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Transforming growth factor beta

Required to maintain the Transforming growth factor beta-1 (TGF-beta-1) chain in a latent state during storage in extracellular matrix. Associates non-covalently with TGF-beta-1 and regulates its activation via interaction with 'milieu molecules', such as LTBP1, LRRC32/GARP and LRRC33/NRROS, that control activation of TGF-beta-1. Interaction with integrins (ITGAV:ITGB6 or ITGAV:ITGB8) results in distortion of the Latency-associated peptide chain and subsequent release of the active TGF-beta-1. Transforming growth factor beta-1 proprotein: Precursor of the Latency-associated peptide (LAP) and Transforming growth factor beta-1 (TGF-beta-1) chains, which constitute the regulatory and active subunit of TGF-beta-1, respectively.

AlphaFold DB , UniProt , Accession A0A087YCR8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 380 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	54.9	Low	56.3	Low	226 Å²	226	122.2 Å²	122.2	100%	1.113	64%	0.638	S	S	*	*				0	-19.7	0	-72.4	-178.7	80	0	0	115.4
2	K	54.7	Low	55.7	Low	189 Å²	189	122.6 Å²	122.6	82%	0.822	63%	0.634	S	S	*	*	H	α-helix	trans	-81.8	-26.9	179.8	-70.6	-174.5	175.2	-179.3	0	114.9	L6	K2-L6 PolarHBondContact O-N 3.34Å
3	L	53.9	Low	55	Low	143 Å²	143	124.2 Å²	124.2	75%	0.749	64%	0.64	S	S	*	*	H	α-helix	trans	-75.2	-38.7	-178.5	-132	81.4	0	0	0	113.3	F5 L6 L7	L3-F5 VanDerWaalsContact C-N 3.31Å; L3-F5 PolarHBondContact O-N 3.05Å; L3-L6 PolarHBondContact O-N 3.23Å; L3-L7 PolarHBondContact O-N 2.96Å
4	G	61.7	Low	54.1	Low	45 Å²	45	125.1 Å²	125.1	46%	0.464	65%	0.646	S	S	.	*	H	α-helix	trans	-67.5	-31.9	177.9	0	0	0	0	0	113	L7 L8	G4-L7 PolarHBondContact O-N 3.32Å; G4-L8 PolarHBondContact O-N 3.39Å; G4-L8 VanDerWaalsContact O-N 3.08Å
5	F	58.3	Low	53.3	Low	153 Å²	153	125.9 Å²	125.9	67%	0.671	65%	0.651	S	S	*	*	H	α-helix	trans	-71.2	-35.6	177.1	-141.3	-90.3	0	0	0	112	L3 M9	L3-F5 VanDerWaalsContact C-N 3.31Å; L3-F5 PolarHBondContact O-N 3.05Å; F5-M9 HydrophobicContact CD1-CG 4.23Å; F5-M9 HydrophobicContact CE1-CG 4.5Å; F5-M9 WeakPolarHBondContact O-CB 3.21Å; F5-M9 WeakPolarHBondContact O-CG 3.28Å; F5-M9 PolarHBondContact O-N 3.22Å
6	L	56.6	Low	52.8	Low	121 Å²	121	124.5 Å²	124.5	63%	0.634	65%	0.65	S	S	*	*	H	α-helix	trans	-68.3	-35.1	174.5	-85.5	159.3	0	0	0	112.5	K2 L3 M9 A10	K2-L6 PolarHBondContact O-N 3.34Å; L3-L6 PolarHBondContact O-N 3.23Å; L6-M9 PolarHBondContact O-N 2.83Å; L6-A10 WeakPolarHBondContact O-CB 3.45Å; L6-A10 PolarHBondContact O-N 3.4Å
7	L	57.4	Low	52.2	Low	107 Å²	107	124.9 Å²	124.9	56%	0.56	66%	0.659	S	S	*	*	H	α-helix	trans	-72.8	-37.1	177.6	-125.6	137.5	0	0	0	112.1	L3 G4 A10 L11	L3-L7 PolarHBondContact O-N 2.96Å; G4-L7 PolarHBondContact O-N 3.32Å; L7-A10 PolarHBondContact O-N 2.79Å; L7-L11 HydrophobicContact CD2-CD1 4.17Å; L7-L11 WeakPolarHBondContact O-CB 3.34Å; L7-L11 WeakPolarHBondContact O-CD1 3.39Å; L7-L11 WeakPolarHBondContact O-CG 3.31Å; L7-L11 PolarHBondContact O-N 3.34Å
8	L	56.5	Low	51.6	Low	104 Å²	104	123.6 Å²	123.6	55%	0.545	66%	0.661	S	S	.	*	H	α-helix	trans	-67.4	-37.4	171.7	-105.9	134.6	0	0	0	112.5	G4 H12	G4-L8 PolarHBondContact O-N 3.39Å; G4-L8 VanDerWaalsContact O-N 3.08Å; L8-H12 WeakPolarHBondContact O-CB 3.48Å; L8-H12 PolarHBondContact O-CD2 2.64Å; L8-H12 PolarHBondContact O-N 2.94Å
9	M	57	Low	50.9	Low	104 Å²	104	120.7 Å²	120.7	51%	0.512	65%	0.652	S	S	.	*	H	α-helix	trans	-69.6	-36.6	173.2	-69.7	-68.4	-76.4	0	0	111.7	F5 L6 H12 M13	F5-M9 HydrophobicContact CD1-CG 4.23Å; F5-M9 HydrophobicContact CE1-CG 4.5Å; F5-M9 WeakPolarHBondContact O-CB 3.21Å; F5-M9 WeakPolarHBondContact O-CG 3.28Å; F5-M9 PolarHBondContact O-N 3.22Å; L6-M9 PolarHBondContact O-N 2.83Å; M9-H12 PolarHBondContact O-N 2.81Å; M9-M13 WeakPolarHBondContact O-CG 3.37Å; M9-M13 PolarHBondContact O-N 3.41Å
10	A	54.8	Low	50.1	Low	52 Å²	52	123.2 Å²	123.2	43%	0.43	66%	0.661	S	S	.	*	H	α-helix	trans	-67.6	-38	174.6	0	0	0	0	0	112.6	L6 L7 M13 L14	L6-A10 WeakPolarHBondContact O-CB 3.45Å; L6-A10 PolarHBondContact O-N 3.4Å; L7-A10 PolarHBondContact O-N 2.79Å; A10-M13 PolarHBondContact O-N 3.33Å; A10-L14 PolarHBondContact O-N 2.96Å
11	L	53.8	Low	49.8	Very low	100 Å²	100	118.8 Å²	118.8	52%	0.524	64%	0.64	S	S	.	*	H	α-helix	trans	-69.4	-37.5	174.1	-79.2	159.5	0	0	0	112.2	L7 M13 L14	L7-L11 HydrophobicContact CD2-CD1 4.17Å; L7-L11 WeakPolarHBondContact O-CB 3.34Å; L7-L11 WeakPolarHBondContact O-CD1 3.39Å; L7-L11 WeakPolarHBondContact O-CG 3.31Å; L7-L11 PolarHBondContact O-N 3.34Å; L11-M13 VanDerWaalsContact C-N 3.3Å; L11-M13 PolarHBondContact O-N 2.78Å; L11-L14 PolarHBondContact O-N 3.39Å
12	H	48.3	Very low	49.4	Very low	127 Å²	127	114.4 Å²	114.4	59%	0.588	63%	0.626	S	S	*	*	H	α-helix	trans	-69.9	-23.8	173.5	-90.9	-56.7	0	0	0	114.1	L8 M9	L8-H12 WeakPolarHBondContact O-CB 3.48Å; L8-H12 PolarHBondContact O-CD2 2.64Å; L8-H12 PolarHBondContact O-N 2.94Å; M9-H12 PolarHBondContact O-N 2.81Å
13	M	47.6	Very low	49.3	Very low	143 Å²	143	108 Å²	108	70%	0.704	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-11.4	174.2	-68.2	-64.2	-139.2	0	0	113.4	M9 A10 L11	M9-M13 WeakPolarHBondContact O-CG 3.37Å; M9-M13 PolarHBondContact O-N 3.41Å; A10-M13 PolarHBondContact O-N 3.33Å; L11-M13 VanDerWaalsContact C-N 3.3Å; L11-M13 PolarHBondContact O-N 2.78Å
14	L	42.3	Very low	49.3	Very low	138 Å²	138	108.7 Å²	108.7	72%	0.723	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-17.2	175.5	-84.1	156.1	0	0	0	113.2	A10 L11	A10-L14 PolarHBondContact O-N 2.96Å; L11-L14 PolarHBondContact O-N 3.39Å
15	D	41.2	Very low	48.9	Very low	136 Å²	136	112 Å²	112	73%	0.727	61%	0.613	S	S	*	*	S	Bend	trans	-100.8	0.1	-173.6	-89.1	-26.4	0	0	0	116.1
16	T	46.4	Very low	49	Very low	104 Å²	104	107.6 Å²	107.6	64%	0.638	60%	0.599	S	S	*	*			trans	-140.9	62.9	176.6	61	0	0	0	0	113.2
17	V	41.9	Very low	49.5	Very low	131 Å²	131	106.6 Å²	106.6	79%	0.794	59%	0.594	S	S	*	*			trans	-125.2	64	147.4	-167.5	0	0	0	0	108	S19	V17-S19 PolarHBondContact O-N 2.96Å
18	S	40.9	Very low	50.1	Low	101 Å²	101	106.2 Å²	106.2	71%	0.706	59%	0.592	S	S	*	*			trans	-68.9	94	156.9	9.1	0	0	0	0	106.3	M20	S18-M20 PolarHBondContact O-N 3.22Å
19	S	38.6	Very low	51	Low	70 Å²	70	107.7 Å²	107.7	49%	0.49	60%	0.596	S	S	.	*			trans	-51.7	105.5	164.3	174.6	0	0	0	0	107.5	V17 S21	V17-S19 PolarHBondContact O-N 2.96Å; S19-S21 PolarHBondContact O-N 2.81Å
20	M	35.6	Very low	52	Low	170 Å²	170	106.4 Å²	106.4	84%	0.837	59%	0.59	S	S	*	*			trans	-72.9	83.8	172.2	-71	-155.8	78.7	0	0	107.4	S18 T22	S18-M20 PolarHBondContact O-N 3.22Å; M20-T22 PolarHBondContact O-N 3.12Å
21	S	42.5	Very low	53	Low	30 Å²	30	105.6 Å²	105.6	21%	0.21	58%	0.58	C	S	.	*			trans	-67	122.2	163.6	68.1	0	0	0	0	107.9	S19 C23 K24	S19-S21 PolarHBondContact O-N 2.81Å; S21-C23 PolarHBondContact O-N 3.22Å; S21-K24 PolarHBondContact O-N 2.85Å
22	T	47.8	Very low	54.2	Low	135 Å²	135	105.9 Å²	105.9	83%	0.828	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-6.9	178	43.4	0	0	0	0	113.8	M20	M20-T22 PolarHBondContact O-N 3.12Å
23	C	53.3	Low	55.8	Low	54 Å²	54	105.2 Å²	105.2	37%	0.365	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123.5	29.3	-178.1	-73.6	0	0	0	0	112.6	S21 C345	S21-C23 PolarHBondContact O-N 3.22Å; C23-C345 HydrophobicContact CB-CB 4.3Å; C23-C345 WeakPolarHBondContact CB-SG 3.25Å; C23-C345 WeakPolarHBondContact SG-CB 3.26Å; C23-C345 CovalentContact SG-SG 2.06Å; C23-C345 PolarHBondContact SG-SG 3Å
24	K	53.6	Low	57.6	Low	158 Å²	158	104.5 Å²	104.5	69%	0.687	56%	0.564	S	S	*	*			trans	-63.3	144.1	168.4	-159.2	171.1	-175.3	179.5	0	109.7	S21 V26	S21-K24 PolarHBondContact O-N 2.85Å; K24-V26 VanDerWaalsContact C-N 3.29Å; K24-V26 WeakPolarHBondContact O-CG2 3.3Å; K24-V26 PolarHBondContact O-N 2.78Å
25	T	53.3	Low	59.6	Low	113 Å²	113	100.2 Å²	100.2	69%	0.693	54%	0.538	S	S	*	.			trans	-62.2	90	176.5	47.4	0	0	0	0	109.5
26	V	59.8	Low	61.7	Low	62 Å²	62	94.9 Å²	94.9	38%	0.376	51%	0.51	S	S	.	.			trans	-67.1	144.8	168.8	-169.9	0	0	0	0	107.4	K24 L28 I30 V31	K24-V26 VanDerWaalsContact C-N 3.29Å; K24-V26 WeakPolarHBondContact O-CG2 3.3Å; K24-V26 PolarHBondContact O-N 2.78Å; V26-L28 PolarHBondContact O-N 3.06Å; V26-I30 HydrophobicContact CG1-CB 3.6Å; V26-I30 HydrophobicContact CG1-CD1 3.95Å; V26-I30 HydrophobicContact CG1-CG1 4.35Å; V26-I30 HydrophobicContact CG1-CG2 3.52Å; V26-V31 HydrophobicContact CB-CG2 3.78Å; V26-V31 HydrophobicContact CG1-CG2 4.41Å
27	D	67.9	Low	63.5	Low	100 Å²	100	95 Å²	95	54%	0.535	50%	0.503	S	S	.	.			trans	-37.9	134.6	170.5	-167.3	-21	0	0	0	111.7	E29 I30 V31	D27-E29 PolarHBondContact O-N 2.63Å; D27-E29 VanDerWaalsContact O-N 3.08Å; D27-E29 PolarHBondContact OD1-N 2.8Å; D27-I30 HydrophobicContact CB-CB 4.49Å; D27-I30 HydrophobicContact CB-CD1 3.92Å; D27-I30 HydrophobicContact CB-CG1 4.1Å; D27-I30 PolarHBondContact O-N 2.97Å; D27-V31 PolarHBondContact O-N 3.39Å
28	L	69.7	Low	65.6	Low	98 Å²	98	91 Å²	91	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-48.9	-38.3	-179	-69.9	171	0	0	0	111.5	V26 R32 M313	V26-L28 PolarHBondContact O-N 3.06Å; L28-R32 VanDerWaalsContact O-CB 3.28Å; L28-R32 WeakPolarHBondContact O-CB 3.11Å; L28-R32 PolarHBondContact O-N 3.32Å; L28-M313 HydrophobicContact CD2-CE 3.17Å; L28-M313 HydrophobicContact CD2-SD 3.52Å; L28-M313 VanDerWaalsContact CD2-SD 3.52Å
29	E	74.7	Confident	67.7	Low	136 Å²	136	86.2 Å²	86.2	64%	0.636	45%	0.45	S	S	*	.	H	α-helix	trans	-72.2	-38.8	-176.6	-164.6	152.2	-148.2	0	0	112.4	D27 R32 Q33	D27-E29 PolarHBondContact O-N 2.63Å; D27-E29 VanDerWaalsContact O-N 3.08Å; D27-E29 PolarHBondContact OD1-N 2.8Å; E29-R32 WeakPolarHBondContact O-CB 3.27Å; E29-R32 PolarHBondContact O-N 2.8Å; E29-Q33 WeakPolarHBondContact O-CB 3.18Å; E29-Q33 PolarHBondContact O-N 3.45Å
30	I	78.9	Confident	69.9	Low	77 Å²	77	88.5 Å²	88.5	40%	0.395	45%	0.448	S	S	.	.	H	α-helix	trans	-71	-39.6	177.1	-59	171.7	0	0	0	110.6	V26 D27 R32 Q33 K34	V26-I30 HydrophobicContact CG1-CB 3.6Å; V26-I30 HydrophobicContact CG1-CD1 3.95Å; V26-I30 HydrophobicContact CG1-CG1 4.35Å; V26-I30 HydrophobicContact CG1-CG2 3.52Å; D27-I30 HydrophobicContact CB-CB 4.49Å; D27-I30 HydrophobicContact CB-CD1 3.92Å; D27-I30 HydrophobicContact CB-CG1 4.1Å; D27-I30 PolarHBondContact O-N 2.97Å; I30-R32 VanDerWaalsContact C-N 3.32Å; I30-Q33 PolarHBondContact O-N 2.81Å; I30-K34 HydrophobicContact CG2-CD 4.32Å; I30-K34 WeakPolarHBondContact O-CB 3.42Å; I30-K34 WeakPolarHBondContact O-CG 3.47Å; I30-K34 PolarHBondContact O-N 2.99Å
31	V	75.2	Confident	72.2	Confident	34 Å²	34	84 Å²	84	21%	0.206	43%	0.433	C	S	.	.	H	α-helix	trans	-63.4	-43	175.3	177.9	0	0	0	0	110.4	V26 D27 K34 R35 Y311	V26-V31 HydrophobicContact CB-CG2 3.78Å; V26-V31 HydrophobicContact CG1-CG2 4.41Å; D27-V31 PolarHBondContact O-N 3.39Å; V31-K34 PolarHBondContact O-N 3.27Å; V31-R35 WeakPolarHBondContact O-CB 3.33Å; V31-R35 PolarHBondContact O-N 2.98Å; V31-Y311 HydrophobicContact CG1-CD2 3.82Å; V31-Y311 HydrophobicContact CG1-CE2 3.77Å
32	R	78.1	Confident	74.1	Confident	107 Å²	107	84.6 Å²	84.6	40%	0.404	43%	0.433	S	S	.	.	H	α-helix	trans	-58.3	-49.6	174.9	176.9	177.1	179.2	-168.5	-1	111.3	L28 E29 I30 R35 I36 L288	L28-R32 VanDerWaalsContact O-CB 3.28Å; L28-R32 WeakPolarHBondContact O-CB 3.11Å; L28-R32 PolarHBondContact O-N 3.32Å; E29-R32 WeakPolarHBondContact O-CB 3.27Å; E29-R32 PolarHBondContact O-N 2.8Å; I30-R32 VanDerWaalsContact C-N 3.32Å; R32-R35 WeakPolarHBondContact O-CB 3.4Å; R32-R35 PolarHBondContact O-N 3.36Å; R32-I36 HydrophobicContact CG-CD1 4.09Å; R32-I36 WeakPolarHBondContact O-CG1 3.24Å; R32-I36 PolarHBondContact O-N 3.21Å; R32-L288 HydrophobicContact CG-CD1 3.72Å
33	Q	83.5	Confident	75.8	Confident	112 Å²	112	78.2 Å²	78.2	52%	0.523	39%	0.393	S	S	.	.	H	α-helix	trans	-63.1	-45.2	-179.4	-171.3	172.9	-7.2	0	0	112.1	E29 I30 R35 I36 E37	E29-Q33 WeakPolarHBondContact O-CB 3.18Å; E29-Q33 PolarHBondContact O-N 3.45Å; I30-Q33 PolarHBondContact O-N 2.81Å; Q33-R35 VanDerWaalsContact C-N 3.26Å; Q33-R35 PolarHBondContact O-N 2.67Å; Q33-I36 PolarHBondContact O-N 3.41Å; Q33-I36 VanDerWaalsContact O-N 3.12Å; Q33-E37 PolarHBondContact O-N 2.85Å
34	K	84.3	Confident	77.3	Confident	128 Å²	128	76.7 Å²	76.7	56%	0.557	38%	0.381	S	S	*	.	H	α-helix	trans	-59.1	-37.2	174.7	-74.8	-177.7	177.7	-175.1	0	112.5	I30 V31 A38	I30-K34 HydrophobicContact CG2-CD 4.32Å; I30-K34 WeakPolarHBondContact O-CB 3.42Å; I30-K34 WeakPolarHBondContact O-CG 3.47Å; I30-K34 PolarHBondContact O-N 2.99Å; V31-K34 PolarHBondContact O-N 3.27Å; K34-A38 VanDerWaalsContact O-CB 3.32Å; K34-A38 WeakPolarHBondContact O-CB 3.21Å; K34-A38 PolarHBondContact O-N 3.45Å
35	R	84.3	Confident	78.5	Confident	49 Å²	49	71.9 Å²	71.9	19%	0.185	37%	0.368	C	S	.	.	H	α-helix	trans	-66.8	-40.8	176.2	-177.7	61.1	171	164.4	7.6	111.8	V31 R32 Q33 A38 I39 L288 N310	V31-R35 WeakPolarHBondContact O-CB 3.33Å; V31-R35 PolarHBondContact O-N 2.98Å; R32-R35 WeakPolarHBondContact O-CB 3.4Å; R32-R35 PolarHBondContact O-N 3.36Å; Q33-R35 VanDerWaalsContact C-N 3.26Å; Q33-R35 PolarHBondContact O-N 2.67Å; R35-A38 PolarHBondContact O-N 3.26Å; R35-I39 HydrophobicContact CG-CD1 3.94Å; R35-I39 WeakPolarHBondContact O-CB 3.35Å; R35-I39 WeakPolarHBondContact O-CG1 3.33Å; R35-I39 PolarHBondContact O-N 2.98Å; R35-L288 HydrophobicContact CB-CD2 4.14Å; R35-L288 HydrophobicContact CG-CD2 3.7Å; R35-N310 PolarHBondContact NE-O 3.14Å
36	I	84.9	Confident	79.8	Confident	24 Å²	24	66.5 Å²	66.5	12%	0.123	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-46.1	176.5	-66.9	164.9	0	0	0	110.1	R32 Q33 A38 I39 R40 I290 D295 L296	R32-I36 HydrophobicContact CG-CD1 4.09Å; R32-I36 WeakPolarHBondContact O-CG1 3.24Å; R32-I36 PolarHBondContact O-N 3.21Å; Q33-I36 PolarHBondContact O-N 3.41Å; Q33-I36 VanDerWaalsContact O-N 3.12Å; I36-A38 PolarHBondContact O-N 2.95Å; I36-I39 PolarHBondContact O-N 3.29Å; I36-R40 PolarHBondContact O-N 2.64Å; I36-I290 HydrophobicContact CG1-CD1 4.27Å; I36-I290 HydrophobicContact CG1-CG1 4.45Å; I36-D295 HydrophobicContact CD1-CB 4.32Å; I36-D295 HydrophobicContact CG2-CB 4.4Å; I36-L296 HydrophobicContact CG2-CD2 3.67Å; I36-L296 HydrophobicContact CG2-CG 4.27Å
37	E	85.4	Confident	80.8	Confident	107 Å²	107	64.2 Å²	64.2	50%	0.5	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-39	176.9	-70.7	175.3	-174.8	0	0	112.9	Q33 R40 S41	Q33-E37 PolarHBondContact O-N 2.85Å; E37-R40 WeakPolarHBondContact O-CB 3.34Å; E37-R40 PolarHBondContact O-N 3.11Å; E37-S41 PolarHBondContact O-N 3.44Å; E37-S41 VanDerWaalsContact O-N 3.09Å; E37-S41 PolarHBondContact O-OG 3.11Å
38	A	84.6	Confident	81.2	Confident	47 Å²	47	63.8 Å²	63.8	39%	0.388	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-43.4	174.1	0	0	0	0	0	111.5	K34 R35 I36 S41 Q42	K34-A38 VanDerWaalsContact O-CB 3.32Å; K34-A38 WeakPolarHBondContact O-CB 3.21Å; K34-A38 PolarHBondContact O-N 3.45Å; R35-A38 PolarHBondContact O-N 3.26Å; I36-A38 PolarHBondContact O-N 2.95Å; A38-S41 PolarHBondContact O-N 3.06Å; A38-Q42 VanDerWaalsContact O-CB 3.25Å; A38-Q42 WeakPolarHBondContact O-CB 3.49Å; A38-Q42 PolarHBondContact O-N 2.77Å
39	I	85.5	Confident	81.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-41.1	177.4	-75.8	167.4	0	0	0	111.1	R35 I36 S41 Q42 I43 I290 Y307 A309 M372	R35-I39 HydrophobicContact CG-CD1 3.94Å; R35-I39 WeakPolarHBondContact O-CB 3.35Å; R35-I39 WeakPolarHBondContact O-CG1 3.33Å; R35-I39 PolarHBondContact O-N 2.98Å; I36-I39 PolarHBondContact O-N 3.29Å; I39-S41 VanDerWaalsContact C-N 3.28Å; I39-S41 PolarHBondContact O-N 3.39Å; I39-Q42 PolarHBondContact O-N 3.48Å; I39-I43 HydrophobicContact CG2-CD1 3.73Å; I39-I43 HydrophobicContact CG2-CG1 4.29Å; I39-I43 WeakPolarHBondContact O-CG1 3.48Å; I39-I43 PolarHBondContact O-N 3.48Å; I39-I290 HydrophobicContact CB-CD1 4.41Å; I39-I290 HydrophobicContact CD1-CD1 3.2Å; I39-I290 HydrophobicContact CG1-CD1 4.37Å; I39-I290 HydrophobicContact CG2-CD1 4.29Å; I39-Y307 VanDerWaalsContact CG2-OH 3.3Å; I39-Y307 WeakPolarHBondContact CG2-OH 3.43Å; I39-A309 HydrophobicContact CD1-CB 3.66Å; I39-M372 HydrophobicContact CG2-CE 4.1Å
40	R	85.8	Confident	81.8	Confident	118 Å²	118	60.7 Å²	60.7	45%	0.445	31%	0.307	S	S	.	.	H	α-helix	trans	-51.9	-50.9	173	-169.2	-176.2	177.6	145.8	0.3	110.9	I36 E37 L44 L296 W298	I36-R40 PolarHBondContact O-N 2.64Å; E37-R40 WeakPolarHBondContact O-CB 3.34Å; E37-R40 PolarHBondContact O-N 3.11Å; R40-L44 WeakPolarHBondContact O-CG 3.45Å; R40-L44 PolarHBondContact O-N 3.17Å; R40-L296 HydrophobicContact CB-CD2 3.64Å; R40-L296 HydrophobicContact CG-CD2 3.95Å; R40-W298 HydrophobicContact CB-CH2 4.48Å; R40-W298 HydrophobicContact CB-CZ2 4.32Å; R40-W298 HydrophobicContact CG-CH2 3.99Å; R40-W298 HydrophobicContact CG-CZ2 3.39Å
41	S	83.1	Confident	81.9	Confident	76 Å²	76	63.8 Å²	63.8	53%	0.531	32%	0.317	S	S	.	.	H	α-helix	trans	-69.6	-37.4	-178.3	-52	0	0	0	0	111.9	E37 A38 I39 S45	E37-S41 PolarHBondContact O-N 3.44Å; E37-S41 VanDerWaalsContact O-N 3.09Å; E37-S41 PolarHBondContact O-OG 3.11Å; A38-S41 PolarHBondContact O-N 3.06Å; I39-S41 VanDerWaalsContact C-N 3.28Å; I39-S41 PolarHBondContact O-N 3.39Å; S41-S45 WeakPolarHBondContact O-CB 3.47Å; S41-S45 PolarHBondContact O-N 3.24Å
42	Q	82.7	Confident	82.2	Confident	42 Å²	42	63 Å²	63	20%	0.196	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-44.7	178.2	-174.5	179.8	3.1	0	0	111.9	A38 I39 S45 K46 N371 M372	A38-Q42 VanDerWaalsContact O-CB 3.25Å; A38-Q42 WeakPolarHBondContact O-CB 3.49Å; A38-Q42 PolarHBondContact O-N 2.77Å; I39-Q42 PolarHBondContact O-N 3.48Å; Q42-S45 PolarHBondContact O-N 3.28Å; Q42-K46 HydrophobicContact CG-CD 4.1Å; Q42-K46 WeakPolarHBondContact O-CB 3.45Å; Q42-K46 VanDerWaalsContact O-CG 3.31Å; Q42-K46 WeakPolarHBondContact O-CG 3.48Å; Q42-K46 PolarHBondContact O-N 2.81Å; Q42-N371 PolarHBondContact NE2-O 3.23Å; Q42-M372 HydrophobicContact CG-SD 4.05Å
43	I	84.3	Confident	82.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-49.3	179.1	-67	170.8	0	0	0	110	I39 S45 K46 L47 F292 W298 W300 L369 M372	I39-I43 HydrophobicContact CG2-CD1 3.73Å; I39-I43 HydrophobicContact CG2-CG1 4.29Å; I39-I43 WeakPolarHBondContact O-CG1 3.48Å; I39-I43 PolarHBondContact O-N 3.48Å; I43-S45 VanDerWaalsContact C-N 3.32Å; I43-S45 PolarHBondContact O-N 2.86Å; I43-K46 PolarHBondContact O-N 3.03Å; I43-L47 HydrophobicContact CG2-CD1 3.77Å; I43-L47 HydrophobicContact CG2-CG 4.38Å; I43-L47 WeakPolarHBondContact O-CB 3.21Å; I43-L47 VanDerWaalsContact O-CG 3.28Å; I43-L47 WeakPolarHBondContact O-CG 3.25Å; I43-L47 PolarHBondContact O-N 3.19Å; I43-F292 HydrophobicContact CD1-CE1 3.79Å; I43-W298 HydrophobicContact CB-CH2 3.92Å; I43-W298 HydrophobicContact CB-CZ3 3.98Å; I43-W298 HydrophobicContact CD1-CH2 4.3Å; I43-W298 HydrophobicContact CD1-CZ3 3.71Å; I43-W298 HydrophobicContact CG1-CZ3 4.44Å; I43-W298 HydrophobicContact CG2-CH2 4Å; I43-W298 HydrophobicContact CG2-CZ3 3.77Å; I43-W300 HydrophobicContact CG2-CH2 4.18Å; I43-L369 HydrophobicContact CB-CD1 4.48Å; I43-L369 HydrophobicContact CG1-CD1 3.98Å; I43-L369 HydrophobicContact CG2-CD1 4.12Å; I43-M372 HydrophobicContact CD1-CE 3.87Å; I43-M372 HydrophobicContact CG1-CE 3.44Å; I43-M372 VanDerWaalsContact CG1-CE 3.44Å; I43-M372 HydrophobicContact CG1-SD 4.38Å
44	L	84.3	Confident	81.6	Confident	22 Å²	22	58.8 Å²	58.8	12%	0.115	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-42.7	178.6	-68.6	176.6	0	0	0	111.6	R40 L47 R48 L49 A52 W298 W300	R40-L44 WeakPolarHBondContact O-CG 3.45Å; R40-L44 PolarHBondContact O-N 3.17Å; L44-L47 CarbonylContact O-C 3.46Å; L44-L47 PolarHBondContact O-N 3.08Å; L44-R48 CarbonylContact O-C 3.53Å; L44-R48 WeakPolarHBondContact O-CA 3.39Å; L44-R48 PolarHBondContact O-N 2.86Å; L44-L49 HydrophobicContact CD2-CB 4.02Å; L44-L49 PolarHBondContact O-N 3.34Å; L44-A52 HydrophobicContact CD2-CB 4.37Å; L44-W298 HydrophobicContact CD1-CZ2 4.17Å; L44-W298 HydrophobicContact CD2-CH2 4.43Å; L44-W298 HydrophobicContact CD2-CZ2 4.23Å; L44-W298 HydrophobicContact CG-CH2 4.14Å; L44-W298 HydrophobicContact CG-CZ2 4.01Å; L44-W300 HydrophobicContact CD2-CZ2 4.36Å
45	S	79.4	Confident	80.3	Confident	57 Å²	57	57 Å²	57	40%	0.399	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-45.6	176.2	179	0	0	0	0	112.9	S41 Q42 I43 L47 R48	S41-S45 WeakPolarHBondContact O-CB 3.47Å; S41-S45 PolarHBondContact O-N 3.24Å; Q42-S45 PolarHBondContact O-N 3.28Å; I43-S45 VanDerWaalsContact C-N 3.32Å; I43-S45 PolarHBondContact O-N 2.86Å; S45-L47 VanDerWaalsContact C-N 3.3Å; S45-L47 PolarHBondContact O-N 2.96Å; S45-R48 WeakPolarHBondContact O-CA 2.93Å; S45-R48 WeakPolarHBondContact O-CG 3.17Å; S45-R48 PolarHBondContact O-N 2.83Å
46	K	79.9	Confident	78.9	Confident	1 Å²	1	63.4 Å²	63.4	0%	0.004	34%	0.335	C	S	.	.	H	α-helix	trans	-65	-34.8	179.2	-77.3	178.5	176.6	-76.1	0	113	Q42 I43 R48 Y99 L369 S370 M372	Q42-K46 HydrophobicContact CG-CD 4.1Å; Q42-K46 WeakPolarHBondContact O-CB 3.45Å; Q42-K46 VanDerWaalsContact O-CG 3.31Å; Q42-K46 WeakPolarHBondContact O-CG 3.48Å; Q42-K46 PolarHBondContact O-N 2.81Å; I43-K46 PolarHBondContact O-N 3.03Å; K46-R48 VanDerWaalsContact C-N 3.26Å; K46-Y99 PolarHBondContact NZ-O 2.92Å; K46-L369 HydrophobicContact CB-CD2 3.83Å; K46-L369 HydrophobicContact CD-CB 4.42Å; K46-L369 HydrophobicContact CD-CD2 4.4Å; K46-S370 WeakPolarHBondContact CE-O 3.49Å; K46-S370 PolarHBondContact NZ-O 3.07Å; K46-S370 PolarHBondContact NZ-OG 3.24Å; K46-M372 HydrophobicContact CD-SD 4.01Å
47	L	80.6	Confident	77.3	Confident	13 Å²	13	67.6 Å²	67.6	7%	0.068	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-5.4	172.3	-63.3	179	0	0	0	113	I43 L44 S45 L49 A101 W300 I356 Y358 E367 L369	I43-L47 HydrophobicContact CG2-CD1 3.77Å; I43-L47 HydrophobicContact CG2-CG 4.38Å; I43-L47 WeakPolarHBondContact O-CB 3.21Å; I43-L47 VanDerWaalsContact O-CG 3.28Å; I43-L47 WeakPolarHBondContact O-CG 3.25Å; I43-L47 PolarHBondContact O-N 3.19Å; L44-L47 CarbonylContact O-C 3.46Å; L44-L47 PolarHBondContact O-N 3.08Å; S45-L47 VanDerWaalsContact C-N 3.3Å; S45-L47 PolarHBondContact O-N 2.96Å; L47-L49 HydrophobicContact CB-CD1 3.96Å; L47-L49 HydrophobicContact CB-CG 3.87Å; L47-L49 HydrophobicContact CD1-CD1 4Å; L47-L49 PolarHBondContact O-N 3.43Å; L47-A101 HydrophobicContact CD2-CB 4.15Å; L47-W300 HydrophobicContact CD1-CH2 3.56Å; L47-W300 HydrophobicContact CD1-CZ3 3.81Å; L47-I356 HydrophobicContact CD1-CD1 3.98Å; L47-I356 HydrophobicContact CD2-CD1 4.11Å; L47-I356 HydrophobicContact CG-CD1 4.5Å; L47-Y358 HydrophobicContact CD1-CE2 4.35Å; L47-Y358 HydrophobicContact CD2-CE1 3.94Å; L47-E367 WeakPolarHBondContact CD2-OE2 3.44Å; L47-L369 HydrophobicContact CD2-CD2 3.8Å; L47-L369 HydrophobicContact CG-CD2 4.09Å
48	R	76.3	Confident	75.6	Confident	91 Å²	91	63.1 Å²	63.1	34%	0.343	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.3	39.9	-168.8	-64.2	-166	-161	166.2	0.7	113.5	L44 S45 K46 F100 M258	L44-R48 CarbonylContact O-C 3.53Å; L44-R48 WeakPolarHBondContact O-CA 3.39Å; L44-R48 PolarHBondContact O-N 2.86Å; S45-R48 WeakPolarHBondContact O-CA 2.93Å; S45-R48 WeakPolarHBondContact O-CG 3.17Å; S45-R48 PolarHBondContact O-N 2.83Å; K46-R48 VanDerWaalsContact C-N 3.26Å; R48-F100 HydrophobicContact CG-CE1 4.32Å; R48-M258 HydrophobicContact CB-CE 3.8Å; R48-M258 HydrophobicContact CB-SD 4.47Å; R48-M258 WeakPolarHBondContact CD-SD 3.3Å; R48-M258 HydrophobicContact CG-CE 3.29Å; R48-M258 HydrophobicContact CG-SD 4.09Å; R48-M258 PolarHBondContact NE-SD 3.3Å; R48-M258 VanDerWaalsContact NH1-CG 3.3Å; R48-M258 PolarHBondContact NH1-O 3.12Å; R48-M258 VanDerWaalsContact NH1-O 3.08Å; R48-M258 PolarHBondContact NH1-SD 2.7Å; R48-M258 PolarHBondContact NH2-O 3.04Å
49	L	78.8	Confident	73.8	Confident	33 Å²	33	62 Å²	62	17%	0.173	33%	0.329	C	S	.	.			trans	-91.4	124	172.3	-65.7	175.7	0	0	0	109.4	L44 L47 K51 P53 W300 Y358 V360	L44-L49 HydrophobicContact CD2-CB 4.02Å; L44-L49 PolarHBondContact O-N 3.34Å; L47-L49 HydrophobicContact CB-CD1 3.96Å; L47-L49 HydrophobicContact CB-CG 3.87Å; L47-L49 HydrophobicContact CD1-CD1 4Å; L47-L49 PolarHBondContact O-N 3.43Å; L49-K51 VanDerWaalsContact C-N 3.28Å; L49-K51 PolarHBondContact O-N 2.85Å; L49-P53 HydrophobicContact CD1-CG 4.45Å; L49-W300 HydrophobicContact CD1-CH2 4.36Å; L49-W300 HydrophobicContact CD1-CZ3 4.33Å; L49-Y358 HydrophobicContact CD1-CE2 4.38Å; L49-V360 HydrophobicContact CD2-CG2 4.48Å
50	P	77.2	Confident	72.1	Confident	137 Å²	137	69.7 Å²	69.7	89%	0.89	37%	0.37	S	S	*	.	S	Bend	trans	-68.5	-30.3	179.5	27.1	-33.8	0	0	0	112.2
51	K	82.5	Confident	70.4	Confident	141 Å²	141	73.3 Å²	73.3	61%	0.613	39%	0.388	S	S	*	.	S	Bend	trans	-146.8	155.8	176.6	-169.4	-176.1	171.8	-162.2	0	108.7	L49 E54	L49-K51 VanDerWaalsContact C-N 3.28Å; L49-K51 PolarHBondContact O-N 2.85Å; K51-E54 IonicContact NZ-OE1 3.89Å
52	A	80.9	Confident	69.1	Low	18 Å²	18	75.1 Å²	75.1	15%	0.149	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-58.3	136.8	169.3	0	0	0	0	0	110.3	L44	L44-A52 HydrophobicContact CD2-CB 4.37Å
53	P	79.3	Confident	68.3	Low	20 Å²	20	80.8 Å²	80.8	13%	0.13	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-54.9	146.4	174.3	-24.7	33.7	0	0	0	112.1	L49 W300	L49-P53 HydrophobicContact CD1-CG 4.45Å; P53-W300 HydrophobicContact CB-CB 4.46Å; P53-W300 HydrophobicContact CG-CD2 4.26Å; P53-W300 HydrophobicContact CG-CE3 4.34Å; P53-W300 HydrophobicContact CG-CG 4.32Å
54	E	69.7	Low	67.5	Low	110 Å²	110	82.2 Å²	82.2	51%	0.514	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-73.2	144	-175.9	-62.8	-155.3	155.3	0	0	111.9	K51 E56 E57 A58	K51-E54 IonicContact NZ-OE1 3.89Å; E54-E56 PolarHBondContact O-N 3.38Å; E54-E57 PolarHBondContact O-N 3.41Å; E54-E57 VanDerWaalsContact O-N 3.16Å; E54-A58 PolarHBondContact O-N 3.22Å
55	P	57.8	Low	67.4	Low	90 Å²	90	83.7 Å²	83.7	58%	0.584	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	0.3	-175.5	27.4	-33.4	0	0	0	114.9	A58	P55-A58 HydrophobicContact CB-CB 4.46Å; P55-A58 WeakPolarHBondContact O-CB 3.26Å
56	E	53.1	Low	67.4	Low	184 Å²	184	86.3 Å²	86.3	86%	0.86	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-23.1	173.4	-65.3	-177.4	177.5	0	0	112.2	E54 A58	E54-E56 PolarHBondContact O-N 3.38Å; E56-A58 PolarHBondContact O-N 2.87Å
57	E	51.6	Low	67.4	Low	112 Å²	112	91.9 Å²	91.9	52%	0.523	48%	0.482	S	S	.	.	S	Bend	trans	-78.8	-5.8	161.3	-61.3	-175.7	157.1	0	0	111.4	E54 G59 Y359	E54-E57 PolarHBondContact O-N 3.41Å; E54-E57 VanDerWaalsContact O-N 3.16Å; E57-G59 VanDerWaalsContact C-N 3.33Å; E57-G59 PolarHBondContact O-N 2.79Å; E57-G59 VanDerWaalsContact O-N 3.17Å; E57-Y359 WeakPolarHBondContact O-CE2 3.38Å
58	A	49.5	Very low	67.5	Low	14 Å²	14	93 Å²	93	12%	0.116	49%	0.488	C	S	.	.	S	Bend	trans	-86.7	69.1	178.2	0	0	0	0	0	112.2	E54 P55 E56 D60 Y359	E54-A58 PolarHBondContact O-N 3.22Å; P55-A58 HydrophobicContact CB-CB 4.46Å; P55-A58 WeakPolarHBondContact O-CB 3.26Å; E56-A58 PolarHBondContact O-N 2.87Å; A58-D60 PolarHBondContact O-N 3.34Å; A58-Y359 VanDerWaalsContact CA-CE2 3.44Å; A58-Y359 WeakPolarHBondContact CA-OH 2.99Å; A58-Y359 HydrophobicContact CB-CE2 3.89Å; A58-Y359 WeakPolarHBondContact CB-OH 3.46Å
59	G	47.3	Very low	67.9	Low	24 Å²	24	91.3 Å²	91.3	25%	0.247	49%	0.485	C	S	.	.			trans	-40.1	123.9	179.9	0	0	0	0	0	112.1	E57 K61	E57-G59 VanDerWaalsContact C-N 3.33Å; E57-G59 PolarHBondContact O-N 2.79Å; E57-G59 VanDerWaalsContact O-N 3.17Å; G59-K61 PolarHBondContact O-N 3.18Å; G59-K61 VanDerWaalsContact O-N 3.08Å
60	D	49.5	Very low	68.1	Low	161 Å²	161	91 Å²	91	86%	0.861	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	115.2	174.4	-91.7	-36.7	0	0	0	109.1	A58 E62	A58-D60 PolarHBondContact O-N 3.34Å; D60-E62 PolarHBondContact O-N 2.87Å
61	K	51.7	Low	68.5	Low	193 Å²	193	85 Å²	85	84%	0.839	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.8	45	171.3	-62.7	-179.7	179.5	173.2	0	113.5	G59 D63	G59-K61 PolarHBondContact O-N 3.18Å; G59-K61 VanDerWaalsContact O-N 3.08Å; K61-D63 PolarHBondContact O-N 2.97Å; K61-D63 VanDerWaalsContact O-N 3.12Å
62	E	55.1	Low	68.7	Low	114 Å²	114	78.9 Å²	78.9	53%	0.533	42%	0.42	S	S	.	.			trans	-59.2	124.6	167.6	-82.6	-176.8	156.1	0	0	106.7	D60 I64	D60-E62 PolarHBondContact O-N 2.87Å; E62-I64 VanDerWaalsContact C-N 3.34Å; E62-I64 PolarHBondContact O-N 3.45Å
63	D	64.9	Low	69	Low	161 Å²	161	82 Å²	82	86%	0.861	43%	0.434	S	S	*	.			trans	-57.4	99	-177.1	-80.7	-39.8	0	0	0	108.4	K61 P65	K61-D63 PolarHBondContact O-N 2.97Å; K61-D63 VanDerWaalsContact O-N 3.12Å; D63-P65 WeakPolarHBondContact O-CD 3.42Å; D63-P65 VanDerWaalsContact O-N 3.09Å
64	I	68.7	Low	69.2	Low	30 Å²	30	81.4 Å²	81.4	15%	0.154	43%	0.43	C	S	.	.			trans	-50.1	122.6	-178.9	-60	169.7	0	0	0	107.2	E62 T66 L68 L69 H302 L357	E62-I64 VanDerWaalsContact C-N 3.34Å; E62-I64 PolarHBondContact O-N 3.45Å; I64-T66 PolarHBondContact O-N 3.16Å; I64-L68 HydrophobicContact CG2-CB 4.3Å; I64-L69 HydrophobicContact CB-CD1 4.27Å; I64-L69 HydrophobicContact CB-CD2 4.32Å; I64-L69 HydrophobicContact CB-CG 4.12Å; I64-L69 HydrophobicContact CD1-CD2 4.2Å; I64-L69 HydrophobicContact CG2-CD1 4.37Å; I64-L69 HydrophobicContact CG2-CD2 3.95Å; I64-L69 HydrophobicContact CG2-CG 3.7Å; I64-H302 HydrophobicContact CD1-CB 3.88Å; I64-L357 HydrophobicContact CD1-CD2 3.92Å; I64-L357 HydrophobicContact CG2-CD2 3.68Å
65	P	81.4	Confident	69.8	Low	54 Å²	54	76.2 Å²	76.2	35%	0.351	41%	0.405	S	S	.	.			trans	-50.2	130.1	-179.6	-29.8	34.1	0	0	0	111.2	D63 N67 L68 L69	D63-P65 WeakPolarHBondContact O-CD 3.42Å; D63-P65 VanDerWaalsContact O-N 3.09Å; P65-N67 PolarHBondContact O-N 3.16Å; P65-L68 HydrophobicContact CB-CD1 4.3Å; P65-L68 HydrophobicContact CB-CG 4.39Å; P65-L68 HydrophobicContact CG-CD1 4.18Å; P65-L68 PolarHBondContact O-N 2.89Å; P65-L69 PolarHBondContact O-N 2.97Å
66	T	80.4	Confident	71.1	Confident	111 Å²	111	76.2 Å²	76.2	68%	0.681	40%	0.396	S	S	*	.	H	α-helix	trans	-53.9	-32.8	-177.5	50.7	0	0	0	0	112.2	I64 L68 L69 S70	I64-T66 PolarHBondContact O-N 3.16Å; T66-L68 VanDerWaalsContact C-N 3.34Å; T66-L68 PolarHBondContact O-N 3.4Å; T66-L69 PolarHBondContact O-N 3.22Å; T66-S70 WeakPolarHBondContact O-CB 3.32Å; T66-S70 PolarHBondContact O-N 2.58Å
67	N	79.8	Confident	72.6	Confident	118 Å²	118	70.2 Å²	70.2	63%	0.631	37%	0.37	S	S	*	.	H	α-helix	trans	-57.3	-43	174.2	-68	-16.5	0	0	0	112.7	P65 S70 L71	P65-N67 PolarHBondContact O-N 3.16Å; N67-S70 WeakPolarHBondContact O-CB 3.44Å; N67-S70 PolarHBondContact O-N 3.01Å; N67-S70 PolarHBondContact O-OG 3.31Å; N67-L71 PolarHBondContact O-N 2.88Å
68	L	82.4	Confident	74	Confident	38 Å²	38	65 Å²	65	20%	0.199	35%	0.345	C	S	.	.	H	α-helix	trans	-76.8	-34.8	-179.1	-65.1	175.7	0	0	0	112.5	I64 P65 T66 S70 L71 Y72 L357 H364 V366	I64-L68 HydrophobicContact CG2-CB 4.3Å; P65-L68 HydrophobicContact CB-CD1 4.3Å; P65-L68 HydrophobicContact CB-CG 4.39Å; P65-L68 HydrophobicContact CG-CD1 4.18Å; P65-L68 PolarHBondContact O-N 2.89Å; T66-L68 VanDerWaalsContact C-N 3.34Å; T66-L68 PolarHBondContact O-N 3.4Å; L68-S70 VanDerWaalsContact C-N 3.29Å; L68-L71 HydrophobicContact CD2-CD2 4.42Å; L68-L71 PolarHBondContact O-N 2.99Å; L68-Y72 WeakPolarHBondContact O-CB 3.47Å; L68-Y72 PolarHBondContact O-N 2.73Å; L68-L357 HydrophobicContact CB-CD1 4.38Å; L68-H364 HydrophobicContact CD1-CB 3.22Å; L68-V366 HydrophobicContact CD2-CG2 4.39Å
69	L	84.3	Confident	75.5	Confident	54 Å²	54	64.9 Å²	64.9	28%	0.283	34%	0.343	S	S	.	.	H	α-helix	trans	-62	-40.8	168.4	-71.5	172.2	0	0	0	111	I64 P65 T66 L71 Y72 N73 L357	I64-L69 HydrophobicContact CB-CD1 4.27Å; I64-L69 HydrophobicContact CB-CD2 4.32Å; I64-L69 HydrophobicContact CB-CG 4.12Å; I64-L69 HydrophobicContact CD1-CD2 4.2Å; I64-L69 HydrophobicContact CG2-CD1 4.37Å; I64-L69 HydrophobicContact CG2-CD2 3.95Å; I64-L69 HydrophobicContact CG2-CG 3.7Å; P65-L69 PolarHBondContact O-N 2.97Å; T66-L69 PolarHBondContact O-N 3.22Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 3.21Å; L69-Y72 PolarHBondContact O-N 3.49Å; L69-N73 WeakPolarHBondContact O-CB 3.25Å; L69-N73 PolarHBondContact O-N 2.91Å; L69-N73 PolarHBondContact O-ND2 3.43Å; L69-L357 HydrophobicContact CD2-CD2 4.33Å
70	S	83.9	Confident	77	Confident	28 Å²	28	68.3 Å²	68.3	20%	0.196	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-43.5	174.7	96.8	0	0	0	0	110.9	T66 N67 L68 N73 N74 K106	T66-S70 WeakPolarHBondContact O-CB 3.32Å; T66-S70 PolarHBondContact O-N 2.58Å; N67-S70 WeakPolarHBondContact O-CB 3.44Å; N67-S70 PolarHBondContact O-N 3.01Å; N67-S70 PolarHBondContact O-OG 3.31Å; L68-S70 VanDerWaalsContact C-N 3.29Å; S70-N73 PolarHBondContact O-N 2.78Å; S70-N74 VanDerWaalsContact O-CB 3.31Å; S70-N74 WeakPolarHBondContact O-CB 3.47Å; S70-N74 VanDerWaalsContact O-CG 3.23Å; S70-N74 PolarHBondContact O-N 2.9Å; S70-N74 PolarHBondContact O-ND2 2.86Å; S70-K106 PolarHBondContact OG-NZ 2.9Å
71	L	84.3	Confident	78.2	Confident	10 Å²	10	62.9 Å²	62.9	5%	0.052	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-51.6	178.2	176.5	61	0	0	0	110.8	N67 L68 L69 N73 N74 T75 L104 K106 L250 V366	N67-L71 PolarHBondContact O-N 2.88Å; L68-L71 HydrophobicContact CD2-CD2 4.42Å; L68-L71 PolarHBondContact O-N 2.99Å; L69-L71 VanDerWaalsContact C-N 3.33Å; L69-L71 PolarHBondContact O-N 3.21Å; L71-N73 PolarHBondContact O-N 2.83Å; L71-N74 PolarHBondContact O-N 3.46Å; L71-T75 PolarHBondContact O-N 3.41Å; L71-T75 PolarHBondContact O-OG1 2.89Å; L71-L104 HydrophobicContact CD1-CB 4.25Å; L71-L104 WeakPolarHBondContact CD2-O 3.35Å; L71-K106 HydrophobicContact CD1-CB 3.7Å; L71-L250 HydrophobicContact CD1-CD1 3.6Å; L71-V366 HydrophobicContact CD2-CB 3.75Å; L71-V366 HydrophobicContact CD2-CG1 4.28Å; L71-V366 HydrophobicContact CD2-CG2 3.85Å; L71-V366 HydrophobicContact CG-CB 4.16Å; L71-V366 HydrophobicContact CG-CG1 4.16Å; L71-V366 HydrophobicContact CG-CG2 4.2Å
72	Y	86.6	Confident	79.1	Confident	13 Å²	13	57.6 Å²	57.6	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-56.6	-46.4	178.2	176.5	-94	0	0	0	112.8	L68 L69 T75 K76 K303 P304 P355 L357	L68-Y72 WeakPolarHBondContact O-CB 3.47Å; L68-Y72 PolarHBondContact O-N 2.73Å; L69-Y72 PolarHBondContact O-N 3.49Å; Y72-T75 PolarHBondContact O-N 3.19Å; Y72-K76 HydrophobicContact CE1-CD 4.39Å; Y72-K76 WeakPolarHBondContact O-CB 3.43Å; Y72-K76 PolarHBondContact O-N 2.81Å; Y72-K303 HydrophobicContact CD1-CB 4.24Å; Y72-K303 HydrophobicContact CD2-CB 4.3Å; Y72-K303 HydrophobicContact CE1-CB 3.86Å; Y72-K303 HydrophobicContact CE1-CG 4.5Å; Y72-K303 HydrophobicContact CE2-CB 3.92Å; Y72-K303 HydrophobicContact CG-CB 4.45Å; Y72-P304 WeakPolarHBondContact OH-CD 3.48Å; Y72-P355 HydrophobicContact CD2-CB 4.49Å; Y72-P355 HydrophobicContact CE2-CB 4.22Å; Y72-P355 HydrophobicContact CE2-CG 4.27Å; Y72-P355 WeakPolarHBondContact CE2-O 3.23Å; Y72-L357 HydrophobicContact CD2-CB 4.13Å
73	N	87.1	Confident	79.5	Confident	82 Å²	82	55.9 Å²	55.9	44%	0.439	29%	0.291	S	S	.	.	H	α-helix	trans	-65.3	-42.9	179.2	-73.1	-23.5	0	0	0	111.6	L69 S70 L71 T75 K76 D77	L69-N73 WeakPolarHBondContact O-CB 3.25Å; L69-N73 PolarHBondContact O-N 2.91Å; L69-N73 PolarHBondContact O-ND2 3.43Å; S70-N73 PolarHBondContact O-N 2.78Å; L71-N73 PolarHBondContact O-N 2.83Å; N73-T75 VanDerWaalsContact C-N 3.34Å; N73-T75 PolarHBondContact O-N 3.41Å; N73-K76 WeakPolarHBondContact O-CB 3.41Å; N73-K76 PolarHBondContact O-N 2.81Å; N73-D77 PolarHBondContact O-N 2.91Å
74	N	84.2	Confident	79.4	Confident	9 Å²	9	55.5 Å²	55.5	5%	0.048	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-40.9	177.4	-77.6	-48.1	0	0	0	112.2	S70 L71 D77 M78 R144 Y248	S70-N74 VanDerWaalsContact O-CB 3.31Å; S70-N74 WeakPolarHBondContact O-CB 3.47Å; S70-N74 VanDerWaalsContact O-CG 3.23Å; S70-N74 PolarHBondContact O-N 2.9Å; S70-N74 PolarHBondContact O-ND2 2.86Å; L71-N74 PolarHBondContact O-N 3.46Å; N74-D77 PolarHBondContact O-N 2.91Å; N74-M78 WeakPolarHBondContact O-CB 3.21Å; N74-M78 PolarHBondContact O-N 3.16Å; N74-R144 PolarHBondContact O-NH1 2.72Å; N74-Y248 WeakPolarHBondContact CB-OH 3.47Å; N74-Y248 PolarHBondContact OD1-OH 3.37Å
75	T	83.1	Confident	78.7	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-42.4	174.1	-51.1	0	0	0	0	111.5	L71 Y72 N73 D77 M78 L79 L104 P355	L71-T75 PolarHBondContact O-N 3.41Å; L71-T75 PolarHBondContact O-OG1 2.89Å; Y72-T75 PolarHBondContact O-N 3.19Å; N73-T75 VanDerWaalsContact C-N 3.34Å; N73-T75 PolarHBondContact O-N 3.41Å; T75-D77 VanDerWaalsContact C-N 3.3Å; T75-D77 PolarHBondContact O-N 3.36Å; T75-M78 HydrophobicContact CG2-CE 4.4Å; T75-M78 WeakPolarHBondContact O-CB 3.37Å; T75-M78 PolarHBondContact O-N 2.81Å; T75-L79 HydrophobicContact CG2-CD1 4.42Å; T75-L79 WeakPolarHBondContact O-CG 3.44Å; T75-L79 PolarHBondContact O-N 3.25Å; T75-L104 HydrophobicContact CG2-CD1 4.42Å; T75-L104 HydrophobicContact CG2-CD2 3.51Å; T75-P355 HydrophobicContact CG2-CB 3.95Å
76	K	84.9	Confident	77	Confident	91 Å²	91	62.3 Å²	62.3	40%	0.396	33%	0.325	S	S	.	.	H	α-helix	trans	-60.9	-40.9	177.3	-176.5	-177.3	178.6	-179.1	0	111.7	Y72 N73 K80	Y72-K76 HydrophobicContact CE1-CD 4.39Å; Y72-K76 WeakPolarHBondContact O-CB 3.43Å; Y72-K76 PolarHBondContact O-N 2.81Å; N73-K76 WeakPolarHBondContact O-CB 3.41Å; N73-K76 PolarHBondContact O-N 2.81Å; K76-K80 WeakPolarHBondContact O-CG 3.38Å; K76-K80 PolarHBondContact O-N 2.6Å
77	D	83.7	Confident	75	Confident	57 Å²	57	65.2 Å²	65.2	31%	0.305	33%	0.33	S	S	.	.	H	α-helix	trans	-74.6	-36.3	179.8	-67.1	-24.9	0	0	0	111.9	N73 N74 T75 L79 K80 E81	N73-D77 PolarHBondContact O-N 2.91Å; N74-D77 PolarHBondContact O-N 2.91Å; T75-D77 VanDerWaalsContact C-N 3.3Å; T75-D77 PolarHBondContact O-N 3.36Å; D77-L79 PolarHBondContact O-N 3.39Å; D77-K80 PolarHBondContact O-N 3.35Å; D77-K80 IonicContact OD1-NZ 3.43Å; D77-K80 PolarHBondContact OD1-NZ 3.03Å; D77-E81 WeakPolarHBondContact O-CG 3.32Å; D77-E81 PolarHBondContact O-N 3.07Å
78	M	81.3	Confident	72.9	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-54.8	-49.3	169	-175.5	-157.3	75.5	0	0	112.1	N74 T75 K80 E81 Q82 R144 L250 M252	N74-M78 WeakPolarHBondContact O-CB 3.21Å; N74-M78 PolarHBondContact O-N 3.16Å; T75-M78 HydrophobicContact CG2-CE 4.4Å; T75-M78 WeakPolarHBondContact O-CB 3.37Å; T75-M78 PolarHBondContact O-N 2.81Å; M78-K80 VanDerWaalsContact C-N 3.28Å; M78-K80 PolarHBondContact O-N 2.92Å; M78-E81 PolarHBondContact O-N 3.4Å; M78-E81 VanDerWaalsContact O-N 3.16Å; M78-Q82 WeakPolarHBondContact O-CG 3.46Å; M78-Q82 PolarHBondContact O-N 3.01Å; M78-R144 VanDerWaalsContact CA-NH2 3.34Å; M78-L250 HydrophobicContact SD-CD2 3.62Å; M78-M252 HydrophobicContact CE-CE 3.24Å; M78-M252 HydrophobicContact SD-CE 3.49Å; M78-M252 WeakPolarHBondContact SD-CE 3.41Å
79	L	80.3	Confident	70.5	Confident	12 Å²	12	71 Å²	71	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-63.5	-34.8	-179.4	-71.1	175.5	0	0	0	112.2	T75 D77 Q83 P353 P355	T75-L79 HydrophobicContact CG2-CD1 4.42Å; T75-L79 WeakPolarHBondContact O-CG 3.44Å; T75-L79 PolarHBondContact O-N 3.25Å; D77-L79 PolarHBondContact O-N 3.39Å; L79-Q83 WeakPolarHBondContact O-CG 3.41Å; L79-Q83 PolarHBondContact O-N 3.09Å; L79-Q83 VanDerWaalsContact O-N 3.12Å; L79-P353 HydrophobicContact CD1-CG 4.42Å; L79-P353 HydrophobicContact CD2-CG 3.72Å; L79-P355 HydrophobicContact CD1-CB 4.34Å; L79-P355 HydrophobicContact CD1-CG 3.82Å
80	K	79.4	Confident	68.3	Low	96 Å²	96	75.5 Å²	75.5	42%	0.417	39%	0.388	S	S	.	.	H	α-helix	trans	-68.1	-39.6	174.3	-70.2	170.1	-174.4	163.5	0	112.4	K76 D77 M78 Q83 L84	K76-K80 WeakPolarHBondContact O-CG 3.38Å; K76-K80 PolarHBondContact O-N 2.6Å; D77-K80 PolarHBondContact O-N 3.35Å; D77-K80 IonicContact OD1-NZ 3.43Å; D77-K80 PolarHBondContact OD1-NZ 3.03Å; M78-K80 VanDerWaalsContact C-N 3.28Å; M78-K80 PolarHBondContact O-N 2.92Å; K80-Q83 WeakPolarHBondContact O-CB 3.48Å; K80-Q83 PolarHBondContact O-N 2.84Å; K80-L84 WeakPolarHBondContact O-CD1 3.46Å; K80-L84 PolarHBondContact O-N 3.12Å
81	E	74.8	Confident	65.9	Low	48 Å²	48	78.3 Å²	78.3	22%	0.224	41%	0.407	C	S	.	.	H	α-helix	trans	-64.4	-45.7	177.1	-72.7	169.7	-173	0	0	110.7	D77 M78 Q83 L84 E85 R144	D77-E81 WeakPolarHBondContact O-CG 3.32Å; D77-E81 PolarHBondContact O-N 3.07Å; M78-E81 PolarHBondContact O-N 3.4Å; M78-E81 VanDerWaalsContact O-N 3.16Å; E81-Q83 VanDerWaalsContact C-N 3.27Å; E81-Q83 PolarHBondContact O-N 2.91Å; E81-L84 WeakPolarHBondContact O-CB 3.1Å; E81-L84 PolarHBondContact O-N 2.91Å; E81-E85 PolarHBondContact O-N 3.42Å; E81-R144 IonicContact OE1-NH2 2.67Å; E81-R144 IonicContact OE2-CZ 3.33Å; E81-R144 IonicContact OE2-NH2 2.78Å; E81-R144 PolarHBondContact OE2-NH2 2.81Å
82	Q	70.1	Confident	63.7	Low	81 Å²	81	86 Å²	86	38%	0.379	44%	0.443	S	S	.	.	H	α-helix	trans	-60.5	-34.6	175.3	-71.9	177.3	-18.3	0	0	112.8	M78 L84 E85 S86 E142	M78-Q82 WeakPolarHBondContact O-CG 3.46Å; M78-Q82 PolarHBondContact O-N 3.01Å; Q82-L84 VanDerWaalsContact C-N 3.32Å; Q82-L84 PolarHBondContact O-N 2.83Å; Q82-E85 PolarHBondContact O-N 3.12Å; Q82-S86 PolarHBondContact O-N 2.91Å; Q82-E142 PolarHBondContact NE2-OE1 2.88Å
83	Q	64.9	Low	61.3	Low	78 Å²	78	94.1 Å²	94.1	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-64.6	-36.7	173.7	-74.4	172	11.3	0	0	112.3	L79 K80 E81 S86 E352	L79-Q83 WeakPolarHBondContact O-CG 3.41Å; L79-Q83 PolarHBondContact O-N 3.09Å; L79-Q83 VanDerWaalsContact O-N 3.12Å; K80-Q83 WeakPolarHBondContact O-CB 3.48Å; K80-Q83 PolarHBondContact O-N 2.84Å; E81-Q83 VanDerWaalsContact C-N 3.27Å; E81-Q83 PolarHBondContact O-N 2.91Å; Q83-S86 PolarHBondContact O-OG 2.83Å; Q83-E352 WeakPolarHBondContact CG-OE1 2.9Å; Q83-E352 PolarHBondContact NE2-OE1 2.91Å; Q83-E352 PolarHBondContact NE2-OE2 3.5Å
84	L	61.8	Low	59.2	Low	154 Å²	154	96.2 Å²	96.2	81%	0.806	49%	0.488	S	S	*	.	H	α-helix	trans	-75	-32.8	178.4	-72.8	156.8	0	0	0	112.5	K80 E81 Q82	K80-L84 WeakPolarHBondContact O-CD1 3.46Å; K80-L84 PolarHBondContact O-N 3.12Å; E81-L84 WeakPolarHBondContact O-CB 3.1Å; E81-L84 PolarHBondContact O-N 2.91Å; Q82-L84 VanDerWaalsContact C-N 3.32Å; Q82-L84 PolarHBondContact O-N 2.83Å
85	E	53.8	Low	57.7	Low	135 Å²	135	101.6 Å²	101.6	63%	0.631	51%	0.513	S	S	*	.	H	α-helix	trans	-85.8	-4.6	-178.3	-71.9	-174.7	168.2	0	0	114.6	E81 Q82 Q87	E81-E85 PolarHBondContact O-N 3.42Å; Q82-E85 PolarHBondContact O-N 3.12Å; E85-Q87 PolarHBondContact O-N 2.84Å
86	S	45	Very low	55.5	Low	92 Å²	92	106.7 Å²	106.7	64%	0.643	54%	0.537	S	S	*	.			trans	-74.2	67.4	-174.2	57.6	0	0	0	0	114.4	Q82 Q83	Q82-S86 PolarHBondContact O-N 2.91Å; Q83-S86 PolarHBondContact O-OG 2.83Å
87	Q	39.2	Very low	53.7	Low	171 Å²	171	106 Å²	106	80%	0.799	54%	0.535	S	S	*	.			trans	-123.9	119.8	145.9	-77.8	-170.7	-7.1	0	0	108.3	E85	E85-Q87 PolarHBondContact O-N 2.84Å
88	I	36.4	Very low	52.3	Low	152 Å²	152	108 Å²	108	78%	0.779	54%	0.543	S	S	*	.	S	Bend	trans	99.3	117.4	154.6	-54.6	154.8	0	0	0	117.8
89	T	32.4	Very low	50.8	Low	125 Å²	125	113.2 Å²	113.2	77%	0.767	56%	0.563	S	S	*	*			trans	81.7	115	160.1	-11	0	0	0	0	119.5
90	I	36.8	Very low	49.9	Very low	150 Å²	150	114.4 Å²	114.4	77%	0.769	57%	0.568	S	S	*	*			trans	-137.9	129.9	157.3	-56.9	178.3	0	0	0	108.7
91	S	34.5	Very low	49.2	Very low	86 Å²	86	110 Å²	110	60%	0.601	55%	0.549	S	S	*	.			trans	-82.4	159.4	175.2	47.5	0	0	0	0	112.1	E93	S91-E93 VanDerWaalsContact C-N 3.28Å; S91-E93 PolarHBondContact O-N 3.46Å
92	Q	37.5	Very low	49.5	Very low	173 Å²	173	109.1 Å²	109.1	81%	0.808	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	15.9	-163.2	-72	-179.1	-36.6	0	0	116.9
93	E	36.9	Very low	50.1	Low	183 Å²	183	106.9 Å²	106.9	86%	0.855	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	-7.7	-164.1	-69.8	178.6	170.3	0	0	116.5	S91	S91-E93 VanDerWaalsContact C-N 3.28Å; S91-E93 PolarHBondContact O-N 3.46Å
94	Q	41.9	Very low	51.2	Low	125 Å²	125	103.3 Å²	103.3	58%	0.584	52%	0.52	S	S	*	.	S	Bend	trans	-103.1	3.8	-173	-73.1	-177.6	-35.9	0	0	116.4	E96	Q94-E96 PolarHBondContact O-N 2.87Å
95	E	52.2	Low	52.5	Low	122 Å²	122	97.5 Å²	97.5	57%	0.57	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-79.8	-16.7	-162.9	-68.5	-177.3	171	0	0	115.8
96	E	38.6	Very low	54.3	Low	108 Å²	108	93.2 Å²	93.2	51%	0.505	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-83.1	-21.4	-175.9	-64.5	-169.9	163.6	0	0	113.7	Q94 E98 S264	Q94-E96 PolarHBondContact O-N 2.87Å; E96-E98 VanDerWaalsContact C-N 3.34Å; E96-E98 PolarHBondContact O-N 3.37Å; E96-S264 WeakPolarHBondContact OE1-CB 3.49Å
97	E	46.5	Very low	56.5	Low	76 Å²	76	89.1 Å²	89.1	36%	0.355	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-83.4	-5.6	-177.6	-66.1	-176.1	172.7	0	0	114.1	T139 I254	E97-T139 HydrophobicContact CB-CG2 4.37Å; E97-T139 WeakPolarHBondContact OE2-CB 3.44Å; E97-T139 VanDerWaalsContact OE2-CG2 3.3Å; E97-T139 WeakPolarHBondContact OE2-CG2 3.42Å; E97-I254 HydrophobicContact CB-CD1 4.31Å; E97-I254 HydrophobicContact CG-CD1 4.2Å
98	E	53.1	Low	59	Low	99 Å²	99	84.6 Å²	84.6	46%	0.463	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-92.2	-12.5	-164.7	-153.1	178.2	-178.6	0	0	114.4	E96 S370	E96-E98 VanDerWaalsContact C-N 3.34Å; E96-E98 PolarHBondContact O-N 3.37Å; E98-S370 WeakPolarHBondContact O-CB 3.41Å; E98-S370 PolarHBondContact O-OG 3.26Å
99	Y	50.3	Low	61.6	Low	112 Å²	112	78 Å²	78	44%	0.439	39%	0.387	S	S	.	.	S	Bend	trans	-73.6	-37.8	-173.7	-180	-98.6	0	0	0	114.1	K46 S370	K46-Y99 PolarHBondContact NZ-O 2.92Å; Y99-S370 PolarHBondContact O-OG 3.28Å
100	F	61.1	Low	64.3	Low	37 Å²	37	75.2 Å²	75.2	16%	0.162	38%	0.376	C	S	.	.	S	Bend	trans	-82.9	158.1	-178.1	-69.6	-67.7	0	0	0	111.8	R48 K102 M258 L262	R48-F100 HydrophobicContact CG-CE1 4.32Å; F100-K102 PolarHBondContact O-N 3.46Å; F100-M258 HydrophobicContact CD1-CE 4.23Å; F100-L262 HydrophobicContact CD2-CD2 3.85Å; F100-L262 HydrophobicContact CE2-CD2 3.48Å; F100-L262 VanDerWaalsContact CE2-CD2 3.48Å
101	A	65.3	Low	66.7	Low	3 Å²	3	70.5 Å²	70.5	3%	0.025	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-61.7	131.9	172.7	0	0	0	0	0	109.7	L47 E367 Q368 L369	L47-A101 HydrophobicContact CD2-CB 4.15Å; A101-E367 HydrophobicContact CB-CB 4.29Å; A101-E367 WeakPolarHBondContact CB-OE2 3.33Å; A101-Q368 WeakPolarHBondContact CA-O 3.14Å; A101-L369 HydrophobicContact CB-CD2 3.86Å
102	K	80.6	Confident	69.2	Low	30 Å²	30	69.4 Å²	69.4	13%	0.13	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	130.9	174.7	-64.2	-176.3	176.2	-166.2	0	108.9	F100 L104 T139 M252 E367 Q368	F100-K102 PolarHBondContact O-N 3.46Å; K102-L104 WeakPolarHBondContact O-CD1 3.2Å; K102-T139 HydrophobicContact CD-CG2 4.4Å; K102-T139 WeakPolarHBondContact CD-OG1 3.3Å; K102-T139 WeakPolarHBondContact CE-OG1 3.31Å; K102-T139 PolarHBondContact NZ-OG1 3.27Å; K102-M252 HydrophobicContact CB-CB 4.18Å; K102-M252 HydrophobicContact CD-CB 4.14Å; K102-M252 HydrophobicContact CD-SD 4.33Å; K102-E367 WeakPolarHBondContact O-CA 3.47Å; K102-Q368 PolarHBondContact N-O 2.96Å; K102-Q368 VanDerWaalsContact N-O 3.15Å; K102-Q368 PolarHBondContact O-N 3.43Å
103	V	83.7	Confident	71.5	Confident	34 Å²	34	65.6 Å²	65.6	21%	0.206	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	127.2	175.6	-180	0	0	0	0	108.3	M252 S253 P255 E367	V103-M252 WeakPolarHBondContact O-CA 3.39Å; V103-S253 PolarHBondContact N-O 2.83Å; V103-S253 PolarHBondContact O-N 2.95Å; V103-P255 HydrophobicContact CG2-CB 4.16Å; V103-P255 HydrophobicContact CG2-CG 4.13Å; V103-E367 HydrophobicContact CG2-CG 4.32Å
104	L	86.8	Confident	73.6	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.016	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.9	178	-64	103.8	0	0	0	111.3	L71 T75 K102 L250 T251 M252 V366 Q368	L71-L104 HydrophobicContact CD1-CB 4.25Å; L71-L104 WeakPolarHBondContact CD2-O 3.35Å; T75-L104 HydrophobicContact CG2-CD1 4.42Å; T75-L104 HydrophobicContact CG2-CD2 3.51Å; K102-L104 WeakPolarHBondContact O-CD1 3.2Å; L104-L250 HydrophobicContact CB-CD1 4.49Å; L104-L250 HydrophobicContact CD2-CD1 4.16Å; L104-L250 HydrophobicContact CD2-CD2 4.44Å; L104-L250 HydrophobicContact CD2-CG 4.46Å; L104-T251 VanDerWaalsContact CA-O 3.3Å; L104-T251 WeakPolarHBondContact CA-O 3.48Å; L104-M252 HydrophobicContact CD2-CE 3.92Å; L104-M252 HydrophobicContact CD2-CG 3.98Å; L104-M252 HydrophobicContact CG-CG 4.19Å; L104-V366 HydrophobicContact CD1-CG1 4.37Å; L104-V366 PolarHBondContact N-O 3.24Å; L104-Q368 HydrophobicContact CD1-CB 3.71Å
105	N	89.9	Confident	75.6	Confident	32 Å²	32	54.9 Å²	54.9	17%	0.171	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	141.1	171.6	-55.2	-64	0	0	0	110.1	F107 T131 T251	N105-F107 HydrophobicContact CB-CE1 4.49Å; N105-F107 HydrophobicContact CB-CE2 3.64Å; N105-F107 HydrophobicContact CB-CZ 3.61Å; N105-T131 HydrophobicContact CB-CG2 4.14Å; N105-T131 VanDerWaalsContact CG-CG2 3.47Å; N105-T251 WeakPolarHBondContact CB-OG1 3.46Å; N105-T251 PolarHBondContact N-O 3.38Å; N105-T251 PolarHBondContact O-N 3.5Å; N105-T251 PolarHBondContact O-OG1 3.46Å
106	K	91.3	Very high	76.9	Confident	44 Å²	44	55.3 Å²	55.3	19%	0.191	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126	175.5	165	178.2	169.6	-180	0	109.1	S70 L71 N108 Y248 I249	S70-K106 PolarHBondContact OG-NZ 2.9Å; L71-K106 HydrophobicContact CD1-CB 3.7Å; K106-N108 WeakPolarHBondContact CE-OD1 2.77Å; K106-Y248 HydrophobicContact CD-CD1 4.36Å; K106-Y248 HydrophobicContact CD-CD2 4.15Å; K106-Y248 HydrophobicContact CD-CG 4.1Å; K106-Y248 HydrophobicContact CG-CD2 3.86Å; K106-Y248 HydrophobicContact CG-CG 3.95Å; K106-I249 WeakPolarHBondContact CA-O 3.5Å
107	F	92.8	Very high	79	Confident	7 Å²	7	56.7 Å²	56.7	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	114.6	176.7	-55.2	-79.8	0	0	0	109.4	N105 E127 I128 T131 V132 Y248 I249 T251	N105-F107 HydrophobicContact CB-CE1 4.49Å; N105-F107 HydrophobicContact CB-CE2 3.64Å; N105-F107 HydrophobicContact CB-CZ 3.61Å; F107-E127 HydrophobicContact CD1-CG 4.23Å; F107-E127 HydrophobicContact CE1-CG 4.23Å; F107-I128 HydrophobicContact CB-CD1 4.28Å; F107-I128 HydrophobicContact CB-CG1 4.17Å; F107-I128 HydrophobicContact CD1-CG1 3.72Å; F107-I128 HydrophobicContact CD2-CD1 4.15Å; F107-I128 HydrophobicContact CD2-CG1 3.75Å; F107-I128 HydrophobicContact CD2-CG2 4.34Å; F107-I128 HydrophobicContact CE1-CB 4.39Å; F107-I128 HydrophobicContact CE1-CG1 3.98Å; F107-I128 HydrophobicContact CE2-CB 4.31Å; F107-I128 HydrophobicContact CE2-CG1 3.98Å; F107-I128 HydrophobicContact CE2-CG2 3.89Å; F107-I128 HydrophobicContact CG-CD1 4.13Å; F107-I128 HydrophobicContact CG-CG1 3.6Å; F107-I128 HydrophobicContact CZ-CB 4.23Å; F107-I128 HydrophobicContact CZ-CG1 4.1Å; F107-I128 HydrophobicContact CZ-CG2 4.13Å; F107-T131 HydrophobicContact CE1-CG2 4.31Å; F107-T131 HydrophobicContact CZ-CG2 3.94Å; F107-V132 HydrophobicContact CE2-CG2 4.33Å; F107-V132 HydrophobicContact CZ-CG2 4.34Å; F107-Y248 CarbonylContact O-C 3.51Å; F107-Y248 WeakPolarHBondContact O-CA 3.36Å; F107-Y248 VanDerWaalsContact O-CB 3.26Å; F107-Y248 WeakPolarHBondContact O-CB 3.43Å; F107-I249 PolarHBondContact N-O 2.96Å; F107-I249 PolarHBondContact O-N 3.47Å; F107-T251 HydrophobicContact CD2-CG2 4.07Å; F107-T251 HydrophobicContact CE2-CG2 3.8Å; F107-T251 WeakPolarHBondContact CE2-OG1 3.34Å
108	N	91.3	Very high	81	Confident	75 Å²	75	54.6 Å²	54.6	40%	0.401	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	152.8	177.6	-65.7	-34.5	0	0	0	110.3	K106 A110	K106-N108 WeakPolarHBondContact CE-OD1 2.77Å; N108-A110 PolarHBondContact O-N 3.37Å
109	M	91.3	Very high	82.8	Confident	15 Å²	15	50.2 Å²	50.2	7%	0.074	26%	0.261	C	S	.	.			trans	-56.7	129.9	169.3	179.3	-174.2	69	0	0	110.7	S111 K112 M121 F122 F123 L246 P247	M109-S111 WeakPolarHBondContact CG-O 3.48Å; M109-K112 HydrophobicContact CE-CB 3.72Å; M109-K112 HydrophobicContact CE-CD 4.16Å; M109-K112 HydrophobicContact CE-CG 4.37Å; M109-K112 HydrophobicContact SD-CB 3.86Å; M109-M121 HydrophobicContact CG-CB 4.07Å; M109-M121 HydrophobicContact SD-CB 3.68Å; M109-M121 HydrophobicContact SD-CG 3.62Å; M109-F122 WeakPolarHBondContact CG-O 3.49Å; M109-F123 HydrophobicContact CB-CE1 4.04Å; M109-F123 HydrophobicContact CB-CZ 4.1Å; M109-L246 HydrophobicContact CE-CD2 3.84Å; M109-P247 WeakPolarHBondContact CB-O 2.89Å; M109-P247 PolarHBondContact N-O 2.76Å; M109-P247 HydrophobicContact SD-CG 4.34Å
110	A	88.8	Confident	84.8	Confident	66 Å²	66	45.6 Å²	45.6	55%	0.545	24%	0.244	S	C	.	.			trans	-79.7	-45.7	-178.1	0	0	0	0	0	111.8	N108 F122	N108-A110 PolarHBondContact O-N 3.37Å; A110-F122 PolarHBondContact N-O 2.93Å
111	S	86.1	Confident	86.4	Confident	50 Å²	50	43.9 Å²	43.9	35%	0.35	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	166.2	177.5	78	0	0	0	0	110.9	M109 F122	M109-S111 WeakPolarHBondContact CG-O 3.48Å; S111-F122 PolarHBondContact O-N 2.99Å; S111-F122 VanDerWaalsContact OG-CB 3.27Å; S111-F122 WeakPolarHBondContact OG-CB 3.35Å; S111-F122 VanDerWaalsContact OG-CD2 3.26Å; S111-F122 WeakPolarHBondContact OG-CD2 3.44Å; S111-F122 VanDerWaalsContact OG-CG 3.3Å; S111-F122 WeakPolarHBondContact OG-CG 3.31Å
112	K	86.8	Confident	87.7	Confident	63 Å²	63	45.5 Å²	45.5	27%	0.274	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	148.6	-177.8	64.8	-177	-179.4	-178.3	0	111.7	M109 T120 G228 T229 D230	M109-K112 HydrophobicContact CE-CB 3.72Å; M109-K112 HydrophobicContact CE-CD 4.16Å; M109-K112 HydrophobicContact CE-CG 4.37Å; M109-K112 HydrophobicContact SD-CB 3.86Å; K112-T120 WeakPolarHBondContact CA-O 3.45Å; K112-G228 WeakPolarHBondContact CD-O 3.34Å; K112-G228 PolarHBondContact NZ-O 3.45Å; K112-T229 WeakPolarHBondContact CD-O 3.44Å; K112-D230 PolarHBondContact NZ-O 3Å
113	N	86.4	Confident	88.4	Confident	93 Å²	93	44.1 Å²	44.1	50%	0.497	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	108.2	163.7	-172.3	-1.3	0	0	0	109	T120 F122	N113-T120 PolarHBondContact N-O 2.91Å; N113-T120 WeakPolarHBondContact O-CA 2.95Å; N113-T120 WeakPolarHBondContact O-CB 3.46Å; N113-T120 PolarHBondContact O-N 2.87Å; N113-T120 PolarHBondContact O-OG1 2.85Å; N113-F122 HydrophobicContact CB-CE2 4.06Å
114	S	81.9	Confident	88.9	Confident	13 Å²	13	45.8 Å²	45.8	9%	0.091	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.4	-175.1	-64.8	0	0	0	0	110.7	T229 N231	S114-T229 WeakPolarHBondContact CB-O 3.48Å; S114-T229 PolarHBondContact OG-O 2.77Å; S114-N231 PolarHBondContact O-ND2 2.9Å
115	T	82.9	Confident	89.2	Confident	70 Å²	70	45.7 Å²	45.7	43%	0.429	25%	0.245	S	C	.	.			trans	-110	172	163.8	74.4	0	0	0	0	109.2	R117 T118	T115-R117 PolarHBondContact O-N 3.37Å; T115-R117 VanDerWaalsContact O-N 3.14Å; T115-R117 PolarHBondContact OG1-N 3.22Å; T115-T118 PolarHBondContact N-O 2.79Å; T115-T118 VanDerWaalsContact O-O 3.1Å; T115-T118 PolarHBondContact OG1-N 3.32Å; T115-T118 PolarHBondContact OG1-O 2.95Å; T115-T118 PolarHBondContact OG1-OG1 3.02Å
116	D	79.3	Confident	89.3	Confident	131 Å²	131	45.2 Å²	45.2	70%	0.701	25%	0.245	S	C	*	.	S	Bend	trans	-63.8	-18.7	178.6	-63.7	-26.3	0	0	0	113.6	T221 F222	D116-T221 HydrophobicContact CB-CG2 3.97Å; D116-T221 WeakPolarHBondContact O-CA 3.49Å; D116-F222 WeakPolarHBondContact O-CD2 3.41Å; D116-F222 PolarHBondContact O-N 3.18Å
117	R	82.5	Confident	89.4	Confident	138 Å²	138	47.8 Å²	47.8	52%	0.521	26%	0.258	S	S	.	.	S	Bend	trans	-112.1	-24	-177.3	-56.8	-167.3	-173.3	172.4	5.6	114	T115 V210 F222	T115-R117 PolarHBondContact O-N 3.37Å; T115-R117 VanDerWaalsContact O-N 3.14Å; T115-R117 PolarHBondContact OG1-N 3.22Å; R117-V210 PolarHBondContact O-N 3.21Å; R117-F222 VanDerWaalsContact C-CE2 3.46Å; R117-F222 WeakPolarHBondContact O-CE2 3.45Å
118	T	88.9	Confident	89.4	Confident	32 Å²	32	47.5 Å²	47.5	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	132	-173.6	69	0	0	0	0	110.9	T115 E207 L208 R209	T115-T118 PolarHBondContact N-O 2.79Å; T115-T118 VanDerWaalsContact O-O 3.1Å; T115-T118 PolarHBondContact OG1-N 3.32Å; T115-T118 PolarHBondContact OG1-O 2.95Å; T115-T118 PolarHBondContact OG1-OG1 3.02Å; T118-E207 WeakPolarHBondContact CB-OE1 3.45Å; T118-E207 VanDerWaalsContact CG2-OE1 3.25Å; T118-E207 WeakPolarHBondContact CG2-OE1 3.37Å; T118-L208 WeakPolarHBondContact CA-O 3.42Å; T118-R209 HydrophobicContact CG2-CG 4.08Å
119	K	91.4	Very high	89.3	Confident	7 Å²	7	47 Å²	47	3%	0.03	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	107.2	173.3	-68.6	175	176.9	-65.4	0	108	L208 F222 V226 T229 D230	K119-L208 HydrophobicContact CB-CB 4.3Å; K119-L208 PolarHBondContact N-O 3.29Å; K119-L208 PolarHBondContact O-N 3.3Å; K119-F222 HydrophobicContact CD-CD2 4.27Å; K119-F222 HydrophobicContact CD-CE1 4.46Å; K119-F222 HydrophobicContact CD-CE2 4.01Å; K119-F222 HydrophobicContact CD-CZ 4.12Å; K119-F222 HydrophobicContact CG-CD2 4.28Å; K119-F222 HydrophobicContact CG-CE2 3.75Å; K119-F222 HydrophobicContact CG-CZ 4.13Å; K119-V226 HydrophobicContact CD-CB 4.25Å; K119-V226 HydrophobicContact CD-CG2 4.01Å; K119-T229 PolarHBondContact NZ-OG1 3.15Å; K119-D230 IonicContact NZ-OD1 3.43Å; K119-D230 PolarHBondContact NZ-OD1 3.27Å
120	T	92.5	Very high	89.2	Confident	15 Å²	15	52.2 Å²	52.2	9%	0.092	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.5	178.7	-45.5	0	0	0	0	109.7	K112 N113 F122 K205 F206	K112-T120 WeakPolarHBondContact CA-O 3.45Å; N113-T120 PolarHBondContact N-O 2.91Å; N113-T120 WeakPolarHBondContact O-CA 2.95Å; N113-T120 WeakPolarHBondContact O-CB 3.46Å; N113-T120 PolarHBondContact O-N 2.87Å; N113-T120 PolarHBondContact O-OG1 2.85Å; T120-F122 HydrophobicContact CG2-CD2 4.27Å; T120-F122 HydrophobicContact CG2-CE2 3.67Å; T120-F122 HydrophobicContact CG2-CZ 3.95Å; T120-K205 HydrophobicContact CG2-CB 4.05Å; T120-K205 HydrophobicContact CG2-CD 3.94Å; T120-K205 HydrophobicContact CG2-CG 4.38Å; T120-F206 CarbonylContact C-O 3.51Å; T120-F206 WeakPolarHBondContact CA-O 3.38Å
121	M	94.1	Very high	89.2	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	119.6	-176.7	-60.1	169.3	-78.5	0	0	108.9	M109 F123 L143 M145 L160 K205 F206 L208 P247	M109-M121 HydrophobicContact CG-CB 4.07Å; M109-M121 HydrophobicContact SD-CB 3.68Å; M109-M121 HydrophobicContact SD-CG 3.62Å; M121-F123 HydrophobicContact CB-CE2 3.74Å; M121-F123 HydrophobicContact CB-CZ 4.32Å; M121-L143 HydrophobicContact CE-CD2 3.98Å; M121-M145 HydrophobicContact CE-SD 3.79Å; M121-M145 HydrophobicContact SD-CG 4.24Å; M121-M145 HydrophobicContact SD-SD 3.8Å; M121-L160 HydrophobicContact CE-CD1 4.44Å; M121-K205 CarbonylContact O-C 3.49Å; M121-K205 WeakPolarHBondContact O-CA 3.12Å; M121-F206 HydrophobicContact CE-CB 4.08Å; M121-F206 PolarHBondContact N-O 3.29Å; M121-F206 PolarHBondContact O-N 3.48Å; M121-L208 HydrophobicContact CE-CB 4.31Å; M121-P247 HydrophobicContact SD-CB 3.73Å; M121-P247 HydrophobicContact SD-CG 3.97Å
122	F	93.6	Very high	89.1	Confident	37 Å²	37	50 Å²	50	16%	0.162	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	140.2	-179.5	-64	-102.2	0	0	0	110.7	M109 A110 S111 N113 T120 E203 Q204 K205	M109-F122 WeakPolarHBondContact CG-O 3.49Å; A110-F122 PolarHBondContact N-O 2.93Å; S111-F122 PolarHBondContact O-N 2.99Å; S111-F122 VanDerWaalsContact OG-CB 3.27Å; S111-F122 WeakPolarHBondContact OG-CB 3.35Å; S111-F122 VanDerWaalsContact OG-CD2 3.26Å; S111-F122 WeakPolarHBondContact OG-CD2 3.44Å; S111-F122 VanDerWaalsContact OG-CG 3.3Å; S111-F122 WeakPolarHBondContact OG-CG 3.31Å; N113-F122 HydrophobicContact CB-CE2 4.06Å; T120-F122 HydrophobicContact CG2-CD2 4.27Å; T120-F122 HydrophobicContact CG2-CE2 3.67Å; T120-F122 HydrophobicContact CG2-CZ 3.95Å; F122-E203 HydrophobicContact CB-CG 4.3Å; F122-E203 HydrophobicContact CD1-CG 4.16Å; F122-Q204 WeakPolarHBondContact CA-O 3.44Å; F122-K205 HydrophobicContact CD1-CB 3.91Å; F122-K205 HydrophobicContact CD1-CD 4.28Å; F122-K205 HydrophobicContact CE1-CB 4.12Å; F122-K205 HydrophobicContact CE1-CD 3.64Å; F122-K205 HydrophobicContact CE1-CG 4.44Å; F122-K205 HydrophobicContact CG-CB 4.24Å; F122-K205 HydrophobicContact CZ-CD 3.97Å
123	F	94.6	Very high	88.9	Confident	1 Å²	1	47.5 Å²	47.5	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.9	-179.9	-67.1	-86.6	0	0	0	110.5	M109 M121 I125 L143 E203 Q204 F206 I249	M109-F123 HydrophobicContact CB-CE1 4.04Å; M109-F123 HydrophobicContact CB-CZ 4.1Å; M121-F123 HydrophobicContact CB-CE2 3.74Å; M121-F123 HydrophobicContact CB-CZ 4.32Å; F123-I125 HydrophobicContact CB-CD1 4.23Å; F123-I125 PolarHBondContact O-N 3.29Å; F123-L143 HydrophobicContact CE2-CD1 4.08Å; F123-L143 HydrophobicContact CZ-CD1 3.65Å; F123-E203 WeakPolarHBondContact O-CA 3Å; F123-Q204 PolarHBondContact N-O 2.73Å; F123-Q204 PolarHBondContact O-N 3Å; F123-Q204 VanDerWaalsContact O-N 3.11Å; F123-F206 AromaticContact CD2-CD2 3.95Å; F123-F206 HydrophobicContact CD2-CD2 3.95Å; F123-F206 AromaticContact CE2-CD2 3.85Å; F123-F206 HydrophobicContact CE2-CD2 3.85Å; F123-I249 HydrophobicContact CB-CD1 4.24Å; F123-I249 HydrophobicContact CD1-CD1 3.57Å; F123-I249 HydrophobicContact CD1-CG1 3.94Å; F123-I249 HydrophobicContact CD2-CD1 3.91Å; F123-I249 HydrophobicContact CE1-CD1 3.81Å; F123-I249 HydrophobicContact CE1-CG1 3.66Å; F123-I249 HydrophobicContact CE2-CD1 4.13Å; F123-I249 HydrophobicContact CE2-CG1 4.36Å; F123-I249 HydrophobicContact CG-CD1 3.62Å; F123-I249 HydrophobicContact CG-CG1 4.4Å; F123-I249 HydrophobicContact CZ-CD1 4.08Å; F123-I249 HydrophobicContact CZ-CG1 3.89Å
124	N	94.1	Very high	88.7	Confident	69 Å²	69	46.5 Å²	46.5	37%	0.369	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	101.4	174.5	-173.9	-31.2	0	0	0	109.4	A126 E127 I128 D202	N124-A126 VanDerWaalsContact C-N 3.33Å; N124-A126 WeakPolarHBondContact OD1-CA 3.47Å; N124-A126 WeakPolarHBondContact OD1-CB 3.41Å; N124-A126 PolarHBondContact OD1-N 3.21Å; N124-E127 HydrophobicContact CB-CB 4.2Å; N124-E127 PolarHBondContact O-N 2.93Å; N124-E127 PolarHBondContact OD1-N 3.27Å; N124-I128 WeakPolarHBondContact O-CG1 3.33Å; N124-I128 PolarHBondContact O-N 3.06Å; N124-D202 CarbonylContact C-O 3.57Å
125	I	93.4	Very high	88.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-74	-27.5	-179.2	-56.4	-48.8	0	0	0	111.3	F123 E127 I128 R129 L193 W196 D202 Q204	F123-I125 HydrophobicContact CB-CD1 4.23Å; F123-I125 PolarHBondContact O-N 3.29Å; I125-E127 VanDerWaalsContact C-N 3.32Å; I125-E127 PolarHBondContact O-N 3.01Å; I125-I128 HydrophobicContact CD1-CD1 3.95Å; I125-I128 PolarHBondContact O-N 3.26Å; I125-R129 VanDerWaalsContact O-CB 3.3Å; I125-R129 WeakPolarHBondContact O-CB 3.45Å; I125-R129 PolarHBondContact O-N 2.94Å; I125-L193 HydrophobicContact CD1-CD1 4.42Å; I125-W196 HydrophobicContact CD1-CD2 4.48Å; I125-W196 HydrophobicContact CD1-CE3 3.65Å; I125-W196 HydrophobicContact CD1-CZ3 4.15Å; I125-W196 HydrophobicContact CG1-CE3 4.38Å; I125-W196 HydrophobicContact CG2-CB 4.27Å; I125-D202 PolarHBondContact N-O 2.87Å; I125-Q204 HydrophobicContact CD1-CB 3.97Å; I125-Q204 HydrophobicContact CD1-CG 4.31Å; I125-Q204 HydrophobicContact CG1-CB 3.59Å; I125-Q204 HydrophobicContact CG1-CG 3.51Å
126	A	92	Very high	88.7	Confident	22 Å²	22	51.5 Å²	51.5	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-40.9	174.3	0	0	0	0	0	111.6	N124 R129 N130 D202	N124-A126 VanDerWaalsContact C-N 3.33Å; N124-A126 WeakPolarHBondContact OD1-CA 3.47Å; N124-A126 WeakPolarHBondContact OD1-CB 3.41Å; N124-A126 PolarHBondContact OD1-N 3.21Å; A126-R129 PolarHBondContact O-N 3.45Å; A126-N130 WeakPolarHBondContact O-CB 3.47Å; A126-N130 PolarHBondContact O-N 3.43Å; A126-N130 PolarHBondContact O-ND2 2.84Å; A126-D202 HydrophobicContact CB-CB 4.2Å; A126-D202 PolarHBondContact N-O 3.31Å
127	E	93.1	Very high	88.8	Confident	99 Å²	99	46.6 Å²	46.6	46%	0.463	23%	0.232	S	C	.	.	H	α-helix	trans	-62	-44.9	174.3	-173.1	-176.4	170.5	0	0	112	F107 N124 I125 N130 T131	F107-E127 HydrophobicContact CD1-CG 4.23Å; F107-E127 HydrophobicContact CE1-CG 4.23Å; N124-E127 HydrophobicContact CB-CB 4.2Å; N124-E127 PolarHBondContact O-N 2.93Å; N124-E127 PolarHBondContact OD1-N 3.27Å; I125-E127 VanDerWaalsContact C-N 3.32Å; I125-E127 PolarHBondContact O-N 3.01Å; E127-N130 PolarHBondContact O-N 3.28Å; E127-T131 WeakPolarHBondContact O-CB 3.46Å; E127-T131 PolarHBondContact O-N 3.43Å; E127-T131 VanDerWaalsContact O-N 3.11Å; E127-T131 PolarHBondContact O-OG1 3.35Å
128	I	91.6	Very high	89	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-44.1	178.1	-56.4	177.7	0	0	0	110.3	F107 N124 I125 N130 T131 V132 L193 L197 I249	F107-I128 HydrophobicContact CB-CD1 4.28Å; F107-I128 HydrophobicContact CB-CG1 4.17Å; F107-I128 HydrophobicContact CD1-CG1 3.72Å; F107-I128 HydrophobicContact CD2-CD1 4.15Å; F107-I128 HydrophobicContact CD2-CG1 3.75Å; F107-I128 HydrophobicContact CD2-CG2 4.34Å; F107-I128 HydrophobicContact CE1-CB 4.39Å; F107-I128 HydrophobicContact CE1-CG1 3.98Å; F107-I128 HydrophobicContact CE2-CB 4.31Å; F107-I128 HydrophobicContact CE2-CG1 3.98Å; F107-I128 HydrophobicContact CE2-CG2 3.89Å; F107-I128 HydrophobicContact CG-CD1 4.13Å; F107-I128 HydrophobicContact CG-CG1 3.6Å; F107-I128 HydrophobicContact CZ-CB 4.23Å; F107-I128 HydrophobicContact CZ-CG1 4.1Å; F107-I128 HydrophobicContact CZ-CG2 4.13Å; N124-I128 WeakPolarHBondContact O-CG1 3.33Å; N124-I128 PolarHBondContact O-N 3.06Å; I125-I128 HydrophobicContact CD1-CD1 3.95Å; I125-I128 PolarHBondContact O-N 3.26Å; I128-N130 PolarHBondContact O-N 2.96Å; I128-T131 PolarHBondContact O-N 3.29Å; I128-V132 HydrophobicContact CG2-CG2 3.96Å; I128-V132 WeakPolarHBondContact O-CB 3.45Å; I128-V132 PolarHBondContact O-N 2.98Å; I128-L193 HydrophobicContact CD1-CD1 4.13Å; I128-L193 HydrophobicContact CG2-CD1 4.42Å; I128-L193 HydrophobicContact CG2-CD2 4.44Å; I128-L197 HydrophobicContact CG2-CD2 4.07Å; I128-I249 HydrophobicContact CD1-CD1 4.27Å
129	R	90.8	Very high	88.7	Confident	65 Å²	65	38.8 Å²	38.8	25%	0.245	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-40.6	178.6	-168.1	-172.6	-63.3	139.3	12.4	111.7	I125 A126 T131 G133 L197 G199 E201	I125-R129 VanDerWaalsContact O-CB 3.3Å; I125-R129 WeakPolarHBondContact O-CB 3.45Å; I125-R129 PolarHBondContact O-N 2.94Å; A126-R129 PolarHBondContact O-N 3.45Å; R129-T131 VanDerWaalsContact C-N 3.33Å; R129-T131 PolarHBondContact O-N 2.64Å; R129-G133 WeakPolarHBondContact O-CA 3.38Å; R129-G133 PolarHBondContact O-N 3.07Å; R129-L197 HydrophobicContact CB-CD2 3.93Å; R129-L197 HydrophobicContact CG-CD2 4.35Å; R129-G199 VanDerWaalsContact CZ-O 3.26Å; R129-G199 PolarHBondContact NH2-O 2.58Å; R129-E201 PolarHBondContact NH2-O 2.93Å
130	N	89.1	Confident	88.5	Confident	125 Å²	125	40.2 Å²	40.2	67%	0.668	21%	0.208	S	C	*	.	H	α-helix	trans	-64.4	-40.5	176.8	-73.5	-25	0	0	0	111.8	A126 E127 I128	A126-N130 WeakPolarHBondContact O-CB 3.47Å; A126-N130 PolarHBondContact O-N 3.43Å; A126-N130 PolarHBondContact O-ND2 2.84Å; E127-N130 PolarHBondContact O-N 3.28Å; I128-N130 PolarHBondContact O-N 2.96Å
131	T	87.6	Confident	88.5	Confident	65 Å²	65	39.5 Å²	39.5	40%	0.399	20%	0.204	S	C	.	.	H	α-helix	trans	-79.3	-54	-175.4	-51.7	0	0	0	0	112.5	N105 F107 E127 I128 R129	N105-T131 HydrophobicContact CB-CG2 4.14Å; N105-T131 VanDerWaalsContact CG-CG2 3.47Å; F107-T131 HydrophobicContact CE1-CG2 4.31Å; F107-T131 HydrophobicContact CZ-CG2 3.94Å; E127-T131 WeakPolarHBondContact O-CB 3.46Å; E127-T131 PolarHBondContact O-N 3.43Å; E127-T131 VanDerWaalsContact O-N 3.11Å; E127-T131 PolarHBondContact O-OG1 3.35Å; I128-T131 PolarHBondContact O-N 3.29Å; R129-T131 VanDerWaalsContact C-N 3.33Å; R129-T131 PolarHBondContact O-N 2.64Å
132	V	85.3	Confident	88.5	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-76.2	-39.2	-178.6	177.4	0	0	0	0	111.1	F107 I128 L138 L197 T251	F107-V132 HydrophobicContact CE2-CG2 4.33Å; F107-V132 HydrophobicContact CZ-CG2 4.34Å; I128-V132 HydrophobicContact CG2-CG2 3.96Å; I128-V132 WeakPolarHBondContact O-CB 3.45Å; I128-V132 PolarHBondContact O-N 2.98Å; V132-L138 HydrophobicContact CG1-CB 4.2Å; V132-L138 HydrophobicContact CG1-CD1 4.31Å; V132-L197 HydrophobicContact CG1-CD1 4.34Å; V132-T251 HydrophobicContact CG2-CG2 4.47Å
133	G	82.8	Confident	88.6	Confident	11 Å²	11	39.1 Å²	39.1	11%	0.113	20%	0.203	C	C	.	.			trans	88.6	-124	-176.8	0	0	0	0	0	114.1	R129	R129-G133 WeakPolarHBondContact O-CA 3.38Å; R129-G133 PolarHBondContact O-N 3.07Å
134	N	81.1	Confident	88.6	Confident	73 Å²	73	39.1 Å²	39.1	39%	0.39	20%	0.203	S	C	.	.	S	Bend	trans	-72.8	138.6	-178.3	-170.6	-13.9	0	0	0	109.7	Q136 L137	N134-Q136 PolarHBondContact O-N 3.4Å; N134-Q136 VanDerWaalsContact O-N 3.14Å; N134-Q136 PolarHBondContact OD1-N 2.96Å; N134-L137 HydrophobicContact CB-CD1 4.3Å; N134-L137 HydrophobicContact CB-CG 4.32Å; N134-L137 WeakPolarHBondContact O-CB 3.29Å; N134-L137 PolarHBondContact O-N 3.45Å
135	F	82.6	Confident	88.5	Confident	59 Å²	59	35.9 Å²	35.9	26%	0.259	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-55	-29.8	177	69.2	-89.4	0	0	0	112.9	L137 L138 L197 Q198	F135-L137 PolarHBondContact O-N 3.04Å; F135-L138 WeakPolarHBondContact O-CB 3.47Å; F135-L138 PolarHBondContact O-N 2.86Å; F135-L197 HydrophobicContact CB-CB 3.76Å; F135-L197 HydrophobicContact CB-CD1 4.35Å; F135-Q198 HydrophobicContact CB-CG 4.25Å; F135-Q198 HydrophobicContact CD1-CG 3.46Å; F135-Q198 VanDerWaalsContact CD1-CG 3.46Å; F135-Q198 HydrophobicContact CD2-CG 4.15Å; F135-Q198 VanDerWaalsContact CD2-NE2 3.34Å; F135-Q198 HydrophobicContact CE1-CG 3.75Å; F135-Q198 HydrophobicContact CE2-CG 4.39Å; F135-Q198 HydrophobicContact CG-CG 3.68Å; F135-Q198 HydrophobicContact CZ-CG 4.2Å
136	Q	81.9	Confident	88.4	Confident	129 Å²	129	36.5 Å²	36.5	60%	0.603	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-67	-19.7	177.2	-65.6	179.7	-15.8	0	0	113.9	N134 L138	N134-Q136 PolarHBondContact O-N 3.4Å; N134-Q136 VanDerWaalsContact O-N 3.14Å; N134-Q136 PolarHBondContact OD1-N 2.96Å; Q136-L138 VanDerWaalsContact C-N 3.33Å
137	L	82.4	Confident	88.4	Confident	27 Å²	27	35.5 Å²	35.5	14%	0.141	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-84.6	-13.3	178.5	-61.8	174.5	0	0	0	112.2	N134 F135 T139 S253 I254 K256	N134-L137 HydrophobicContact CB-CD1 4.3Å; N134-L137 HydrophobicContact CB-CG 4.32Å; N134-L137 WeakPolarHBondContact O-CB 3.29Å; N134-L137 PolarHBondContact O-N 3.45Å; F135-L137 PolarHBondContact O-N 3.04Å; L137-T139 PolarHBondContact O-N 2.85Å; L137-S253 CarbonylContact O-C 3.56Å; L137-S253 WeakPolarHBondContact O-CA 3.26Å; L137-S253 VanDerWaalsContact O-CB 3.29Å; L137-S253 WeakPolarHBondContact O-CB 3.2Å; L137-I254 HydrophobicContact CD2-CB 4.27Å; L137-I254 PolarHBondContact O-N 2.94Å; L137-K256 HydrophobicContact CD1-CB 4.41Å; L137-K256 HydrophobicContact CD1-CG 3.62Å
138	L	86.1	Confident	88.3	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	110.1	179.3	-177.3	64.5	0	0	0	109.5	V132 F135 Q136 A141 L193 Q194 L197 T251	V132-L138 HydrophobicContact CG1-CB 4.2Å; V132-L138 HydrophobicContact CG1-CD1 4.31Å; F135-L138 WeakPolarHBondContact O-CB 3.47Å; F135-L138 PolarHBondContact O-N 2.86Å; Q136-L138 VanDerWaalsContact C-N 3.33Å; L138-A141 HydrophobicContact CD1-CB 4.27Å; L138-A141 HydrophobicContact CD2-CB 4.29Å; L138-L193 HydrophobicContact CD1-CD2 4.49Å; L138-L193 HydrophobicContact CD2-CB 3.96Å; L138-L193 HydrophobicContact CD2-CD2 3.76Å; L138-L193 HydrophobicContact CD2-CG 3.84Å; L138-Q194 HydrophobicContact CB-CG 4.42Å; L138-Q194 HydrophobicContact CD2-CG 3.9Å; L138-Q194 PolarHBondContact O-NE2 3.16Å; L138-Q194 VanDerWaalsContact O-NE2 3.16Å; L138-L197 HydrophobicContact CB-CD1 4.48Å; L138-L197 HydrophobicContact CD2-CD1 3.93Å; L138-T251 HydrophobicContact CD1-CG2 4.09Å
139	T	83.6	Confident	88.1	Confident	6 Å²	6	40.9 Å²	40.9	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-44.3	179.8	70.6	0	0	0	0	111.5	E97 K102 L137 M252 I254	E97-T139 HydrophobicContact CB-CG2 4.37Å; E97-T139 WeakPolarHBondContact OE2-CB 3.44Å; E97-T139 VanDerWaalsContact OE2-CG2 3.3Å; E97-T139 WeakPolarHBondContact OE2-CG2 3.42Å; K102-T139 HydrophobicContact CD-CG2 4.4Å; K102-T139 WeakPolarHBondContact CD-OG1 3.3Å; K102-T139 WeakPolarHBondContact CE-OG1 3.31Å; K102-T139 PolarHBondContact NZ-OG1 3.27Å; L137-T139 PolarHBondContact O-N 2.85Å; T139-M252 PolarHBondContact N-O 3.46Å; T139-M252 PolarHBondContact OG1-O 3.45Å; T139-I254 HydrophobicContact CG2-CD1 3.99Å; T139-I254 HydrophobicContact CG2-CG1 3.75Å
140	T	87.1	Confident	88.1	Confident	36 Å²	36	38.7 Å²	38.7	22%	0.221	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	146.1	-179.3	57.9	0	0	0	0	110.1	T190 M252	T140-T190 WeakPolarHBondContact CA-OG1 3.4Å; T140-M252 PolarHBondContact N-O 2.94Å; T140-M252 PolarHBondContact O-N 2.74Å; T140-M252 WeakPolarHBondContact OG1-CB 3.48Å; T140-M252 WeakPolarHBondContact OG1-CG 3.44Å; T140-M252 PolarHBondContact OG1-SD 3.39Å
141	A	92.6	Very high	88.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	131.8	171.8	0	0	0	0	0	110.4	L138 I189 T190 L193 L250 T251	L138-A141 HydrophobicContact CD1-CB 4.27Å; L138-A141 HydrophobicContact CD2-CB 4.29Å; A141-I189 HydrophobicContact CB-CG1 4.02Å; A141-I189 WeakPolarHBondContact O-CG1 3.44Å; A141-I189 PolarHBondContact O-N 2.89Å; A141-T190 PolarHBondContact N-OG1 2.84Å; A141-T190 PolarHBondContact O-N 3.31Å; A141-L193 HydrophobicContact CB-CB 4.3Å; A141-L193 HydrophobicContact CB-CD2 3.52Å; A141-L250 CarbonylContact C-O 3.56Å; A141-L250 VanDerWaalsContact CA-O 3.32Å; A141-L250 WeakPolarHBondContact CA-O 3.49Å; A141-T251 HydrophobicContact CB-CG2 4.29Å
142	E	93.8	Very high	88.2	Confident	31 Å²	31	34.6 Å²	34.6	15%	0.145	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	128.5	179	-67.5	-176.2	-178.4	0	0	110.7	Q82 R144 F187 I249 L250	Q82-E142 PolarHBondContact NE2-OE1 2.88Å; E142-R144 HydrophobicContact CB-CG 4.27Å; E142-F187 CarbonylContact C-O 3.5Å; E142-F187 VanDerWaalsContact CA-O 3.28Å; E142-F187 WeakPolarHBondContact CA-O 3.41Å; E142-I249 WeakPolarHBondContact O-CA 3.2Å; E142-L250 PolarHBondContact N-O 3.28Å; E142-L250 PolarHBondContact O-N 3.5Å
143	L	95.4	Very high	88.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	121.7	168.3	176.6	63.8	0	0	0	108.6	M121 F123 M145 L160 S186 F187 I189 F206 I249	M121-L143 HydrophobicContact CE-CD2 3.98Å; F123-L143 HydrophobicContact CE2-CD1 4.08Å; F123-L143 HydrophobicContact CZ-CD1 3.65Å; L143-M145 HydrophobicContact CD2-CE 4.42Å; L143-L160 HydrophobicContact CD2-CD1 3.88Å; L143-L160 HydrophobicContact CD2-CD2 4.01Å; L143-S186 VanDerWaalsContact O-CA 3.31Å; L143-S186 WeakPolarHBondContact O-CA 3.39Å; L143-F187 PolarHBondContact N-O 3.27Å; L143-F187 PolarHBondContact O-N 3.08Å; L143-I189 HydrophobicContact CB-CD1 3.96Å; L143-I189 HydrophobicContact CB-CG1 4.22Å; L143-I189 HydrophobicContact CB-CG2 3.96Å; L143-F206 HydrophobicContact CD2-CB 4.14Å; L143-F206 HydrophobicContact CD2-CD2 4.08Å; L143-F206 HydrophobicContact CD2-CG 4.02Å; L143-I249 HydrophobicContact CD1-CG1 3.96Å
144	R	93.4	Very high	88.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.3	-176	-56.6	-172.4	84.5	-164.2	10.4	111.4	N74 M78 E81 E142 W184 L185 P247 Y248	N74-R144 PolarHBondContact O-NH1 2.72Å; M78-R144 VanDerWaalsContact CA-NH2 3.34Å; E81-R144 IonicContact OE1-NH2 2.67Å; E81-R144 IonicContact OE2-CZ 3.33Å; E81-R144 IonicContact OE2-NH2 2.78Å; E81-R144 PolarHBondContact OE2-NH2 2.81Å; E142-R144 HydrophobicContact CB-CG 4.27Å; R144-W184 HydrophobicContact CB-CE3 3.84Å; R144-W184 HydrophobicContact CB-CZ3 4.33Å; R144-L185 WeakPolarHBondContact CA-O 3.45Å; R144-P247 WeakPolarHBondContact O-CA 2.99Å; R144-Y248 HydrophobicContact CB-CE2 4.04Å; R144-Y248 HydrophobicContact CG-CE2 4.35Å; R144-Y248 PolarHBondContact N-O 3.27Å; R144-Y248 PolarHBondContact NH1-OH 3.3Å; R144-Y248 PolarHBondContact O-N 2.8Å; R144-Y248 VanDerWaalsContact O-N 3.16Å
145	M	93.3	Very high	88.9	Confident	1 Å²	1	53 Å²	53	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	130.2	-176.4	-70.3	173.6	-74.8	0	0	110.3	M121 L143 W184 L185 F187 L208 V226 P247	M121-M145 HydrophobicContact CE-SD 3.79Å; M121-M145 HydrophobicContact SD-CG 4.24Å; M121-M145 HydrophobicContact SD-SD 3.8Å; L143-M145 HydrophobicContact CD2-CE 4.42Å; M145-W184 VanDerWaalsContact C-CE3 3.48Å; M145-W184 CarbonylContact O-C 3.6Å; M145-W184 WeakPolarHBondContact O-CA 3.19Å; M145-L185 HydrophobicContact CE-CD2 4.11Å; M145-L185 HydrophobicContact CE-CG 4.38Å; M145-L185 PolarHBondContact N-O 3.32Å; M145-L185 PolarHBondContact O-N 2.88Å; M145-F187 HydrophobicContact CE-CD2 3.63Å; M145-F187 HydrophobicContact CE-CE2 3.5Å; M145-L208 HydrophobicContact CE-CD1 4.38Å; M145-L208 HydrophobicContact CE-CD2 4.43Å; M145-L208 HydrophobicContact SD-CD2 4.08Å; M145-V226 HydrophobicContact CB-CG1 3.81Å; M145-V226 HydrophobicContact CG-CG1 4.14Å; M145-P247 HydrophobicContact CG-CB 3.99Å; M145-P247 HydrophobicContact CG-CG 4.3Å
146	L	91.8	Very high	89.2	Confident	14 Å²	14	51.2 Å²	51.2	7%	0.073	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120.5	179.4	-177.2	65	0	0	0	110.6	W184 S227 Q245	L146-W184 HydrophobicContact CB-CD2 4.44Å; L146-W184 HydrophobicContact CB-CE3 4.04Å; L146-W184 HydrophobicContact CB-CH2 3.96Å; L146-W184 HydrophobicContact CB-CZ2 4.4Å; L146-W184 HydrophobicContact CB-CZ3 3.79Å; L146-W184 HydrophobicContact CD1-CD2 4.34Å; L146-W184 HydrophobicContact CD1-CZ2 4.49Å; L146-S227 PolarHBondContact O-N 2.94Å; L146-Q245 HydrophobicContact CD2-CB 4.07Å; L146-Q245 HydrophobicContact CD2-CG 4.34Å
147	I	91.6	Very high	89.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.9	-179.4	-53.9	-58.7	0	0	0	110.5	P150 V176 L180 E182 K183 L185 F224 V226	I147-P150 HydrophobicContact CG2-CB 4.39Å; I147-P150 HydrophobicContact CG2-CG 4.48Å; I147-V176 HydrophobicContact CG2-CG1 4.4Å; I147-L180 HydrophobicContact CB-CB 4.5Å; I147-L180 WeakPolarHBondContact CB-O 3.28Å; I147-L180 HydrophobicContact CG1-CB 4.46Å; I147-E182 WeakPolarHBondContact O-CA 3.37Å; I147-E182 PolarHBondContact O-N 3.43Å; I147-K183 PolarHBondContact N-O 3.07Å; I147-L185 HydrophobicContact CD1-CB 3.85Å; I147-L185 HydrophobicContact CD1-CD2 4.03Å; I147-L185 HydrophobicContact CG1-CB 3.91Å; I147-F224 HydrophobicContact CD1-CD2 3.85Å; I147-F224 HydrophobicContact CD1-CE2 3.6Å; I147-F224 HydrophobicContact CD1-CZ 4.45Å; I147-F224 HydrophobicContact CG2-CB 4.21Å; I147-F224 HydrophobicContact CG2-CD2 3.97Å; I147-F224 HydrophobicContact CG2-CG 4.27Å; I147-V226 HydrophobicContact CD1-CG2 4.18Å
148	K	90.1	Very high	90.2	Very high	59 Å²	59	47.3 Å²	47.3	26%	0.257	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	138.9	-178.5	-66.7	-64.3	-162.2	175.4	0	110.3	E182 F225	K148-E182 WeakPolarHBondContact CD-OE1 3.36Å; K148-E182 WeakPolarHBondContact CE-OE2 3.45Å; K148-E182 IonicContact NZ-OE1 2.64Å; K148-E182 PolarHBondContact NZ-OE1 2.93Å; K148-E182 IonicContact NZ-OE2 3.48Å; K148-E182 PolarHBondContact NZ-OE2 2.8Å; K148-F225 HydrophobicContact CB-CB 3.99Å; K148-F225 PolarHBondContact N-O 3.44Å; K148-F225 WeakPolarHBondContact O-CB 3.2Å; K148-F225 PolarHBondContact O-N 2.98Å
149	K	87.9	Confident	90.7	Very high	154 Å²	154	48.2 Å²	48.2	67%	0.67	24%	0.237	S	C	*	.	S	Bend	trans	43.7	55.5	172.1	-56.5	174.5	-179.7	177.7	0	114.1	F225	K149-F225 HydrophobicContact CB-CD2 3.93Å; K149-F225 HydrophobicContact CB-CE2 4.48Å; K149-F225 HydrophobicContact CD-CD2 4.39Å
150	P	90.8	Very high	91.3	Very high	18 Å²	18	47.9 Å²	47.9	12%	0.117	24%	0.235	C	C	.	.			trans	-67.1	135.8	173.8	31.2	-34.8	0	0	0	110.5	I147 I152 N178 K181 F224	I147-P150 HydrophobicContact CG2-CB 4.39Å; I147-P150 HydrophobicContact CG2-CG 4.48Å; P150-I152 HydrophobicContact CB-CD1 4.16Å; P150-I152 HydrophobicContact CB-CG1 4.46Å; P150-N178 PolarHBondContact O-OD1 2.67Å; P150-K181 HydrophobicContact CG-CB 3.7Å; P150-K181 HydrophobicContact CG-CG 4.36Å; P150-F224 HydrophobicContact CB-CB 3.92Å
151	S	90.9	Very high	91.7	Very high	96 Å²	96	48.1 Å²	48.1	67%	0.671	23%	0.232	S	C	*	.			trans	-131.5	64.8	176.8	-176.5	0	0	0	0	108.9	S223	S151-S223 PolarHBondContact N-O 2.97Å
152	I	89	Confident	91.8	Very high	9 Å²	9	48.3 Å²	48.3	5%	0.046	23%	0.233	C	C	.	.			trans	-109.5	134.8	-172.3	-56.8	166.2	0	0	0	109.2	P150 Q156 V176 N178 F224	P150-I152 HydrophobicContact CB-CD1 4.16Å; P150-I152 HydrophobicContact CB-CG1 4.46Å; I152-Q156 HydrophobicContact CD1-CB 4.05Å; I152-Q156 HydrophobicContact CG1-CB 4.32Å; I152-Q156 HydrophobicContact CG2-CB 4.07Å; I152-V176 HydrophobicContact CD1-CB 4.18Å; I152-V176 HydrophobicContact CD1-CG1 3.81Å; I152-V176 WeakPolarHBondContact CD1-O 3.45Å; I152-N178 PolarHBondContact N-OD1 2.87Å; I152-N178 PolarHBondContact O-ND2 3.01Å; I152-F224 HydrophobicContact CD1-CD1 4.07Å
153	D	85.3	Confident	91.7	Very high	172 Å²	172	47 Å²	47	92%	0.92	23%	0.227	S	C	*	.	S	Bend	trans	-69.5	-48.3	-178.7	-66.8	-33.8	0	0	0	112.9
154	K	86.4	Confident	91.4	Very high	183 Å²	183	49.3 Å²	49.3	80%	0.796	24%	0.241	S	C	*	.	S	Bend	trans	-126.3	-73.4	176.9	-68.9	-176.8	179.7	178.2	0	111.1
155	E	90.7	Very high	90.9	Very high	118 Å²	118	51.4 Å²	51.4	55%	0.551	26%	0.264	S	S	*	.			trans	-150.3	151	177	62	-174.5	-177.5	0	0	109.6	F175 V176 T177	E155-F175 HydrophobicContact CB-CD1 4.4Å; E155-F175 HydrophobicContact CG-CD1 4Å; E155-V176 CarbonylContact C-O 3.59Å; E155-V176 WeakPolarHBondContact CA-O 3.45Å; E155-T177 HydrophobicContact CB-CG2 4.02Å
156	Q	89.9	Confident	90.3	Very high	21 Å²	21	56.8 Å²	56.8	10%	0.098	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.5	174.2	-175.5	168.8	44.9	0	0	108.8	I152 V176 V210 T221 F224	I152-Q156 HydrophobicContact CD1-CB 4.05Å; I152-Q156 HydrophobicContact CG1-CB 4.32Å; I152-Q156 HydrophobicContact CG2-CB 4.07Å; Q156-V176 PolarHBondContact N-O 3.23Å; Q156-V176 PolarHBondContact O-N 2.97Å; Q156-V210 HydrophobicContact CG-CG1 4.37Å; Q156-T221 PolarHBondContact NE2-O 3.24Å; Q156-F224 VanDerWaalsContact OE1-CD1 3.22Å; Q156-F224 VanDerWaalsContact OE1-CE1 3.31Å
157	R	92.2	Very high	90.2	Very high	75 Å²	75	59.6 Å²	59.6	28%	0.283	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	130.8	175.8	-178.7	177.4	160.1	172.6	-5.8	110.3	E159 R174 F175 F211	R157-E159 IonicContact CZ-OE1 3.78Å; R157-E159 IonicContact NE-OE1 2.94Å; R157-E159 PolarHBondContact NE-OE1 3.48Å; R157-E159 IonicContact NH2-OE1 2.67Å; R157-E159 PolarHBondContact NH2-OE1 2.8Å; R157-R174 WeakPolarHBondContact CA-O 3.39Å; R157-F175 HydrophobicContact CB-CD1 3.89Å; R157-F175 HydrophobicContact CB-CE1 3.77Å; R157-F175 HydrophobicContact CB-CZ 4.49Å; R157-F175 HydrophobicContact CG-CD1 4.46Å; R157-F175 HydrophobicContact CG-CE1 4.17Å; R157-F175 HydrophobicContact CG-CZ 4.42Å; R157-F211 HydrophobicContact CB-CB 3.89Å; R157-F211 HydrophobicContact CB-CD1 4.48Å; R157-F211 HydrophobicContact CB-CG 4.41Å; R157-F211 HydrophobicContact CG-CB 3.83Å; R157-F211 HydrophobicContact CG-CG 4.24Å; R157-F211 WeakPolarHBondContact O-CB 3.2Å; R157-F211 PolarHBondContact O-N 2.83Å
158	V	93.5	Very high	90.2	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.3	174.2	-61.8	0	0	0	0	110.5	S173 R174 V176 L185 F187 L208 R209 F222 F224	V158-S173 CarbonylContact O-C 3.49Å; V158-S173 WeakPolarHBondContact O-CA 3.43Å; V158-R174 HydrophobicContact CG2-CB 4.47Å; V158-R174 PolarHBondContact N-O 2.99Å; V158-R174 PolarHBondContact O-N 2.82Å; V158-V176 HydrophobicContact CG1-CG2 4.4Å; V158-V176 HydrophobicContact CG2-CG2 3.88Å; V158-L185 HydrophobicContact CG2-CD2 4.13Å; V158-F187 HydrophobicContact CG2-CZ 4.3Å; V158-L208 HydrophobicContact CB-CD1 4.02Å; V158-L208 HydrophobicContact CB-CG 4.44Å; V158-L208 HydrophobicContact CG2-CD1 4.04Å; V158-R209 WeakPolarHBondContact CA-O 3.28Å; V158-F222 HydrophobicContact CG1-CE1 4.09Å; V158-F224 HydrophobicContact CG1-CE1 3.91Å; V158-F224 HydrophobicContact CG1-CZ 3.85Å
159	E	95.2	Very high	90.4	Very high	19 Å²	19	66.4 Å²	66.4	9%	0.089	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.4	-176	-61.2	-168.3	154.6	0	0	110.3	R157 Y161 Y170 L208 R209 F211	R157-E159 IonicContact CZ-OE1 3.78Å; R157-E159 IonicContact NE-OE1 2.94Å; R157-E159 PolarHBondContact NE-OE1 3.48Å; R157-E159 IonicContact NH2-OE1 2.67Å; R157-E159 PolarHBondContact NH2-OE1 2.8Å; E159-Y161 HydrophobicContact CB-CD2 4.3Å; E159-Y161 HydrophobicContact CB-CE2 3.58Å; E159-Y161 PolarHBondContact OE2-OH 3.26Å; E159-Y170 HydrophobicContact CB-CD2 4.47Å; E159-Y170 HydrophobicContact CB-CE2 4.2Å; E159-Y170 HydrophobicContact CG-CE2 4.19Å; E159-L208 WeakPolarHBondContact O-CA 3.04Å; E159-R209 PolarHBondContact N-O 2.98Å; E159-R209 PolarHBondContact O-N 2.87Å; E159-F211 HydrophobicContact CG-CB 4.35Å; E159-F211 VanDerWaalsContact OE1-CD2 3.28Å; E159-F211 WeakPolarHBondContact OE1-CD2 3.39Å
160	L	96.3	Very high	90.7	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130	176.4	-171.6	69.1	0	0	0	109.8	M121 L143 H171 A172 F187 I189 F206 L208	M121-L160 HydrophobicContact CE-CD1 4.44Å; L143-L160 HydrophobicContact CD2-CD1 3.88Å; L143-L160 HydrophobicContact CD2-CD2 4.01Å; L160-H171 WeakPolarHBondContact O-CB 3.4Å; L160-H171 PolarHBondContact O-N 3.25Å; L160-A172 PolarHBondContact N-O 3.2Å; L160-F187 HydrophobicContact CB-CD1 3.97Å; L160-F187 HydrophobicContact CB-CE1 3.9Å; L160-F187 HydrophobicContact CB-CG 4.36Å; L160-F187 HydrophobicContact CB-CZ 4.25Å; L160-F187 HydrophobicContact CD2-CB 3.63Å; L160-F187 HydrophobicContact CD2-CD1 3.97Å; L160-F187 HydrophobicContact CD2-CD2 4.14Å; L160-F187 HydrophobicContact CD2-CG 3.66Å; L160-I189 HydrophobicContact CD2-CG2 3.85Å; L160-F206 HydrophobicContact CD1-CB 4.1Å; L160-F206 HydrophobicContact CD1-CD1 4.28Å; L160-F206 HydrophobicContact CD2-CD1 4.22Å; L160-F206 HydrophobicContact CG-CD1 4.24Å; L160-L208 HydrophobicContact CD1-CD1 4.43Å
161	Y	95.4	Very high	90.9	Very high	41 Å²	41	65 Å²	65	16%	0.161	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	152	173.3	-66.1	-103.5	0	0	0	109.9	E159 F168 R169 Y170 F206 E207 R209	E159-Y161 HydrophobicContact CB-CD2 4.3Å; E159-Y161 HydrophobicContact CB-CE2 3.58Å; E159-Y161 PolarHBondContact OE2-OH 3.26Å; Y161-F168 HydrophobicContact CD1-CB 4.39Å; Y161-R169 CarbonylContact C-O 3.58Å; Y161-R169 WeakPolarHBondContact CA-O 3.37Å; Y161-Y170 HydrophobicContact CE1-CD2 4.23Å; Y161-Y170 HydrophobicContact CE1-CG 4.46Å; Y161-Y170 HydrophobicContact CE2-CD2 4.31Å; Y161-Y170 AromaticContact CZ-CD2 3.89Å; Y161-F206 CarbonylContact O-C 3.55Å; Y161-F206 WeakPolarHBondContact O-CA 3.27Å; Y161-E207 PolarHBondContact N-O 3.39Å; Y161-E207 PolarHBondContact O-N 3.12Å; Y161-R209 HydrophobicContact CD2-CB 4.43Å; Y161-R209 HydrophobicContact CD2-CG 3.99Å; Y161-R209 HydrophobicContact CE2-CB 4.26Å; Y161-R209 HydrophobicContact CE2-CG 4.19Å
162	Y	94.9	Very high	91.1	Very high	3 Å²	3	61.8 Å²	61.8	1%	0.012	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.5	175.3	66.7	-84.8	0	0	0	111.1	T164 F168 R169 H171 P192 W196	Y162-T164 WeakPolarHBondContact CE2-OG1 3.3Å; Y162-F168 WeakPolarHBondContact O-CA 3.44Å; Y162-R169 HydrophobicContact CD1-CB 4.32Å; Y162-R169 WeakPolarHBondContact CD1-O 3.48Å; Y162-R169 HydrophobicContact CE1-CB 3.89Å; Y162-R169 HydrophobicContact CE1-CG 3.92Å; Y162-R169 HydrophobicContact CE2-CB 4.2Å; Y162-R169 PolarHBondContact N-O 3.45Å; Y162-R169 PolarHBondContact O-N 3.12Å; Y162-R169 VanDerWaalsContact OH-CD 3.25Å; Y162-R169 WeakPolarHBondContact OH-CD 3.34Å; Y162-H171 HydrophobicContact CD1-CB 3.92Å; Y162-H171 HydrophobicContact CE1-CB 4.15Å; Y162-P192 HydrophobicContact CD1-CB 4.24Å; Y162-P192 HydrophobicContact CD1-CG 3.98Å; Y162-P192 HydrophobicContact CD2-CB 4.09Å; Y162-P192 HydrophobicContact CE1-CB 4.49Å; Y162-P192 HydrophobicContact CE1-CG 4Å; Y162-P192 HydrophobicContact CE2-CB 4.38Å; Y162-P192 HydrophobicContact CG-CB 4.01Å; Y162-P192 HydrophobicContact CG-CG 4.26Å; Y162-W196 HydrophobicContact CD2-CZ2 4.44Å
163	S	92.6	Very high	91.3	Very high	3 Å²	3	63 Å²	63	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	134.2	177.1	47.2	0	0	0	0	112.1	W196 Q204 K205	S163-W196 PolarHBondContact O-NE1 3.15Å; S163-Q204 PolarHBondContact OG-OE1 2.84Å; S163-K205 PolarHBondContact N-O 2.79Å; S163-K205 PolarHBondContact OG-N 3.32Å; S163-K205 PolarHBondContact OG-O 2.64Å; S163-K205 VanDerWaalsContact OG-O 3.12Å
164	T	88.8	Confident	91.7	Very high	49 Å²	49	60.5 Å²	60.5	30%	0.301	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	88	168.7	-57.3	0	0	0	0	107.4	Y162 A166 S167	Y162-T164 WeakPolarHBondContact CE2-OG1 3.3Å; T164-A166 PolarHBondContact O-N 3.48Å; T164-S167 PolarHBondContact N-O 2.94Å; T164-S167 PolarHBondContact O-N 3.09Å; T164-S167 PolarHBondContact O-OG 3.41Å
165	G	82.3	Confident	91.9	Very high	45 Å²	45	56.9 Å²	56.9	46%	0.464	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	-122	-169.1	0	0	0	0	0	111.4
166	A	81.6	Confident	92	Very high	113 Å²	113	51.2 Å²	51.2	93%	0.934	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-10.8	-178.7	0	0	0	0	0	114.6	T164	T164-A166 PolarHBondContact O-N 3.48Å
167	S	89.4	Confident	92.2	Very high	74 Å²	74	52.6 Å²	52.6	52%	0.517	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	169.4	-176.6	69.9	0	0	0	0	112.4	T164	T164-S167 PolarHBondContact N-O 2.94Å; T164-S167 PolarHBondContact O-N 3.09Å; T164-S167 PolarHBondContact O-OG 3.41Å
168	F	90.9	Very high	92.1	Very high	66 Å²	66	52.6 Å²	52.6	29%	0.289	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.2	176.6	-72.3	-84.6	0	0	0	110.2	Y161 Y162 K205 E207	Y161-F168 HydrophobicContact CD1-CB 4.39Å; Y162-F168 WeakPolarHBondContact O-CA 3.44Å; F168-K205 HydrophobicContact CE1-CD 4.28Å; F168-K205 HydrophobicContact CE1-CG 4.11Å; F168-K205 HydrophobicContact CZ-CD 4.08Å; F168-K205 VanDerWaalsContact CZ-CE 3.47Å; F168-K205 HydrophobicContact CZ-CG 4.42Å; F168-E207 HydrophobicContact CD1-CB 4.15Å; F168-E207 HydrophobicContact CE1-CB 3.83Å; F168-E207 WeakPolarHBondContact CE1-OE2 3.32Å; F168-E207 WeakPolarHBondContact CE2-OE2 3.28Å; F168-E207 HydrophobicContact CZ-CB 4.49Å; F168-E207 VanDerWaalsContact CZ-OE2 3.25Å; F168-E207 WeakPolarHBondContact CZ-OE2 3.45Å
169	R	94.5	Very high	91.9	Very high	136 Å²	136	55.8 Å²	55.8	51%	0.513	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.9	175.5	-175.8	160.7	175.2	-167.9	2.5	110.2	Y161 Y162	Y161-R169 CarbonylContact C-O 3.58Å; Y161-R169 WeakPolarHBondContact CA-O 3.37Å; Y162-R169 HydrophobicContact CD1-CB 4.32Å; Y162-R169 WeakPolarHBondContact CD1-O 3.48Å; Y162-R169 HydrophobicContact CE1-CB 3.89Å; Y162-R169 HydrophobicContact CE1-CG 3.92Å; Y162-R169 HydrophobicContact CE2-CB 4.2Å; Y162-R169 PolarHBondContact N-O 3.45Å; Y162-R169 PolarHBondContact O-N 3.12Å; Y162-R169 VanDerWaalsContact OH-CD 3.25Å; Y162-R169 WeakPolarHBondContact OH-CD 3.34Å
170	Y	94.6	Very high	91.6	Very high	100 Å²	100	56.6 Å²	56.6	39%	0.392	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	137.9	173.4	171	-94	0	0	0	109.9	E159 Y161 S173	E159-Y170 HydrophobicContact CB-CD2 4.47Å; E159-Y170 HydrophobicContact CB-CE2 4.2Å; E159-Y170 HydrophobicContact CG-CE2 4.19Å; Y161-Y170 HydrophobicContact CE1-CD2 4.23Å; Y161-Y170 HydrophobicContact CE1-CG 4.46Å; Y161-Y170 HydrophobicContact CE2-CD2 4.31Å; Y161-Y170 AromaticContact CZ-CD2 3.89Å; Y170-S173 WeakPolarHBondContact OH-CB 3.48Å; Y170-S173 PolarHBondContact OH-N 3.01Å; Y170-S173 VanDerWaalsContact OH-N 3.13Å; Y170-S173 PolarHBondContact OH-OG 3.36Å
171	H	94.5	Very high	91.4	Very high	43 Å²	43	62.7 Å²	62.7	20%	0.199	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-65.5	176.9	-169.8	56.2	0	0	0	112.1	L160 Y162 D188 P192	L160-H171 WeakPolarHBondContact O-CB 3.4Å; L160-H171 PolarHBondContact O-N 3.25Å; Y162-H171 HydrophobicContact CD1-CB 3.92Å; Y162-H171 HydrophobicContact CE1-CB 4.15Å; H171-D188 PolarHBondContact CD2-O 3.16Å; H171-D188 PolarHBondContact NE2-O 2.97Å; H171-P192 VanDerWaalsContact CE1-CD 3.44Å; H171-P192 WeakPolarHBondContact CE1-CD 3.44Å; H171-P192 VanDerWaalsContact CE1-CG 3.45Å; H171-P192 WeakPolarHBondContact CE1-CG 3.37Å; H171-P192 WeakPolarHBondContact ND1-CG 3.5Å
172	A	94.5	Very high	91	Very high	28 Å²	28	65.5 Å²	65.5	23%	0.231	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	158.5	-172.6	0	0	0	0	0	111.5	L160 F187	L160-A172 PolarHBondContact N-O 3.2Å; A172-F187 HydrophobicContact CB-CD1 3.99Å; A172-F187 HydrophobicContact CB-CE1 4.34Å
173	S	94.2	Very high	90.8	Very high	35 Å²	35	70.5 Å²	70.5	25%	0.245	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	147.3	175.5	66.1	0	0	0	0	111.5	V158 Y170	V158-S173 CarbonylContact O-C 3.49Å; V158-S173 WeakPolarHBondContact O-CA 3.43Å; Y170-S173 WeakPolarHBondContact OH-CB 3.48Å; Y170-S173 PolarHBondContact OH-N 3.01Å; Y170-S173 VanDerWaalsContact OH-N 3.13Å; Y170-S173 PolarHBondContact OH-OG 3.36Å
174	R	92.8	Very high	90.7	Very high	118 Å²	118	71.7 Å²	71.7	45%	0.445	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.1	174.6	-69.6	-67.7	-169.3	180	1.3	110.6	R157 V158 L185 F187	R157-R174 WeakPolarHBondContact CA-O 3.39Å; V158-R174 HydrophobicContact CG2-CB 4.47Å; V158-R174 PolarHBondContact N-O 2.99Å; V158-R174 PolarHBondContact O-N 2.82Å; R174-L185 HydrophobicContact CB-CD1 3.93Å; R174-L185 HydrophobicContact CG-CD1 4.22Å; R174-F187 HydrophobicContact CB-CE1 4.07Å; R174-F187 HydrophobicContact CB-CZ 3.89Å; R174-F187 HydrophobicContact CG-CD1 4.07Å; R174-F187 HydrophobicContact CG-CE1 3.44Å; R174-F187 VanDerWaalsContact CG-CE1 3.44Å; R174-F187 HydrophobicContact CG-CE2 4.42Å; R174-F187 HydrophobicContact CG-CZ 3.65Å
175	F	92.1	Very high	90.8	Very high	107 Å²	107	69.9 Å²	69.9	47%	0.469	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.7	171.7	-66.7	-87.1	0	0	0	109.6	E155 R157	E155-F175 HydrophobicContact CB-CD1 4.4Å; E155-F175 HydrophobicContact CG-CD1 4Å; R157-F175 HydrophobicContact CB-CD1 3.89Å; R157-F175 HydrophobicContact CB-CE1 3.77Å; R157-F175 HydrophobicContact CB-CZ 4.49Å; R157-F175 HydrophobicContact CG-CD1 4.46Å; R157-F175 HydrophobicContact CG-CE1 4.17Å; R157-F175 HydrophobicContact CG-CZ 4.42Å
176	V	92.3	Very high	91.4	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.6	178	-175.5	0	0	0	0	108.9	I147 I152 E155 Q156 V158 L180 L185 F224	I147-V176 HydrophobicContact CG2-CG1 4.4Å; I152-V176 HydrophobicContact CD1-CB 4.18Å; I152-V176 HydrophobicContact CD1-CG1 3.81Å; I152-V176 WeakPolarHBondContact CD1-O 3.45Å; E155-V176 CarbonylContact C-O 3.59Å; E155-V176 WeakPolarHBondContact CA-O 3.45Å; Q156-V176 PolarHBondContact N-O 3.23Å; Q156-V176 PolarHBondContact O-N 2.97Å; V158-V176 HydrophobicContact CG1-CG2 4.4Å; V158-V176 HydrophobicContact CG2-CG2 3.88Å; V176-L180 HydrophobicContact CB-CD1 4.3Å; V176-L180 HydrophobicContact CG1-CB 4.49Å; V176-L180 HydrophobicContact CG1-CD1 3.92Å; V176-L185 HydrophobicContact CG2-CD1 4.41Å; V176-L185 HydrophobicContact CG2-CD2 4.08Å; V176-F224 HydrophobicContact CB-CE1 4.14Å; V176-F224 HydrophobicContact CG1-CD1 4.1Å; V176-F224 HydrophobicContact CG1-CE1 4.08Å; V176-F224 HydrophobicContact CG1-CG 4.48Å; V176-F224 HydrophobicContact CG1-CZ 4.46Å; V176-F224 HydrophobicContact CG2-CE1 4.14Å; V176-F224 HydrophobicContact CG2-CZ 4.15Å
177	T	92.8	Very high	91.9	Very high	49 Å²	49	63.6 Å²	63.6	30%	0.301	31%	0.313	S	S	.	.			trans	-126	167.6	177	65.5	0	0	0	0	110.3	E155 A179 L180	E155-T177 HydrophobicContact CB-CG2 4.02Å; T177-A179 PolarHBondContact O-N 2.91Å; T177-A179 VanDerWaalsContact O-N 3.08Å; T177-A179 PolarHBondContact OG1-N 3.05Å; T177-L180 WeakPolarHBondContact O-CB 3.31Å; T177-L180 PolarHBondContact O-N 3.11Å
178	N	91.1	Very high	92.1	Very high	76 Å²	76	64.4 Å²	64.4	41%	0.406	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-61	-18.8	176.2	-67.5	-26.7	0	0	0	113.4	P150 I152 L180 K181	P150-N178 PolarHBondContact O-OD1 2.67Å; I152-N178 PolarHBondContact N-OD1 2.87Å; I152-N178 PolarHBondContact O-ND2 3.01Å; N178-L180 PolarHBondContact O-N 3.46Å; N178-K181 WeakPolarHBondContact O-CB 3.44Å; N178-K181 PolarHBondContact O-N 2.94Å
179	A	89.8	Confident	92.3	Very high	66 Å²	66	61.2 Å²	61.2	55%	0.545	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-69	-14.7	176.3	0	0	0	0	0	113.8	T177 K181 K183	T177-A179 PolarHBondContact O-N 2.91Å; T177-A179 VanDerWaalsContact O-N 3.08Å; T177-A179 PolarHBondContact OG1-N 3.05Å; A179-K181 VanDerWaalsContact C-N 3.29Å; A179-K183 WeakPolarHBondContact O-CD 3.47Å; A179-K183 WeakPolarHBondContact O-CE 3.41Å; A179-K183 PolarHBondContact O-NZ 3.49Å
180	L	88.7	Confident	92.2	Very high	36 Å²	36	55.5 Å²	55.5	19%	0.188	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-85.6	5.3	173.9	-74.3	164.4	0	0	0	113.3	I147 V176 T177 N178 E182 K183	I147-L180 HydrophobicContact CB-CB 4.5Å; I147-L180 WeakPolarHBondContact CB-O 3.28Å; I147-L180 HydrophobicContact CG1-CB 4.46Å; V176-L180 HydrophobicContact CB-CD1 4.3Å; V176-L180 HydrophobicContact CG1-CB 4.49Å; V176-L180 HydrophobicContact CG1-CD1 3.92Å; T177-L180 WeakPolarHBondContact O-CB 3.31Å; T177-L180 PolarHBondContact O-N 3.11Å; N178-L180 PolarHBondContact O-N 3.46Å; L180-E182 PolarHBondContact O-N 2.98Å; L180-K183 HydrophobicContact CD2-CB 4.1Å; L180-K183 PolarHBondContact O-N 2.85Å
181	K	91.3	Very high	92	Very high	129 Å²	129	56.1 Å²	56.1	56%	0.561	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	123.8	173.7	-179.4	175.3	177.3	-175.8	0	110.4	P150 N178 A179 K183	P150-K181 HydrophobicContact CG-CB 3.7Å; P150-K181 HydrophobicContact CG-CG 4.36Å; N178-K181 WeakPolarHBondContact O-CB 3.44Å; N178-K181 PolarHBondContact O-N 2.94Å; A179-K181 VanDerWaalsContact C-N 3.29Å; K181-K183 PolarHBondContact O-N 3.01Å
182	E	88.1	Confident	92	Very high	99 Å²	99	54.1 Å²	54.1	46%	0.463	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	21.9	-177.9	-57.7	-65	156.9	0	0	114.1	I147 K148 L180	I147-E182 WeakPolarHBondContact O-CA 3.37Å; I147-E182 PolarHBondContact O-N 3.43Å; K148-E182 WeakPolarHBondContact CD-OE1 3.36Å; K148-E182 WeakPolarHBondContact CE-OE2 3.45Å; K148-E182 IonicContact NZ-OE1 2.64Å; K148-E182 PolarHBondContact NZ-OE1 2.93Å; K148-E182 IonicContact NZ-OE2 3.48Å; K148-E182 PolarHBondContact NZ-OE2 2.8Å; L180-E182 PolarHBondContact O-N 2.98Å
183	K	89.8	Confident	92	Very high	108 Å²	108	52.8 Å²	52.8	47%	0.47	26%	0.264	S	S	.	.	S	Bend	trans	-117	162.3	175.2	-61.4	-175	-175.5	161.9	0	111.7	I147 A179 L180 K181	I147-K183 PolarHBondContact N-O 3.07Å; A179-K183 WeakPolarHBondContact O-CD 3.47Å; A179-K183 WeakPolarHBondContact O-CE 3.41Å; A179-K183 PolarHBondContact O-NZ 3.49Å; L180-K183 HydrophobicContact CD2-CB 4.1Å; L180-K183 PolarHBondContact O-N 2.85Å; K181-K183 PolarHBondContact O-N 3.01Å
184	W	89.8	Confident	91.8	Very high	29 Å²	29	54 Å²	54	11%	0.11	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	133.2	179.4	-64.8	99.2	0	0	0	111.3	R144 M145 L146 Q245 Y248	R144-W184 HydrophobicContact CB-CE3 3.84Å; R144-W184 HydrophobicContact CB-CZ3 4.33Å; M145-W184 VanDerWaalsContact C-CE3 3.48Å; M145-W184 CarbonylContact O-C 3.6Å; M145-W184 WeakPolarHBondContact O-CA 3.19Å; L146-W184 HydrophobicContact CB-CD2 4.44Å; L146-W184 HydrophobicContact CB-CE3 4.04Å; L146-W184 HydrophobicContact CB-CH2 3.96Å; L146-W184 HydrophobicContact CB-CZ2 4.4Å; L146-W184 HydrophobicContact CB-CZ3 3.79Å; L146-W184 HydrophobicContact CD1-CD2 4.34Å; L146-W184 HydrophobicContact CD1-CZ2 4.49Å; W184-Q245 HydrophobicContact CH2-CB 3.9Å; W184-Q245 HydrophobicContact CH2-CG 4.48Å; W184-Q245 HydrophobicContact CZ2-CB 4.44Å; W184-Y248 HydrophobicContact CE3-CE1 4.31Å; W184-Y248 HydrophobicContact CH2-CD1 4.17Å; W184-Y248 AromaticContact CH2-CE1 3.34Å; W184-Y248 HydrophobicContact CH2-CE1 3.34Å; W184-Y248 HydrophobicContact CZ2-CE1 4.03Å; W184-Y248 HydrophobicContact CZ3-CD1 4.17Å; W184-Y248 AromaticContact CZ3-CE1 3.48Å; W184-Y248 HydrophobicContact CZ3-CE1 3.48Å; W184-Y248 VanDerWaalsContact CZ3-CE1 3.48Å
185	L	92.6	Very high	91.8	Very high	10 Å²	10	51.7 Å²	51.7	5%	0.052	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.7	161.8	177.3	65.6	0	0	0	107.7	R144 M145 I147 V158 R174 V176 F187	R144-L185 WeakPolarHBondContact CA-O 3.45Å; M145-L185 HydrophobicContact CE-CD2 4.11Å; M145-L185 HydrophobicContact CE-CG 4.38Å; M145-L185 PolarHBondContact N-O 3.32Å; M145-L185 PolarHBondContact O-N 2.88Å; I147-L185 HydrophobicContact CD1-CB 3.85Å; I147-L185 HydrophobicContact CD1-CD2 4.03Å; I147-L185 HydrophobicContact CG1-CB 3.91Å; V158-L185 HydrophobicContact CG2-CD2 4.13Å; R174-L185 HydrophobicContact CB-CD1 3.93Å; R174-L185 HydrophobicContact CG-CD1 4.22Å; V176-L185 HydrophobicContact CG2-CD1 4.41Å; V176-L185 HydrophobicContact CG2-CD2 4.08Å; L185-F187 HydrophobicContact CD1-CE2 4.28Å; L185-F187 HydrophobicContact CD2-CE2 3.82Å; L185-F187 HydrophobicContact CD2-CZ 4.38Å; L185-F187 HydrophobicContact CG-CD2 4.46Å; L185-F187 HydrophobicContact CG-CE2 3.78Å
186	S	93	Very high	91.9	Very high	24 Å²	24	47 Å²	47	17%	0.168	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	144.9	-177.8	56.2	0	0	0	0	112.6	L143	L143-S186 VanDerWaalsContact O-CA 3.31Å; L143-S186 WeakPolarHBondContact O-CA 3.39Å
187	F	94.2	Very high	91.8	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.1	169.8	-68.3	-94.1	0	0	0	108.6	E142 L143 M145 V158 L160 A172 R174 L185 I189 L208	E142-F187 CarbonylContact C-O 3.5Å; E142-F187 VanDerWaalsContact CA-O 3.28Å; E142-F187 WeakPolarHBondContact CA-O 3.41Å; L143-F187 PolarHBondContact N-O 3.27Å; L143-F187 PolarHBondContact O-N 3.08Å; M145-F187 HydrophobicContact CE-CD2 3.63Å; M145-F187 HydrophobicContact CE-CE2 3.5Å; V158-F187 HydrophobicContact CG2-CZ 4.3Å; L160-F187 HydrophobicContact CB-CD1 3.97Å; L160-F187 HydrophobicContact CB-CE1 3.9Å; L160-F187 HydrophobicContact CB-CG 4.36Å; L160-F187 HydrophobicContact CB-CZ 4.25Å; L160-F187 HydrophobicContact CD2-CB 3.63Å; L160-F187 HydrophobicContact CD2-CD1 3.97Å; L160-F187 HydrophobicContact CD2-CD2 4.14Å; L160-F187 HydrophobicContact CD2-CG 3.66Å; A172-F187 HydrophobicContact CB-CD1 3.99Å; A172-F187 HydrophobicContact CB-CE1 4.34Å; R174-F187 HydrophobicContact CB-CE1 4.07Å; R174-F187 HydrophobicContact CB-CZ 3.89Å; R174-F187 HydrophobicContact CG-CD1 4.07Å; R174-F187 HydrophobicContact CG-CE1 3.44Å; R174-F187 VanDerWaalsContact CG-CE1 3.44Å; R174-F187 HydrophobicContact CG-CE2 4.42Å; R174-F187 HydrophobicContact CG-CZ 3.65Å; L185-F187 HydrophobicContact CD1-CE2 4.28Å; L185-F187 HydrophobicContact CD2-CE2 3.82Å; L185-F187 HydrophobicContact CD2-CZ 4.38Å; L185-F187 HydrophobicContact CG-CD2 4.46Å; L185-F187 HydrophobicContact CG-CE2 3.78Å; F187-I189 HydrophobicContact CB-CG2 4.22Å; F187-I189 PolarHBondContact O-N 3.22Å; F187-L208 HydrophobicContact CE2-CD1 4.26Å; F187-L208 HydrophobicContact CZ-CD1 4.26Å
188	D	92.8	Very high	91.7	Very high	91 Å²	91	50.8 Å²	50.8	49%	0.487	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	117.6	166	179.6	-3.2	0	0	0	107.7	H171 T190	H171-D188 PolarHBondContact CD2-O 3.16Å; H171-D188 PolarHBondContact NE2-O 2.97Å; D188-T190 VanDerWaalsContact OD1-CB 3.23Å; D188-T190 WeakPolarHBondContact OD1-CB 3.47Å; D188-T190 PolarHBondContact OD1-N 3.43Å; D188-T190 PolarHBondContact OD1-OG1 3.2Å
189	I	94.8	Very high	91.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.			trans	-119.9	25.3	-179.6	58.3	156.8	0	0	0	111.1	A141 L143 L160 F187 E191 P192 L193 F206 I249	A141-I189 HydrophobicContact CB-CG1 4.02Å; A141-I189 WeakPolarHBondContact O-CG1 3.44Å; A141-I189 PolarHBondContact O-N 2.89Å; L143-I189 HydrophobicContact CB-CD1 3.96Å; L143-I189 HydrophobicContact CB-CG1 4.22Å; L143-I189 HydrophobicContact CB-CG2 3.96Å; L160-I189 HydrophobicContact CD2-CG2 3.85Å; F187-I189 HydrophobicContact CB-CG2 4.22Å; F187-I189 PolarHBondContact O-N 3.22Å; I189-E191 PolarHBondContact O-N 3.14Å; I189-P192 HydrophobicContact CB-CG 4.47Å; I189-P192 WeakPolarHBondContact O-CD 3.46Å; I189-L193 VanDerWaalsContact O-CB 3.31Å; I189-L193 WeakPolarHBondContact O-CB 3.35Å; I189-L193 PolarHBondContact O-N 2.87Å; I189-F206 HydrophobicContact CB-CE1 4.33Å; I189-F206 HydrophobicContact CB-CZ 3.92Å; I189-F206 HydrophobicContact CD1-CE2 3.63Å; I189-F206 HydrophobicContact CD1-CZ 3.58Å; I189-F206 HydrophobicContact CG1-CZ 4.37Å; I189-F206 HydrophobicContact CG2-CE1 3.91Å; I189-F206 HydrophobicContact CG2-CZ 3.89Å; I189-I249 HydrophobicContact CD1-CB 4.46Å; I189-I249 HydrophobicContact CD1-CD1 3.91Å; I189-I249 HydrophobicContact CD1-CG1 3.84Å; I189-I249 HydrophobicContact CD1-CG2 3.87Å
190	T	92	Very high	91.3	Very high	16 Å²	16	54 Å²	54	10%	0.098	26%	0.264	C	S	.	.	H	α-helix	trans	-56.2	-51.3	-177.5	-55.6	0	0	0	0	111.6	T140 A141 D188 L193 Q194	T140-T190 WeakPolarHBondContact CA-OG1 3.4Å; A141-T190 PolarHBondContact N-OG1 2.84Å; A141-T190 PolarHBondContact O-N 3.31Å; D188-T190 VanDerWaalsContact OD1-CB 3.23Å; D188-T190 WeakPolarHBondContact OD1-CB 3.47Å; D188-T190 PolarHBondContact OD1-N 3.43Å; D188-T190 PolarHBondContact OD1-OG1 3.2Å; T190-L193 PolarHBondContact O-N 3.22Å; T190-Q194 HydrophobicContact CG2-CG 4.49Å; T190-Q194 WeakPolarHBondContact O-CB 3.41Å; T190-Q194 VanDerWaalsContact O-CG 3.27Å; T190-Q194 WeakPolarHBondContact O-CG 3.42Å; T190-Q194 PolarHBondContact O-N 3.38Å
191	E	91.3	Very high	91.4	Very high	113 Å²	113	57 Å²	57	53%	0.528	28%	0.277	S	S	.	.	H	α-helix	trans	-62	-52.9	178.7	173.1	-170.8	-174.5	0	0	112.7	I189 L193 Q194 Q195	I189-E191 PolarHBondContact O-N 3.14Å; E191-L193 VanDerWaalsContact C-N 3.28Å; E191-L193 PolarHBondContact O-N 3.3Å; E191-Q194 PolarHBondContact O-N 3.3Å; E191-Q195 PolarHBondContact O-N 3.28Å
192	P	93.7	Very high	91.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-54	-42.7	175.4	-28.4	32	0	0	0	113.7	Y162 H171 I189 Q195 W196 F206	Y162-P192 HydrophobicContact CD1-CB 4.24Å; Y162-P192 HydrophobicContact CD1-CG 3.98Å; Y162-P192 HydrophobicContact CD2-CB 4.09Å; Y162-P192 HydrophobicContact CE1-CB 4.49Å; Y162-P192 HydrophobicContact CE1-CG 4Å; Y162-P192 HydrophobicContact CE2-CB 4.38Å; Y162-P192 HydrophobicContact CG-CB 4.01Å; Y162-P192 HydrophobicContact CG-CG 4.26Å; H171-P192 VanDerWaalsContact CE1-CD 3.44Å; H171-P192 WeakPolarHBondContact CE1-CD 3.44Å; H171-P192 VanDerWaalsContact CE1-CG 3.45Å; H171-P192 WeakPolarHBondContact CE1-CG 3.37Å; H171-P192 WeakPolarHBondContact ND1-CG 3.5Å; I189-P192 HydrophobicContact CB-CG 4.47Å; I189-P192 WeakPolarHBondContact O-CD 3.46Å; P192-Q195 PolarHBondContact O-N 2.94Å; P192-W196 PolarHBondContact O-N 2.98Å; P192-F206 HydrophobicContact CB-CE1 4.14Å; P192-F206 HydrophobicContact CB-CZ 4.22Å
193	L	93.9	Very high	91.5	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-72	-38.1	-177.5	-168.1	62.3	0	0	0	111.9	I125 I128 L138 A141 I189 T190 E191 Q195 W196 L197 I249 T251	I125-L193 HydrophobicContact CD1-CD1 4.42Å; I128-L193 HydrophobicContact CD1-CD1 4.13Å; I128-L193 HydrophobicContact CG2-CD1 4.42Å; I128-L193 HydrophobicContact CG2-CD2 4.44Å; L138-L193 HydrophobicContact CD1-CD2 4.49Å; L138-L193 HydrophobicContact CD2-CB 3.96Å; L138-L193 HydrophobicContact CD2-CD2 3.76Å; L138-L193 HydrophobicContact CD2-CG 3.84Å; A141-L193 HydrophobicContact CB-CB 4.3Å; A141-L193 HydrophobicContact CB-CD2 3.52Å; I189-L193 VanDerWaalsContact O-CB 3.31Å; I189-L193 WeakPolarHBondContact O-CB 3.35Å; I189-L193 PolarHBondContact O-N 2.87Å; T190-L193 PolarHBondContact O-N 3.22Å; E191-L193 VanDerWaalsContact C-N 3.28Å; E191-L193 PolarHBondContact O-N 3.3Å; L193-Q195 VanDerWaalsContact C-N 3.29Å; L193-Q195 PolarHBondContact O-N 2.95Å; L193-W196 HydrophobicContact CD1-CE3 4.07Å; L193-W196 PolarHBondContact O-N 3.45Å; L193-L197 HydrophobicContact CG-CD1 4.48Å; L193-L197 WeakPolarHBondContact O-CB 3.48Å; L193-L197 VanDerWaalsContact O-CG 3.26Å; L193-L197 WeakPolarHBondContact O-CG 3.41Å; L193-L197 PolarHBondContact O-N 3.38Å; L193-I249 HydrophobicContact CD2-CG2 4.05Å; L193-T251 HydrophobicContact CD2-CG2 3.64Å
194	Q	92	Very high	91.7	Very high	61 Å²	61	51.3 Å²	51.3	29%	0.285	26%	0.258	S	S	.	.	H	α-helix	trans	-58.9	-41.8	172.3	-75.6	177.2	-16	0	0	111.2	L138 T190 E191 L197 Q198	L138-Q194 HydrophobicContact CB-CG 4.42Å; L138-Q194 HydrophobicContact CD2-CG 3.9Å; L138-Q194 PolarHBondContact O-NE2 3.16Å; L138-Q194 VanDerWaalsContact O-NE2 3.16Å; T190-Q194 HydrophobicContact CG2-CG 4.49Å; T190-Q194 WeakPolarHBondContact O-CB 3.41Å; T190-Q194 VanDerWaalsContact O-CG 3.27Å; T190-Q194 WeakPolarHBondContact O-CG 3.42Å; T190-Q194 PolarHBondContact O-N 3.38Å; E191-Q194 PolarHBondContact O-N 3.3Å; Q194-L197 PolarHBondContact O-N 3.18Å; Q194-Q198 WeakPolarHBondContact O-CG 3.33Å; Q194-Q198 PolarHBondContact O-N 2.94Å
195	Q	91.9	Very high	91.9	Very high	69 Å²	69	53.1 Å²	53.1	32%	0.322	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-44.4	175.8	-172.7	-177.4	-31.9	0	0	111.9	E191 P192 L193 L197 Q198 G199	E191-Q195 PolarHBondContact O-N 3.28Å; P192-Q195 PolarHBondContact O-N 2.94Å; L193-Q195 VanDerWaalsContact C-N 3.29Å; L193-Q195 PolarHBondContact O-N 2.95Å; Q195-L197 VanDerWaalsContact C-N 3.33Å; Q195-L197 PolarHBondContact O-N 3.41Å; Q195-Q198 WeakPolarHBondContact O-CB 3.4Å; Q195-Q198 PolarHBondContact O-N 3.01Å; Q195-G199 PolarHBondContact O-N 2.92Å
196	W	93.3	Very high	92.1	Very high	8 Å²	8	52.6 Å²	52.6	3%	0.03	26%	0.264	C	S	.	.	H	α-helix	trans	-66	-33.5	177.9	-69.1	-14.8	0	0	0	113.5	I125 Y162 S163 P192 L193 Q198 G199 Q204 F206	I125-W196 HydrophobicContact CD1-CD2 4.48Å; I125-W196 HydrophobicContact CD1-CE3 3.65Å; I125-W196 HydrophobicContact CD1-CZ3 4.15Å; I125-W196 HydrophobicContact CG1-CE3 4.38Å; I125-W196 HydrophobicContact CG2-CB 4.27Å; Y162-W196 HydrophobicContact CD2-CZ2 4.44Å; S163-W196 PolarHBondContact O-NE1 3.15Å; P192-W196 PolarHBondContact O-N 2.98Å; L193-W196 HydrophobicContact CD1-CE3 4.07Å; L193-W196 PolarHBondContact O-N 3.45Å; W196-Q198 VanDerWaalsContact C-N 3.26Å; W196-Q198 PolarHBondContact O-N 2.88Å; W196-G199 PolarHBondContact O-N 3.39Å; W196-Q204 HydrophobicContact CB-CG 4.28Å; W196-Q204 HydrophobicContact CD2-CB 3.59Å; W196-Q204 HydrophobicContact CD2-CG 3.67Å; W196-Q204 HydrophobicContact CE3-CB 3.65Å; W196-Q204 HydrophobicContact CE3-CG 4.14Å; W196-Q204 HydrophobicContact CG-CB 4.21Å; W196-Q204 HydrophobicContact CG-CG 3.74Å; W196-Q204 HydrophobicContact CH2-CB 3.74Å; W196-Q204 HydrophobicContact CZ2-CB 3.67Å; W196-Q204 HydrophobicContact CZ2-CG 4.37Å; W196-Q204 HydrophobicContact CZ3-CB 3.71Å; W196-F206 HydrophobicContact CE3-CE2 4.28Å; W196-F206 HydrophobicContact CE3-CZ 4.28Å; W196-F206 AromaticContact CH2-CD1 3.99Å; W196-F206 HydrophobicContact CH2-CD1 3.99Å; W196-F206 AromaticContact CH2-CD2 3.58Å; W196-F206 HydrophobicContact CH2-CD2 3.58Å; W196-F206 AromaticContact CH2-CE1 3.74Å; W196-F206 HydrophobicContact CH2-CE1 3.74Å; W196-F206 AromaticContact CH2-CE2 3.32Å; W196-F206 HydrophobicContact CH2-CE2 3.32Å; W196-F206 AromaticContact CH2-CG 3.91Å; W196-F206 HydrophobicContact CH2-CG 3.91Å; W196-F206 AromaticContact CH2-CZ 3.38Å; W196-F206 HydrophobicContact CH2-CZ 3.38Å; W196-F206 HydrophobicContact CZ2-CE1 4.33Å; W196-F206 HydrophobicContact CZ2-CZ 4.26Å; W196-F206 AromaticContact CZ3-CD2 3.79Å; W196-F206 HydrophobicContact CZ3-CD2 3.79Å; W196-F206 HydrophobicContact CZ3-CE1 4.24Å; W196-F206 AromaticContact CZ3-CE2 3.16Å; W196-F206 HydrophobicContact CZ3-CE2 3.16Å; W196-F206 AromaticContact CZ3-CZ 3.41Å; W196-F206 HydrophobicContact CZ3-CZ 3.41Å; W196-F206 VanDerWaalsContact CZ3-CZ 3.41Å
197	L	91.3	Very high	92.2	Very high	11 Å²	11	52.2 Å²	52.2	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-67.2	-26.1	175	-72.9	175.4	0	0	0	112.9	I128 R129 V132 F135 L138 L193 Q194 Q195	I128-L197 HydrophobicContact CG2-CD2 4.07Å; R129-L197 HydrophobicContact CB-CD2 3.93Å; R129-L197 HydrophobicContact CG-CD2 4.35Å; V132-L197 HydrophobicContact CG1-CD1 4.34Å; F135-L197 HydrophobicContact CB-CB 3.76Å; F135-L197 HydrophobicContact CB-CD1 4.35Å; L138-L197 HydrophobicContact CB-CD1 4.48Å; L138-L197 HydrophobicContact CD2-CD1 3.93Å; L193-L197 HydrophobicContact CG-CD1 4.48Å; L193-L197 WeakPolarHBondContact O-CB 3.48Å; L193-L197 VanDerWaalsContact O-CG 3.26Å; L193-L197 WeakPolarHBondContact O-CG 3.41Å; L193-L197 PolarHBondContact O-N 3.38Å; Q194-L197 PolarHBondContact O-N 3.18Å; Q195-L197 VanDerWaalsContact C-N 3.33Å; Q195-L197 PolarHBondContact O-N 3.41Å
198	Q	90.3	Very high	92.2	Very high	118 Å²	118	52.1 Å²	52.1	55%	0.551	26%	0.259	S	S	*	.	H	α-helix	trans	-77.1	-27.9	172.2	-67.6	173.8	18.3	0	0	112.9	F135 Q194 Q195 W196	F135-Q198 HydrophobicContact CB-CG 4.25Å; F135-Q198 HydrophobicContact CD1-CG 3.46Å; F135-Q198 VanDerWaalsContact CD1-CG 3.46Å; F135-Q198 HydrophobicContact CD2-CG 4.15Å; F135-Q198 VanDerWaalsContact CD2-NE2 3.34Å; F135-Q198 HydrophobicContact CE1-CG 3.75Å; F135-Q198 HydrophobicContact CE2-CG 4.39Å; F135-Q198 HydrophobicContact CG-CG 3.68Å; F135-Q198 HydrophobicContact CZ-CG 4.2Å; Q194-Q198 WeakPolarHBondContact O-CG 3.33Å; Q194-Q198 PolarHBondContact O-N 2.94Å; Q195-Q198 WeakPolarHBondContact O-CB 3.4Å; Q195-Q198 PolarHBondContact O-N 3.01Å; W196-Q198 VanDerWaalsContact C-N 3.26Å; W196-Q198 PolarHBondContact O-N 2.88Å
199	G	86.8	Confident	92.2	Very high	33 Å²	33	51.3 Å²	51.3	34%	0.34	25%	0.249	S	C	.	.	S	Bend	trans	-70.1	173.8	178.1	0	0	0	0	0	113.3	R129 Q195 W196	R129-G199 VanDerWaalsContact CZ-O 3.26Å; R129-G199 PolarHBondContact NH2-O 2.58Å; Q195-G199 PolarHBondContact O-N 2.92Å; W196-G199 PolarHBondContact O-N 3.39Å
200	Q	86.6	Confident	91.9	Very high	178 Å²	178	52.1 Å²	52.1	83%	0.832	25%	0.254	S	S	*	.			trans	-105.6	-8.1	175.7	-69.3	-169.5	-16.5	0	0	113.8
201	E	89.4	Confident	91.7	Very high	98 Å²	98	55.1 Å²	55.1	46%	0.458	27%	0.266	S	S	.	.			trans	-67.1	135.3	-179.7	-66	-179.8	-156.1	0	0	110.8	R129 Q204	R129-E201 PolarHBondContact NH2-O 2.93Å; E201-Q204 VanDerWaalsContact CB-NE2 3.29Å; E201-Q204 VanDerWaalsContact CD-NE2 3.33Å; E201-Q204 PolarHBondContact OE2-NE2 3.43Å
202	D	90.3	Very high	91	Very high	101 Å²	101	52.8 Å²	52.8	54%	0.54	26%	0.261	S	S	.	.	S	Bend	trans	-85.8	-21.6	-176.9	-68.5	-30.1	0	0	0	112.7	N124 I125 A126	N124-D202 CarbonylContact C-O 3.57Å; I125-D202 PolarHBondContact N-O 2.87Å; A126-D202 HydrophobicContact CB-CB 4.2Å; A126-D202 PolarHBondContact N-O 3.31Å
203	E	92.1	Very high	90.1	Very high	100 Å²	100	57.9 Å²	57.9	47%	0.467	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	132.8	178.7	-168.8	176	-130.9	0	0	110.2	F122 F123	F122-E203 HydrophobicContact CB-CG 4.3Å; F122-E203 HydrophobicContact CD1-CG 4.16Å; F123-E203 WeakPolarHBondContact O-CA 3Å
204	Q	94.4	Very high	88.7	Confident	16 Å²	16	64.4 Å²	64.4	8%	0.075	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	163.8	174.4	-68.2	-69.8	-16.8	0	0	109.9	F122 F123 I125 S163 W196 E201	F122-Q204 WeakPolarHBondContact CA-O 3.44Å; F123-Q204 PolarHBondContact N-O 2.73Å; F123-Q204 PolarHBondContact O-N 3Å; F123-Q204 VanDerWaalsContact O-N 3.11Å; I125-Q204 HydrophobicContact CD1-CB 3.97Å; I125-Q204 HydrophobicContact CD1-CG 4.31Å; I125-Q204 HydrophobicContact CG1-CB 3.59Å; I125-Q204 HydrophobicContact CG1-CG 3.51Å; S163-Q204 PolarHBondContact OG-OE1 2.84Å; W196-Q204 HydrophobicContact CB-CG 4.28Å; W196-Q204 HydrophobicContact CD2-CB 3.59Å; W196-Q204 HydrophobicContact CD2-CG 3.67Å; W196-Q204 HydrophobicContact CE3-CB 3.65Å; W196-Q204 HydrophobicContact CE3-CG 4.14Å; W196-Q204 HydrophobicContact CG-CB 4.21Å; W196-Q204 HydrophobicContact CG-CG 3.74Å; W196-Q204 HydrophobicContact CH2-CB 3.74Å; W196-Q204 HydrophobicContact CZ2-CB 3.67Å; W196-Q204 HydrophobicContact CZ2-CG 4.37Å; W196-Q204 HydrophobicContact CZ3-CB 3.71Å; E201-Q204 VanDerWaalsContact CB-NE2 3.29Å; E201-Q204 VanDerWaalsContact CD-NE2 3.33Å; E201-Q204 PolarHBondContact OE2-NE2 3.43Å
205	K	94.3	Very high	87.3	Confident	66 Å²	66	69.7 Å²	69.7	29%	0.287	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.5	-173.5	59.9	-173.2	174.2	-175.3	0	113.3	T120 M121 F122 S163 F168	T120-K205 HydrophobicContact CG2-CB 4.05Å; T120-K205 HydrophobicContact CG2-CD 3.94Å; T120-K205 HydrophobicContact CG2-CG 4.38Å; M121-K205 CarbonylContact O-C 3.49Å; M121-K205 WeakPolarHBondContact O-CA 3.12Å; F122-K205 HydrophobicContact CD1-CB 3.91Å; F122-K205 HydrophobicContact CD1-CD 4.28Å; F122-K205 HydrophobicContact CE1-CB 4.12Å; F122-K205 HydrophobicContact CE1-CD 3.64Å; F122-K205 HydrophobicContact CE1-CG 4.44Å; F122-K205 HydrophobicContact CG-CB 4.24Å; F122-K205 HydrophobicContact CZ-CD 3.97Å; S163-K205 PolarHBondContact N-O 2.79Å; S163-K205 PolarHBondContact OG-N 3.32Å; S163-K205 PolarHBondContact OG-O 2.64Å; S163-K205 VanDerWaalsContact OG-O 3.12Å; F168-K205 HydrophobicContact CE1-CD 4.28Å; F168-K205 HydrophobicContact CE1-CG 4.11Å; F168-K205 HydrophobicContact CZ-CD 4.08Å; F168-K205 VanDerWaalsContact CZ-CE 3.47Å; F168-K205 HydrophobicContact CZ-CG 4.42Å
206	F	95.7	Very high	85.8	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	142.9	165.4	-72.9	-73.6	0	0	0	109.6	T120 M121 F123 L143 L160 Y161 I189 P192 W196 I249	T120-F206 CarbonylContact C-O 3.51Å; T120-F206 WeakPolarHBondContact CA-O 3.38Å; M121-F206 HydrophobicContact CE-CB 4.08Å; M121-F206 PolarHBondContact N-O 3.29Å; M121-F206 PolarHBondContact O-N 3.48Å; F123-F206 AromaticContact CD2-CD2 3.95Å; F123-F206 HydrophobicContact CD2-CD2 3.95Å; F123-F206 AromaticContact CE2-CD2 3.85Å; F123-F206 HydrophobicContact CE2-CD2 3.85Å; L143-F206 HydrophobicContact CD2-CB 4.14Å; L143-F206 HydrophobicContact CD2-CD2 4.08Å; L143-F206 HydrophobicContact CD2-CG 4.02Å; L160-F206 HydrophobicContact CD1-CB 4.1Å; L160-F206 HydrophobicContact CD1-CD1 4.28Å; L160-F206 HydrophobicContact CD2-CD1 4.22Å; L160-F206 HydrophobicContact CG-CD1 4.24Å; Y161-F206 CarbonylContact O-C 3.55Å; Y161-F206 WeakPolarHBondContact O-CA 3.27Å; I189-F206 HydrophobicContact CB-CE1 4.33Å; I189-F206 HydrophobicContact CB-CZ 3.92Å; I189-F206 HydrophobicContact CD1-CE2 3.63Å; I189-F206 HydrophobicContact CD1-CZ 3.58Å; I189-F206 HydrophobicContact CG1-CZ 4.37Å; I189-F206 HydrophobicContact CG2-CE1 3.91Å; I189-F206 HydrophobicContact CG2-CZ 3.89Å; P192-F206 HydrophobicContact CB-CE1 4.14Å; P192-F206 HydrophobicContact CB-CZ 4.22Å; W196-F206 HydrophobicContact CE3-CE2 4.28Å; W196-F206 HydrophobicContact CE3-CZ 4.28Å; W196-F206 AromaticContact CH2-CD1 3.99Å; W196-F206 HydrophobicContact CH2-CD1 3.99Å; W196-F206 AromaticContact CH2-CD2 3.58Å; W196-F206 HydrophobicContact CH2-CD2 3.58Å; W196-F206 AromaticContact CH2-CE1 3.74Å; W196-F206 HydrophobicContact CH2-CE1 3.74Å; W196-F206 AromaticContact CH2-CE2 3.32Å; W196-F206 HydrophobicContact CH2-CE2 3.32Å; W196-F206 AromaticContact CH2-CG 3.91Å; W196-F206 HydrophobicContact CH2-CG 3.91Å; W196-F206 AromaticContact CH2-CZ 3.38Å; W196-F206 HydrophobicContact CH2-CZ 3.38Å; W196-F206 HydrophobicContact CZ2-CE1 4.33Å; W196-F206 HydrophobicContact CZ2-CZ 4.26Å; W196-F206 AromaticContact CZ3-CD2 3.79Å; W196-F206 HydrophobicContact CZ3-CD2 3.79Å; W196-F206 HydrophobicContact CZ3-CE1 4.24Å; W196-F206 AromaticContact CZ3-CE2 3.16Å; W196-F206 HydrophobicContact CZ3-CE2 3.16Å; W196-F206 AromaticContact CZ3-CZ 3.41Å; W196-F206 HydrophobicContact CZ3-CZ 3.41Å; W196-F206 VanDerWaalsContact CZ3-CZ 3.41Å; F206-I249 HydrophobicContact CE2-CD1 3.96Å
207	E	94.4	Very high	83.8	Confident	15 Å²	15	81.5 Å²	81.5	7%	0.07	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.2	176.2	-166.3	-175.7	161.5	0	0	109.6	T118 Y161 F168 R209	T118-E207 WeakPolarHBondContact CB-OE1 3.45Å; T118-E207 VanDerWaalsContact CG2-OE1 3.25Å; T118-E207 WeakPolarHBondContact CG2-OE1 3.37Å; Y161-E207 PolarHBondContact N-O 3.39Å; Y161-E207 PolarHBondContact O-N 3.12Å; F168-E207 HydrophobicContact CD1-CB 4.15Å; F168-E207 HydrophobicContact CE1-CB 3.83Å; F168-E207 WeakPolarHBondContact CE1-OE2 3.32Å; F168-E207 WeakPolarHBondContact CE2-OE2 3.28Å; F168-E207 HydrophobicContact CZ-CB 4.49Å; F168-E207 VanDerWaalsContact CZ-OE2 3.25Å; F168-E207 WeakPolarHBondContact CZ-OE2 3.45Å; E207-R209 HydrophobicContact CG-CG 4.12Å; E207-R209 IonicContact OE1-CZ 3.65Å; E207-R209 IonicContact OE1-NE 3.51Å; E207-R209 PolarHBondContact OE1-NE 3.41Å; E207-R209 IonicContact OE1-NH2 2.82Å; E207-R209 PolarHBondContact OE1-NH2 3.13Å; E207-R209 IonicContact OE2-CZ 2.85Å; E207-R209 IonicContact OE2-NE 3.01Å; E207-R209 PolarHBondContact OE2-NE 2.9Å; E207-R209 IonicContact OE2-NH2 2.58Å; E207-R209 PolarHBondContact OE2-NH2 3.43Å
208	L	94.3	Very high	82.3	Confident	0 Å²	0	85.7 Å²	85.7	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.4	172.1	-172.8	73.7	0	0	0	108.6	T118 K119 M121 M145 V158 E159 L160 F187 F222	T118-L208 WeakPolarHBondContact CA-O 3.42Å; K119-L208 HydrophobicContact CB-CB 4.3Å; K119-L208 PolarHBondContact N-O 3.29Å; K119-L208 PolarHBondContact O-N 3.3Å; M121-L208 HydrophobicContact CE-CB 4.31Å; M145-L208 HydrophobicContact CE-CD1 4.38Å; M145-L208 HydrophobicContact CE-CD2 4.43Å; M145-L208 HydrophobicContact SD-CD2 4.08Å; V158-L208 HydrophobicContact CB-CD1 4.02Å; V158-L208 HydrophobicContact CB-CG 4.44Å; V158-L208 HydrophobicContact CG2-CD1 4.04Å; E159-L208 WeakPolarHBondContact O-CA 3.04Å; L160-L208 HydrophobicContact CD1-CD1 4.43Å; F187-L208 HydrophobicContact CE2-CD1 4.26Å; F187-L208 HydrophobicContact CZ-CD1 4.26Å; L208-F222 HydrophobicContact CD2-CE1 3.89Å; L208-F222 HydrophobicContact CD2-CZ 4.15Å; L208-F222 HydrophobicContact CG-CE1 4.16Å; L208-F222 HydrophobicContact CG-CZ 4.13Å
209	R	92.6	Very high	81	Confident	74 Å²	74	82.4 Å²	82.4	28%	0.279	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.7	-179.7	-57.7	-172.3	178.5	158.4	3.5	110.5	T118 V158 E159 Y161 E207	T118-R209 HydrophobicContact CG2-CG 4.08Å; V158-R209 WeakPolarHBondContact CA-O 3.28Å; E159-R209 PolarHBondContact N-O 2.98Å; E159-R209 PolarHBondContact O-N 2.87Å; Y161-R209 HydrophobicContact CD2-CB 4.43Å; Y161-R209 HydrophobicContact CD2-CG 3.99Å; Y161-R209 HydrophobicContact CE2-CB 4.26Å; Y161-R209 HydrophobicContact CE2-CG 4.19Å; E207-R209 HydrophobicContact CG-CG 4.12Å; E207-R209 IonicContact OE1-CZ 3.65Å; E207-R209 IonicContact OE1-NE 3.51Å; E207-R209 PolarHBondContact OE1-NE 3.41Å; E207-R209 IonicContact OE1-NH2 2.82Å; E207-R209 PolarHBondContact OE1-NH2 3.13Å; E207-R209 IonicContact OE2-CZ 2.85Å; E207-R209 IonicContact OE2-NE 3.01Å; E207-R209 PolarHBondContact OE2-NE 2.9Å; E207-R209 IonicContact OE2-NH2 2.58Å; E207-R209 PolarHBondContact OE2-NH2 3.43Å
210	V	89.9	Confident	80.4	Confident	17 Å²	17	82.3 Å²	82.3	10%	0.103	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	130.9	167.3	-175.8	0	0	0	0	108.2	R117 Q156 C212 A220 F222	R117-V210 PolarHBondContact O-N 3.21Å; Q156-V210 HydrophobicContact CG-CG1 4.37Å; V210-C212 PolarHBondContact O-N 2.96Å; V210-A220 HydrophobicContact CB-CB 4.42Å; V210-A220 HydrophobicContact CG1-CB 3.73Å; V210-F222 HydrophobicContact CG2-CB 4.41Å; V210-F222 HydrophobicContact CG2-CD1 3.5Å; V210-F222 HydrophobicContact CG2-CD2 3.8Å; V210-F222 HydrophobicContact CG2-CE1 3.54Å; V210-F222 HydrophobicContact CG2-CE2 3.84Å; V210-F222 HydrophobicContact CG2-CG 3.63Å; V210-F222 HydrophobicContact CG2-CZ 3.7Å
211	F	87.1	Confident	80.4	Confident	80 Å²	80	77 Å²	77	35%	0.351	40%	0.404	S	S	.	.			trans	-63.7	129.6	173.6	175.5	-103.2	0	0	0	109.5	R157 E159 E213	R157-F211 HydrophobicContact CB-CB 3.89Å; R157-F211 HydrophobicContact CB-CD1 4.48Å; R157-F211 HydrophobicContact CB-CG 4.41Å; R157-F211 HydrophobicContact CG-CB 3.83Å; R157-F211 HydrophobicContact CG-CG 4.24Å; R157-F211 WeakPolarHBondContact O-CB 3.2Å; R157-F211 PolarHBondContact O-N 2.83Å; E159-F211 HydrophobicContact CG-CB 4.35Å; E159-F211 VanDerWaalsContact OE1-CD2 3.28Å; E159-F211 WeakPolarHBondContact OE1-CD2 3.39Å; F211-E213 HydrophobicContact CE1-CB 4.39Å
212	C	75.9	Confident	80.3	Confident	64 Å²	64	73.6 Å²	73.6	43%	0.432	39%	0.388	S	S	.	.			trans	-117.7	126.3	174.7	-168	0	0	0	0	108.3	V210	V210-C212 PolarHBondContact O-N 2.96Å
213	E	75.3	Confident	80.2	Confident	106 Å²	106	71.2 Å²	71.2	50%	0.495	38%	0.379	S	S	.	.			trans	-74.7	129.9	169.7	-168	163	-145.8	0	0	108.4	F211 E215 Q216	F211-E213 HydrophobicContact CE1-CB 4.39Å; E213-E215 PolarHBondContact O-N 3.34Å; E213-Q216 PolarHBondContact O-N 3.12Å; E213-Q216 VanDerWaalsContact O-N 3.11Å
214	C	65.4	Low	80.1	Confident	138 Å²	138	66.6 Å²	66.6	93%	0.932	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-18.2	-173.4	-67.8	0	0	0	0	114
215	E	62.2	Low	79.8	Confident	172 Å²	172	70.7 Å²	70.7	80%	0.804	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-14.9	-178.5	-68.5	-175.5	163.5	0	0	113.9	E213	E213-E215 PolarHBondContact O-N 3.34Å
216	Q	60.1	Low	79.5	Confident	121 Å²	121	67.6 Å²	67.6	57%	0.565	36%	0.361	S	S	*	.			trans	-98.2	110.7	178.8	-73.5	-176.2	-4.3	0	0	111.2	E213 T218	E213-Q216 PolarHBondContact O-N 3.12Å; E213-Q216 VanDerWaalsContact O-N 3.11Å; Q216-T218 PolarHBondContact O-N 3.16Å
217	Q	52	Low	79	Confident	204 Å²	204	67.9 Å²	67.9	95%	0.953	36%	0.364	S	S	*	.			trans	-70.6	-6.8	177.3	-68	176.1	4.4	0	0	113.7	A219	Q217-A219 PolarHBondContact O-N 3.23Å
218	T	59.1	Low	78.5	Confident	99 Å²	99	67.2 Å²	67.2	61%	0.607	36%	0.36	S	S	*	.	S	Bend	trans	-76	121.9	175.2	47.4	0	0	0	0	110.3	Q216 A220	Q216-T218 PolarHBondContact O-N 3.16Å; T218-A220 PolarHBondContact O-N 3Å
219	A	63.2	Low	77.9	Confident	49 Å²	49	67.3 Å²	67.3	41%	0.405	36%	0.361	S	S	.	.			trans	-47.6	98.3	167.5	0	0	0	0	0	112.2	Q217 T221	Q217-A219 PolarHBondContact O-N 3.23Å; A219-T221 PolarHBondContact O-N 3.01Å
220	A	74	Confident	77	Confident	30 Å²	30	65.6 Å²	65.6	25%	0.248	36%	0.357	C	S	.	.			trans	-67.3	117.8	173.6	0	0	0	0	0	109.7	V210 T218	V210-A220 HydrophobicContact CB-CB 4.42Å; V210-A220 HydrophobicContact CG1-CB 3.73Å; T218-A220 PolarHBondContact O-N 3Å
221	T	85.9	Confident	76	Confident	66 Å²	66	70.5 Å²	70.5	41%	0.405	38%	0.383	S	S	.	.			trans	-108	160.5	176.2	56.6	0	0	0	0	110.6	D116 Q156 A219 S223	D116-T221 HydrophobicContact CB-CG2 3.97Å; D116-T221 WeakPolarHBondContact O-CA 3.49Å; Q156-T221 PolarHBondContact NE2-O 3.24Å; A219-T221 PolarHBondContact O-N 3.01Å; T221-S223 PolarHBondContact O-N 3.08Å
222	F	87.3	Confident	75	Confident	28 Å²	28	71 Å²	71	12%	0.123	39%	0.385	C	S	.	.			trans	-63.6	127	174.5	-72.7	-79.4	0	0	0	111	D116 R117 K119 V158 L208 V210 F224	D116-F222 WeakPolarHBondContact O-CD2 3.41Å; D116-F222 PolarHBondContact O-N 3.18Å; R117-F222 VanDerWaalsContact C-CE2 3.46Å; R117-F222 WeakPolarHBondContact O-CE2 3.45Å; K119-F222 HydrophobicContact CD-CD2 4.27Å; K119-F222 HydrophobicContact CD-CE1 4.46Å; K119-F222 HydrophobicContact CD-CE2 4.01Å; K119-F222 HydrophobicContact CD-CZ 4.12Å; K119-F222 HydrophobicContact CG-CD2 4.28Å; K119-F222 HydrophobicContact CG-CE2 3.75Å; K119-F222 HydrophobicContact CG-CZ 4.13Å; V158-F222 HydrophobicContact CG1-CE1 4.09Å; L208-F222 HydrophobicContact CD2-CE1 3.89Å; L208-F222 HydrophobicContact CD2-CZ 4.15Å; L208-F222 HydrophobicContact CG-CE1 4.16Å; L208-F222 HydrophobicContact CG-CZ 4.13Å; V210-F222 HydrophobicContact CG2-CB 4.41Å; V210-F222 HydrophobicContact CG2-CD1 3.5Å; V210-F222 HydrophobicContact CG2-CD2 3.8Å; V210-F222 HydrophobicContact CG2-CE1 3.54Å; V210-F222 HydrophobicContact CG2-CE2 3.84Å; V210-F222 HydrophobicContact CG2-CG 3.63Å; V210-F222 HydrophobicContact CG2-CZ 3.7Å; F222-F224 VanDerWaalsContact C-N 3.25Å; F222-F224 AromaticContact CD1-CE1 3.86Å; F222-F224 HydrophobicContact CD1-CE1 3.86Å; F222-F224 HydrophobicContact CD1-CE2 4.18Å; F222-F224 AromaticContact CD1-CZ 3.66Å; F222-F224 HydrophobicContact CD1-CZ 3.66Å; F222-F224 HydrophobicContact CE1-CZ 4.02Å
223	S	88.5	Confident	74.2	Confident	50 Å²	50	79 Å²	79	35%	0.35	41%	0.406	S	S	.	.	S	Bend	trans	-93.4	15.7	175	-58.1	0	0	0	0	112	S151 T221	S151-S223 PolarHBondContact N-O 2.97Å; T221-S223 PolarHBondContact O-N 3.08Å
224	F	89.6	Confident	73.5	Confident	3 Å²	3	76.3 Å²	76.3	1%	0.013	41%	0.407	C	S	.	.	S	Bend	trans	-150.5	163	179	64.6	-91.9	0	0	0	109.8	I147 P150 I152 Q156 V158 V176 F222 V226	I147-F224 HydrophobicContact CD1-CD2 3.85Å; I147-F224 HydrophobicContact CD1-CE2 3.6Å; I147-F224 HydrophobicContact CD1-CZ 4.45Å; I147-F224 HydrophobicContact CG2-CB 4.21Å; I147-F224 HydrophobicContact CG2-CD2 3.97Å; I147-F224 HydrophobicContact CG2-CG 4.27Å; P150-F224 HydrophobicContact CB-CB 3.92Å; I152-F224 HydrophobicContact CD1-CD1 4.07Å; Q156-F224 VanDerWaalsContact OE1-CD1 3.22Å; Q156-F224 VanDerWaalsContact OE1-CE1 3.31Å; V158-F224 HydrophobicContact CG1-CE1 3.91Å; V158-F224 HydrophobicContact CG1-CZ 3.85Å; V176-F224 HydrophobicContact CB-CE1 4.14Å; V176-F224 HydrophobicContact CG1-CD1 4.1Å; V176-F224 HydrophobicContact CG1-CE1 4.08Å; V176-F224 HydrophobicContact CG1-CG 4.48Å; V176-F224 HydrophobicContact CG1-CZ 4.46Å; V176-F224 HydrophobicContact CG2-CE1 4.14Å; V176-F224 HydrophobicContact CG2-CZ 4.15Å; F222-F224 VanDerWaalsContact C-N 3.25Å; F222-F224 AromaticContact CD1-CE1 3.86Å; F222-F224 HydrophobicContact CD1-CE1 3.86Å; F222-F224 HydrophobicContact CD1-CE2 4.18Å; F222-F224 AromaticContact CD1-CZ 3.66Å; F222-F224 HydrophobicContact CD1-CZ 3.66Å; F222-F224 HydrophobicContact CE1-CZ 4.02Å; F224-V226 HydrophobicContact CD2-CG2 4.05Å; F224-V226 HydrophobicContact CE2-CG2 3.59Å
225	F	88.3	Confident	73.1	Confident	103 Å²	103	77.7 Å²	77.7	45%	0.452	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	147.1	177.6	-64.2	-85	0	0	0	109.9	K148 K149 D230	K148-F225 HydrophobicContact CB-CB 3.99Å; K148-F225 PolarHBondContact N-O 3.44Å; K148-F225 WeakPolarHBondContact O-CB 3.2Å; K148-F225 PolarHBondContact O-N 2.98Å; K149-F225 HydrophobicContact CB-CD2 3.93Å; K149-F225 HydrophobicContact CB-CE2 4.48Å; K149-F225 HydrophobicContact CD-CD2 4.39Å; F225-D230 WeakPolarHBondContact CB-OD2 3.23Å; F225-D230 HydrophobicContact CD1-CB 4.48Å; F225-D230 WeakPolarHBondContact CD1-OD2 3.44Å
226	V	87.8	Confident	72.8	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.1	171.3	178.8	0	0	0	0	107.3	K119 M145 I147 F224 G228 T229 P247	K119-V226 HydrophobicContact CD-CB 4.25Å; K119-V226 HydrophobicContact CD-CG2 4.01Å; M145-V226 HydrophobicContact CB-CG1 3.81Å; M145-V226 HydrophobicContact CG-CG1 4.14Å; I147-V226 HydrophobicContact CD1-CG2 4.18Å; F224-V226 HydrophobicContact CD2-CG2 4.05Å; F224-V226 HydrophobicContact CE2-CG2 3.59Å; V226-G228 PolarHBondContact O-N 3.46Å; V226-T229 HydrophobicContact CB-CG2 3.92Å; V226-T229 WeakPolarHBondContact CB-OG1 3.4Å; V226-T229 HydrophobicContact CG1-CG2 3.68Å; V226-T229 PolarHBondContact O-N 3.29Å; V226-T229 PolarHBondContact O-OG1 3.12Å; V226-P247 HydrophobicContact CG1-CG 4.26Å
227	S	87.1	Confident	72.7	Confident	7 Å²	7	72.2 Å²	72.2	5%	0.049	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	131.7	-179.9	-176.9	0	0	0	0	110.9	L146 T229 Q245 P247	L146-S227 PolarHBondContact O-N 2.94Å; S227-T229 VanDerWaalsContact C-N 3.27Å; S227-T229 PolarHBondContact O-N 2.9Å; S227-Q245 WeakPolarHBondContact CB-O 3.2Å; S227-Q245 PolarHBondContact OG-N 3.24Å; S227-Q245 PolarHBondContact OG-O 3.4Å; S227-P247 WeakPolarHBondContact O-CD 3.32Å
228	G	81.9	Confident	73.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	-11.9	-179.7	0	0	0	0	0	116.3	K112 V226 E244	K112-G228 WeakPolarHBondContact CD-O 3.34Å; K112-G228 PolarHBondContact NZ-O 3.45Å; V226-G228 PolarHBondContact O-N 3.46Å; G228-E244 VanDerWaalsContact CA-OE2 3.24Å; G228-E244 WeakPolarHBondContact CA-OE2 3.46Å; G228-E244 PolarHBondContact N-OE2 2.94Å
229	T	82.1	Confident	72.8	Confident	2 Å²	2	70 Å²	70	1%	0.012	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-22.1	-176.5	69.5	0	0	0	0	114.5	K112 S114 K119 V226 S227 P247	K112-T229 WeakPolarHBondContact CD-O 3.44Å; S114-T229 WeakPolarHBondContact CB-O 3.48Å; S114-T229 PolarHBondContact OG-O 2.77Å; K119-T229 PolarHBondContact NZ-OG1 3.15Å; V226-T229 HydrophobicContact CB-CG2 3.92Å; V226-T229 WeakPolarHBondContact CB-OG1 3.4Å; V226-T229 HydrophobicContact CG1-CG2 3.68Å; V226-T229 PolarHBondContact O-N 3.29Å; V226-T229 PolarHBondContact O-OG1 3.12Å; S227-T229 VanDerWaalsContact C-N 3.27Å; S227-T229 PolarHBondContact O-N 2.9Å; T229-P247 HydrophobicContact CG2-CG 3.57Å
230	D	74.8	Confident	72.4	Confident	38 Å²	38	71.3 Å²	71.3	20%	0.203	37%	0.371	C	S	.	.	S	Bend	trans	-79.1	147.2	-173.4	-58.8	-58.7	0	0	0	112	K112 K119 F225 K232	K112-D230 PolarHBondContact NZ-O 3Å; K119-D230 IonicContact NZ-OD1 3.43Å; K119-D230 PolarHBondContact NZ-OD1 3.27Å; F225-D230 WeakPolarHBondContact CB-OD2 3.23Å; F225-D230 HydrophobicContact CD1-CB 4.48Å; F225-D230 WeakPolarHBondContact CD1-OD2 3.44Å; D230-K232 PolarHBondContact O-N 3.36Å
231	N	69.3	Low	71.6	Confident	121 Å²	121	73.3 Å²	73.3	65%	0.647	38%	0.377	S	S	*	.			trans	-79.7	114.3	177.1	-68.7	-24.5	0	0	0	108.7	S114	S114-N231 PolarHBondContact O-ND2 2.9Å
232	K	65.6	Low	70.2	Confident	91 Å²	91	78.1 Å²	78.1	40%	0.396	40%	0.397	S	S	.	.			trans	-109.5	148	176.9	-68.1	-174.1	175.2	-179.8	0	110.7	D230 E240 E244	D230-K232 PolarHBondContact O-N 3.36Å; K232-E240 WeakPolarHBondContact CD-OE2 3.25Å; K232-E240 IonicContact NZ-OE1 3.34Å; K232-E240 PolarHBondContact NZ-OE1 3.28Å; K232-E240 IonicContact NZ-OE2 3.56Å; K232-E240 PolarHBondContact NZ-OE2 2.9Å; K232-E244 WeakPolarHBondContact CE-OE1 3.39Å; K232-E244 IonicContact NZ-OE1 2.7Å; K232-E244 PolarHBondContact NZ-OE1 3.03Å
233	R	59.4	Low	68.9	Low	231 Å²	231	84.5 Å²	84.5	87%	0.872	43%	0.429	S	S	*	.			trans	-63.9	135.1	-179.3	-161.8	172.4	-179.2	170.5	-0.1	110.5	D235 K236	R233-D235 VanDerWaalsContact C-N 3.33Å; R233-D235 PolarHBondContact O-N 3.09Å; R233-K236 PolarHBondContact O-N 3.22Å
234	G	60.3	Low	68.2	Low	50 Å²	50	84.1 Å²	84.1	52%	0.515	42%	0.422	S	S	.	.	H	α-helix	trans	-51.4	-32.4	-157.3	0	0	0	0	0	118.1	K236 A237	G234-K236 VanDerWaalsContact C-N 3.33Å; G234-K236 PolarHBondContact O-N 2.82Å; G234-A237 PolarHBondContact O-N 3.31Å
235	D	57.3	Low	67.8	Low	166 Å²	166	87.6 Å²	87.6	89%	0.888	44%	0.438	S	S	*	.	H	α-helix	trans	-75.7	-17.8	-170.7	-56.5	-24.7	0	0	0	114.4	R233	R233-D235 VanDerWaalsContact C-N 3.33Å; R233-D235 PolarHBondContact O-N 3.09Å
236	K	55	Low	67.8	Low	156 Å²	156	84.5 Å²	84.5	68%	0.678	43%	0.426	S	S	*	.	H	α-helix	trans	-105.8	-11.5	173	-77.7	-174	175.8	-177.9	0	113.7	R233 G234 T238 E240	R233-K236 PolarHBondContact O-N 3.22Å; G234-K236 VanDerWaalsContact C-N 3.33Å; G234-K236 PolarHBondContact O-N 2.82Å; K236-T238 PolarHBondContact O-N 2.91Å; K236-E240 WeakPolarHBondContact O-CB 3.49Å; K236-E240 PolarHBondContact O-N 3.4Å
237	A	59.1	Low	68	Low	23 Å²	23	84.5 Å²	84.5	19%	0.19	43%	0.426	C	S	.	.	H	α-helix	trans	-64.3	-41.9	-167.6	0	0	0	0	0	112.9	G234 L241	G234-A237 PolarHBondContact O-N 3.31Å; A237-L241 VanDerWaalsContact O-CB 3.28Å; A237-L241 WeakPolarHBondContact O-CB 3.29Å; A237-L241 WeakPolarHBondContact O-CD1 3.34Å; A237-L241 WeakPolarHBondContact O-CG 3.39Å; A237-L241 PolarHBondContact O-N 2.56Å
238	T	59.7	Low	68.3	Low	107 Å²	107	84.1 Å²	84.1	66%	0.656	42%	0.424	S	S	*	.	H	α-helix	trans	-71.2	-40.3	-173	-34.5	0	0	0	0	113.1	K236	K236-T238 PolarHBondContact O-N 2.91Å
239	M	52.7	Low	68.9	Low	149 Å²	149	84.1 Å²	84.1	73%	0.734	42%	0.424	S	S	*	.	H	α-helix	trans	-74.8	-34.8	178.9	-72.9	-86.2	-82.2	0	0	112.1
240	E	55	Low	69.5	Low	77 Å²	77	84.2 Å²	84.2	36%	0.36	42%	0.424	S	S	.	.	H	α-helix	trans	-77	-33.8	177.6	-119.2	171.7	175.8	0	0	112.2	K232 K236 M242 M243 E244	K232-E240 WeakPolarHBondContact CD-OE2 3.25Å; K232-E240 IonicContact NZ-OE1 3.34Å; K232-E240 PolarHBondContact NZ-OE1 3.28Å; K232-E240 IonicContact NZ-OE2 3.56Å; K232-E240 PolarHBondContact NZ-OE2 2.9Å; K236-E240 WeakPolarHBondContact O-CB 3.49Å; K236-E240 PolarHBondContact O-N 3.4Å; E240-M242 PolarHBondContact O-N 2.95Å; E240-M243 CarbonylContact O-C 3.54Å; E240-M243 PolarHBondContact O-N 2.81Å; E240-E244 WeakPolarHBondContact O-CB 3.39Å; E240-E244 VanDerWaalsContact O-CG 3.31Å; E240-E244 WeakPolarHBondContact O-CG 3.33Å; E240-E244 PolarHBondContact O-N 3.5Å
241	L	57.6	Low	70.3	Confident	72 Å²	72	82.4 Å²	82.4	38%	0.377	41%	0.414	S	S	.	.	H	α-helix	trans	-58.5	-29	171.6	-84.1	162.9	0	0	0	112.9	A237 L246	A237-L241 VanDerWaalsContact O-CB 3.28Å; A237-L241 WeakPolarHBondContact O-CB 3.29Å; A237-L241 WeakPolarHBondContact O-CD1 3.34Å; A237-L241 WeakPolarHBondContact O-CG 3.39Å; A237-L241 PolarHBondContact O-N 2.56Å; L241-L246 HydrophobicContact CD2-CD2 4.08Å
242	M	55.9	Low	71.1	Confident	167 Å²	167	77.2 Å²	77.2	82%	0.823	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.1	174	-69.4	-176.8	76.6	0	0	113.4	E240	E240-M242 PolarHBondContact O-N 2.95Å
243	M	60.3	Low	72.1	Confident	162 Å²	162	73.1 Å²	73.1	80%	0.798	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-17.9	-179.8	-66.4	-167	170.6	0	0	113.4	E240	E240-M243 CarbonylContact O-C 3.54Å; E240-M243 PolarHBondContact O-N 2.81Å
244	E	72.8	Confident	73.1	Confident	41 Å²	41	63.5 Å²	63.5	19%	0.192	34%	0.335	C	S	.	.	S	Bend	trans	-80.8	137.2	-179.5	-77.7	-178.9	-166.7	0	0	111.9	G228 K232 E240 L246	G228-E244 VanDerWaalsContact CA-OE2 3.24Å; G228-E244 WeakPolarHBondContact CA-OE2 3.46Å; G228-E244 PolarHBondContact N-OE2 2.94Å; K232-E244 WeakPolarHBondContact CE-OE1 3.39Å; K232-E244 IonicContact NZ-OE1 2.7Å; K232-E244 PolarHBondContact NZ-OE1 3.03Å; E240-E244 WeakPolarHBondContact O-CB 3.39Å; E240-E244 VanDerWaalsContact O-CG 3.31Å; E240-E244 WeakPolarHBondContact O-CG 3.33Å; E240-E244 PolarHBondContact O-N 3.5Å; E244-L246 PolarHBondContact O-N 2.87Å; E244-L246 VanDerWaalsContact O-N 3.16Å
245	Q	81.6	Confident	73.6	Confident	76 Å²	76	63 Å²	63	36%	0.355	32%	0.322	S	S	.	.			trans	-76.6	103.2	168.8	-63.1	-63.5	-52.7	0	0	108	L146 W184 S227	L146-Q245 HydrophobicContact CD2-CB 4.07Å; L146-Q245 HydrophobicContact CD2-CG 4.34Å; W184-Q245 HydrophobicContact CH2-CB 3.9Å; W184-Q245 HydrophobicContact CH2-CG 4.48Å; W184-Q245 HydrophobicContact CZ2-CB 4.44Å; S227-Q245 WeakPolarHBondContact CB-O 3.2Å; S227-Q245 PolarHBondContact OG-N 3.24Å; S227-Q245 PolarHBondContact OG-O 3.4Å
246	L	88.8	Confident	73.8	Confident	38 Å²	38	60.8 Å²	60.8	20%	0.199	30%	0.304	C	S	.	.			trans	-67.6	152.7	174.3	-69.5	151.6	0	0	0	110.6	M109 L241 E244 Y248	M109-L246 HydrophobicContact CE-CD2 3.84Å; L241-L246 HydrophobicContact CD2-CD2 4.08Å; E244-L246 PolarHBondContact O-N 2.87Å; E244-L246 VanDerWaalsContact O-N 3.16Å; L246-Y248 WeakPolarHBondContact O-CD1 3.41Å; L246-Y248 PolarHBondContact O-N 3.4Å
247	P	92.6	Very high	74	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.314	C	S	.	.			trans	-54.7	137.5	166.3	-23.7	35.5	0	0	0	110.5	M109 M121 R144 M145 V226 S227 T229	M109-P247 WeakPolarHBondContact CB-O 2.89Å; M109-P247 PolarHBondContact N-O 2.76Å; M109-P247 HydrophobicContact SD-CG 4.34Å; M121-P247 HydrophobicContact SD-CB 3.73Å; M121-P247 HydrophobicContact SD-CG 3.97Å; R144-P247 WeakPolarHBondContact O-CA 2.99Å; M145-P247 HydrophobicContact CG-CB 3.99Å; M145-P247 HydrophobicContact CG-CG 4.3Å; V226-P247 HydrophobicContact CG1-CG 4.26Å; S227-P247 WeakPolarHBondContact O-CD 3.32Å; T229-P247 HydrophobicContact CG2-CG 3.57Å
248	Y	93.2	Very high	73.9	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	155.8	-179.5	65.5	-99.2	0	0	0	111.7	N74 K106 F107 R144 W184 L246 L250	N74-Y248 WeakPolarHBondContact CB-OH 3.47Å; N74-Y248 PolarHBondContact OD1-OH 3.37Å; K106-Y248 HydrophobicContact CD-CD1 4.36Å; K106-Y248 HydrophobicContact CD-CD2 4.15Å; K106-Y248 HydrophobicContact CD-CG 4.1Å; K106-Y248 HydrophobicContact CG-CD2 3.86Å; K106-Y248 HydrophobicContact CG-CG 3.95Å; F107-Y248 CarbonylContact O-C 3.51Å; F107-Y248 WeakPolarHBondContact O-CA 3.36Å; F107-Y248 VanDerWaalsContact O-CB 3.26Å; F107-Y248 WeakPolarHBondContact O-CB 3.43Å; R144-Y248 HydrophobicContact CB-CE2 4.04Å; R144-Y248 HydrophobicContact CG-CE2 4.35Å; R144-Y248 PolarHBondContact N-O 3.27Å; R144-Y248 PolarHBondContact NH1-OH 3.3Å; R144-Y248 PolarHBondContact O-N 2.8Å; R144-Y248 VanDerWaalsContact O-N 3.16Å; W184-Y248 HydrophobicContact CE3-CE1 4.31Å; W184-Y248 HydrophobicContact CH2-CD1 4.17Å; W184-Y248 AromaticContact CH2-CE1 3.34Å; W184-Y248 HydrophobicContact CH2-CE1 3.34Å; W184-Y248 HydrophobicContact CZ2-CE1 4.03Å; W184-Y248 HydrophobicContact CZ3-CD1 4.17Å; W184-Y248 AromaticContact CZ3-CE1 3.48Å; W184-Y248 HydrophobicContact CZ3-CE1 3.48Å; W184-Y248 VanDerWaalsContact CZ3-CE1 3.48Å; L246-Y248 WeakPolarHBondContact O-CD1 3.41Å; L246-Y248 PolarHBondContact O-N 3.4Å; Y248-L250 HydrophobicContact CD2-CB 4.38Å; Y248-L250 HydrophobicContact CE2-CB 4.11Å
249	I	94.8	Very high	73.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.5	170.5	-62.5	171.5	0	0	0	107.9	K106 F107 F123 I128 E142 L143 I189 L193 F206 T251	K106-I249 WeakPolarHBondContact CA-O 3.5Å; F107-I249 PolarHBondContact N-O 2.96Å; F107-I249 PolarHBondContact O-N 3.47Å; F123-I249 HydrophobicContact CB-CD1 4.24Å; F123-I249 HydrophobicContact CD1-CD1 3.57Å; F123-I249 HydrophobicContact CD1-CG1 3.94Å; F123-I249 HydrophobicContact CD2-CD1 3.91Å; F123-I249 HydrophobicContact CE1-CD1 3.81Å; F123-I249 HydrophobicContact CE1-CG1 3.66Å; F123-I249 HydrophobicContact CE2-CD1 4.13Å; F123-I249 HydrophobicContact CE2-CG1 4.36Å; F123-I249 HydrophobicContact CG-CD1 3.62Å; F123-I249 HydrophobicContact CG-CG1 4.4Å; F123-I249 HydrophobicContact CZ-CD1 4.08Å; F123-I249 HydrophobicContact CZ-CG1 3.89Å; I128-I249 HydrophobicContact CD1-CD1 4.27Å; E142-I249 WeakPolarHBondContact O-CA 3.2Å; L143-I249 HydrophobicContact CD1-CG1 3.96Å; I189-I249 HydrophobicContact CD1-CB 4.46Å; I189-I249 HydrophobicContact CD1-CD1 3.91Å; I189-I249 HydrophobicContact CD1-CG1 3.84Å; I189-I249 HydrophobicContact CD1-CG2 3.87Å; L193-I249 HydrophobicContact CD2-CG2 4.05Å; F206-I249 HydrophobicContact CE2-CD1 3.96Å; I249-T251 HydrophobicContact CG2-CG2 3.79Å
250	L	93.1	Very high	73	Confident	4 Å²	4	58 Å²	58	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.6	169.4	-175.4	64.7	0	0	0	108.3	L71 M78 L104 A141 E142 Y248	L71-L250 HydrophobicContact CD1-CD1 3.6Å; M78-L250 HydrophobicContact SD-CD2 3.62Å; L104-L250 HydrophobicContact CB-CD1 4.49Å; L104-L250 HydrophobicContact CD2-CD1 4.16Å; L104-L250 HydrophobicContact CD2-CD2 4.44Å; L104-L250 HydrophobicContact CD2-CG 4.46Å; A141-L250 CarbonylContact C-O 3.56Å; A141-L250 VanDerWaalsContact CA-O 3.32Å; A141-L250 WeakPolarHBondContact CA-O 3.49Å; E142-L250 PolarHBondContact N-O 3.28Å; E142-L250 PolarHBondContact O-N 3.5Å; Y248-L250 HydrophobicContact CD2-CB 4.38Å; Y248-L250 HydrophobicContact CE2-CB 4.11Å
251	T	91.9	Very high	72.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	144.6	177	61.5	0	0	0	0	110.3	L104 N105 F107 V132 L138 A141 L193 I249	L104-T251 VanDerWaalsContact CA-O 3.3Å; L104-T251 WeakPolarHBondContact CA-O 3.48Å; N105-T251 WeakPolarHBondContact CB-OG1 3.46Å; N105-T251 PolarHBondContact N-O 3.38Å; N105-T251 PolarHBondContact O-N 3.5Å; N105-T251 PolarHBondContact O-OG1 3.46Å; F107-T251 HydrophobicContact CD2-CG2 4.07Å; F107-T251 HydrophobicContact CE2-CG2 3.8Å; F107-T251 WeakPolarHBondContact CE2-OG1 3.34Å; V132-T251 HydrophobicContact CG2-CG2 4.47Å; L138-T251 HydrophobicContact CD1-CG2 4.09Å; A141-T251 HydrophobicContact CB-CG2 4.29Å; L193-T251 HydrophobicContact CD2-CG2 3.64Å; I249-T251 HydrophobicContact CG2-CG2 3.79Å
252	M	87.6	Confident	71.7	Confident	12 Å²	12	63 Å²	63	6%	0.059	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.5	166.2	-56.1	-176.2	-172.7	0	0	108.7	M78 K102 V103 L104 T139 T140	M78-M252 HydrophobicContact CE-CE 3.24Å; M78-M252 HydrophobicContact SD-CE 3.49Å; M78-M252 WeakPolarHBondContact SD-CE 3.41Å; K102-M252 HydrophobicContact CB-CB 4.18Å; K102-M252 HydrophobicContact CD-CB 4.14Å; K102-M252 HydrophobicContact CD-SD 4.33Å; V103-M252 WeakPolarHBondContact O-CA 3.39Å; L104-M252 HydrophobicContact CD2-CE 3.92Å; L104-M252 HydrophobicContact CD2-CG 3.98Å; L104-M252 HydrophobicContact CG-CG 4.19Å; T139-M252 PolarHBondContact N-O 3.46Å; T139-M252 PolarHBondContact OG1-O 3.45Å; T140-M252 PolarHBondContact N-O 2.94Å; T140-M252 PolarHBondContact O-N 2.74Å; T140-M252 WeakPolarHBondContact OG1-CB 3.48Å; T140-M252 WeakPolarHBondContact OG1-CG 3.44Å; T140-M252 PolarHBondContact OG1-SD 3.39Å
253	S	85.9	Confident	70.7	Confident	5 Å²	5	61.9 Å²	61.9	4%	0.035	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	155	-176.8	58.9	0	0	0	0	113.2	V103 L137	V103-S253 PolarHBondContact N-O 2.83Å; V103-S253 PolarHBondContact O-N 2.95Å; L137-S253 CarbonylContact O-C 3.56Å; L137-S253 WeakPolarHBondContact O-CA 3.26Å; L137-S253 VanDerWaalsContact O-CB 3.29Å; L137-S253 WeakPolarHBondContact O-CB 3.2Å
254	I	79.8	Confident	69.5	Low	29 Å²	29	58.2 Å²	58.2	15%	0.149	32%	0.324	C	S	.	.			trans	-82.9	130	171.9	-57.8	169	0	0	0	107.9	E97 L137 T139 M258	E97-I254 HydrophobicContact CB-CD1 4.31Å; E97-I254 HydrophobicContact CG-CD1 4.2Å; L137-I254 HydrophobicContact CD2-CB 4.27Å; L137-I254 PolarHBondContact O-N 2.94Å; T139-I254 HydrophobicContact CG2-CD1 3.99Å; T139-I254 HydrophobicContact CG2-CG1 3.75Å; I254-M258 HydrophobicContact CG2-CB 4.14Å
255	P	70.6	Confident	68.1	Low	38 Å²	38	68.3 Å²	68.3	25%	0.247	36%	0.36	C	S	.	.			trans	-63.4	144.8	-179.2	17.9	-24.3	0	0	0	112.6	V103 N257 M258	V103-P255 HydrophobicContact CG2-CB 4.16Å; V103-P255 HydrophobicContact CG2-CG 4.13Å; P255-N257 VanDerWaalsContact C-N 3.27Å; P255-N257 PolarHBondContact O-N 2.93Å; P255-N257 VanDerWaalsContact O-N 3.16Å; P255-M258 HydrophobicContact CB-CB 4.5Å; P255-M258 HydrophobicContact CG-CB 4Å; P255-M258 HydrophobicContact CG-CE 4.41Å; P255-M258 HydrophobicContact CG-CG 3.92Å; P255-M258 HydrophobicContact CG-SD 4.29Å; P255-M258 WeakPolarHBondContact O-CB 3.38Å; P255-M258 PolarHBondContact O-N 3.38Å
256	K	62	Low	66.4	Low	120 Å²	120	70.6 Å²	70.6	52%	0.522	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-57.7	-29.6	-174.9	-70.1	174.7	179.3	169.8	0	114.9	L137 M258	L137-K256 HydrophobicContact CD1-CB 4.41Å; L137-K256 HydrophobicContact CD1-CG 3.62Å; K256-M258 PolarHBondContact O-N 3.03Å
257	N	60	Low	64.1	Low	164 Å²	164	75.1 Å²	75.1	88%	0.877	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-82.4	14	-177.2	-73.9	-6.2	0	0	0	114.2	P255	P255-N257 VanDerWaalsContact C-N 3.27Å; P255-N257 PolarHBondContact O-N 2.93Å; P255-N257 VanDerWaalsContact O-N 3.16Å
258	M	57.1	Low	61.5	Low	24 Å²	24	83.2 Å²	83.2	12%	0.118	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-122.2	-2.2	-153.8	-145.2	68.7	157.6	0	0	115.1	R48 F100 I254 P255 K256 S260	R48-M258 HydrophobicContact CB-CE 3.8Å; R48-M258 HydrophobicContact CB-SD 4.47Å; R48-M258 WeakPolarHBondContact CD-SD 3.3Å; R48-M258 HydrophobicContact CG-CE 3.29Å; R48-M258 HydrophobicContact CG-SD 4.09Å; R48-M258 PolarHBondContact NE-SD 3.3Å; R48-M258 VanDerWaalsContact NH1-CG 3.3Å; R48-M258 PolarHBondContact NH1-O 3.12Å; R48-M258 VanDerWaalsContact NH1-O 3.08Å; R48-M258 PolarHBondContact NH1-SD 2.7Å; R48-M258 PolarHBondContact NH2-O 3.04Å; F100-M258 HydrophobicContact CD1-CE 4.23Å; I254-M258 HydrophobicContact CG2-CB 4.14Å; P255-M258 HydrophobicContact CB-CB 4.5Å; P255-M258 HydrophobicContact CG-CB 4Å; P255-M258 HydrophobicContact CG-CE 4.41Å; P255-M258 HydrophobicContact CG-CG 3.92Å; P255-M258 HydrophobicContact CG-SD 4.29Å; P255-M258 WeakPolarHBondContact O-CB 3.38Å; P255-M258 PolarHBondContact O-N 3.38Å; K256-M258 PolarHBondContact O-N 3.03Å; M258-S260 PolarHBondContact O-N 2.97Å
259	S	48.9	Very low	58.8	Low	105 Å²	105	87.5 Å²	87.5	73%	0.734	45%	0.447	S	S	*	.			trans	-85.2	17.5	-158.4	72.6	0	0	0	0	118
260	S	43.4	Very low	56	Low	84 Å²	84	92.7 Å²	92.7	59%	0.587	48%	0.479	S	S	*	.	S	Bend	trans	-103.5	109.5	-178.6	63	0	0	0	0	112.1	M258	M258-S260 PolarHBondContact O-N 2.97Å
261	H	44.6	Very low	53.6	Low	174 Å²	174	98 Å²	98	81%	0.806	52%	0.517	S	S	*	.			trans	70.8	107.2	164.2	-62.4	-78.1	0	0	0	117.8
262	L	41.3	Very low	51.1	Low	81 Å²	81	100.4 Å²	100.4	42%	0.424	54%	0.542	S	S	.	.			trans	-111.7	127.3	166.1	-68.3	164.3	0	0	0	107.9	F100	F100-L262 HydrophobicContact CD2-CD2 3.85Å; F100-L262 HydrophobicContact CE2-CD2 3.48Å; F100-L262 VanDerWaalsContact CE2-CD2 3.48Å
263	T	35.6	Very low	49.2	Very low	142 Å²	142	107.8 Å²	107.8	87%	0.871	58%	0.576	S	S	*	*			trans	-125	128.9	172.9	51.8	0	0	0	0	109.9
264	S	35.2	Very low	47.5	Very low	86 Å²	86	115.1 Å²	115.1	60%	0.601	61%	0.61	S	S	*	*			trans	-85.9	142.3	-169.5	176.1	0	0	0	0	115	E96	E96-S264 WeakPolarHBondContact OE1-CB 3.49Å
265	R	41.3	Very low	46.4	Very low	252 Å²	252	118.7 Å²	118.7	95%	0.951	63%	0.633	S	S	*	*			trans	-148.5	121.5	155.8	-160.3	179	-161.7	-177.6	5.6	111.3
266	K	46.1	Very low	46	Very low	125 Å²	125	118.6 Å²	118.6	54%	0.543	63%	0.633	S	S	.	*			trans	-75.5	152.3	-172.2	-179	172.3	-173.2	158.6	0	116.3
267	K	41.5	Very low	45.8	Very low	132 Å²	132	117.4 Å²	117.4	57%	0.574	64%	0.636	S	S	*	*			trans	-146.7	136.6	148.2	-98.4	-176.1	-173.1	-177	0	112.4	S380	K267-S380 PolarHBondContact NZ-OG 3.21Å
268	R	36.8	Very low	45.6	Very low	170 Å²	170	113.3 Å²	113.3	64%	0.642	63%	0.625	S	S	*	*			trans	-77.5	152.1	-179.5	-56.3	177.4	-161.6	137.9	3.6	113.5	K378	R268-K378 PolarHBondContact O-NZ 3.36Å
269	S	38.4	Very low	45.5	Very low	90 Å²	90	119.7 Å²	119.7	63%	0.629	65%	0.654	S	S	*	*			trans	-113.3	141.5	172.7	63.2	0	0	0	0	113.1
270	T	34.3	Very low	46.1	Very low	109 Å²	109	116.8 Å²	116.8	67%	0.669	63%	0.632	S	S	*	*			trans	-138.1	137.8	159.7	45.5	0	0	0	0	107.5	Q349	T270-Q349 PolarHBondContact O-NE2 3.49Å; T270-Q349 PolarHBondContact OG1-NE2 3.4Å; T270-Q349 VanDerWaalsContact OG1-NE2 3.1Å
271	S	42.4	Very low	47.3	Very low	116 Å²	116	120.5 Å²	120.5	81%	0.811	64%	0.64	S	S	*	*			trans	-79.3	132.2	-173	177.1	0	0	0	0	111.7
272	G	40.2	Very low	48.7	Very low	51 Å²	51	117.3 Å²	117.3	53%	0.526	63%	0.629	S	S	.	*			trans	-152.9	95.6	164.4	0	0	0	0	0	107.7	E274	G272-E274 PolarHBondContact O-N 2.93Å
273	Q	47.5	Very low	50.4	Low	166 Å²	166	114.8 Å²	114.8	78%	0.776	62%	0.618	S	S	*	*			trans	-82.9	94.8	174.7	-88.4	-174.9	-23.9	0	0	109.1
274	E	51.1	Low	52.5	Low	159 Å²	159	108.6 Å²	108.6	74%	0.743	58%	0.58	S	S	*	*			trans	-138	113.4	160.2	-70.7	-170	168.1	0	0	109	G272 C284	G272-E274 PolarHBondContact O-N 2.93Å; E274-C284 PolarHBondContact O-SG 3.38Å
275	T	55.5	Low	54.7	Low	104 Å²	104	104.7 Å²	104.7	64%	0.638	55%	0.553	S	S	*	*	B	Isolated β-bridge	trans	-83.1	112.5	168.9	-57.1	0	0	0	0	106.8
276	C	62.5	Low	56.8	Low	37 Å²	37	93.9 Å²	93.9	25%	0.25	51%	0.512	C	S	.	.			trans	-82	147.9	-174.4	-55.3	0	0	0	0	112.7	T280 C284	C276-T280 HydrophobicContact CB-CG2 3.85Å; C276-T280 WeakPolarHBondContact CB-OG1 3.37Å; C276-C284 HydrophobicContact CB-CB 3.59Å; C276-C284 WeakPolarHBondContact CB-SG 2.96Å; C276-C284 PolarHBondContact N-SG 2.93Å; C276-C284 VanDerWaalsContact N-SG 3.37Å; C276-C284 WeakPolarHBondContact SG-CB 3.34Å; C276-C284 CovalentContact SG-SG 2Å; C276-C284 PolarHBondContact SG-SG 2.93Å
277	T	58	Low	58.6	Low	94 Å²	94	92.1 Å²	92.1	58%	0.577	52%	0.516	S	S	*	.			trans	-69.6	162.5	172.9	42.2	0	0	0	0	112.2	Q279 T280 R286	T277-Q279 PolarHBondContact O-N 3.42Å; T277-T280 PolarHBondContact O-N 2.99Å; T277-T280 PolarHBondContact O-OG1 2.89Å; T277-R286 PolarHBondContact O-NH1 3.46Å
278	A	56.1	Low	60.8	Low	79 Å²	79	86.2 Å²	86.2	65%	0.653	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-32.9	-175	0	0	0	0	0	113.9	T280 R286	A278-T280 PolarHBondContact O-N 3.22Å; A278-R286 VanDerWaalsContact C-NH1 3.34Å; A278-R286 PolarHBondContact O-NH1 2.93Å; A278-R286 PolarHBondContact O-NH2 3.06Å; A278-R286 VanDerWaalsContact O-NH2 3.12Å
279	Q	55.3	Low	63.4	Low	157 Å²	157	83.5 Å²	83.5	73%	0.734	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	2.6	-170.7	-59.9	88.7	-5.6	0	0	116.3	T277	T277-Q279 PolarHBondContact O-N 3.42Å
280	T	61.7	Low	65.8	Low	44 Å²	44	79.2 Å²	79.2	27%	0.27	45%	0.451	S	S	.	.			trans	-86.7	111.7	-176.5	46.1	0	0	0	0	113.4	C276 T277 A278 N282 R286	C276-T280 HydrophobicContact CB-CG2 3.85Å; C276-T280 WeakPolarHBondContact CB-OG1 3.37Å; T277-T280 PolarHBondContact O-N 2.99Å; T277-T280 PolarHBondContact O-OG1 2.89Å; A278-T280 PolarHBondContact O-N 3.22Å; T280-N282 VanDerWaalsContact C-N 3.27Å; T280-N282 PolarHBondContact O-N 2.88Å; T280-R286 PolarHBondContact O-NH2 3.47Å; T280-R286 PolarHBondContact OG1-NH2 2.96Å
281	E	67.1	Low	68.4	Low	163 Å²	163	76 Å²	76	76%	0.762	43%	0.43	S	S	*	.			trans	-77.2	-10.8	178.9	-63.4	-168.9	167.7	0	0	114.3	S315	E281-S315 WeakPolarHBondContact O-CB 3.44Å; E281-S315 PolarHBondContact O-N 2.95Å; E281-S315 PolarHBondContact O-OG 3.07Å
282	N	74.6	Confident	70.7	Confident	107 Å²	107	70.6 Å²	70.6	57%	0.572	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-84.5	158.3	180	-64.1	-16.7	0	0	0	112	T280 C284	T280-N282 VanDerWaalsContact C-N 3.27Å; T280-N282 PolarHBondContact O-N 2.88Å; N282-C284 PolarHBondContact O-N 2.81Å; N282-C284 VanDerWaalsContact O-N 3.07Å
283	C	76.8	Confident	72.9	Confident	28 Å²	28	75.8 Å²	75.8	19%	0.189	40%	0.395	C	S	.	.	S	Bend	trans	-53.5	113.7	177.5	174.9	0	0	0	0	112.3	S315 C316 C346 C379	C283-S315 PolarHBondContact N-O 3Å; C283-C316 VanDerWaalsContact CB-SG 3.52Å; C283-C346 WeakPolarHBondContact CA-SG 3.06Å; C283-C346 HydrophobicContact CB-CB 3.67Å; C283-C346 WeakPolarHBondContact CB-SG 3.39Å; C283-C346 WeakPolarHBondContact SG-CA 3.37Å; C283-C346 WeakPolarHBondContact SG-CB 3.43Å; C283-C346 CovalentContact SG-SG 2.04Å; C283-C346 PolarHBondContact SG-SG 3.1Å; C283-C379 WeakPolarHBondContact CB-SG 3.45Å
284	C	79.3	Confident	74.8	Confident	12 Å²	12	76.3 Å²	76.3	8%	0.081	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	165.6	178.1	-163.1	0	0	0	0	113.3	E274 C276 N282 M313	E274-C284 PolarHBondContact O-SG 3.38Å; C276-C284 HydrophobicContact CB-CB 3.59Å; C276-C284 WeakPolarHBondContact CB-SG 2.96Å; C276-C284 PolarHBondContact N-SG 2.93Å; C276-C284 VanDerWaalsContact N-SG 3.37Å; C276-C284 WeakPolarHBondContact SG-CB 3.34Å; C276-C284 CovalentContact SG-SG 2Å; C276-C284 PolarHBondContact SG-SG 2.93Å; N282-C284 PolarHBondContact O-N 2.81Å; N282-C284 VanDerWaalsContact O-N 3.07Å; C284-M313 PolarHBondContact N-O 3.1Å; C284-M313 PolarHBondContact O-N 2.71Å
285	V	83.4	Confident	76.5	Confident	4 Å²	4	71 Å²	71	2%	0.024	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127	171.9	-175	0	0	0	0	109	N310 V374 C377	V285-N310 HydrophobicContact CG1-CB 3.79Å; V285-V374 HydrophobicContact CG1-CG1 4.46Å; V285-V374 HydrophobicContact CG2-CG1 4.39Å; V285-C377 HydrophobicContact CG2-CB 4.23Å; V285-C377 WeakPolarHBondContact CG2-SG 3.43Å
286	R	83.6	Confident	78	Confident	25 Å²	25	66.5 Å²	66.5	9%	0.094	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	141.8	172.5	-58.4	-50.8	-166	111.2	-2.4	110.1	T277 A278 T280 N310 Y311 M313	T277-R286 PolarHBondContact O-NH1 3.46Å; A278-R286 VanDerWaalsContact C-NH1 3.34Å; A278-R286 PolarHBondContact O-NH1 2.93Å; A278-R286 PolarHBondContact O-NH2 3.06Å; A278-R286 VanDerWaalsContact O-NH2 3.12Å; T280-R286 PolarHBondContact O-NH2 3.47Å; T280-R286 PolarHBondContact OG1-NH2 2.96Å; R286-N310 VanDerWaalsContact O-CA 3.28Å; R286-N310 WeakPolarHBondContact O-CA 3.35Å; R286-N310 WeakPolarHBondContact O-CB 3.4Å; R286-Y311 HydrophobicContact CB-CD1 4Å; R286-Y311 HydrophobicContact CB-CD2 4.45Å; R286-Y311 HydrophobicContact CB-CE1 3.53Å; R286-Y311 HydrophobicContact CB-CE2 4.05Å; R286-Y311 HydrophobicContact CB-CG 4.44Å; R286-Y311 HydrophobicContact CG-CE2 4.35Å; R286-Y311 PolarHBondContact N-O 2.04Å; R286-Y311 PolarHBondContact O-N 2.84Å; R286-M313 HydrophobicContact CG-CB 4.11Å; R286-M313 HydrophobicContact CG-CE 4.12Å
287	S	85.6	Confident	79	Confident	88 Å²	88	67.4 Å²	67.4	62%	0.615	36%	0.359	S	S	*	.			trans	-72.9	130.9	-179.1	55.3	0	0	0	0	111.2	N310	S287-N310 WeakPolarHBondContact CA-OD1 3.49Å
288	L	87.4	Confident	80.4	Confident	8 Å²	8	63.3 Å²	63.3	4%	0.042	33%	0.333	C	S	.	.			trans	-143	112.5	173.8	175.2	62.7	0	0	0	108.7	R32 R35 I290 L308 A309 N310 Y311	R32-L288 HydrophobicContact CG-CD1 3.72Å; R35-L288 HydrophobicContact CB-CD2 4.14Å; R35-L288 HydrophobicContact CG-CD2 3.7Å; L288-I290 HydrophobicContact CD2-CD1 4.19Å; L288-I290 HydrophobicContact CD2-CG1 4.27Å; L288-I290 HydrophobicContact CG-CD1 4.45Å; L288-I290 HydrophobicContact CG-CG1 4.02Å; L288-L308 CarbonylContact O-C 3.57Å; L288-A309 PolarHBondContact O-N 2.88Å; L288-N310 PolarHBondContact N-OD1 3.05Å; L288-N310 PolarHBondContact O-N 2.79Å; L288-Y311 HydrophobicContact CB-CD1 3.61Å; L288-Y311 HydrophobicContact CB-CE1 3.95Å; L288-Y311 HydrophobicContact CD2-CD1 4.06Å; L288-Y311 HydrophobicContact CG-CD1 4.43Å
289	Y	89.8	Confident	81.7	Confident	113 Å²	113	66.3 Å²	66.3	44%	0.443	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132	169	-172.8	-98.3	0	0	0	109.2	D291 G306 Y307	Y289-D291 HydrophobicContact CE1-CB 4.1Å; Y289-G306 VanDerWaalsContact OH-CA 3.32Å; Y289-G306 WeakPolarHBondContact OH-CA 3.47Å; Y289-Y307 WeakPolarHBondContact CD2-O 3.37Å
290	I	89.8	Confident	83	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.3	176	-60.6	-179.9	0	0	0	107.8	I36 I39 L288 D295 L296 G306 Y307 A309	I36-I290 HydrophobicContact CG1-CD1 4.27Å; I36-I290 HydrophobicContact CG1-CG1 4.45Å; I39-I290 HydrophobicContact CB-CD1 4.41Å; I39-I290 HydrophobicContact CD1-CD1 3.2Å; I39-I290 HydrophobicContact CG1-CD1 4.37Å; I39-I290 HydrophobicContact CG2-CD1 4.29Å; L288-I290 HydrophobicContact CD2-CD1 4.19Å; L288-I290 HydrophobicContact CD2-CG1 4.27Å; L288-I290 HydrophobicContact CG-CD1 4.45Å; L288-I290 HydrophobicContact CG-CG1 4.02Å; I290-D295 WeakPolarHBondContact CA-OD2 3.29Å; I290-D295 HydrophobicContact CG2-CB 4.23Å; I290-L296 HydrophobicContact CG2-CD1 3.97Å; I290-L296 HydrophobicContact CG2-CG 4.3Å; I290-G306 CarbonylContact O-C 3.55Å; I290-G306 WeakPolarHBondContact O-CA 2.91Å; I290-Y307 HydrophobicContact CB-CE1 4.49Å; I290-Y307 PolarHBondContact N-O 3.26Å; I290-Y307 PolarHBondContact O-N 3.41Å; I290-A309 HydrophobicContact CD1-CB 3.69Å; I290-A309 HydrophobicContact CG1-CB 4.16Å
291	D	89.4	Confident	84.2	Confident	42 Å²	42	57.4 Å²	57.4	23%	0.225	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.6	170.2	-174.1	-44.4	0	0	0	108.9	Y289 R293 K294 D295	Y289-D291 HydrophobicContact CE1-CB 4.1Å; D291-R293 PolarHBondContact O-N 2.02Å; D291-R293 WeakPolarHBondContact OD1-CA 3.3Å; D291-R293 WeakPolarHBondContact OD1-CB 3.46Å; D291-R293 PolarHBondContact OD1-N 2.83Å; D291-K294 HydrophobicContact CB-CB 3.9Å; D291-K294 PolarHBondContact O-N 3.38Å; D291-K294 PolarHBondContact OD1-N 3.07Å; D291-K294 VanDerWaalsContact OD1-N 3.12Å; D291-D295 PolarHBondContact N-OD2 2.99Å; D291-D295 WeakPolarHBondContact O-CB 3.31Å; D291-D295 PolarHBondContact O-N 2.97Å
292	F	89.8	Confident	85.1	Confident	1 Å²	1	51.6 Å²	51.6	0%	0.004	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-34	-177.9	-68.9	-65	0	0	0	112.1	I43 L296 G297 W298 I301 P304 T305 Y307 L354	I43-F292 HydrophobicContact CD1-CE1 3.79Å; F292-L296 HydrophobicContact CD1-CD1 3.7Å; F292-L296 HydrophobicContact CE1-CD1 4.17Å; F292-L296 CarbonylContact O-C 3.46Å; F292-L296 WeakPolarHBondContact O-CB 3.16Å; F292-G297 PolarHBondContact O-N 2.95Å; F292-G297 VanDerWaalsContact O-N 3.12Å; F292-W298 HydrophobicContact CB-CB 4.44Å; F292-W298 AromaticContact CD1-CE3 3.95Å; F292-W298 HydrophobicContact CD1-CE3 3.95Å; F292-W298 HydrophobicContact CD1-CZ3 4.43Å; F292-W298 HydrophobicContact CE1-CE3 4.49Å; F292-W298 PolarHBondContact O-N 3.08Å; F292-I301 HydrophobicContact CD1-CD1 3.83Å; F292-I301 HydrophobicContact CD2-CB 4.46Å; F292-I301 HydrophobicContact CD2-CG2 3.99Å; F292-I301 HydrophobicContact CE1-CD1 3.77Å; F292-I301 HydrophobicContact CE2-CG2 4.01Å; F292-I301 HydrophobicContact CG-CB 4.44Å; F292-I301 HydrophobicContact CG-CD1 4.3Å; F292-I301 HydrophobicContact CG-CG2 4.44Å; F292-I301 HydrophobicContact CZ-CD1 4.17Å; F292-I301 HydrophobicContact CZ-CG2 4.49Å; F292-P304 WeakPolarHBondContact CD2-O 3.49Å; F292-P304 HydrophobicContact CE2-CG 4.17Å; F292-P304 WeakPolarHBondContact CE2-O 2.94Å; F292-T305 WeakPolarHBondContact CD2-O 2.8Å; F292-T305 PolarHBondContact N-O 3.37Å; F292-T305 VanDerWaalsContact N-O 3.09Å; F292-Y307 HydrophobicContact CE1-CD1 4.32Å; F292-Y307 HydrophobicContact CE1-CE1 4.03Å; F292-Y307 HydrophobicContact CE2-CD1 4.08Å; F292-Y307 AromaticContact CZ-CD1 3.62Å; F292-Y307 HydrophobicContact CZ-CD1 3.62Å; F292-Y307 AromaticContact CZ-CE1 3.7Å; F292-Y307 HydrophobicContact CZ-CE1 3.7Å; F292-L354 HydrophobicContact CZ-CD2 4.32Å
293	R	87.4	Confident	85.7	Confident	161 Å²	161	50.8 Å²	50.8	61%	0.608	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-45.9	179.9	-72.9	-167.5	-85.9	-154.9	-4.1	111.8	D291 G297 W298	D291-R293 PolarHBondContact O-N 2.02Å; D291-R293 WeakPolarHBondContact OD1-CA 3.3Å; D291-R293 WeakPolarHBondContact OD1-CB 3.46Å; D291-R293 PolarHBondContact OD1-N 2.83Å; R293-G297 VanDerWaalsContact O-CA 3.29Å; R293-G297 WeakPolarHBondContact O-CA 3.48Å; R293-G297 PolarHBondContact O-N 3.3Å; R293-W298 WeakPolarHBondContact CG-O 3.45Å
294	K	86.9	Confident	86.4	Confident	176 Å²	176	50.4 Å²	50.4	77%	0.765	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-46.5	-174.5	-168.6	-175.9	175.9	-179.6	0	113	D291	D291-K294 HydrophobicContact CB-CB 3.9Å; D291-K294 PolarHBondContact O-N 3.38Å; D291-K294 PolarHBondContact OD1-N 3.07Å; D291-K294 VanDerWaalsContact OD1-N 3.12Å
295	D	86.8	Confident	86.8	Confident	47 Å²	47	52.7 Å²	52.7	25%	0.251	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-30	-170.4	-58.2	-46.5	0	0	0	112.4	I36 I290 D291	I36-D295 HydrophobicContact CD1-CB 4.32Å; I36-D295 HydrophobicContact CG2-CB 4.4Å; I290-D295 WeakPolarHBondContact CA-OD2 3.29Å; I290-D295 HydrophobicContact CG2-CB 4.23Å; D291-D295 PolarHBondContact N-OD2 2.99Å; D291-D295 WeakPolarHBondContact O-CB 3.31Å; D291-D295 PolarHBondContact O-N 2.97Å
296	L	85.6	Confident	87.1	Confident	10 Å²	10	52.9 Å²	52.9	5%	0.052	27%	0.265	C	S	.	.	S	Bend	trans	-108.9	-12.7	-178.7	-67.7	168.7	0	0	0	113.9	I36 R40 I290 F292 W298	I36-L296 HydrophobicContact CG2-CD2 3.67Å; I36-L296 HydrophobicContact CG2-CG 4.27Å; R40-L296 HydrophobicContact CB-CD2 3.64Å; R40-L296 HydrophobicContact CG-CD2 3.95Å; I290-L296 HydrophobicContact CG2-CD1 3.97Å; I290-L296 HydrophobicContact CG2-CG 4.3Å; F292-L296 HydrophobicContact CD1-CD1 3.7Å; F292-L296 HydrophobicContact CE1-CD1 4.17Å; F292-L296 CarbonylContact O-C 3.46Å; F292-L296 WeakPolarHBondContact O-CB 3.16Å; L296-W298 HydrophobicContact CB-CB 4.46Å; L296-W298 HydrophobicContact CB-CD2 3.92Å; L296-W298 HydrophobicContact CB-CE3 4.27Å; L296-W298 HydrophobicContact CB-CG 3.99Å; L296-W298 HydrophobicContact CD1-CD2 4.36Å; L296-W298 HydrophobicContact CD1-CE3 3.9Å; L296-W298 HydrophobicContact CD1-CH2 4.5Å; L296-W298 HydrophobicContact CD1-CZ3 3.96Å; L296-W298 PolarHBondContact O-N 3.44Å
297	G	84.9	Confident	87.5	Confident	57 Å²	57	52.3 Å²	52.3	59%	0.588	26%	0.263	S	S	*	.			trans	66.3	19.4	-176.6	0	0	0	0	0	113.8	F292 R293	F292-G297 PolarHBondContact O-N 2.95Å; F292-G297 VanDerWaalsContact O-N 3.12Å; R293-G297 VanDerWaalsContact O-CA 3.29Å; R293-G297 WeakPolarHBondContact O-CA 3.48Å; R293-G297 PolarHBondContact O-N 3.3Å
298	W	86.9	Confident	87.7	Confident	7 Å²	7	52.2 Å²	52.2	3%	0.027	26%	0.255	C	S	.	.			trans	-92.7	125.8	-175.4	-69.6	-6.2	0	0	0	111.8	R40 I43 L44 F292 R293 L296 W300 I301	R40-W298 HydrophobicContact CB-CH2 4.48Å; R40-W298 HydrophobicContact CB-CZ2 4.32Å; R40-W298 HydrophobicContact CG-CH2 3.99Å; R40-W298 HydrophobicContact CG-CZ2 3.39Å; I43-W298 HydrophobicContact CB-CH2 3.92Å; I43-W298 HydrophobicContact CB-CZ3 3.98Å; I43-W298 HydrophobicContact CD1-CH2 4.3Å; I43-W298 HydrophobicContact CD1-CZ3 3.71Å; I43-W298 HydrophobicContact CG1-CZ3 4.44Å; I43-W298 HydrophobicContact CG2-CH2 4Å; I43-W298 HydrophobicContact CG2-CZ3 3.77Å; L44-W298 HydrophobicContact CD1-CZ2 4.17Å; L44-W298 HydrophobicContact CD2-CH2 4.43Å; L44-W298 HydrophobicContact CD2-CZ2 4.23Å; L44-W298 HydrophobicContact CG-CH2 4.14Å; L44-W298 HydrophobicContact CG-CZ2 4.01Å; F292-W298 HydrophobicContact CB-CB 4.44Å; F292-W298 AromaticContact CD1-CE3 3.95Å; F292-W298 HydrophobicContact CD1-CE3 3.95Å; F292-W298 HydrophobicContact CD1-CZ3 4.43Å; F292-W298 HydrophobicContact CE1-CE3 4.49Å; F292-W298 PolarHBondContact O-N 3.08Å; R293-W298 WeakPolarHBondContact CG-O 3.45Å; L296-W298 HydrophobicContact CB-CB 4.46Å; L296-W298 HydrophobicContact CB-CD2 3.92Å; L296-W298 HydrophobicContact CB-CE3 4.27Å; L296-W298 HydrophobicContact CB-CG 3.99Å; L296-W298 HydrophobicContact CD1-CD2 4.36Å; L296-W298 HydrophobicContact CD1-CE3 3.9Å; L296-W298 HydrophobicContact CD1-CH2 4.5Å; L296-W298 HydrophobicContact CD1-CZ3 3.96Å; L296-W298 PolarHBondContact O-N 3.44Å; W298-W300 AromaticContact CD1-NE1 3.61Å; W298-W300 AromaticContact CD2-CE2 3.9Å; W298-W300 AromaticContact CD2-CZ2 3.83Å; W298-W300 HydrophobicContact CD2-CZ2 3.83Å; W298-W300 AromaticContact CD2-NE1 3.49Å; W298-W300 AromaticContact CE2-NE1 3.93Å; W298-W300 AromaticContact CE3-CZ2 3.59Å; W298-W300 HydrophobicContact CE3-CZ2 3.59Å; W298-W300 HydrophobicContact CG-CZ2 4.49Å; W298-W300 AromaticContact CG-NE1 3.25Å; W298-W300 VanDerWaalsContact CG-NE1 3.25Å; W298-W300 HydrophobicContact CH2-CZ2 4.07Å; W298-W300 HydrophobicContact CZ2-CZ2 4.27Å; W298-W300 HydrophobicContact CZ3-CH2 4.43Å; W298-W300 AromaticContact CZ3-CZ2 3.73Å; W298-W300 HydrophobicContact CZ3-CZ2 3.73Å; W298-W300 AromaticContact NE1-NE1 3.98Å; W298-I301 HydrophobicContact CE3-CD1 3.65Å; W298-I301 HydrophobicContact CE3-CG1 4.44Å; W298-I301 HydrophobicContact CZ3-CD1 3.93Å
299	K	82.6	Confident	87.7	Confident	143 Å²	143	51.8 Å²	51.8	62%	0.622	25%	0.253	S	S	*	.			trans	-106.4	-12.3	174.2	-62.5	-178.7	-178.7	178.4	0	113.5	H302	K299-H302 PolarHBondContact O-CE1 2.8Å
300	W	83.7	Confident	87.7	Confident	5 Å²	5	47 Å²	47	2%	0.019	24%	0.235	C	C	.	.	S	Bend	trans	-78.9	-23	-175.5	61	-89.4	0	0	0	113.4	I43 L44 L47 L49 P53 W298 H302 Y358 Y359	I43-W300 HydrophobicContact CG2-CH2 4.18Å; L44-W300 HydrophobicContact CD2-CZ2 4.36Å; L47-W300 HydrophobicContact CD1-CH2 3.56Å; L47-W300 HydrophobicContact CD1-CZ3 3.81Å; L49-W300 HydrophobicContact CD1-CH2 4.36Å; L49-W300 HydrophobicContact CD1-CZ3 4.33Å; P53-W300 HydrophobicContact CB-CB 4.46Å; P53-W300 HydrophobicContact CG-CD2 4.26Å; P53-W300 HydrophobicContact CG-CE3 4.34Å; P53-W300 HydrophobicContact CG-CG 4.32Å; W298-W300 AromaticContact CD1-NE1 3.61Å; W298-W300 AromaticContact CD2-CE2 3.9Å; W298-W300 AromaticContact CD2-CZ2 3.83Å; W298-W300 HydrophobicContact CD2-CZ2 3.83Å; W298-W300 AromaticContact CD2-NE1 3.49Å; W298-W300 AromaticContact CE2-NE1 3.93Å; W298-W300 AromaticContact CE3-CZ2 3.59Å; W298-W300 HydrophobicContact CE3-CZ2 3.59Å; W298-W300 HydrophobicContact CG-CZ2 4.49Å; W298-W300 AromaticContact CG-NE1 3.25Å; W298-W300 VanDerWaalsContact CG-NE1 3.25Å; W298-W300 HydrophobicContact CH2-CZ2 4.07Å; W298-W300 HydrophobicContact CZ2-CZ2 4.27Å; W298-W300 HydrophobicContact CZ3-CH2 4.43Å; W298-W300 AromaticContact CZ3-CZ2 3.73Å; W298-W300 HydrophobicContact CZ3-CZ2 3.73Å; W298-W300 AromaticContact NE1-NE1 3.98Å; W300-H302 PolarHBondContact O-ND1 3.34Å; W300-Y358 AromaticContact CE3-CD2 3.68Å; W300-Y358 HydrophobicContact CE3-CD2 3.68Å; W300-Y358 HydrophobicContact CE3-CG 4.03Å; W300-Y358 AromaticContact CZ3-CD2 3.46Å; W300-Y358 HydrophobicContact CZ3-CD2 3.46Å; W300-Y358 VanDerWaalsContact CZ3-CD2 3.46Å; W300-Y358 HydrophobicContact CZ3-CE2 4.17Å; W300-Y358 AromaticContact CZ3-CG 3.75Å; W300-Y358 HydrophobicContact CZ3-CG 3.75Å; W300-Y358 WeakPolarHBondContact O-CA 3.39Å; W300-Y359 WeakPolarHBondContact CA-OH 3.5Å; W300-Y359 HydrophobicContact CB-CE2 4.05Å
301	I	86.6	Confident	87.4	Confident	9 Å²	9	48.1 Å²	48.1	5%	0.046	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.6	169.8	-57.5	-177.3	0	0	0	109.4	F292 W298	F292-I301 HydrophobicContact CD1-CD1 3.83Å; F292-I301 HydrophobicContact CD2-CB 4.46Å; F292-I301 HydrophobicContact CD2-CG2 3.99Å; F292-I301 HydrophobicContact CE1-CD1 3.77Å; F292-I301 HydrophobicContact CE2-CG2 4.01Å; F292-I301 HydrophobicContact CG-CB 4.44Å; F292-I301 HydrophobicContact CG-CD1 4.3Å; F292-I301 HydrophobicContact CG-CG2 4.44Å; F292-I301 HydrophobicContact CZ-CD1 4.17Å; F292-I301 HydrophobicContact CZ-CG2 4.49Å; W298-I301 HydrophobicContact CE3-CD1 3.65Å; W298-I301 HydrophobicContact CE3-CG1 4.44Å; W298-I301 HydrophobicContact CZ3-CD1 3.93Å
302	H	86.1	Confident	87.1	Confident	41 Å²	41	47.1 Å²	47.1	19%	0.19	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-41.8	-174.1	-74.1	46.8	0	0	0	112.3	I64 K299 W300 L357 Y359	I64-H302 HydrophobicContact CD1-CB 3.88Å; K299-H302 PolarHBondContact O-CE1 2.8Å; W300-H302 PolarHBondContact O-ND1 3.34Å; H302-L357 PolarHBondContact N-O 2.92Å; H302-Y359 AromaticContact CE1-CD1 3.67Å; H302-Y359 AromaticContact CE1-CE1 2.95Å; H302-Y359 WeakPolarHBondContact CE1-CE1 3.49Å; H302-Y359 AromaticContact CE1-CZ 3.55Å; H302-Y359 PolarHBondContact CE1-OH 3.08Å; H302-Y359 AromaticContact ND1-CE1 3.76Å; H302-Y359 AromaticContact NE2-CE1 3.45Å; H302-Y359 WeakPolarHBondContact NE2-CE1 3.46Å
303	K	87.5	Confident	86.7	Confident	89 Å²	89	48.6 Å²	48.6	39%	0.387	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	138.9	176.3	-63.7	-69.3	-176.9	-179.8	0	110.6	Y72 I356 L357	Y72-K303 HydrophobicContact CD1-CB 4.24Å; Y72-K303 HydrophobicContact CD2-CB 4.3Å; Y72-K303 HydrophobicContact CE1-CB 3.86Å; Y72-K303 HydrophobicContact CE1-CG 4.5Å; Y72-K303 HydrophobicContact CE2-CB 3.92Å; Y72-K303 HydrophobicContact CG-CB 4.45Å; K303-I356 WeakPolarHBondContact O-CA 2.95Å; K303-L357 HydrophobicContact CB-CB 4.18Å; K303-L357 HydrophobicContact CB-CD2 4.49Å; K303-L357 HydrophobicContact CG-CD2 4.36Å; K303-L357 PolarHBondContact N-O 3.44Å; K303-L357 PolarHBondContact O-N 3.11Å
304	P	90.7	Very high	86.3	Confident	20 Å²	20	41.9 Å²	41.9	13%	0.13	22%	0.224	C	C	.	.			cis	-72	166.7	-11.5	30.9	-29.8	0	0	0	111	Y72 F292 G306 L354 P355	Y72-P304 WeakPolarHBondContact OH-CD 3.48Å; F292-P304 WeakPolarHBondContact CD2-O 3.49Å; F292-P304 HydrophobicContact CE2-CG 4.17Å; F292-P304 WeakPolarHBondContact CE2-O 2.94Å; P304-G306 PolarHBondContact O-N 3.46Å; P304-L354 HydrophobicContact CG-CD1 4.16Å; P304-P355 WeakPolarHBondContact CD-O 3.14Å
305	T	88.8	Confident	85.7	Confident	60 Å²	60	35.5 Å²	35.5	37%	0.368	20%	0.201	S	C	.	.	S	Bend	trans	-72.4	-22.9	174.5	50.3	0	0	0	0	112.6	F292	F292-T305 WeakPolarHBondContact CD2-O 2.8Å; F292-T305 PolarHBondContact N-O 3.37Å; F292-T305 VanDerWaalsContact N-O 3.09Å
306	G	89.1	Confident	85.1	Confident	9 Å²	9	33.5 Å²	33.5	9%	0.093	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	168.2	175.4	0	0	0	0	0	109.7	Y289 I290 P304	Y289-G306 VanDerWaalsContact OH-CA 3.32Å; Y289-G306 WeakPolarHBondContact OH-CA 3.47Å; I290-G306 CarbonylContact O-C 3.55Å; I290-G306 WeakPolarHBondContact O-CA 2.91Å; P304-G306 PolarHBondContact O-N 3.46Å
307	Y	91.9	Very high	84.2	Confident	12 Å²	12	37.5 Å²	37.5	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	161.3	-177.1	75	-75.7	0	0	0	111.6	I39 Y289 I290 F292 A309 L354 M372 I373	I39-Y307 VanDerWaalsContact CG2-OH 3.3Å; I39-Y307 WeakPolarHBondContact CG2-OH 3.43Å; Y289-Y307 WeakPolarHBondContact CD2-O 3.37Å; I290-Y307 HydrophobicContact CB-CE1 4.49Å; I290-Y307 PolarHBondContact N-O 3.26Å; I290-Y307 PolarHBondContact O-N 3.41Å; F292-Y307 HydrophobicContact CE1-CD1 4.32Å; F292-Y307 HydrophobicContact CE1-CE1 4.03Å; F292-Y307 HydrophobicContact CE2-CD1 4.08Å; F292-Y307 AromaticContact CZ-CD1 3.62Å; F292-Y307 HydrophobicContact CZ-CD1 3.62Å; F292-Y307 AromaticContact CZ-CE1 3.7Å; F292-Y307 HydrophobicContact CZ-CE1 3.7Å; Y307-A309 HydrophobicContact CD2-CB 4.13Å; Y307-A309 VanDerWaalsContact CE2-CA 3.44Å; Y307-A309 HydrophobicContact CE2-CB 3.43Å; Y307-A309 VanDerWaalsContact CE2-CB 3.43Å; Y307-A309 PolarHBondContact O-N 2.96Å; Y307-L354 HydrophobicContact CD1-CD2 3.67Å; Y307-L354 HydrophobicContact CD2-CD1 4.19Å; Y307-L354 HydrophobicContact CD2-CD2 3.9Å; Y307-L354 HydrophobicContact CE1-CD2 3.82Å; Y307-L354 HydrophobicContact CE2-CD2 4.02Å; Y307-L354 HydrophobicContact CG-CD1 4.05Å; Y307-L354 HydrophobicContact CG-CD2 3.72Å; Y307-M372 HydrophobicContact CE2-CB 4.36Å; Y307-M372 VanDerWaalsContact OH-CE 3.29Å; Y307-M372 WeakPolarHBondContact OH-CE 3.42Å; Y307-I373 HydrophobicContact CD2-CD1 4.39Å; Y307-I373 HydrophobicContact CD2-CG1 3.78Å; Y307-I373 HydrophobicContact CE2-CG1 4.02Å
308	L	89.3	Confident	83	Confident	86 Å²	86	37.4 Å²	37.4	45%	0.45	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	90.2	177	-163.4	79.2	0	0	0	109.2	L288 N310 I373	L288-L308 CarbonylContact O-C 3.57Å; L308-N310 WeakPolarHBondContact CD2-OD1 3.32Å; L308-N310 WeakPolarHBondContact CG-OD1 3.25Å; L308-I373 WeakPolarHBondContact O-CG2 3.22Å
309	A	87.6	Confident	81.4	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.224	C	C	.	.			trans	-71.4	-34.1	-177.5	0	0	0	0	0	112.8	I39 L288 I290 Y307 V374	I39-A309 HydrophobicContact CD1-CB 3.66Å; L288-A309 PolarHBondContact O-N 2.88Å; I290-A309 HydrophobicContact CD1-CB 3.69Å; I290-A309 HydrophobicContact CG1-CB 4.16Å; Y307-A309 HydrophobicContact CD2-CB 4.13Å; Y307-A309 VanDerWaalsContact CE2-CA 3.44Å; Y307-A309 HydrophobicContact CE2-CB 3.43Å; Y307-A309 VanDerWaalsContact CE2-CB 3.43Å; Y307-A309 PolarHBondContact O-N 2.96Å; A309-V374 PolarHBondContact O-N 2.82Å
310	N	89.5	Confident	79.7	Confident	11 Å²	11	45 Å²	45	6%	0.059	23%	0.23	C	C	.	.			trans	54.9	166.4	-171.1	-61.3	-27.5	0	0	0	113.3	R35 V285 R286 S287 L288 L308 V374	R35-N310 PolarHBondContact NE-O 3.14Å; V285-N310 HydrophobicContact CG1-CB 3.79Å; R286-N310 VanDerWaalsContact O-CA 3.28Å; R286-N310 WeakPolarHBondContact O-CA 3.35Å; R286-N310 WeakPolarHBondContact O-CB 3.4Å; S287-N310 WeakPolarHBondContact CA-OD1 3.49Å; L288-N310 PolarHBondContact N-OD1 3.05Å; L288-N310 PolarHBondContact O-N 2.79Å; L308-N310 WeakPolarHBondContact CD2-OD1 3.32Å; L308-N310 WeakPolarHBondContact CG-OD1 3.25Å; N310-V374 HydrophobicContact CB-CB 3.88Å; N310-V374 WeakPolarHBondContact CB-O 3.17Å; N310-V374 PolarHBondContact ND2-O 3.31Å
311	Y	85.3	Confident	77.9	Confident	24 Å²	24	51.6 Å²	51.6	9%	0.094	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	156	174.2	66.6	-74.9	0	0	0	111.1	V31 R286 L288 M313	V31-Y311 HydrophobicContact CG1-CD2 3.82Å; V31-Y311 HydrophobicContact CG1-CE2 3.77Å; R286-Y311 HydrophobicContact CB-CD1 4Å; R286-Y311 HydrophobicContact CB-CD2 4.45Å; R286-Y311 HydrophobicContact CB-CE1 3.53Å; R286-Y311 HydrophobicContact CB-CE2 4.05Å; R286-Y311 HydrophobicContact CB-CG 4.44Å; R286-Y311 HydrophobicContact CG-CE2 4.35Å; R286-Y311 PolarHBondContact N-O 2.04Å; R286-Y311 PolarHBondContact O-N 2.84Å; L288-Y311 HydrophobicContact CB-CD1 3.61Å; L288-Y311 HydrophobicContact CB-CE1 3.95Å; L288-Y311 HydrophobicContact CD2-CD1 4.06Å; L288-Y311 HydrophobicContact CG-CD1 4.43Å; Y311-M313 HydrophobicContact CD2-CB 3.94Å; Y311-M313 HydrophobicContact CE2-CB 3.7Å; Y311-M313 HydrophobicContact CE2-CG 4.27Å; Y311-M313 HydrophobicContact CE2-SD 3.77Å
312	C	82.4	Confident	76.2	Confident	22 Å²	22	52.4 Å²	52.4	15%	0.149	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.7	175.4	-65.5	0	0	0	0	109.9	V347 P348 C377	C312-V347 VanDerWaalsContact SG-C 3.53Å; C312-P348 WeakPolarHBondContact SG-CA 3.28Å; C312-C377 WeakPolarHBondContact CA-SG 3.47Å; C312-C377 HydrophobicContact CB-CB 3.8Å; C312-C377 WeakPolarHBondContact CB-SG 3.43Å; C312-C377 WeakPolarHBondContact SG-CB 3.34Å; C312-C377 CovalentContact SG-SG 2.02Å; C312-C377 PolarHBondContact SG-SG 2.82Å
313	M	81.4	Confident	74.6	Confident	31 Å²	31	59.9 Å²	59.9	15%	0.153	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	145.9	176.3	-170.1	-172.8	76.1	0	0	110.5	L28 C284 R286 Y311	L28-M313 HydrophobicContact CD2-CE 3.17Å; L28-M313 HydrophobicContact CD2-SD 3.52Å; L28-M313 VanDerWaalsContact CD2-SD 3.52Å; C284-M313 PolarHBondContact N-O 3.1Å; C284-M313 PolarHBondContact O-N 2.71Å; R286-M313 HydrophobicContact CG-CB 4.11Å; R286-M313 HydrophobicContact CG-CE 4.12Å; Y311-M313 HydrophobicContact CD2-CB 3.94Å; Y311-M313 HydrophobicContact CE2-CB 3.7Å; Y311-M313 HydrophobicContact CE2-CG 4.27Å; Y311-M313 HydrophobicContact CE2-SD 3.77Å
314	G	78.3	Confident	73.1	Confident	20 Å²	20	59.8 Å²	59.8	21%	0.206	31%	0.313	C	S	.	.	S	Bend	trans	139	164.5	175.7	0	0	0	0	0	110.9
315	S	75.6	Confident	71.5	Confident	43 Å²	43	67.1 Å²	67.1	30%	0.301	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-75.8	138.7	177.3	67.3	0	0	0	0	110.5	E281 C283	E281-S315 WeakPolarHBondContact O-CB 3.44Å; E281-S315 PolarHBondContact O-N 2.95Å; E281-S315 PolarHBondContact O-OG 3.07Å; C283-S315 PolarHBondContact N-O 3Å
316	C	72.6	Confident	70.1	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.027	36%	0.357	C	S	.	.			trans	-106.9	113.4	169.6	-73.6	0	0	0	0	107.8	C283 P344 C379	C283-C316 VanDerWaalsContact CB-SG 3.52Å; C316-P344 HydrophobicContact CB-CB 3.87Å; C316-P344 HydrophobicContact CB-CG 3.63Å; C316-P344 WeakPolarHBondContact CB-O 3.34Å; C316-C379 VanDerWaalsContact CA-SG 3.59Å; C316-C379 HydrophobicContact CB-CB 3.65Å; C316-C379 WeakPolarHBondContact CB-SG 3.36Å; C316-C379 WeakPolarHBondContact SG-CA 3.4Å; C316-C379 WeakPolarHBondContact SG-CB 3.28Å; C316-C379 CovalentContact SG-SG 2.03Å; C316-C379 PolarHBondContact SG-SG 3.46Å
317	T	67.9	Low	68.5	Low	94 Å²	94	73.8 Å²	73.8	58%	0.577	37%	0.365	S	S	*	.			trans	-81.7	150.8	169.9	54.8	0	0	0	0	109.5	I319	T317-I319 PolarHBondContact O-N 2.63Å
318	Y	60	Low	67	Low	55 Å²	55	77.5 Å²	77.5	22%	0.216	38%	0.383	C	S	.	.			trans	-71.7	99.8	169.6	-80.3	-80.2	0	0	0	108.2	W320 L330 A331 K334 A342 Q343 P344	Y318-W320 PolarHBondContact O-N 3.29Å; Y318-L330 HydrophobicContact CE1-CB 3.96Å; Y318-L330 HydrophobicContact CE1-CD2 3.85Å; Y318-L330 HydrophobicContact CE1-CG 3.81Å; Y318-L330 WeakPolarHBondContact OH-CD2 3.41Å; Y318-L330 WeakPolarHBondContact OH-CG 3.04Å; Y318-A331 HydrophobicContact CD1-CB 3.81Å; Y318-A331 HydrophobicContact CG-CB 4.18Å; Y318-K334 HydrophobicContact CD2-CD 3.92Å; Y318-K334 HydrophobicContact CE2-CD 3.45Å; Y318-K334 VanDerWaalsContact CE2-CD 3.45Å; Y318-A342 PolarHBondContact OH-O 3.47Å; Y318-Q343 WeakPolarHBondContact OH-CA 3.43Å; Y318-Q343 PolarHBondContact OH-N 3.47Å; Y318-P344 HydrophobicContact CE1-CG 4.37Å; Y318-P344 VanDerWaalsContact CE2-CD 3.41Å; Y318-P344 HydrophobicContact CE2-CG 4.44Å; Y318-P344 WeakPolarHBondContact OH-CD 3.37Å
319	I	53.6	Low	65.7	Low	110 Å²	110	78.6 Å²	78.6	56%	0.564	39%	0.388	S	S	*	.			trans	-80.5	118.8	174	-47.7	176.9	0	0	0	106.8	T317 N321 A322	T317-I319 PolarHBondContact O-N 2.63Å; I319-N321 HydrophobicContact CG2-CB 4.06Å; I319-N321 PolarHBondContact O-N 3.12Å; I319-A322 PolarHBondContact O-N 3.39Å
320	W	45.2	Very low	64.4	Low	199 Å²	199	80.3 Å²	80.3	75%	0.754	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-12	174.6	-85.1	-35.6	0	0	0	113.8	Y318	Y318-W320 PolarHBondContact O-N 3.29Å
321	N	47.6	Very low	63	Low	145 Å²	145	80.1 Å²	80.1	78%	0.775	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	36.6	-178.6	-61.4	-9.4	0	0	0	113.1	I319	I319-N321 HydrophobicContact CG2-CB 4.06Å; I319-N321 PolarHBondContact O-N 3.12Å
322	A	50	Low	61.9	Low	25 Å²	25	84.3 Å²	84.3	21%	0.207	42%	0.42	C	S	.	.			trans	-78.9	121.9	171.7	0	0	0	0	0	110.1	I319 N324 Q328	I319-A322 PolarHBondContact O-N 3.39Å; A322-N324 PolarHBondContact O-N 2Å; A322-Q328 PolarHBondContact O-NE2 3.15Å
323	E	51.9	Low	61	Low	199 Å²	199	89.6 Å²	89.6	93%	0.93	44%	0.438	S	S	*	.	S	Bend	trans	-56.7	-13.3	171	-68.6	176.3	155.1	0	0	113.2
324	N	56.6	Low	59.9	Low	87 Å²	87	91.6 Å²	91.6	47%	0.465	45%	0.446	S	S	.	.	S	Bend	trans	-95.4	119.3	177.1	-68.2	-52	0	0	0	111.4	A322 Y326 S327	A322-N324 PolarHBondContact O-N 2Å; N324-Y326 PolarHBondContact O-N 3.47Å; N324-S327 PolarHBondContact O-N 3.09Å
325	K	57.4	Low	59.2	Low	174 Å²	174	98.4 Å²	98.4	76%	0.757	47%	0.472	S	S	*	.	H	α-helix	trans	-50.2	-32.7	175.2	-64.6	-176.8	-179.6	-178.4	0	113.6	Q328 I329	K325-Q328 PolarHBondContact O-N 3.5Å; K325-I329 WeakPolarHBondContact O-CG1 3.35Å; K325-I329 PolarHBondContact O-N 2.89Å
326	Y	58.5	Low	58.6	Low	170 Å²	170	104.4 Å²	104.4	67%	0.667	50%	0.495	S	S	*	.	H	α-helix	trans	-64	-39.4	179.4	-168.8	-100.3	0	0	0	113.1	N324 I329 L330	N324-Y326 PolarHBondContact O-N 3.47Å; Y326-I329 PolarHBondContact O-N 3.04Å; Y326-L330 WeakPolarHBondContact O-CB 3.48Å; Y326-L330 PolarHBondContact O-N 2.06Å
327	S	55.2	Low	57.9	Low	39 Å²	39	107.7 Å²	107.7	27%	0.273	51%	0.513	S	S	.	.	H	α-helix	trans	-72.9	-31.4	-178.7	-57.5	0	0	0	0	112.4	N324 A331	N324-S327 PolarHBondContact O-N 3.09Å; S327-A331 PolarHBondContact O-N 2.87Å; S327-A331 VanDerWaalsContact O-N 3.11Å
328	Q	60.3	Low	57.3	Low	90 Å²	90	108.3 Å²	108.3	42%	0.421	52%	0.518	S	S	.	.	H	α-helix	trans	-67.7	-44.7	173.5	-63.1	176.7	11.8	0	0	111.3	A322 K325 L330 A331 L332	A322-Q328 PolarHBondContact O-NE2 3.15Å; K325-Q328 PolarHBondContact O-N 3.5Å; Q328-L330 VanDerWaalsContact C-N 3.32Å; Q328-L330 PolarHBondContact O-N 2.96Å; Q328-A331 PolarHBondContact O-N 3.31Å; Q328-L332 WeakPolarHBondContact O-CG 3.45Å; Q328-L332 PolarHBondContact O-N 2.03Å; Q328-L332 VanDerWaalsContact O-N 3.08Å
329	I	62.5	Low	56.9	Low	109 Å²	109	108.7 Å²	108.7	56%	0.559	54%	0.539	S	S	*	.	H	α-helix	trans	-61.6	-42	176.5	-66.3	165.8	0	0	0	110.7	K325 Y326 A331 L332 Y333	K325-I329 WeakPolarHBondContact O-CG1 3.35Å; K325-I329 PolarHBondContact O-N 2.89Å; Y326-I329 PolarHBondContact O-N 3.04Å; I329-A331 PolarHBondContact O-N 3.33Å; I329-L332 PolarHBondContact O-N 2.8Å; I329-Y333 WeakPolarHBondContact O-CB 3.31Å; I329-Y333 PolarHBondContact O-N 3.49Å
330	L	60.4	Low	56.8	Low	35 Å²	35	104.5 Å²	104.5	18%	0.183	52%	0.52	C	S	.	.	H	α-helix	trans	-67	-36.8	-179.9	-158.6	66.4	0	0	0	112.5	Y318 Y326 Q328 Y333 K334 A342	Y318-L330 HydrophobicContact CE1-CB 3.96Å; Y318-L330 HydrophobicContact CE1-CD2 3.85Å; Y318-L330 HydrophobicContact CE1-CG 3.81Å; Y318-L330 WeakPolarHBondContact OH-CD2 3.41Å; Y318-L330 WeakPolarHBondContact OH-CG 3.04Å; Y326-L330 WeakPolarHBondContact O-CB 3.48Å; Y326-L330 PolarHBondContact O-N 2.06Å; Q328-L330 VanDerWaalsContact C-N 3.32Å; Q328-L330 PolarHBondContact O-N 2.96Å; L330-Y333 PolarHBondContact O-N 3Å; L330-K334 PolarHBondContact O-N 2.98Å; L330-K334 VanDerWaalsContact O-N 3.13Å; L330-A342 HydrophobicContact CD1-CB 3.57Å; L330-A342 HydrophobicContact CD2-CB 4.1Å; L330-A342 HydrophobicContact CG-CB 3.98Å
331	A	61.2	Low	57.2	Low	8 Å²	8	98.3 Å²	98.3	7%	0.066	51%	0.508	C	S	.	.	H	α-helix	trans	-64.7	-43.6	173.8	0	0	0	0	0	112.2	Y318 S327 Q328 I329 K334 H335	Y318-A331 HydrophobicContact CD1-CB 3.81Å; Y318-A331 HydrophobicContact CG-CB 4.18Å; S327-A331 PolarHBondContact O-N 2.87Å; S327-A331 VanDerWaalsContact O-N 3.11Å; Q328-A331 PolarHBondContact O-N 3.31Å; I329-A331 PolarHBondContact O-N 3.33Å; A331-K334 PolarHBondContact O-N 2.52Å; A331-H335 PolarHBondContact O-N 3.32Å
332	L	61.7	Low	57.6	Low	111 Å²	111	93 Å²	93	58%	0.581	48%	0.484	S	S	*	.	H	α-helix	trans	-63.9	-41.7	175.4	-70.1	169.3	0	0	0	111.9	Q328 I329 K334 H335 H336	Q328-L332 WeakPolarHBondContact O-CG 3.45Å; Q328-L332 PolarHBondContact O-N 2.03Å; Q328-L332 VanDerWaalsContact O-N 3.08Å; I329-L332 PolarHBondContact O-N 2.8Å; L332-K334 PolarHBondContact O-N 2.91Å; L332-H335 PolarHBondContact O-N 2.91Å; L332-H336 PolarHBondContact O-N 3.46Å; L332-H336 VanDerWaalsContact O-N 3.07Å
333	Y	62.7	Low	58.3	Low	133 Å²	133	95.1 Å²	95.1	52%	0.522	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-40	179.6	-168.2	-103.3	0	0	0	112.4	I329 L330 H336 N337 A340	I329-Y333 WeakPolarHBondContact O-CB 3.31Å; I329-Y333 PolarHBondContact O-N 3.49Å; L330-Y333 PolarHBondContact O-N 3Å; Y333-H336 PolarHBondContact O-N 2.84Å; Y333-N337 PolarHBondContact O-N 3.07Å; Y333-A340 HydrophobicContact CD1-CB 4.09Å; Y333-A340 HydrophobicContact CE1-CB 3.53Å
334	K	59.3	Low	59.1	Low	74 Å²	74	86.3 Å²	86.3	32%	0.322	45%	0.45	S	S	.	.	H	α-helix	trans	-67.8	-37.3	174.8	-177.6	169.4	-178.2	166.3	0	112.9	Y318 L330 A331 L332 H336 N337	Y318-K334 HydrophobicContact CD2-CD 3.92Å; Y318-K334 HydrophobicContact CE2-CD 3.45Å; Y318-K334 VanDerWaalsContact CE2-CD 3.45Å; L330-K334 PolarHBondContact O-N 2.98Å; L330-K334 VanDerWaalsContact O-N 3.13Å; A331-K334 PolarHBondContact O-N 2.52Å; L332-K334 PolarHBondContact O-N 2.91Å; K334-H336 VanDerWaalsContact C-N 3.29Å; K334-H336 PolarHBondContact O-N 3.03Å; K334-N337 CarbonylContact O-C 3.33Å; K334-N337 PolarHBondContact O-N 3.06Å
335	H	63.8	Low	59.9	Low	162 Å²	162	83.7 Å²	83.7	75%	0.75	44%	0.438	S	S	*	.	H	α-helix	trans	-63.5	-38.1	176	-172.5	70.2	0	0	0	111.5	A331 L332	A331-H335 PolarHBondContact O-N 3.32Å; L332-H335 PolarHBondContact O-N 2.91Å
336	H	61.8	Low	60.9	Low	170 Å²	170	76.6 Å²	76.6	79%	0.787	41%	0.41	S	S	*	.	H	α-helix	trans	-84.7	-20.6	-179	-157.8	-69	0	0	0	113.8	L332 Y333 K334	L332-H336 PolarHBondContact O-N 3.46Å; L332-H336 VanDerWaalsContact O-N 3.07Å; Y333-H336 PolarHBondContact O-N 2.84Å; K334-H336 VanDerWaalsContact C-N 3.29Å; K334-H336 PolarHBondContact O-N 3.03Å
337	N	57.7	Low	61.9	Low	73 Å²	73	70 Å²	70	39%	0.39	39%	0.387	S	S	.	.			trans	-142.9	87.1	175.5	-169.4	8	0	0	0	111.6	Y333 K334 G339 A340	Y333-N337 PolarHBondContact O-N 3.07Å; K334-N337 CarbonylContact O-C 3.33Å; K334-N337 PolarHBondContact O-N 3.06Å; N337-G339 PolarHBondContact O-N 3.46Å; N337-G339 VanDerWaalsContact O-N 3.1Å; N337-A340 HydrophobicContact CB-CB 4.21Å; N337-A340 WeakPolarHBondContact O-CB 3.16Å; N337-A340 PolarHBondContact O-N 3.04Å
338	P	56.8	Low	63	Low	106 Å²	106	70.6 Å²	70.6	69%	0.688	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.6	-177.5	-17.1	27.3	0	0	0	114
339	G	51.3	Low	63.7	Low	63 Å²	63	68.1 Å²	68.1	65%	0.649	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-11.9	175.6	0	0	0	0	0	114.3	N337 S341	N337-G339 PolarHBondContact O-N 3.46Å; N337-G339 VanDerWaalsContact O-N 3.1Å; G339-S341 PolarHBondContact O-N 3.22Å
340	A	51.9	Low	64.2	Low	22 Å²	22	65.2 Å²	65.2	18%	0.182	37%	0.366	C	S	.	.	S	Bend	trans	-84.2	104	176.1	0	0	0	0	0	110.7	Y333 N337 A342	Y333-A340 HydrophobicContact CD1-CB 4.09Å; Y333-A340 HydrophobicContact CE1-CB 3.53Å; N337-A340 HydrophobicContact CB-CB 4.21Å; N337-A340 WeakPolarHBondContact O-CB 3.16Å; N337-A340 PolarHBondContact O-N 3.04Å; A340-A342 VanDerWaalsContact C-N 3.27Å; A340-A342 PolarHBondContact O-N 2.99Å
341	S	52.9	Low	65.2	Low	70 Å²	70	66.1 Å²	66.1	49%	0.49	37%	0.371	S	S	.	.			trans	-75.6	65.3	-176.5	179.5	0	0	0	0	113.2	G339	G339-S341 PolarHBondContact O-N 3.22Å
342	A	56.5	Low	66.1	Low	33 Å²	33	67.3 Å²	67.3	27%	0.273	38%	0.375	S	S	.	.			trans	-100.6	119.8	154.8	0	0	0	0	0	107.3	Y318 L330 A340	Y318-A342 PolarHBondContact OH-O 3.47Å; L330-A342 HydrophobicContact CD1-CB 3.57Å; L330-A342 HydrophobicContact CD2-CB 4.1Å; L330-A342 HydrophobicContact CG-CB 3.98Å; A340-A342 VanDerWaalsContact C-N 3.27Å; A340-A342 PolarHBondContact O-N 2.99Å
343	Q	63.6	Low	67.2	Low	69 Å²	69	63.6 Å²	63.6	32%	0.322	36%	0.357	S	S	.	.			trans	-131.8	133.8	167.9	-175.1	171.9	-6.2	0	0	107.2	Y318 C345	Y318-Q343 WeakPolarHBondContact OH-CA 3.43Å; Y318-Q343 PolarHBondContact OH-N 3.47Å; Q343-C345 PolarHBondContact O-N 3.05Å
344	P	68.7	Low	68.4	Low	15 Å²	15	57.8 Å²	57.8	10%	0.097	34%	0.335	C	S	.	.			trans	-59.7	140.5	175.5	24.5	-35.1	0	0	0	109.5	C316 Y318 C379	C316-P344 HydrophobicContact CB-CB 3.87Å; C316-P344 HydrophobicContact CB-CG 3.63Å; C316-P344 WeakPolarHBondContact CB-O 3.34Å; Y318-P344 HydrophobicContact CE1-CG 4.37Å; Y318-P344 VanDerWaalsContact CE2-CD 3.41Å; Y318-P344 HydrophobicContact CE2-CG 4.44Å; Y318-P344 WeakPolarHBondContact OH-CD 3.37Å; P344-C379 HydrophobicContact CB-CB 4.3Å
345	C	74.1	Confident	69.8	Low	31 Å²	31	54.7 Å²	54.7	21%	0.209	32%	0.323	C	S	.	.			trans	-107.7	146.7	178.2	-65.1	0	0	0	0	110.5	C23 Q343 V347 S380	C23-C345 HydrophobicContact CB-CB 4.3Å; C23-C345 WeakPolarHBondContact CB-SG 3.25Å; C23-C345 WeakPolarHBondContact SG-CB 3.26Å; C23-C345 CovalentContact SG-SG 2.06Å; C23-C345 PolarHBondContact SG-SG 3Å; Q343-C345 PolarHBondContact O-N 3.05Å; C345-V347 HydrophobicContact CB-CG1 4.46Å; C345-V347 PolarHBondContact O-N 3.13Å; C345-S380 PolarHBondContact N-O 3.4Å; C345-S380 VanDerWaalsContact N-O 3.09Å; C345-S380 PolarHBondContact O-N 3.44Å; C345-S380 VanDerWaalsContact O-N 3.15Å
346	C	77.5	Confident	71.1	Confident	25 Å²	25	47 Å²	47	17%	0.169	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	109.8	175.8	-169.9	0	0	0	0	109.3	C283	C283-C346 WeakPolarHBondContact CA-SG 3.06Å; C283-C346 HydrophobicContact CB-CB 3.67Å; C283-C346 WeakPolarHBondContact CB-SG 3.39Å; C283-C346 WeakPolarHBondContact SG-CA 3.37Å; C283-C346 WeakPolarHBondContact SG-CB 3.43Å; C283-C346 CovalentContact SG-SG 2.04Å; C283-C346 PolarHBondContact SG-SG 3.1Å
347	V	79.1	Confident	72.4	Confident	33 Å²	33	39 Å²	39	20%	0.2	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.6	-174.3	-64.5	0	0	0	0	111.1	C312 C345 C377 K378 S380	C312-V347 VanDerWaalsContact SG-C 3.53Å; C345-V347 HydrophobicContact CB-CG1 4.46Å; C345-V347 PolarHBondContact O-N 3.13Å; V347-C377 CarbonylContact O-C 3.54Å; V347-C377 VanDerWaalsContact O-CA 3.31Å; V347-C377 WeakPolarHBondContact O-CA 3.43Å; V347-K378 HydrophobicContact CG2-CG 3.94Å; V347-K378 WeakPolarHBondContact CG2-O 3.02Å; V347-K378 PolarHBondContact N-O 3.44Å; V347-K378 PolarHBondContact O-N 2.91Å; V347-S380 VanDerWaalsContact CG2-OG 3.25Å; V347-S380 WeakPolarHBondContact CG2-OG 2.97Å
348	P	79.6	Confident	73.7	Confident	50 Å²	50	35.8 Å²	35.8	33%	0.325	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	140.9	174.4	26.9	-34.5	0	0	0	111	C312 L351 V374	C312-P348 WeakPolarHBondContact SG-CA 3.28Å; P348-L351 HydrophobicContact CB-CD1 4.34Å; P348-L351 HydrophobicContact CB-CD2 3.86Å; P348-L351 HydrophobicContact CB-CG 4.13Å; P348-L351 HydrophobicContact CG-CD1 4.45Å; P348-L351 HydrophobicContact CG-CD2 4.43Å; P348-V374 HydrophobicContact CB-CG1 3.95Å; P348-V374 HydrophobicContact CB-CG2 4.24Å
349	Q	74.9	Confident	74.7	Confident	38 Å²	38	31 Å²	31	18%	0.178	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-59.6	178.2	170.4	169.3	-3	0	0	110.6	T270 S376 K378	T270-Q349 PolarHBondContact O-NE2 3.49Å; T270-Q349 PolarHBondContact OG1-NE2 3.4Å; T270-Q349 VanDerWaalsContact OG1-NE2 3.1Å; Q349-S376 WeakPolarHBondContact CB-OG 3.18Å; Q349-S376 PolarHBondContact N-O 3.08Å; Q349-K378 HydrophobicContact CB-CB 4.3Å; Q349-K378 HydrophobicContact CB-CD 3.98Å; Q349-K378 HydrophobicContact CB-CG 3.98Å; Q349-K378 HydrophobicContact CG-CD 4.08Å
350	T	73.3	Confident	75.6	Confident	49 Å²	49	30.4 Å²	30.4	30%	0.301	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128	175.7	-52.8	0	0	0	0	109.1	K375 S376	T350-K375 HydrophobicContact CG2-CB 4.2Å; T350-K375 PolarHBondContact O-N 3.46Å; T350-S376 WeakPolarHBondContact CB-OG 3.49Å; T350-S376 PolarHBondContact N-OG 3.44Å; T350-S376 PolarHBondContact O-N 2.92Å; T350-S376 PolarHBondContact OG1-OG 3.21Å
351	L	81.4	Confident	76.7	Confident	54 Å²	54	30.6 Å²	30.6	28%	0.283	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	145.9	177.1	-65.4	157.2	0	0	0	109.3	P348 N371 I373 V374	P348-L351 HydrophobicContact CB-CD1 4.34Å; P348-L351 HydrophobicContact CB-CD2 3.86Å; P348-L351 HydrophobicContact CB-CG 4.13Å; P348-L351 HydrophobicContact CG-CD1 4.45Å; P348-L351 HydrophobicContact CG-CD2 4.43Å; L351-N371 HydrophobicContact CB-CB 4.11Å; L351-N371 WeakPolarHBondContact CB-OD1 3.2Å; L351-N371 HydrophobicContact CD1-CB 3.88Å; L351-I373 CarbonylContact C-O 3.46Å; L351-I373 WeakPolarHBondContact CA-O 3.31Å; L351-V374 HydrophobicContact CD2-CB 4.27Å; L351-V374 HydrophobicContact CD2-CG2 3.71Å
352	E	80.6	Confident	77.4	Confident	33 Å²	33	38.8 Å²	38.8	15%	0.154	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	150.3	176.1	-79.3	-178.7	179.1	0	0	111.8	Q83 M372 I373 K375	Q83-E352 WeakPolarHBondContact CG-OE1 2.9Å; Q83-E352 PolarHBondContact NE2-OE1 2.91Å; Q83-E352 PolarHBondContact NE2-OE2 3.5Å; E352-M372 PolarHBondContact O-N 3.33Å; E352-I373 HydrophobicContact CB-CB 4.01Å; E352-I373 HydrophobicContact CB-CG2 4.41Å; E352-I373 PolarHBondContact N-O 2.94Å; E352-I373 PolarHBondContact O-N 3.46Å; E352-K375 HydrophobicContact CG-CG 3.82Å; E352-K375 WeakPolarHBondContact OE1-CE 2.97Å; E352-K375 IonicContact OE1-NZ 3.71Å; E352-K375 WeakPolarHBondContact OE2-CE 3.1Å; E352-K375 IonicContact OE2-NZ 3.4Å; E352-K375 PolarHBondContact OE2-NZ 3.33Å
353	P	84.3	Confident	78.2	Confident	33 Å²	33	43.3 Å²	43.3	21%	0.214	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	158.9	174.4	32.9	-36.4	0	0	0	112.1	L79 Q368 L369	L79-P353 HydrophobicContact CD1-CG 4.42Å; L79-P353 HydrophobicContact CD2-CG 3.72Å; P353-Q368 HydrophobicContact CB-CG 3.76Å; P353-L369 CarbonylContact C-O 3.54Å; P353-L369 WeakPolarHBondContact CA-O 3.5Å; P353-L369 WeakPolarHBondContact CB-O 3.37Å
354	L	87.6	Confident	79	Confident	10 Å²	10	42.3 Å²	42.3	5%	0.052	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	119.1	176.2	179.5	72.5	0	0	0	109.7	F292 P304 Y307 I356 L369 M372 I373	F292-L354 HydrophobicContact CZ-CD2 4.32Å; P304-L354 HydrophobicContact CG-CD1 4.16Å; Y307-L354 HydrophobicContact CD1-CD2 3.67Å; Y307-L354 HydrophobicContact CD2-CD1 4.19Å; Y307-L354 HydrophobicContact CD2-CD2 3.9Å; Y307-L354 HydrophobicContact CE1-CD2 3.82Å; Y307-L354 HydrophobicContact CE2-CD2 4.02Å; Y307-L354 HydrophobicContact CG-CD1 4.05Å; Y307-L354 HydrophobicContact CG-CD2 3.72Å; L354-I356 HydrophobicContact CD2-CG2 3.99Å; L354-I356 HydrophobicContact CG-CG2 4.07Å; L354-L369 PolarHBondContact N-O 3.49Å; L354-L369 PolarHBondContact O-N 3.4Å; L354-M372 HydrophobicContact CB-CB 3.76Å; L354-M372 HydrophobicContact CB-CG 4.05Å; L354-I373 HydrophobicContact CD1-CD1 4.25Å
355	P	88.9	Confident	79.7	Confident	10 Å²	10	45.3 Å²	45.3	7%	0.065	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137	170.8	32.1	-31.8	0	0	0	109.5	Y72 T75 L79 P304	Y72-P355 HydrophobicContact CD2-CB 4.49Å; Y72-P355 HydrophobicContact CE2-CB 4.22Å; Y72-P355 HydrophobicContact CE2-CG 4.27Å; Y72-P355 WeakPolarHBondContact CE2-O 3.23Å; T75-P355 HydrophobicContact CG2-CB 3.95Å; L79-P355 HydrophobicContact CD1-CB 4.34Å; L79-P355 HydrophobicContact CD1-CG 3.82Å; P304-P355 WeakPolarHBondContact CD-O 3.14Å
356	I	90.1	Very high	80.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.3	176.8	61.8	162.5	0	0	0	111.2	L47 K303 L354 Y358 V366 E367 L369	L47-I356 HydrophobicContact CD1-CD1 3.98Å; L47-I356 HydrophobicContact CD2-CD1 4.11Å; L47-I356 HydrophobicContact CG-CD1 4.5Å; K303-I356 WeakPolarHBondContact O-CA 2.95Å; L354-I356 HydrophobicContact CD2-CG2 3.99Å; L354-I356 HydrophobicContact CG-CG2 4.07Å; I356-Y358 HydrophobicContact CD1-CD1 3.93Å; I356-Y358 HydrophobicContact CD1-CE1 4.29Å; I356-Y358 HydrophobicContact CG1-CD1 4.26Å; I356-V366 WeakPolarHBondContact O-CA 3.44Å; I356-E367 PolarHBondContact N-O 3.05Å; I356-E367 PolarHBondContact O-N 2.99Å; I356-L369 HydrophobicContact CD1-CD1 3.72Å; I356-L369 HydrophobicContact CD1-CD2 4.25Å; I356-L369 HydrophobicContact CD1-CG 3.95Å; I356-L369 HydrophobicContact CG1-CD1 4.18Å; I356-L369 HydrophobicContact CG1-CG 4.08Å; I356-L369 HydrophobicContact CG2-CD1 4.07Å
357	L	88.8	Confident	80.7	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.8	171.1	169.7	68.5	0	0	0	108.2	I64 L68 L69 Y72 H302 K303 K365 V366	I64-L357 HydrophobicContact CD1-CD2 3.92Å; I64-L357 HydrophobicContact CG2-CD2 3.68Å; L68-L357 HydrophobicContact CB-CD1 4.38Å; L69-L357 HydrophobicContact CD2-CD2 4.33Å; Y72-L357 HydrophobicContact CD2-CB 4.13Å; H302-L357 PolarHBondContact N-O 2.92Å; K303-L357 HydrophobicContact CB-CB 4.18Å; K303-L357 HydrophobicContact CB-CD2 4.49Å; K303-L357 HydrophobicContact CG-CD2 4.36Å; K303-L357 PolarHBondContact N-O 3.44Å; K303-L357 PolarHBondContact O-N 3.11Å; L357-K365 WeakPolarHBondContact CA-O 3.44Å; L357-V366 HydrophobicContact CB-CG2 4.44Å; L357-V366 HydrophobicContact CD1-CG2 3.62Å
358	Y	86.6	Confident	81	Confident	6 Å²	6	43.1 Å²	43.1	2%	0.024	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	168.1	-177.5	73.6	-75.3	0	0	0	110.5	L47 L49 W300 I356 V360 H364 K365 E367	L47-Y358 HydrophobicContact CD1-CE2 4.35Å; L47-Y358 HydrophobicContact CD2-CE1 3.94Å; L49-Y358 HydrophobicContact CD1-CE2 4.38Å; W300-Y358 AromaticContact CE3-CD2 3.68Å; W300-Y358 HydrophobicContact CE3-CD2 3.68Å; W300-Y358 HydrophobicContact CE3-CG 4.03Å; W300-Y358 AromaticContact CZ3-CD2 3.46Å; W300-Y358 HydrophobicContact CZ3-CD2 3.46Å; W300-Y358 VanDerWaalsContact CZ3-CD2 3.46Å; W300-Y358 HydrophobicContact CZ3-CE2 4.17Å; W300-Y358 AromaticContact CZ3-CG 3.75Å; W300-Y358 HydrophobicContact CZ3-CG 3.75Å; W300-Y358 WeakPolarHBondContact O-CA 3.39Å; I356-Y358 HydrophobicContact CD1-CD1 3.93Å; I356-Y358 HydrophobicContact CD1-CE1 4.29Å; I356-Y358 HydrophobicContact CG1-CD1 4.26Å; Y358-V360 HydrophobicContact CD2-CG2 3.82Å; Y358-V360 HydrophobicContact CE2-CG2 3.32Å; Y358-H364 WeakPolarHBondContact O-CA 3.39Å; Y358-K365 HydrophobicContact CD1-CB 4.42Å; Y358-K365 HydrophobicContact CE1-CB 3.93Å; Y358-K365 PolarHBondContact N-O 3.45Å; Y358-K365 VanDerWaalsContact N-O 3.12Å; Y358-K365 PolarHBondContact O-N 3.49Å; Y358-E367 HydrophobicContact CE1-CB 4.26Å; Y358-E367 HydrophobicContact CE1-CG 4.09Å; Y358-E367 VanDerWaalsContact OH-CD 3.28Å; Y358-E367 PolarHBondContact OH-OE1 3.34Å
359	Y	76.4	Confident	81.2	Confident	7 Å²	7	40.7 Å²	40.7	3%	0.027	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	157.3	165.9	56.5	-112.7	0	0	0	111.3	E57 A58 W300 H302 Q363	E57-Y359 WeakPolarHBondContact O-CE2 3.38Å; A58-Y359 VanDerWaalsContact CA-CE2 3.44Å; A58-Y359 WeakPolarHBondContact CA-OH 2.99Å; A58-Y359 HydrophobicContact CB-CE2 3.89Å; A58-Y359 WeakPolarHBondContact CB-OH 3.46Å; W300-Y359 WeakPolarHBondContact CA-OH 3.5Å; W300-Y359 HydrophobicContact CB-CE2 4.05Å; H302-Y359 AromaticContact CE1-CD1 3.67Å; H302-Y359 AromaticContact CE1-CE1 2.95Å; H302-Y359 WeakPolarHBondContact CE1-CE1 3.49Å; H302-Y359 AromaticContact CE1-CZ 3.55Å; H302-Y359 PolarHBondContact CE1-OH 3.08Å; H302-Y359 AromaticContact ND1-CE1 3.76Å; H302-Y359 AromaticContact NE2-CE1 3.45Å; H302-Y359 WeakPolarHBondContact NE2-CE1 3.46Å; Y359-Q363 WeakPolarHBondContact CA-O 3.42Å; Y359-Q363 WeakPolarHBondContact CB-O 3.36Å
360	V	70.8	Confident	81.4	Confident	50 Å²	50	39.2 Å²	39.2	30%	0.303	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115	166.7	-175.5	0	0	0	0	106.3	L49 Y358 R362 Q363	L49-V360 HydrophobicContact CD2-CG2 4.48Å; Y358-V360 HydrophobicContact CD2-CG2 3.82Å; Y358-V360 HydrophobicContact CE2-CG2 3.32Å; V360-R362 PolarHBondContact O-N 2.94Å; V360-Q363 PolarHBondContact N-O 3.19Å; V360-Q363 VanDerWaalsContact N-O 3.09Å; V360-Q363 PolarHBondContact O-N 3.46Å
361	G	74.3	Confident	81.7	Confident	26 Å²	26	39.4 Å²	39.4	27%	0.268	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	-121.1	-167.1	0	0	0	0	0	111.2
362	R	68.3	Low	81.9	Confident	241 Å²	241	36.9 Å²	36.9	91%	0.909	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	6.1	-178	-62.1	-176.7	-176.1	173.6	0.8	115.3	V360	V360-R362 PolarHBondContact O-N 2.94Å
363	Q	73.5	Confident	82.2	Confident	129 Å²	129	36.5 Å²	36.5	60%	0.603	18%	0.176	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.1	-175.9	-68.6	-175.6	-11.4	0	0	111.2	Y359 V360	Y359-Q363 WeakPolarHBondContact CA-O 3.42Å; Y359-Q363 WeakPolarHBondContact CB-O 3.36Å; V360-Q363 PolarHBondContact N-O 3.19Å; V360-Q363 VanDerWaalsContact N-O 3.09Å; V360-Q363 PolarHBondContact O-N 3.46Å
364	H	80.4	Confident	82.2	Confident	47 Å²	47	35 Å²	35	22%	0.218	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	139.2	170.2	-55.8	-71.8	0	0	0	111	L68 Y358	L68-H364 HydrophobicContact CD1-CB 3.22Å; Y358-H364 WeakPolarHBondContact O-CA 3.39Å
365	K	82.9	Confident	82	Confident	79 Å²	79	38.1 Å²	38.1	34%	0.343	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	139.4	-179.6	-64.6	-175.9	178.9	-179.2	0	110.9	L357 Y358	L357-K365 WeakPolarHBondContact CA-O 3.44Å; Y358-K365 HydrophobicContact CD1-CB 4.42Å; Y358-K365 HydrophobicContact CE1-CB 3.93Å; Y358-K365 PolarHBondContact N-O 3.45Å; Y358-K365 VanDerWaalsContact N-O 3.12Å; Y358-K365 PolarHBondContact O-N 3.49Å
366	V	86.3	Confident	81.4	Confident	5 Å²	5	38 Å²	38	3%	0.03	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.9	170.3	-178.6	0	0	0	0	108.2	L68 L71 L104 I356 L357	L68-V366 HydrophobicContact CD2-CG2 4.39Å; L71-V366 HydrophobicContact CD2-CB 3.75Å; L71-V366 HydrophobicContact CD2-CG1 4.28Å; L71-V366 HydrophobicContact CD2-CG2 3.85Å; L71-V366 HydrophobicContact CG-CB 4.16Å; L71-V366 HydrophobicContact CG-CG1 4.16Å; L71-V366 HydrophobicContact CG-CG2 4.2Å; L104-V366 HydrophobicContact CD1-CG1 4.37Å; L104-V366 PolarHBondContact N-O 3.24Å; I356-V366 WeakPolarHBondContact O-CA 3.44Å; L357-V366 HydrophobicContact CB-CG2 4.44Å; L357-V366 HydrophobicContact CD1-CG2 3.62Å
367	E	86	Confident	80.9	Confident	14 Å²	14	39.1 Å²	39.1	7%	0.065	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.4	-178.1	-71	-177.8	-150.1	0	0	110.8	L47 A101 K102 V103 I356 Y358	L47-E367 WeakPolarHBondContact CD2-OE2 3.44Å; A101-E367 HydrophobicContact CB-CB 4.29Å; A101-E367 WeakPolarHBondContact CB-OE2 3.33Å; K102-E367 WeakPolarHBondContact O-CA 3.47Å; V103-E367 HydrophobicContact CG2-CG 4.32Å; I356-E367 PolarHBondContact N-O 3.05Å; I356-E367 PolarHBondContact O-N 2.99Å; Y358-E367 HydrophobicContact CE1-CB 4.26Å; Y358-E367 HydrophobicContact CE1-CG 4.09Å; Y358-E367 VanDerWaalsContact OH-CD 3.28Å; Y358-E367 PolarHBondContact OH-OE1 3.34Å
368	Q	85.5	Confident	80.2	Confident	23 Å²	23	41.2 Å²	41.2	11%	0.107	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.5	174.4	178.5	174.3	-50.1	0	0	109.8	A101 K102 L104 P353	A101-Q368 WeakPolarHBondContact CA-O 3.14Å; K102-Q368 PolarHBondContact N-O 2.96Å; K102-Q368 VanDerWaalsContact N-O 3.15Å; K102-Q368 PolarHBondContact O-N 3.43Å; L104-Q368 HydrophobicContact CD1-CB 3.71Å; P353-Q368 HydrophobicContact CB-CG 3.76Å
369	L	83.8	Confident	79.5	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.3	174.7	-60	179.1	0	0	0	109.6	I43 K46 L47 A101 P353 L354 I356 M372	I43-L369 HydrophobicContact CB-CD1 4.48Å; I43-L369 HydrophobicContact CG1-CD1 3.98Å; I43-L369 HydrophobicContact CG2-CD1 4.12Å; K46-L369 HydrophobicContact CB-CD2 3.83Å; K46-L369 HydrophobicContact CD-CB 4.42Å; K46-L369 HydrophobicContact CD-CD2 4.4Å; L47-L369 HydrophobicContact CD2-CD2 3.8Å; L47-L369 HydrophobicContact CG-CD2 4.09Å; A101-L369 HydrophobicContact CB-CD2 3.86Å; P353-L369 CarbonylContact C-O 3.54Å; P353-L369 WeakPolarHBondContact CA-O 3.5Å; P353-L369 WeakPolarHBondContact CB-O 3.37Å; L354-L369 PolarHBondContact N-O 3.49Å; L354-L369 PolarHBondContact O-N 3.4Å; I356-L369 HydrophobicContact CD1-CD1 3.72Å; I356-L369 HydrophobicContact CD1-CD2 4.25Å; I356-L369 HydrophobicContact CD1-CG 3.95Å; I356-L369 HydrophobicContact CG1-CD1 4.18Å; I356-L369 HydrophobicContact CG1-CG 4.08Å; I356-L369 HydrophobicContact CG2-CD1 4.07Å; L369-M372 HydrophobicContact CB-CG 3.49Å; L369-M372 VanDerWaalsContact CB-CG 3.49Å; L369-M372 HydrophobicContact CB-SD 4.17Å; L369-M372 HydrophobicContact CD1-CG 4.27Å; L369-M372 HydrophobicContact CD1-SD 4.36Å
370	S	80.3	Confident	79	Confident	7 Å²	7	47 Å²	47	5%	0.049	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	154.3	173.7	61.5	0	0	0	0	112.3	K46 E98 Y99 M372	K46-S370 WeakPolarHBondContact CE-O 3.49Å; K46-S370 PolarHBondContact NZ-O 3.07Å; K46-S370 PolarHBondContact NZ-OG 3.24Å; E98-S370 WeakPolarHBondContact O-CB 3.41Å; E98-S370 PolarHBondContact O-OG 3.26Å; Y99-S370 PolarHBondContact O-OG 3.28Å; S370-M372 PolarHBondContact O-N 3.48Å
371	N	78.1	Confident	79.4	Confident	53 Å²	53	46.9 Å²	46.9	28%	0.283	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	59.8	41.8	166.5	-65.4	-37.2	0	0	0	115.6	Q42 L351	Q42-N371 PolarHBondContact NE2-O 3.23Å; L351-N371 HydrophobicContact CB-CB 4.11Å; L351-N371 WeakPolarHBondContact CB-OD1 3.2Å; L351-N371 HydrophobicContact CD1-CB 3.88Å
372	M	85.8	Confident	79.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-31	-175.2	-67.6	-54.7	-57.9	0	0	114	I39 Q42 I43 K46 Y307 E352 L354 L369 S370	I39-M372 HydrophobicContact CG2-CE 4.1Å; Q42-M372 HydrophobicContact CG-SD 4.05Å; I43-M372 HydrophobicContact CD1-CE 3.87Å; I43-M372 HydrophobicContact CG1-CE 3.44Å; I43-M372 VanDerWaalsContact CG1-CE 3.44Å; I43-M372 HydrophobicContact CG1-SD 4.38Å; K46-M372 HydrophobicContact CD-SD 4.01Å; Y307-M372 HydrophobicContact CE2-CB 4.36Å; Y307-M372 VanDerWaalsContact OH-CE 3.29Å; Y307-M372 WeakPolarHBondContact OH-CE 3.42Å; E352-M372 PolarHBondContact O-N 3.33Å; L354-M372 HydrophobicContact CB-CB 3.76Å; L354-M372 HydrophobicContact CB-CG 4.05Å; L369-M372 HydrophobicContact CB-CG 3.49Å; L369-M372 VanDerWaalsContact CB-CG 3.49Å; L369-M372 HydrophobicContact CB-SD 4.17Å; L369-M372 HydrophobicContact CD1-CG 4.27Å; L369-M372 HydrophobicContact CD1-SD 4.36Å; S370-M372 PolarHBondContact O-N 3.48Å
373	I	87.3	Confident	80.3	Confident	26 Å²	26	37.2 Å²	37.2	13%	0.133	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.8	-175.2	-63.9	167.2	0	0	0	109.4	Y307 L308 L351 E352 L354	Y307-I373 HydrophobicContact CD2-CD1 4.39Å; Y307-I373 HydrophobicContact CD2-CG1 3.78Å; Y307-I373 HydrophobicContact CE2-CG1 4.02Å; L308-I373 WeakPolarHBondContact O-CG2 3.22Å; L351-I373 CarbonylContact C-O 3.46Å; L351-I373 WeakPolarHBondContact CA-O 3.31Å; E352-I373 HydrophobicContact CB-CB 4.01Å; E352-I373 HydrophobicContact CB-CG2 4.41Å; E352-I373 PolarHBondContact N-O 2.94Å; E352-I373 PolarHBondContact O-N 3.46Å; L354-I373 HydrophobicContact CD1-CD1 4.25Å
374	V	84.8	Confident	80.7	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.1	176	-174.4	0	0	0	0	110.6	V285 A309 N310 P348 L351	V285-V374 HydrophobicContact CG1-CG1 4.46Å; V285-V374 HydrophobicContact CG2-CG1 4.39Å; A309-V374 PolarHBondContact O-N 2.82Å; N310-V374 HydrophobicContact CB-CB 3.88Å; N310-V374 WeakPolarHBondContact CB-O 3.17Å; N310-V374 PolarHBondContact ND2-O 3.31Å; P348-V374 HydrophobicContact CB-CG1 3.95Å; P348-V374 HydrophobicContact CB-CG2 4.24Å; L351-V374 HydrophobicContact CD2-CB 4.27Å; L351-V374 HydrophobicContact CD2-CG2 3.71Å
375	K	82.6	Confident	80.7	Confident	75 Å²	75	30.9 Å²	30.9	33%	0.326	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-35.4	175.8	-76	-60.9	-165.8	175.5	0	114.4	T350 E352	T350-K375 HydrophobicContact CG2-CB 4.2Å; T350-K375 PolarHBondContact O-N 3.46Å; E352-K375 HydrophobicContact CG-CG 3.82Å; E352-K375 WeakPolarHBondContact OE1-CE 2.97Å; E352-K375 IonicContact OE1-NZ 3.71Å; E352-K375 WeakPolarHBondContact OE2-CE 3.1Å; E352-K375 IonicContact OE2-NZ 3.4Å; E352-K375 PolarHBondContact OE2-NZ 3.33Å
376	S	77.1	Confident	80.6	Confident	9 Å²	9	27.7 Å²	27.7	6%	0.063	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	155.4	178.3	64.4	0	0	0	0	110.8	Q349 T350	Q349-S376 WeakPolarHBondContact CB-OG 3.18Å; Q349-S376 PolarHBondContact N-O 3.08Å; T350-S376 WeakPolarHBondContact CB-OG 3.49Å; T350-S376 PolarHBondContact N-OG 3.44Å; T350-S376 PolarHBondContact O-N 2.92Å; T350-S376 PolarHBondContact OG1-OG 3.21Å
377	C	79.5	Confident	80.2	Confident	23 Å²	23	29.3 Å²	29.3	16%	0.155	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.6	178.4	-59.4	0	0	0	0	110.1	V285 C312 V347	V285-C377 HydrophobicContact CG2-CB 4.23Å; V285-C377 WeakPolarHBondContact CG2-SG 3.43Å; C312-C377 WeakPolarHBondContact CA-SG 3.47Å; C312-C377 HydrophobicContact CB-CB 3.8Å; C312-C377 WeakPolarHBondContact CB-SG 3.43Å; C312-C377 WeakPolarHBondContact SG-CB 3.34Å; C312-C377 CovalentContact SG-SG 2.02Å; C312-C377 PolarHBondContact SG-SG 2.82Å; V347-C377 CarbonylContact O-C 3.54Å; V347-C377 VanDerWaalsContact O-CA 3.31Å; V347-C377 WeakPolarHBondContact O-CA 3.43Å
378	K	73.8	Confident	79.7	Confident	45 Å²	45	30.5 Å²	30.5	20%	0.196	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	161.2	171.3	65.3	-175.8	174.7	-172.7	0	112.1	R268 V347 Q349	R268-K378 PolarHBondContact O-NZ 3.36Å; V347-K378 HydrophobicContact CG2-CG 3.94Å; V347-K378 WeakPolarHBondContact CG2-O 3.02Å; V347-K378 PolarHBondContact N-O 3.44Å; V347-K378 PolarHBondContact O-N 2.91Å; Q349-K378 HydrophobicContact CB-CB 4.3Å; Q349-K378 HydrophobicContact CB-CD 3.98Å; Q349-K378 HydrophobicContact CB-CG 3.98Å; Q349-K378 HydrophobicContact CG-CD 4.08Å
379	C	72.4	Confident	79.3	Confident	63 Å²	63	31.1 Å²	31.1	43%	0.426	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.1	167.2	-63.7	0	0	0	0	109.6	C283 C316 P344	C283-C379 WeakPolarHBondContact CB-SG 3.45Å; C316-C379 VanDerWaalsContact CA-SG 3.59Å; C316-C379 HydrophobicContact CB-CB 3.65Å; C316-C379 WeakPolarHBondContact CB-SG 3.36Å; C316-C379 WeakPolarHBondContact SG-CA 3.4Å; C316-C379 WeakPolarHBondContact SG-CB 3.28Å; C316-C379 CovalentContact SG-SG 2.03Å; C316-C379 PolarHBondContact SG-SG 3.46Å; P344-C379 HydrophobicContact CB-CB 4.3Å
380	S	66.1	Low	78.9	Confident	71 Å²	71	33.9 Å²	33.9	50%	0.497	19%	0.194	S	C	.	.			trans	-137.5	0	175.2	74.2	0	0	0	0	113.2	K267 C345 V347	K267-S380 PolarHBondContact NZ-OG 3.21Å; C345-S380 PolarHBondContact N-O 3.4Å; C345-S380 VanDerWaalsContact N-O 3.09Å; C345-S380 PolarHBondContact O-N 3.44Å; C345-S380 VanDerWaalsContact O-N 3.15Å; V347-S380 VanDerWaalsContact CG2-OG 3.25Å; V347-S380 WeakPolarHBondContact CG2-OG 2.97Å

Retrieved 380 of 380 residues in 300.2 ms (Link to these results)

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