBondContact O-N 2.85Å; V221-T225 WeakPolarHBondContact O-CB 3.36Å; V221-T225 PolarHBondContact O-N 3.43Å; V221-T225 PolarHBondContact O-OG1 3.14Å
222	S	92.5	Very high	90.4	Very high	66 Å²	66	87 Å²	87	46%	0.462	51%	0.513	S	S	.	.	H	α-helix	trans	-62.8	-45.4	176.6	-56.6	0	0	0	0	111.3	K218 V219 S220 T225 L226	K218-S222 VanDerWaalsContact O-CB 3.29Å; K218-S222 WeakPolarHBondContact O-CB 3.34Å; K218-S222 PolarHBondContact O-N 3.01Å; K218-S222 PolarHBondContact O-OG 2.99Å; V219-S222 PolarHBondContact O-N 3.38Å; S220-S222 VanDerWaalsContact C-N 3.35Å; S220-S222 PolarHBondContact O-N 3.3Å; S222-T225 PolarHBondContact O-N 3.46Å; S222-L226 WeakPolarHBondContact O-CB 3.33Å; S222-L226 VanDerWaalsContact O-CG 3.32Å; S222-L226 WeakPolarHBondContact O-CG 3.35Å; S222-L226 PolarHBondContact O-N 3.43Å
223	A	95.4	Very high	91.4	Very high	59 Å²	59	91.2 Å²	91.2	49%	0.488	53%	0.525	S	S	.	.	H	α-helix	trans	-63.9	-42.4	177.6	0	0	0	0	0	112.1	V219 S220 L226 G227	V219-A223 VanDerWaalsContact O-CB 3.3Å; V219-A223 WeakPolarHBondContact O-CB 3.33Å; V219-A223 PolarHBondContact O-N 3.33Å; S220-A223 PolarHBondContact O-N 2.91Å; A223-L226 PolarHBondContact O-N 2.93Å; A223-G227 PolarHBondContact O-N 3.35Å
224	A	95.4	Very high	92.3	Very high	65 Å²	65	87.8 Å²	87.8	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-41.9	176.2	0	0	0	0	0	111.8	S220 V221 G227 L228	S220-A224 WeakPolarHBondContact O-CB 3.47Å; S220-A224 PolarHBondContact O-N 2.86Å; V221-A224 PolarHBondContact O-N 2.85Å; A224-G227 PolarHBondContact O-N 2.87Å; A224-L228 WeakPolarHBondContact O-CB 3.34Å; A224-L228 PolarHBondContact O-N 3.32Å
225	T	95.3	Very high	93.1	Very high	93 Å²	93	87.2 Å²	87.2	57%	0.571	50%	0.501	S	S	*	.	H	α-helix	trans	-65.6	-43.7	177.9	-54	0	0	0	0	111.2	V221 S222 L228 G229	V221-T225 WeakPolarHBondContact O-CB 3.36Å; V221-T225 PolarHBondContact O-N 3.43Å; V221-T225 PolarHBondContact O-OG1 3.14Å; S222-T225 PolarHBondContact O-N 3.46Å; T225-L228 PolarHBondContact O-N 2.83Å; T225-G229 PolarHBondContact O-N 2.85Å
226	L	96.9	Very high	93.6	Very high	130 Å²	130	84.7 Å²	84.7	68%	0.681	50%	0.5	S	S	*	.	H	α-helix	trans	-63.2	-42.2	174.3	-74.6	172	0	0	0	111.7	S222 A223 G229 F230	S222-L226 WeakPolarHBondContact O-CB 3.33Å; S222-L226 VanDerWaalsContact O-CG 3.32Å; S222-L226 WeakPolarHBondContact O-CG 3.35Å; S222-L226 PolarHBondContact O-N 3.43Å; A223-L226 PolarHBondContact O-N 2.93Å; L226-G229 PolarHBondContact O-N 2.91Å; L226-F230 WeakPolarHBondContact O-CB 3.41Å; L226-F230 PolarHBondContact O-N 3.4Å
227	G	95.9	Very high	94.1	Very high	32 Å²	32	85.9 Å²	85.9	33%	0.33	50%	0.499	S	S	.	.	H	α-helix	trans	-61.5	-45.5	176.2	0	0	0	0	0	112.4	A223 A224 F230 I231	A223-G227 PolarHBondContact O-N 3.35Å; A224-G227 PolarHBondContact O-N 2.87Å; G227-F230 PolarHBondContact O-N 3.23Å; G227-I231 VanDerWaalsContact O-CG1 3.29Å; G227-I231 WeakPolarHBondContact O-CG1 2.98Å; G227-I231 PolarHBondContact O-N 2.85Å
228	L	96.6	Very high	94.1	Very high	110 Å²	110	88.1 Å²	88.1	58%	0.576	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-44.1	176.5	-169.6	71.2	0	0	0	111.5	A224 T225 F230 I231 I232	A224-L228 WeakPolarHBondContact O-CB 3.34Å; A224-L228 PolarHBondContact O-N 3.32Å; T225-L228 PolarHBondContact O-N 2.83Å; L228-F230 VanDerWaalsContact C-N 3.33Å; L228-F230 PolarHBondContact O-N 3.47Å; L228-I231 PolarHBondContact O-N 3.32Å; L228-I232 HydrophobicContact CG-CD1 4.18Å; L228-I232 WeakPolarHBondContact O-CG1 3.08Å; L228-I232 PolarHBondContact O-N 2.87Å
229	G	96.1	Very high	94.1	Very high	38 Å²	38	91.2 Å²	91.2	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-59.9	-41.8	175.2	0	0	0	0	0	112.5	T225 L226 I232 F233	T225-G229 PolarHBondContact O-N 2.85Å; L226-G229 PolarHBondContact O-N 2.91Å; G229-I232 PolarHBondContact O-N 2.87Å; G229-F233 WeakPolarHBondContact O-CB 3.07Å; G229-F233 PolarHBondContact O-N 2.8Å
230	F	96.7	Very high	93.8	Very high	138 Å²	138	94.7 Å²	94.7	61%	0.605	52%	0.515	S	S	*	.	H	α-helix	trans	-64.9	-42.2	176.5	-173.8	-103.2	0	0	0	112.2	L226 G227 L228 F233 C234	L226-F230 WeakPolarHBondContact O-CB 3.41Å; L226-F230 PolarHBondContact O-N 3.4Å; G227-F230 PolarHBondContact O-N 3.23Å; L228-F230 VanDerWaalsContact C-N 3.33Å; L228-F230 PolarHBondContact O-N 3.47Å; F230-F233 PolarHBondContact O-N 3.44Å; F230-C234 WeakPolarHBondContact O-CB 3.46Å; F230-C234 PolarHBondContact O-N 2.89Å; F230-C234 PolarHBondContact O-SG 3.32Å; F230-C234 VanDerWaalsContact O-SG 3.32Å
231	I	96.2	Very high	93.4	Very high	97 Å²	97	99.5 Å²	99.5	50%	0.497	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-46.3	176	-67.9	164.2	0	0	0	110.9	G227 L228 F233 C234 L235	G227-I231 VanDerWaalsContact O-CG1 3.29Å; G227-I231 WeakPolarHBondContact O-CG1 2.98Å; G227-I231 PolarHBondContact O-N 2.85Å; L228-I231 PolarHBondContact O-N 3.32Å; I231-F233 VanDerWaalsContact C-N 3.33Å; I231-F233 PolarHBondContact O-N 3.46Å; I231-C234 PolarHBondContact O-N 3.18Å; I231-L235 HydrophobicContact CG2-CD1 3.94Å; I231-L235 HydrophobicContact CG2-CG 4.38Å; I231-L235 WeakPolarHBondContact O-CB 3.46Å; I231-L235 VanDerWaalsContact O-CG 3.29Å; I231-L235 WeakPolarHBondContact O-CG 3.44Å; I231-L235 PolarHBondContact O-N 3.02Å
232	I	95.6	Very high	92.6	Very high	107 Å²	107	103.7 Å²	103.7	55%	0.549	54%	0.535	S	S	.	.	H	α-helix	trans	-61.4	-43.8	177.3	-66.5	166.7	0	0	0	110.5	L228 G229 L235 G236	L228-I232 HydrophobicContact CG-CD1 4.18Å; L228-I232 WeakPolarHBondContact O-CG1 3.08Å; L228-I232 PolarHBondContact O-N 2.87Å; G229-I232 PolarHBondContact O-N 2.87Å; I232-L235 PolarHBondContact O-N 2.93Å; I232-G236 PolarHBondContact O-N 2.89Å
233	F	95.4	Very high	91.4	Very high	139 Å²	139	104.8 Å²	104.8	61%	0.61	54%	0.542	S	S	*	.	H	α-helix	trans	-60.3	-47.7	176.4	178.3	-98.4	0	0	0	111.8	G229 F230 I231 G236 F237	G229-F233 WeakPolarHBondContact O-CB 3.07Å; G229-F233 PolarHBondContact O-N 2.8Å; F230-F233 PolarHBondContact O-N 3.44Å; I231-F233 VanDerWaalsContact C-N 3.33Å; I231-F233 PolarHBondContact O-N 3.46Å; F233-G236 PolarHBondContact O-N 3.5Å; F233-F237 WeakPolarHBondContact O-CB 3.15Å; F233-F237 PolarHBondContact O-N 3Å
234	C	95.3	Very high	89.7	Confident	35 Å²	35	108.4 Å²	108.4	24%	0.236	55%	0.549	C	S	.	.	H	α-helix	trans	-60.8	-47.2	176.5	-71.9	0	0	0	0	111.8	F230 I231 G236 F237 F238	F230-C234 WeakPolarHBondContact O-CB 3.46Å; F230-C234 PolarHBondContact O-N 2.89Å; F230-C234 PolarHBondContact O-SG 3.32Å; F230-C234 VanDerWaalsContact O-SG 3.32Å; I231-C234 PolarHBondContact O-N 3.18Å; C234-G236 VanDerWaalsContact C-N 3.32Å; C234-G236 PolarHBondContact O-N 2.88Å; C234-F237 PolarHBondContact O-N 3.27Å; C234-F238 HydrophobicContact CB-CD2 4.41Å; C234-F238 HydrophobicContact CB-CE2 4.36Å; C234-F238 WeakPolarHBondContact O-CD2 3.29Å; C234-F238 PolarHBondContact O-N 3.38Å
235	L	94.9	Very high	87.9	Confident	108 Å²	108	110.7 Å²	110.7	57%	0.565	56%	0.561	S	S	*	*	H	α-helix	trans	-60.9	-41	177.7	-71.1	173.7	0	0	0	111.9	I231 I232 R239	I231-L235 HydrophobicContact CG2-CD1 3.94Å; I231-L235 HydrophobicContact CG2-CG 4.38Å; I231-L235 WeakPolarHBondContact O-CB 3.46Å; I231-L235 VanDerWaalsContact O-CG 3.29Å; I231-L235 WeakPolarHBondContact O-CG 3.44Å; I231-L235 PolarHBondContact O-N 3.02Å; I232-L235 PolarHBondContact O-N 2.93Å; L235-R239 WeakPolarHBondContact O-CB 3.46Å; L235-R239 WeakPolarHBondContact O-CG 3.06Å; L235-R239 PolarHBondContact O-N 3.34Å; L235-R239 VanDerWaalsContact O-N 3.08Å
236	G	92	Very high	85.9	Confident	41 Å²	41	111 Å²	111	42%	0.423	57%	0.567	S	S	.	*	H	α-helix	trans	-62.1	-47.3	173.5	0	0	0	0	0	112.2	I232 F233 C234 R239 W240	I232-G236 PolarHBondContact O-N 2.89Å; F233-G236 PolarHBondContact O-N 3.5Å; C234-G236 VanDerWaalsContact C-N 3.32Å; C234-G236 PolarHBondContact O-N 2.88Å; G236-R239 PolarHBondContact O-N 3.08Å; G236-W240 WeakPolarHBondContact O-CB 3.39Å; G236-W240 PolarHBondContact O-N 3.46Å
237	F	92	Very high	83.7	Confident	95 Å²	95	109.5 Å²	109.5	42%	0.417	57%	0.567	S	S	.	*	H	α-helix	trans	-62.6	-43.9	178.8	-176.2	-101	0	0	0	112.6	F233 C234 W240 R241	F233-F237 WeakPolarHBondContact O-CB 3.15Å; F233-F237 PolarHBondContact O-N 3Å; C234-F237 PolarHBondContact O-N 3.27Å; F237-W240 HydrophobicContact CD2-CE3 4.44Å; F237-W240 HydrophobicContact CE2-CE3 4.36Å; F237-W240 HydrophobicContact CE2-CZ3 4.36Å; F237-W240 PolarHBondContact O-N 2.87Å; F237-R241 PolarHBondContact O-N 3.42Å
238	F	90.1	Very high	81.6	Confident	133 Å²	133	118.1 Å²	118.1	58%	0.583	59%	0.591	S	S	*	*	H	α-helix	trans	-65.4	-39.4	176.7	-79.6	-65.7	0	0	0	112.5	C234 R241 K242	C234-F238 HydrophobicContact CB-CD2 4.41Å; C234-F238 HydrophobicContact CB-CE2 4.36Å; C234-F238 WeakPolarHBondContact O-CD2 3.29Å; C234-F238 PolarHBondContact O-N 3.38Å; F238-R241 PolarHBondContact O-N 2.93Å; F238-K242 PolarHBondContact O-N 3.28Å
239	R	89.1	Confident	79.7	Confident	205 Å²	205	119.2 Å²	119.2	77%	0.774	60%	0.603	S	S	*	*	H	α-helix	trans	-64.9	-42.9	174.6	-79.8	-177.3	146	171.5	-4.8	112.1	L235 G236 K242 S243	L235-R239 WeakPolarHBondContact O-CB 3.46Å; L235-R239 WeakPolarHBondContact O-CG 3.06Å; L235-R239 PolarHBondContact O-N 3.34Å; L235-R239 VanDerWaalsContact O-N 3.08Å; G236-R239 PolarHBondContact O-N 3.08Å; R239-K242 PolarHBondContact O-N 3.01Å; R239-S243 PolarHBondContact O-N 2.88Å
240	W	84.5	Confident	78	Confident	152 Å²	152	122.4 Å²	122.4	58%	0.576	62%	0.617	S	S	*	*	H	α-helix	trans	-60.7	-44.8	175.9	-179.5	69.2	0	0	0	111.6	G236 F237 K242 S243 H244	G236-W240 WeakPolarHBondContact O-CB 3.39Å; G236-W240 PolarHBondContact O-N 3.46Å; F237-W240 HydrophobicContact CD2-CE3 4.44Å; F237-W240 HydrophobicContact CE2-CE3 4.36Å; F237-W240 HydrophobicContact CE2-CZ3 4.36Å; F237-W240 PolarHBondContact O-N 2.87Å; W240-K242 PolarHBondContact O-N 3.34Å; W240-S243 PolarHBondContact O-N 3.4Å; W240-H244 AromaticContact CE2-CD2 3.58Å; W240-H244 AromaticContact CE2-NE2 3.75Å; W240-H244 AromaticContact CZ2-CD2 3.85Å; W240-H244 AromaticContact CZ2-NE2 3.81Å; W240-H244 AromaticContact NE1-CD2 3.46Å; W240-H244 PolarHBondContact NE1-CD2 3.41Å; W240-H244 AromaticContact NE1-NE2 3.44Å; W240-H244 PolarHBondContact NE1-NE2 2.97Å; W240-H244 PolarHBondContact O-N 3.44Å
241	R	82.3	Confident	76.1	Confident	165 Å²	165	123 Å²	123	62%	0.623	63%	0.625	S	S	*	*	H	α-helix	trans	-62.6	-39.9	176.2	-162.1	-179.7	-172.4	175.6	3.9	112.6	F237 F238 H244 S245	F237-R241 PolarHBondContact O-N 3.42Å; F238-R241 PolarHBondContact O-N 2.93Å; R241-H244 PolarHBondContact O-N 3.43Å; R241-S245 PolarHBondContact O-N 2.91Å
242	K	76.8	Confident	74.4	Confident	169 Å²	169	124.7 Å²	124.7	74%	0.735	64%	0.642	S	S	*	*	H	α-helix	trans	-67.5	-35.8	177.7	-166.7	173.4	-178.2	176.8	0	112.1	F238 R239 W240 H244 S245	F238-K242 PolarHBondContact O-N 3.28Å; R239-K242 PolarHBondContact O-N 3.01Å; W240-K242 PolarHBondContact O-N 3.34Å; K242-H244 VanDerWaalsContact C-N 3.35Å; K242-S245 PolarHBondContact O-N 3.33Å
243	S	66.7	Low	72.7	Confident	89 Å²	89	123.1 Å²	123.1	62%	0.622	65%	0.653	S	S	*	*	H	α-helix	trans	-65.4	-36.9	176	-168.6	0	0	0	0	112.4	R239 W240 S245 S246	R239-S243 PolarHBondContact O-N 2.88Å; W240-S243 PolarHBondContact O-N 3.4Å; S243-S245 VanDerWaalsContact C-N 3.3Å; S243-S245 PolarHBondContact O-N 3.19Å; S243-S246 PolarHBondContact O-N 3.49Å
244	H	60	Low	70.9	Confident	136 Å²	136	120.1 Å²	120.1	63%	0.63	65%	0.649	S	S	*	*	H	α-helix	trans	-73.4	-17.9	177.9	-92	-75	0	0	0	114.2	W240 R241 K242	W240-H244 AromaticContact CE2-CD2 3.58Å; W240-H244 AromaticContact CE2-NE2 3.75Å; W240-H244 AromaticContact CZ2-CD2 3.85Å; W240-H244 AromaticContact CZ2-NE2 3.81Å; W240-H244 AromaticContact NE1-CD2 3.46Å; W240-H244 PolarHBondContact NE1-CD2 3.41Å; W240-H244 AromaticContact NE1-NE2 3.44Å; W240-H244 PolarHBondContact NE1-NE2 2.97Å; W240-H244 PolarHBondContact O-N 3.44Å; R241-H244 PolarHBondContact O-N 3.43Å; K242-H244 VanDerWaalsContact C-N 3.35Å
245	S	57.2	Low	69	Low	113 Å²	113	125.1 Å²	125.1	79%	0.79	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-5	176.5	-110.4	0	0	0	0	114.4	R241 K242 S243	R241-S245 PolarHBondContact O-N 2.91Å; K242-S245 PolarHBondContact O-N 3.33Å; S243-S245 VanDerWaalsContact C-N 3.3Å; S243-S245 PolarHBondContact O-N 3.19Å
246	S	53.1	Low	67.1	Low	100 Å²	100	129.7 Å²	129.7	70%	0.699	69%	0.69	S	S	*	*			trans	-107.7	79.2	178.9	-161.6	0	0	0	0	110.1	S243	S243-S246 PolarHBondContact O-N 3.49Å
247	S	52.1	Low	65.8	Low	97 Å²	97	133.6 Å²	133.6	68%	0.678	71%	0.708	S	S	*	*			trans	-139.2	128.1	165.1	-157.2	0	0	0	0	108.6
248	Y	50	Low	64.2	Low	214 Å²	214	137 Å²	137	84%	0.839	73%	0.725	S	S	*	*			trans	90.8	80.6	-172	-61.3	-79.3	0	0	0	115.9	P250	Y248-P250 WeakPolarHBondContact O-CD 3.47Å
249	T	58.7	Low	62.2	Low	133 Å²	133	134.6 Å²	134.6	82%	0.816	74%	0.738	S	S	*	*			trans	-83.8	111.5	146.6	-27.2	0	0	0	0	106.7	L251	T249-L251 PolarHBondContact O-N 3.44Å
250	P	58.9	Low	60.2	Low	105 Å²	105	134.5 Å²	134.5	68%	0.682	74%	0.737	S	S	*	*			trans	-69.1	132.6	176.9	26	-29.9	0	0	0	109.7	Y248	Y248-P250 WeakPolarHBondContact O-CD 3.47Å
251	L	57.9	Low	58.4	Low	149 Å²	149	136.4 Å²	136.4	78%	0.78	77%	0.769	S	S	*	*			trans	-62.9	138.8	170.1	-76.7	159	0	0	0	109.1	T249 G253	T249-L251 PolarHBondContact O-N 3.44Å; L251-G253 PolarHBondContact O-N 3.03Å
252	P	60.1	Low	57.2	Low	133 Å²	133	135 Å²	135	86%	0.864	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	111	173.6	1.5	9.9	0	0	0	108.4
253	G	59.7	Low	56.2	Low	75 Å²	75	133.2 Å²	133.2	77%	0.773	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	139	-5.2	174.2	0	0	0	0	0	117.2	L251 T255	L251-G253 PolarHBondContact O-N 3.03Å; G253-T255 PolarHBondContact O-N 3.49Å
254	S	57.4	Low	55.6	Low	76 Å²	76	135.6 Å²	135.6	53%	0.531	79%	0.787	S	S	.	*			trans	-93.8	94.3	175.1	63.1	0	0	0	0	111.7	Y256	S254-Y256 PolarHBondContact O-N 3.44Å
255	T	54.7	Low	55.3	Low	139 Å²	139	135.6 Å²	135.6	85%	0.853	80%	0.796	S	S	*	*			trans	-79.3	96.6	165.1	-35.4	0	0	0	0	108.1	G253	G253-T255 PolarHBondContact O-N 3.49Å
256	Y	56.6	Low	55.2	Low	205 Å²	205	137 Å²	137	80%	0.804	80%	0.797	S	S	*	*			trans	-116.8	125.4	161.4	-73.5	-74	0	0	0	108.2	S254	S254-Y256 PolarHBondContact O-N 3.44Å
257	P	62.9	Low	55.4	Low	122 Å²	122	139.5 Å²	139.5	79%	0.792	80%	0.803	S	S	*	*			trans	-69.4	133.3	177.3	14.1	-7.9	0	0	0	110.2	G259	P257-G259 PolarHBondContact O-N 3.3Å
258	E	58.7	Low	55.6	Low	168 Å²	168	142.5 Å²	142.5	79%	0.785	81%	0.812	S	S	*	*			trans	-55.6	128.2	174	-70.2	-176.5	139.9	0	0	111.3
259	G	49.6	Very low	56	Low	82 Å²	82	137 Å²	137	85%	0.845	81%	0.81	S	S	*	*			trans	-94.8	111.5	153.5	0	0	0	0	0	108.7	P257	P257-G259 PolarHBondContact O-N 3.3Å
260	R	46.8	Very low	55.8	Low	203 Å²	203	137.3 Å²	137.3	77%	0.766	81%	0.81	S	S	*	*			trans	-126.9	139.8	165	-109.7	-166.8	-146	-176.9	8.8	108.6
261	P	46.4	Very low	55.5	Low	191 Å²	191	140.3 Å²	140.3	100%	1.24	82%	0.821	S	S	*	*				-70.6	0	125.1	5.1	14.6	0	0	0	110.3

Retrieved 261 of 261 residues in 301.7 ms (Link to these results)

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