A0A5K4EZK6_SCHMA Loading...

WD_REPEATS_REGION domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EZK6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 480 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.8	Very low	26.1	Very low	241 Å²	241	144.9 Å²	144.9	100%	1.187	73%	0.734	S	S	*	*				0	98.9	0	-90.1	-176.3	-98	0	0	107.5
2	H	21.8	Very low	26.1	Very low	188 Å²	188	137.6 Å²	137.6	87%	0.87	72%	0.722	S	S	*	*			trans	-89.8	108.4	161.3	-97.3	-46.8	0	0	0	105.8	I4	H2-I4 PolarHBondContact O-N 2.66Å; H2-I4 VanDerWaalsContact O-N 3.13Å
3	E	20.1	Very low	26.3	Very low	188 Å²	188	136.7 Å²	136.7	88%	0.879	73%	0.734	S	S	*	*			trans	-60.1	111.2	163.4	-82.9	177.1	143.8	0	0	107	N5	E3-N5 PolarHBondContact O-N 2.89Å
4	I	23.7	Very low	26.6	Very low	125 Å²	125	131.2 Å²	131.2	64%	0.641	73%	0.726	S	S	*	*			trans	-73.7	106.9	168	-61.9	174.1	0	0	0	105.2	H2 I6	H2-I4 PolarHBondContact O-N 2.66Å; H2-I4 VanDerWaalsContact O-N 3.13Å; I4-I6 PolarHBondContact O-N 3.2Å
5	N	22.3	Very low	27	Very low	98 Å²	98	131.7 Å²	131.7	52%	0.524	72%	0.718	S	S	.	*			trans	-67.3	117.7	177	-150.9	5.2	0	0	0	108.1	E3 D7 D8	E3-N5 PolarHBondContact O-N 2.89Å; N5-D7 PolarHBondContact O-N 2.85Å; N5-D8 PolarHBondContact O-N 3.11Å; N5-D8 VanDerWaalsContact O-N 3.12Å
6	I	29.5	Very low	27.6	Very low	149 Å²	149	127.6 Å²	127.6	76%	0.764	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-60.1	-20.6	-173.6	-69.1	170.4	0	0	0	111.7	I4	I4-I6 PolarHBondContact O-N 3.2Å
7	D	26.1	Very low	28.2	Very low	130 Å²	130	128.8 Å²	128.8	70%	0.695	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-84.5	-11.4	-179	-64.5	-26.8	0	0	0	114.7	N5 I9	N5-D7 PolarHBondContact O-N 2.85Å; D7-I9 PolarHBondContact O-N 2.71Å
8	D	26.7	Very low	28.8	Very low	137 Å²	137	123 Å²	123	73%	0.733	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-82.4	2.9	-179.4	-79.6	-31.5	0	0	0	113.8	N5	N5-D8 PolarHBondContact O-N 3.11Å; N5-D8 VanDerWaalsContact O-N 3.12Å
9	I	31	Very low	29.4	Very low	78 Å²	78	121.7 Å²	121.7	40%	0.4	66%	0.657	S	S	.	*			trans	-106.2	69.9	175.8	-53.5	163	0	0	0	109.2	D7 L11	D7-I9 PolarHBondContact O-N 2.71Å; I9-L11 HydrophobicContact CG2-CB 4.08Å; I9-L11 HydrophobicContact CG2-CD1 3.46Å; I9-L11 VanDerWaalsContact CG2-CD1 3.46Å; I9-L11 HydrophobicContact CG2-CG 3.69Å; I9-L11 PolarHBondContact O-N 3.28Å
10	N	25.2	Very low	30.3	Very low	165 Å²	165	120.9 Å²	120.9	88%	0.882	65%	0.645	S	S	*	*			trans	-70.6	75.5	159.3	-101.7	-36.5	0	0	0	109.2
11	L	31.5	Very low	31.3	Very low	95 Å²	95	115.4 Å²	115.4	50%	0.497	62%	0.616	S	S	.	*			trans	-101.7	125.3	164.3	-75.4	169.9	0	0	0	108	I9	I9-L11 HydrophobicContact CG2-CB 4.08Å; I9-L11 HydrophobicContact CG2-CD1 3.46Å; I9-L11 VanDerWaalsContact CG2-CD1 3.46Å; I9-L11 HydrophobicContact CG2-CG 3.69Å; I9-L11 PolarHBondContact O-N 3.28Å
12	G	26.1	Very low	32.6	Very low	57 Å²	57	104.7 Å²	104.7	59%	0.588	57%	0.565	S	S	*	*			trans	-42.9	143.2	-178.4	0	0	0	0	0	112.4	G14 F15	G12-G14 PolarHBondContact O-N 3Å; G12-F15 PolarHBondContact O-N 2.79Å
13	S	28.2	Very low	34.7	Very low	126 Å²	126	95.9 Å²	95.9	88%	0.881	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	11.2	-166	51.7	0	0	0	0	118.3
14	G	31	Very low	37.2	Very low	60 Å²	60	87 Å²	87	62%	0.619	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-16.1	173.7	0	0	0	0	0	115.7	G12	G12-G14 PolarHBondContact O-N 3Å
15	F	32.6	Very low	39.5	Very low	139 Å²	139	81.5 Å²	81.5	61%	0.61	46%	0.456	S	S	*	.	S	Bend	trans	-99.9	-10.4	-170.3	-84.2	-81.4	0	0	0	116.1	G12 H17 A18	G12-F15 PolarHBondContact O-N 2.79Å; F15-H17 VanDerWaalsContact C-N 3.33Å; F15-H17 PolarHBondContact O-N 3.07Å; F15-A18 PolarHBondContact O-N 3.34Å
16	S	36.3	Very low	42.2	Very low	66 Å²	66	77 Å²	77	46%	0.462	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-32.2	-174.9	54.6	0	0	0	0	113.4	Y20	S16-Y20 WeakPolarHBondContact O-CD2 3.45Å
17	H	37.2	Very low	44.6	Very low	148 Å²	148	70.8 Å²	70.8	69%	0.685	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-28.5	-178.7	-67	84.4	0	0	0	113.2	F15 R19	F15-H17 VanDerWaalsContact C-N 3.33Å; F15-H17 PolarHBondContact O-N 3.07Å; H17-R19 PolarHBondContact O-N 3.07Å
18	A	38.9	Very low	47.1	Very low	24 Å²	24	65 Å²	65	20%	0.198	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-73.5	-25.2	-176.8	0	0	0	0	0	113.3	F15 Y20 A21	F15-A18 PolarHBondContact O-N 3.34Å; A18-Y20 PolarHBondContact O-N 2.85Å; A18-A21 PolarHBondContact O-N 3.01Å
19	R	39.9	Very low	49.5	Very low	98 Å²	98	60 Å²	60	37%	0.37	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-68.9	-21.2	-178.6	-73.4	-174.3	179.6	-157.4	-4.6	114.2	H17 S42	H17-R19 PolarHBondContact O-N 3.07Å; R19-S42 WeakPolarHBondContact O-CB 3.33Å; R19-S42 PolarHBondContact O-N 3.21Å; R19-S42 PolarHBondContact O-OG 3.31Å
20	Y	47.7	Very low	51.7	Low	106 Å²	106	57.2 Å²	57.2	42%	0.416	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-107.1	6.3	-177.7	-57.7	-77.2	0	0	0	113.1	S16 A18 S22 L45 F466 N468	S16-Y20 WeakPolarHBondContact O-CD2 3.45Å; A18-Y20 PolarHBondContact O-N 2.85Å; Y20-S22 PolarHBondContact O-N 2.78Å; Y20-L45 HydrophobicContact CD1-CD1 4.02Å; Y20-L45 HydrophobicContact CE1-CD1 3.33Å; Y20-L45 HydrophobicContact CE1-CD2 4.29Å; Y20-L45 HydrophobicContact CE1-CG 4.35Å; Y20-F466 HydrophobicContact CD1-CE1 4.26Å; Y20-F466 AromaticContact CD1-CZ 3.65Å; Y20-F466 HydrophobicContact CD1-CZ 3.65Å; Y20-F466 HydrophobicContact CE1-CZ 4.23Å; Y20-F466 HydrophobicContact CG-CZ 4.47Å; Y20-N468 PolarHBondContact O-ND2 3.39Å
21	A	50.9	Low	54.1	Low	5 Å²	5	53.8 Å²	53.8	4%	0.041	31%	0.313	C	S	.	.			trans	-68.8	127.7	176.2	0	0	0	0	0	109.1	A18 I41 P417 P456	A18-A21 PolarHBondContact O-N 3.01Å; A21-I41 HydrophobicContact CB-CD1 3.89Å; A21-I41 WeakPolarHBondContact O-CG1 3.24Å; A21-I41 PolarHBondContact O-N 3.39Å; A21-P417 HydrophobicContact CB-CG 4.2Å; A21-P456 HydrophobicContact CB-CB 4.18Å; A21-P456 HydrophobicContact CB-CG 4.32Å
22	S	57.6	Low	56.1	Low	16 Å²	16	53.3 Å²	53.3	11%	0.112	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	138.2	171.4	-60.7	0	0	0	0	109.1	Y20 S39 V454 N468 S470	Y20-S22 PolarHBondContact O-N 2.78Å; S22-S39 CarbonylContact C-O 3.49Å; S22-S39 WeakPolarHBondContact CA-O 3.07Å; S22-V454 VanDerWaalsContact O-CB 3.25Å; S22-V454 WeakPolarHBondContact O-CB 3.5Å; S22-V454 WeakPolarHBondContact O-CG1 3.3Å; S22-N468 PolarHBondContact OG-O 2.78Å; S22-S470 WeakPolarHBondContact CB-OG 3.29Å
23	V	66.2	Low	58.6	Low	3 Å²	3	51.2 Å²	51.2	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	147.8	174	-66.9	0	0	0	0	109.5	S25 S38 S39 I41 V390 G415	V23-S25 PolarHBondContact O-N 2.82Å; V23-S38 CarbonylContact O-C 3.02Å; V23-S38 WeakPolarHBondContact O-CA 3.46Å; V23-S39 WeakPolarHBondContact CG2-OG 3.21Å; V23-S39 PolarHBondContact N-O 2.98Å; V23-S39 PolarHBondContact O-N 3.06Å; V23-I41 HydrophobicContact CB-CG1 4.41Å; V23-I41 HydrophobicContact CG1-CD1 3.59Å; V23-I41 HydrophobicContact CG1-CG1 3.37Å; V23-I41 HydrophobicContact CG2-CG1 4.19Å; V23-V390 HydrophobicContact CG2-CG1 4.44Å; V23-G415 WeakPolarHBondContact CG1-O 3.16Å
24	V	71.8	Confident	61	Low	2 Å²	2	45.2 Å²	45.2	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.9	173.3	173	0	0	0	0	109	L27 I36 G37 S413 L452 V454 I472	V24-L27 HydrophobicContact CG1-CD2 3.81Å; V24-L27 HydrophobicContact CG1-CG 3.99Å; V24-I36 HydrophobicContact CB-CG2 4.15Å; V24-I36 HydrophobicContact CG1-CG2 3.65Å; V24-I36 HydrophobicContact CG2-CG2 3.51Å; V24-G37 WeakPolarHBondContact CA-O 3.39Å; V24-S413 WeakPolarHBondContact CB-OG 3.02Å; V24-L452 HydrophobicContact CB-CD2 4.15Å; V24-L452 HydrophobicContact CG1-CD2 4.26Å; V24-L452 HydrophobicContact CG2-CD2 3.3Å; V24-V454 HydrophobicContact CB-CG2 4.43Å; V24-V454 HydrophobicContact CG2-CG2 3.39Å; V24-I472 HydrophobicContact CG2-CD1 4.25Å
25	S	73.6	Confident	63.5	Low	10 Å²	10	42.4 Å²	42.4	7%	0.07	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	-6.9	-174.8	55.1	0	0	0	0	113.1	V23 G37 S38 S39 V91 Y393	V23-S25 PolarHBondContact O-N 2.82Å; S25-G37 PolarHBondContact N-O 3.09Å; S25-G37 PolarHBondContact OG-O 2.76Å; S25-S38 PolarHBondContact OG-O 3.2Å; S25-S39 VanDerWaalsContact CB-OG 3.32Å; S25-S39 WeakPolarHBondContact CB-OG 3.11Å; S25-S39 PolarHBondContact OG-N 2.71Å; S25-V91 WeakPolarHBondContact CB-O 3.13Å; S25-V91 PolarHBondContact OG-O 2.83Å; S25-Y393 VanDerWaalsContact C-CD2 3.45Å; S25-Y393 VanDerWaalsContact C-CE2 3.47Å; S25-Y393 WeakPolarHBondContact O-CD2 3.21Å; S25-Y393 WeakPolarHBondContact O-CE2 3.08Å; S25-Y393 PolarHBondContact O-OH 2.65Å
26	A	78.6	Confident	65.8	Low	3 Å²	3	35.9 Å²	35.9	3%	0.025	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	150.7	169.7	0	0	0	0	0	110.5	G37 V91 I94	A26-G37 PolarHBondContact N-O 3.23Å; A26-G37 PolarHBondContact O-N 2.77Å; A26-V91 HydrophobicContact CB-CG1 3.82Å; A26-I94 HydrophobicContact CB-CB 4.34Å; A26-I94 HydrophobicContact CB-CD1 3.72Å; A26-I94 HydrophobicContact CB-CG1 3.69Å
27	L	78.7	Confident	67.9	Low	19 Å²	19	32.8 Å²	32.8	10%	0.099	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.8	176.2	-68.3	171.7	0	0	0	109.5	V24 L34 F35 I36 L395 L411	V24-L27 HydrophobicContact CG1-CD2 3.81Å; V24-L27 HydrophobicContact CG1-CG 3.99Å; L27-L34 HydrophobicContact CD2-CD1 4.48Å; L27-F35 WeakPolarHBondContact CA-O 3.41Å; L27-I36 HydrophobicContact CD2-CB 4.35Å; L27-I36 HydrophobicContact CD2-CD1 4.41Å; L27-I36 HydrophobicContact CD2-CG1 3.97Å; L27-I36 HydrophobicContact CD2-CG2 4Å; L27-L395 HydrophobicContact CB-CB 3.92Å; L27-L395 HydrophobicContact CB-CD2 4.23Å; L27-L395 HydrophobicContact CD1-CB 3.95Å; L27-L411 HydrophobicContact CD1-CB 4.35Å
28	G	78.7	Confident	69.8	Low	7 Å²	7	26.6 Å²	26.6	7%	0.072	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.1	172.1	0	0	0	0	0	111.2	F35	G28-F35 PolarHBondContact N-O 3.49Å; G28-F35 PolarHBondContact O-N 2.6Å
29	V	77.6	Confident	71.3	Confident	32 Å²	32	26.2 Å²	26.2	19%	0.194	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135.1	172.3	63.2	0	0	0	0	110.3	K33 L55 L395 L397 L401	V29-K33 VanDerWaalsContact CA-O 3.3Å; V29-K33 WeakPolarHBondContact CA-O 3.33Å; V29-K33 WeakPolarHBondContact CG2-O 3.3Å; V29-L55 HydrophobicContact CG2-CD1 4.1Å; V29-L395 HydrophobicContact CB-CD2 3.88Å; V29-L395 HydrophobicContact CG1-CD1 4.25Å; V29-L395 HydrophobicContact CG1-CD2 4.01Å; V29-L395 HydrophobicContact CG1-CG 4.43Å; V29-L397 HydrophobicContact CB-CD2 4.32Å; V29-L397 HydrophobicContact CG1-CD2 4.4Å; V29-L397 HydrophobicContact CG2-CD2 4.2Å; V29-L401 HydrophobicContact CG1-CD1 4.48Å; V29-L401 HydrophobicContact CG2-CD1 4.04Å; V29-L401 HydrophobicContact CG2-CD2 4.37Å
30	H	78.1	Confident	72.5	Confident	20 Å²	20	22.2 Å²	22.2	9%	0.093	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	136.4	175.4	-168.4	54.7	0	0	0	110.2	Q32 K33 F35 A96 L97 D106	H30-Q32 VanDerWaalsContact C-N 3.26Å; H30-Q32 PolarHBondContact O-N 3.41Å; H30-Q32 VanDerWaalsContact O-N 3.1Å; H30-K33 PolarHBondContact N-O 3.25Å; H30-K33 WeakPolarHBondContact O-CA 3.21Å; H30-K33 WeakPolarHBondContact O-CB 3.39Å; H30-K33 PolarHBondContact O-N 2.78Å; H30-F35 HydrophobicContact CB-CE2 3.93Å; H30-A96 HydrophobicContact CB-CB 3.61Å; H30-L97 PolarHBondContact NE2-O 2.95Å; H30-D106 IonicContact CD2-OD1 3.31Å
31	N	74.5	Confident	72.8	Confident	94 Å²	94	19 Å²	19	50%	0.503	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	46.5	174.4	-67.4	-13.4	0	0	0	114.6	K33 D106	N31-K33 PolarHBondContact O-N 3.05Å; N31-D106 WeakPolarHBondContact CB-OD1 3.33Å; N31-D106 PolarHBondContact ND2-OD1 3.13Å
32	Q	74.7	Confident	72.8	Confident	85 Å²	85	19.7 Å²	19.7	40%	0.397	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	22.1	-178.1	-51.4	168.5	40.9	0	0	113.8	H30 L55 L401	H30-Q32 VanDerWaalsContact C-N 3.26Å; H30-Q32 PolarHBondContact O-N 3.41Å; H30-Q32 VanDerWaalsContact O-N 3.1Å; Q32-L55 HydrophobicContact CB-CB 4.35Å; Q32-L55 WeakPolarHBondContact O-CA 3.31Å; Q32-L55 WeakPolarHBondContact O-CB 3.38Å; Q32-L55 VanDerWaalsContact O-CG 3.23Å; Q32-L55 WeakPolarHBondContact O-CG 3.29Å; Q32-L55 PolarHBondContact O-N 2.82Å; Q32-L401 HydrophobicContact CG-CD2 4.04Å
33	K	78.7	Confident	72.1	Confident	12 Å²	12	20.5 Å²	20.5	5%	0.052	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.2	168.5	-66.5	-177.8	175.7	168.8	0	110.5	V29 H30 N31 F35 V52 Y53 D106 L122	V29-K33 VanDerWaalsContact CA-O 3.3Å; V29-K33 WeakPolarHBondContact CA-O 3.33Å; V29-K33 WeakPolarHBondContact CG2-O 3.3Å; H30-K33 PolarHBondContact N-O 3.25Å; H30-K33 WeakPolarHBondContact O-CA 3.21Å; H30-K33 WeakPolarHBondContact O-CB 3.39Å; H30-K33 PolarHBondContact O-N 2.78Å; N31-K33 PolarHBondContact O-N 3.05Å; K33-F35 HydrophobicContact CB-CD2 4.49Å; K33-F35 HydrophobicContact CB-CE2 3.71Å; K33-F35 HydrophobicContact CB-CZ 3.99Å; K33-F35 HydrophobicContact CD-CZ 4.43Å; K33-V52 HydrophobicContact CB-CG1 4.13Å; K33-V52 HydrophobicContact CD-CG1 4.03Å; K33-V52 HydrophobicContact CG-CG1 4.43Å; K33-Y53 CarbonylContact C-O 3.21Å; K33-Y53 WeakPolarHBondContact CA-O 3.37Å; K33-D106 HydrophobicContact CD-CB 4.24Å; K33-D106 VanDerWaalsContact CD-OD2 3.23Å; K33-D106 WeakPolarHBondContact CD-OD2 2.81Å; K33-D106 WeakPolarHBondContact CE-OD2 3.5Å; K33-D106 IonicContact NZ-OD2 3.54Å; K33-D106 PolarHBondContact NZ-OD2 3.34Å; K33-L122 HydrophobicContact CD-CD1 3.55Å; K33-L122 VanDerWaalsContact NZ-CD1 3.27Å
34	L	78.4	Confident	70.9	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.3	172.6	172.9	68	0	0	0	108.7	L27 I36 V52 Y53 L55 L395 L411	L27-L34 HydrophobicContact CD2-CD1 4.48Å; L34-I36 HydrophobicContact CD1-CG1 4.44Å; L34-I36 HydrophobicContact CD2-CD1 3.77Å; L34-I36 HydrophobicContact CD2-CG1 4.15Å; L34-I36 HydrophobicContact CG-CD1 4.06Å; L34-I36 HydrophobicContact CG-CG1 3.86Å; L34-V52 CarbonylContact O-C 3.57Å; L34-V52 WeakPolarHBondContact O-CA 3.05Å; L34-Y53 PolarHBondContact N-O 3.11Å; L34-Y53 PolarHBondContact O-N 3.02Å; L34-L55 HydrophobicContact CB-CD1 4.38Å; L34-L55 HydrophobicContact CB-CD2 3.92Å; L34-L55 HydrophobicContact CB-CG 4.34Å; L34-L395 HydrophobicContact CD1-CD2 3.72Å; L34-L411 HydrophobicContact CD1-CD1 3.65Å; L34-L411 HydrophobicContact CD2-CD1 3.66Å; L34-L411 HydrophobicContact CG-CD1 4.33Å
35	F	83.1	Confident	69.8	Low	1 Å²	1	27.9 Å²	27.9	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.7	179.3	-62.6	-95.2	0	0	0	108	L27 G28 H30 K33 L50 V52 I94 V108 L122	L27-F35 WeakPolarHBondContact CA-O 3.41Å; G28-F35 PolarHBondContact N-O 3.49Å; G28-F35 PolarHBondContact O-N 2.6Å; H30-F35 HydrophobicContact CB-CE2 3.93Å; K33-F35 HydrophobicContact CB-CD2 4.49Å; K33-F35 HydrophobicContact CB-CE2 3.71Å; K33-F35 HydrophobicContact CB-CZ 3.99Å; K33-F35 HydrophobicContact CD-CZ 4.43Å; F35-L50 HydrophobicContact CB-CD1 3.97Å; F35-L50 HydrophobicContact CD1-CD1 4.24Å; F35-L50 HydrophobicContact CD1-CD2 4.3Å; F35-V52 HydrophobicContact CD1-CB 4.49Å; F35-V52 HydrophobicContact CD1-CG1 4.17Å; F35-V52 HydrophobicContact CD1-CG2 3.69Å; F35-V52 HydrophobicContact CE1-CG1 3.89Å; F35-V52 HydrophobicContact CE1-CG2 3.82Å; F35-V52 HydrophobicContact CZ-CG1 4.24Å; F35-I94 HydrophobicContact CB-CD1 4.27Å; F35-I94 HydrophobicContact CB-CG2 4.16Å; F35-V108 HydrophobicContact CD1-CB 4.36Å; F35-V108 HydrophobicContact CD1-CG1 3.67Å; F35-V108 HydrophobicContact CD1-CG2 3.83Å; F35-V108 HydrophobicContact CD2-CG1 3.95Å; F35-V108 HydrophobicContact CE1-CB 4.29Å; F35-V108 HydrophobicContact CE1-CG1 3.41Å; F35-V108 VanDerWaalsContact CE1-CG1 3.41Å; F35-V108 HydrophobicContact CE1-CG2 3.84Å; F35-V108 HydrophobicContact CE2-CG1 3.72Å; F35-V108 HydrophobicContact CG-CG1 3.94Å; F35-V108 HydrophobicContact CZ-CG1 3.44Å; F35-V108 VanDerWaalsContact CZ-CG1 3.44Å; F35-L122 HydrophobicContact CE1-CD1 3.97Å; F35-L122 HydrophobicContact CZ-CD1 4.07Å
36	I	81.7	Confident	69.3	Low	3 Å²	3	34 Å²	34	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	110.8	-177.7	-49.2	-169.1	0	0	0	109	V24 L27 L34 L50 V51 Y53 L452 I472	V24-I36 HydrophobicContact CB-CG2 4.15Å; V24-I36 HydrophobicContact CG1-CG2 3.65Å; V24-I36 HydrophobicContact CG2-CG2 3.51Å; L27-I36 HydrophobicContact CD2-CB 4.35Å; L27-I36 HydrophobicContact CD2-CD1 4.41Å; L27-I36 HydrophobicContact CD2-CG1 3.97Å; L27-I36 HydrophobicContact CD2-CG2 4Å; L34-I36 HydrophobicContact CD1-CG1 4.44Å; L34-I36 HydrophobicContact CD2-CD1 3.77Å; L34-I36 HydrophobicContact CD2-CG1 4.15Å; L34-I36 HydrophobicContact CG-CD1 4.06Å; L34-I36 HydrophobicContact CG-CG1 3.86Å; I36-L50 WeakPolarHBondContact O-CA 3.39Å; I36-V51 PolarHBondContact N-O 2.79Å; I36-V51 PolarHBondContact O-N 3.42Å; I36-Y53 HydrophobicContact CB-CE2 4.47Å; I36-Y53 HydrophobicContact CD1-CD2 3.85Å; I36-Y53 HydrophobicContact CD1-CE2 3.55Å; I36-Y53 HydrophobicContact CG1-CD2 4.08Å; I36-Y53 HydrophobicContact CG1-CE2 3.97Å; I36-L452 HydrophobicContact CD1-CD1 4Å; I36-L452 HydrophobicContact CD1-CD2 4.09Å; I36-L452 HydrophobicContact CG2-CD2 4.3Å; I36-I472 HydrophobicContact CB-CD1 4.02Å; I36-I472 HydrophobicContact CD1-CD1 3.63Å; I36-I472 HydrophobicContact CD1-CG2 4.5Å; I36-I472 HydrophobicContact CG1-CD1 4.39Å; I36-I472 HydrophobicContact CG2-CD1 3.58Å
37	G	79.6	Confident	68.8	Low	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	140.5	173.7	0	0	0	0	0	110.6	V24 S25 A26 G49	V24-G37 WeakPolarHBondContact CA-O 3.39Å; S25-G37 PolarHBondContact N-O 3.09Å; S25-G37 PolarHBondContact OG-O 2.76Å; A26-G37 PolarHBondContact N-O 3.23Å; A26-G37 PolarHBondContact O-N 2.77Å; G37-G49 CarbonylContact C-O 3.42Å; G37-G49 WeakPolarHBondContact CA-O 3.3Å
38	S	76.3	Confident	68.7	Low	19 Å²	19	34.4 Å²	34.4	13%	0.133	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	155.5	175.4	64.6	0	0	0	0	112.9	V23 S25 G48 G49 V91	V23-S38 CarbonylContact O-C 3.02Å; V23-S38 WeakPolarHBondContact O-CA 3.46Å; S25-S38 PolarHBondContact OG-O 3.2Å; S38-G48 VanDerWaalsContact O-CA 3.29Å; S38-G48 WeakPolarHBondContact O-CA 3.18Å; S38-G49 PolarHBondContact N-O 3.37Å; S38-G49 PolarHBondContact O-N 2.82Å; S38-G49 WeakPolarHBondContact OG-CA 3.25Å; S38-G49 PolarHBondContact OG-N 2.93Å; S38-G49 VanDerWaalsContact OG-N 3.08Å; S38-G49 PolarHBondContact OG-O 2.9Å; S38-V91 PolarHBondContact O-N 2.81Å; S38-V91 VanDerWaalsContact O-N 3.12Å
39	S	72	Confident	68.7	Low	15 Å²	15	34.2 Å²	34.2	11%	0.105	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	161.3	172.1	61.9	0	0	0	0	109.7	S22 V23 S25 S90	S22-S39 CarbonylContact C-O 3.49Å; S22-S39 WeakPolarHBondContact CA-O 3.07Å; V23-S39 WeakPolarHBondContact CG2-OG 3.21Å; V23-S39 PolarHBondContact N-O 2.98Å; V23-S39 PolarHBondContact O-N 3.06Å; S25-S39 VanDerWaalsContact CB-OG 3.32Å; S25-S39 WeakPolarHBondContact CB-OG 3.11Å; S25-S39 PolarHBondContact OG-N 2.71Å; S39-S90 VanDerWaalsContact CB-OG 3.27Å; S39-S90 WeakPolarHBondContact CB-OG 3.45Å
40	S	64.8	Low	69	Low	14 Å²	14	32.8 Å²	32.8	10%	0.098	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	143.6	168.8	74.7	0	0	0	0	110.8	S42 L45 G47	S40-S42 VanDerWaalsContact C-N 3.3Å; S40-S42 PolarHBondContact O-N 2.81Å; S40-S42 PolarHBondContact OG-O 3.4Å; S40-L45 WeakPolarHBondContact CB-O 3.2Å; S40-L45 PolarHBondContact OG-O 3.01Å; S40-G47 PolarHBondContact N-O 3.39Å
41	I	54	Low	69.1	Low	39 Å²	39	32.4 Å²	32.4	20%	0.2	18%	0.181	C	C	.	.	S	Bend	trans	-63.9	-36.5	177.8	-70.8	170.6	0	0	0	111.9	A21 V23 G43	A21-I41 HydrophobicContact CB-CD1 3.89Å; A21-I41 WeakPolarHBondContact O-CG1 3.24Å; A21-I41 PolarHBondContact O-N 3.39Å; V23-I41 HydrophobicContact CB-CG1 4.41Å; V23-I41 HydrophobicContact CG1-CD1 3.59Å; V23-I41 HydrophobicContact CG1-CG1 3.37Å; V23-I41 HydrophobicContact CG2-CG1 4.19Å; I41-G43 PolarHBondContact O-N 3.28Å
42	S	51.2	Low	69.4	Low	19 Å²	19	28 Å²	28	13%	0.133	16%	0.157	C	C	.	.	S	Bend	trans	-88.5	90.2	175.4	56.8	0	0	0	0	109.2	R19 S40 D44 L45	R19-S42 WeakPolarHBondContact O-CB 3.33Å; R19-S42 PolarHBondContact O-N 3.21Å; R19-S42 PolarHBondContact O-OG 3.31Å; S40-S42 VanDerWaalsContact C-N 3.3Å; S40-S42 PolarHBondContact O-N 2.81Å; S40-S42 PolarHBondContact OG-O 3.4Å; S42-D44 PolarHBondContact O-N 3.25Å; S42-L45 PolarHBondContact O-N 3.38Å
43	G	41.3	Very low	69.6	Low	33 Å²	33	24 Å²	24	34%	0.34	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	18.5	177.6	0	0	0	0	0	117.2	I41	I41-G43 PolarHBondContact O-N 3.28Å
44	D	41.5	Very low	69.5	Low	93 Å²	93	26.2 Å²	26.2	50%	0.497	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-13.8	167.9	-51.8	-17.7	0	0	0	111.2	S42 W46 R389	S42-D44 PolarHBondContact O-N 3.25Å; D44-W46 VanDerWaalsContact O-CD1 3.31Å; D44-W46 PolarHBondContact O-NE1 2.89Å; D44-R389 IonicContact OD1-CZ 2.8Å; D44-R389 IonicContact OD1-NH1 3.73Å; D44-R389 PolarHBondContact OD1-NH1 3.49Å; D44-R389 IonicContact OD1-NH2 3.82Å; D44-R389 PolarHBondContact OD1-NH2 2.81Å
45	L	48.9	Very low	69	Low	68 Å²	68	26.6 Å²	26.6	36%	0.356	15%	0.152	S	C	.	.	S	Bend	trans	-111.9	99.8	174.1	-79.2	132.7	0	0	0	109.4	Y20 S40 S42 G47 F466	Y20-L45 HydrophobicContact CD1-CD1 4.02Å; Y20-L45 HydrophobicContact CE1-CD1 3.33Å; Y20-L45 HydrophobicContact CE1-CD2 4.29Å; Y20-L45 HydrophobicContact CE1-CG 4.35Å; S40-L45 WeakPolarHBondContact CB-O 3.2Å; S40-L45 PolarHBondContact OG-O 3.01Å; S42-L45 PolarHBondContact O-N 3.38Å; L45-G47 PolarHBondContact O-N 2.74Å; L45-F466 HydrophobicContact CD2-CE2 4.32Å
46	W	62.8	Low	67.9	Low	138 Å²	138	33.2 Å²	33.2	52%	0.523	18%	0.181	S	C	.	.			trans	-70.9	46.2	-169.2	-55.7	73.2	0	0	0	113.1	D44 D88 S89 D114	D44-W46 VanDerWaalsContact O-CD1 3.31Å; D44-W46 PolarHBondContact O-NE1 2.89Å; W46-D88 WeakPolarHBondContact CB-O 3.42Å; W46-D88 CarbonylContact O-C 3.52Å; W46-S89 WeakPolarHBondContact O-CA 3.49Å; W46-S89 PolarHBondContact O-N 3Å; W46-D114 HydrophobicContact CE3-CB 4.46Å; W46-D114 HydrophobicContact CZ3-CB 4.34Å
47	G	67.7	Low	66.4	Low	20 Å²	20	40.1 Å²	40.1	21%	0.206	22%	0.218	C	C	.	.			trans	-94.7	123.4	177.7	0	0	0	0	0	111.3	S40 L45	S40-G47 PolarHBondContact N-O 3.39Å; L45-G47 PolarHBondContact O-N 2.74Å
48	G	76.6	Confident	65	Low	10 Å²	10	40.6 Å²	40.6	10%	0.103	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	176	171.2	0	0	0	0	0	112.4	S38 S86 F87 S89	S38-G48 VanDerWaalsContact O-CA 3.29Å; S38-G48 WeakPolarHBondContact O-CA 3.18Å; G48-S86 WeakPolarHBondContact O-CA 3.33Å; G48-F87 PolarHBondContact N-O 3.23Å; G48-F87 PolarHBondContact O-N 3.17Å; G48-S89 WeakPolarHBondContact CA-O 3.39Å; G48-S89 PolarHBondContact N-O 2.97Å
49	G	80.2	Confident	63.5	Low	4 Å²	4	48 Å²	48	4%	0.041	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	164	175.7	0	0	0	0	0	112.8	G37 S38 T85 V91	G37-G49 CarbonylContact C-O 3.42Å; G37-G49 WeakPolarHBondContact CA-O 3.3Å; S38-G49 PolarHBondContact N-O 3.37Å; S38-G49 PolarHBondContact O-N 2.82Å; S38-G49 WeakPolarHBondContact OG-CA 3.25Å; S38-G49 PolarHBondContact OG-N 2.93Å; S38-G49 VanDerWaalsContact OG-N 3.08Å; S38-G49 PolarHBondContact OG-O 2.9Å; G49-T85 CarbonylContact C-O 3.58Å; G49-T85 WeakPolarHBondContact CA-O 3.47Å; G49-V91 WeakPolarHBondContact O-CG2 3.48Å
50	L	83.1	Confident	62.1	Low	1 Å²	1	52 Å²	52	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.2	171.4	171.3	71.1	0	0	0	108.8	F35 I36 V52 E84 T85 F87 I94 V108 I110 V120	F35-L50 HydrophobicContact CB-CD1 3.97Å; F35-L50 HydrophobicContact CD1-CD1 4.24Å; F35-L50 HydrophobicContact CD1-CD2 4.3Å; I36-L50 WeakPolarHBondContact O-CA 3.39Å; L50-V52 HydrophobicContact CD2-CG2 4.03Å; L50-V52 HydrophobicContact CG-CG2 4.12Å; L50-E84 CarbonylContact O-C 3.58Å; L50-E84 VanDerWaalsContact O-CA 3.31Å; L50-E84 WeakPolarHBondContact O-CA 3Å; L50-T85 HydrophobicContact CB-CG2 3.91Å; L50-T85 PolarHBondContact N-O 3.41Å; L50-T85 PolarHBondContact O-N 3.28Å; L50-F87 HydrophobicContact CB-CE2 3.76Å; L50-F87 HydrophobicContact CB-CZ 4.27Å; L50-I94 HydrophobicContact CD1-CD1 4Å; L50-V108 HydrophobicContact CD2-CG2 4.39Å; L50-I110 HydrophobicContact CB-CD1 4.14Å; L50-I110 HydrophobicContact CD2-CD1 3.65Å; L50-I110 HydrophobicContact CG-CD1 4.32Å; L50-V120 HydrophobicContact CD2-CG1 4.27Å
51	V	80.6	Confident	60.9	Low	13 Å²	13	57.3 Å²	57.3	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.1	167.8	-169.6	0	0	0	0	109.1	I36 Y53 V81 E84 L469	I36-V51 PolarHBondContact N-O 2.79Å; I36-V51 PolarHBondContact O-N 3.42Å; V51-Y53 HydrophobicContact CB-CE2 3.81Å; V51-Y53 HydrophobicContact CG1-CD2 4.16Å; V51-Y53 HydrophobicContact CG1-CE1 4.39Å; V51-Y53 HydrophobicContact CG1-CE2 3.41Å; V51-Y53 VanDerWaalsContact CG1-CE2 3.41Å; V51-V81 HydrophobicContact CG1-CG1 3.95Å; V51-V81 HydrophobicContact CG1-CG2 3.96Å; V51-E84 HydrophobicContact CG1-CB 4.47Å; V51-E84 HydrophobicContact CG2-CB 4.38Å; V51-L469 HydrophobicContact CG2-CD2 3.8Å
52	V	80.7	Confident	60.2	Low	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.3	179.9	-173.4	0	0	0	0	109.7	K33 L34 F35 L50 V81 V82 T83 L122	K33-V52 HydrophobicContact CB-CG1 4.13Å; K33-V52 HydrophobicContact CD-CG1 4.03Å; K33-V52 HydrophobicContact CG-CG1 4.43Å; L34-V52 CarbonylContact O-C 3.57Å; L34-V52 WeakPolarHBondContact O-CA 3.05Å; F35-V52 HydrophobicContact CD1-CB 4.49Å; F35-V52 HydrophobicContact CD1-CG1 4.17Å; F35-V52 HydrophobicContact CD1-CG2 3.69Å; F35-V52 HydrophobicContact CE1-CG1 3.89Å; F35-V52 HydrophobicContact CE1-CG2 3.82Å; F35-V52 HydrophobicContact CZ-CG1 4.24Å; L50-V52 HydrophobicContact CD2-CG2 4.03Å; L50-V52 HydrophobicContact CG-CG2 4.12Å; V52-V81 WeakPolarHBondContact O-CA 3.1Å; V52-V82 HydrophobicContact CB-CB 4.41Å; V52-V82 HydrophobicContact CG1-CB 4.3Å; V52-V82 PolarHBondContact O-N 3.37Å; V52-T83 HydrophobicContact CB-CG2 3.93Å; V52-T83 HydrophobicContact CG2-CG2 3.75Å; V52-T83 PolarHBondContact N-O 2.69Å; V52-L122 HydrophobicContact CG1-CD1 3.82Å; V52-L122 HydrophobicContact CG2-CD1 4.48Å; V52-L122 HydrophobicContact CG2-CD2 4.49Å
53	Y	77.9	Confident	59.4	Low	3 Å²	3	55.1 Å²	55.1	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144.1	178.8	-61.8	-96.1	0	0	0	111.1	K33 L34 I36 V51 I77 Q80 V81 I472	K33-Y53 CarbonylContact C-O 3.21Å; K33-Y53 WeakPolarHBondContact CA-O 3.37Å; L34-Y53 PolarHBondContact N-O 3.11Å; L34-Y53 PolarHBondContact O-N 3.02Å; I36-Y53 HydrophobicContact CB-CE2 4.47Å; I36-Y53 HydrophobicContact CD1-CD2 3.85Å; I36-Y53 HydrophobicContact CD1-CE2 3.55Å; I36-Y53 HydrophobicContact CG1-CD2 4.08Å; I36-Y53 HydrophobicContact CG1-CE2 3.97Å; V51-Y53 HydrophobicContact CB-CE2 3.81Å; V51-Y53 HydrophobicContact CG1-CD2 4.16Å; V51-Y53 HydrophobicContact CG1-CE1 4.39Å; V51-Y53 HydrophobicContact CG1-CE2 3.41Å; V51-Y53 VanDerWaalsContact CG1-CE2 3.41Å; Y53-I77 HydrophobicContact CD1-CB 4.35Å; Y53-I77 HydrophobicContact CD1-CD1 3.67Å; Y53-I77 HydrophobicContact CD1-CG1 4.03Å; Y53-I77 WeakPolarHBondContact CD1-O 3.49Å; Y53-I77 HydrophobicContact CD2-CD1 4.48Å; Y53-I77 HydrophobicContact CE1-CB 4.48Å; Y53-I77 HydrophobicContact CE1-CD1 3.71Å; Y53-I77 HydrophobicContact CE1-CG1 3.83Å; Y53-I77 WeakPolarHBondContact CE1-O 3.39Å; Y53-I77 HydrophobicContact CG-CD1 4.07Å; Y53-Q80 CarbonylContact C-O 3.57Å; Y53-Q80 WeakPolarHBondContact CA-O 3.35Å; Y53-Q80 HydrophobicContact CD1-CB 4.35Å; Y53-V81 HydrophobicContact CD1-CG2 3.76Å; Y53-V81 HydrophobicContact CE1-CB 4.49Å; Y53-V81 HydrophobicContact CE1-CG2 3.28Å; Y53-I472 HydrophobicContact CE2-CD1 4.27Å
54	N	76.8	Confident	58.8	Low	58 Å²	58	61.1 Å²	61.1	31%	0.31	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	118.6	173.7	-168.9	-5.7	0	0	0	111.1	K56 Q80 V82	N54-K56 VanDerWaalsContact C-N 3.32Å; N54-K56 PolarHBondContact O-N 2.77Å; N54-K56 VanDerWaalsContact OD1-CB 3.29Å; N54-K56 WeakPolarHBondContact OD1-CB 3.47Å; N54-K56 PolarHBondContact OD1-N 2.86Å; N54-Q80 PolarHBondContact N-O 2.8Å; N54-Q80 PolarHBondContact O-OE1 3.26Å; N54-V82 HydrophobicContact CB-CG2 3.43Å; N54-V82 VanDerWaalsContact CB-CG2 3.43Å
55	L	69	Low	58.1	Low	7 Å²	7	59.8 Å²	59.8	4%	0.037	28%	0.282	C	S	.	.			trans	-82.8	-4.4	-179	-49.9	173	0	0	0	113	V29 Q32 L34 N57 V58 F62	V29-L55 HydrophobicContact CG2-CD1 4.1Å; Q32-L55 HydrophobicContact CB-CB 4.35Å; Q32-L55 WeakPolarHBondContact O-CA 3.31Å; Q32-L55 WeakPolarHBondContact O-CB 3.38Å; Q32-L55 VanDerWaalsContact O-CG 3.23Å; Q32-L55 WeakPolarHBondContact O-CG 3.29Å; Q32-L55 PolarHBondContact O-N 2.82Å; L34-L55 HydrophobicContact CB-CD1 4.38Å; L34-L55 HydrophobicContact CB-CD2 3.92Å; L34-L55 HydrophobicContact CB-CG 4.34Å; L55-N57 PolarHBondContact O-N 2.93Å; L55-V58 WeakPolarHBondContact O-CG2 3.06Å; L55-V58 PolarHBondContact O-N 2.87Å; L55-V58 VanDerWaalsContact O-N 3.13Å; L55-F62 HydrophobicContact CB-CE2 4.48Å; L55-F62 HydrophobicContact CD2-CD2 4.26Å; L55-F62 HydrophobicContact CD2-CE2 3.18Å; L55-F62 HydrophobicContact CD2-CZ 3.38Å; L55-F62 HydrophobicContact CG-CE2 4.39Å
56	K	58.6	Low	57	Low	140 Å²	140	59.9 Å²	59.9	61%	0.609	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-14.3	-167.5	-105.4	-177.4	173.9	172.2	0	117.2	N54	N54-K56 VanDerWaalsContact C-N 3.32Å; N54-K56 PolarHBondContact O-N 2.77Å; N54-K56 VanDerWaalsContact OD1-CB 3.29Å; N54-K56 WeakPolarHBondContact OD1-CB 3.47Å; N54-K56 PolarHBondContact OD1-N 2.86Å
57	N	50.5	Low	55.1	Low	149 Å²	149	64.3 Å²	64.3	80%	0.797	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	12.1	-177.8	-81.7	-23.8	0	0	0	114.7	L55 K59	L55-N57 PolarHBondContact O-N 2.93Å; N57-K59 VanDerWaalsContact C-N 3.32Å; N57-K59 PolarHBondContact O-N 2.85Å
58	V	51.2	Low	53.2	Low	10 Å²	10	70.7 Å²	70.7	6%	0.061	34%	0.335	C	S	.	.			trans	-99.8	35	-164.3	-157.3	0	0	0	0	114.1	L55 N60 F62	L55-V58 WeakPolarHBondContact O-CG2 3.06Å; L55-V58 PolarHBondContact O-N 2.87Å; L55-V58 VanDerWaalsContact O-N 3.13Å; V58-N60 PolarHBondContact O-N 3.01Å; V58-F62 HydrophobicContact CB-CD2 3.39Å; V58-F62 HydrophobicContact CB-CE2 3.79Å; V58-F62 HydrophobicContact CB-CG 4.37Å; V58-F62 HydrophobicContact CG1-CB 3.53Å; V58-F62 HydrophobicContact CG1-CD2 3.03Å; V58-F62 HydrophobicContact CG1-CE2 3.77Å; V58-F62 HydrophobicContact CG1-CG 3.55Å; V58-F62 HydrophobicContact CG2-CD2 3.69Å; V58-F62 HydrophobicContact CG2-CE2 3.52Å
59	K	45	Very low	50.9	Low	175 Å²	175	77.8 Å²	77.8	76%	0.761	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-24.9	176	-76.7	-170.1	175	-176.8	0	113.3	N57	N57-K59 VanDerWaalsContact C-N 3.32Å; N57-K59 PolarHBondContact O-N 2.85Å
60	N	41.6	Very low	48.5	Very low	97 Å²	97	85.4 Å²	85.4	52%	0.519	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-12.2	-174.7	-71.9	-28.7	0	0	0	116.4	V58	V58-N60 PolarHBondContact O-N 3.01Å
61	Y	38.8	Very low	46.4	Very low	127 Å²	127	90.3 Å²	90.3	50%	0.498	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-21.8	-159.1	-67.6	-75	0	0	0	117.5	G63 R64	Y61-G63 PolarHBondContact O-N 3.47Å; Y61-R64 HydrophobicContact CD1-CB 4.45Å; Y61-R64 PolarHBondContact O-N 3.24Å
62	F	39.5	Very low	44.4	Very low	8 Å²	8	92.2 Å²	92.2	4%	0.035	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	107.7	178.9	-105.8	-65.6	0	0	0	107.2	L55 V58 I77 M402 R409 Y474	L55-F62 HydrophobicContact CB-CE2 4.48Å; L55-F62 HydrophobicContact CD2-CD2 4.26Å; L55-F62 HydrophobicContact CD2-CE2 3.18Å; L55-F62 HydrophobicContact CD2-CZ 3.38Å; L55-F62 HydrophobicContact CG-CE2 4.39Å; V58-F62 HydrophobicContact CB-CD2 3.39Å; V58-F62 HydrophobicContact CB-CE2 3.79Å; V58-F62 HydrophobicContact CB-CG 4.37Å; V58-F62 HydrophobicContact CG1-CB 3.53Å; V58-F62 HydrophobicContact CG1-CD2 3.03Å; V58-F62 HydrophobicContact CG1-CE2 3.77Å; V58-F62 HydrophobicContact CG1-CG 3.55Å; V58-F62 HydrophobicContact CG2-CD2 3.69Å; V58-F62 HydrophobicContact CG2-CE2 3.52Å; F62-I77 HydrophobicContact CD1-CG2 4.39Å; F62-I77 HydrophobicContact CE1-CD1 4.22Å; F62-I77 HydrophobicContact CE1-CG2 3.75Å; F62-I77 HydrophobicContact CZ-CD1 4.39Å; F62-I77 HydrophobicContact CZ-CG2 3.97Å; F62-M402 HydrophobicContact CB-CE 3.43Å; F62-M402 VanDerWaalsContact CB-CE 3.43Å; F62-M402 HydrophobicContact CD2-CE 3.73Å; F62-M402 HydrophobicContact CD2-SD 4.25Å; F62-M402 HydrophobicContact CG-CE 3.86Å; F62-R409 VanDerWaalsContact CB-NH1 3.26Å; F62-R409 PolarHBondContact O-NH1 2.63Å; F62-Y474 AromaticContact CD1-CE2 3.77Å; F62-Y474 HydrophobicContact CD1-CE2 3.77Å; F62-Y474 AromaticContact CD1-CZ 3.74Å; F62-Y474 AromaticContact CE1-CE2 3.51Å; F62-Y474 HydrophobicContact CE1-CE2 3.51Å; F62-Y474 AromaticContact CE1-CZ 3.54Å; F62-Y474 WeakPolarHBondContact CE1-OH 3Å
63	G	35.7	Very low	42.5	Very low	3 Å²	3	95.9 Å²	95.9	3%	0.031	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	21.9	-178.3	0	0	0	0	0	116.8	Y61 I65 Y450	Y61-G63 PolarHBondContact O-N 3.47Å; G63-I65 PolarHBondContact O-N 2.71Å; G63-Y450 VanDerWaalsContact C-CE1 3.46Å; G63-Y450 VanDerWaalsContact CA-CZ 3.46Å; G63-Y450 WeakPolarHBondContact O-CE1 3.23Å; G63-Y450 PolarHBondContact O-OH 3.27Å
64	R	27.8	Very low	40.9	Very low	159 Å²	159	96.9 Å²	96.9	60%	0.6	49%	0.485	S	S	*	.			trans	-69.4	108.9	173.3	-153.1	178.3	-174.7	-173.3	0.7	109.7	Y61 A66	Y61-R64 HydrophobicContact CD1-CB 4.45Å; Y61-R64 PolarHBondContact O-N 3.24Å; R64-A66 PolarHBondContact O-N 3.01Å; R64-A66 VanDerWaalsContact O-N 3.1Å
65	I	27	Very low	39.5	Very low	65 Å²	65	95.6 Å²	95.6	33%	0.333	48%	0.478	S	S	.	.			trans	-59.3	111.6	175.1	-61.6	166.4	0	0	0	108.4	G63 Y67 V74 K476	G63-I65 PolarHBondContact O-N 2.71Å; I65-Y67 PolarHBondContact O-N 2.82Å; I65-V74 HydrophobicContact CG1-CG1 4.38Å; I65-K476 HydrophobicContact CD1-CD 4Å; I65-K476 HydrophobicContact CG1-CD 4.2Å
66	A	25.9	Very low	38.7	Very low	70 Å²	70	98.3 Å²	98.3	58%	0.579	49%	0.493	S	S	*	.			trans	-64.8	120.1	151.6	0	0	0	0	0	106.3	R64 E68	R64-A66 PolarHBondContact O-N 3.01Å; R64-A66 VanDerWaalsContact O-N 3.1Å; A66-E68 PolarHBondContact O-N 3.38Å
67	Y	23.7	Very low	38.8	Very low	231 Å²	231	91.6 Å²	91.6	91%	0.906	46%	0.464	S	S	*	.			trans	-67.3	85.7	173.7	-94.9	-92.5	0	0	0	108.3	I65	I65-Y67 PolarHBondContact O-N 2.82Å
68	E	26.6	Very low	39.2	Very low	154 Å²	154	85.4 Å²	85.4	72%	0.72	43%	0.432	S	S	*	.			trans	-137.9	127.8	169.9	-68.9	-168.5	169.4	0	0	110.2	A66 E70	A66-E68 PolarHBondContact O-N 3.38Å; E68-E70 VanDerWaalsContact C-N 3.33Å; E68-E70 PolarHBondContact O-N 3.12Å
69	D	28.6	Very low	39.8	Very low	160 Å²	160	93.1 Å²	93.1	86%	0.856	47%	0.467	S	S	*	.	S	Bend	trans	-66.5	88.1	172.8	-70.9	-42.7	0	0	0	108.7
70	E	29.9	Very low	40.9	Very low	163 Å²	163	86.9 Å²	86.9	76%	0.762	44%	0.441	S	S	*	.	S	Bend	trans	171.7	166.7	156.6	-97.1	162.8	-157.2	0	0	108.5	E68 A72	E68-E70 VanDerWaalsContact C-N 3.33Å; E68-E70 PolarHBondContact O-N 3.12Å; E70-A72 PolarHBondContact O-N 2.92Å
71	S	39.7	Very low	42.3	Very low	105 Å²	105	84 Å²	84	73%	0.734	43%	0.427	S	S	*	.			trans	-63.5	69.1	174.9	46	0	0	0	0	112
72	A	37	Very low	44.2	Very low	52 Å²	52	79 Å²	79	43%	0.43	41%	0.409	S	S	.	.			trans	-92.4	136.3	179.3	0	0	0	0	0	110.1	E70 V74	E70-A72 PolarHBondContact O-N 2.92Å; A72-V74 PolarHBondContact O-N 3.23Å; A72-V74 VanDerWaalsContact O-N 3.12Å
73	V	41.4	Very low	46.1	Very low	78 Å²	78	78.9 Å²	78.9	47%	0.473	41%	0.41	S	S	.	.			trans	-52.3	117.6	168.8	170.9	0	0	0	0	108.2	D76 H473	V73-D76 HydrophobicContact CG1-CB 4.38Å; V73-H473 HydrophobicContact CG1-CB 4.06Å; V73-H473 VanDerWaalsContact CG1-ND1 3.31Å; V73-H473 WeakPolarHBondContact CG1-ND1 3.3Å; V73-H473 HydrophobicContact CG2-CB 4.18Å
74	V	43.6	Very low	48.4	Very low	23 Å²	23	82.7 Å²	82.7	14%	0.139	43%	0.426	C	S	.	.	S	Bend	trans	-77.7	-32.2	-170.5	-174.6	0	0	0	0	111.5	I65 A72 Y450 Y474 K476	I65-V74 HydrophobicContact CG1-CG1 4.38Å; A72-V74 PolarHBondContact O-N 3.23Å; A72-V74 VanDerWaalsContact O-N 3.12Å; V74-Y450 HydrophobicContact CG1-CE1 3.95Å; V74-Y474 PolarHBondContact N-O 3.18Å; V74-K476 HydrophobicContact CG2-CB 3.74Å
75	D	49	Very low	50.9	Low	32 Å²	32	76.3 Å²	76.3	17%	0.171	41%	0.405	C	S	.	.			trans	-158.5	131.7	175.9	-160.4	8	0	0	0	108.8	Y474	D75-Y474 HydrophobicContact CB-CD2 4.16Å
76	D	51.2	Low	53.6	Low	63 Å²	63	76.4 Å²	76.4	34%	0.337	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-102.3	94.7	174.1	-176.3	2.2	0	0	0	108.9	V73 S78 H473	V73-D76 HydrophobicContact CG1-CB 4.38Å; D76-S78 PolarHBondContact O-N 3.15Å; D76-S78 WeakPolarHBondContact OD1-CB 3.36Å; D76-S78 PolarHBondContact OD1-N 3.19Å; D76-S78 PolarHBondContact OD1-OG 2.94Å; D76-S78 PolarHBondContact OD2-OG 3Å; D76-S78 VanDerWaalsContact OD2-OG 3.08Å; D76-H473 IonicContact OD1-CE1 3.85Å; D76-H473 IonicContact OD2-CE1 3.91Å
77	I	60.1	Low	56.3	Low	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-80.6	5.9	177.5	61.2	159.7	0	0	0	112.9	Y53 F62 Q79 Q80 Y474	Y53-I77 HydrophobicContact CD1-CB 4.35Å; Y53-I77 HydrophobicContact CD1-CD1 3.67Å; Y53-I77 HydrophobicContact CD1-CG1 4.03Å; Y53-I77 WeakPolarHBondContact CD1-O 3.49Å; Y53-I77 HydrophobicContact CD2-CD1 4.48Å; Y53-I77 HydrophobicContact CE1-CB 4.48Å; Y53-I77 HydrophobicContact CE1-CD1 3.71Å; Y53-I77 HydrophobicContact CE1-CG1 3.83Å; Y53-I77 WeakPolarHBondContact CE1-O 3.39Å; Y53-I77 HydrophobicContact CG-CD1 4.07Å; F62-I77 HydrophobicContact CD1-CG2 4.39Å; F62-I77 HydrophobicContact CE1-CD1 4.22Å; F62-I77 HydrophobicContact CE1-CG2 3.75Å; F62-I77 HydrophobicContact CZ-CD1 4.39Å; F62-I77 HydrophobicContact CZ-CG2 3.97Å; I77-Q79 PolarHBondContact O-N 2.9Å; I77-Q79 VanDerWaalsContact O-N 3.16Å; I77-Q80 WeakPolarHBondContact O-CA 3.44Å; I77-Q80 VanDerWaalsContact O-CB 3.29Å; I77-Q80 WeakPolarHBondContact O-CB 3.48Å; I77-Q80 PolarHBondContact O-N 3.08Å; I77-Y474 HydrophobicContact CD1-CE2 3.75Å; I77-Y474 HydrophobicContact CG1-CE2 3.95Å; I77-Y474 HydrophobicContact CG2-CD2 4.24Å; I77-Y474 HydrophobicContact CG2-CE2 3.8Å
78	S	59.6	Low	59	Low	19 Å²	19	70.3 Å²	70.3	13%	0.133	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-58.4	-29.3	179.3	64.3	0	0	0	0	113.2	D76 Q80 V81	D76-S78 PolarHBondContact O-N 3.15Å; D76-S78 WeakPolarHBondContact OD1-CB 3.36Å; D76-S78 PolarHBondContact OD1-N 3.19Å; D76-S78 PolarHBondContact OD1-OG 2.94Å; D76-S78 PolarHBondContact OD2-OG 3Å; D76-S78 VanDerWaalsContact OD2-OG 3.08Å; S78-Q80 PolarHBondContact O-N 3.45Å; S78-V81 WeakPolarHBondContact O-CB 3.27Å; S78-V81 VanDerWaalsContact O-CG2 3.23Å; S78-V81 WeakPolarHBondContact O-CG2 2.94Å; S78-V81 PolarHBondContact O-N 3.12Å
79	Q	63.4	Low	61.7	Low	171 Å²	171	63 Å²	63	80%	0.799	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-68.4	-14	174.5	-61	-65.1	-26.1	0	0	113.3	I77	I77-Q79 PolarHBondContact O-N 2.9Å; I77-Q79 VanDerWaalsContact O-N 3.16Å
80	Q	68.1	Low	64.3	Low	44 Å²	44	55.6 Å²	55.6	21%	0.206	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-95.3	0.6	178.5	-55	176.9	18.3	0	0	112.2	Y53 N54 I77 S78 V82	Y53-Q80 CarbonylContact C-O 3.57Å; Y53-Q80 WeakPolarHBondContact CA-O 3.35Å; Y53-Q80 HydrophobicContact CD1-CB 4.35Å; N54-Q80 PolarHBondContact N-O 2.8Å; N54-Q80 PolarHBondContact O-OE1 3.26Å; I77-Q80 WeakPolarHBondContact O-CA 3.44Å; I77-Q80 VanDerWaalsContact O-CB 3.29Å; I77-Q80 WeakPolarHBondContact O-CB 3.48Å; I77-Q80 PolarHBondContact O-N 3.08Å; S78-Q80 PolarHBondContact O-N 3.45Å; Q80-V82 PolarHBondContact O-N 3.29Å
81	V	71.8	Confident	66.9	Low	38 Å²	38	47.9 Å²	47.9	23%	0.23	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	124.3	176.6	177.3	0	0	0	0	108.8	V51 V52 Y53 S78 M134	V51-V81 HydrophobicContact CG1-CG1 3.95Å; V51-V81 HydrophobicContact CG1-CG2 3.96Å; V52-V81 WeakPolarHBondContact O-CA 3.1Å; Y53-V81 HydrophobicContact CD1-CG2 3.76Å; Y53-V81 HydrophobicContact CE1-CB 4.49Å; Y53-V81 HydrophobicContact CE1-CG2 3.28Å; S78-V81 WeakPolarHBondContact O-CB 3.27Å; S78-V81 VanDerWaalsContact O-CG2 3.23Å; S78-V81 WeakPolarHBondContact O-CG2 2.94Å; S78-V81 PolarHBondContact O-N 3.12Å; V81-M134 HydrophobicContact CG1-CE 3.7Å; V81-M134 HydrophobicContact CG1-SD 3.99Å
82	V	78.1	Confident	69	Low	20 Å²	20	43.2 Å²	43.2	12%	0.121	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-45.1	179.5	-178.3	0	0	0	0	109.6	V52 N54 Q80 M134 Q135	V52-V82 HydrophobicContact CB-CB 4.41Å; V52-V82 HydrophobicContact CG1-CB 4.3Å; V52-V82 PolarHBondContact O-N 3.37Å; N54-V82 HydrophobicContact CB-CG2 3.43Å; N54-V82 VanDerWaalsContact CB-CG2 3.43Å; Q80-V82 PolarHBondContact O-N 3.29Å; V82-M134 CarbonylContact O-C 3.52Å; V82-M134 WeakPolarHBondContact O-CA 3.34Å; V82-Q135 HydrophobicContact CG1-CB 3.45Å; V82-Q135 VanDerWaalsContact CG1-CB 3.45Å; V82-Q135 HydrophobicContact CG1-CG 4.25Å; V82-Q135 PolarHBondContact O-N 3Å
83	T	80.6	Confident	71.4	Confident	7 Å²	7	41.5 Å²	41.5	4%	0.043	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	162.7	-179.7	-158.9	0	0	0	0	109.7	V52 L122 Q135 L137	V52-T83 HydrophobicContact CB-CG2 3.93Å; V52-T83 HydrophobicContact CG2-CG2 3.75Å; V52-T83 PolarHBondContact N-O 2.69Å; T83-L122 HydrophobicContact CG2-CD2 3.41Å; T83-L122 VanDerWaalsContact CG2-CD2 3.41Å; T83-Q135 VanDerWaalsContact CB-O 3.31Å; T83-Q135 WeakPolarHBondContact CB-O 3.34Å; T83-Q135 PolarHBondContact OG1-O 3.13Å; T83-L137 HydrophobicContact CG2-CD2 3.82Å
84	E	82.8	Confident	73.6	Confident	82 Å²	82	38.6 Å²	38.6	38%	0.383	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	149.4	179	74.6	-161.8	168.9	0	0	110.4	L50 V51 M134 L469	L50-E84 CarbonylContact O-C 3.58Å; L50-E84 VanDerWaalsContact O-CA 3.31Å; L50-E84 WeakPolarHBondContact O-CA 3Å; V51-E84 HydrophobicContact CG1-CB 4.47Å; V51-E84 HydrophobicContact CG2-CB 4.38Å; E84-M134 HydrophobicContact CB-CE 3.8Å; E84-M134 HydrophobicContact CG-CE 3.37Å; E84-L469 HydrophobicContact CB-CD1 4.43Å; E84-L469 HydrophobicContact CB-CD2 3.64Å; E84-L469 HydrophobicContact CG-CD1 3.62Å; E84-L469 HydrophobicContact CG-CD2 3.81Å; E84-L469 HydrophobicContact CG-CG 4.29Å; E84-L469 WeakPolarHBondContact OE1-CD1 3.35Å; E84-L469 WeakPolarHBondContact OE2-CD1 3.49Å; E84-L469 WeakPolarHBondContact OE2-CD2 3.33Å
85	T	81.2	Confident	75.8	Confident	26 Å²	26	38 Å²	38	16%	0.16	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	149.9	178.6	-172.2	0	0	0	0	110.5	G49 L50 F87 L137 I139	G49-T85 CarbonylContact C-O 3.58Å; G49-T85 WeakPolarHBondContact CA-O 3.47Å; L50-T85 HydrophobicContact CB-CG2 3.91Å; L50-T85 PolarHBondContact N-O 3.41Å; L50-T85 PolarHBondContact O-N 3.28Å; T85-F87 HydrophobicContact CG2-CE1 4.32Å; T85-F87 HydrophobicContact CG2-CE2 4.19Å; T85-F87 HydrophobicContact CG2-CZ 3.72Å; T85-L137 HydrophobicContact CG2-CD2 4.15Å; T85-I139 HydrophobicContact CG2-CD1 4.24Å
86	S	82.8	Confident	77.5	Confident	66 Å²	66	38.1 Å²	38.1	46%	0.462	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	154.7	176.1	53.7	0	0	0	0	111.2	G48	G48-S86 WeakPolarHBondContact O-CA 3.33Å
87	F	82.3	Confident	78.8	Confident	18 Å²	18	35.1 Å²	35.1	8%	0.079	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.4	175.8	-58.6	-65.1	0	0	0	110.2	G48 L50 T85 S89 V91 I110 L112 Q118 V120 I139	G48-F87 PolarHBondContact N-O 3.23Å; G48-F87 PolarHBondContact O-N 3.17Å; L50-F87 HydrophobicContact CB-CE2 3.76Å; L50-F87 HydrophobicContact CB-CZ 4.27Å; T85-F87 HydrophobicContact CG2-CE1 4.32Å; T85-F87 HydrophobicContact CG2-CE2 4.19Å; T85-F87 HydrophobicContact CG2-CZ 3.72Å; F87-S89 WeakPolarHBondContact CB-O 3.38Å; F87-S89 PolarHBondContact O-N 2.61Å; F87-S89 VanDerWaalsContact O-N 3.17Å; F87-V91 HydrophobicContact CD2-CG2 3.66Å; F87-V91 HydrophobicContact CE2-CG2 3.92Å; F87-I110 HydrophobicContact CE2-CD1 3.69Å; F87-I110 HydrophobicContact CZ-CD1 3.47Å; F87-I110 VanDerWaalsContact CZ-CD1 3.47Å; F87-L112 HydrophobicContact CB-CD1 4.19Å; F87-L112 HydrophobicContact CB-CD2 4.3Å; F87-L112 HydrophobicContact CD1-CD1 4.4Å; F87-L112 HydrophobicContact CD2-CD2 4.1Å; F87-L112 HydrophobicContact CG-CD1 4.32Å; F87-L112 HydrophobicContact CG-CD2 4.14Å; F87-Q118 HydrophobicContact CD1-CG 4.2Å; F87-Q118 HydrophobicContact CE1-CB 4.34Å; F87-Q118 HydrophobicContact CE1-CG 3.9Å; F87-V120 HydrophobicContact CZ-CG2 4.46Å; F87-I139 HydrophobicContact CE1-CD1 4.1Å
88	D	81	Confident	79.2	Confident	155 Å²	155	38.9 Å²	38.9	83%	0.829	22%	0.216	S	C	*	.	S	Bend	trans	-75.8	10.2	172.1	-60.7	-35.5	0	0	0	113	W46	W46-D88 WeakPolarHBondContact CB-O 3.42Å; W46-D88 CarbonylContact O-C 3.52Å
89	S	83.5	Confident	79.3	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-150.3	155.1	170.7	-172.4	0	0	0	0	111.4	W46 G48 F87 D113 D114	W46-S89 WeakPolarHBondContact O-CA 3.49Å; W46-S89 PolarHBondContact O-N 3Å; G48-S89 WeakPolarHBondContact CA-O 3.39Å; G48-S89 PolarHBondContact N-O 2.97Å; F87-S89 WeakPolarHBondContact CB-O 3.38Å; F87-S89 PolarHBondContact O-N 2.61Å; F87-S89 VanDerWaalsContact O-N 3.17Å; S89-D113 PolarHBondContact OG-N 3.18Å; S89-D114 PolarHBondContact OG-N 3.3Å; S89-D114 VanDerWaalsContact OG-N 3.11Å
90	S	82.4	Confident	78.7	Confident	5 Å²	5	36.6 Å²	36.6	4%	0.035	21%	0.214	C	C	.	.			trans	-60.9	142.5	178.1	-73.1	0	0	0	0	111.8	S39 A92 L112 D113	S39-S90 VanDerWaalsContact CB-OG 3.27Å; S39-S90 WeakPolarHBondContact CB-OG 3.45Å; S90-A92 PolarHBondContact O-N 3.3Å; S90-L112 VanDerWaalsContact O-CA 3.32Å; S90-L112 WeakPolarHBondContact O-CA 3.5Å; S90-D113 WeakPolarHBondContact CB-OD2 3.23Å; S90-D113 PolarHBondContact O-N 2.91Å
91	V	84.9	Confident	77.4	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	114.2	175.3	177.1	0	0	0	0	110.1	S25 A26 S38 G49 F87 I94 I110 L112	S25-V91 WeakPolarHBondContact CB-O 3.13Å; S25-V91 PolarHBondContact OG-O 2.83Å; A26-V91 HydrophobicContact CB-CG1 3.82Å; S38-V91 PolarHBondContact O-N 2.81Å; S38-V91 VanDerWaalsContact O-N 3.12Å; G49-V91 WeakPolarHBondContact O-CG2 3.48Å; F87-V91 HydrophobicContact CD2-CG2 3.66Å; F87-V91 HydrophobicContact CE2-CG2 3.92Å; V91-I94 HydrophobicContact CG1-CD1 4.18Å; V91-I94 HydrophobicContact CG1-CG1 3.92Å; V91-I110 HydrophobicContact CB-CG2 4.23Å; V91-I110 HydrophobicContact CG1-CG2 3.47Å; V91-I110 VanDerWaalsContact CG1-CG2 3.47Å; V91-I110 HydrophobicContact CG2-CG2 3.94Å; V91-L112 HydrophobicContact CG2-CD2 3.93Å
92	A	83.8	Confident	75.8	Confident	8 Å²	8	40.9 Å²	40.9	7%	0.066	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	-37	-179.6	0	0	0	0	0	112.9	S90 G111 D113 L149 Y393	S90-A92 PolarHBondContact O-N 3.3Å; A92-G111 PolarHBondContact N-O 2.85Å; A92-D113 WeakPolarHBondContact CB-OD1 3.41Å; A92-L149 WeakPolarHBondContact CB-O 3.45Å; A92-Y393 PolarHBondContact O-OH 2.91Å
93	S	88	Confident	74.1	Confident	16 Å²	16	47.9 Å²	47.9	11%	0.112	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	146.2	-172.7	-168.7	0	0	0	0	111.6	I110 G111 V152	S93-I110 WeakPolarHBondContact O-CA 3.46Å; S93-G111 PolarHBondContact N-O 2.83Å; S93-G111 PolarHBondContact O-N 2.98Å; S93-V152 PolarHBondContact OG-N 2.89Å
94	I	88.6	Confident	72.5	Confident	17 Å²	17	53.2 Å²	53.2	9%	0.087	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.4	177	-64	170.7	0	0	0	108.6	A26 F35 L50 V91 V108 V109	A26-I94 HydrophobicContact CB-CB 4.34Å; A26-I94 HydrophobicContact CB-CD1 3.72Å; A26-I94 HydrophobicContact CB-CG1 3.69Å; F35-I94 HydrophobicContact CB-CD1 4.27Å; F35-I94 HydrophobicContact CB-CG2 4.16Å; L50-I94 HydrophobicContact CD1-CD1 4Å; V91-I94 HydrophobicContact CG1-CD1 4.18Å; V91-I94 HydrophobicContact CG1-CG1 3.92Å; I94-V108 HydrophobicContact CG2-CB 4.39Å; I94-V109 WeakPolarHBondContact CA-O 3.44Å
95	A	89	Confident	71.5	Confident	11 Å²	11	51.9 Å²	51.9	9%	0.091	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.8	172.7	0	0	0	0	0	110.8	V108 V109 V152 A154	A95-V108 CarbonylContact O-C 3.44Å; A95-V108 WeakPolarHBondContact O-CA 3.17Å; A95-V109 PolarHBondContact N-O 3.23Å; A95-V109 PolarHBondContact O-N 2.82Å; A95-V152 HydrophobicContact CB-CB 4.35Å; A95-V152 HydrophobicContact CB-CG1 3.97Å; A95-A154 HydrophobicContact CB-CB 3.92Å
96	A	83.6	Confident	71.2	Confident	33 Å²	33	51.6 Å²	51.6	27%	0.273	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130	175.2	0	0	0	0	0	111.6	H30 A154	H30-A96 HydrophobicContact CB-CB 3.61Å; A96-A154 WeakPolarHBondContact O-CB 3.48Å
97	L	80.2	Confident	71.2	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.9	171.6	-69	164.3	0	0	0	108.9	H30 L99 A107 V109 L119 A154 P163 I165	H30-L97 PolarHBondContact NE2-O 2.95Å; L97-L99 HydrophobicContact CB-CG 4.4Å; L97-L99 PolarHBondContact O-N 3.07Å; L97-A107 HydrophobicContact CB-CB 4.12Å; L97-A107 WeakPolarHBondContact CB-O 3.43Å; L97-A107 HydrophobicContact CD1-CB 3.92Å; L97-A107 PolarHBondContact N-O 2.81Å; L97-V109 HydrophobicContact CD1-CG2 3.59Å; L97-V109 HydrophobicContact CD2-CG2 4.11Å; L97-V109 HydrophobicContact CG-CG2 3.85Å; L97-L119 HydrophobicContact CD1-CD1 3.3Å; L97-A154 HydrophobicContact CD2-CB 3.7Å; L97-A154 HydrophobicContact CG-CB 4.32Å; L97-P163 HydrophobicContact CD2-CB 3.73Å; L97-P163 HydrophobicContact CD2-CG 3.82Å; L97-I165 HydrophobicContact CD2-CG1 4.37Å
98	N	67.8	Low	71.6	Confident	78 Å²	78	47.7 Å²	47.7	42%	0.417	28%	0.279	S	S	.	.			trans	-81.2	109.7	163.1	-142.4	-7.7	0	0	0	106.2	Q156	N98-Q156 PolarHBondContact O-OE1 2.83Å
99	L	61.1	Low	72.1	Confident	59 Å²	59	40.3 Å²	40.3	31%	0.309	24%	0.24	S	C	.	.			trans	-101.7	98.9	173.3	-73.9	166.2	0	0	0	106.7	L97 C101 A107 P163	L97-L99 HydrophobicContact CB-CG 4.4Å; L97-L99 PolarHBondContact O-N 3.07Å; L99-C101 PolarHBondContact O-N 2.83Å; L99-A107 HydrophobicContact CD1-CB 3.68Å; L99-P163 HydrophobicContact CD2-CG 3.6Å
100	S	50.9	Low	72.5	Confident	84 Å²	84	40.3 Å²	40.3	59%	0.587	24%	0.24	S	C	*	.			trans	-68.6	-8.2	178.1	60.8	0	0	0	0	114	S102 Q156	S100-S102 PolarHBondContact O-N 2.71Å; S100-Q156 PolarHBondContact OG-NE2 2.81Å
101	C	41.3	Very low	73	Confident	65 Å²	65	40.1 Å²	40.1	44%	0.439	24%	0.238	S	C	.	.	S	Bend	trans	-87.4	105.3	177.1	-77.4	0	0	0	0	111.7	L99	L99-C101 PolarHBondContact O-N 2.83Å
102	S	38.5	Very low	73.3	Confident	106 Å²	106	40.2 Å²	40.2	74%	0.741	24%	0.239	S	C	*	.	S	Bend	trans	16.9	123.8	153.8	60	0	0	0	0	118.7	S100	S100-S102 PolarHBondContact O-N 2.71Å
103	E	42.4	Very low	73.4	Confident	168 Å²	168	42.6 Å²	42.6	79%	0.785	25%	0.25	S	C	*	.	S	Bend	trans	87.2	76.3	173.4	-56.2	-168.1	174.2	0	0	115.6	T105	E103-T105 PolarHBondContact O-N 3.21Å; E103-T105 PolarHBondContact O-OG1 2.79Å
104	L	46.9	Very low	73.3	Confident	119 Å²	119	44.8 Å²	44.8	62%	0.623	26%	0.261	S	S	*	.			trans	46.9	32.4	136.9	-64.7	150.1	0	0	0	117.8	E124	L104-E124 HydrophobicContact CB-CG 3.56Å; L104-E124 VanDerWaalsContact CB-OE1 3.28Å; L104-E124 WeakPolarHBondContact CB-OE1 3.5Å; L104-E124 VanDerWaalsContact CD1-CD 3.41Å; L104-E124 VanDerWaalsContact CD1-OE1 3.26Å; L104-E124 WeakPolarHBondContact CD1-OE1 3.26Å; L104-E124 VanDerWaalsContact CD1-OE2 3.27Å; L104-E124 WeakPolarHBondContact CD1-OE2 3.42Å; L104-E124 WeakPolarHBondContact CD2-OE1 3.4Å; L104-E124 WeakPolarHBondContact CG-OE1 3.3Å
105	T	60.5	Low	73.3	Confident	54 Å²	54	44 Å²	44	33%	0.331	26%	0.256	S	S	.	.			trans	-106	102.5	175.9	40.8	0	0	0	0	109.6	E103 A107 T121	E103-T105 PolarHBondContact O-N 3.21Å; E103-T105 PolarHBondContact O-OG1 2.79Å; T105-A107 PolarHBondContact O-N 3.49Å; T105-T121 HydrophobicContact CG2-CG2 3.9Å
106	D	75.1	Confident	73.5	Confident	20 Å²	20	43.7 Å²	43.7	11%	0.107	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	113.4	168.6	-63.4	-46.1	0	0	0	107.8	H30 N31 K33 L122	H30-D106 IonicContact CD2-OD1 3.31Å; N31-D106 WeakPolarHBondContact CB-OD1 3.33Å; N31-D106 PolarHBondContact ND2-OD1 3.13Å; K33-D106 HydrophobicContact CD-CB 4.24Å; K33-D106 VanDerWaalsContact CD-OD2 3.23Å; K33-D106 WeakPolarHBondContact CD-OD2 2.81Å; K33-D106 WeakPolarHBondContact CE-OD2 3.5Å; K33-D106 IonicContact NZ-OD2 3.54Å; K33-D106 PolarHBondContact NZ-OD2 3.34Å; D106-L122 HydrophobicContact CB-CB 4.23Å; D106-L122 HydrophobicContact CB-CD1 3.99Å; D106-L122 HydrophobicContact CB-CG 4.44Å; D106-L122 PolarHBondContact O-N 2.76Å
107	A	84.1	Confident	74	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.7	179.6	0	0	0	0	0	111.1	L97 L99 T105 V120 T121	L97-A107 HydrophobicContact CB-CB 4.12Å; L97-A107 WeakPolarHBondContact CB-O 3.43Å; L97-A107 HydrophobicContact CD1-CB 3.92Å; L97-A107 PolarHBondContact N-O 2.81Å; L99-A107 HydrophobicContact CD1-CB 3.68Å; T105-A107 PolarHBondContact O-N 3.49Å; A107-V120 CarbonylContact C-O 3.58Å; A107-V120 VanDerWaalsContact CA-O 3.3Å; A107-V120 WeakPolarHBondContact CA-O 3.41Å; A107-T121 HydrophobicContact CB-CG2 4.48Å
108	V	89.1	Confident	74.6	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149.1	173.9	-60.2	0	0	0	0	109.8	F35 L50 I94 A95 I110 V120	F35-V108 HydrophobicContact CD1-CB 4.36Å; F35-V108 HydrophobicContact CD1-CG1 3.67Å; F35-V108 HydrophobicContact CD1-CG2 3.83Å; F35-V108 HydrophobicContact CD2-CG1 3.95Å; F35-V108 HydrophobicContact CE1-CB 4.29Å; F35-V108 HydrophobicContact CE1-CG1 3.41Å; F35-V108 VanDerWaalsContact CE1-CG1 3.41Å; F35-V108 HydrophobicContact CE1-CG2 3.84Å; F35-V108 HydrophobicContact CE2-CG1 3.72Å; F35-V108 HydrophobicContact CG-CG1 3.94Å; F35-V108 HydrophobicContact CZ-CG1 3.44Å; F35-V108 VanDerWaalsContact CZ-CG1 3.44Å; L50-V108 HydrophobicContact CD2-CG2 4.39Å; I94-V108 HydrophobicContact CG2-CB 4.39Å; A95-V108 CarbonylContact O-C 3.44Å; A95-V108 WeakPolarHBondContact O-CA 3.17Å; V108-I110 HydrophobicContact CG2-CG1 4.36Å; V108-V120 HydrophobicContact CG2-CB 3.94Å; V108-V120 PolarHBondContact N-O 3.5Å; V108-V120 PolarHBondContact O-N 3.36Å
109	V	91.8	Very high	75.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.1	169.7	-170.2	0	0	0	0	108.4	I94 A95 L97 Q118 L119 V152 I165	I94-V109 WeakPolarHBondContact CA-O 3.44Å; A95-V109 PolarHBondContact N-O 3.23Å; A95-V109 PolarHBondContact O-N 2.82Å; L97-V109 HydrophobicContact CD1-CG2 3.59Å; L97-V109 HydrophobicContact CD2-CG2 4.11Å; L97-V109 HydrophobicContact CG-CG2 3.85Å; V109-Q118 CarbonylContact C-O 3.51Å; V109-Q118 WeakPolarHBondContact CA-O 3.25Å; V109-L119 HydrophobicContact CG2-CD1 4.13Å; V109-V152 HydrophobicContact CB-CG1 3.93Å; V109-V152 HydrophobicContact CG1-CG1 3.69Å; V109-I165 HydrophobicContact CG1-CD1 4.21Å; V109-I165 HydrophobicContact CG1-CG2 4.02Å; V109-I165 HydrophobicContact CG2-CD1 3.54Å; V109-I165 HydrophobicContact CG2-CG1 3.89Å; V109-I165 HydrophobicContact CG2-CG2 4.39Å
110	I	92.4	Very high	77.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.9	178.3	-49	175.3	0	0	0	107.9	L50 F87 V91 S93 V108 L112 I117 Q118 V120	L50-I110 HydrophobicContact CB-CD1 4.14Å; L50-I110 HydrophobicContact CD2-CD1 3.65Å; L50-I110 HydrophobicContact CG-CD1 4.32Å; F87-I110 HydrophobicContact CE2-CD1 3.69Å; F87-I110 HydrophobicContact CZ-CD1 3.47Å; F87-I110 VanDerWaalsContact CZ-CD1 3.47Å; V91-I110 HydrophobicContact CB-CG2 4.23Å; V91-I110 HydrophobicContact CG1-CG2 3.47Å; V91-I110 VanDerWaalsContact CG1-CG2 3.47Å; V91-I110 HydrophobicContact CG2-CG2 3.94Å; S93-I110 WeakPolarHBondContact O-CA 3.46Å; V108-I110 HydrophobicContact CG2-CG1 4.36Å; I110-L112 HydrophobicContact CG2-CD2 3.88Å; I110-I117 CarbonylContact O-C 3.52Å; I110-I117 VanDerWaalsContact O-CA 3.32Å; I110-I117 WeakPolarHBondContact O-CA 3.48Å; I110-Q118 HydrophobicContact CB-CB 4.13Å; I110-Q118 PolarHBondContact N-O 3.45Å; I110-Q118 PolarHBondContact O-N 3.24Å; I110-V120 HydrophobicContact CD1-CB 4.49Å; I110-V120 HydrophobicContact CD1-CG2 3.57Å; I110-V120 HydrophobicContact CG1-CG2 4.24Å
111	G	92.3	Very high	78.9	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.6	167.2	0	0	0	0	0	110.1	A92 S93 L149	A92-G111 PolarHBondContact N-O 2.85Å; S93-G111 PolarHBondContact N-O 2.83Å; S93-G111 PolarHBondContact O-N 2.98Å; G111-L149 VanDerWaalsContact CA-CD1 3.46Å
112	L	90.9	Very high	80.9	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	154.8	-179.5	-59.1	-175.9	0	0	0	111.8	F87 S90 V91 I110 D114 G115 S116 Q118 L149	F87-L112 HydrophobicContact CB-CD1 4.19Å; F87-L112 HydrophobicContact CB-CD2 4.3Å; F87-L112 HydrophobicContact CD1-CD1 4.4Å; F87-L112 HydrophobicContact CD2-CD2 4.1Å; F87-L112 HydrophobicContact CG-CD1 4.32Å; F87-L112 HydrophobicContact CG-CD2 4.14Å; S90-L112 VanDerWaalsContact O-CA 3.32Å; S90-L112 WeakPolarHBondContact O-CA 3.5Å; V91-L112 HydrophobicContact CG2-CD2 3.93Å; I110-L112 HydrophobicContact CG2-CD2 3.88Å; L112-D114 WeakPolarHBondContact CB-OD1 3.47Å; L112-D114 PolarHBondContact O-N 3.22Å; L112-D114 VanDerWaalsContact O-N 3.13Å; L112-G115 PolarHBondContact O-N 2.85Å; L112-G115 VanDerWaalsContact O-N 3.09Å; L112-S116 WeakPolarHBondContact CB-O 3.21Å; L112-S116 PolarHBondContact N-O 3.26Å; L112-Q118 HydrophobicContact CD1-CG 3.82Å; L112-Q118 HydrophobicContact CG-CG 4.2Å; L112-L149 WeakPolarHBondContact O-CB 3.5Å; L112-L149 PolarHBondContact O-N 2.79Å
113	D	85.9	Confident	82.8	Confident	57 Å²	57	33.2 Å²	33.2	31%	0.305	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-8.3	179.6	-80.7	-18.3	0	0	0	113.7	S89 S90 A92 P148	S89-D113 PolarHBondContact OG-N 3.18Å; S90-D113 WeakPolarHBondContact CB-OD2 3.23Å; S90-D113 PolarHBondContact O-N 2.91Å; A92-D113 WeakPolarHBondContact CB-OD1 3.41Å; D113-P148 VanDerWaalsContact O-CA 3.23Å; D113-P148 WeakPolarHBondContact O-CA 3.36Å; D113-P148 WeakPolarHBondContact O-CB 3.46Å; D113-P148 VanDerWaalsContact O-CG 3.23Å; D113-P148 WeakPolarHBondContact O-CG 3.45Å
114	D	86.7	Confident	84.1	Confident	63 Å²	63	30.7 Å²	30.7	34%	0.337	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-0.1	174	70.8	-20.6	0	0	0	113	W46 S89 L112 S116	W46-D114 HydrophobicContact CE3-CB 4.46Å; W46-D114 HydrophobicContact CZ3-CB 4.34Å; S89-D114 PolarHBondContact OG-N 3.3Å; S89-D114 VanDerWaalsContact OG-N 3.11Å; L112-D114 WeakPolarHBondContact CB-OD1 3.47Å; L112-D114 PolarHBondContact O-N 3.22Å; L112-D114 VanDerWaalsContact O-N 3.13Å; D114-S116 WeakPolarHBondContact OD1-CB 3.44Å; D114-S116 PolarHBondContact OD1-N 2.79Å; D114-S116 PolarHBondContact OD1-OG 2.94Å; D114-S116 WeakPolarHBondContact OD2-CB 3.35Å; D114-S116 PolarHBondContact OD2-OG 3.27Å
115	G	89.3	Confident	85	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	90	-1.3	-175.4	0	0	0	0	0	114.3	L112 W147	L112-G115 PolarHBondContact O-N 2.85Å; L112-G115 VanDerWaalsContact O-N 3.09Å; G115-W147 WeakPolarHBondContact CA-O 3.39Å
116	S	92.7	Very high	84.8	Confident	5 Å²	5	29.7 Å²	29.7	4%	0.035	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	145.3	179.1	-59	0	0	0	0	111.7	L112 D114 A142 T143 L149	L112-S116 WeakPolarHBondContact CB-O 3.21Å; L112-S116 PolarHBondContact N-O 3.26Å; D114-S116 WeakPolarHBondContact OD1-CB 3.44Å; D114-S116 PolarHBondContact OD1-N 2.79Å; D114-S116 PolarHBondContact OD1-OG 2.94Å; D114-S116 WeakPolarHBondContact OD2-CB 3.35Å; D114-S116 PolarHBondContact OD2-OG 3.27Å; S116-A142 WeakPolarHBondContact CA-O 3.39Å; S116-T143 WeakPolarHBondContact OG-CG2 3.11Å; S116-T143 PolarHBondContact OG-OG1 3.15Å; S116-L149 VanDerWaalsContact O-CD1 3.28Å; S116-L149 WeakPolarHBondContact O-CD1 3.4Å
117	I	94.4	Very high	83.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143	166.8	57.2	170.6	0	0	0	111.1	I110 S141 A142 L149 T167 W177 L182	I110-I117 CarbonylContact O-C 3.52Å; I110-I117 VanDerWaalsContact O-CA 3.32Å; I110-I117 WeakPolarHBondContact O-CA 3.48Å; I117-S141 WeakPolarHBondContact O-CA 3.47Å; I117-A142 HydrophobicContact CD1-CB 4.36Å; I117-A142 HydrophobicContact CG1-CB 3.95Å; I117-A142 WeakPolarHBondContact CG1-O 3.27Å; I117-A142 PolarHBondContact N-O 2.74Å; I117-A142 PolarHBondContact O-N 2.99Å; I117-L149 HydrophobicContact CG2-CD1 3.48Å; I117-L149 VanDerWaalsContact CG2-CD1 3.48Å; I117-T167 HydrophobicContact CG2-CG2 3.76Å; I117-W177 HydrophobicContact CD1-CD2 3.65Å; I117-W177 HydrophobicContact CD1-CE3 3.46Å; I117-W177 VanDerWaalsContact CD1-CE3 3.46Å; I117-W177 HydrophobicContact CD1-CG 4.42Å; I117-W177 HydrophobicContact CD1-CH2 3.5Å; I117-W177 HydrophobicContact CD1-CZ2 3.74Å; I117-W177 HydrophobicContact CD1-CZ3 3.38Å; I117-W177 HydrophobicContact CG1-CH2 3.94Å; I117-W177 HydrophobicContact CG1-CZ2 4.35Å; I117-W177 HydrophobicContact CG1-CZ3 4.12Å; I117-L182 HydrophobicContact CD1-CD1 3.6Å; I117-L182 HydrophobicContact CD1-CD2 4.41Å; I117-L182 HydrophobicContact CD1-CG 3.8Å; I117-L182 HydrophobicContact CG1-CD1 4.32Å; I117-L182 HydrophobicContact CG1-CD2 4.37Å; I117-L182 HydrophobicContact CG1-CG 4.28Å
118	Q	92.7	Very high	82.2	Confident	17 Å²	17	40.1 Å²	40.1	8%	0.079	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	119.5	176.9	-52.4	-66.5	-17.2	0	0	109.3	F87 V109 I110 L112 V120 I139 S141	F87-Q118 HydrophobicContact CD1-CG 4.2Å; F87-Q118 HydrophobicContact CE1-CB 4.34Å; F87-Q118 HydrophobicContact CE1-CG 3.9Å; V109-Q118 CarbonylContact C-O 3.51Å; V109-Q118 WeakPolarHBondContact CA-O 3.25Å; I110-Q118 HydrophobicContact CB-CB 4.13Å; I110-Q118 PolarHBondContact N-O 3.45Å; I110-Q118 PolarHBondContact O-N 3.24Å; L112-Q118 HydrophobicContact CD1-CG 3.82Å; L112-Q118 HydrophobicContact CG-CG 4.2Å; Q118-V120 HydrophobicContact CB-CG2 4.33Å; Q118-I139 HydrophobicContact CB-CG2 4.13Å; Q118-S141 PolarHBondContact NE2-OG 3.28Å; Q118-S141 PolarHBondContact OE1-OG 3.5Å
119	L	92.2	Very high	80.4	Confident	15 Å²	15	42.1 Å²	42.1	8%	0.079	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	105.8	167.1	175.1	63.5	0	0	0	108.3	L97 V109 I139 N140 L182	L97-L119 HydrophobicContact CD1-CD1 3.3Å; V109-L119 HydrophobicContact CG2-CD1 4.13Å; L119-I139 WeakPolarHBondContact O-CA 3.25Å; L119-N140 HydrophobicContact CB-CB 4.32Å; L119-N140 PolarHBondContact N-O 3.38Å; L119-N140 PolarHBondContact O-N 3.22Å; L119-L182 HydrophobicContact CB-CD1 4.1Å; L119-L182 HydrophobicContact CB-CD2 4.48Å
120	V	90	Very high	78.1	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.2	179.2	-178.4	0	0	0	0	109.1	L50 F87 A107 V108 I110 Q118 L137 T138 I139	L50-V120 HydrophobicContact CD2-CG1 4.27Å; F87-V120 HydrophobicContact CZ-CG2 4.46Å; A107-V120 CarbonylContact C-O 3.58Å; A107-V120 VanDerWaalsContact CA-O 3.3Å; A107-V120 WeakPolarHBondContact CA-O 3.41Å; V108-V120 HydrophobicContact CG2-CB 3.94Å; V108-V120 PolarHBondContact N-O 3.5Å; V108-V120 PolarHBondContact O-N 3.36Å; I110-V120 HydrophobicContact CD1-CB 4.49Å; I110-V120 HydrophobicContact CD1-CG2 3.57Å; I110-V120 HydrophobicContact CG1-CG2 4.24Å; Q118-V120 HydrophobicContact CB-CG2 4.33Å; V120-L137 HydrophobicContact CG1-CB 4.4Å; V120-T138 WeakPolarHBondContact CA-O 3.32Å; V120-I139 HydrophobicContact CG2-CG1 4.24Å; V120-I139 HydrophobicContact CG2-CG2 4.45Å
121	T	87.6	Confident	75.8	Confident	26 Å²	26	58 Å²	58	16%	0.16	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.7	177	-49.8	0	0	0	0	109.8	T105 A107 L137 T138	T105-T121 HydrophobicContact CG2-CG2 3.9Å; A107-T121 HydrophobicContact CB-CG2 4.48Å; T121-L137 CarbonylContact O-C 3.59Å; T121-L137 VanDerWaalsContact O-CA 3.29Å; T121-L137 WeakPolarHBondContact O-CA 3.27Å; T121-T138 PolarHBondContact N-O 3.13Å; T121-T138 PolarHBondContact O-N 3.18Å
122	L	84.3	Confident	74	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.1	173.9	-59.1	175.5	0	0	0	109.2	K33 F35 V52 T83 D106 L137	K33-L122 HydrophobicContact CD-CD1 3.55Å; K33-L122 VanDerWaalsContact NZ-CD1 3.27Å; F35-L122 HydrophobicContact CE1-CD1 3.97Å; F35-L122 HydrophobicContact CZ-CD1 4.07Å; V52-L122 HydrophobicContact CG1-CD1 3.82Å; V52-L122 HydrophobicContact CG2-CD1 4.48Å; V52-L122 HydrophobicContact CG2-CD2 4.49Å; T83-L122 HydrophobicContact CG2-CD2 3.41Å; T83-L122 VanDerWaalsContact CG2-CD2 3.41Å; D106-L122 HydrophobicContact CB-CB 4.23Å; D106-L122 HydrophobicContact CB-CD1 3.99Å; D106-L122 HydrophobicContact CB-CG 4.44Å; D106-L122 PolarHBondContact O-N 2.76Å; L122-L137 HydrophobicContact CD2-CB 4.12Å
123	R	78.2	Confident	72.6	Confident	145 Å²	145	70.6 Å²	70.6	55%	0.547	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-97.1	136.3	177.6	-68.6	-175.2	177.1	-171.9	-2.1	110.4	V125 Q135 P136	R123-V125 PolarHBondContact O-N 3.13Å; R123-Q135 VanDerWaalsContact O-CD 3.27Å; R123-Q135 WeakPolarHBondContact O-CG 3.26Å; R123-Q135 PolarHBondContact O-NE2 2.67Å; R123-P136 HydrophobicContact CB-CG 4.18Å; R123-P136 PolarHBondContact N-O 2.99Å
124	E	69.2	Low	72.1	Confident	116 Å²	116	71.6 Å²	71.6	54%	0.542	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-55.3	140.3	176.9	-70.6	-152.8	129	0	0	112.9	L104	L104-E124 HydrophobicContact CB-CG 3.56Å; L104-E124 VanDerWaalsContact CB-OE1 3.28Å; L104-E124 WeakPolarHBondContact CB-OE1 3.5Å; L104-E124 VanDerWaalsContact CD1-CD 3.41Å; L104-E124 VanDerWaalsContact CD1-OE1 3.26Å; L104-E124 WeakPolarHBondContact CD1-OE1 3.26Å; L104-E124 VanDerWaalsContact CD1-OE2 3.27Å; L104-E124 WeakPolarHBondContact CD1-OE2 3.42Å; L104-E124 WeakPolarHBondContact CD2-OE1 3.4Å; L104-E124 WeakPolarHBondContact CG-OE1 3.3Å
125	V	64.7	Low	71.7	Confident	64 Å²	64	69.6 Å²	69.6	39%	0.388	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-81.1	118.4	170.8	-174.5	0	0	0	0	107.2	R123 A127 S129 Q135	R123-V125 PolarHBondContact O-N 3.13Å; V125-A127 PolarHBondContact O-N 2.89Å; V125-S129 WeakPolarHBondContact CG1-OG 3.28Å; V125-Q135 HydrophobicContact CG2-CB 4.02Å; V125-Q135 HydrophobicContact CG2-CG 3.83Å
126	S	57.1	Low	71.3	Confident	88 Å²	88	72.8 Å²	72.8	62%	0.615	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-55.2	134.2	176.1	62.3	0	0	0	0	110.2	N128 S129	S126-N128 PolarHBondContact O-N 2.8Å; S126-S129 PolarHBondContact O-N 3.17Å; S126-S129 PolarHBondContact O-OG 2.91Å
127	A	55.7	Low	71	Confident	98 Å²	98	74.7 Å²	74.7	81%	0.81	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-6.6	-172.3	0	0	0	0	0	116.4	V125	V125-A127 PolarHBondContact O-N 2.89Å
128	N	49.7	Very low	70.7	Confident	142 Å²	142	76.6 Å²	76.6	76%	0.759	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	0.6	-175.5	-67	-11.7	0	0	0	114.7	S126 H130	S126-N128 PolarHBondContact O-N 2.8Å; N128-H130 PolarHBondContact O-N 2.89Å
129	S	49.6	Very low	70.5	Confident	43 Å²	43	78.4 Å²	78.4	30%	0.301	43%	0.428	S	S	.	.			trans	-87.2	98	175.7	60.6	0	0	0	0	110.9	V125 S126 Q131	V125-S129 WeakPolarHBondContact CG1-OG 3.28Å; S126-S129 PolarHBondContact O-N 3.17Å; S126-S129 PolarHBondContact O-OG 2.91Å; S129-Q131 PolarHBondContact O-N 2.78Å; S129-Q131 VanDerWaalsContact O-N 3.13Å
130	H	45	Very low	70.4	Confident	182 Å²	182	82 Å²	82	84%	0.843	45%	0.448	S	S	*	.			trans	-78.8	24.4	179	-77.3	-60.6	0	0	0	115.1	N128	N128-H130 PolarHBondContact O-N 2.89Å
131	Q	44.2	Very low	70.5	Confident	151 Å²	151	85.6 Å²	85.6	71%	0.706	47%	0.473	S	S	*	.	S	Bend	trans	-129.6	146.7	172.3	-78.8	-178.2	-22.7	0	0	109.5	S129 Q133	S129-Q131 PolarHBondContact O-N 2.78Å; S129-Q131 VanDerWaalsContact O-N 3.13Å; Q131-Q133 PolarHBondContact O-N 2.76Å
132	S	54.3	Low	70.6	Confident	131 Å²	131	85 Å²	85	92%	0.916	47%	0.47	S	S	*	.			trans	-60.5	62.4	172.9	54.2	0	0	0	0	111.3
133	Q	61.8	Low	70.8	Confident	138 Å²	138	89 Å²	89	65%	0.645	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-84.7	128.8	171.8	-96.2	-178.7	-21.6	0	0	108	Q131 Q135	Q131-Q133 PolarHBondContact O-N 2.76Å; Q133-Q135 PolarHBondContact O-N 3.19Å
134	M	75.4	Confident	71.2	Confident	78 Å²	78	86.7 Å²	86.7	38%	0.384	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-49.8	138.4	170.5	-66.1	-73.8	-106.9	0	0	109.6	V81 V82 E84	V81-M134 HydrophobicContact CG1-CE 3.7Å; V81-M134 HydrophobicContact CG1-SD 3.99Å; V82-M134 CarbonylContact O-C 3.52Å; V82-M134 WeakPolarHBondContact O-CA 3.34Å; E84-M134 HydrophobicContact CB-CE 3.8Å; E84-M134 HydrophobicContact CG-CE 3.37Å
135	Q	78.2	Confident	72.2	Confident	20 Å²	20	81.5 Å²	81.5	9%	0.093	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-60.5	127.2	177.1	-170.2	167.3	18.9	0	0	108.8	V82 T83 R123 V125 Q133 L137	V82-Q135 HydrophobicContact CG1-CB 3.45Å; V82-Q135 VanDerWaalsContact CG1-CB 3.45Å; V82-Q135 HydrophobicContact CG1-CG 4.25Å; V82-Q135 PolarHBondContact O-N 3Å; T83-Q135 VanDerWaalsContact CB-O 3.31Å; T83-Q135 WeakPolarHBondContact CB-O 3.34Å; T83-Q135 PolarHBondContact OG1-O 3.13Å; R123-Q135 VanDerWaalsContact O-CD 3.27Å; R123-Q135 WeakPolarHBondContact O-CG 3.26Å; R123-Q135 PolarHBondContact O-NE2 2.67Å; V125-Q135 HydrophobicContact CG2-CB 4.02Å; V125-Q135 HydrophobicContact CG2-CG 3.83Å; Q133-Q135 PolarHBondContact O-N 3.19Å; Q135-L137 PolarHBondContact O-N 2.8Å
136	P	80.7	Confident	73.3	Confident	67 Å²	67	85.8 Å²	85.8	44%	0.435	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-64.7	139.9	177.1	23.7	-29.1	0	0	0	109.9	R123	R123-P136 HydrophobicContact CB-CG 4.18Å; R123-P136 PolarHBondContact N-O 2.99Å
137	L	86.1	Confident	74.8	Confident	45 Å²	45	88.5 Å²	88.5	24%	0.236	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	154.8	176.5	62.5	82.7	0	0	0	110.4	T83 T85 V120 T121 L122 Q135 I139	T83-L137 HydrophobicContact CG2-CD2 3.82Å; T85-L137 HydrophobicContact CG2-CD2 4.15Å; V120-L137 HydrophobicContact CG1-CB 4.4Å; T121-L137 CarbonylContact O-C 3.59Å; T121-L137 VanDerWaalsContact O-CA 3.29Å; T121-L137 WeakPolarHBondContact O-CA 3.27Å; L122-L137 HydrophobicContact CD2-CB 4.12Å; Q135-L137 PolarHBondContact O-N 2.8Å; L137-I139 HydrophobicContact CD1-CD1 3.61Å; L137-I139 HydrophobicContact CD1-CG1 3.38Å
138	T	87.6	Confident	76.2	Confident	41 Å²	41	85.8 Å²	85.8	25%	0.252	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	140	166.4	49.4	0	0	0	0	109.9	V120 T121	V120-T138 WeakPolarHBondContact CA-O 3.32Å; T121-T138 PolarHBondContact N-O 3.13Å; T121-T138 PolarHBondContact O-N 3.18Å
139	I	88.9	Confident	78.1	Confident	54 Å²	54	79.1 Å²	79.1	28%	0.277	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.9	179.8	-51.4	-175.1	0	0	0	107.9	T85 F87 Q118 L119 V120 L137	T85-I139 HydrophobicContact CG2-CD1 4.24Å; F87-I139 HydrophobicContact CE1-CD1 4.1Å; Q118-I139 HydrophobicContact CB-CG2 4.13Å; L119-I139 WeakPolarHBondContact O-CA 3.25Å; V120-I139 HydrophobicContact CG2-CG1 4.24Å; V120-I139 HydrophobicContact CG2-CG2 4.45Å; L137-I139 HydrophobicContact CD1-CD1 3.61Å; L137-I139 HydrophobicContact CD1-CG1 3.38Å
140	N	89.5	Confident	79.8	Confident	91 Å²	91	78.6 Å²	78.6	49%	0.487	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.4	165.9	-68.1	-13.3	0	0	0	108.2	L119 L182	L119-N140 HydrophobicContact CB-CB 4.32Å; L119-N140 PolarHBondContact N-O 3.38Å; L119-N140 PolarHBondContact O-N 3.22Å; N140-L182 HydrophobicContact CB-CD2 4.25Å; N140-L182 WeakPolarHBondContact O-CD2 3.45Å
141	S	92	Very high	81.9	Confident	77 Å²	77	72 Å²	72	54%	0.538	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	145	-174.9	-44.7	0	0	0	0	111.1	I117 Q118	I117-S141 WeakPolarHBondContact O-CA 3.47Å; Q118-S141 PolarHBondContact NE2-OG 3.28Å; Q118-S141 PolarHBondContact OE1-OG 3.5Å
142	A	91.6	Very high	84.2	Confident	12 Å²	12	65.1 Å²	65.1	10%	0.099	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	141.6	168.7	0	0	0	0	0	110.7	S116 I117 Y144 W177 L182	S116-A142 WeakPolarHBondContact CA-O 3.39Å; I117-A142 HydrophobicContact CD1-CB 4.36Å; I117-A142 HydrophobicContact CG1-CB 3.95Å; I117-A142 WeakPolarHBondContact CG1-O 3.27Å; I117-A142 PolarHBondContact N-O 2.74Å; I117-A142 PolarHBondContact O-N 2.99Å; A142-Y144 HydrophobicContact CB-CD2 4.04Å; A142-Y144 HydrophobicContact CB-CE2 3.93Å; A142-W177 HydrophobicContact CB-CZ3 4.04Å; A142-L182 HydrophobicContact CB-CB 4.43Å; A142-L182 HydrophobicContact CB-CD2 3.57Å; A142-L182 HydrophobicContact CB-CG 3.76Å
143	T	87.3	Confident	85.8	Confident	86 Å²	86	60.1 Å²	60.1	53%	0.528	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	106.8	179	-44.6	0	0	0	0	108.5	S116	S116-T143 WeakPolarHBondContact OG-CG2 3.11Å; S116-T143 PolarHBondContact OG-OG1 3.15Å
144	Y	86.4	Confident	87	Confident	96 Å²	96	54.9 Å²	54.9	38%	0.376	29%	0.292	S	S	.	.			trans	-131.3	-11.8	177.4	-70.2	-94.3	0	0	0	112.9	A142 K175 W177 M183 P184	A142-Y144 HydrophobicContact CB-CD2 4.04Å; A142-Y144 HydrophobicContact CB-CE2 3.93Å; Y144-K175 PolarHBondContact O-NZ 3.41Å; Y144-W177 AromaticContact CD2-CH2 3.47Å; Y144-W177 HydrophobicContact CD2-CH2 3.47Å; Y144-W177 VanDerWaalsContact CD2-CH2 3.47Å; Y144-W177 AromaticContact CD2-CZ3 3.42Å; Y144-W177 HydrophobicContact CD2-CZ3 3.42Å; Y144-W177 VanDerWaalsContact CD2-CZ3 3.42Å; Y144-W177 HydrophobicContact CE2-CH2 4.46Å; Y144-W177 AromaticContact CE2-CZ3 3.99Å; Y144-W177 HydrophobicContact CE2-CZ3 3.99Å; Y144-W177 AromaticContact CG-CH2 3.93Å; Y144-W177 HydrophobicContact CG-CH2 3.93Å; Y144-W177 HydrophobicContact CG-CZ3 4.18Å; Y144-M183 WeakPolarHBondContact OH-CE 2.96Å; Y144-P184 HydrophobicContact CD1-CG 3.97Å; Y144-P184 HydrophobicContact CD2-CG 4.49Å; Y144-P184 HydrophobicContact CE1-CG 4.27Å; Y144-P184 HydrophobicContact CG-CG 4.09Å
145	H	90.5	Very high	87.1	Confident	7 Å²	7	52.1 Å²	52.1	3%	0.032	28%	0.28	C	S	.	.			trans	-84.4	138.4	171.8	-75.3	-92.5	0	0	0	109.8	W147 L149 T167 D169 K175 W177	H145-W147 VanDerWaalsContact C-N 3.28Å; H145-W147 WeakPolarHBondContact CB-O 3.15Å; H145-L149 HydrophobicContact CB-CD2 4.44Å; H145-T167 PolarHBondContact NE2-OG1 2.92Å; H145-D169 HydrophobicContact CB-CB 4.49Å; H145-D169 IonicContact CE1-OD2 2.6Å; H145-D169 IonicContact CG-OD2 2.79Å; H145-D169 IonicContact ND1-OD2 2.66Å; H145-D169 PolarHBondContact ND1-OD2 2.98Å; H145-K175 WeakPolarHBondContact NE2-CD 3.4Å; H145-W177 AromaticContact CD2-CZ2 3.97Å
146	D	88.2	Confident	86.7	Confident	154 Å²	154	52.4 Å²	52.4	82%	0.824	28%	0.282	S	S	*	.	S	Bend	trans	-85.4	-8.6	174.7	-57.6	-47.5	0	0	0	111.9
147	W	87.2	Confident	85.6	Confident	146 Å²	146	49.6 Å²	49.6	55%	0.553	26%	0.263	S	S	*	.	S	Bend	trans	-127.6	155.6	-176.5	-67.5	94.7	0	0	0	111.1	G115 H145 L149 D169 V170 A171	G115-W147 WeakPolarHBondContact CA-O 3.39Å; H145-W147 VanDerWaalsContact C-N 3.28Å; H145-W147 WeakPolarHBondContact CB-O 3.15Å; W147-L149 PolarHBondContact O-N 3.05Å; W147-D169 HydrophobicContact CB-CB 4.01Å; W147-V170 HydrophobicContact CB-CG2 3.99Å; W147-V170 HydrophobicContact CE3-CG2 4.35Å; W147-A171 HydrophobicContact CB-CB 4.13Å; W147-A171 VanDerWaalsContact CD1-CB 3.43Å; W147-A171 HydrophobicContact CD2-CB 3.99Å; W147-A171 HydrophobicContact CG-CB 3.58Å
148	P	86.2	Confident	84.2	Confident	41 Å²	41	51.5 Å²	51.5	27%	0.266	28%	0.28	S	S	.	.			trans	-49.7	137.1	174.8	-27.7	32.6	0	0	0	113.1	D113 D169 V170	D113-P148 VanDerWaalsContact O-CA 3.23Å; D113-P148 WeakPolarHBondContact O-CA 3.36Å; D113-P148 WeakPolarHBondContact O-CB 3.46Å; D113-P148 VanDerWaalsContact O-CG 3.23Å; D113-P148 WeakPolarHBondContact O-CG 3.45Å; P148-D169 VanDerWaalsContact O-CA 3.28Å; P148-D169 WeakPolarHBondContact O-CA 3.28Å; P148-D169 VanDerWaalsContact O-CB 3.25Å; P148-D169 WeakPolarHBondContact O-CB 3.28Å; P148-V170 HydrophobicContact CB-CG1 4.23Å; P148-V170 HydrophobicContact CB-CG2 4.12Å; P148-V170 HydrophobicContact CG-CG2 4.15Å; P148-V170 PolarHBondContact O-N 3.04Å
149	L	89.1	Confident	82.5	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	133.8	174.2	-74.6	173.9	0	0	0	110.7	A92 G111 L112 S116 I117 H145 W147 V152 T167 D169	A92-L149 WeakPolarHBondContact CB-O 3.45Å; G111-L149 VanDerWaalsContact CA-CD1 3.46Å; L112-L149 WeakPolarHBondContact O-CB 3.5Å; L112-L149 PolarHBondContact O-N 2.79Å; S116-L149 VanDerWaalsContact O-CD1 3.28Å; S116-L149 WeakPolarHBondContact O-CD1 3.4Å; I117-L149 HydrophobicContact CG2-CD1 3.48Å; I117-L149 VanDerWaalsContact CG2-CD1 3.48Å; H145-L149 HydrophobicContact CB-CD2 4.44Å; W147-L149 PolarHBondContact O-N 3.05Å; L149-V152 HydrophobicContact CD1-CG2 4.45Å; L149-T167 HydrophobicContact CD2-CG2 4.48Å; L149-D169 HydrophobicContact CD2-CB 4.46Å
150	E	85.5	Confident	81.1	Confident	32 Å²	32	51.2 Å²	51.2	15%	0.15	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-40.8	175.1	176.7	65.8	-168.3	0	0	110.7	L168 V170 T203 P204 K391	E150-L168 HydrophobicContact CB-CD2 4.46Å; E150-L168 HydrophobicContact CB-CG 4.4Å; E150-L168 HydrophobicContact CG-CD2 4.32Å; E150-L168 PolarHBondContact N-O 2.94Å; E150-V170 HydrophobicContact CB-CG1 4.21Å; E150-T203 PolarHBondContact OE1-OG1 3.24Å; E150-T203 VanDerWaalsContact OE1-OG1 3.08Å; E150-P204 WeakPolarHBondContact CG-O 3.5Å; E150-K391 IonicContact OE1-NZ 2.91Å; E150-K391 PolarHBondContact OE1-NZ 3.03Å; E150-K391 IonicContact OE2-NZ 3.68Å; E150-K391 PolarHBondContact OE2-NZ 2.8Å
151	K	89	Confident	79.8	Confident	45 Å²	45	51.1 Å²	51.1	20%	0.196	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	142.5	-174.6	-154.5	165.7	-173.3	-179.8	0	112.4	I153 T167 L168 D205 I206	K151-I153 HydrophobicContact CG-CG1 4.47Å; K151-T167 WeakPolarHBondContact O-CA 3.25Å; K151-L168 HydrophobicContact CB-CB 4.48Å; K151-L168 PolarHBondContact N-O 2.82Å; K151-L168 VanDerWaalsContact N-O 3.15Å; K151-L168 PolarHBondContact O-N 2.85Å; K151-D205 WeakPolarHBondContact CD-OD1 3.02Å; K151-D205 IonicContact NZ-OD1 3.74Å; K151-D205 PolarHBondContact NZ-OD1 2.77Å; K151-D205 IonicContact NZ-OD2 3.13Å; K151-I206 HydrophobicContact CB-CG2 3.81Å; K151-I206 HydrophobicContact CD-CG2 3.68Å; K151-I206 WeakPolarHBondContact CD-O 3.23Å; K151-I206 WeakPolarHBondContact CE-O 3.12Å; K151-I206 HydrophobicContact CG-CG2 4.1Å; K151-I206 PolarHBondContact NZ-O 2.86Å
152	V	91.9	Very high	78.7	Confident	6 Å²	6	50.5 Å²	50.5	4%	0.036	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.2	169.4	-175.5	0	0	0	0	108.7	S93 A95 V109 L149 I165 I166 T167	S93-V152 PolarHBondContact OG-N 2.89Å; A95-V152 HydrophobicContact CB-CB 4.35Å; A95-V152 HydrophobicContact CB-CG1 3.97Å; V109-V152 HydrophobicContact CB-CG1 3.93Å; V109-V152 HydrophobicContact CG1-CG1 3.69Å; L149-V152 HydrophobicContact CD1-CG2 4.45Å; V152-I165 HydrophobicContact CG1-CG2 3.81Å; V152-I166 CarbonylContact C-O 3.51Å; V152-I166 WeakPolarHBondContact CA-O 3.29Å; V152-T167 HydrophobicContact CG1-CG2 4.39Å; V152-T167 HydrophobicContact CG2-CG2 4.22Å
153	I	89.7	Confident	77.9	Confident	26 Å²	26	50.1 Å²	50.1	13%	0.133	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	133.4	176.7	-58.8	175.5	0	0	0	108	K151 I165 I166 I206 L208	K151-I153 HydrophobicContact CG-CG1 4.47Å; I153-I165 WeakPolarHBondContact O-CA 3.35Å; I153-I166 HydrophobicContact CB-CB 4.38Å; I153-I166 PolarHBondContact N-O 3.15Å; I153-I166 PolarHBondContact O-N 2.81Å; I153-I206 HydrophobicContact CD1-CG1 4.13Å; I153-I206 HydrophobicContact CD1-CG2 3.97Å; I153-L208 HydrophobicContact CD1-CB 4.31Å; I153-L208 HydrophobicContact CG2-CB 3.87Å; I153-L208 HydrophobicContact CG2-CD2 4.04Å
154	A	85.4	Confident	77.6	Confident	28 Å²	28	47.8 Å²	47.8	23%	0.231	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.8	170.5	0	0	0	0	0	109.5	A95 A96 L97	A95-A154 HydrophobicContact CB-CB 3.92Å; A96-A154 WeakPolarHBondContact O-CB 3.48Å; L97-A154 HydrophobicContact CD2-CB 3.7Å; L97-A154 HydrophobicContact CG-CB 4.32Å
155	S	77.3	Confident	77.8	Confident	20 Å²	20	43.2 Å²	43.2	14%	0.14	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.5	174.4	-172.3	0	0	0	0	109.8	P163 H164 L208	S155-P163 CarbonylContact O-C 3.57Å; S155-P163 VanDerWaalsContact O-CA 3.27Å; S155-P163 WeakPolarHBondContact O-CA 3.43Å; S155-P163 WeakPolarHBondContact O-CB 3.38Å; S155-H164 PolarHBondContact N-O 2.79Å; S155-H164 PolarHBondContact O-N 3.49Å; S155-L208 WeakPolarHBondContact OG-CD2 3.46Å
156	Q	69.8	Low	77.8	Confident	26 Å²	26	43 Å²	43	12%	0.121	25%	0.248	C	C	.	.			trans	-128.6	124	167.4	-161.3	-170.5	20.9	0	0	107.4	N98 S100 P163	N98-Q156 PolarHBondContact O-OE1 2.83Å; S100-Q156 PolarHBondContact OG-NE2 2.81Å; Q156-P163 HydrophobicContact CB-CB 4.38Å; Q156-P163 HydrophobicContact CG-CB 4.37Å
157	T	59.1	Low	78.1	Confident	8 Å²	8	35.6 Å²	35.6	5%	0.049	21%	0.209	C	C	.	.			trans	-86.9	144.8	172.1	70.6	0	0	0	0	109.2	G159 S160 E225 F227	T157-G159 PolarHBondContact O-N 2.99Å; T157-S160 PolarHBondContact O-N 3.47Å; T157-S160 WeakPolarHBondContact OG1-CB 3.12Å; T157-S160 PolarHBondContact OG1-N 2.54Å; T157-E225 WeakPolarHBondContact CB-OE1 3.32Å; T157-E225 HydrophobicContact CG2-CB 4.01Å; T157-E225 HydrophobicContact CG2-CG 4.14Å; T157-E225 PolarHBondContact OG1-OE1 3.16Å; T157-F227 HydrophobicContact CG2-CE1 3.93Å; T157-F227 HydrophobicContact CG2-CZ 3.99Å
158	S	55.2	Low	78.3	Confident	85 Å²	85	28.7 Å²	28.7	59%	0.594	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.2	-178.1	44.7	0	0	0	0	113.5	N223	S158-N223 VanDerWaalsContact OG-CG 3.27Å; S158-N223 PolarHBondContact OG-OD1 2.72Å
159	G	53.1	Low	78.5	Confident	59 Å²	59	26.9 Å²	26.9	61%	0.608	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-14	176.6	0	0	0	0	0	115.5	T157	T157-G159 PolarHBondContact O-N 2.99Å
160	S	60.1	Low	78.2	Confident	30 Å²	30	29 Å²	29	21%	0.21	18%	0.184	C	C	.	.			trans	-101.8	127.7	-178.3	-179.4	0	0	0	0	111.2	T157 N162	T157-S160 PolarHBondContact O-N 3.47Å; T157-S160 WeakPolarHBondContact OG1-CB 3.12Å; T157-S160 PolarHBondContact OG1-N 2.54Å; S160-N162 PolarHBondContact O-N 3.21Å; S160-N162 PolarHBondContact OG-N 3.29Å; S160-N162 VanDerWaalsContact OG-N 3.09Å; S160-N162 PolarHBondContact OG-O 3.47Å
161	T	61.2	Low	78.1	Confident	89 Å²	89	29.7 Å²	29.7	55%	0.546	19%	0.194	S	C	.	.	S	Bend	trans	-67.8	-22.4	169.7	56.4	0	0	0	0	112
162	N	68.1	Low	77.9	Confident	64 Å²	64	27.6 Å²	27.6	34%	0.342	19%	0.186	S	C	.	.	S	Bend	trans	-106	122.9	-174.7	-64.7	-4.1	0	0	0	109.9	S160 P180	S160-N162 PolarHBondContact O-N 3.21Å; S160-N162 PolarHBondContact OG-N 3.29Å; S160-N162 VanDerWaalsContact OG-N 3.09Å; S160-N162 PolarHBondContact OG-O 3.47Å; N162-P180 HydrophobicContact CB-CG 4.3Å
163	P	76.3	Confident	77.8	Confident	3 Å²	3	28.4 Å²	28.4	2%	0.019	19%	0.191	C	C	.	.			trans	-68.6	151	171.6	29.5	-33	0	0	0	110.2	L97 L99 S155 Q156 C179	L97-P163 HydrophobicContact CD2-CB 3.73Å; L97-P163 HydrophobicContact CD2-CG 3.82Å; L99-P163 HydrophobicContact CD2-CG 3.6Å; S155-P163 CarbonylContact O-C 3.57Å; S155-P163 VanDerWaalsContact O-CA 3.27Å; S155-P163 WeakPolarHBondContact O-CA 3.43Å; S155-P163 WeakPolarHBondContact O-CB 3.38Å; Q156-P163 HydrophobicContact CB-CB 4.38Å; Q156-P163 HydrophobicContact CG-CB 4.37Å; P163-C179 HydrophobicContact CG-CB 3.82Å; P163-C179 WeakPolarHBondContact O-CB 3.3Å
164	H	81.2	Confident	77.9	Confident	38 Å²	38	27.1 Å²	27.1	18%	0.176	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	140.8	170.5	-65.9	-55.3	0	0	0	109.8	S155 L176	S155-H164 PolarHBondContact N-O 2.79Å; S155-H164 PolarHBondContact O-N 3.49Å; H164-L176 HydrophobicContact CB-CD1 3.88Å
165	I	89.2	Confident	78.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.5	172.2	-52.1	166.7	0	0	0	107.2	L97 V109 V152 I153 T167 L176 W177 C179 L182	L97-I165 HydrophobicContact CD2-CG1 4.37Å; V109-I165 HydrophobicContact CG1-CD1 4.21Å; V109-I165 HydrophobicContact CG1-CG2 4.02Å; V109-I165 HydrophobicContact CG2-CD1 3.54Å; V109-I165 HydrophobicContact CG2-CG1 3.89Å; V109-I165 HydrophobicContact CG2-CG2 4.39Å; V152-I165 HydrophobicContact CG1-CG2 3.81Å; I153-I165 WeakPolarHBondContact O-CA 3.35Å; I165-T167 HydrophobicContact CG2-CG2 4.15Å; I165-L176 CarbonylContact O-C 3.59Å; I165-L176 WeakPolarHBondContact O-CA 3.46Å; I165-W177 HydrophobicContact CB-CB 4.1Å; I165-W177 HydrophobicContact CB-CG 4.47Å; I165-W177 PolarHBondContact N-O 2.99Å; I165-W177 PolarHBondContact O-N 2.83Å; I165-C179 HydrophobicContact CD1-CB 3.93Å; I165-C179 HydrophobicContact CG1-CB 4.07Å; I165-L182 HydrophobicContact CD1-CD1 4.07Å
166	I	91.7	Very high	78.9	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130	173.1	-55.1	173.7	0	0	0	107.5	V152 I153 V174 K175 L176 I206 L208 L229 I246	V152-I166 CarbonylContact C-O 3.51Å; V152-I166 WeakPolarHBondContact CA-O 3.29Å; I153-I166 HydrophobicContact CB-CB 4.38Å; I153-I166 PolarHBondContact N-O 3.15Å; I153-I166 PolarHBondContact O-N 2.81Å; I166-V174 HydrophobicContact CG2-CG1 3.79Å; I166-K175 CarbonylContact C-O 3.57Å; I166-K175 VanDerWaalsContact CA-O 3.3Å; I166-K175 WeakPolarHBondContact CA-O 3.46Å; I166-L176 HydrophobicContact CD1-CD1 4.43Å; I166-L176 HydrophobicContact CG1-CD1 3.79Å; I166-I206 HydrophobicContact CG2-CD1 3.78Å; I166-L208 HydrophobicContact CD1-CD1 3.99Å; I166-L208 HydrophobicContact CD1-CD2 4.27Å; I166-L229 HydrophobicContact CD1-CD1 3.97Å; I166-L229 HydrophobicContact CG2-CD1 4.35Å; I166-I246 HydrophobicContact CD1-CD1 4.16Å
167	T	93.7	Very high	79.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	146.9	177.8	57.9	0	0	0	0	110	I117 H145 L149 K151 V152 I165 V174 K175 W177	I117-T167 HydrophobicContact CG2-CG2 3.76Å; H145-T167 PolarHBondContact NE2-OG1 2.92Å; L149-T167 HydrophobicContact CD2-CG2 4.48Å; K151-T167 WeakPolarHBondContact O-CA 3.25Å; V152-T167 HydrophobicContact CG1-CG2 4.39Å; V152-T167 HydrophobicContact CG2-CG2 4.22Å; I165-T167 HydrophobicContact CG2-CG2 4.15Å; T167-V174 CarbonylContact O-C 3.5Å; T167-V174 VanDerWaalsContact O-CA 3.26Å; T167-V174 WeakPolarHBondContact O-CA 3.27Å; T167-K175 PolarHBondContact N-O 3.05Å; T167-K175 PolarHBondContact O-N 2.84Å; T167-W177 PolarHBondContact OG1-NE1 2.87Å
168	L	92.4	Very high	81	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.6	172.3	168.8	71.5	0	0	0	108	E150 K151 C173 V174 I190 P204 I206	E150-L168 HydrophobicContact CB-CD2 4.46Å; E150-L168 HydrophobicContact CB-CG 4.4Å; E150-L168 HydrophobicContact CG-CD2 4.32Å; E150-L168 PolarHBondContact N-O 2.94Å; K151-L168 HydrophobicContact CB-CB 4.48Å; K151-L168 PolarHBondContact N-O 2.82Å; K151-L168 VanDerWaalsContact N-O 3.15Å; K151-L168 PolarHBondContact O-N 2.85Å; L168-C173 WeakPolarHBondContact CA-O 3.31Å; L168-V174 HydrophobicContact CD1-CG2 3.83Å; L168-I190 HydrophobicContact CD1-CD1 3.98Å; L168-P204 HydrophobicContact CD1-CB 4.15Å; L168-P204 HydrophobicContact CD1-CG 4.01Å; L168-P204 HydrophobicContact CD2-CB 3.89Å; L168-P204 HydrophobicContact CD2-CG 3.93Å; L168-P204 HydrophobicContact CG-CB 4.45Å; L168-P204 HydrophobicContact CG-CG 4.12Å; L168-I206 HydrophobicContact CB-CB 4.38Å; L168-I206 HydrophobicContact CB-CD1 4.32Å; L168-I206 HydrophobicContact CB-CG2 3.69Å; L168-I206 HydrophobicContact CD2-CB 3.81Å; L168-I206 HydrophobicContact CD2-CG2 3.52Å; L168-I206 HydrophobicContact CG-CG2 4.24Å
169	D	89.6	Confident	82.3	Confident	3 Å²	3	23.1 Å²	23.1	2%	0.016	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	167.6	168.1	67.4	31.6	0	0	0	112.9	H145 W147 P148 L149 A171 G172 C173 P204	H145-D169 HydrophobicContact CB-CB 4.49Å; H145-D169 IonicContact CE1-OD2 2.6Å; H145-D169 IonicContact CG-OD2 2.79Å; H145-D169 IonicContact ND1-OD2 2.66Å; H145-D169 PolarHBondContact ND1-OD2 2.98Å; W147-D169 HydrophobicContact CB-CB 4.01Å; P148-D169 VanDerWaalsContact O-CA 3.28Å; P148-D169 WeakPolarHBondContact O-CA 3.28Å; P148-D169 VanDerWaalsContact O-CB 3.25Å; P148-D169 WeakPolarHBondContact O-CB 3.28Å; L149-D169 HydrophobicContact CD2-CB 4.46Å; D169-A171 PolarHBondContact O-N 2.86Å; D169-A171 WeakPolarHBondContact OD1-CA 3.32Å; D169-A171 WeakPolarHBondContact OD1-CB 3.49Å; D169-A171 PolarHBondContact OD1-N 2.99Å; D169-G172 PolarHBondContact O-N 3.23Å; D169-G172 PolarHBondContact OD1-N 2.76Å; D169-C173 PolarHBondContact N-O 3.41Å; D169-C173 WeakPolarHBondContact OD1-CB 3.43Å; D169-C173 PolarHBondContact OD1-N 2.93Å; D169-C173 WeakPolarHBondContact OD2-CB 3.4Å; D169-P204 VanDerWaalsContact O-CG 3.29Å; D169-P204 WeakPolarHBondContact O-CG 3.38Å
170	V	83.3	Confident	83.6	Confident	47 Å²	47	24 Å²	24	29%	0.285	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.4	-179.6	-63.9	0	0	0	0	113.9	W147 P148 E150 G172 P204	W147-V170 HydrophobicContact CB-CG2 3.99Å; W147-V170 HydrophobicContact CE3-CG2 4.35Å; P148-V170 HydrophobicContact CB-CG1 4.23Å; P148-V170 HydrophobicContact CB-CG2 4.12Å; P148-V170 HydrophobicContact CG-CG2 4.15Å; P148-V170 PolarHBondContact O-N 3.04Å; E150-V170 HydrophobicContact CB-CG1 4.21Å; V170-G172 VanDerWaalsContact C-N 3.29Å; V170-P204 WeakPolarHBondContact O-CD 3.43Å
171	A	82.6	Confident	84.7	Confident	45 Å²	45	25.5 Å²	25.5	37%	0.372	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.6	175.7	0	0	0	0	0	112.6	W147 D169	W147-A171 HydrophobicContact CB-CB 4.13Å; W147-A171 VanDerWaalsContact CD1-CB 3.43Å; W147-A171 HydrophobicContact CD2-CB 3.99Å; W147-A171 HydrophobicContact CG-CB 3.58Å; D169-A171 PolarHBondContact O-N 2.86Å; D169-A171 WeakPolarHBondContact OD1-CA 3.32Å; D169-A171 WeakPolarHBondContact OD1-CB 3.49Å; D169-A171 PolarHBondContact OD1-N 2.99Å
172	G	86.1	Confident	86	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.01	13%	0.133	C	C	.	.			trans	84.4	25.4	-177.1	0	0	0	0	0	113.3	D169 V170 S189 I190	D169-G172 PolarHBondContact O-N 3.23Å; D169-G172 PolarHBondContact OD1-N 2.76Å; V170-G172 VanDerWaalsContact C-N 3.29Å; G172-S189 CarbonylContact O-C 3.47Å; G172-S189 WeakPolarHBondContact O-CA 3.47Å; G172-I190 VanDerWaalsContact CA-CG1 3.42Å; G172-I190 WeakPolarHBondContact O-CG1 3.33Å; G172-I190 PolarHBondContact O-N 2.84Å
173	C	89.3	Confident	87.1	Confident	23 Å²	23	23.5 Å²	23.5	16%	0.155	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.6	166.1	-163.6	0	0	0	0	109.3	L168 D169 S187	L168-C173 WeakPolarHBondContact CA-O 3.31Å; D169-C173 PolarHBondContact N-O 3.41Å; D169-C173 WeakPolarHBondContact OD1-CB 3.43Å; D169-C173 PolarHBondContact OD1-N 2.93Å; D169-C173 WeakPolarHBondContact OD2-CB 3.4Å; C173-S187 PolarHBondContact SG-OG 2.78Å
174	V	91.9	Very high	87.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.7	173.3	-174.7	0	0	0	0	108.6	I166 T167 L168 S187 W188 I190 I206 L229	I166-V174 HydrophobicContact CG2-CG1 3.79Å; T167-V174 CarbonylContact O-C 3.5Å; T167-V174 VanDerWaalsContact O-CA 3.26Å; T167-V174 WeakPolarHBondContact O-CA 3.27Å; L168-V174 HydrophobicContact CD1-CG2 3.83Å; V174-S187 VanDerWaalsContact O-CA 3.25Å; V174-S187 WeakPolarHBondContact O-CA 3.39Å; V174-S187 PolarHBondContact O-OG 2.86Å; V174-W188 HydrophobicContact CB-CD2 4.02Å; V174-W188 HydrophobicContact CB-CH2 4.27Å; V174-W188 HydrophobicContact CB-CZ2 3.77Å; V174-W188 HydrophobicContact CG1-CD2 4.35Å; V174-W188 HydrophobicContact CG1-CH2 3.53Å; V174-W188 HydrophobicContact CG1-CZ2 3.27Å; V174-W188 HydrophobicContact CG1-CZ3 4.18Å; V174-W188 HydrophobicContact CG2-CZ2 4.5Å; V174-W188 PolarHBondContact N-O 3.46Å; V174-W188 PolarHBondContact O-N 2.72Å; V174-I190 HydrophobicContact CG2-CG2 4.14Å; V174-I206 HydrophobicContact CG1-CD1 3.84Å; V174-I206 HydrophobicContact CG2-CD1 4.13Å; V174-L229 HydrophobicContact CG1-CD2 4.41Å
175	K	92	Very high	88	Confident	27 Å²	27	28.1 Å²	28.1	12%	0.117	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137.4	172.9	-59.7	-170.9	-175.9	-164.6	0	110.9	Y144 H145 I166 T167 W177 P184 K186	Y144-K175 PolarHBondContact O-NZ 3.41Å; H145-K175 WeakPolarHBondContact NE2-CD 3.4Å; I166-K175 CarbonylContact C-O 3.57Å; I166-K175 VanDerWaalsContact CA-O 3.3Å; I166-K175 WeakPolarHBondContact CA-O 3.46Å; T167-K175 PolarHBondContact N-O 3.05Å; T167-K175 PolarHBondContact O-N 2.84Å; K175-W177 HydrophobicContact CB-CZ2 4.38Å; K175-W177 HydrophobicContact CD-CZ2 4.15Å; K175-P184 HydrophobicContact CD-CB 4.32Å; K175-K186 WeakPolarHBondContact CA-O 3.19Å
176	L	90.3	Very high	88	Confident	10 Å²	10	30 Å²	30	5%	0.052	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.5	169.3	176.7	69.4	0	0	0	107.8	H164 I165 I166 P184 I185 K186 W188 I246	H164-L176 HydrophobicContact CB-CD1 3.88Å; I165-L176 CarbonylContact O-C 3.59Å; I165-L176 WeakPolarHBondContact O-CA 3.46Å; I166-L176 HydrophobicContact CD1-CD1 4.43Å; I166-L176 HydrophobicContact CG1-CD1 3.79Å; L176-P184 CarbonylContact O-C 3.58Å; L176-I185 PolarHBondContact O-N 2.99Å; L176-K186 HydrophobicContact CB-CB 4.22Å; L176-K186 HydrophobicContact CD2-CD 4.33Å; L176-K186 PolarHBondContact N-O 3.05Å; L176-K186 PolarHBondContact O-N 3.26Å; L176-W188 HydrophobicContact CB-CZ3 4.23Å; L176-I246 HydrophobicContact CD1-CD1 4.3Å
177	W	89.7	Confident	87.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	149.7	-174.6	-51.5	67.9	0	0	0	112	I117 A142 Y144 H145 I165 T167 K175 L182 M183 P184	I117-W177 HydrophobicContact CD1-CD2 3.65Å; I117-W177 HydrophobicContact CD1-CE3 3.46Å; I117-W177 VanDerWaalsContact CD1-CE3 3.46Å; I117-W177 HydrophobicContact CD1-CG 4.42Å; I117-W177 HydrophobicContact CD1-CH2 3.5Å; I117-W177 HydrophobicContact CD1-CZ2 3.74Å; I117-W177 HydrophobicContact CD1-CZ3 3.38Å; I117-W177 HydrophobicContact CG1-CH2 3.94Å; I117-W177 HydrophobicContact CG1-CZ2 4.35Å; I117-W177 HydrophobicContact CG1-CZ3 4.12Å; A142-W177 HydrophobicContact CB-CZ3 4.04Å; Y144-W177 AromaticContact CD2-CH2 3.47Å; Y144-W177 HydrophobicContact CD2-CH2 3.47Å; Y144-W177 VanDerWaalsContact CD2-CH2 3.47Å; Y144-W177 AromaticContact CD2-CZ3 3.42Å; Y144-W177 HydrophobicContact CD2-CZ3 3.42Å; Y144-W177 VanDerWaalsContact CD2-CZ3 3.42Å; Y144-W177 HydrophobicContact CE2-CH2 4.46Å; Y144-W177 AromaticContact CE2-CZ3 3.99Å; Y144-W177 HydrophobicContact CE2-CZ3 3.99Å; Y144-W177 AromaticContact CG-CH2 3.93Å; Y144-W177 HydrophobicContact CG-CH2 3.93Å; Y144-W177 HydrophobicContact CG-CZ3 4.18Å; H145-W177 AromaticContact CD2-CZ2 3.97Å; I165-W177 HydrophobicContact CB-CB 4.1Å; I165-W177 HydrophobicContact CB-CG 4.47Å; I165-W177 PolarHBondContact N-O 2.99Å; I165-W177 PolarHBondContact O-N 2.83Å; T167-W177 PolarHBondContact OG1-NE1 2.87Å; K175-W177 HydrophobicContact CB-CZ2 4.38Å; K175-W177 HydrophobicContact CD-CZ2 4.15Å; W177-L182 WeakPolarHBondContact CZ3-O 3.39Å; W177-M183 WeakPolarHBondContact CA-O 3.34Å; W177-P184 HydrophobicContact CD2-CB 4.28Å; W177-P184 HydrophobicContact CE3-CB 4.28Å; W177-P184 HydrophobicContact CZ3-CG 4.46Å
178	D	84	Confident	87.6	Confident	40 Å²	40	33.1 Å²	33.1	21%	0.214	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	114.7	163.1	179.3	54.2	0	0	0	108	P180 S181 L182 M183 I185	D178-P180 WeakPolarHBondContact OD1-CD 3.41Å; D178-S181 WeakPolarHBondContact CB-OG 3.06Å; D178-S181 VanDerWaalsContact OD2-CB 3.3Å; D178-S181 WeakPolarHBondContact OD2-CB 3.29Å; D178-S181 PolarHBondContact OD2-N 2.85Å; D178-S181 PolarHBondContact OD2-OG 2.94Å; D178-L182 VanDerWaalsContact O-CA 3.31Å; D178-L182 WeakPolarHBondContact O-CA 3.38Å; D178-L182 PolarHBondContact O-N 2.83Å; D178-M183 PolarHBondContact N-O 3.49Å; D178-I185 HydrophobicContact CB-CD1 3.75Å; D178-I185 HydrophobicContact CB-CG1 3.77Å
179	C	83.5	Confident	87.3	Confident	6 Å²	6	36.2 Å²	36.2	4%	0.041	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-43.7	-173.6	-176.5	0	0	0	0	113.6	P163 I165 L182	P163-C179 HydrophobicContact CG-CB 3.82Å; P163-C179 WeakPolarHBondContact O-CB 3.3Å; I165-C179 HydrophobicContact CD1-CB 3.93Å; I165-C179 HydrophobicContact CG1-CB 4.07Å; C179-L182 PolarHBondContact O-N 2.88Å
180	P	79.3	Confident	86.9	Confident	77 Å²	77	36.2 Å²	36.2	50%	0.5	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-41.8	-178.6	-24.3	35.6	0	0	0	113.8	N162 D178	N162-P180 HydrophobicContact CB-CG 4.3Å; D178-P180 WeakPolarHBondContact OD1-CD 3.41Å
181	S	83.6	Confident	86.2	Confident	62 Å²	62	39.5 Å²	39.5	43%	0.434	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-14.3	178.8	63.5	0	0	0	0	113.6	D178 M183	D178-S181 WeakPolarHBondContact CB-OG 3.06Å; D178-S181 VanDerWaalsContact OD2-CB 3.3Å; D178-S181 WeakPolarHBondContact OD2-CB 3.29Å; D178-S181 PolarHBondContact OD2-N 2.85Å; D178-S181 PolarHBondContact OD2-OG 2.94Å; S181-M183 WeakPolarHBondContact O-CG 3.37Å; S181-M183 PolarHBondContact O-N 2.9Å
182	L	88.5	Confident	85.1	Confident	11 Å²	11	39.2 Å²	39.2	6%	0.058	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	37.5	-172.1	-153.2	68.9	0	0	0	111.9	I117 L119 N140 A142 I165 W177 D178 C179	I117-L182 HydrophobicContact CD1-CD1 3.6Å; I117-L182 HydrophobicContact CD1-CD2 4.41Å; I117-L182 HydrophobicContact CD1-CG 3.8Å; I117-L182 HydrophobicContact CG1-CD1 4.32Å; I117-L182 HydrophobicContact CG1-CD2 4.37Å; I117-L182 HydrophobicContact CG1-CG 4.28Å; L119-L182 HydrophobicContact CB-CD1 4.1Å; L119-L182 HydrophobicContact CB-CD2 4.48Å; N140-L182 HydrophobicContact CB-CD2 4.25Å; N140-L182 WeakPolarHBondContact O-CD2 3.45Å; A142-L182 HydrophobicContact CB-CB 4.43Å; A142-L182 HydrophobicContact CB-CD2 3.57Å; A142-L182 HydrophobicContact CB-CG 3.76Å; I165-L182 HydrophobicContact CD1-CD1 4.07Å; W177-L182 WeakPolarHBondContact CZ3-O 3.39Å; D178-L182 VanDerWaalsContact O-CA 3.31Å; D178-L182 WeakPolarHBondContact O-CA 3.38Å; D178-L182 PolarHBondContact O-N 2.83Å; C179-L182 PolarHBondContact O-N 2.88Å
183	M	89.9	Confident	83.6	Confident	100 Å²	100	44.2 Å²	44.2	49%	0.493	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	141.8	177.7	-62.3	-157.9	102.6	0	0	111.5	Y144 W177 D178 S181 I185	Y144-M183 WeakPolarHBondContact OH-CE 2.96Å; W177-M183 WeakPolarHBondContact CA-O 3.34Å; D178-M183 PolarHBondContact N-O 3.49Å; S181-M183 WeakPolarHBondContact O-CG 3.37Å; S181-M183 PolarHBondContact O-N 2.9Å; M183-I185 PolarHBondContact O-N 2.92Å
184	P	90.4	Very high	81.8	Confident	43 Å²	43	45.6 Å²	45.6	28%	0.279	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	125.6	175.1	28.4	-32.4	0	0	0	110.4	Y144 K175 L176 W177	Y144-P184 HydrophobicContact CD1-CG 3.97Å; Y144-P184 HydrophobicContact CD2-CG 4.49Å; Y144-P184 HydrophobicContact CE1-CG 4.27Å; Y144-P184 HydrophobicContact CG-CG 4.09Å; K175-P184 HydrophobicContact CD-CB 4.32Å; L176-P184 CarbonylContact O-C 3.58Å; W177-P184 HydrophobicContact CD2-CB 4.28Å; W177-P184 HydrophobicContact CE3-CB 4.28Å; W177-P184 HydrophobicContact CZ3-CG 4.46Å
185	I	87.5	Confident	79.8	Confident	94 Å²	94	56.6 Å²	56.6	48%	0.482	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-42.8	175.2	-50.6	167.4	0	0	0	110	L176 D178 M183	L176-I185 PolarHBondContact O-N 2.99Å; D178-I185 HydrophobicContact CB-CD1 3.75Å; D178-I185 HydrophobicContact CB-CG1 3.77Å; M183-I185 PolarHBondContact O-N 2.92Å
186	K	87.7	Confident	77.8	Confident	40 Å²	40	57.3 Å²	57.3	17%	0.174	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	151.4	-179.8	-62	-176.5	-176.3	174.5	0	110.4	K175 L176 W188 I246 I248 N249	K175-K186 WeakPolarHBondContact CA-O 3.19Å; L176-K186 HydrophobicContact CB-CB 4.22Å; L176-K186 HydrophobicContact CD2-CD 4.33Å; L176-K186 PolarHBondContact N-O 3.05Å; L176-K186 PolarHBondContact O-N 3.26Å; K186-W188 HydrophobicContact CB-CE3 4.44Å; K186-W188 HydrophobicContact CB-CZ3 4.26Å; K186-I246 PolarHBondContact NZ-O 2.79Å; K186-I248 PolarHBondContact NZ-O 3.43Å; K186-N249 WeakPolarHBondContact CE-OD1 3.38Å; K186-N249 PolarHBondContact NZ-OD1 2.73Å
187	S	89	Confident	75.8	Confident	58 Å²	58	61.2 Å²	61.2	41%	0.406	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	143.2	171.1	-177.1	0	0	0	0	110	C173 V174	C173-S187 PolarHBondContact SG-OG 2.78Å; V174-S187 VanDerWaalsContact O-CA 3.25Å; V174-S187 WeakPolarHBondContact O-CA 3.39Å; V174-S187 PolarHBondContact O-OG 2.86Å
188	W	89	Confident	73.7	Confident	9 Å²	9	68.6 Å²	68.6	3%	0.034	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	163.1	174.2	64.9	98.2	0	0	0	109.8	V174 L176 K186 L229 W244 I246 S252 P254	V174-W188 HydrophobicContact CB-CD2 4.02Å; V174-W188 HydrophobicContact CB-CH2 4.27Å; V174-W188 HydrophobicContact CB-CZ2 3.77Å; V174-W188 HydrophobicContact CG1-CD2 4.35Å; V174-W188 HydrophobicContact CG1-CH2 3.53Å; V174-W188 HydrophobicContact CG1-CZ2 3.27Å; V174-W188 HydrophobicContact CG1-CZ3 4.18Å; V174-W188 HydrophobicContact CG2-CZ2 4.5Å; V174-W188 PolarHBondContact N-O 3.46Å; V174-W188 PolarHBondContact O-N 2.72Å; L176-W188 HydrophobicContact CB-CZ3 4.23Å; K186-W188 HydrophobicContact CB-CE3 4.44Å; K186-W188 HydrophobicContact CB-CZ3 4.26Å; W188-L229 HydrophobicContact CZ2-CD2 3.84Å; W188-W244 AromaticContact CD1-CE3 3.69Å; W188-W244 AromaticContact CD1-CH2 3.98Å; W188-W244 AromaticContact CD1-CZ3 3.41Å; W188-W244 VanDerWaalsContact CD1-CZ3 3.41Å; W188-W244 HydrophobicContact CG-CZ3 4.46Å; W188-W244 AromaticContact NE1-CD2 3.7Å; W188-W244 AromaticContact NE1-CE3 3.44Å; W188-W244 AromaticContact NE1-CZ3 3.63Å; W188-I246 HydrophobicContact CH2-CG2 4.01Å; W188-I246 HydrophobicContact CZ2-CG2 4.47Å; W188-S252 WeakPolarHBondContact CB-O 3.17Å; W188-P254 HydrophobicContact CD2-CG 3.87Å; W188-P254 HydrophobicContact CE3-CG 4.22Å; W188-P254 HydrophobicContact CG-CG 4.21Å; W188-P254 HydrophobicContact CZ2-CG 4.2Å
189	S	85.6	Confident	71.8	Confident	64 Å²	64	69.8 Å²	69.8	45%	0.448	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135.9	179	-56.4	0	0	0	0	111	G172 N191	G172-S189 CarbonylContact O-C 3.47Å; G172-S189 WeakPolarHBondContact O-CA 3.47Å; S189-N191 PolarHBondContact O-N 3.38Å
190	I	82	Confident	70.2	Confident	4 Å²	4	74 Å²	74	2%	0.021	43%	0.431	C	S	.	.			trans	-83.4	86.8	168.2	57	172.8	0	0	0	108.5	L168 G172 V174 S192 P204 T231 P234 W244	L168-I190 HydrophobicContact CD1-CD1 3.98Å; G172-I190 VanDerWaalsContact CA-CG1 3.42Å; G172-I190 WeakPolarHBondContact O-CG1 3.33Å; G172-I190 PolarHBondContact O-N 2.84Å; V174-I190 HydrophobicContact CG2-CG2 4.14Å; I190-S192 PolarHBondContact O-N 3.11Å; I190-P204 HydrophobicContact CD1-CB 3.66Å; I190-T231 HydrophobicContact CG2-CG2 4Å; I190-P234 HydrophobicContact CG1-CG 4.36Å; I190-P234 WeakPolarHBondContact O-CD 3.39Å; I190-W244 HydrophobicContact CB-CZ2 4.26Å; I190-W244 HydrophobicContact CG2-CH2 3.77Å; I190-W244 HydrophobicContact CG2-CZ2 3.34Å
191	N	67.7	Low	69.3	Low	116 Å²	116	73.1 Å²	73.1	62%	0.62	43%	0.431	S	S	*	.			trans	-57.5	128.1	-175.3	-78.2	-12	0	0	0	111.7	S189 N233	S189-N191 PolarHBondContact O-N 3.38Å; N191-N233 PolarHBondContact O-ND2 2.81Å
192	S	61	Low	68.7	Low	38 Å²	38	73.1 Å²	73.1	27%	0.266	42%	0.423	S	S	.	.			trans	-83.9	134.9	157	179.1	0	0	0	0	109.4	I190 T194 P234 L235	I190-S192 PolarHBondContact O-N 3.11Å; S192-T194 PolarHBondContact O-N 3.1Å; S192-T194 PolarHBondContact OG-N 2.76Å; S192-T194 VanDerWaalsContact OG-N 3.15Å; S192-T194 PolarHBondContact OG-O 2.99Å; S192-T194 PolarHBondContact OG-OG1 2.66Å; S192-P234 WeakPolarHBondContact CB-O 3.36Å; S192-P234 PolarHBondContact OG-O 2.76Å; S192-L235 PolarHBondContact OG-O 2.77Å
193	T	54.1	Low	68.2	Low	106 Å²	106	75 Å²	75	65%	0.65	43%	0.434	S	S	*	.	S	Bend	trans	-77.9	-3.6	173.9	45.7	0	0	0	0	112.9
194	T	51.9	Low	67.9	Low	52 Å²	52	70.2 Å²	70.2	32%	0.319	41%	0.411	S	S	.	.	S	Bend	trans	-147.3	134.8	-165.7	40	0	0	0	0	111.2	S192 L235 D236	S192-T194 PolarHBondContact O-N 3.1Å; S192-T194 PolarHBondContact OG-N 2.76Å; S192-T194 VanDerWaalsContact OG-N 3.15Å; S192-T194 PolarHBondContact OG-O 2.99Å; S192-T194 PolarHBondContact OG-OG1 2.66Å; T194-L235 PolarHBondContact OG1-O 3.37Å; T194-D236 WeakPolarHBondContact OG1-CB 3.32Å; T194-D236 PolarHBondContact OG1-OD2 3.41Å
195	W	49.1	Very low	67.8	Low	231 Å²	231	68.6 Å²	68.6	88%	0.875	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-64	150.4	172.4	-80.4	74.7	0	0	0	110.8	V197	W195-V197 PolarHBondContact O-N 3.25Å; W195-V197 VanDerWaalsContact O-N 3.16Å
196	P	50.9	Low	67.9	Low	42 Å²	42	64.2 Å²	64.2	27%	0.273	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-54.7	123.4	175.6	11.8	-17.2	0	0	0	110.3	N198 G199 L235	P196-N198 PolarHBondContact O-N 2.76Å; P196-G199 PolarHBondContact O-N 3.49Å; P196-L235 HydrophobicContact CB-CD2 3.4Å; P196-L235 VanDerWaalsContact CB-CD2 3.4Å; P196-L235 HydrophobicContact CG-CD2 3.48Å; P196-L235 VanDerWaalsContact CG-CD2 3.48Å
197	V	46.7	Very low	68	Low	92 Å²	92	63 Å²	63	56%	0.558	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-71.4	123.4	173.1	-173.3	0	0	0	0	107.6	W195 G199	W195-V197 PolarHBondContact O-N 3.25Å; W195-V197 VanDerWaalsContact O-N 3.16Å; V197-G199 VanDerWaalsContact C-N 3.27Å; V197-G199 PolarHBondContact O-N 3.28Å
198	N	46.4	Very low	67.9	Low	155 Å²	155	61 Å²	61	83%	0.829	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	62.7	22.3	-177.6	-55	-33.3	0	0	0	115.8	P196 S200	P196-N198 PolarHBondContact O-N 2.76Å; N198-S200 PolarHBondContact O-N 3.01Å
199	G	44.7	Very low	67.5	Low	66 Å²	66	61.1 Å²	61.1	68%	0.68	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	75.2	3.4	175.2	0	0	0	0	0	115.2	P196 V197	P196-G199 PolarHBondContact O-N 3.49Å; V197-G199 VanDerWaalsContact C-N 3.27Å; V197-G199 PolarHBondContact O-N 3.28Å
200	S	48.7	Very low	66.7	Low	93 Å²	93	60.9 Å²	60.9	65%	0.65	36%	0.359	S	S	*	.			trans	-100.1	112.2	178.4	-56.7	0	0	0	0	110.5	N198	N198-S200 PolarHBondContact O-N 3.01Å
201	A	60.8	Low	65.3	Low	60 Å²	60	62 Å²	62	50%	0.496	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-100.5	129.3	178.1	0	0	0	0	0	111.1	L235	A201-L235 HydrophobicContact CB-CD2 3.08Å; A201-L235 HydrophobicContact CB-CG 3.94Å
202	F	71.3	Confident	64.2	Low	62 Å²	62	60.7 Å²	60.7	27%	0.272	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-72.9	138.3	161.4	-76.5	-84.1	0	0	0	109.5	L269 Y286	F202-L269 HydrophobicContact CE2-CD1 3.54Å; F202-L269 HydrophobicContact CZ-CB 4.49Å; F202-L269 HydrophobicContact CZ-CD1 3.53Å; F202-Y286 HydrophobicContact CE1-CD2 4.01Å; F202-Y286 HydrophobicContact CE1-CE2 4.27Å; F202-Y286 HydrophobicContact CZ-CD2 4.49Å
203	T	77	Confident	63.2	Low	49 Å²	49	61.4 Å²	61.4	30%	0.301	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-65.7	141.6	176.6	58.8	0	0	0	0	110.1	E150 R239 K391	E150-T203 PolarHBondContact OE1-OG1 3.24Å; E150-T203 VanDerWaalsContact OE1-OG1 3.08Å; T203-R239 PolarHBondContact O-NH1 2.6Å; T203-R239 PolarHBondContact O-NH2 3.38Å; T203-K391 PolarHBondContact OG1-NZ 3.47Å
204	P	85	Confident	62.2	Low	0 Å²	0	60.3 Å²	60.3	0%	0	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-63.6	161.3	172.3	27.8	-31.1	0	0	0	110.4	E150 L168 D169 V170 I190 L232 P234	E150-P204 WeakPolarHBondContact CG-O 3.5Å; L168-P204 HydrophobicContact CD1-CB 4.15Å; L168-P204 HydrophobicContact CD1-CG 4.01Å; L168-P204 HydrophobicContact CD2-CB 3.89Å; L168-P204 HydrophobicContact CD2-CG 3.93Å; L168-P204 HydrophobicContact CG-CB 4.45Å; L168-P204 HydrophobicContact CG-CG 4.12Å; D169-P204 VanDerWaalsContact O-CG 3.29Å; D169-P204 WeakPolarHBondContact O-CG 3.38Å; V170-P204 WeakPolarHBondContact O-CD 3.43Å; I190-P204 HydrophobicContact CD1-CB 3.66Å; P204-L232 WeakPolarHBondContact CA-O 3.44Å; P204-P234 HydrophobicContact CB-CB 4.07Å; P204-P234 HydrophobicContact CB-CG 4.43Å; P204-P234 HydrophobicContact CG-CB 4.28Å
205	D	87.5	Confident	61.2	Low	10 Å²	10	63.7 Å²	63.7	5%	0.053	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	156.9	168.4	-167.7	20.6	0	0	0	110	K151 T231 L232 A272 L273	K151-D205 WeakPolarHBondContact CD-OD1 3.02Å; K151-D205 IonicContact NZ-OD1 3.74Å; K151-D205 PolarHBondContact NZ-OD1 2.77Å; K151-D205 IonicContact NZ-OD2 3.13Å; D205-T231 CarbonylContact O-C 3.54Å; D205-T231 VanDerWaalsContact O-CA 3.25Å; D205-T231 WeakPolarHBondContact O-CA 3.11Å; D205-L232 HydrophobicContact CB-CB 4.35Å; D205-L232 PolarHBondContact N-O 3.02Å; D205-L232 PolarHBondContact O-N 3.29Å; D205-A272 VanDerWaalsContact OD2-CA 3.24Å; D205-A272 WeakPolarHBondContact OD2-CA 3.09Å; D205-L273 PolarHBondContact OD2-N 3.25Å
206	I	90.1	Very high	60.1	Low	1 Å²	1	55.6 Å²	55.6	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	139	-175.4	-175.2	168.2	0	0	0	109.5	K151 I153 I166 L168 V174 L229 S230 T231	K151-I206 HydrophobicContact CB-CG2 3.81Å; K151-I206 HydrophobicContact CD-CG2 3.68Å; K151-I206 WeakPolarHBondContact CD-O 3.23Å; K151-I206 WeakPolarHBondContact CE-O 3.12Å; K151-I206 HydrophobicContact CG-CG2 4.1Å; K151-I206 PolarHBondContact NZ-O 2.86Å; I153-I206 HydrophobicContact CD1-CG1 4.13Å; I153-I206 HydrophobicContact CD1-CG2 3.97Å; I166-I206 HydrophobicContact CG2-CD1 3.78Å; L168-I206 HydrophobicContact CB-CB 4.38Å; L168-I206 HydrophobicContact CB-CD1 4.32Å; L168-I206 HydrophobicContact CB-CG2 3.69Å; L168-I206 HydrophobicContact CD2-CB 3.81Å; L168-I206 HydrophobicContact CD2-CG2 3.52Å; L168-I206 HydrophobicContact CG-CG2 4.24Å; V174-I206 HydrophobicContact CG1-CD1 3.84Å; V174-I206 HydrophobicContact CG2-CD1 4.13Å; I206-L229 HydrophobicContact CD1-CD1 3.71Å; I206-L229 HydrophobicContact CD1-CD2 3.46Å; I206-L229 VanDerWaalsContact CD1-CD2 3.46Å; I206-L229 HydrophobicContact CD1-CG 3.93Å; I206-L229 HydrophobicContact CG1-CD1 3.58Å; I206-L229 HydrophobicContact CG1-CD2 3.78Å; I206-L229 HydrophobicContact CG1-CG 3.75Å; I206-S230 CarbonylContact C-O 3.58Å; I206-S230 WeakPolarHBondContact CA-O 3.11Å; I206-T231 HydrophobicContact CB-CG2 4.25Å; I206-T231 HydrophobicContact CD1-CG2 4.2Å; I206-T231 HydrophobicContact CG1-CG2 3.96Å
207	S	89.2	Confident	59	Low	14 Å²	14	60.3 Å²	60.3	10%	0.098	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	136.3	174.1	-167.1	0	0	0	0	109.7	L229 S230 W275	S207-L229 CarbonylContact O-C 3.54Å; S207-L229 WeakPolarHBondContact O-CA 3.23Å; S207-S230 WeakPolarHBondContact CB-OG 3.23Å; S207-S230 PolarHBondContact N-O 2.75Å; S207-S230 PolarHBondContact O-N 3.11Å; S207-S230 PolarHBondContact O-OG 3.15Å; S207-W275 PolarHBondContact O-NE1 3.47Å; S207-W275 PolarHBondContact OG-N 3.44Å
208	L	87.2	Confident	58.2	Low	18 Å²	18	60.1 Å²	60.1	9%	0.094	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	134.8	174.4	-177.1	71.8	0	0	0	108.7	I153 S155 I166 S210 L229	I153-L208 HydrophobicContact CD1-CB 4.31Å; I153-L208 HydrophobicContact CG2-CB 3.87Å; I153-L208 HydrophobicContact CG2-CD2 4.04Å; S155-L208 WeakPolarHBondContact OG-CD2 3.46Å; I166-L208 HydrophobicContact CD1-CD1 3.99Å; I166-L208 HydrophobicContact CD1-CD2 4.27Å; L208-S210 PolarHBondContact O-N 3.07Å; L208-L229 HydrophobicContact CB-CD1 4.18Å; L208-L229 HydrophobicContact CD1-CD1 3.95Å
209	L	81.3	Confident	57.3	Low	11 Å²	11	59.2 Å²	59.2	6%	0.058	37%	0.37	C	S	.	.			trans	-67.4	104.6	170.7	179.3	64	0	0	0	108.1	N226 L228 W275 P278	L209-N226 HydrophobicContact CB-CB 4.09Å; L209-N226 HydrophobicContact CD2-CB 3.89Å; L209-N226 HydrophobicContact CG-CB 3.79Å; L209-N226 WeakPolarHBondContact O-CB 3.34Å; L209-L228 HydrophobicContact CB-CB 4.24Å; L209-L228 WeakPolarHBondContact CB-O 3.48Å; L209-L228 HydrophobicContact CD2-CB 4.24Å; L209-L228 PolarHBondContact N-O 3.13Å; L209-W275 HydrophobicContact CB-CD2 3.99Å; L209-W275 HydrophobicContact CB-CG 3.95Å; L209-W275 HydrophobicContact CD1-CB 3.82Å; L209-W275 HydrophobicContact CD1-CD2 3.92Å; L209-W275 HydrophobicContact CD1-CE3 3.98Å; L209-W275 HydrophobicContact CD1-CG 3.89Å; L209-W275 HydrophobicContact CG-CD2 4.47Å; L209-P278 HydrophobicContact CD2-CB 4.13Å
210	S	67.5	Low	56.7	Low	59 Å²	59	63.7 Å²	63.7	41%	0.413	38%	0.378	S	S	.	.			trans	-76	131.7	178.9	176.1	0	0	0	0	111	L208 N212	L208-S210 PolarHBondContact O-N 3.07Å; S210-N212 PolarHBondContact O-N 2.85Å; S210-N212 PolarHBondContact OG-N 3.12Å; S210-N212 VanDerWaalsContact OG-N 3.12Å
211	S	52.4	Low	55.9	Low	28 Å²	28	67.6 Å²	67.6	20%	0.196	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-68.5	-19.7	168.5	55.1	0	0	0	0	112.7	N213 T214	S211-N213 PolarHBondContact O-N 3.42Å; S211-T214 PolarHBondContact O-OG1 3.26Å
212	N	45.9	Very low	54.6	Low	88 Å²	88	70.9 Å²	70.9	47%	0.471	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-83.1	4.6	-172.3	-66.6	-12.2	0	0	0	113.7	S210 T214	S210-N212 PolarHBondContact O-N 2.85Å; S210-N212 PolarHBondContact OG-N 3.12Å; S210-N212 VanDerWaalsContact OG-N 3.12Å; N212-T214 PolarHBondContact O-N 2.83Å
213	N	38.9	Very low	53	Low	53 Å²	53	72.6 Å²	72.6	28%	0.283	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-78.5	8.5	174	-121	-10.4	0	0	0	113.5	S211 T329	S211-N213 PolarHBondContact O-N 3.42Å; N213-T329 PolarHBondContact OD1-OG1 2.81Å
214	T	33.6	Very low	51.2	Low	83 Å²	83	74.3 Å²	74.3	51%	0.509	42%	0.421	S	S	.	.			trans	-120	72.7	170.6	51.9	0	0	0	0	110.2	S211 N212 G216	S211-T214 PolarHBondContact O-OG1 3.26Å; N212-T214 PolarHBondContact O-N 2.83Å; T214-G216 PolarHBondContact O-N 2.97Å
215	N	31.5	Very low	49.5	Very low	123 Å²	123	77.2 Å²	77.2	66%	0.658	43%	0.434	S	S	*	.			trans	-74.3	100.9	164.4	-81.7	-17.6	0	0	0	109.2	N331	N215-N331 PolarHBondContact O-ND2 2.95Å
216	G	26.5	Very low	48.1	Very low	61 Å²	61	78.3 Å²	78.3	63%	0.629	44%	0.44	S	S	*	.	S	Bend	trans	111	113.7	167.5	0	0	0	0	0	113.3	T214	T214-G216 PolarHBondContact O-N 2.97Å
217	I	27.3	Very low	47.1	Very low	141 Å²	141	79.5 Å²	79.5	72%	0.723	45%	0.445	S	S	*	.			trans	81.7	55.4	-179.6	-36.1	163.4	0	0	0	113.5
218	I	28.8	Very low	46.7	Very low	87 Å²	87	80.4 Å²	80.4	45%	0.446	45%	0.449	S	S	.	.			trans	-89.6	101.8	142.5	-61.6	175.1	0	0	0	104.7	D220	I218-D220 PolarHBondContact O-N 3.01Å
219	N	28.5	Very low	46.8	Very low	137 Å²	137	79.6 Å²	79.6	73%	0.733	44%	0.444	S	S	*	.			trans	-54	129.5	151	-83.8	-21.4	0	0	0	106	Q221	N219-Q221 PolarHBondContact O-N 2.95Å
220	D	31.7	Very low	47.2	Very low	159 Å²	159	79 Å²	79	85%	0.85	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	29.5	-178	-73.7	-44.3	0	0	0	116.2	I218	I218-D220 PolarHBondContact O-N 3.01Å
221	Q	32.8	Very low	48.2	Very low	176 Å²	176	76.2 Å²	76.2	82%	0.822	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	-5.7	-173.8	-66.5	-158.8	-20.3	0	0	115.8	N219	N219-Q221 PolarHBondContact O-N 2.95Å
222	N	33.5	Very low	49.8	Very low	128 Å²	128	74.9 Å²	74.9	68%	0.684	41%	0.413	S	S	*	.			trans	-136	75.5	168.9	-76.1	-37.1	0	0	0	110.9	C224	N222-C224 PolarHBondContact O-N 3.33Å
223	N	35.9	Very low	51.5	Low	98 Å²	98	71.3 Å²	71.3	52%	0.524	39%	0.393	S	S	.	.			trans	-62.7	78.2	161.2	-90	-26.3	0	0	0	109.1	S158 E225	S158-N223 VanDerWaalsContact OG-CG 3.27Å; S158-N223 PolarHBondContact OG-OD1 2.72Å; N223-E225 PolarHBondContact O-N 3.37Å
224	C	39.3	Very low	53.1	Low	86 Å²	86	69 Å²	69	58%	0.581	38%	0.381	S	S	*	.			trans	-77.5	83.2	166.3	-66.8	0	0	0	0	107.4	N222 N226	N222-C224 PolarHBondContact O-N 3.33Å; C224-N226 PolarHBondContact O-N 2.83Å; C224-N226 PolarHBondContact O-OD1 3.2Å
225	E	50	Low	54.5	Low	61 Å²	61	66.8 Å²	66.8	29%	0.285	37%	0.366	S	S	.	.			trans	-55.9	110.8	164	-61.7	-170.7	137.5	0	0	107.4	T157 N223 F227	T157-E225 WeakPolarHBondContact CB-OE1 3.32Å; T157-E225 HydrophobicContact CG2-CB 4.01Å; T157-E225 HydrophobicContact CG2-CG 4.14Å; T157-E225 PolarHBondContact OG1-OE1 3.16Å; N223-E225 PolarHBondContact O-N 3.37Å; E225-F227 HydrophobicContact CB-CD2 3.81Å; E225-F227 HydrophobicContact CB-CE2 3.16Å; E225-F227 HydrophobicContact CB-CZ 3.65Å; E225-F227 HydrophobicContact CG-CE2 4.16Å; E225-F227 HydrophobicContact CG-CZ 4.36Å; E225-F227 WeakPolarHBondContact O-CD2 3.48Å; E225-F227 PolarHBondContact O-N 3.48Å; E225-F227 WeakPolarHBondContact OE2-CE2 3.25Å; E225-F227 WeakPolarHBondContact OE2-CZ 3.4Å
226	N	59.1	Low	55.9	Low	33 Å²	33	62.6 Å²	62.6	18%	0.176	34%	0.343	C	S	.	.			trans	-86.5	96.8	-174.9	-75	-26.8	0	0	0	109.3	L209 C224 L228	L209-N226 HydrophobicContact CB-CB 4.09Å; L209-N226 HydrophobicContact CD2-CB 3.89Å; L209-N226 HydrophobicContact CG-CB 3.79Å; L209-N226 WeakPolarHBondContact O-CB 3.34Å; C224-N226 PolarHBondContact O-N 2.83Å; C224-N226 PolarHBondContact O-OD1 3.2Å; N226-L228 VanDerWaalsContact C-N 3.31Å
227	F	68.1	Low	57.5	Low	25 Å²	25	65 Å²	65	11%	0.11	34%	0.342	C	S	.	.			trans	-91.9	6.5	178.4	-65.3	-76.7	0	0	0	113.4	T157 E225 L229 D245 I246 R247	T157-F227 HydrophobicContact CG2-CE1 3.93Å; T157-F227 HydrophobicContact CG2-CZ 3.99Å; E225-F227 HydrophobicContact CB-CD2 3.81Å; E225-F227 HydrophobicContact CB-CE2 3.16Å; E225-F227 HydrophobicContact CB-CZ 3.65Å; E225-F227 HydrophobicContact CG-CE2 4.16Å; E225-F227 HydrophobicContact CG-CZ 4.36Å; E225-F227 WeakPolarHBondContact O-CD2 3.48Å; E225-F227 PolarHBondContact O-N 3.48Å; E225-F227 WeakPolarHBondContact OE2-CE2 3.25Å; E225-F227 WeakPolarHBondContact OE2-CZ 3.4Å; F227-L229 PolarHBondContact O-N 3.09Å; F227-D245 WeakPolarHBondContact CB-OD1 3Å; F227-I246 HydrophobicContact CB-CG1 3.81Å; F227-I246 HydrophobicContact CD1-CD1 3.92Å; F227-I246 HydrophobicContact CD1-CG1 3.65Å; F227-I246 HydrophobicContact CG-CG1 4.22Å; F227-I246 PolarHBondContact O-N 3.48Å; F227-I246 VanDerWaalsContact O-N 3.13Å; F227-R247 HydrophobicContact CB-CG 3.79Å; F227-R247 HydrophobicContact CD1-CG 3.66Å; F227-R247 HydrophobicContact CD2-CG 3.41Å; F227-R247 VanDerWaalsContact CD2-CG 3.41Å; F227-R247 HydrophobicContact CE1-CG 3.97Å; F227-R247 HydrophobicContact CE2-CG 3.69Å; F227-R247 HydrophobicContact CG-CG 3.34Å; F227-R247 HydrophobicContact CZ-CG 3.96Å
228	L	81.6	Confident	59.4	Low	34 Å²	34	62.9 Å²	62.9	18%	0.178	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.6	-175	-158	77.3	0	0	0	110.1	L209 N226 L243 W244 W275 I295	L209-L228 HydrophobicContact CB-CB 4.24Å; L209-L228 WeakPolarHBondContact CB-O 3.48Å; L209-L228 HydrophobicContact CD2-CB 4.24Å; L209-L228 PolarHBondContact N-O 3.13Å; N226-L228 VanDerWaalsContact C-N 3.31Å; L228-L243 HydrophobicContact CD2-CD1 4.47Å; L228-W244 CarbonylContact C-O 3.59Å; L228-W244 WeakPolarHBondContact CA-O 3.31Å; L228-W275 HydrophobicContact CD2-CH2 3.3Å; L228-W275 HydrophobicContact CD2-CZ2 3.56Å; L228-W275 HydrophobicContact CD2-CZ3 4.18Å; L228-W275 HydrophobicContact CG-CH2 4.25Å; L228-W275 HydrophobicContact CG-CZ2 4.02Å; L228-I295 HydrophobicContact CD2-CD1 3.87Å
229	L	88.8	Confident	61.7	Low	0 Å²	0	59 Å²	59	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	143.3	174.1	-167.3	87	0	0	0	108.6	I166 V174 W188 I206 S207 L208 F227 T231 L243 W244 I246	I166-L229 HydrophobicContact CD1-CD1 3.97Å; I166-L229 HydrophobicContact CG2-CD1 4.35Å; V174-L229 HydrophobicContact CG1-CD2 4.41Å; W188-L229 HydrophobicContact CZ2-CD2 3.84Å; I206-L229 HydrophobicContact CD1-CD1 3.71Å; I206-L229 HydrophobicContact CD1-CD2 3.46Å; I206-L229 VanDerWaalsContact CD1-CD2 3.46Å; I206-L229 HydrophobicContact CD1-CG 3.93Å; I206-L229 HydrophobicContact CG1-CD1 3.58Å; I206-L229 HydrophobicContact CG1-CD2 3.78Å; I206-L229 HydrophobicContact CG1-CG 3.75Å; S207-L229 CarbonylContact O-C 3.54Å; S207-L229 WeakPolarHBondContact O-CA 3.23Å; L208-L229 HydrophobicContact CB-CD1 4.18Å; L208-L229 HydrophobicContact CD1-CD1 3.95Å; F227-L229 PolarHBondContact O-N 3.09Å; L229-T231 HydrophobicContact CD2-CG2 3.79Å; L229-T231 HydrophobicContact CG-CG2 4.46Å; L229-L243 CarbonylContact O-C 3.58Å; L229-L243 VanDerWaalsContact O-CA 3.29Å; L229-L243 WeakPolarHBondContact O-CA 3.24Å; L229-W244 HydrophobicContact CB-CB 4.07Å; L229-W244 HydrophobicContact CB-CG 4.43Å; L229-W244 HydrophobicContact CD2-CB 4.46Å; L229-W244 HydrophobicContact CD2-CG 4.21Å; L229-W244 PolarHBondContact N-O 2.88Å; L229-W244 PolarHBondContact O-N 3.49Å; L229-I246 HydrophobicContact CB-CG2 4.48Å
230	S	89.1	Confident	64.1	Low	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	139.1	166	62.2	0	0	0	0	109.6	I206 S207 C242 W275 L281	I206-S230 CarbonylContact C-O 3.58Å; I206-S230 WeakPolarHBondContact CA-O 3.11Å; S207-S230 WeakPolarHBondContact CB-OG 3.23Å; S207-S230 PolarHBondContact N-O 2.75Å; S207-S230 PolarHBondContact O-N 3.11Å; S207-S230 PolarHBondContact O-OG 3.15Å; S230-C242 CarbonylContact C-O 3.58Å; S230-C242 VanDerWaalsContact CA-O 3.23Å; S230-C242 WeakPolarHBondContact CA-O 3.37Å; S230-W275 PolarHBondContact OG-NE1 2.98Å; S230-L281 WeakPolarHBondContact OG-CD1 3.35Å
231	T	89.1	Confident	66.6	Low	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.6	172.6	63.4	0	0	0	0	111.2	I190 D205 I206 L229 I241 C242 W244	I190-T231 HydrophobicContact CG2-CG2 4Å; D205-T231 CarbonylContact O-C 3.54Å; D205-T231 VanDerWaalsContact O-CA 3.25Å; D205-T231 WeakPolarHBondContact O-CA 3.11Å; I206-T231 HydrophobicContact CB-CG2 4.25Å; I206-T231 HydrophobicContact CD1-CG2 4.2Å; I206-T231 HydrophobicContact CG1-CG2 3.96Å; L229-T231 HydrophobicContact CD2-CG2 3.79Å; L229-T231 HydrophobicContact CG-CG2 4.46Å; T231-I241 WeakPolarHBondContact O-CA 3Å; T231-C242 PolarHBondContact N-O 3.03Å; T231-C242 PolarHBondContact O-N 2.83Å; T231-C242 WeakPolarHBondContact OG1-CB 3.32Å; T231-W244 VanDerWaalsContact CG2-NE1 3.3Å; T231-W244 PolarHBondContact OG1-NE1 2.99Å
232	L	86.2	Confident	69.1	Low	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.2	170.2	-163.9	61.7	0	0	0	108.3	P204 D205 R239 I241 P270 L273 L283	P204-L232 WeakPolarHBondContact CA-O 3.44Å; D205-L232 HydrophobicContact CB-CB 4.35Å; D205-L232 PolarHBondContact N-O 3.02Å; D205-L232 PolarHBondContact O-N 3.29Å; L232-R239 HydrophobicContact CD1-CB 4.07Å; L232-R239 HydrophobicContact CG-CB 4.34Å; L232-R239 PolarHBondContact O-NH2 2.87Å; L232-I241 HydrophobicContact CD1-CG1 3.9Å; L232-P270 HydrophobicContact CD1-CB 3.92Å; L232-P270 HydrophobicContact CD2-CB 3.78Å; L232-P270 HydrophobicContact CG-CB 4.39Å; L232-L273 HydrophobicContact CB-CD1 3.55Å; L232-L273 HydrophobicContact CB-CG 4.02Å; L232-L273 HydrophobicContact CD1-CD1 4.31Å; L232-L273 HydrophobicContact CD1-CG 4.5Å; L232-L273 HydrophobicContact CG-CD1 4.41Å; L232-L283 HydrophobicContact CD1-CD1 4.2Å; L232-L283 HydrophobicContact CD2-CD1 4.18Å
233	N	80.5	Confident	71.6	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.07	17%	0.167	C	C	.	.			trans	-58.4	142.7	-173.2	-70.6	16	0	0	0	111.1	N191 R239 K240 C242	N191-N233 PolarHBondContact O-ND2 2.81Å; N233-R239 PolarHBondContact O-NE 3.3Å; N233-R239 PolarHBondContact O-NH2 3.27Å; N233-K240 PolarHBondContact N-O 2.89Å; N233-K240 PolarHBondContact OD1-O 3.44Å; N233-C242 PolarHBondContact OD1-SG 3.44Å
234	P	72.4	Confident	74	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.019	14%	0.143	C	C	.	.	S	Bend	trans	-67.6	158.1	170.3	31.7	-34.4	0	0	0	108.9	I190 S192 P204	I190-P234 HydrophobicContact CG1-CG 4.36Å; I190-P234 WeakPolarHBondContact O-CD 3.39Å; S192-P234 WeakPolarHBondContact CB-O 3.36Å; S192-P234 PolarHBondContact OG-O 2.76Å; P204-P234 HydrophobicContact CB-CB 4.07Å; P204-P234 HydrophobicContact CB-CG 4.43Å; P204-P234 HydrophobicContact CG-CB 4.28Å
235	L	63.4	Low	76.1	Confident	37 Å²	37	24.7 Å²	24.7	19%	0.194	12%	0.121	C	C	.	.	S	Bend	trans	65	65.8	156.1	-58	156.5	0	0	0	118	S192 T194 P196 A201	S192-L235 PolarHBondContact OG-O 2.77Å; T194-L235 PolarHBondContact OG1-O 3.37Å; P196-L235 HydrophobicContact CB-CD2 3.4Å; P196-L235 VanDerWaalsContact CB-CD2 3.4Å; P196-L235 HydrophobicContact CG-CD2 3.48Å; P196-L235 VanDerWaalsContact CG-CD2 3.48Å; A201-L235 HydrophobicContact CB-CD2 3.08Å; A201-L235 HydrophobicContact CB-CG 3.94Å
236	D	62.2	Low	77.5	Confident	35 Å²	35	22.2 Å²	22.2	19%	0.187	11%	0.11	C	C	.	.			trans	-177.2	159.7	150.3	-160.5	-8.7	0	0	0	109.6	T194 K238 R239	T194-D236 WeakPolarHBondContact OG1-CB 3.32Å; T194-D236 PolarHBondContact OG1-OD2 3.41Å; D236-K238 HydrophobicContact CB-CB 4.28Å; D236-K238 PolarHBondContact O-N 3.08Å; D236-K238 WeakPolarHBondContact OD2-CB 3.44Å; D236-K238 WeakPolarHBondContact OD2-CD 3.17Å; D236-R239 WeakPolarHBondContact O-CG 3.43Å
237	L	60	Low	78.2	Confident	113 Å²	113	27.2 Å²	27.2	59%	0.592	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21	165.5	-61	168.2	0	0	0	112.2	L269	L237-L269 HydrophobicContact CB-CD2 3.93Å; L237-L269 HydrophobicContact CD2-CD1 3.85Å; L237-L269 HydrophobicContact CD2-CD2 3.46Å; L237-L269 VanDerWaalsContact CD2-CD2 3.46Å; L237-L269 HydrophobicContact CD2-CG 4.23Å; L237-L269 HydrophobicContact CG-CD2 4.28Å
238	K	66.4	Low	78.2	Confident	95 Å²	95	29.1 Å²	29.1	41%	0.413	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	0	-175.2	-69.2	173	148.7	-134.4	0	115.3	D236 D261 C262	D236-K238 HydrophobicContact CB-CB 4.28Å; D236-K238 PolarHBondContact O-N 3.08Å; D236-K238 WeakPolarHBondContact OD2-CB 3.44Å; D236-K238 WeakPolarHBondContact OD2-CD 3.17Å; K238-D261 HydrophobicContact CB-CB 3.92Å; K238-D261 VanDerWaalsContact CD-OD2 3.31Å; K238-D261 WeakPolarHBondContact CD-OD2 3.28Å; K238-D261 WeakPolarHBondContact CE-OD2 3.35Å; K238-D261 HydrophobicContact CG-CB 4.33Å; K238-D261 IonicContact NZ-OD2 2.68Å; K238-D261 PolarHBondContact NZ-OD2 3.13Å; K238-D261 CarbonylContact O-C 3.57Å; K238-D261 VanDerWaalsContact O-CA 3.27Å; K238-D261 WeakPolarHBondContact O-CA 3.29Å; K238-C262 PolarHBondContact O-N 3.25Å
239	R	76.3	Confident	76.9	Confident	5 Å²	5	33.3 Å²	33.3	2%	0.019	16%	0.159	C	C	.	.			trans	-15.7	128.1	-169.6	-56.6	-167.3	73.3	179.6	1.3	115.3	T203 L232 N233 D236 C262 P270	T203-R239 PolarHBondContact O-NH1 2.6Å; T203-R239 PolarHBondContact O-NH2 3.38Å; L232-R239 HydrophobicContact CD1-CB 4.07Å; L232-R239 HydrophobicContact CG-CB 4.34Å; L232-R239 PolarHBondContact O-NH2 2.87Å; N233-R239 PolarHBondContact O-NE 3.3Å; N233-R239 PolarHBondContact O-NH2 3.27Å; D236-R239 WeakPolarHBondContact O-CG 3.43Å; R239-C262 WeakPolarHBondContact O-CB 3.19Å; R239-C262 PolarHBondContact O-N 3.28Å; R239-C262 PolarHBondContact O-SG 2.82Å; R239-P270 HydrophobicContact CB-CB 4.24Å; R239-P270 HydrophobicContact CB-CG 4.24Å; R239-P270 WeakPolarHBondContact CD-O 3.32Å; R239-P270 PolarHBondContact NH1-O 2.79Å
240	K	79.9	Confident	75.3	Confident	32 Å²	32	40.9 Å²	40.9	14%	0.139	20%	0.2	C	C	.	.			trans	-98.9	146	179.5	-63	176	-179	166.9	0	111.3	N233 Q258 D261	N233-K240 PolarHBondContact N-O 2.89Å; N233-K240 PolarHBondContact OD1-O 3.44Å; K240-Q258 HydrophobicContact CB-CG 4.35Å; K240-Q258 HydrophobicContact CD-CG 4.14Å; K240-D261 WeakPolarHBondContact CE-OD1 3.07Å; K240-D261 IonicContact NZ-OD1 2.9Å
241	I	84.1	Confident	73.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.2	167.5	-59.7	172.4	0	0	0	107.3	T231 L232 S259 L273 L281 L283 Y293	T231-I241 WeakPolarHBondContact O-CA 3Å; L232-I241 HydrophobicContact CD1-CG1 3.9Å; I241-S259 PolarHBondContact N-OG 2.96Å; I241-S259 PolarHBondContact O-N 2.77Å; I241-S259 PolarHBondContact O-OG 2.81Å; I241-L273 HydrophobicContact CD1-CD2 4.01Å; I241-L273 HydrophobicContact CG1-CD2 4.14Å; I241-L273 HydrophobicContact CG2-CD1 4.39Å; I241-L281 HydrophobicContact CD1-CD2 4.49Å; I241-L281 HydrophobicContact CG2-CD2 3.6Å; I241-L283 HydrophobicContact CD1-CD2 4.47Å; I241-Y293 HydrophobicContact CD1-CD2 3.86Å; I241-Y293 HydrophobicContact CD1-CE1 4.39Å; I241-Y293 HydrophobicContact CD1-CE2 3.54Å; I241-Y293 HydrophobicContact CD1-CG 4.4Å
242	C	84.7	Confident	72.3	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.8	174.8	-61	0	0	0	0	109.6	S230 T231 N233 W244 L255 I257	S230-C242 CarbonylContact C-O 3.58Å; S230-C242 VanDerWaalsContact CA-O 3.23Å; S230-C242 WeakPolarHBondContact CA-O 3.37Å; T231-C242 PolarHBondContact N-O 3.03Å; T231-C242 PolarHBondContact O-N 2.83Å; T231-C242 WeakPolarHBondContact OG1-CB 3.32Å; N233-C242 PolarHBondContact OD1-SG 3.44Å; C242-W244 HydrophobicContact CB-CH2 4.42Å; C242-W244 HydrophobicContact CB-CZ2 3.36Å; C242-W244 PolarHBondContact O-NE1 3.32Å; C242-L255 HydrophobicContact CB-CD1 3.55Å; C242-I257 CarbonylContact C-O 3.56Å; C242-I257 WeakPolarHBondContact CA-O 3.49Å
243	L	87	Confident	71.2	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.016	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135	171.3	-60.6	-173.7	0	0	0	109.8	L228 L229 V256 I257 W275 L281 I295 M300	L228-L243 HydrophobicContact CD2-CD1 4.47Å; L229-L243 CarbonylContact O-C 3.58Å; L229-L243 VanDerWaalsContact O-CA 3.29Å; L229-L243 WeakPolarHBondContact O-CA 3.24Å; L243-V256 PolarHBondContact O-N 3.27Å; L243-I257 HydrophobicContact CB-CB 4.21Å; L243-I257 HydrophobicContact CD1-CB 4.23Å; L243-I257 HydrophobicContact CD1-CD1 4.25Å; L243-I257 HydrophobicContact CG-CB 4.38Å; L243-I257 PolarHBondContact N-O 3.05Å; L243-I257 PolarHBondContact O-N 3.47Å; L243-W275 HydrophobicContact CD1-CH2 4.41Å; L243-W275 HydrophobicContact CD2-CH2 3.7Å; L243-W275 HydrophobicContact CD2-CZ2 3.62Å; L243-L281 HydrophobicContact CD2-CD2 4.49Å; L243-I295 HydrophobicContact CD1-CB 4.01Å; L243-I295 HydrophobicContact CD1-CD1 4.31Å; L243-I295 HydrophobicContact CD1-CG2 3.94Å; L243-M300 HydrophobicContact CD1-CE 3.34Å; L243-M300 HydrophobicContact CD2-CE 4.43Å; L243-M300 HydrophobicContact CG-CE 3.72Å
244	W	86.2	Confident	70.4	Confident	5 Å²	5	52.4 Å²	52.4	2%	0.019	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.2	-176.2	-37.9	76.1	0	0	0	109.6	W188 I190 L228 L229 T231 C242 N253 P254 L255	W188-W244 AromaticContact CD1-CE3 3.69Å; W188-W244 AromaticContact CD1-CH2 3.98Å; W188-W244 AromaticContact CD1-CZ3 3.41Å; W188-W244 VanDerWaalsContact CD1-CZ3 3.41Å; W188-W244 HydrophobicContact CG-CZ3 4.46Å; W188-W244 AromaticContact NE1-CD2 3.7Å; W188-W244 AromaticContact NE1-CE3 3.44Å; W188-W244 AromaticContact NE1-CZ3 3.63Å; I190-W244 HydrophobicContact CB-CZ2 4.26Å; I190-W244 HydrophobicContact CG2-CH2 3.77Å; I190-W244 HydrophobicContact CG2-CZ2 3.34Å; L228-W244 CarbonylContact C-O 3.59Å; L228-W244 WeakPolarHBondContact CA-O 3.31Å; L229-W244 HydrophobicContact CB-CB 4.07Å; L229-W244 HydrophobicContact CB-CG 4.43Å; L229-W244 HydrophobicContact CD2-CB 4.46Å; L229-W244 HydrophobicContact CD2-CG 4.21Å; L229-W244 PolarHBondContact N-O 2.88Å; L229-W244 PolarHBondContact O-N 3.49Å; T231-W244 VanDerWaalsContact CG2-NE1 3.3Å; T231-W244 PolarHBondContact OG1-NE1 2.99Å; C242-W244 HydrophobicContact CB-CH2 4.42Å; C242-W244 HydrophobicContact CB-CZ2 3.36Å; C242-W244 PolarHBondContact O-NE1 3.32Å; W244-N253 WeakPolarHBondContact CZ3-OD1 3.42Å; W244-P254 VanDerWaalsContact CA-O 3.3Å; W244-P254 WeakPolarHBondContact CA-O 3.15Å; W244-P254 HydrophobicContact CB-CB 4.5Å; W244-P254 HydrophobicContact CB-CG 4.3Å; W244-P254 HydrophobicContact CE3-CG 3.87Å; W244-L255 HydrophobicContact CD2-CD1 4.36Å; W244-L255 HydrophobicContact CE3-CB 3.92Å; W244-L255 HydrophobicContact CE3-CD1 4.37Å; W244-L255 HydrophobicContact CH2-CB 4.43Å; W244-L255 HydrophobicContact CH2-CD1 4.17Å; W244-L255 HydrophobicContact CZ2-CD1 4.11Å; W244-L255 HydrophobicContact CZ3-CB 3.89Å; W244-L255 HydrophobicContact CZ3-CD1 4.35Å
245	D	83.3	Confident	70.3	Confident	23 Å²	23	55 Å²	55	12%	0.123	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	107.7	170	-175.1	-22	0	0	0	108.9	F227 R247 I248 P254 V256	F227-D245 WeakPolarHBondContact CB-OD1 3Å; D245-R247 PolarHBondContact O-N 2.86Å; D245-R247 VanDerWaalsContact O-N 3.11Å; D245-R247 VanDerWaalsContact OD1-CB 3.3Å; D245-R247 WeakPolarHBondContact OD1-CB 3.49Å; D245-R247 IonicContact OD1-CZ 3.84Å; D245-R247 PolarHBondContact OD1-N 2.77Å; D245-R247 IonicContact OD1-NE 3.28Å; D245-R247 PolarHBondContact OD1-NE 3.15Å; D245-R247 IonicContact OD1-NH2 3.8Å; D245-R247 IonicContact OD2-CZ 3.42Å; D245-R247 IonicContact OD2-NE 3.76Å; D245-R247 PolarHBondContact OD2-NE 3.43Å; D245-R247 IonicContact OD2-NH2 2.71Å; D245-R247 PolarHBondContact OD2-NH2 2.9Å; D245-I248 HydrophobicContact CB-CD1 3.86Å; D245-I248 HydrophobicContact CB-CG1 4.04Å; D245-I248 WeakPolarHBondContact O-CB 3.3Å; D245-I248 PolarHBondContact O-N 2.86Å; D245-I248 VanDerWaalsContact O-N 3.11Å; D245-P254 PolarHBondContact N-O 3.25Å; D245-P254 WeakPolarHBondContact O-CB 3.23Å; D245-V256 HydrophobicContact CB-CG2 3.68Å
246	I	79.4	Confident	70.6	Confident	9 Å²	9	57 Å²	57	5%	0.046	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.9	-172.9	66	178.2	0	0	0	113.4	I166 L176 K186 W188 F227 L229 I248	I166-I246 HydrophobicContact CD1-CD1 4.16Å; L176-I246 HydrophobicContact CD1-CD1 4.3Å; K186-I246 PolarHBondContact NZ-O 2.79Å; W188-I246 HydrophobicContact CH2-CG2 4.01Å; W188-I246 HydrophobicContact CZ2-CG2 4.47Å; F227-I246 HydrophobicContact CB-CG1 3.81Å; F227-I246 HydrophobicContact CD1-CD1 3.92Å; F227-I246 HydrophobicContact CD1-CG1 3.65Å; F227-I246 HydrophobicContact CG-CG1 4.22Å; F227-I246 PolarHBondContact O-N 3.48Å; F227-I246 VanDerWaalsContact O-N 3.13Å; L229-I246 HydrophobicContact CB-CG2 4.48Å; I246-I248 VanDerWaalsContact C-N 3.29Å
247	R	73.8	Confident	71.1	Confident	139 Å²	139	57.9 Å²	57.9	53%	0.525	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.6	173.6	-65.8	175	-74.9	-166.5	8.4	113.3	F227 D245 N249	F227-R247 HydrophobicContact CB-CG 3.79Å; F227-R247 HydrophobicContact CD1-CG 3.66Å; F227-R247 HydrophobicContact CD2-CG 3.41Å; F227-R247 VanDerWaalsContact CD2-CG 3.41Å; F227-R247 HydrophobicContact CE1-CG 3.97Å; F227-R247 HydrophobicContact CE2-CG 3.69Å; F227-R247 HydrophobicContact CG-CG 3.34Å; F227-R247 HydrophobicContact CZ-CG 3.96Å; D245-R247 PolarHBondContact O-N 2.86Å; D245-R247 VanDerWaalsContact O-N 3.11Å; D245-R247 VanDerWaalsContact OD1-CB 3.3Å; D245-R247 WeakPolarHBondContact OD1-CB 3.49Å; D245-R247 IonicContact OD1-CZ 3.84Å; D245-R247 PolarHBondContact OD1-N 2.77Å; D245-R247 IonicContact OD1-NE 3.28Å; D245-R247 PolarHBondContact OD1-NE 3.15Å; D245-R247 IonicContact OD1-NH2 3.8Å; D245-R247 IonicContact OD2-CZ 3.42Å; D245-R247 IonicContact OD2-NE 3.76Å; D245-R247 PolarHBondContact OD2-NE 3.43Å; D245-R247 IonicContact OD2-NH2 2.71Å; D245-R247 PolarHBondContact OD2-NH2 2.9Å; R247-N249 PolarHBondContact O-N 3.01Å; R247-N249 PolarHBondContact O-OD1 2.8Å
248	I	68.5	Low	71.8	Confident	64 Å²	64	57 Å²	57	33%	0.328	30%	0.297	S	S	.	.			trans	-65.7	103.1	-177.7	-59	176.6	0	0	0	106.7	K186 D245 I246 V251 P254 V256	K186-I248 PolarHBondContact NZ-O 3.43Å; D245-I248 HydrophobicContact CB-CD1 3.86Å; D245-I248 HydrophobicContact CB-CG1 4.04Å; D245-I248 WeakPolarHBondContact O-CB 3.3Å; D245-I248 PolarHBondContact O-N 2.86Å; D245-I248 VanDerWaalsContact O-N 3.11Å; I246-I248 VanDerWaalsContact C-N 3.29Å; I248-V251 HydrophobicContact CG2-CG2 3.85Å; I248-P254 HydrophobicContact CB-CB 4.47Å; I248-V256 HydrophobicContact CD1-CG2 4.27Å
249	N	54.2	Low	72.2	Confident	122 Å²	122	52.8 Å²	52.8	65%	0.652	28%	0.279	S	S	*	.			trans	-80.5	-25.2	-171.4	-79.3	-16.5	0	0	0	113	K186 R247	K186-N249 WeakPolarHBondContact CE-OD1 3.38Å; K186-N249 PolarHBondContact NZ-OD1 2.73Å; R247-N249 PolarHBondContact O-N 3.01Å; R247-N249 PolarHBondContact O-OD1 2.8Å
250	D	54.7	Low	71.7	Confident	160 Å²	160	56.2 Å²	56.2	86%	0.856	30%	0.304	S	S	*	.	S	Bend	trans	-101.8	7	-162.1	-69.3	-23.9	0	0	0	115.1
251	V	53	Low	71.2	Confident	78 Å²	78	56.7 Å²	56.7	47%	0.473	31%	0.308	S	S	.	.			trans	-126.3	128.9	-179.4	-156.3	0	0	0	0	108.8	I248 N253	I248-V251 HydrophobicContact CG2-CG2 3.85Å; V251-N253 WeakPolarHBondContact CB-O 3.41Å; V251-N253 HydrophobicContact CG1-CB 4.17Å; V251-N253 WeakPolarHBondContact CG1-O 3.19Å; V251-N253 PolarHBondContact O-N 2.92Å
252	S	61.2	Low	70.3	Confident	106 Å²	106	56.9 Å²	56.9	74%	0.741	31%	0.309	S	S	*	.	S	Bend	trans	-56.4	1.7	164.5	55.2	0	0	0	0	113.5	W188	W188-S252 WeakPolarHBondContact CB-O 3.17Å
253	N	63.6	Low	69	Low	67 Å²	67	59.8 Å²	59.8	36%	0.358	33%	0.329	S	S	.	.			trans	-149.6	93.6	-177.7	-170.5	-16.4	0	0	0	109.4	W244 V251 L255	W244-N253 WeakPolarHBondContact CZ3-OD1 3.42Å; V251-N253 WeakPolarHBondContact CB-O 3.41Å; V251-N253 HydrophobicContact CG1-CB 4.17Å; V251-N253 WeakPolarHBondContact CG1-O 3.19Å; V251-N253 PolarHBondContact O-N 2.92Å; N253-L255 PolarHBondContact O-N 3.13Å; N253-L255 WeakPolarHBondContact OD1-CB 3.32Å; N253-L255 PolarHBondContact OD1-N 3.33Å
254	P	63.7	Low	67.5	Low	3 Å²	3	65.7 Å²	65.7	2%	0.019	36%	0.361	C	S	.	.			trans	-76.2	21.5	-177.6	27.4	-29.6	0	0	0	114.1	W188 W244 D245 I248 V256	W188-P254 HydrophobicContact CD2-CG 3.87Å; W188-P254 HydrophobicContact CE3-CG 4.22Å; W188-P254 HydrophobicContact CG-CG 4.21Å; W188-P254 HydrophobicContact CZ2-CG 4.2Å; W244-P254 VanDerWaalsContact CA-O 3.3Å; W244-P254 WeakPolarHBondContact CA-O 3.15Å; W244-P254 HydrophobicContact CB-CB 4.5Å; W244-P254 HydrophobicContact CB-CG 4.3Å; W244-P254 HydrophobicContact CE3-CG 3.87Å; D245-P254 PolarHBondContact N-O 3.25Å; D245-P254 WeakPolarHBondContact O-CB 3.23Å; I248-P254 HydrophobicContact CB-CB 4.47Å; P254-V256 PolarHBondContact O-N 3.21Å
255	L	70	Confident	66.3	Low	57 Å²	57	65.7 Å²	65.7	30%	0.298	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	125.8	-175.8	-178.9	73.6	0	0	0	111.5	C242 W244 N253 I257 Q258	C242-L255 HydrophobicContact CB-CD1 3.55Å; W244-L255 HydrophobicContact CD2-CD1 4.36Å; W244-L255 HydrophobicContact CE3-CB 3.92Å; W244-L255 HydrophobicContact CE3-CD1 4.37Å; W244-L255 HydrophobicContact CH2-CB 4.43Å; W244-L255 HydrophobicContact CH2-CD1 4.17Å; W244-L255 HydrophobicContact CZ2-CD1 4.11Å; W244-L255 HydrophobicContact CZ3-CB 3.89Å; W244-L255 HydrophobicContact CZ3-CD1 4.35Å; N253-L255 PolarHBondContact O-N 3.13Å; N253-L255 WeakPolarHBondContact OD1-CB 3.32Å; N253-L255 PolarHBondContact OD1-N 3.33Å; L255-I257 WeakPolarHBondContact CD1-O 3.45Å; L255-Q258 HydrophobicContact CD1-CB 4.36Å; L255-Q258 HydrophobicContact CD2-CB 4.28Å
256	V	70.2	Confident	65.1	Low	79 Å²	79	73.3 Å²	73.3	48%	0.479	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-48.5	176.2	-172.2	0	0	0	0	110.4	L243 D245 I248 P254	L243-V256 PolarHBondContact O-N 3.27Å; D245-V256 HydrophobicContact CB-CG2 3.68Å; I248-V256 HydrophobicContact CD1-CG2 4.27Å; P254-V256 PolarHBondContact O-N 3.21Å
257	I	73.9	Confident	64.4	Low	55 Å²	55	82.2 Å²	82.2	28%	0.282	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	139	-177	-53.8	-176	0	0	0	109	C242 L243 L255 M300	C242-I257 CarbonylContact C-O 3.56Å; C242-I257 WeakPolarHBondContact CA-O 3.49Å; L243-I257 HydrophobicContact CB-CB 4.21Å; L243-I257 HydrophobicContact CD1-CB 4.23Å; L243-I257 HydrophobicContact CD1-CD1 4.25Å; L243-I257 HydrophobicContact CG-CB 4.38Å; L243-I257 PolarHBondContact N-O 3.05Å; L243-I257 PolarHBondContact O-N 3.47Å; L255-I257 WeakPolarHBondContact CD1-O 3.45Å; I257-M300 HydrophobicContact CB-CE 4.44Å; I257-M300 HydrophobicContact CG2-CE 3.92Å; I257-M300 HydrophobicContact CG2-SD 4.3Å
258	Q	74.3	Confident	64.1	Low	95 Å²	95	76 Å²	76	44%	0.444	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.5	168.7	-172.4	-179.1	-65	0	0	108.4	K240 L255	K240-Q258 HydrophobicContact CB-CG 4.35Å; K240-Q258 HydrophobicContact CD-CG 4.14Å; L255-Q258 HydrophobicContact CD1-CB 4.36Å; L255-Q258 HydrophobicContact CD2-CB 4.28Å
259	S	74	Confident	64.4	Low	6 Å²	6	74.3 Å²	74.3	4%	0.042	40%	0.403	C	S	.	.			trans	-64.1	158.1	174.3	76.2	0	0	0	0	110.7	I241	I241-S259 PolarHBondContact N-OG 2.96Å; I241-S259 PolarHBondContact O-N 2.77Å; I241-S259 PolarHBondContact O-OG 2.81Å
260	S	65.7	Low	65.6	Low	76 Å²	76	68.5 Å²	68.5	53%	0.531	37%	0.372	S	S	.	.			trans	-59.2	161.9	156.7	53.3	0	0	0	0	110	C262	S260-C262 PolarHBondContact O-N 2.87Å
261	D	68.8	Low	66.7	Low	42 Å²	42	61.6 Å²	61.6	23%	0.225	34%	0.336	C	S	.	.			trans	-44.2	128.6	173.2	-65.8	-5.9	0	0	0	109.9	K238 K240 S263	K238-D261 HydrophobicContact CB-CB 3.92Å; K238-D261 VanDerWaalsContact CD-OD2 3.31Å; K238-D261 WeakPolarHBondContact CD-OD2 3.28Å; K238-D261 WeakPolarHBondContact CE-OD2 3.35Å; K238-D261 HydrophobicContact CG-CB 4.33Å; K238-D261 IonicContact NZ-OD2 2.68Å; K238-D261 PolarHBondContact NZ-OD2 3.13Å; K238-D261 CarbonylContact O-C 3.57Å; K238-D261 VanDerWaalsContact O-CA 3.27Å; K238-D261 WeakPolarHBondContact O-CA 3.29Å; K240-D261 WeakPolarHBondContact CE-OD1 3.07Å; K240-D261 IonicContact NZ-OD1 2.9Å; D261-S263 PolarHBondContact O-N 2.75Å
262	C	66.7	Low	68.1	Low	5 Å²	5	58 Å²	58	3%	0.034	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-70.5	13.3	174.6	-67.7	0	0	0	0	112.2	K238 R239 S260 N264 V265 P270	K238-C262 PolarHBondContact O-N 3.25Å; R239-C262 WeakPolarHBondContact O-CB 3.19Å; R239-C262 PolarHBondContact O-N 3.28Å; R239-C262 PolarHBondContact O-SG 2.82Å; S260-C262 PolarHBondContact O-N 2.87Å; C262-N264 PolarHBondContact O-N 3.13Å; C262-V265 WeakPolarHBondContact O-CB 3.39Å; C262-V265 VanDerWaalsContact O-CG2 3.32Å; C262-V265 WeakPolarHBondContact O-CG2 3.23Å; C262-V265 PolarHBondContact O-N 3.12Å; C262-P270 HydrophobicContact CB-CG 3.59Å
263	S	56.4	Low	69.2	Low	61 Å²	61	53 Å²	53	43%	0.427	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-59.9	-14.5	178.6	57.4	0	0	0	0	114.3	D261 V265	D261-S263 PolarHBondContact O-N 2.75Å; S263-V265 PolarHBondContact O-N 3.43Å
264	N	56.8	Low	70.3	Confident	127 Å²	127	50.7 Å²	50.7	68%	0.679	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-73.7	-11.8	174.2	-72.9	-9.5	0	0	0	113.1	C262 K266 L302	C262-N264 PolarHBondContact O-N 3.13Å; N264-K266 PolarHBondContact O-N 2.87Å; N264-K266 VanDerWaalsContact O-N 3.15Å; N264-L302 HydrophobicContact CB-CD1 4.36Å
265	V	60.9	Low	71.3	Confident	5 Å²	5	51 Å²	51	3%	0.03	27%	0.269	C	S	.	.	S	Bend	trans	-69.2	106.8	166.5	-178.3	0	0	0	0	107.3	C262 S263 H267 D268 T285 Y291 L302	C262-V265 WeakPolarHBondContact O-CB 3.39Å; C262-V265 VanDerWaalsContact O-CG2 3.32Å; C262-V265 WeakPolarHBondContact O-CG2 3.23Å; C262-V265 PolarHBondContact O-N 3.12Å; S263-V265 PolarHBondContact O-N 3.43Å; V265-H267 PolarHBondContact O-N 3.18Å; V265-D268 HydrophobicContact CG1-CB 3.97Å; V265-D268 WeakPolarHBondContact CG1-O 3.33Å; V265-D268 PolarHBondContact O-N 2.82Å; V265-T285 HydrophobicContact CG1-CG2 4.11Å; V265-Y291 HydrophobicContact CG1-CE2 3.6Å; V265-Y291 HydrophobicContact CG2-CE2 4.28Å; V265-L302 HydrophobicContact CG2-CD1 3.85Å
266	K	57.8	Low	71.7	Confident	184 Å²	184	48.4 Å²	48.4	80%	0.8	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	102.4	-172.3	-76.2	-177.7	177.6	176.9	0	111.9	N264 D268	N264-K266 PolarHBondContact O-N 2.87Å; N264-K266 VanDerWaalsContact O-N 3.15Å; K266-D268 PolarHBondContact O-N 2.77Å
267	H	63.5	Low	72	Confident	195 Å²	195	45.8 Å²	45.8	90%	0.903	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	19	174	-57.1	-62.5	0	0	0	116	V265	V265-H267 PolarHBondContact O-N 3.18Å
268	D	68.7	Low	72.1	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.043	25%	0.25	C	C	.	.			trans	-126	141	-178.6	-166.6	3.7	0	0	0	110.8	V265 K266 T285 Y286 E287 H289	V265-D268 HydrophobicContact CG1-CB 3.97Å; V265-D268 WeakPolarHBondContact CG1-O 3.33Å; V265-D268 PolarHBondContact O-N 2.82Å; K266-D268 PolarHBondContact O-N 2.77Å; D268-T285 WeakPolarHBondContact OD2-CB 3.35Å; D268-T285 PolarHBondContact OD2-OG1 3.49Å; D268-Y286 WeakPolarHBondContact OD1-CA 3.45Å; D268-Y286 WeakPolarHBondContact OD1-CB 3.21Å; D268-Y286 PolarHBondContact OD1-N 3.31Å; D268-E287 HydrophobicContact CB-CB 4.38Å; D268-E287 HydrophobicContact CB-CG 4.31Å; D268-E287 VanDerWaalsContact CG-CB 3.5Å; D268-E287 PolarHBondContact OD1-N 2.81Å; D268-E287 WeakPolarHBondContact OD2-CA 3.37Å; D268-E287 VanDerWaalsContact OD2-CB 3.22Å; D268-E287 WeakPolarHBondContact OD2-CB 3.4Å; D268-E287 PolarHBondContact OD2-N 3.29Å; D268-E287 VanDerWaalsContact OD2-N 3.08Å; D268-H289 IonicContact OD2-CE1 2.68Å; D268-H289 IonicContact OD2-CG 2.69Å; D268-H289 IonicContact OD2-ND1 3.69Å; D268-H289 PolarHBondContact OD2-ND1 2.95Å
269	L	74.5	Confident	72.3	Confident	29 Å²	29	45 Å²	45	15%	0.152	24%	0.244	C	C	.	.			trans	-98.5	124.2	-166.8	-66.8	168.2	0	0	0	110.7	F202 L237 T271 T285 Y286	F202-L269 HydrophobicContact CE2-CD1 3.54Å; F202-L269 HydrophobicContact CZ-CB 4.49Å; F202-L269 HydrophobicContact CZ-CD1 3.53Å; L237-L269 HydrophobicContact CB-CD2 3.93Å; L237-L269 HydrophobicContact CD2-CD1 3.85Å; L237-L269 HydrophobicContact CD2-CD2 3.46Å; L237-L269 VanDerWaalsContact CD2-CD2 3.46Å; L237-L269 HydrophobicContact CD2-CG 4.23Å; L237-L269 HydrophobicContact CG-CD2 4.28Å; L269-T271 PolarHBondContact O-N 3Å; L269-T285 CarbonylContact O-C 3.57Å; L269-T285 WeakPolarHBondContact O-CA 3.22Å; L269-T285 WeakPolarHBondContact O-CB 3.46Å; L269-Y286 PolarHBondContact O-N 3.45Å
270	P	79.9	Confident	72.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	133.9	171.1	-25.9	35.9	0	0	0	111.2	L232 R239 C262 L283	L232-P270 HydrophobicContact CD1-CB 3.92Å; L232-P270 HydrophobicContact CD2-CB 3.78Å; L232-P270 HydrophobicContact CG-CB 4.39Å; R239-P270 HydrophobicContact CB-CB 4.24Å; R239-P270 HydrophobicContact CB-CG 4.24Å; R239-P270 WeakPolarHBondContact CD-O 3.32Å; R239-P270 PolarHBondContact NH1-O 2.79Å; C262-P270 HydrophobicContact CB-CG 3.59Å; P270-L283 HydrophobicContact CB-CD1 3.66Å; P270-L283 HydrophobicContact CB-CD2 3.95Å; P270-L283 HydrophobicContact CB-CG 4.24Å; P270-L283 HydrophobicContact CG-CD2 4.03Å
271	T	78.2	Confident	73.4	Confident	15 Å²	15	42.5 Å²	42.5	9%	0.092	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	-37.7	-176	46.6	0	0	0	0	113.2	L269 G284 T285 Y286 C321 K322	L269-T271 PolarHBondContact O-N 3Å; T271-G284 PolarHBondContact N-O 3.22Å; T271-G284 PolarHBondContact OG1-O 2.95Å; T271-G284 VanDerWaalsContact OG1-O 3.13Å; T271-T285 WeakPolarHBondContact OG1-CA 3.09Å; T271-T285 PolarHBondContact OG1-N 3.48Å; T271-T285 PolarHBondContact OG1-O 3.11Å; T271-Y286 HydrophobicContact CG2-CD2 4.25Å; T271-C321 WeakPolarHBondContact CG2-SG 3.03Å; T271-K322 PolarHBondContact OG1-O 3.46Å
272	A	81.6	Confident	74.1	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.017	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	151.5	-174.5	0	0	0	0	0	112.7	D205 L283 G284 I324	D205-A272 VanDerWaalsContact OD2-CA 3.24Å; D205-A272 WeakPolarHBondContact OD2-CA 3.09Å; A272-L283 WeakPolarHBondContact O-CA 2.78Å; A272-L283 WeakPolarHBondContact O-CD1 3.32Å; A272-G284 PolarHBondContact N-O 3.35Å; A272-G284 PolarHBondContact O-N 2.6Å; A272-I324 HydrophobicContact CB-CB 4.27Å; A272-I324 HydrophobicContact CB-CG1 4.26Å
273	L	85.1	Confident	74.7	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142.1	177.5	-70.6	173.2	0	0	0	111.3	D205 L232 I241 L281 L282 L283	D205-L273 PolarHBondContact OD2-N 3.25Å; L232-L273 HydrophobicContact CB-CD1 3.55Å; L232-L273 HydrophobicContact CB-CG 4.02Å; L232-L273 HydrophobicContact CD1-CD1 4.31Å; L232-L273 HydrophobicContact CD1-CG 4.5Å; L232-L273 HydrophobicContact CG-CD1 4.41Å; I241-L273 HydrophobicContact CD1-CD2 4.01Å; I241-L273 HydrophobicContact CG1-CD2 4.14Å; I241-L273 HydrophobicContact CG2-CD1 4.39Å; L273-L281 HydrophobicContact CD2-CD2 3.92Å; L273-L281 HydrophobicContact CD2-CG 4.14Å; L273-L282 WeakPolarHBondContact CA-O 3.19Å; L273-L283 HydrophobicContact CD2-CB 4.2Å; L273-L283 HydrophobicContact CD2-CD1 3.52Å; L273-L283 HydrophobicContact CD2-CG 4.48Å; L273-L283 HydrophobicContact CG-CD1 4.23Å
274	S	86.5	Confident	75.7	Confident	20 Å²	20	37.3 Å²	37.3	14%	0.14	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	138.9	170.3	-167.4	0	0	0	0	112.6	L276 L282 I327	S274-L276 PolarHBondContact O-N 3.32Å; S274-L282 PolarHBondContact N-O 3.08Å; S274-L282 VanDerWaalsContact N-O 3.11Å; S274-L282 WeakPolarHBondContact O-CA 3.34Å; S274-L282 VanDerWaalsContact O-CB 3.32Å; S274-L282 WeakPolarHBondContact O-CB 3.13Å; S274-L282 PolarHBondContact O-N 3.48Å; S274-I327 WeakPolarHBondContact OG-CD1 3.38Å
275	W	83.9	Confident	76.6	Confident	9 Å²	9	31.3 Å²	31.3	3%	0.034	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	116.6	177	-73.1	98.8	0	0	0	112	S207 L209 L228 S230 L243 L281 I295 I327	S207-W275 PolarHBondContact O-NE1 3.47Å; S207-W275 PolarHBondContact OG-N 3.44Å; L209-W275 HydrophobicContact CB-CD2 3.99Å; L209-W275 HydrophobicContact CB-CG 3.95Å; L209-W275 HydrophobicContact CD1-CB 3.82Å; L209-W275 HydrophobicContact CD1-CD2 3.92Å; L209-W275 HydrophobicContact CD1-CE3 3.98Å; L209-W275 HydrophobicContact CD1-CG 3.89Å; L209-W275 HydrophobicContact CG-CD2 4.47Å; L228-W275 HydrophobicContact CD2-CH2 3.3Å; L228-W275 HydrophobicContact CD2-CZ2 3.56Å; L228-W275 HydrophobicContact CD2-CZ3 4.18Å; L228-W275 HydrophobicContact CG-CH2 4.25Å; L228-W275 HydrophobicContact CG-CZ2 4.02Å; S230-W275 PolarHBondContact OG-NE1 2.98Å; L243-W275 HydrophobicContact CD1-CH2 4.41Å; L243-W275 HydrophobicContact CD2-CH2 3.7Å; L243-W275 HydrophobicContact CD2-CZ2 3.62Å; W275-L281 HydrophobicContact CD2-CD1 3.7Å; W275-L281 HydrophobicContact CE3-CB 4.28Å; W275-L281 HydrophobicContact CE3-CD1 4.01Å; W275-L281 HydrophobicContact CG-CD1 4.03Å; W275-L281 HydrophobicContact CH2-CD1 4.5Å; W275-L281 HydrophobicContact CZ2-CD1 4.24Å; W275-L281 HydrophobicContact CZ3-CB 4.21Å; W275-L281 HydrophobicContact CZ3-CD1 4.41Å; W275-I295 HydrophobicContact CH2-CD1 3.94Å; W275-I295 HydrophobicContact CH2-CG2 3.93Å; W275-I295 HydrophobicContact CZ3-CD1 3.96Å; W275-I295 HydrophobicContact CZ3-CG2 3.89Å; W275-I327 VanDerWaalsContact O-CD1 3.27Å; W275-I327 WeakPolarHBondContact O-CD1 3.32Å
276	L	78.7	Confident	77.1	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	-42	172.8	-174.1	64.8	0	0	0	111.9	S274 H280 L282 I327 K345 I347 F368	S274-L276 PolarHBondContact O-N 3.32Å; L276-H280 HydrophobicContact CB-CB 4.09Å; L276-H280 WeakPolarHBondContact CB-O 3.5Å; L276-H280 HydrophobicContact CD2-CB 4.19Å; L276-H280 PolarHBondContact N-O 3.38Å; L276-L282 HydrophobicContact CB-CD2 4.07Å; L276-L282 HydrophobicContact CB-CG 3.99Å; L276-L282 HydrophobicContact CD1-CD1 4.37Å; L276-L282 HydrophobicContact CD1-CD2 4.48Å; L276-L282 HydrophobicContact CD2-CD2 4.01Å; L276-L282 HydrophobicContact CG-CD2 4.43Å; L276-I327 HydrophobicContact CD1-CD1 4.22Å; L276-I327 HydrophobicContact CD1-CG2 4.24Å; L276-K345 HydrophobicContact CD1-CD 4.15Å; L276-K345 PolarHBondContact O-NZ 3.28Å; L276-I347 HydrophobicContact CD1-CD1 3.99Å; L276-I347 HydrophobicContact CD1-CG1 4.5Å; L276-F368 HydrophobicContact CD2-CE1 4.42Å; L276-F368 HydrophobicContact CD2-CZ 3.81Å
277	S	75.7	Confident	77.4	Confident	24 Å²	24	28 Å²	28	17%	0.168	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	171.2	-179.9	84.7	0	0	0	0	109.6	N279 H280	S277-N279 PolarHBondContact O-N 3.17Å; S277-N279 PolarHBondContact OG-N 3.03Å; S277-H280 PolarHBondContact N-O 2.85Å; S277-H280 PolarHBondContact O-N 3.12Å; S277-H280 VanDerWaalsContact O-N 3.15Å; S277-H280 VanDerWaalsContact O-O 3.12Å; S277-H280 WeakPolarHBondContact OG-CB 3.29Å; S277-H280 PolarHBondContact OG-N 3.42Å; S277-H280 VanDerWaalsContact OG-N 3.08Å; S277-H280 PolarHBondContact OG-ND1 2.99Å
278	P	77.5	Confident	77.5	Confident	73 Å²	73	19.1 Å²	19.1	47%	0.474	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-21.9	174.4	-27.1	36.4	0	0	0	114.9	L209 I295	L209-P278 HydrophobicContact CD2-CB 4.13Å; P278-I295 WeakPolarHBondContact O-CD1 3.42Å
279	N	77.6	Confident	77.6	Confident	61 Å²	61	22.6 Å²	22.6	33%	0.326	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-13.3	-179.5	-59.9	-42.4	0	0	0	113.5	S277 D294 I295 R296	S277-N279 PolarHBondContact O-N 3.17Å; S277-N279 PolarHBondContact OG-N 3.03Å; N279-D294 WeakPolarHBondContact O-CA 3.34Å; N279-I295 WeakPolarHBondContact O-CG1 3.37Å; N279-I295 PolarHBondContact O-N 3.49Å; N279-R296 HydrophobicContact CB-CG 4.26Å
280	H	79.5	Confident	77.6	Confident	29 Å²	29	22 Å²	22	13%	0.134	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.1	-169.7	-62.4	134.5	0	0	0	111.4	L276 S277 V292 Y293 D366	L276-H280 HydrophobicContact CB-CB 4.09Å; L276-H280 WeakPolarHBondContact CB-O 3.5Å; L276-H280 HydrophobicContact CD2-CB 4.19Å; L276-H280 PolarHBondContact N-O 3.38Å; S277-H280 PolarHBondContact N-O 2.85Å; S277-H280 PolarHBondContact O-N 3.12Å; S277-H280 VanDerWaalsContact O-N 3.15Å; S277-H280 VanDerWaalsContact O-O 3.12Å; S277-H280 WeakPolarHBondContact OG-CB 3.29Å; S277-H280 PolarHBondContact OG-N 3.42Å; S277-H280 VanDerWaalsContact OG-N 3.08Å; S277-H280 PolarHBondContact OG-ND1 2.99Å; H280-V292 HydrophobicContact CB-CG1 3.88Å; H280-Y293 CarbonylContact C-O 3.49Å; H280-Y293 WeakPolarHBondContact CA-O 3.17Å; H280-D366 IonicContact CE1-OD2 2.69Å
281	L	83.1	Confident	77.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.8	177.7	-174.9	70.2	0	0	0	109.8	S230 I241 L243 L273 W275 V292 Y293 I295	S230-L281 WeakPolarHBondContact OG-CD1 3.35Å; I241-L281 HydrophobicContact CD1-CD2 4.49Å; I241-L281 HydrophobicContact CG2-CD2 3.6Å; L243-L281 HydrophobicContact CD2-CD2 4.49Å; L273-L281 HydrophobicContact CD2-CD2 3.92Å; L273-L281 HydrophobicContact CD2-CG 4.14Å; W275-L281 HydrophobicContact CD2-CD1 3.7Å; W275-L281 HydrophobicContact CE3-CB 4.28Å; W275-L281 HydrophobicContact CE3-CD1 4.01Å; W275-L281 HydrophobicContact CG-CD1 4.03Å; W275-L281 HydrophobicContact CH2-CD1 4.5Å; W275-L281 HydrophobicContact CZ2-CD1 4.24Å; W275-L281 HydrophobicContact CZ3-CB 4.21Å; W275-L281 HydrophobicContact CZ3-CD1 4.41Å; L281-V292 WeakPolarHBondContact O-CA 3.45Å; L281-Y293 PolarHBondContact N-O 3.46Å; L281-Y293 PolarHBondContact O-N 3.44Å; L281-I295 HydrophobicContact CB-CG2 4.34Å
282	L	82.8	Confident	77.4	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	140.4	173	-57.9	-177	0	0	0	110.3	L273 S274 L276 L290 Y291 V292 I324 I327 I347 F368	L273-L282 WeakPolarHBondContact CA-O 3.19Å; S274-L282 PolarHBondContact N-O 3.08Å; S274-L282 VanDerWaalsContact N-O 3.11Å; S274-L282 WeakPolarHBondContact O-CA 3.34Å; S274-L282 VanDerWaalsContact O-CB 3.32Å; S274-L282 WeakPolarHBondContact O-CB 3.13Å; S274-L282 PolarHBondContact O-N 3.48Å; L276-L282 HydrophobicContact CB-CD2 4.07Å; L276-L282 HydrophobicContact CB-CG 3.99Å; L276-L282 HydrophobicContact CD1-CD1 4.37Å; L276-L282 HydrophobicContact CD1-CD2 4.48Å; L276-L282 HydrophobicContact CD2-CD2 4.01Å; L276-L282 HydrophobicContact CG-CD2 4.43Å; L282-L290 HydrophobicContact CB-CD1 4.19Å; L282-Y291 CarbonylContact C-O 3.57Å; L282-Y291 VanDerWaalsContact CA-O 3.32Å; L282-Y291 WeakPolarHBondContact CA-O 3.35Å; L282-V292 HydrophobicContact CD2-CB 4.46Å; L282-V292 HydrophobicContact CD2-CG1 4.47Å; L282-V292 HydrophobicContact CD2-CG2 3.52Å; L282-I324 HydrophobicContact CB-CD1 3.62Å; L282-I324 HydrophobicContact CD1-CG2 4.5Å; L282-I327 HydrophobicContact CD1-CD1 3.54Å; L282-I327 HydrophobicContact CD1-CG1 4.16Å; L282-I327 HydrophobicContact CG-CD1 4.32Å; L282-I347 HydrophobicContact CD1-CD1 3.63Å; L282-I347 HydrophobicContact CD1-CG1 4.11Å; L282-I347 HydrophobicContact CD1-CG2 3.93Å; L282-I347 HydrophobicContact CD2-CD1 4.41Å; L282-F368 HydrophobicContact CD2-CZ 4.31Å
283	L	81	Confident	77.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	118.9	168.8	177.4	72.5	0	0	0	110.1	L232 I241 P270 A272 L273 T285 L290 Y291 Y293	L232-L283 HydrophobicContact CD1-CD1 4.2Å; L232-L283 HydrophobicContact CD2-CD1 4.18Å; I241-L283 HydrophobicContact CD1-CD2 4.47Å; P270-L283 HydrophobicContact CB-CD1 3.66Å; P270-L283 HydrophobicContact CB-CD2 3.95Å; P270-L283 HydrophobicContact CB-CG 4.24Å; P270-L283 HydrophobicContact CG-CD2 4.03Å; A272-L283 WeakPolarHBondContact O-CA 2.78Å; A272-L283 WeakPolarHBondContact O-CD1 3.32Å; L273-L283 HydrophobicContact CD2-CB 4.2Å; L273-L283 HydrophobicContact CD2-CD1 3.52Å; L273-L283 HydrophobicContact CD2-CG 4.48Å; L273-L283 HydrophobicContact CG-CD1 4.23Å; L283-T285 HydrophobicContact CD2-CG2 4.49Å; L283-L290 WeakPolarHBondContact O-CA 3.16Å; L283-Y291 PolarHBondContact N-O 3.41Å; L283-Y291 PolarHBondContact O-N 3.48Å; L283-Y293 HydrophobicContact CB-CD2 4.14Å; L283-Y293 HydrophobicContact CB-CE2 3.78Å; L283-Y293 HydrophobicContact CD2-CE2 3.7Å; L283-Y293 HydrophobicContact CG-CE2 4.35Å
284	G	77.6	Confident	76.7	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	149.7	169.2	0	0	0	0	0	110.2	T271 A272 I324	T271-G284 PolarHBondContact N-O 3.22Å; T271-G284 PolarHBondContact OG1-O 2.95Å; T271-G284 VanDerWaalsContact OG1-O 3.13Å; A272-G284 PolarHBondContact N-O 3.35Å; A272-G284 PolarHBondContact O-N 2.6Å; G284-I324 VanDerWaalsContact N-CD1 3.29Å
285	T	75.4	Confident	76.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	172.8	-175.5	57	0	0	0	0	112.7	V265 D268 L269 T271 L283 G288 H289 Y291 K322	V265-T285 HydrophobicContact CG1-CG2 4.11Å; D268-T285 WeakPolarHBondContact OD2-CB 3.35Å; D268-T285 PolarHBondContact OD2-OG1 3.49Å; L269-T285 CarbonylContact O-C 3.57Å; L269-T285 WeakPolarHBondContact O-CA 3.22Å; L269-T285 WeakPolarHBondContact O-CB 3.46Å; T271-T285 WeakPolarHBondContact OG1-CA 3.09Å; T271-T285 PolarHBondContact OG1-N 3.48Å; T271-T285 PolarHBondContact OG1-O 3.11Å; L283-T285 HydrophobicContact CD2-CG2 4.49Å; T285-G288 PolarHBondContact O-N 2.83Å; T285-H289 PolarHBondContact N-O 3.02Å; T285-H289 VanDerWaalsContact N-O 3.1Å; T285-H289 VanDerWaalsContact OG1-CA 3.3Å; T285-H289 WeakPolarHBondContact OG1-CA 3.35Å; T285-H289 VanDerWaalsContact OG1-CB 3.32Å; T285-H289 WeakPolarHBondContact OG1-CB 3.43Å; T285-H289 PolarHBondContact OG1-N 2.83Å; T285-H289 PolarHBondContact OG1-O 2.77Å; T285-Y291 HydrophobicContact CG2-CD2 3.84Å; T285-Y291 HydrophobicContact CG2-CE2 3.69Å; T285-K322 WeakPolarHBondContact O-CB 3.48Å; T285-K322 PolarHBondContact O-N 2.82Å; T285-K322 VanDerWaalsContact O-N 3.08Å
286	Y	70.9	Confident	75.7	Confident	48 Å²	48	32 Å²	32	19%	0.188	16%	0.156	C	C	.	.	S	Bend	trans	-72.8	-42.8	-171.7	-173.6	-99.2	0	0	0	113.6	F202 D268 L269 T271 G288 R320 C321	F202-Y286 HydrophobicContact CE1-CD2 4.01Å; F202-Y286 HydrophobicContact CE1-CE2 4.27Å; F202-Y286 HydrophobicContact CZ-CD2 4.49Å; D268-Y286 WeakPolarHBondContact OD1-CA 3.45Å; D268-Y286 WeakPolarHBondContact OD1-CB 3.21Å; D268-Y286 PolarHBondContact OD1-N 3.31Å; L269-Y286 PolarHBondContact O-N 3.45Å; T271-Y286 HydrophobicContact CG2-CD2 4.25Å; Y286-G288 PolarHBondContact O-N 3.35Å; Y286-R320 HydrophobicContact CD1-CB 4.47Å; Y286-R320 HydrophobicContact CD1-CG 4.47Å; Y286-R320 HydrophobicContact CE1-CB 3.72Å; Y286-R320 HydrophobicContact CE1-CG 3.46Å; Y286-R320 VanDerWaalsContact CE1-CG 3.46Å; Y286-R320 HydrophobicContact CE2-CB 3.94Å; Y286-R320 HydrophobicContact CE2-CG 4.44Å; Y286-R320 VanDerWaalsContact CZ-CB 3.41Å; Y286-R320 VanDerWaalsContact CZ-CG 3.43Å; Y286-R320 CarbonylContact O-C 3.29Å; Y286-R320 VanDerWaalsContact O-CA 3.25Å; Y286-R320 WeakPolarHBondContact O-CA 3.43Å; Y286-R320 WeakPolarHBondContact OH-CB 3.39Å; Y286-R320 WeakPolarHBondContact OH-CD 3.36Å; Y286-R320 WeakPolarHBondContact OH-CG 3.31Å; Y286-C321 VanDerWaalsContact CD2-CA 3.48Å; Y286-C321 HydrophobicContact CD2-CB 3.51Å; Y286-C321 HydrophobicContact CE2-CB 3.71Å; Y286-C321 VanDerWaalsContact O-CA 3.31Å; Y286-C321 WeakPolarHBondContact O-CA 2.97Å; Y286-C321 PolarHBondContact O-N 2.92Å
287	E	64	Low	75.3	Confident	72 Å²	72	34.4 Å²	34.4	34%	0.336	17%	0.169	S	C	.	.	S	Bend	trans	-81.7	-1.7	173.5	-56.3	-65.1	149	0	0	111.9	D268 H319	D268-E287 HydrophobicContact CB-CB 4.38Å; D268-E287 HydrophobicContact CB-CG 4.31Å; D268-E287 VanDerWaalsContact CG-CB 3.5Å; D268-E287 PolarHBondContact OD1-N 2.81Å; D268-E287 WeakPolarHBondContact OD2-CA 3.37Å; D268-E287 VanDerWaalsContact OD2-CB 3.22Å; D268-E287 WeakPolarHBondContact OD2-CB 3.4Å; D268-E287 PolarHBondContact OD2-N 3.29Å; D268-E287 VanDerWaalsContact OD2-N 3.08Å; E287-H319 IonicContact OE2-ND1 3.54Å
288	G	65	Low	74.3	Confident	9 Å²	9	38.7 Å²	38.7	9%	0.093	20%	0.196	C	C	.	.			trans	97.7	22.2	164.2	0	0	0	0	0	115.7	T285 Y286 K322	T285-G288 PolarHBondContact O-N 2.83Å; Y286-G288 PolarHBondContact O-N 3.35Å; G288-K322 WeakPolarHBondContact O-CD 3.45Å; G288-K322 VanDerWaalsContact O-CE 3.26Å; G288-K322 WeakPolarHBondContact O-CE 3.39Å; G288-K322 PolarHBondContact O-NZ 2.91Å
289	H	70.6	Confident	73.5	Confident	80 Å²	80	41.2 Å²	41.2	37%	0.37	20%	0.2	S	C	.	.			trans	-77.4	147.9	169	-51.9	92.9	0	0	0	110.8	D268 T285 Y291	D268-H289 IonicContact OD2-CE1 2.68Å; D268-H289 IonicContact OD2-CG 2.69Å; D268-H289 IonicContact OD2-ND1 3.69Å; D268-H289 PolarHBondContact OD2-ND1 2.95Å; T285-H289 PolarHBondContact N-O 3.02Å; T285-H289 VanDerWaalsContact N-O 3.1Å; T285-H289 VanDerWaalsContact OG1-CA 3.3Å; T285-H289 WeakPolarHBondContact OG1-CA 3.35Å; T285-H289 VanDerWaalsContact OG1-CB 3.32Å; T285-H289 WeakPolarHBondContact OG1-CB 3.43Å; T285-H289 PolarHBondContact OG1-N 2.83Å; T285-H289 PolarHBondContact OG1-O 2.77Å; H289-Y291 HydrophobicContact CB-CD2 4.34Å; H289-Y291 HydrophobicContact CB-CE2 3.54Å
290	L	74.7	Confident	72.5	Confident	18 Å²	18	38.7 Å²	38.7	9%	0.094	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.7	173.4	-177.3	65.8	0	0	0	108.6	L282 L283 I324 L349	L282-L290 HydrophobicContact CB-CD1 4.19Å; L283-L290 WeakPolarHBondContact O-CA 3.16Å; L290-I324 HydrophobicContact CD1-CD1 4Å; L290-I324 HydrophobicContact CD1-CG1 4.27Å; L290-L349 HydrophobicContact CB-CD1 4.11Å; L290-L349 HydrophobicContact CD1-CD1 4.44Å; L290-L349 HydrophobicContact CD1-CD2 4.05Å; L290-L349 HydrophobicContact CD2-CD1 4.36Å
291	Y	76.3	Confident	71.2	Confident	27 Å²	27	42.5 Å²	42.5	11%	0.106	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	152.6	177.4	-63.3	-82.5	0	0	0	110.8	V265 L282 L283 T285 H289 L302 N304	V265-Y291 HydrophobicContact CG1-CE2 3.6Å; V265-Y291 HydrophobicContact CG2-CE2 4.28Å; L282-Y291 CarbonylContact C-O 3.57Å; L282-Y291 VanDerWaalsContact CA-O 3.32Å; L282-Y291 WeakPolarHBondContact CA-O 3.35Å; L283-Y291 PolarHBondContact N-O 3.41Å; L283-Y291 PolarHBondContact O-N 3.48Å; T285-Y291 HydrophobicContact CG2-CD2 3.84Å; T285-Y291 HydrophobicContact CG2-CE2 3.69Å; H289-Y291 HydrophobicContact CB-CD2 4.34Å; H289-Y291 HydrophobicContact CB-CE2 3.54Å; Y291-L302 HydrophobicContact CD1-CD2 3.65Å; Y291-L302 HydrophobicContact CE1-CD2 4.42Å; Y291-L302 HydrophobicContact CG-CD2 3.78Å; Y291-N304 WeakPolarHBondContact CD1-OD1 3.22Å; Y291-N304 WeakPolarHBondContact CE1-OD1 3.43Å
292	V	78.1	Confident	69.7	Low	9 Å²	9	45.1 Å²	45.1	6%	0.055	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.5	172.5	-173.1	0	0	0	0	109.3	H280 L281 L282 S303 V305 F368	H280-V292 HydrophobicContact CB-CG1 3.88Å; L281-V292 WeakPolarHBondContact O-CA 3.45Å; L282-V292 HydrophobicContact CD2-CB 4.46Å; L282-V292 HydrophobicContact CD2-CG1 4.47Å; L282-V292 HydrophobicContact CD2-CG2 3.52Å; V292-S303 VanDerWaalsContact O-O 3.11Å; V292-S303 PolarHBondContact O-OG 2.71Å; V292-V305 HydrophobicContact CB-CG2 3.53Å; V292-V305 HydrophobicContact CG2-CB 4.34Å; V292-V305 HydrophobicContact CG2-CG2 3.39Å; V292-F368 HydrophobicContact CG2-CE2 3.64Å; V292-F368 HydrophobicContact CG2-CZ 4.03Å
293	Y	76.4	Confident	68.2	Low	6 Å²	6	48 Å²	48	2%	0.024	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.4	174.1	-74.1	-90.4	0	0	0	109.9	I241 H280 L281 L283 M300 L302	I241-Y293 HydrophobicContact CD1-CD2 3.86Å; I241-Y293 HydrophobicContact CD1-CE1 4.39Å; I241-Y293 HydrophobicContact CD1-CE2 3.54Å; I241-Y293 HydrophobicContact CD1-CG 4.4Å; H280-Y293 CarbonylContact C-O 3.49Å; H280-Y293 WeakPolarHBondContact CA-O 3.17Å; L281-Y293 PolarHBondContact N-O 3.46Å; L281-Y293 PolarHBondContact O-N 3.44Å; L283-Y293 HydrophobicContact CB-CD2 4.14Å; L283-Y293 HydrophobicContact CB-CE2 3.78Å; L283-Y293 HydrophobicContact CD2-CE2 3.7Å; L283-Y293 HydrophobicContact CG-CE2 4.35Å; Y293-M300 HydrophobicContact CD1-CB 4.11Å; Y293-M300 WeakPolarHBondContact CD1-O 3.33Å; Y293-M300 HydrophobicContact CE1-CB 4.47Å; Y293-M300 VanDerWaalsContact CE1-O 3.25Å; Y293-M300 WeakPolarHBondContact CE1-O 3.32Å; Y293-L302 HydrophobicContact CD1-CD2 4.46Å; Y293-L302 HydrophobicContact CD2-CD2 4.42Å; Y293-L302 HydrophobicContact CE1-CD2 3.69Å; Y293-L302 HydrophobicContact CE1-CG 3.65Å; Y293-L302 HydrophobicContact CE2-CD2 3.61Å; Y293-L302 HydrophobicContact CE2-CG 4.46Å; Y293-L302 WeakPolarHBondContact OH-CD2 3.22Å; Y293-L302 WeakPolarHBondContact OH-CG 3.3Å
294	D	76.6	Confident	66.7	Low	37 Å²	37	52.9 Å²	52.9	20%	0.198	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	110.9	163.1	-172.3	-13.7	0	0	0	109.5	N279 R296 N297	N279-D294 WeakPolarHBondContact O-CA 3.34Å; D294-R296 PolarHBondContact O-N 2.92Å; D294-R296 WeakPolarHBondContact OD1-CB 3.08Å; D294-R296 WeakPolarHBondContact OD1-CG 2.96Å; D294-R296 IonicContact OD1-CZ 2.76Å; D294-R296 PolarHBondContact OD1-N 2.87Å; D294-R296 IonicContact OD1-NE 3.78Å; D294-R296 PolarHBondContact OD1-NE 3.13Å; D294-R296 IonicContact OD1-NH2 2.73Å; D294-R296 IonicContact OD2-CZ 2.86Å; D294-R296 VanDerWaalsContact OD2-CZ 3.31Å; D294-R296 IonicContact OD2-NE 3.73Å; D294-R296 PolarHBondContact OD2-NE 2.96Å; D294-R296 VanDerWaalsContact OD2-NE 3.13Å; D294-R296 IonicContact OD2-NH2 3.75Å; D294-R296 PolarHBondContact OD2-NH2 2.89Å; D294-N297 WeakPolarHBondContact O-CB 3.39Å; D294-N297 PolarHBondContact O-N 2.95Å; D294-N297 VanDerWaalsContact O-N 3.12Å
295	I	75.9	Confident	65.3	Low	25 Å²	25	54.1 Å²	54.1	13%	0.128	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-15.2	-177.6	68.6	162.5	0	0	0	112.7	L228 L243 W275 P278 N279 L281 N297 M300	L228-I295 HydrophobicContact CD2-CD1 3.87Å; L243-I295 HydrophobicContact CD1-CB 4.01Å; L243-I295 HydrophobicContact CD1-CD1 4.31Å; L243-I295 HydrophobicContact CD1-CG2 3.94Å; W275-I295 HydrophobicContact CH2-CD1 3.94Å; W275-I295 HydrophobicContact CH2-CG2 3.93Å; W275-I295 HydrophobicContact CZ3-CD1 3.96Å; W275-I295 HydrophobicContact CZ3-CG2 3.89Å; P278-I295 WeakPolarHBondContact O-CD1 3.42Å; N279-I295 WeakPolarHBondContact O-CG1 3.37Å; N279-I295 PolarHBondContact O-N 3.49Å; L281-I295 HydrophobicContact CB-CG2 4.34Å; I295-N297 PolarHBondContact O-N 3.36Å; I295-M300 HydrophobicContact CB-CE 4.11Å; I295-M300 HydrophobicContact CG2-CE 3.93Å
296	R	72.8	Confident	63.5	Low	152 Å²	152	59.8 Å²	59.8	57%	0.574	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-20	175.5	-57.2	171.8	-66.5	-178.4	1	111.3	N279 D294 P298	N279-R296 HydrophobicContact CB-CG 4.26Å; D294-R296 PolarHBondContact O-N 2.92Å; D294-R296 WeakPolarHBondContact OD1-CB 3.08Å; D294-R296 WeakPolarHBondContact OD1-CG 2.96Å; D294-R296 IonicContact OD1-CZ 2.76Å; D294-R296 PolarHBondContact OD1-N 2.87Å; D294-R296 IonicContact OD1-NE 3.78Å; D294-R296 PolarHBondContact OD1-NE 3.13Å; D294-R296 IonicContact OD1-NH2 2.73Å; D294-R296 IonicContact OD2-CZ 2.86Å; D294-R296 VanDerWaalsContact OD2-CZ 3.31Å; D294-R296 IonicContact OD2-NE 3.73Å; D294-R296 PolarHBondContact OD2-NE 2.96Å; D294-R296 VanDerWaalsContact OD2-NE 3.13Å; D294-R296 IonicContact OD2-NH2 3.75Å; D294-R296 PolarHBondContact OD2-NH2 2.89Å; R296-P298 VanDerWaalsContact O-CD 3.24Å; R296-P298 WeakPolarHBondContact O-CD 3.43Å
297	N	70.8	Confident	62.2	Low	52 Å²	52	59.6 Å²	59.6	28%	0.278	31%	0.305	S	S	.	.	S	Bend	trans	-74.7	112	170.8	-174.6	-10.7	0	0	0	108.5	D294 I295 K299 M300	D294-N297 WeakPolarHBondContact O-CB 3.39Å; D294-N297 PolarHBondContact O-N 2.95Å; D294-N297 VanDerWaalsContact O-N 3.12Å; I295-N297 PolarHBondContact O-N 3.36Å; N297-K299 PolarHBondContact O-N 2.92Å; N297-K299 PolarHBondContact OD1-N 2.68Å; N297-M300 PolarHBondContact O-N 2.77Å
298	P	54.7	Low	60.7	Low	114 Å²	114	59.9 Å²	59.9	74%	0.74	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.9	-173.9	25.2	-34.6	0	0	0	113.7	R296	R296-P298 VanDerWaalsContact O-CD 3.24Å; R296-P298 WeakPolarHBondContact O-CD 3.43Å
299	K	59.8	Low	59.5	Low	127 Å²	127	63 Å²	63	55%	0.552	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-9.3	174.2	-64.7	-176.2	176.1	176.3	0	114	N297 E301	N297-K299 PolarHBondContact O-N 2.92Å; N297-K299 PolarHBondContact OD1-N 2.68Å; K299-E301 HydrophobicContact CB-CG 3.78Å; K299-E301 HydrophobicContact CD-CG 4.09Å; K299-E301 WeakPolarHBondContact CD-OE1 3.4Å; K299-E301 IonicContact NZ-OE1 3Å; K299-E301 PolarHBondContact NZ-OE1 2.68Å; K299-E301 PolarHBondContact O-N 3.39Å
300	M	57.3	Low	57.6	Low	7 Å²	7	63.4 Å²	63.4	3%	0.034	34%	0.344	C	S	.	.			trans	46.7	41.9	-167.5	-64.8	-165.4	157.8	0	0	111.9	L243 I257 Y293 I295 N297 L302	L243-M300 HydrophobicContact CD1-CE 3.34Å; L243-M300 HydrophobicContact CD2-CE 4.43Å; L243-M300 HydrophobicContact CG-CE 3.72Å; I257-M300 HydrophobicContact CB-CE 4.44Å; I257-M300 HydrophobicContact CG2-CE 3.92Å; I257-M300 HydrophobicContact CG2-SD 4.3Å; Y293-M300 HydrophobicContact CD1-CB 4.11Å; Y293-M300 WeakPolarHBondContact CD1-O 3.33Å; Y293-M300 HydrophobicContact CE1-CB 4.47Å; Y293-M300 VanDerWaalsContact CE1-O 3.25Å; Y293-M300 WeakPolarHBondContact CE1-O 3.32Å; I295-M300 HydrophobicContact CB-CE 4.11Å; I295-M300 HydrophobicContact CG2-CE 3.93Å; N297-M300 PolarHBondContact O-N 2.77Å; M300-L302 PolarHBondContact O-N 3.1Å
301	E	52	Low	55.2	Low	109 Å²	109	69.7 Å²	69.7	51%	0.509	38%	0.378	S	S	.	.			trans	-67.4	128.3	176.9	-77.3	172.4	178.6	0	0	109	K299 S303	K299-E301 HydrophobicContact CB-CG 3.78Å; K299-E301 HydrophobicContact CD-CG 4.09Å; K299-E301 WeakPolarHBondContact CD-OE1 3.4Å; K299-E301 IonicContact NZ-OE1 3Å; K299-E301 PolarHBondContact NZ-OE1 2.68Å; K299-E301 PolarHBondContact O-N 3.39Å; E301-S303 PolarHBondContact O-N 3.3Å; E301-S303 VanDerWaalsContact O-N 3.13Å
302	L	52.3	Low	52.8	Low	56 Å²	56	76.3 Å²	76.3	29%	0.293	41%	0.409	S	S	.	.			trans	-56.9	109.9	-179.4	-82	155	0	0	0	111	N264 V265 Y291 Y293 M300 N304	N264-L302 HydrophobicContact CB-CD1 4.36Å; V265-L302 HydrophobicContact CG2-CD1 3.85Å; Y291-L302 HydrophobicContact CD1-CD2 3.65Å; Y291-L302 HydrophobicContact CE1-CD2 4.42Å; Y291-L302 HydrophobicContact CG-CD2 3.78Å; Y293-L302 HydrophobicContact CD1-CD2 4.46Å; Y293-L302 HydrophobicContact CD2-CD2 4.42Å; Y293-L302 HydrophobicContact CE1-CD2 3.69Å; Y293-L302 HydrophobicContact CE1-CG 3.65Å; Y293-L302 HydrophobicContact CE2-CD2 3.61Å; Y293-L302 HydrophobicContact CE2-CG 4.46Å; Y293-L302 WeakPolarHBondContact OH-CD2 3.22Å; Y293-L302 WeakPolarHBondContact OH-CG 3.3Å; M300-L302 PolarHBondContact O-N 3.1Å; L302-N304 PolarHBondContact O-N 2.8Å
303	S	49.8	Very low	50.5	Low	59 Å²	59	82.5 Å²	82.5	41%	0.413	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-82.6	106	155.6	46.1	0	0	0	0	107.5	V292 E301 V305	V292-S303 VanDerWaalsContact O-O 3.11Å; V292-S303 PolarHBondContact O-OG 2.71Å; E301-S303 PolarHBondContact O-N 3.3Å; E301-S303 VanDerWaalsContact O-N 3.13Å; S303-V305 PolarHBondContact O-N 2.84Å
304	N	49.4	Very low	48.6	Very low	103 Å²	103	87.3 Å²	87.3	55%	0.551	47%	0.468	S	S	*	.			trans	-63.4	125.2	169	-155.5	28.4	0	0	0	106.9	Y291 L302 D306	Y291-N304 WeakPolarHBondContact CD1-OD1 3.22Å; Y291-N304 WeakPolarHBondContact CE1-OD1 3.43Å; L302-N304 PolarHBondContact O-N 2.8Å; N304-D306 PolarHBondContact O-N 3.08Å
305	V	47.8	Very low	46.5	Very low	26 Å²	26	94.6 Å²	94.6	16%	0.158	50%	0.499	C	S	.	.			trans	-84.3	118.6	174	-177	0	0	0	0	107	V292 S303 V307 D366 F368	V292-V305 HydrophobicContact CB-CG2 3.53Å; V292-V305 HydrophobicContact CG2-CB 4.34Å; V292-V305 HydrophobicContact CG2-CG2 3.39Å; S303-V305 PolarHBondContact O-N 2.84Å; V305-V307 PolarHBondContact O-N 2.72Å; V305-D366 WeakPolarHBondContact CG1-O 3.49Å; V305-F368 HydrophobicContact CB-CD2 4.14Å; V305-F368 HydrophobicContact CB-CE2 4.15Å; V305-F368 HydrophobicContact CG1-CD2 3.49Å; V305-F368 VanDerWaalsContact CG1-CD2 3.49Å; V305-F368 HydrophobicContact CG1-CE2 3.73Å; V305-F368 HydrophobicContact CG2-CE2 4.18Å
306	D	39.1	Very low	44.6	Very low	119 Å²	119	94.7 Å²	94.7	64%	0.636	50%	0.501	S	S	*	.			trans	-64.6	101.5	170	-77.8	-29	0	0	0	107.3	N304 T308 M367	N304-D306 PolarHBondContact O-N 3.08Å; D306-T308 PolarHBondContact O-N 3.08Å; D306-M367 VanDerWaalsContact O-CE 3.23Å; D306-M367 WeakPolarHBondContact O-CE 3.37Å
307	V	42.6	Very low	42.9	Very low	44 Å²	44	93 Å²	93	27%	0.267	51%	0.512	S	S	.	.			trans	-74.5	100.6	167.5	-177.9	0	0	0	0	105.8	V305 D309 Y359 F368	V305-V307 PolarHBondContact O-N 2.72Å; V307-D309 PolarHBondContact O-N 2.77Å; V307-D309 VanDerWaalsContact O-N 3.16Å; V307-Y359 HydrophobicContact CG1-CD1 4.12Å; V307-Y359 HydrophobicContact CG1-CE1 4Å; V307-F368 HydrophobicContact CG1-CB 4.47Å; V307-F368 WeakPolarHBondContact CG1-O 3.44Å; V307-F368 HydrophobicContact CG2-CB 4.3Å
308	T	33.9	Very low	41.3	Very low	78 Å²	78	91.7 Å²	91.7	48%	0.479	51%	0.508	S	S	.	.			trans	-77.7	101.8	174.7	45.8	0	0	0	0	109.3	D306 M367	D306-T308 PolarHBondContact O-N 3.08Å; T308-M367 HydrophobicContact CG2-CE 3.26Å; T308-M367 WeakPolarHBondContact OG1-CE 3.22Å
309	D	39	Very low	40.6	Very low	76 Å²	76	92.5 Å²	92.5	41%	0.406	50%	0.501	S	S	.	.			trans	-147.6	146.6	144.5	-104.6	-37.6	0	0	0	111	V307 T369 H370	V307-D309 PolarHBondContact O-N 2.77Å; V307-D309 VanDerWaalsContact O-N 3.16Å; D309-T369 VanDerWaalsContact OD2-CG2 3.31Å; D309-T369 WeakPolarHBondContact OD2-CG2 3.23Å; D309-H370 PolarHBondContact OD2-N 2.67Å
310	A	30	Very low	40.1	Very low	88 Å²	88	92.5 Å²	92.5	73%	0.727	50%	0.498	S	S	*	.	S	Bend	trans	-60.2	129.3	-154.4	0	0	0	0	0	116
311	N	24.2	Very low	39.8	Very low	150 Å²	150	93.5 Å²	93.5	80%	0.802	51%	0.505	S	S	*	.	S	Bend	trans	61.4	127.7	168	-68.5	-24.1	0	0	0	116.1
312	E	26.1	Very low	40.1	Very low	166 Å²	166	88.8 Å²	88.8	78%	0.776	48%	0.483	S	S	*	.	S	Bend	trans	81.5	107.2	179.6	-49.1	-169	176	0	0	113.4	F314	E312-F314 PolarHBondContact O-N 2.84Å
313	T	30	Very low	40.6	Very low	138 Å²	138	88.6 Å²	88.6	85%	0.847	48%	0.481	S	S	*	.			trans	-33.6	105.8	147.7	41.6	0	0	0	0	108.6	K315	T313-K315 VanDerWaalsContact C-N 3.32Å; T313-K315 PolarHBondContact O-N 2.93Å
314	F	37.4	Very low	41.1	Very low	107 Å²	107	86.2 Å²	86.2	47%	0.469	46%	0.463	S	S	.	.			trans	-56.2	91.9	-171.3	-87.5	-98	0	0	0	110.6	E312 S316	E312-F314 PolarHBondContact O-N 2.84Å; F314-S316 PolarHBondContact O-N 2.9Å
315	K	32.6	Very low	41.5	Very low	191 Å²	191	82.9 Å²	82.9	83%	0.83	45%	0.447	S	S	*	.			trans	-76.5	98.5	153.1	-78.4	-177.7	177.5	178.9	0	104.9	T313 S317	T313-K315 VanDerWaalsContact C-N 3.32Å; T313-K315 PolarHBondContact O-N 2.93Å; K315-S317 PolarHBondContact O-N 3.24Å; K315-S317 VanDerWaalsContact O-N 3.14Å
316	S	35.7	Very low	42.3	Very low	27 Å²	27	83.9 Å²	83.9	19%	0.189	45%	0.449	C	S	.	.			trans	-44.3	124.9	156.9	172.3	0	0	0	0	107.3	F314 S318 Q351	F314-S316 PolarHBondContact O-N 2.9Å; S316-S318 WeakPolarHBondContact CB-O 3.47Å; S316-S318 PolarHBondContact O-N 2.77Å; S316-S318 VanDerWaalsContact O-N 3.08Å; S316-S318 PolarHBondContact OG-N 3.2Å; S316-S318 PolarHBondContact OG-O 2.75Å; S316-Q351 PolarHBondContact OG-NE2 2.93Å
317	S	35.8	Very low	43.3	Very low	115 Å²	115	79.1 Å²	79.1	80%	0.804	42%	0.424	S	S	*	.	S	Bend	trans	-64.7	-7.6	174.4	55.2	0	0	0	0	112.2	K315	K315-S317 PolarHBondContact O-N 3.24Å; K315-S317 VanDerWaalsContact O-N 3.14Å
318	S	38.4	Very low	44.3	Very low	25 Å²	25	78.1 Å²	78.1	18%	0.175	42%	0.417	C	S	.	.	S	Bend	trans	-115.3	113.9	179	156.5	0	0	0	0	109.5	S316 Q351 N353	S316-S318 WeakPolarHBondContact CB-O 3.47Å; S316-S318 PolarHBondContact O-N 2.77Å; S316-S318 VanDerWaalsContact O-N 3.08Å; S316-S318 PolarHBondContact OG-N 3.2Å; S316-S318 PolarHBondContact OG-O 2.75Å; S318-Q351 PolarHBondContact OG-OE1 2.82Å; S318-N353 PolarHBondContact OG-ND2 2.82Å
319	H	38.8	Very low	45.6	Very low	132 Å²	132	76.3 Å²	76.3	61%	0.611	41%	0.406	S	S	*	.			trans	-71	134.3	169.2	-54.2	-63.2	0	0	0	108.5	E287	E287-H319 IonicContact OE2-ND1 3.54Å
320	R	50.6	Low	46.7	Very low	126 Å²	126	73.6 Å²	73.6	48%	0.475	39%	0.391	S	S	.	.	S	Bend	trans	111.4	138.7	153.8	-52.1	172.8	179.1	-167	3.3	118.9	Y286 I352	Y286-R320 HydrophobicContact CD1-CB 4.47Å; Y286-R320 HydrophobicContact CD1-CG 4.47Å; Y286-R320 HydrophobicContact CE1-CB 3.72Å; Y286-R320 HydrophobicContact CE1-CG 3.46Å; Y286-R320 VanDerWaalsContact CE1-CG 3.46Å; Y286-R320 HydrophobicContact CE2-CB 3.94Å; Y286-R320 HydrophobicContact CE2-CG 4.44Å; Y286-R320 VanDerWaalsContact CZ-CB 3.41Å; Y286-R320 VanDerWaalsContact CZ-CG 3.43Å; Y286-R320 CarbonylContact O-C 3.29Å; Y286-R320 VanDerWaalsContact O-CA 3.25Å; Y286-R320 WeakPolarHBondContact O-CA 3.43Å; Y286-R320 WeakPolarHBondContact OH-CB 3.39Å; Y286-R320 WeakPolarHBondContact OH-CD 3.36Å; Y286-R320 WeakPolarHBondContact OH-CG 3.31Å; R320-I352 HydrophobicContact CB-CG2 4.01Å
321	C	50.5	Low	47.8	Very low	29 Å²	29	72.5 Å²	72.5	20%	0.196	37%	0.373	C	S	.	.			trans	23.6	115.9	-176.2	-149.2	0	0	0	0	119.4	T271 Y286 Q351 I352	T271-C321 WeakPolarHBondContact CG2-SG 3.03Å; Y286-C321 VanDerWaalsContact CD2-CA 3.48Å; Y286-C321 HydrophobicContact CD2-CB 3.51Å; Y286-C321 HydrophobicContact CE2-CB 3.71Å; Y286-C321 VanDerWaalsContact O-CA 3.31Å; Y286-C321 WeakPolarHBondContact O-CA 2.97Å; Y286-C321 PolarHBondContact O-N 2.92Å; C321-Q351 CarbonylContact O-C 3.6Å; C321-Q351 VanDerWaalsContact O-C 3.29Å; C321-Q351 WeakPolarHBondContact O-CA 3.38Å; C321-I352 HydrophobicContact CB-CB 3.84Å; C321-I352 HydrophobicContact CB-CD1 3.91Å; C321-I352 HydrophobicContact CB-CG1 4.23Å; C321-I352 PolarHBondContact O-N 2.78Å
322	K	57.7	Low	49.2	Very low	9 Å²	9	68.2 Å²	68.2	4%	0.039	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.7	160.8	-73.2	-172.6	-170	176.1	0	112.3	T271 T285 G288 L349 I350 Q351 D357	T271-K322 PolarHBondContact OG1-O 3.46Å; T285-K322 WeakPolarHBondContact O-CB 3.48Å; T285-K322 PolarHBondContact O-N 2.82Å; T285-K322 VanDerWaalsContact O-N 3.08Å; G288-K322 WeakPolarHBondContact O-CD 3.45Å; G288-K322 VanDerWaalsContact O-CE 3.26Å; G288-K322 WeakPolarHBondContact O-CE 3.39Å; G288-K322 PolarHBondContact O-NZ 2.91Å; K322-L349 HydrophobicContact CB-CB 4.47Å; K322-L349 HydrophobicContact CD-CB 3.84Å; K322-L349 HydrophobicContact CD-CD1 3.77Å; K322-L349 HydrophobicContact CD-CG 4.45Å; K322-L349 HydrophobicContact CG-CB 4.4Å; K322-I350 CarbonylContact C-O 3.6Å; K322-I350 WeakPolarHBondContact CA-O 3.34Å; K322-Q351 HydrophobicContact CD-CG 4.26Å; K322-Q351 HydrophobicContact CG-CG 3.66Å; K322-D357 WeakPolarHBondContact CE-OD2 3.14Å; K322-D357 IonicContact NZ-OD2 3.66Å; K322-D357 PolarHBondContact NZ-OD2 3.34Å
323	Q	63.3	Low	50.2	Low	53 Å²	53	64.4 Å²	64.4	25%	0.248	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129.3	162	-172	173.9	4.5	0	0	108.5	V325 L349 I350 P392	Q323-V325 HydrophobicContact CB-CG2 4.38Å; Q323-V325 HydrophobicContact CG-CG2 4.38Å; Q323-V325 WeakPolarHBondContact O-CG2 3.35Å; Q323-V325 PolarHBondContact O-N 2.82Å; Q323-L349 WeakPolarHBondContact O-CA 3.26Å; Q323-I350 PolarHBondContact N-O 2.68Å; Q323-I350 PolarHBondContact O-N 3.34Å; Q323-P392 PolarHBondContact OE1-O 2.7Å
324	I	59.6	Low	50.9	Low	8 Å²	8	66.3 Å²	66.3	4%	0.041	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	118.6	165.1	-59.3	164	0	0	0	106.5	A272 L282 G284 L290 I347 L349	A272-I324 HydrophobicContact CB-CB 4.27Å; A272-I324 HydrophobicContact CB-CG1 4.26Å; L282-I324 HydrophobicContact CB-CD1 3.62Å; L282-I324 HydrophobicContact CD1-CG2 4.5Å; G284-I324 VanDerWaalsContact N-CD1 3.29Å; L290-I324 HydrophobicContact CD1-CD1 4Å; L290-I324 HydrophobicContact CD1-CG1 4.27Å; I324-I347 HydrophobicContact CG2-CG2 4.3Å; I324-L349 HydrophobicContact CB-CD2 4.21Å; I324-L349 HydrophobicContact CG1-CD2 3.59Å; I324-L349 HydrophobicContact CG2-CD2 4.33Å
325	V	58.2	Low	51.1	Low	34 Å²	34	67.2 Å²	67.2	21%	0.206	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-46.4	-163.7	171.3	0	0	0	0	111.2	Q323 G348 I350 G394	Q323-V325 HydrophobicContact CB-CG2 4.38Å; Q323-V325 HydrophobicContact CG-CG2 4.38Å; Q323-V325 WeakPolarHBondContact O-CG2 3.35Å; Q323-V325 PolarHBondContact O-N 2.82Å; V325-G348 PolarHBondContact N-O 3.26Å; V325-I350 HydrophobicContact CB-CD1 4.14Å; V325-I350 HydrophobicContact CB-CG1 4.46Å; V325-I350 HydrophobicContact CG1-CD1 3.91Å; V325-I350 HydrophobicContact CG2-CB 3.55Å; V325-I350 HydrophobicContact CG2-CD1 3.43Å; V325-I350 VanDerWaalsContact CG2-CD1 3.43Å; V325-I350 HydrophobicContact CG2-CG1 3.53Å; V325-G394 VanDerWaalsContact CG1-C 3.44Å; V325-G394 WeakPolarHBondContact CG1-O 3.43Å
326	Q	64.8	Low	51.8	Low	46 Å²	46	60.2 Å²	60.2	22%	0.215	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	148.9	-178.4	-159.1	174	-9.8	0	0	109.9	G348 F396	Q326-G348 PolarHBondContact O-N 2.84Å; Q326-F396 HydrophobicContact CB-CD2 3.81Å; Q326-F396 PolarHBondContact NE2-O 3.27Å; Q326-F396 PolarHBondContact OE1-O 3.01Å
327	I	60.8	Low	52.1	Low	20 Å²	20	65.8 Å²	65.8	10%	0.103	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	115.5	168.2	-56.4	175.5	0	0	0	106.1	S274 W275 L276 L282 K345 Y346 I347	S274-I327 WeakPolarHBondContact OG-CD1 3.38Å; W275-I327 VanDerWaalsContact O-CD1 3.27Å; W275-I327 WeakPolarHBondContact O-CD1 3.32Å; L276-I327 HydrophobicContact CD1-CD1 4.22Å; L276-I327 HydrophobicContact CD1-CG2 4.24Å; L282-I327 HydrophobicContact CD1-CD1 3.54Å; L282-I327 HydrophobicContact CD1-CG1 4.16Å; L282-I327 HydrophobicContact CG-CD1 4.32Å; I327-K345 HydrophobicContact CG2-CB 4.43Å; I327-K345 HydrophobicContact CG2-CD 4.4Å; I327-Y346 CarbonylContact C-O 3.54Å; I327-Y346 WeakPolarHBondContact CA-O 3.33Å; I327-I347 HydrophobicContact CG1-CG1 4.26Å; I327-I347 HydrophobicContact CG2-CG1 4.39Å
328	L	63.7	Low	52.3	Low	22 Å²	22	66.7 Å²	66.7	12%	0.115	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.7	174.8	-93.3	-177.9	0	0	0	109.7	K345 Y346 F396 W408	L328-K345 CarbonylContact O-C 3.53Å; L328-K345 VanDerWaalsContact O-CA 3.25Å; L328-K345 WeakPolarHBondContact O-CA 3.46Å; L328-Y346 PolarHBondContact N-O 3.37Å; L328-Y346 PolarHBondContact O-N 2.9Å; L328-F396 HydrophobicContact CD1-CB 3.17Å; L328-F396 HydrophobicContact CD1-CD1 4.25Å; L328-F396 HydrophobicContact CD1-CG 4.03Å; L328-F396 HydrophobicContact CG-CB 3.76Å; L328-W408 HydrophobicContact CD1-CB 3.76Å
329	T	60.7	Low	52.6	Low	41 Å²	41	74 Å²	74	25%	0.252	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.3	167.3	-54	0	0	0	0	108.3	N213 K345	N213-T329 PolarHBondContact OD1-OG1 2.81Å; T329-K345 HydrophobicContact CG2-CG 4.16Å
330	H	61.6	Low	52.9	Low	18 Å²	18	69.9 Å²	69.9	8%	0.083	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.1	174.4	-175.2	66.1	0	0	0	109.4	Y332 T343 S344 Y346 S399	H330-Y332 AromaticContact CD2-CD2 3.93Å; H330-Y332 AromaticContact CD2-CE2 3.62Å; H330-Y332 AromaticContact CD2-CZ 3.82Å; H330-Y332 AromaticContact NE2-CE1 3.85Å; H330-Y332 AromaticContact NE2-CZ 3.83Å; H330-T343 WeakPolarHBondContact O-CA 3.28Å; H330-S344 PolarHBondContact N-O 3.26Å; H330-S344 PolarHBondContact O-N 2.57Å; H330-Y346 HydrophobicContact CB-CD2 4.21Å; H330-Y346 HydrophobicContact CB-CE2 3.89Å; H330-S399 PolarHBondContact CE1-OG 3.16Å; H330-S399 PolarHBondContact ND1-OG 3.24Å
331	N	54.3	Low	52.7	Low	65 Å²	65	66.6 Å²	66.6	35%	0.348	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.7	177.2	-68.8	-8.4	0	0	0	108.4	N215 T343	N215-N331 PolarHBondContact O-ND2 2.95Å; N331-T343 WeakPolarHBondContact OD1-CG2 3.29Å
332	Y	53	Low	52.8	Low	60 Å²	60	70.1 Å²	70.1	24%	0.235	38%	0.377	C	S	.	.			trans	-68.8	140.7	171.1	-79.5	-84.4	0	0	0	109.3	H330 K334 I340 N342	H330-Y332 AromaticContact CD2-CD2 3.93Å; H330-Y332 AromaticContact CD2-CE2 3.62Å; H330-Y332 AromaticContact CD2-CZ 3.82Å; H330-Y332 AromaticContact NE2-CE1 3.85Å; H330-Y332 AromaticContact NE2-CZ 3.83Å; Y332-K334 PolarHBondContact O-N 3.38Å; Y332-I340 HydrophobicContact CD2-CG2 3.76Å; Y332-I340 HydrophobicContact CE1-CD1 4.29Å; Y332-I340 HydrophobicContact CE2-CG2 3.61Å; Y332-I340 HydrophobicContact CG-CG2 4.49Å; Y332-N342 PolarHBondContact N-O 2.91Å
333	P	47.8	Very low	52.9	Low	87 Å²	87	72.2 Å²	72.2	57%	0.565	39%	0.391	S	S	*	.			trans	-56.9	131.2	172.9	-18.5	29.4	0	0	0	109	T335 S336	P333-T335 PolarHBondContact O-N 3.47Å; P333-S336 PolarHBondContact O-N 2.98Å; P333-S336 PolarHBondContact O-OG 3.31Å
334	K	43.3	Very low	53.1	Low	178 Å²	178	69.7 Å²	69.7	77%	0.774	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-8.9	-179.3	-77.6	-179	175.9	177.1	0	115.4	Y332	Y332-K334 PolarHBondContact O-N 3.38Å
335	T	42.9	Very low	53.8	Low	126 Å²	126	70.9 Å²	70.9	77%	0.773	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	2.4	179.8	55.3	0	0	0	0	114.2	P333 T337	P333-T335 PolarHBondContact O-N 3.47Å; T335-T337 PolarHBondContact O-N 3.31Å
336	S	45.5	Very low	54.5	Low	44 Å²	44	69.7 Å²	69.7	31%	0.308	38%	0.376	S	S	.	.			trans	-69.1	124.4	175.3	62.2	0	0	0	0	110.7	P333 E338	P333-S336 PolarHBondContact O-N 2.98Å; P333-S336 PolarHBondContact O-OG 3.31Å; S336-E338 PolarHBondContact O-N 3.49Å
337	T	43	Very low	55.1	Low	144 Å²	144	67.5 Å²	67.5	88%	0.883	37%	0.366	S	S	*	.			trans	-76	-2.8	179	47	0	0	0	0	114	T335	T335-T337 PolarHBondContact O-N 3.31Å
338	E	40.9	Very low	55.6	Low	133 Å²	133	66.6 Å²	66.6	62%	0.621	36%	0.361	S	S	*	.	S	Bend	trans	-91.4	133.2	174.8	-65.5	-174.5	165.9	0	0	108.9	S336 I340	S336-E338 PolarHBondContact O-N 3.49Å; E338-I340 HydrophobicContact CB-CD1 3.92Å; E338-I340 HydrophobicContact CB-CG1 3.85Å; E338-I340 PolarHBondContact O-N 2.91Å
339	N	43	Very low	56.1	Low	179 Å²	179	65.5 Å²	65.5	96%	0.957	36%	0.355	S	S	*	.			trans	-66.8	52.4	176.2	-81.6	-21.1	0	0	0	111.8
340	I	45	Very low	56.5	Low	46 Å²	46	63.6 Å²	63.6	24%	0.236	34%	0.344	C	S	.	.			trans	-84.9	132.3	174.9	-55.5	172.5	0	0	0	106.3	Y332 E338 N342	Y332-I340 HydrophobicContact CD2-CG2 3.76Å; Y332-I340 HydrophobicContact CE1-CD1 4.29Å; Y332-I340 HydrophobicContact CE2-CG2 3.61Å; Y332-I340 HydrophobicContact CG-CG2 4.49Å; E338-I340 HydrophobicContact CB-CD1 3.92Å; E338-I340 HydrophobicContact CB-CG1 3.85Å; E338-I340 PolarHBondContact O-N 2.91Å; I340-N342 PolarHBondContact O-N 3.47Å; I340-N342 VanDerWaalsContact O-N 3.13Å
341	P	47	Very low	56.8	Low	57 Å²	57	62.9 Å²	62.9	37%	0.37	34%	0.34	S	S	.	.			trans	-49.7	125.2	174.6	-22.9	31.1	0	0	0	109.5	T343	P341-T343 PolarHBondContact O-N 2.77Å
342	N	52.8	Low	57	Low	102 Å²	102	62.1 Å²	62.1	55%	0.545	34%	0.336	S	S	.	.	S	Bend	trans	-54.1	-16	-168.8	-84.9	-32.7	0	0	0	114.7	Y332 I340	Y332-N342 PolarHBondContact N-O 2.91Å; I340-N342 PolarHBondContact O-N 3.47Å; I340-N342 VanDerWaalsContact O-N 3.13Å
343	T	59.4	Low	57.3	Low	53 Å²	53	61.1 Å²	61.1	33%	0.325	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	123.8	176.6	56.4	0	0	0	0	109	H330 N331 P341 V363	H330-T343 WeakPolarHBondContact O-CA 3.28Å; N331-T343 WeakPolarHBondContact OD1-CG2 3.29Å; P341-T343 PolarHBondContact O-N 2.77Å; T343-V363 WeakPolarHBondContact O-CG2 3.38Å
344	S	67	Low	57.7	Low	1 Å²	1	57 Å²	57	1%	0.007	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.6	170.1	-71.2	0	0	0	0	109.2	H330 Q360	H330-S344 PolarHBondContact N-O 3.26Å; H330-S344 PolarHBondContact O-N 2.57Å; S344-Q360 PolarHBondContact OG-NE2 3.42Å
345	K	74.8	Confident	58.5	Low	32 Å²	32	48.6 Å²	48.6	14%	0.139	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.9	171.1	-67.7	-177	177.6	171.9	0	109.9	L276 I327 L328 T329 Q360 Q361	L276-K345 HydrophobicContact CD1-CD 4.15Å; L276-K345 PolarHBondContact O-NZ 3.28Å; I327-K345 HydrophobicContact CG2-CB 4.43Å; I327-K345 HydrophobicContact CG2-CD 4.4Å; L328-K345 CarbonylContact O-C 3.53Å; L328-K345 VanDerWaalsContact O-CA 3.25Å; L328-K345 WeakPolarHBondContact O-CA 3.46Å; T329-K345 HydrophobicContact CG2-CG 4.16Å; K345-Q360 CarbonylContact O-C 3.51Å; K345-Q360 WeakPolarHBondContact O-CA 3.43Å; K345-Q361 HydrophobicContact CB-CB 4.09Å; K345-Q361 PolarHBondContact O-N 2.73Å
346	Y	73.8	Confident	59.8	Low	10 Å²	10	42.6 Å²	42.6	4%	0.039	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.7	173.8	-64.2	-83.3	0	0	0	109.7	I327 L328 H330 V358 Y359 Q360 V371 P407 W408	I327-Y346 CarbonylContact C-O 3.54Å; I327-Y346 WeakPolarHBondContact CA-O 3.33Å; L328-Y346 PolarHBondContact N-O 3.37Å; L328-Y346 PolarHBondContact O-N 2.9Å; H330-Y346 HydrophobicContact CB-CD2 4.21Å; H330-Y346 HydrophobicContact CB-CE2 3.89Å; Y346-V358 HydrophobicContact CD1-CG1 4.31Å; Y346-Y359 CarbonylContact C-O 3.59Å; Y346-Y359 VanDerWaalsContact CA-O 3.28Å; Y346-Y359 WeakPolarHBondContact CA-O 3.41Å; Y346-Q360 HydrophobicContact CD1-CB 3.99Å; Y346-Q360 HydrophobicContact CD1-CG 4.24Å; Y346-Q360 HydrophobicContact CE1-CB 3.78Å; Y346-Q360 HydrophobicContact CE1-CG 3.76Å; Y346-V371 HydrophobicContact CD1-CG2 4.33Å; Y346-V371 HydrophobicContact CE1-CG2 4.38Å; Y346-P407 HydrophobicContact CE2-CB 3.79Å; Y346-P407 HydrophobicContact CE2-CG 4.29Å; Y346-W408 AromaticContact CD1-CD1 3.67Å; Y346-W408 AromaticContact CD1-NE1 3.34Å; Y346-W408 VanDerWaalsContact CD1-NE1 3.34Å; Y346-W408 AromaticContact CD2-CD1 3.66Å; Y346-W408 AromaticContact CE1-CD1 3.9Å; Y346-W408 AromaticContact CE1-NE1 3.52Å; Y346-W408 AromaticContact CE2-CD1 3.88Å; Y346-W408 AromaticContact CG-CD1 3.54Å; Y346-W408 AromaticContact CG-NE1 3.71Å
347	I	75.9	Confident	60.9	Low	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.9	179.2	-57.7	165.9	0	0	0	107.5	L276 L282 I324 I327 L349 V358 Y359 F368	L276-I347 HydrophobicContact CD1-CD1 3.99Å; L276-I347 HydrophobicContact CD1-CG1 4.5Å; L282-I347 HydrophobicContact CD1-CD1 3.63Å; L282-I347 HydrophobicContact CD1-CG1 4.11Å; L282-I347 HydrophobicContact CD1-CG2 3.93Å; L282-I347 HydrophobicContact CD2-CD1 4.41Å; I324-I347 HydrophobicContact CG2-CG2 4.3Å; I327-I347 HydrophobicContact CG1-CG1 4.26Å; I327-I347 HydrophobicContact CG2-CG1 4.39Å; I347-L349 HydrophobicContact CG2-CD2 4Å; I347-V358 WeakPolarHBondContact O-CA 3.31Å; I347-Y359 PolarHBondContact N-O 3.49Å; I347-Y359 PolarHBondContact O-N 3.18Å; I347-F368 HydrophobicContact CD1-CD1 3.69Å; I347-F368 HydrophobicContact CD1-CE1 3.15Å; I347-F368 HydrophobicContact CD1-CZ 3.93Å; I347-F368 HydrophobicContact CG1-CE1 4.48Å
348	G	72.5	Confident	62.3	Low	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.1	170.9	0	0	0	0	0	113.1	V325 Q326 D357 F396	V325-G348 PolarHBondContact N-O 3.26Å; Q326-G348 PolarHBondContact O-N 2.84Å; G348-D357 WeakPolarHBondContact CA-O 3.18Å; G348-F396 VanDerWaalsContact CA-CE2 3.46Å
349	L	72.9	Confident	63.9	Low	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	115.5	172	-49.8	-176.6	0	0	0	109.3	L290 K322 Q323 I324 I347 I356 D357 Y359	L290-L349 HydrophobicContact CB-CD1 4.11Å; L290-L349 HydrophobicContact CD1-CD1 4.44Å; L290-L349 HydrophobicContact CD1-CD2 4.05Å; L290-L349 HydrophobicContact CD2-CD1 4.36Å; K322-L349 HydrophobicContact CB-CB 4.47Å; K322-L349 HydrophobicContact CD-CB 3.84Å; K322-L349 HydrophobicContact CD-CD1 3.77Å; K322-L349 HydrophobicContact CD-CG 4.45Å; K322-L349 HydrophobicContact CG-CB 4.4Å; Q323-L349 WeakPolarHBondContact O-CA 3.26Å; I324-L349 HydrophobicContact CB-CD2 4.21Å; I324-L349 HydrophobicContact CG1-CD2 3.59Å; I324-L349 HydrophobicContact CG2-CD2 4.33Å; I347-L349 HydrophobicContact CG2-CD2 4Å; L349-I356 WeakPolarHBondContact O-CA 3.43Å; L349-I356 WeakPolarHBondContact O-CG1 3.27Å; L349-D357 HydrophobicContact CB-CB 4.44Å; L349-D357 PolarHBondContact N-O 3.28Å; L349-D357 PolarHBondContact O-N 2.94Å; L349-Y359 HydrophobicContact CD1-CD2 4.06Å; L349-Y359 HydrophobicContact CD1-CE2 3.42Å; L349-Y359 VanDerWaalsContact CD1-CE2 3.42Å; L349-Y359 HydrophobicContact CG-CD2 4.16Å; L349-Y359 HydrophobicContact CG-CE2 3.87Å
350	I	69.4	Low	65.5	Low	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.8	175.9	-70.7	171.1	0	0	0	109.2	K322 Q323 V325 S355 I356 P392 G394 L412	K322-I350 CarbonylContact C-O 3.6Å; K322-I350 WeakPolarHBondContact CA-O 3.34Å; Q323-I350 PolarHBondContact N-O 2.68Å; Q323-I350 PolarHBondContact O-N 3.34Å; V325-I350 HydrophobicContact CB-CD1 4.14Å; V325-I350 HydrophobicContact CB-CG1 4.46Å; V325-I350 HydrophobicContact CG1-CD1 3.91Å; V325-I350 HydrophobicContact CG2-CB 3.55Å; V325-I350 HydrophobicContact CG2-CD1 3.43Å; V325-I350 VanDerWaalsContact CG2-CD1 3.43Å; V325-I350 HydrophobicContact CG2-CG1 3.53Å; I350-S355 CarbonylContact C-O 3.58Å; I350-S355 WeakPolarHBondContact CA-O 3.2Å; I350-I356 HydrophobicContact CD1-CD1 4.14Å; I350-I356 HydrophobicContact CG1-CB 4.11Å; I350-I356 HydrophobicContact CG1-CD1 3.66Å; I350-I356 HydrophobicContact CG1-CG1 3.94Å; I350-P392 HydrophobicContact CG2-CB 3.72Å; I350-P392 HydrophobicContact CG2-CG 3.78Å; I350-G394 VanDerWaalsContact CD1-N 3.25Å; I350-L412 HydrophobicContact CD1-CD1 3.47Å; I350-L412 VanDerWaalsContact CD1-CD1 3.47Å; I350-L412 HydrophobicContact CG1-CD1 3.93Å; I350-L412 HydrophobicContact CG2-CD1 4.14Å
351	Q	67.7	Low	67	Low	3 Å²	3	20.3 Å²	20.3	1%	0.014	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	158.9	176.9	-65.2	-175.8	30	0	0	111.3	S316 S318 C321 K322 N353 G354 S355 D357 P392	S316-Q351 PolarHBondContact OG-NE2 2.93Å; S318-Q351 PolarHBondContact OG-OE1 2.82Å; C321-Q351 CarbonylContact O-C 3.6Å; C321-Q351 VanDerWaalsContact O-C 3.29Å; C321-Q351 WeakPolarHBondContact O-CA 3.38Å; K322-Q351 HydrophobicContact CD-CG 4.26Å; K322-Q351 HydrophobicContact CG-CG 3.66Å; Q351-N353 WeakPolarHBondContact CB-OD1 3.2Å; Q351-N353 PolarHBondContact O-N 3.25Å; Q351-N353 VanDerWaalsContact O-N 3.16Å; Q351-G354 WeakPolarHBondContact O-CA 3.46Å; Q351-G354 PolarHBondContact O-N 2.85Å; Q351-S355 VanDerWaalsContact CB-OG 3.22Å; Q351-S355 WeakPolarHBondContact CB-OG 3.36Å; Q351-S355 WeakPolarHBondContact CG-OG 3.38Å; Q351-S355 PolarHBondContact N-O 3.01Å; Q351-S355 PolarHBondContact NE2-OG 2.79Å; Q351-S355 PolarHBondContact OE1-OG 3.16Å; Q351-D357 PolarHBondContact NE2-OD2 2.69Å; Q351-P392 WeakPolarHBondContact O-CG 3.12Å
352	I	60.5	Low	68.1	Low	49 Å²	49	19.8 Å²	19.8	25%	0.251	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.4	-177.9	-145.8	167.5	0	0	0	113.5	R320 C321 G354	R320-I352 HydrophobicContact CB-CG2 4.01Å; C321-I352 HydrophobicContact CB-CB 3.84Å; C321-I352 HydrophobicContact CB-CD1 3.91Å; C321-I352 HydrophobicContact CB-CG1 4.23Å; C321-I352 PolarHBondContact O-N 2.78Å; I352-G354 PolarHBondContact O-N 2.82Å
353	N	57.9	Low	68.7	Low	38 Å²	38	18 Å²	18	20%	0.203	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-4.3	175.2	69.8	-11.4	0	0	0	112.6	S318 Q351 S355 R376	S318-N353 PolarHBondContact OG-ND2 2.82Å; Q351-N353 WeakPolarHBondContact CB-OD1 3.2Å; Q351-N353 PolarHBondContact O-N 3.25Å; Q351-N353 VanDerWaalsContact O-N 3.16Å; N353-S355 PolarHBondContact ND2-OG 2.82Å; N353-S355 WeakPolarHBondContact OD1-CB 3.31Å; N353-S355 PolarHBondContact OD1-N 3.34Å; N353-S355 PolarHBondContact OD1-OG 2.9Å; N353-R376 WeakPolarHBondContact O-CD 3.32Å
354	G	56.8	Low	69	Low	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	87.1	0.4	-176.1	0	0	0	0	0	114.8	Q351 I352 L412	Q351-G354 WeakPolarHBondContact O-CA 3.46Å; Q351-G354 PolarHBondContact O-N 2.85Å; I352-G354 PolarHBondContact O-N 2.82Å; G354-L412 VanDerWaalsContact O-CD2 3.23Å; G354-L412 WeakPolarHBondContact O-CD2 3.39Å
355	S	60.5	Low	68.9	Low	2 Å²	2	24.7 Å²	24.7	1%	0.014	14%	0.135	C	C	.	.			trans	-67.3	152.8	171.8	58.4	0	0	0	0	111.1	I350 Q351 N353 D374	I350-S355 CarbonylContact C-O 3.58Å; I350-S355 WeakPolarHBondContact CA-O 3.2Å; Q351-S355 VanDerWaalsContact CB-OG 3.22Å; Q351-S355 WeakPolarHBondContact CB-OG 3.36Å; Q351-S355 WeakPolarHBondContact CG-OG 3.38Å; Q351-S355 PolarHBondContact N-O 3.01Å; Q351-S355 PolarHBondContact NE2-OG 2.79Å; Q351-S355 PolarHBondContact OE1-OG 3.16Å; N353-S355 PolarHBondContact ND2-OG 2.82Å; N353-S355 WeakPolarHBondContact OD1-CB 3.31Å; N353-S355 PolarHBondContact OD1-N 3.34Å; N353-S355 PolarHBondContact OD1-OG 2.9Å; S355-D374 VanDerWaalsContact CA-O 3.23Å; S355-D374 WeakPolarHBondContact CA-O 3.37Å; S355-D374 WeakPolarHBondContact CB-O 3.29Å
356	I	69.4	Low	68.3	Low	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141.2	179.4	-175.8	161.7	0	0	0	111.7	L349 I350 V358 Y372 H373 D374 F396 L410	L349-I356 WeakPolarHBondContact O-CA 3.43Å; L349-I356 WeakPolarHBondContact O-CG1 3.27Å; I350-I356 HydrophobicContact CD1-CD1 4.14Å; I350-I356 HydrophobicContact CG1-CB 4.11Å; I350-I356 HydrophobicContact CG1-CD1 3.66Å; I350-I356 HydrophobicContact CG1-CG1 3.94Å; I356-V358 HydrophobicContact CD1-CG2 4.25Å; I356-V358 HydrophobicContact CG1-CG2 4.2Å; I356-Y372 HydrophobicContact CG2-CD1 4.33Å; I356-Y372 HydrophobicContact CG2-CE1 3.73Å; I356-H373 CarbonylContact O-C 3.56Å; I356-H373 VanDerWaalsContact O-CA 3.32Å; I356-H373 WeakPolarHBondContact O-CA 3.25Å; I356-H373 PolarHBondContact O-ND1 3.16Å; I356-D374 HydrophobicContact CG2-CB 3.61Å; I356-D374 PolarHBondContact N-O 2.85Å; I356-D374 PolarHBondContact O-N 3.23Å; I356-F396 HydrophobicContact CD1-CE2 4.21Å; I356-F396 HydrophobicContact CD1-CZ 3.83Å; I356-L410 HydrophobicContact CB-CD2 4.26Å; I356-L410 HydrophobicContact CD1-CD1 3.44Å; I356-L410 VanDerWaalsContact CD1-CD1 3.44Å; I356-L410 HydrophobicContact CD1-CD2 3.31Å; I356-L410 HydrophobicContact CD1-CG 3.98Å; I356-L410 HydrophobicContact CG1-CD2 4.21Å; I356-L410 HydrophobicContact CG2-CD2 3.62Å
357	D	68.5	Low	68	Low	9 Å²	9	28.3 Å²	28.3	5%	0.048	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.1	165.7	-56.5	-47.7	0	0	0	109	K322 G348 L349 Q351 Y359 Y372 H373	K322-D357 WeakPolarHBondContact CE-OD2 3.14Å; K322-D357 IonicContact NZ-OD2 3.66Å; K322-D357 PolarHBondContact NZ-OD2 3.34Å; G348-D357 WeakPolarHBondContact CA-O 3.18Å; L349-D357 HydrophobicContact CB-CB 4.44Å; L349-D357 PolarHBondContact N-O 3.28Å; L349-D357 PolarHBondContact O-N 2.94Å; Q351-D357 PolarHBondContact NE2-OD2 2.69Å; D357-Y359 HydrophobicContact CB-CD2 4.44Å; D357-Y359 HydrophobicContact CB-CE2 3.54Å; D357-Y372 CarbonylContact C-O 3.56Å; D357-Y372 WeakPolarHBondContact CA-O 3.46Å; D357-H373 IonicContact OD1-CE1 3.33Å; D357-H373 IonicContact OD1-CG 2.8Å; D357-H373 IonicContact OD1-ND1 3.58Å; D357-H373 PolarHBondContact OD1-ND1 3.16Å
358	V	72.5	Confident	67.8	Low	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.7	173	-171.6	0	0	0	0	109.7	Y346 I347 I356 V371 Y372 F396 W408	Y346-V358 HydrophobicContact CD1-CG1 4.31Å; I347-V358 WeakPolarHBondContact O-CA 3.31Å; I356-V358 HydrophobicContact CD1-CG2 4.25Å; I356-V358 HydrophobicContact CG1-CG2 4.2Å; V358-V371 HydrophobicContact CB-CG2 4.07Å; V358-V371 HydrophobicContact CG1-CG2 3.86Å; V358-V371 VanDerWaalsContact O-CG2 3.29Å; V358-V371 WeakPolarHBondContact O-CG2 3.03Å; V358-V371 PolarHBondContact O-N 3.48Å; V358-Y372 HydrophobicContact CG2-CD1 3.88Å; V358-Y372 PolarHBondContact N-O 3.47Å; V358-Y372 PolarHBondContact O-N 2.89Å; V358-F396 HydrophobicContact CG1-CE1 3.99Å; V358-F396 HydrophobicContact CG1-CZ 4.34Å; V358-F396 HydrophobicContact CG2-CE1 3.81Å; V358-F396 HydrophobicContact CG2-CZ 3.79Å; V358-W408 HydrophobicContact CB-CH2 4.33Å; V358-W408 HydrophobicContact CB-CZ2 4.11Å; V358-W408 HydrophobicContact CG1-CH2 4.36Å; V358-W408 HydrophobicContact CG1-CZ2 3.78Å; V358-W408 HydrophobicContact CG2-CH2 3.8Å; V358-W408 HydrophobicContact CG2-CZ2 4.07Å; V358-W408 HydrophobicContact CG2-CZ3 4.41Å
359	Y	73.9	Confident	67.8	Low	14 Å²	14	30.9 Å²	30.9	6%	0.055	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.7	177.7	-58.7	-89.6	0	0	0	109.8	V307 Y346 I347 L349 D357 F368 T369 H370	V307-Y359 HydrophobicContact CG1-CD1 4.12Å; V307-Y359 HydrophobicContact CG1-CE1 4Å; Y346-Y359 CarbonylContact C-O 3.59Å; Y346-Y359 VanDerWaalsContact CA-O 3.28Å; Y346-Y359 WeakPolarHBondContact CA-O 3.41Å; I347-Y359 PolarHBondContact N-O 3.49Å; I347-Y359 PolarHBondContact O-N 3.18Å; L349-Y359 HydrophobicContact CD1-CD2 4.06Å; L349-Y359 HydrophobicContact CD1-CE2 3.42Å; L349-Y359 VanDerWaalsContact CD1-CE2 3.42Å; L349-Y359 HydrophobicContact CG-CD2 4.16Å; L349-Y359 HydrophobicContact CG-CE2 3.87Å; D357-Y359 HydrophobicContact CB-CD2 4.44Å; D357-Y359 HydrophobicContact CB-CE2 3.54Å; Y359-F368 HydrophobicContact CD1-CB 4.48Å; Y359-T369 CarbonylContact C-O 3.57Å; Y359-T369 VanDerWaalsContact CA-O 3.28Å; Y359-T369 WeakPolarHBondContact CA-O 3.41Å; Y359-H370 HydrophobicContact CD1-CB 4.1Å; Y359-H370 HydrophobicContact CE1-CB 3.98Å; Y359-H370 AromaticContact CE1-CD2 3.8Å
360	Q	77.3	Confident	67.8	Low	49 Å²	49	32.9 Å²	32.9	23%	0.229	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.9	169.2	-177.4	174.9	-9.4	0	0	108.8	S344 K345 Y346 F368 T369 V371	S344-Q360 PolarHBondContact OG-NE2 3.42Å; K345-Q360 CarbonylContact O-C 3.51Å; K345-Q360 WeakPolarHBondContact O-CA 3.43Å; Y346-Q360 HydrophobicContact CD1-CB 3.99Å; Y346-Q360 HydrophobicContact CD1-CG 4.24Å; Y346-Q360 HydrophobicContact CE1-CB 3.78Å; Y346-Q360 HydrophobicContact CE1-CG 3.76Å; Q360-F368 CarbonylContact O-C 3.54Å; Q360-F368 WeakPolarHBondContact O-CA 3.1Å; Q360-T369 PolarHBondContact N-O 3.27Å; Q360-T369 PolarHBondContact O-N 2.91Å; Q360-V371 HydrophobicContact CB-CG1 3.67Å; Q360-V371 HydrophobicContact CB-CG2 4.33Å
361	Q	75.6	Confident	67.8	Low	6 Å²	6	35.5 Å²	35.5	3%	0.028	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.4	170.9	-167.8	-172.3	5.4	0	0	109.8	K345 V363 D366 M367 F368	K345-Q361 HydrophobicContact CB-CB 4.09Å; K345-Q361 PolarHBondContact O-N 2.73Å; Q361-V363 PolarHBondContact O-N 2.86Å; Q361-D366 PolarHBondContact NE2-OD1 3.13Å; Q361-M367 WeakPolarHBondContact CA-O 3.14Å; Q361-F368 HydrophobicContact CB-CD1 3.78Å; Q361-F368 HydrophobicContact CB-CE1 3.57Å; Q361-F368 HydrophobicContact CG-CD1 4.03Å; Q361-F368 HydrophobicContact CG-CE1 3.56Å; Q361-F368 HydrophobicContact CG-CZ 4.13Å
362	D	70.4	Confident	67.7	Low	46 Å²	46	36.9 Å²	36.9	25%	0.246	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	108.2	160	-172.3	-13.2	0	0	0	109	S364 N365 D366 M367	D362-S364 PolarHBondContact O-N 2.68Å; D362-S364 VanDerWaalsContact O-N 3.12Å; D362-S364 WeakPolarHBondContact OD1-CB 3.37Å; D362-S364 PolarHBondContact OD1-N 3.42Å; D362-S364 PolarHBondContact OD1-OG 2.64Å; D362-S364 PolarHBondContact OD2-OG 2.78Å; D362-N365 PolarHBondContact O-N 3.1Å; D362-D366 PolarHBondContact O-N 2.96Å; D362-M367 PolarHBondContact N-O 2.8Å
363	V	65.2	Low	68	Low	64 Å²	64	38.5 Å²	38.5	39%	0.388	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.7	-177.4	-177	0	0	0	0	112.1	T343 Q361	T343-V363 WeakPolarHBondContact O-CG2 3.38Å; Q361-V363 PolarHBondContact O-N 2.86Å
364	S	65.5	Low	68.3	Low	80 Å²	80	37.8 Å²	37.8	56%	0.559	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-33.5	179.7	67.2	0	0	0	0	113.6	D362	D362-S364 PolarHBondContact O-N 2.68Å; D362-S364 VanDerWaalsContact O-N 3.12Å; D362-S364 WeakPolarHBondContact OD1-CB 3.37Å; D362-S364 PolarHBondContact OD1-N 3.42Å; D362-S364 PolarHBondContact OD1-OG 2.64Å; D362-S364 PolarHBondContact OD2-OG 2.78Å
365	N	66	Low	68.1	Low	115 Å²	115	39.6 Å²	39.6	62%	0.615	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.5	5.3	-170.9	-66.8	-28.6	0	0	0	114	D362 M367	D362-N365 PolarHBondContact O-N 3.1Å; N365-M367 HydrophobicContact CB-CB 4.47Å; N365-M367 HydrophobicContact CB-CG 3.81Å; N365-M367 PolarHBondContact O-N 2.87Å
366	D	62.2	Low	67.7	Low	68 Å²	68	41.4 Å²	41.4	36%	0.364	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	23.5	-173.3	-75.6	-32.5	0	0	0	113.8	H280 V305 Q361 D362	H280-D366 IonicContact CE1-OD2 2.69Å; V305-D366 WeakPolarHBondContact CG1-O 3.49Å; Q361-D366 PolarHBondContact NE2-OD1 3.13Å; D362-D366 PolarHBondContact O-N 2.96Å
367	M	66.8	Low	66.4	Low	50 Å²	50	47.8 Å²	47.8	25%	0.246	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	136.9	178	-68.5	-64.1	-73.9	0	0	109.9	D306 T308 Q361 D362 N365	D306-M367 VanDerWaalsContact O-CE 3.23Å; D306-M367 WeakPolarHBondContact O-CE 3.37Å; T308-M367 HydrophobicContact CG2-CE 3.26Å; T308-M367 WeakPolarHBondContact OG1-CE 3.22Å; Q361-M367 WeakPolarHBondContact CA-O 3.14Å; D362-M367 PolarHBondContact N-O 2.8Å; N365-M367 HydrophobicContact CB-CB 4.47Å; N365-M367 HydrophobicContact CB-CG 3.81Å; N365-M367 PolarHBondContact O-N 2.87Å
368	F	72.6	Confident	64.9	Low	2 Å²	2	51.6 Å²	51.6	1%	0.009	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.1	171.6	-60.4	-75.9	0	0	0	109.9	L276 L282 V292 V305 V307 I347 Y359 Q360 Q361	L276-F368 HydrophobicContact CD2-CE1 4.42Å; L276-F368 HydrophobicContact CD2-CZ 3.81Å; L282-F368 HydrophobicContact CD2-CZ 4.31Å; V292-F368 HydrophobicContact CG2-CE2 3.64Å; V292-F368 HydrophobicContact CG2-CZ 4.03Å; V305-F368 HydrophobicContact CB-CD2 4.14Å; V305-F368 HydrophobicContact CB-CE2 4.15Å; V305-F368 HydrophobicContact CG1-CD2 3.49Å; V305-F368 VanDerWaalsContact CG1-CD2 3.49Å; V305-F368 HydrophobicContact CG1-CE2 3.73Å; V305-F368 HydrophobicContact CG2-CE2 4.18Å; V307-F368 HydrophobicContact CG1-CB 4.47Å; V307-F368 WeakPolarHBondContact CG1-O 3.44Å; V307-F368 HydrophobicContact CG2-CB 4.3Å; I347-F368 HydrophobicContact CD1-CD1 3.69Å; I347-F368 HydrophobicContact CD1-CE1 3.15Å; I347-F368 HydrophobicContact CD1-CZ 3.93Å; I347-F368 HydrophobicContact CG1-CE1 4.48Å; Y359-F368 HydrophobicContact CD1-CB 4.48Å; Q360-F368 CarbonylContact O-C 3.54Å; Q360-F368 WeakPolarHBondContact O-CA 3.1Å; Q361-F368 HydrophobicContact CB-CD1 3.78Å; Q361-F368 HydrophobicContact CB-CE1 3.57Å; Q361-F368 HydrophobicContact CG-CD1 4.03Å; Q361-F368 HydrophobicContact CG-CE1 3.56Å; Q361-F368 HydrophobicContact CG-CZ 4.13Å
369	T	71.6	Confident	63.3	Low	53 Å²	53	55.1 Å²	55.1	33%	0.325	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.7	171.9	-52.3	0	0	0	0	108.5	D309 Y359 Q360 V371	D309-T369 VanDerWaalsContact OD2-CG2 3.31Å; D309-T369 WeakPolarHBondContact OD2-CG2 3.23Å; Y359-T369 CarbonylContact C-O 3.57Å; Y359-T369 VanDerWaalsContact CA-O 3.28Å; Y359-T369 WeakPolarHBondContact CA-O 3.41Å; Q360-T369 PolarHBondContact N-O 3.27Å; Q360-T369 PolarHBondContact O-N 2.91Å; T369-V371 PolarHBondContact O-N 3.26Å
370	H	72.9	Confident	61.4	Low	41 Å²	41	60 Å²	60	19%	0.19	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	118.1	178.3	174.7	-100.1	0	0	0	109.2	D309 Y359 Y372	D309-H370 PolarHBondContact OD2-N 2.67Å; Y359-H370 HydrophobicContact CD1-CB 4.1Å; Y359-H370 HydrophobicContact CE1-CB 3.98Å; Y359-H370 AromaticContact CE1-CD2 3.8Å; H370-Y372 PolarHBondContact NE2-O 2.74Å; H370-Y372 VanDerWaalsContact NE2-O 3.1Å
371	V	69.3	Low	59.4	Low	57 Å²	57	65 Å²	65	35%	0.345	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-18.8	-171.3	-65	0	0	0	0	113.9	Y346 V358 Q360 T369	Y346-V371 HydrophobicContact CD1-CG2 4.33Å; Y346-V371 HydrophobicContact CE1-CG2 4.38Å; V358-V371 HydrophobicContact CB-CG2 4.07Å; V358-V371 HydrophobicContact CG1-CG2 3.86Å; V358-V371 VanDerWaalsContact O-CG2 3.29Å; V358-V371 WeakPolarHBondContact O-CG2 3.03Å; V358-V371 PolarHBondContact O-N 3.48Å; Q360-V371 HydrophobicContact CB-CG1 3.67Å; Q360-V371 HydrophobicContact CB-CG2 4.33Å; T369-V371 PolarHBondContact O-N 3.26Å
372	Y	65.8	Low	57.6	Low	32 Å²	32	66.2 Å²	66.2	13%	0.125	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	140.2	179.7	175.3	-94.9	0	0	0	112.1	I356 D357 V358 H370 D374 W408 L448 D449	I356-Y372 HydrophobicContact CG2-CD1 4.33Å; I356-Y372 HydrophobicContact CG2-CE1 3.73Å; D357-Y372 CarbonylContact C-O 3.56Å; D357-Y372 WeakPolarHBondContact CA-O 3.46Å; V358-Y372 HydrophobicContact CG2-CD1 3.88Å; V358-Y372 PolarHBondContact N-O 3.47Å; V358-Y372 PolarHBondContact O-N 2.89Å; H370-Y372 PolarHBondContact NE2-O 2.74Å; H370-Y372 VanDerWaalsContact NE2-O 3.1Å; Y372-D374 HydrophobicContact CE1-CB 3.86Å; Y372-W408 HydrophobicContact CD1-CH2 4.21Å; Y372-W408 HydrophobicContact CG-CH2 4.15Å; Y372-L448 PolarHBondContact OH-O 3.03Å; Y372-D449 PolarHBondContact OH-OD1 3.18Å
373	H	67.8	Low	55.9	Low	83 Å²	83	68.9 Å²	68.9	38%	0.384	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.9	169.5	175.9	68.3	0	0	0	109.5	I356 D357 G375	I356-H373 CarbonylContact O-C 3.56Å; I356-H373 VanDerWaalsContact O-CA 3.32Å; I356-H373 WeakPolarHBondContact O-CA 3.25Å; I356-H373 PolarHBondContact O-ND1 3.16Å; D357-H373 IonicContact OD1-CE1 3.33Å; D357-H373 IonicContact OD1-CG 2.8Å; D357-H373 IonicContact OD1-ND1 3.58Å; D357-H373 PolarHBondContact OD1-ND1 3.16Å; H373-G375 PolarHBondContact CD2-N 3.24Å; H373-G375 WeakPolarHBondContact NE2-CA 3.15Å; H373-G375 PolarHBondContact NE2-N 3.42Å
374	D	63.7	Low	54.4	Low	23 Å²	23	71.9 Å²	71.9	12%	0.123	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	97.6	162.9	-177.6	13.4	0	0	0	108.9	S355 I356 Y372 R376	S355-D374 VanDerWaalsContact CA-O 3.23Å; S355-D374 WeakPolarHBondContact CA-O 3.37Å; S355-D374 WeakPolarHBondContact CB-O 3.29Å; I356-D374 HydrophobicContact CG2-CB 3.61Å; I356-D374 PolarHBondContact N-O 2.85Å; I356-D374 PolarHBondContact O-N 3.23Å; Y372-D374 HydrophobicContact CE1-CB 3.86Å; D374-R376 PolarHBondContact O-N 3.36Å
375	G	53.4	Low	53	Low	38 Å²	38	78.2 Å²	78.2	39%	0.392	41%	0.408	S	S	.	.			trans	-81.9	95	173.2	0	0	0	0	0	109.3	H373 K377	H373-G375 PolarHBondContact CD2-N 3.24Å; H373-G375 WeakPolarHBondContact NE2-CA 3.15Å; H373-G375 PolarHBondContact NE2-N 3.42Å; G375-K377 PolarHBondContact O-N 3.2Å
376	R	51.5	Low	51.5	Low	40 Å²	40	75.7 Å²	75.7	15%	0.151	40%	0.399	C	S	.	.			trans	-52	116.2	164.4	-83.8	-173	156.5	-140.2	-15.2	108.8	N353 D374 S378 T414	N353-R376 WeakPolarHBondContact O-CD 3.32Å; D374-R376 PolarHBondContact O-N 3.36Å; R376-S378 VanDerWaalsContact C-N 3.32Å; R376-S378 PolarHBondContact O-N 3.14Å; R376-T414 PolarHBondContact NH1-OG1 3.25Å; R376-T414 VanDerWaalsContact NH2-CB 3.27Å; R376-T414 VanDerWaalsContact NH2-CG2 3.27Å; R376-T414 PolarHBondContact NH2-OG1 3.12Å
377	K	41.7	Very low	50.3	Low	133 Å²	133	75.5 Å²	75.5	58%	0.578	39%	0.393	S	S	*	.			trans	-55.3	103.3	173.1	-79.9	-166.9	-178.7	-167.1	0	107	G375 M379 I480	G375-K377 PolarHBondContact O-N 3.2Å; K377-M379 VanDerWaalsContact C-N 3.34Å; K377-M379 PolarHBondContact O-N 3.45Å; K377-I480 HydrophobicContact CD-CD1 4.23Å; K377-I480 PolarHBondContact NZ-O 3.13Å; K377-I480 VanDerWaalsContact NZ-O 3.09Å
378	S	37.8	Very low	48.8	Very low	89 Å²	89	76.8 Å²	76.8	62%	0.622	42%	0.42	S	S	*	.			trans	1.4	83.5	160.4	167	0	0	0	0	111.7	R376 T380	R376-S378 VanDerWaalsContact C-N 3.32Å; R376-S378 PolarHBondContact O-N 3.14Å; S378-T380 PolarHBondContact O-N 3.45Å; S378-T380 WeakPolarHBondContact OG-CG2 3.08Å
379	M	38.6	Very low	47.5	Very low	75 Å²	75	84 Å²	84	37%	0.369	45%	0.447	S	S	.	.			trans	-70.2	81.9	165.1	-79.1	-175.5	96.6	0	0	105.3	K377 N381 I382 D418	K377-M379 VanDerWaalsContact C-N 3.34Å; K377-M379 PolarHBondContact O-N 3.45Å; M379-N381 PolarHBondContact O-N 3.06Å; M379-I382 HydrophobicContact CB-CD1 3.72Å; M379-I382 HydrophobicContact CB-CG1 4.08Å; M379-I382 HydrophobicContact CE-CD1 3.81Å; M379-I382 HydrophobicContact CE-CG1 4.05Å; M379-I382 HydrophobicContact CG-CD1 4.15Å; M379-I382 HydrophobicContact SD-CD1 3.33Å; M379-I382 WeakPolarHBondContact SD-CD1 3.28Å; M379-I382 HydrophobicContact SD-CG1 4.15Å; M379-D418 VanDerWaalsContact CE-OD1 3.3Å; M379-D418 WeakPolarHBondContact CE-OD1 3.12Å
380	T	34.4	Very low	46.5	Very low	116 Å²	116	82.8 Å²	82.8	71%	0.712	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	3.8	-179.3	37	0	0	0	0	113.5	S378	S378-T380 PolarHBondContact O-N 3.45Å; S378-T380 WeakPolarHBondContact OG-CG2 3.08Å
381	N	34.3	Very low	45.8	Very low	153 Å²	153	84 Å²	84	82%	0.818	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.5	18.6	-171.5	-90.7	-24.5	0	0	0	115	M379 D383	M379-N381 PolarHBondContact O-N 3.06Å; N381-D383 PolarHBondContact O-N 3.29Å
382	I	38.4	Very low	45.4	Very low	32 Å²	32	81.7 Å²	81.7	16%	0.164	43%	0.43	C	S	.	.	S	Bend	trans	-80	109.6	162.5	-62.6	163	0	0	0	106.8	M379 N384 Y387 I416	M379-I382 HydrophobicContact CB-CD1 3.72Å; M379-I382 HydrophobicContact CB-CG1 4.08Å; M379-I382 HydrophobicContact CE-CD1 3.81Å; M379-I382 HydrophobicContact CE-CG1 4.05Å; M379-I382 HydrophobicContact CG-CD1 4.15Å; M379-I382 HydrophobicContact SD-CD1 3.33Å; M379-I382 WeakPolarHBondContact SD-CD1 3.28Å; M379-I382 HydrophobicContact SD-CG1 4.15Å; I382-N384 PolarHBondContact O-N 3.38Å; I382-Y387 HydrophobicContact CB-CE2 3.8Å; I382-Y387 HydrophobicContact CG2-CD2 4.33Å; I382-Y387 HydrophobicContact CG2-CE2 3.54Å; I382-Y387 WeakPolarHBondContact O-CE2 3.45Å; I382-I416 HydrophobicContact CD1-CD1 3.43Å; I382-I416 VanDerWaalsContact CD1-CD1 3.43Å; I382-I416 HydrophobicContact CG1-CD1 4.19Å; I382-I416 HydrophobicContact CG2-CD1 3.76Å
383	D	35.2	Very low	45.2	Very low	103 Å²	103	82.1 Å²	82.1	55%	0.551	43%	0.432	S	S	*	.			trans	-49	125.8	-178.9	-140.3	-16	0	0	0	110.2	N381 R385 C386	N381-D383 PolarHBondContact O-N 3.29Å; D383-R385 PolarHBondContact O-N 2.88Å; D383-C386 PolarHBondContact O-N 3.34Å
384	N	33.8	Very low	45.1	Very low	127 Å²	127	78.6 Å²	78.6	68%	0.679	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-5.5	-173.5	-87.9	-36.9	0	0	0	115	I382	I382-N384 PolarHBondContact O-N 3.38Å
385	R	34.4	Very low	45.2	Very low	212 Å²	212	78.2 Å²	78.2	80%	0.8	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-22.5	-177.2	-54.3	-173.8	-146.1	-161.4	4.8	113.5	D383	D383-R385 PolarHBondContact O-N 2.88Å
386	C	35.2	Very low	45.8	Very low	63 Å²	63	76.5 Å²	76.5	43%	0.426	40%	0.398	S	S	.	.	S	Bend	trans	-89.9	-21.2	-176.9	-61.8	0	0	0	0	113.8	D383 G388 R389	D383-C386 PolarHBondContact O-N 3.34Å; C386-G388 PolarHBondContact O-N 3.45Å; C386-G388 VanDerWaalsContact O-N 3.14Å; C386-R389 PolarHBondContact O-N 3.3Å
387	Y	36.5	Very low	46.4	Very low	63 Å²	63	74.7 Å²	74.7	25%	0.247	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-13.5	-173.3	-79.8	-78.8	0	0	0	115	I382	I382-Y387 HydrophobicContact CB-CE2 3.8Å; I382-Y387 HydrophobicContact CG2-CD2 4.33Å; I382-Y387 HydrophobicContact CG2-CE2 3.54Å; I382-Y387 WeakPolarHBondContact O-CE2 3.45Å
388	G	36.1	Very low	47.4	Very low	78 Å²	78	69.4 Å²	69.4	80%	0.804	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-19.1	176.8	0	0	0	0	0	114.5	C386	C386-G388 PolarHBondContact O-N 3.45Å; C386-G388 VanDerWaalsContact O-N 3.14Å
389	R	45.1	Very low	48.6	Very low	154 Å²	154	65.4 Å²	65.4	58%	0.581	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-24.9	-170.7	-72.9	-175.2	174.2	-177.3	-4.9	114.7	D44 C386	D44-R389 IonicContact OD1-CZ 2.8Å; D44-R389 IonicContact OD1-NH1 3.73Å; D44-R389 PolarHBondContact OD1-NH1 3.49Å; D44-R389 IonicContact OD1-NH2 3.82Å; D44-R389 PolarHBondContact OD1-NH2 2.81Å; C386-R389 PolarHBondContact O-N 3.3Å
390	V	51.1	Low	49.7	Very low	27 Å²	27	68.5 Å²	68.5	16%	0.164	36%	0.361	C	S	.	.			trans	-108.6	108	-174	-173	0	0	0	0	110.1	V23	V23-V390 HydrophobicContact CG2-CG1 4.44Å
391	K	58.1	Low	50.7	Low	65 Å²	65	65.4 Å²	65.4	28%	0.283	34%	0.34	S	S	.	.			trans	-87.1	127.5	174.3	-71.5	174.3	-179.3	168.6	0	109	E150 T203 Y393	E150-K391 IonicContact OE1-NZ 2.91Å; E150-K391 PolarHBondContact OE1-NZ 3.03Å; E150-K391 IonicContact OE2-NZ 3.68Å; E150-K391 PolarHBondContact OE2-NZ 2.8Å; T203-K391 PolarHBondContact OG1-NZ 3.47Å; K391-Y393 HydrophobicContact CB-CD2 4.49Å; K391-Y393 HydrophobicContact CB-CE2 3.71Å; K391-Y393 WeakPolarHBondContact O-CD2 3.37Å; K391-Y393 WeakPolarHBondContact O-CE2 3.25Å
392	P	60	Low	51.7	Low	9 Å²	9	59.1 Å²	59.1	6%	0.058	31%	0.306	C	S	.	.			trans	-68	139.5	170.7	26	-29.1	0	0	0	109.5	Q323 I350 Q351 S413	Q323-P392 PolarHBondContact OE1-O 2.7Å; I350-P392 HydrophobicContact CG2-CB 3.72Å; I350-P392 HydrophobicContact CG2-CG 3.78Å; Q351-P392 WeakPolarHBondContact O-CG 3.12Å; P392-S413 WeakPolarHBondContact CA-O 3.4Å
393	Y	62.5	Low	52.4	Low	41 Å²	41	59.9 Å²	59.9	16%	0.161	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	150.3	-179.6	-72.2	-85.8	0	0	0	109.9	S25 A92 K391 S413	S25-Y393 VanDerWaalsContact C-CD2 3.45Å; S25-Y393 VanDerWaalsContact C-CE2 3.47Å; S25-Y393 WeakPolarHBondContact O-CD2 3.21Å; S25-Y393 WeakPolarHBondContact O-CE2 3.08Å; S25-Y393 PolarHBondContact O-OH 2.65Å; A92-Y393 PolarHBondContact O-OH 2.91Å; K391-Y393 HydrophobicContact CB-CD2 4.49Å; K391-Y393 HydrophobicContact CB-CE2 3.71Å; K391-Y393 WeakPolarHBondContact O-CD2 3.37Å; K391-Y393 WeakPolarHBondContact O-CE2 3.25Å; Y393-S413 PolarHBondContact N-O 2.85Å; Y393-S413 PolarHBondContact O-N 3.1Å
394	G	64.7	Low	53.3	Low	10 Å²	10	59.9 Å²	59.9	10%	0.103	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	167.4	168	0	0	0	0	0	112.6	V325 I350 L411	V325-G394 VanDerWaalsContact CG1-C 3.44Å; V325-G394 WeakPolarHBondContact CG1-O 3.43Å; I350-G394 VanDerWaalsContact CD1-N 3.25Å; G394-L411 CarbonylContact C-O 3.56Å; G394-L411 WeakPolarHBondContact CA-O 3.19Å
395	L	66.5	Low	54.2	Low	15 Å²	15	61.5 Å²	61.5	8%	0.079	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	122.5	-179.4	-175	72.9	0	0	0	108	L27 V29 L34 L397 L411	L27-L395 HydrophobicContact CB-CB 3.92Å; L27-L395 HydrophobicContact CB-CD2 4.23Å; L27-L395 HydrophobicContact CD1-CB 3.95Å; V29-L395 HydrophobicContact CB-CD2 3.88Å; V29-L395 HydrophobicContact CG1-CD1 4.25Å; V29-L395 HydrophobicContact CG1-CD2 4.01Å; V29-L395 HydrophobicContact CG1-CG 4.43Å; L34-L395 HydrophobicContact CD1-CD2 3.72Å; L395-L397 HydrophobicContact CD2-CD2 4.02Å; L395-L397 HydrophobicContact CG-CD2 4.41Å; L395-L411 HydrophobicContact CB-CB 4.36Å; L395-L411 HydrophobicContact CD2-CD1 4.48Å; L395-L411 PolarHBondContact N-O 2.47Å; L395-L411 PolarHBondContact O-N 3.26Å
396	F	66.3	Low	55.2	Low	2 Å²	2	53.2 Å²	53.2	1%	0.009	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.7	168	-64.3	-104.8	0	0	0	110.3	Q326 L328 G348 I356 V358 W408 R409 L410	Q326-F396 HydrophobicContact CB-CD2 3.81Å; Q326-F396 PolarHBondContact NE2-O 3.27Å; Q326-F396 PolarHBondContact OE1-O 3.01Å; L328-F396 HydrophobicContact CD1-CB 3.17Å; L328-F396 HydrophobicContact CD1-CD1 4.25Å; L328-F396 HydrophobicContact CD1-CG 4.03Å; L328-F396 HydrophobicContact CG-CB 3.76Å; G348-F396 VanDerWaalsContact CA-CE2 3.46Å; I356-F396 HydrophobicContact CD1-CE2 4.21Å; I356-F396 HydrophobicContact CD1-CZ 3.83Å; V358-F396 HydrophobicContact CG1-CE1 3.99Å; V358-F396 HydrophobicContact CG1-CZ 4.34Å; V358-F396 HydrophobicContact CG2-CE1 3.81Å; V358-F396 HydrophobicContact CG2-CZ 3.79Å; F396-W408 HydrophobicContact CD1-CB 4.23Å; F396-W408 AromaticContact CD1-CD2 3.9Å; F396-W408 HydrophobicContact CD1-CD2 3.9Å; F396-W408 AromaticContact CD1-CE3 3.64Å; F396-W408 HydrophobicContact CD1-CE3 3.64Å; F396-W408 HydrophobicContact CD1-CG 4.15Å; F396-W408 HydrophobicContact CD1-CZ3 4.34Å; F396-W408 HydrophobicContact CE1-CD2 4.03Å; F396-W408 AromaticContact CE1-CE3 3.73Å; F396-W408 HydrophobicContact CE1-CE3 3.73Å; F396-W408 HydrophobicContact CE1-CZ3 4.01Å; F396-R409 CarbonylContact C-O 2.76Å; F396-R409 WeakPolarHBondContact CA-O 3.39Å; F396-L410 HydrophobicContact CD1-CD1 4.47Å; F396-L410 HydrophobicContact CD2-CD1 4.1Å; F396-L410 HydrophobicContact CE1-CD1 4.26Å; F396-L410 HydrophobicContact CE2-CD1 3.84Å; F396-L410 HydrophobicContact CG-CD1 4.38Å; F396-L410 HydrophobicContact CZ-CD1 3.92Å
397	L	64.8	Low	56.4	Low	2 Å²	2	51 Å²	51	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.2	169.1	-55.1	176.8	0	0	0	108	V29 L395 M402 W408 R409 L411	V29-L397 HydrophobicContact CB-CD2 4.32Å; V29-L397 HydrophobicContact CG1-CD2 4.4Å; V29-L397 HydrophobicContact CG2-CD2 4.2Å; L395-L397 HydrophobicContact CD2-CD2 4.02Å; L395-L397 HydrophobicContact CG-CD2 4.41Å; L397-M402 HydrophobicContact CB-CG 3.89Å; L397-M402 HydrophobicContact CD1-CG 4.3Å; L397-M402 HydrophobicContact CD1-SD 4.09Å; L397-W408 CarbonylContact O-C 3.48Å; L397-W408 WeakPolarHBondContact O-CA 2.85Å; L397-R409 HydrophobicContact CB-CB 4.31Å; L397-R409 PolarHBondContact N-O 2.98Å; L397-R409 PolarHBondContact O-N 3.15Å; L397-L411 HydrophobicContact CD1-CD1 3.87Å; L397-L411 HydrophobicContact CD1-CD2 4.43Å; L397-L411 HydrophobicContact CD1-CG 3.95Å; L397-L411 HydrophobicContact CD2-CD1 4.3Å; L397-L411 HydrophobicContact CG-CD1 4.21Å; L397-L411 HydrophobicContact CG-CG 4.27Å
398	S	62.7	Low	57.7	Low	21 Å²	21	48.5 Å²	48.5	15%	0.147	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	159.3	176.3	65.5	0	0	0	0	111.6	D400 L401 M402	S398-D400 PolarHBondContact O-N 2.69Å; S398-D400 VanDerWaalsContact O-N 3.13Å; S398-D400 PolarHBondContact OG-N 2.97Å; S398-L401 PolarHBondContact O-N 3.34Å; S398-L401 VanDerWaalsContact O-N 3.12Å; S398-M402 PolarHBondContact O-N 3.1Å
399	S	62.9	Low	58.9	Low	6 Å²	6	46.4 Å²	46.4	4%	0.042	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-31.5	166.8	57.4	0	0	0	0	113.8	H330 L401 M402 Q406 P407	H330-S399 PolarHBondContact CE1-OG 3.16Å; H330-S399 PolarHBondContact ND1-OG 3.24Å; S399-L401 VanDerWaalsContact C-N 3.27Å; S399-L401 PolarHBondContact O-N 2.61Å; S399-M402 CarbonylContact O-C 3.39Å; S399-M402 PolarHBondContact O-N 3.08Å; S399-M402 VanDerWaalsContact O-N 3.11Å; S399-Q406 WeakPolarHBondContact CA-O 3.44Å; S399-Q406 WeakPolarHBondContact CB-O 3.35Å; S399-P407 PolarHBondContact N-O 3.31Å
400	D	60.4	Low	59.7	Low	139 Å²	139	39.7 Å²	39.7	74%	0.743	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-26	-175.1	-56.9	-18.6	0	0	0	111.8	S398	S398-D400 PolarHBondContact O-N 2.69Å; S398-D400 VanDerWaalsContact O-N 3.13Å; S398-D400 PolarHBondContact OG-N 2.97Å
401	L	55.9	Low	60.3	Low	52 Å²	52	38.7 Å²	38.7	27%	0.272	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.8	172.2	-72.2	156.9	0	0	0	111.7	V29 Q32 S398 S399	V29-L401 HydrophobicContact CG1-CD1 4.48Å; V29-L401 HydrophobicContact CG2-CD1 4.04Å; V29-L401 HydrophobicContact CG2-CD2 4.37Å; Q32-L401 HydrophobicContact CG-CD2 4.04Å; S398-L401 PolarHBondContact O-N 3.34Å; S398-L401 VanDerWaalsContact O-N 3.12Å; S399-L401 VanDerWaalsContact C-N 3.27Å; S399-L401 PolarHBondContact O-N 2.61Å
402	M	54.2	Low	60.5	Low	21 Å²	21	35.8 Å²	35.8	10%	0.103	19%	0.192	C	C	.	.	S	Bend	trans	-128.3	-168.4	-167.7	-61.8	-54.2	-63.9	0	0	110.9	F62 L397 S398 S399 S404	F62-M402 HydrophobicContact CB-CE 3.43Å; F62-M402 VanDerWaalsContact CB-CE 3.43Å; F62-M402 HydrophobicContact CD2-CE 3.73Å; F62-M402 HydrophobicContact CD2-SD 4.25Å; F62-M402 HydrophobicContact CG-CE 3.86Å; L397-M402 HydrophobicContact CB-CG 3.89Å; L397-M402 HydrophobicContact CD1-CG 4.3Å; L397-M402 HydrophobicContact CD1-SD 4.09Å; S398-M402 PolarHBondContact O-N 3.1Å; S399-M402 CarbonylContact O-C 3.39Å; S399-M402 PolarHBondContact O-N 3.08Å; S399-M402 VanDerWaalsContact O-N 3.11Å; M402-S404 PolarHBondContact O-N 3.14Å
403	N	54	Low	60.5	Low	47 Å²	47	35.5 Å²	35.5	25%	0.251	19%	0.19	S	C	.	.			trans	-67.8	134.3	178.4	-179	-1.5	0	0	0	110.6	Q405 Q406	N403-Q405 PolarHBondContact ND2-OE1 3.04Å; N403-Q405 PolarHBondContact O-N 3.08Å; N403-Q405 PolarHBondContact OD1-N 2.99Å; N403-Q406 PolarHBondContact O-N 3.22Å
404	S	54.9	Low	60	Low	103 Å²	103	34 Å²	34	72%	0.72	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-17.5	176.9	60.1	0	0	0	0	116	M402 Q406	M402-S404 PolarHBondContact O-N 3.14Å; S404-Q406 VanDerWaalsContact C-N 3.3Å; S404-Q406 PolarHBondContact O-N 3.24Å
405	Q	52.8	Low	59	Low	162 Å²	162	33.7 Å²	33.7	76%	0.757	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-10.5	-178.1	-68.7	180	-18.3	0	0	114.2	N403	N403-Q405 PolarHBondContact ND2-OE1 3.04Å; N403-Q405 PolarHBondContact O-N 3.08Å; N403-Q405 PolarHBondContact OD1-N 2.99Å
406	Q	55.4	Low	57.8	Low	37 Å²	37	35.6 Å²	35.6	17%	0.173	19%	0.192	C	C	.	.			trans	-130.1	127.6	-179.7	-63.9	-179.7	-37.9	0	0	109.8	S399 N403 S404 W408 R409 T446	S399-Q406 WeakPolarHBondContact CA-O 3.44Å; S399-Q406 WeakPolarHBondContact CB-O 3.35Å; N403-Q406 PolarHBondContact O-N 3.22Å; S404-Q406 VanDerWaalsContact C-N 3.3Å; S404-Q406 PolarHBondContact O-N 3.24Å; Q406-W408 PolarHBondContact O-N 3.38Å; Q406-R409 VanDerWaalsContact OE1-NE 3.1Å; Q406-T446 HydrophobicContact CB-CG2 3.95Å; Q406-T446 HydrophobicContact CG-CG2 3.83Å
407	P	59.4	Low	56.3	Low	17 Å²	17	36.5 Å²	36.5	11%	0.11	20%	0.198	C	C	.	.	S	Bend	trans	-64.7	-30.9	-175.2	25	-33.6	0	0	0	112.2	Y346 S399	Y346-P407 HydrophobicContact CE2-CB 3.79Å; Y346-P407 HydrophobicContact CE2-CG 4.29Å; S399-P407 PolarHBondContact N-O 3.31Å
408	W	62.9	Low	54.9	Low	11 Å²	11	41 Å²	41	4%	0.042	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	163.1	178.3	56.4	-94	0	0	0	111.8	L328 Y346 V358 Y372 F396 L397 Q406 L410	L328-W408 HydrophobicContact CD1-CB 3.76Å; Y346-W408 AromaticContact CD1-CD1 3.67Å; Y346-W408 AromaticContact CD1-NE1 3.34Å; Y346-W408 VanDerWaalsContact CD1-NE1 3.34Å; Y346-W408 AromaticContact CD2-CD1 3.66Å; Y346-W408 AromaticContact CE1-CD1 3.9Å; Y346-W408 AromaticContact CE1-NE1 3.52Å; Y346-W408 AromaticContact CE2-CD1 3.88Å; Y346-W408 AromaticContact CG-CD1 3.54Å; Y346-W408 AromaticContact CG-NE1 3.71Å; V358-W408 HydrophobicContact CB-CH2 4.33Å; V358-W408 HydrophobicContact CB-CZ2 4.11Å; V358-W408 HydrophobicContact CG1-CH2 4.36Å; V358-W408 HydrophobicContact CG1-CZ2 3.78Å; V358-W408 HydrophobicContact CG2-CH2 3.8Å; V358-W408 HydrophobicContact CG2-CZ2 4.07Å; V358-W408 HydrophobicContact CG2-CZ3 4.41Å; Y372-W408 HydrophobicContact CD1-CH2 4.21Å; Y372-W408 HydrophobicContact CG-CH2 4.15Å; F396-W408 HydrophobicContact CD1-CB 4.23Å; F396-W408 AromaticContact CD1-CD2 3.9Å; F396-W408 HydrophobicContact CD1-CD2 3.9Å; F396-W408 AromaticContact CD1-CE3 3.64Å; F396-W408 HydrophobicContact CD1-CE3 3.64Å; F396-W408 HydrophobicContact CD1-CG 4.15Å; F396-W408 HydrophobicContact CD1-CZ3 4.34Å; F396-W408 HydrophobicContact CE1-CD2 4.03Å; F396-W408 AromaticContact CE1-CE3 3.73Å; F396-W408 HydrophobicContact CE1-CE3 3.73Å; F396-W408 HydrophobicContact CE1-CZ3 4.01Å; L397-W408 CarbonylContact O-C 3.48Å; L397-W408 WeakPolarHBondContact O-CA 2.85Å; Q406-W408 PolarHBondContact O-N 3.38Å; W408-L410 HydrophobicContact CE3-CB 4.29Å; W408-L410 HydrophobicContact CZ3-CB 3.87Å
409	R	62.8	Low	53.4	Low	33 Å²	33	45.1 Å²	45.1	13%	0.125	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.8	165.4	-68.2	-173.6	169.3	-165.9	-7.8	109.9	F62 F396 L397 Q406 L448	F62-R409 VanDerWaalsContact CB-NH1 3.26Å; F62-R409 PolarHBondContact O-NH1 2.63Å; F396-R409 CarbonylContact C-O 2.76Å; F396-R409 WeakPolarHBondContact CA-O 3.39Å; L397-R409 HydrophobicContact CB-CB 4.31Å; L397-R409 PolarHBondContact N-O 2.98Å; L397-R409 PolarHBondContact O-N 3.15Å; Q406-R409 VanDerWaalsContact OE1-NE 3.1Å; R409-L448 HydrophobicContact CG-CD1 4.35Å; R409-L448 HydrophobicContact CG-CD2 4.01Å
410	L	61.1	Low	51.9	Low	13 Å²	13	51 Å²	51	7%	0.068	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.6	176.7	179.5	73.6	0	0	0	110.3	I356 F396 W408 L412	I356-L410 HydrophobicContact CB-CD2 4.26Å; I356-L410 HydrophobicContact CD1-CD1 3.44Å; I356-L410 VanDerWaalsContact CD1-CD1 3.44Å; I356-L410 HydrophobicContact CD1-CD2 3.31Å; I356-L410 HydrophobicContact CD1-CG 3.98Å; I356-L410 HydrophobicContact CG1-CD2 4.21Å; I356-L410 HydrophobicContact CG2-CD2 3.62Å; F396-L410 HydrophobicContact CD1-CD1 4.47Å; F396-L410 HydrophobicContact CD2-CD1 4.1Å; F396-L410 HydrophobicContact CE1-CD1 4.26Å; F396-L410 HydrophobicContact CE2-CD1 3.84Å; F396-L410 HydrophobicContact CG-CD1 4.38Å; F396-L410 HydrophobicContact CZ-CD1 3.92Å; W408-L410 HydrophobicContact CE3-CB 4.29Å; W408-L410 HydrophobicContact CZ3-CB 3.87Å; L410-L412 HydrophobicContact CD2-CB 4.06Å; L410-L412 HydrophobicContact CG-CB 4.24Å
411	L	64.4	Low	50.6	Low	6 Å²	6	49 Å²	49	3%	0.031	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	119.8	158.2	-62.9	-179.6	0	0	0	107.4	L27 L34 G394 L395 L397 L452 Y474	L27-L411 HydrophobicContact CD1-CB 4.35Å; L34-L411 HydrophobicContact CD1-CD1 3.65Å; L34-L411 HydrophobicContact CD2-CD1 3.66Å; L34-L411 HydrophobicContact CG-CD1 4.33Å; G394-L411 CarbonylContact C-O 3.56Å; G394-L411 WeakPolarHBondContact CA-O 3.19Å; L395-L411 HydrophobicContact CB-CB 4.36Å; L395-L411 HydrophobicContact CD2-CD1 4.48Å; L395-L411 PolarHBondContact N-O 2.47Å; L395-L411 PolarHBondContact O-N 3.26Å; L397-L411 HydrophobicContact CD1-CD1 3.87Å; L397-L411 HydrophobicContact CD1-CD2 4.43Å; L397-L411 HydrophobicContact CD1-CG 3.95Å; L397-L411 HydrophobicContact CD2-CD1 4.3Å; L397-L411 HydrophobicContact CG-CD1 4.21Å; L397-L411 HydrophobicContact CG-CG 4.27Å; L411-L452 HydrophobicContact CD2-CD1 4.38Å; L411-Y474 HydrophobicContact CD2-CE1 3.57Å; L411-Y474 WeakPolarHBondContact CD2-OH 3.16Å
412	L	61	Low	49.2	Very low	4 Å²	4	53.3 Å²	53.3	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.6	178.6	179.4	70.9	0	0	0	108.7	I350 G354 L410 T414 L452	I350-L412 HydrophobicContact CD1-CD1 3.47Å; I350-L412 VanDerWaalsContact CD1-CD1 3.47Å; I350-L412 HydrophobicContact CG1-CD1 3.93Å; I350-L412 HydrophobicContact CG2-CD1 4.14Å; G354-L412 VanDerWaalsContact O-CD2 3.23Å; G354-L412 WeakPolarHBondContact O-CD2 3.39Å; L410-L412 HydrophobicContact CD2-CB 4.06Å; L410-L412 HydrophobicContact CG-CB 4.24Å; L412-T414 HydrophobicContact CD1-CG2 4.42Å; L412-T414 HydrophobicContact CD2-CG2 3.77Å; L412-T414 HydrophobicContact CG-CG2 3.78Å; L412-L452 WeakPolarHBondContact O-CB 3.23Å; L412-L452 PolarHBondContact O-N 2.95Å
413	S	61.5	Low	47.8	Very low	4 Å²	4	59.3 Å²	59.3	3%	0.028	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.5	162	-167.1	0	0	0	0	110.6	V24 P392 Y393 L452	V24-S413 WeakPolarHBondContact CB-OG 3.02Å; P392-S413 WeakPolarHBondContact CA-O 3.4Å; Y393-S413 PolarHBondContact N-O 2.85Å; Y393-S413 PolarHBondContact O-N 3.1Å; S413-L452 PolarHBondContact OG-O 3.19Å
414	T	51.7	Low	46.5	Very low	10 Å²	10	63.3 Å²	63.3	6%	0.061	35%	0.347	C	S	.	.			trans	-112.7	15.7	-176.7	66.2	0	0	0	0	112.4	R376 L412 I416 Q451	R376-T414 PolarHBondContact NH1-OG1 3.25Å; R376-T414 VanDerWaalsContact NH2-CB 3.27Å; R376-T414 VanDerWaalsContact NH2-CG2 3.27Å; R376-T414 PolarHBondContact NH2-OG1 3.12Å; L412-T414 HydrophobicContact CD1-CG2 4.42Å; L412-T414 HydrophobicContact CD2-CG2 3.77Å; L412-T414 HydrophobicContact CG-CG2 3.78Å; T414-I416 PolarHBondContact O-N 3.27Å; T414-Q451 PolarHBondContact OG1-NE2 3.36Å
415	G	43.4	Very low	44.9	Very low	3 Å²	3	66.3 Å²	66.3	3%	0.031	36%	0.355	C	S	.	.	S	Bend	trans	59.6	11.1	167.2	0	0	0	0	0	117.6	V23	V23-G415 WeakPolarHBondContact CG1-O 3.16Å
416	I	40.4	Very low	43.5	Very low	54 Å²	54	65.2 Å²	65.2	28%	0.277	35%	0.354	S	S	.	.			trans	-136.5	114.1	179.2	-58.5	174.9	0	0	0	108.3	I382 T414	I382-I416 HydrophobicContact CD1-CD1 3.43Å; I382-I416 VanDerWaalsContact CD1-CD1 3.43Å; I382-I416 HydrophobicContact CG1-CD1 4.19Å; I382-I416 HydrophobicContact CG2-CD1 3.76Å; T414-I416 PolarHBondContact O-N 3.27Å
417	P	36.1	Very low	41.8	Very low	22 Å²	22	69 Å²	69	14%	0.143	38%	0.38	C	S	.	.			trans	-66.3	131.2	166.2	15	-10.8	0	0	0	108.9	A21 N419	A21-P417 HydrophobicContact CB-CG 4.2Å; P417-N419 PolarHBondContact O-N 3.05Å
418	D	35.6	Very low	40	Very low	96 Å²	96	76.6 Å²	76.6	51%	0.513	42%	0.418	S	S	.	.			trans	-70.9	95.8	-178.4	-135.8	-8.3	0	0	0	109.2	M379 N420	M379-D418 VanDerWaalsContact CE-OD1 3.3Å; M379-D418 WeakPolarHBondContact CE-OD1 3.12Å; D418-N420 PolarHBondContact O-N 3.28Å
419	N	30.7	Very low	38	Very low	107 Å²	107	82.1 Å²	82.1	57%	0.572	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	2.8	-176.8	-93.6	-6.7	0	0	0	114	P417	P417-N419 PolarHBondContact O-N 3.05Å
420	N	30.5	Very low	36	Very low	130 Å²	130	86.4 Å²	86.4	70%	0.695	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	10.7	-172.4	-83.5	-14.5	0	0	0	115.4	D418 N422	D418-N420 PolarHBondContact O-N 3.28Å; N420-N422 PolarHBondContact O-N 2.74Å
421	S	33.9	Very low	34.1	Very low	96 Å²	96	92.4 Å²	92.4	67%	0.671	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-10.2	179	56.5	0	0	0	0	114.9
422	N	26.5	Very low	32.2	Very low	144 Å²	144	97.3 Å²	97.3	77%	0.77	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	5	-174.4	-81.2	-14.8	0	0	0	116.5	N420	N420-N422 PolarHBondContact O-N 2.74Å
423	N	25.1	Very low	30.2	Very low	146 Å²	146	104.3 Å²	104.3	78%	0.781	59%	0.593	S	S	*	*	S	Bend	trans	-145.1	33.2	-169.5	-98.7	-16.4	0	0	0	118
424	N	25.7	Very low	28.3	Very low	132 Å²	132	115 Å²	115	71%	0.706	63%	0.634	S	S	*	*			trans	-147.3	102.1	159.8	-85.7	-38.4	0	0	0	112.7	L426	N424-L426 HydrophobicContact CB-CD1 3.88Å; N424-L426 HydrophobicContact CB-CG 4.14Å; N424-L426 PolarHBondContact O-N 3.41Å
425	N	22.5	Very low	26.9	Very low	166 Å²	166	119.9 Å²	119.9	89%	0.888	66%	0.664	S	S	*	*			trans	-59.7	74.8	146.3	-81.6	-31.2	0	0	0	108.5	T427	N425-T427 VanDerWaalsContact C-N 3.29Å; N425-T427 PolarHBondContact O-N 3.46Å
426	L	22.6	Very low	25.9	Very low	138 Å²	138	123.7 Å²	123.7	72%	0.723	70%	0.695	S	S	*	*			trans	-77.7	90.3	168.1	-98	150.9	0	0	0	107.3	N424 L428	N424-L426 HydrophobicContact CB-CD1 3.88Å; N424-L426 HydrophobicContact CB-CG 4.14Å; N424-L426 PolarHBondContact O-N 3.41Å; L426-L428 PolarHBondContact O-N 3.32Å
427	T	20.3	Very low	24.9	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.724	72%	0.721	S	S	*	*			trans	-47	109.6	163	28.6	0	0	0	0	109.4	N425 T429	N425-T427 VanDerWaalsContact C-N 3.29Å; N425-T427 PolarHBondContact O-N 3.46Å; T427-T429 VanDerWaalsContact C-N 3.35Å; T427-T429 PolarHBondContact O-N 3.05Å
428	L	21.2	Very low	24.3	Very low	175 Å²	175	135.9 Å²	135.9	92%	0.916	76%	0.756	S	S	*	*			trans	-57.7	95.9	166.7	-84.9	144.9	0	0	0	108.7	L426	L426-L428 PolarHBondContact O-N 3.32Å
429	T	20.7	Very low	23.5	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	77%	0.766	S	S	*	*			trans	-89.9	125.2	158.9	36.1	0	0	0	0	107.9	T427	T427-T429 VanDerWaalsContact C-N 3.35Å; T427-T429 PolarHBondContact O-N 3.05Å
430	T	21.7	Very low	23.1	Very low	124 Å²	124	141.8 Å²	141.8	76%	0.761	77%	0.774	S	S	*	*			trans	-63.7	165.4	-177.8	41.1	0	0	0	0	112.7
431	T	21.6	Very low	22.6	Very low	139 Å²	139	142.4 Å²	142.4	85%	0.853	77%	0.773	S	S	*	*			trans	94.9	125.5	178.1	72.6	0	0	0	0	113.3
432	S	22.9	Very low	22.1	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	78%	0.781	S	S	*	*			cis	-157.1	153.6	24	48.3	0	0	0	0	111
433	L	20.6	Very low	21.9	Very low	151 Å²	151	143.2 Å²	143.2	79%	0.791	78%	0.78	S	S	*	*			trans	-60.9	124.1	-177.5	-68.6	115.7	0	0	0	113.3	T435	L433-T435 HydrophobicContact CD2-CG2 4.16Å
434	Y	21.3	Very low	21.9	Very low	227 Å²	227	145.3 Å²	145.3	89%	0.89	79%	0.787	S	S	*	*			trans	-108.5	85.5	149.1	-102	-89.2	0	0	0	108.5	A436	Y434-A436 PolarHBondContact O-N 3.27Å
435	T	20.7	Very low	21.9	Very low	114 Å²	114	144.4 Å²	144.4	70%	0.699	79%	0.788	S	S	*	*			trans	-75	92.9	160.1	40.2	0	0	0	0	108.2	L433 N437	L433-T435 HydrophobicContact CD2-CG2 4.16Å; T435-N437 PolarHBondContact O-N 3.06Å
436	A	23.1	Very low	22.3	Very low	83 Å²	83	138.5 Å²	138.5	69%	0.686	76%	0.758	S	S	*	*			trans	-74.1	105.2	163.2	0	0	0	0	0	108.4	Y434 M438	Y434-A436 PolarHBondContact O-N 3.27Å; A436-M438 PolarHBondContact O-N 2.96Å
437	N	19.9	Very low	22.6	Very low	154 Å²	154	140.6 Å²	140.6	82%	0.824	76%	0.761	S	S	*	*			trans	-59.5	100.4	165.6	-100.2	-24.8	0	0	0	109.1	T435	T435-N437 PolarHBondContact O-N 3.06Å
438	M	23.3	Very low	23.5	Very low	178 Å²	178	135.8 Å²	135.8	88%	0.877	73%	0.731	S	S	*	*			trans	-110	88	163.5	-70.6	-70.8	-94.1	0	0	108	A436	A436-M438 PolarHBondContact O-N 2.96Å
439	N	19.1	Very low	24.3	Very low	133 Å²	133	128.8 Å²	128.8	71%	0.711	70%	0.695	S	S	*	*			trans	-80.2	137.4	155.5	-86.8	-29.7	0	0	0	107.8
440	Y	21	Very low	25.3	Very low	193 Å²	193	124.2 Å²	124.2	76%	0.757	66%	0.664	S	S	*	*			trans	116.1	117.7	156.8	-68.1	-72.9	0	0	0	118.8
441	H	21.3	Very low	26.5	Very low	143 Å²	143	118.7 Å²	118.7	66%	0.662	63%	0.629	S	S	*	*			trans	78.8	88.2	148.2	-63.1	-54.1	0	0	0	120.1	T443	H441-T443 PolarHBondContact O-N 2.81Å
442	T	22.1	Very low	27.6	Very low	137 Å²	137	112.1 Å²	112.1	84%	0.84	59%	0.589	S	S	*	*				20.6	68.9	126	57.8	0	0	0	0	116.9
443	T	23.3	Very low	28.5	Very low	121 Å²	121	107.5 Å²	107.5	74%	0.742	56%	0.556	S	S	*	*			trans	-147.4	121	145.2	41.5	0	0	0	0	105.1	H441 P445	H441-T443 PolarHBondContact O-N 2.81Å; T443-P445 VanDerWaalsContact O-CD 3.28Å; T443-P445 WeakPolarHBondContact O-CD 3.03Å
444	M	24.2	Very low	29.4	Very low	189 Å²	189	100.9 Å²	100.9	93%	0.931	52%	0.522	S	S	*	.			trans	-58.7	116.7	-176.8	-88.8	-108	169.3	0	0	109.9	T446	M444-T446 PolarHBondContact O-N 2.76Å
445	P	27.1	Very low	29.9	Very low	113 Å²	113	94.5 Å²	94.5	73%	0.734	50%	0.5	S	S	*	.			trans	-76.8	119.2	172.1	31.4	-28.6	0	0	0	107.3	T443 K447	T443-P445 VanDerWaalsContact O-CD 3.28Å; T443-P445 WeakPolarHBondContact O-CD 3.03Å; P445-K447 PolarHBondContact O-N 2.95Å
446	T	31.1	Very low	30.5	Very low	42 Å²	42	91.4 Å²	91.4	26%	0.258	48%	0.482	S	S	.	.			trans	-50.3	104.9	167.8	20.5	0	0	0	0	110.1	Q406 M444	Q406-T446 HydrophobicContact CB-CG2 3.95Å; Q406-T446 HydrophobicContact CG-CG2 3.83Å; M444-T446 PolarHBondContact O-N 2.76Å
447	K	28.7	Very low	30.6	Very low	182 Å²	182	93.4 Å²	93.4	79%	0.791	48%	0.481	S	S	*	.			trans	-87.3	105.7	169.2	-118.4	-179.7	178.3	179	0	108.5	P445	P445-K447 PolarHBondContact O-N 2.95Å
448	L	38.5	Very low	31	Very low	18 Å²	18	91.8 Å²	91.8	9%	0.094	47%	0.472	C	S	.	.			trans	-150.9	111.9	163.5	-89.6	110	0	0	0	111.8	Y372 R409 Y450	Y372-L448 PolarHBondContact OH-O 3.03Å; R409-L448 HydrophobicContact CG-CD1 4.35Å; R409-L448 HydrophobicContact CG-CD2 4.01Å; L448-Y450 HydrophobicContact CB-CD2 3.86Å; L448-Y450 HydrophobicContact CB-CE2 3.56Å; L448-Y450 HydrophobicContact CD2-CD2 3.44Å; L448-Y450 VanDerWaalsContact CD2-CD2 3.44Å; L448-Y450 HydrophobicContact CD2-CE2 3.03Å; L448-Y450 HydrophobicContact CG-CD2 3.97Å; L448-Y450 HydrophobicContact CG-CE2 3.33Å
449	D	39.1	Very low	31.1	Very low	28 Å²	28	89.6 Å²	89.6	15%	0.15	46%	0.462	C	S	.	.			trans	-114.4	98.8	168.4	-64.6	-29.1	0	0	0	108.1	Y372 N479	Y372-D449 PolarHBondContact OH-OD1 3.18Å; D449-N479 PolarHBondContact OD2-ND2 3.12Å
450	Y	41.6	Very low	31.3	Very low	31 Å²	31	92.2 Å²	92.2	12%	0.122	47%	0.47	C	S	.	.			trans	-129.4	117.6	175.8	-60	-85.6	0	0	0	110.3	G63 V74 L448 Y474	G63-Y450 VanDerWaalsContact C-CE1 3.46Å; G63-Y450 VanDerWaalsContact CA-CZ 3.46Å; G63-Y450 WeakPolarHBondContact O-CE1 3.23Å; G63-Y450 PolarHBondContact O-OH 3.27Å; V74-Y450 HydrophobicContact CG1-CE1 3.95Å; L448-Y450 HydrophobicContact CB-CD2 3.86Å; L448-Y450 HydrophobicContact CB-CE2 3.56Å; L448-Y450 HydrophobicContact CD2-CD2 3.44Å; L448-Y450 VanDerWaalsContact CD2-CD2 3.44Å; L448-Y450 HydrophobicContact CD2-CE2 3.03Å; L448-Y450 HydrophobicContact CG-CD2 3.97Å; L448-Y450 HydrophobicContact CG-CE2 3.33Å; Y450-Y474 HydrophobicContact CD1-CD1 4.39Å; Y450-Y474 HydrophobicContact CG-CD1 4.47Å
451	Q	45.5	Very low	31.5	Very low	8 Å²	8	85.4 Å²	85.4	4%	0.037	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.5	172.3	-170.4	-175.2	-27.2	0	0	109.3	T414 C453 I475 L477	T414-Q451 PolarHBondContact OG1-NE2 3.36Å; Q451-C453 PolarHBondContact NE2-SG 3.4Å; Q451-C453 PolarHBondContact O-N 2.87Å; Q451-I475 WeakPolarHBondContact CB-O 3.45Å; Q451-I475 PolarHBondContact N-O 2.81Å; Q451-I475 PolarHBondContact O-N 3.06Å; Q451-L477 HydrophobicContact CB-CD1 4.25Å; Q451-L477 HydrophobicContact CB-CG 4.39Å; Q451-L477 VanDerWaalsContact OE1-CD1 3.25Å; Q451-L477 VanDerWaalsContact OE1-CG 3.28Å
452	L	46	Very low	31.7	Very low	1 Å²	1	86.5 Å²	86.5	1%	0.005	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	101.3	174.6	-157.4	129.8	0	0	0	108.1	V24 I36 L411 L412 S413 I472 Y474	V24-L452 HydrophobicContact CB-CD2 4.15Å; V24-L452 HydrophobicContact CG1-CD2 4.26Å; V24-L452 HydrophobicContact CG2-CD2 3.3Å; I36-L452 HydrophobicContact CD1-CD1 4Å; I36-L452 HydrophobicContact CD1-CD2 4.09Å; I36-L452 HydrophobicContact CG2-CD2 4.3Å; L411-L452 HydrophobicContact CD2-CD1 4.38Å; L412-L452 WeakPolarHBondContact O-CB 3.23Å; L412-L452 PolarHBondContact O-N 2.95Å; S413-L452 PolarHBondContact OG-O 3.19Å; L452-I472 HydrophobicContact CD1-CG2 4.03Å; L452-I472 HydrophobicContact CD2-CD1 4.23Å; L452-I472 HydrophobicContact CD2-CG2 3.4Å; L452-I472 VanDerWaalsContact CD2-CG2 3.4Å; L452-I472 HydrophobicContact CG-CG2 3.41Å; L452-I472 VanDerWaalsContact CG-CG2 3.41Å; L452-Y474 HydrophobicContact CD1-CE1 4.06Å
453	C	40.1	Very low	31.9	Very low	12 Å²	12	83.1 Å²	83.1	8%	0.081	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	129.3	-178.7	-73.7	0	0	0	0	110.2	Q451 H455 H473 I475	Q451-C453 PolarHBondContact NE2-SG 3.4Å; Q451-C453 PolarHBondContact O-N 2.87Å; C453-H455 PolarHBondContact O-N 3.05Å; C453-H473 PolarHBondContact N-O 3.26Å; C453-H473 VanDerWaalsContact N-O 3.1Å; C453-H473 PolarHBondContact O-N 2.68Å; C453-H473 VanDerWaalsContact O-O 3.13Å; C453-I475 HydrophobicContact CB-CD1 3.61Å; C453-I475 HydrophobicContact CB-CG1 3.93Å
454	V	40.3	Very low	32	Very low	11 Å²	11	83.7 Å²	83.7	7%	0.067	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	109.2	171.9	-173	0	0	0	0	106.4	S22 V24 P456 S470 I472	S22-V454 VanDerWaalsContact O-CB 3.25Å; S22-V454 WeakPolarHBondContact O-CB 3.5Å; S22-V454 WeakPolarHBondContact O-CG1 3.3Å; V24-V454 HydrophobicContact CB-CG2 4.43Å; V24-V454 HydrophobicContact CG2-CG2 3.39Å; V454-P456 VanDerWaalsContact O-CD 3.29Å; V454-P456 WeakPolarHBondContact O-CD 3.1Å; V454-S470 WeakPolarHBondContact CG1-OG 3.31Å; V454-I472 HydrophobicContact CG2-CG1 4.4Å
455	H	32.7	Very low	32.3	Very low	94 Å²	94	77.3 Å²	77.3	44%	0.435	43%	0.427	S	S	.	.			trans	-82.5	116.9	-178.9	-163.9	-81.5	0	0	0	109.4	C453 N457 R471	C453-H455 PolarHBondContact O-N 3.05Å; H455-N457 VanDerWaalsContact C-N 3.34Å; H455-N457 PolarHBondContact O-N 2.89Å; H455-R471 PolarHBondContact N-O 3.21Å
456	P	31.5	Very low	32.5	Very low	48 Å²	48	74.7 Å²	74.7	31%	0.312	40%	0.404	S	S	.	.			trans	-79.5	91.4	169.8	31.5	-25.6	0	0	0	106.1	A21 V454	A21-P456 HydrophobicContact CB-CB 4.18Å; A21-P456 HydrophobicContact CB-CG 4.32Å; V454-P456 VanDerWaalsContact O-CD 3.29Å; V454-P456 WeakPolarHBondContact O-CD 3.1Å
457	N	26.3	Very low	32.4	Very low	126 Å²	126	77.8 Å²	77.8	67%	0.674	42%	0.419	S	S	*	.			trans	159.3	104.6	153.7	-81.8	-21.9	0	0	0	108.6	H455	H455-N457 VanDerWaalsContact C-N 3.34Å; H455-N457 PolarHBondContact O-N 2.89Å
458	L	28.3	Very low	32.7	Very low	120 Å²	120	71.9 Å²	71.9	63%	0.628	40%	0.396	S	S	*	.	S	Bend	trans	-149.3	-9.5	144.8	-107.1	165.7	0	0	0	113.2
459	I	24.2	Very low	32.6	Very low	132 Å²	132	74.1 Å²	74.1	68%	0.677	41%	0.408	S	S	*	.			trans	-148.1	118.6	164.4	-46.8	177.1	0	0	0	109.7	T461	I459-T461 HydrophobicContact CB-CG2 4.05Å; I459-T461 HydrophobicContact CG2-CG2 3.44Å; I459-T461 VanDerWaalsContact CG2-CG2 3.44Å; I459-T461 PolarHBondContact O-N 3.45Å
460	E	24.1	Very low	32.6	Very low	188 Å²	188	74 Å²	74	88%	0.879	41%	0.409	S	S	*	.			trans	-58.7	102.8	156.3	-79.2	179.3	152.4	0	0	107.3
461	T	26.2	Very low	32.3	Very low	50 Å²	50	78.3 Å²	78.3	31%	0.307	43%	0.425	S	S	.	.			trans	-112.8	118.3	168.4	55.9	0	0	0	0	109.8	I459 V463 N467	I459-T461 HydrophobicContact CB-CG2 4.05Å; I459-T461 HydrophobicContact CG2-CG2 3.44Å; I459-T461 VanDerWaalsContact CG2-CG2 3.44Å; I459-T461 PolarHBondContact O-N 3.45Å; T461-V463 PolarHBondContact O-N 3.38Å; T461-V463 VanDerWaalsContact O-N 3.16Å; T461-N467 PolarHBondContact OG1-O 2.91Å
462	N	24.4	Very low	32	Very low	165 Å²	165	78.2 Å²	78.2	88%	0.882	43%	0.425	S	S	*	.			trans	-61.2	112.3	173.4	-75.2	-34.8	0	0	0	109.4
463	V	25.7	Very low	31.4	Very low	67 Å²	67	79 Å²	79	41%	0.406	43%	0.428	S	S	.	.			trans	-61.1	128	168.3	175.7	0	0	0	0	108.5	T461 F466	T461-V463 PolarHBondContact O-N 3.38Å; T461-V463 VanDerWaalsContact O-N 3.16Å; V463-F466 HydrophobicContact CB-CD2 4.41Å; V463-F466 HydrophobicContact CG1-CD2 3.6Å; V463-F466 HydrophobicContact CG1-CE2 3.85Å; V463-F466 HydrophobicContact CG1-CG 4.27Å; V463-F466 HydrophobicContact CG2-CB 4.47Å; V463-F466 HydrophobicContact CG2-CD1 4.01Å; V463-F466 HydrophobicContact CG2-CD2 3.89Å; V463-F466 HydrophobicContact CG2-CE1 4.15Å; V463-F466 HydrophobicContact CG2-CE2 4.03Å; V463-F466 HydrophobicContact CG2-CG 3.87Å; V463-F466 HydrophobicContact CG2-CZ 4.14Å
464	P	26.7	Very low	31.2	Very low	133 Å²	133	78.6 Å²	78.6	86%	0.864	43%	0.425	S	S	*	.	S	Bend		-115.1	122.9	85.8	-0.1	20.2	0	0	0	111.6
465	G	29.7	Very low	30.8	Very low	54 Å²	54	81 Å²	81	56%	0.557	44%	0.437	S	S	*	.	S	Bend	trans	106.7	12.9	-179.1	0	0	0	0	0	117.3
466	F	31.1	Very low	30.8	Very low	59 Å²	59	80.6 Å²	80.6	26%	0.259	43%	0.434	S	S	.	.			trans	45.7	78.4	169.4	-95.7	-83.7	0	0	0	116.2	Y20 L45 V463 N468	Y20-F466 HydrophobicContact CD1-CE1 4.26Å; Y20-F466 AromaticContact CD1-CZ 3.65Å; Y20-F466 HydrophobicContact CD1-CZ 3.65Å; Y20-F466 HydrophobicContact CE1-CZ 4.23Å; Y20-F466 HydrophobicContact CG-CZ 4.47Å; L45-F466 HydrophobicContact CD2-CE2 4.32Å; V463-F466 HydrophobicContact CB-CD2 4.41Å; V463-F466 HydrophobicContact CG1-CD2 3.6Å; V463-F466 HydrophobicContact CG1-CE2 3.85Å; V463-F466 HydrophobicContact CG1-CG 4.27Å; V463-F466 HydrophobicContact CG2-CB 4.47Å; V463-F466 HydrophobicContact CG2-CD1 4.01Å; V463-F466 HydrophobicContact CG2-CD2 3.89Å; V463-F466 HydrophobicContact CG2-CE1 4.15Å; V463-F466 HydrophobicContact CG2-CE2 4.03Å; V463-F466 HydrophobicContact CG2-CG 3.87Å; V463-F466 HydrophobicContact CG2-CZ 4.14Å; F466-N468 HydrophobicContact CD1-CB 4.38Å; F466-N468 PolarHBondContact O-N 3.26Å
467	N	30	Very low	30.7	Very low	107 Å²	107	80.3 Å²	80.3	57%	0.572	43%	0.43	S	S	*	.			trans	-84.1	47.3	165.7	-80.8	-19.1	0	0	0	112.4	T461 L469	T461-N467 PolarHBondContact OG1-O 2.91Å; N467-L469 PolarHBondContact O-N 3.19Å; N467-L469 VanDerWaalsContact O-N 3.13Å
468	N	34.6	Very low	30.8	Very low	57 Å²	57	81 Å²	81	31%	0.305	43%	0.427	S	S	.	.			trans	-87.2	67.3	168.7	-83.4	-7.6	0	0	0	110.1	Y20 S22 F466 S470	Y20-N468 PolarHBondContact O-ND2 3.39Å; S22-N468 PolarHBondContact OG-O 2.78Å; F466-N468 HydrophobicContact CD1-CB 4.38Å; F466-N468 PolarHBondContact O-N 3.26Å; N468-S470 PolarHBondContact O-N 2.7Å; N468-S470 PolarHBondContact O-OG 3Å
469	L	37	Very low	30.6	Very low	66 Å²	66	81.7 Å²	81.7	35%	0.346	43%	0.431	S	S	.	.			trans	-83.4	72.5	163.9	-74.3	151.5	0	0	0	108.1	V51 E84 N467 R471	V51-L469 HydrophobicContact CG2-CD2 3.8Å; E84-L469 HydrophobicContact CB-CD1 4.43Å; E84-L469 HydrophobicContact CB-CD2 3.64Å; E84-L469 HydrophobicContact CG-CD1 3.62Å; E84-L469 HydrophobicContact CG-CD2 3.81Å; E84-L469 HydrophobicContact CG-CG 4.29Å; E84-L469 WeakPolarHBondContact OE1-CD1 3.35Å; E84-L469 WeakPolarHBondContact OE2-CD1 3.49Å; E84-L469 WeakPolarHBondContact OE2-CD2 3.33Å; N467-L469 PolarHBondContact O-N 3.19Å; N467-L469 VanDerWaalsContact O-N 3.13Å; L469-R471 PolarHBondContact O-N 3.09Å
470	S	37.6	Very low	30.6	Very low	25 Å²	25	83.5 Å²	83.5	18%	0.175	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-62.1	118.4	173.2	31.9	0	0	0	0	109.5	S22 V454 N468 I472	S22-S470 WeakPolarHBondContact CB-OG 3.29Å; V454-S470 WeakPolarHBondContact CG1-OG 3.31Å; N468-S470 PolarHBondContact O-N 2.7Å; N468-S470 PolarHBondContact O-OG 3Å; S470-I472 PolarHBondContact O-N 3.27Å
471	R	36.6	Very low	31	Very low	122 Å²	122	78.3 Å²	78.3	46%	0.46	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-60.6	127.3	172.5	-67.9	-177.5	-178.8	177.7	0.6	108.5	H455 L469 H473	H455-R471 PolarHBondContact N-O 3.21Å; L469-R471 PolarHBondContact O-N 3.09Å; R471-H473 PolarHBondContact O-CD2 3.32Å; R471-H473 VanDerWaalsContact O-CD2 3.3Å
472	I	38.3	Very low	31.2	Very low	6 Å²	6	79.8 Å²	79.8	3%	0.031	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	119.6	-177.4	-64.2	178.6	0	0	0	107.6	V24 I36 Y53 L452 V454 S470	V24-I472 HydrophobicContact CG2-CD1 4.25Å; I36-I472 HydrophobicContact CB-CD1 4.02Å; I36-I472 HydrophobicContact CD1-CD1 3.63Å; I36-I472 HydrophobicContact CD1-CG2 4.5Å; I36-I472 HydrophobicContact CG1-CD1 4.39Å; I36-I472 HydrophobicContact CG2-CD1 3.58Å; Y53-I472 HydrophobicContact CE2-CD1 4.27Å; L452-I472 HydrophobicContact CD1-CG2 4.03Å; L452-I472 HydrophobicContact CD2-CD1 4.23Å; L452-I472 HydrophobicContact CD2-CG2 3.4Å; L452-I472 VanDerWaalsContact CD2-CG2 3.4Å; L452-I472 HydrophobicContact CG-CG2 3.41Å; L452-I472 VanDerWaalsContact CG-CG2 3.41Å; V454-I472 HydrophobicContact CG2-CG1 4.4Å; S470-I472 PolarHBondContact O-N 3.27Å
473	H	34.9	Very low	31.6	Very low	18 Å²	18	75.1 Å²	75.1	8%	0.083	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.8	-179.6	-67.9	-74.5	0	0	0	109.8	V73 D76 C453 R471	V73-H473 HydrophobicContact CG1-CB 4.06Å; V73-H473 VanDerWaalsContact CG1-ND1 3.31Å; V73-H473 WeakPolarHBondContact CG1-ND1 3.3Å; V73-H473 HydrophobicContact CG2-CB 4.18Å; D76-H473 IonicContact OD1-CE1 3.85Å; D76-H473 IonicContact OD2-CE1 3.91Å; C453-H473 PolarHBondContact N-O 3.26Å; C453-H473 VanDerWaalsContact N-O 3.1Å; C453-H473 PolarHBondContact O-N 2.68Å; C453-H473 VanDerWaalsContact O-O 3.13Å; R471-H473 PolarHBondContact O-CD2 3.32Å; R471-H473 VanDerWaalsContact O-CD2 3.3Å
474	Y	35.5	Very low	31.9	Very low	2 Å²	2	75.5 Å²	75.5	1%	0.008	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	120.4	169.4	-75.8	-76.9	0	0	0	109.9	F62 V74 D75 I77 L411 Y450 L452	F62-Y474 AromaticContact CD1-CE2 3.77Å; F62-Y474 HydrophobicContact CD1-CE2 3.77Å; F62-Y474 AromaticContact CD1-CZ 3.74Å; F62-Y474 AromaticContact CE1-CE2 3.51Å; F62-Y474 HydrophobicContact CE1-CE2 3.51Å; F62-Y474 AromaticContact CE1-CZ 3.54Å; F62-Y474 WeakPolarHBondContact CE1-OH 3Å; V74-Y474 PolarHBondContact N-O 3.18Å; D75-Y474 HydrophobicContact CB-CD2 4.16Å; I77-Y474 HydrophobicContact CD1-CE2 3.75Å; I77-Y474 HydrophobicContact CG1-CE2 3.95Å; I77-Y474 HydrophobicContact CG2-CD2 4.24Å; I77-Y474 HydrophobicContact CG2-CE2 3.8Å; L411-Y474 HydrophobicContact CD2-CE1 3.57Å; L411-Y474 WeakPolarHBondContact CD2-OH 3.16Å; Y450-Y474 HydrophobicContact CD1-CD1 4.39Å; Y450-Y474 HydrophobicContact CG-CD1 4.47Å; L452-Y474 HydrophobicContact CD1-CE1 4.06Å
475	I	31.1	Very low	32.3	Very low	63 Å²	63	71.9 Å²	71.9	32%	0.323	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.1	171.2	-54.8	-177.7	0	0	0	107.6	Q451 C453	Q451-I475 WeakPolarHBondContact CB-O 3.45Å; Q451-I475 PolarHBondContact N-O 2.81Å; Q451-I475 PolarHBondContact O-N 3.06Å; C453-I475 HydrophobicContact CB-CD1 3.61Å; C453-I475 HydrophobicContact CB-CG1 3.93Å
476	K	32.8	Very low	32.4	Very low	84 Å²	84	73.1 Å²	73.1	37%	0.365	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-73.7	123.2	170.5	178	-176.9	179.6	-166.7	0	108.1	I65 V74	I65-K476 HydrophobicContact CD1-CD 4Å; I65-K476 HydrophobicContact CG1-CD 4.2Å; V74-K476 HydrophobicContact CG2-CB 3.74Å
477	L	29.6	Very low	32.5	Very low	43 Å²	43	74.1 Å²	74.1	23%	0.225	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-74.2	129.7	165.7	-78.5	163.7	0	0	0	108.2	Q451 N479	Q451-L477 HydrophobicContact CB-CD1 4.25Å; Q451-L477 HydrophobicContact CB-CG 4.39Å; Q451-L477 VanDerWaalsContact OE1-CD1 3.25Å; Q451-L477 VanDerWaalsContact OE1-CG 3.28Å; L477-N479 PolarHBondContact O-N 2.9Å
478	F	27.6	Very low	32.7	Very low	141 Å²	141	71.6 Å²	71.6	62%	0.618	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-64.5	127.2	177.7	-84.4	-91.8	0	0	0	110.2	I480	F478-I480 HydrophobicContact CB-CG1 3.87Å; F478-I480 PolarHBondContact O-N 3.04Å
479	N	24.9	Very low	32.6	Very low	133 Å²	133	72.8 Å²	72.8	71%	0.711	35%	0.352	S	S	*	.			trans	-71.6	106.6	151.4	-114.3	-55.5	0	0	0	106.6	D449 L477	D449-N479 PolarHBondContact OD2-ND2 3.12Å; L477-N479 PolarHBondContact O-N 2.9Å
480	I	25.1	Very low	32.2	Very low	171 Å²	171	73.5 Å²	73.5	88%	0.877	35%	0.352	S	S	*	.			trans	-102.5	0	173.4	-57.9	168.3	0	0	0	108.9	K377 F478	K377-I480 HydrophobicContact CD-CD1 4.23Å; K377-I480 PolarHBondContact NZ-O 3.13Å; K377-I480 VanDerWaalsContact NZ-O 3.09Å; F478-I480 HydrophobicContact CB-CG1 3.87Å; F478-I480 PolarHBondContact O-N 3.04Å

Retrieved 480 of 480 residues in 137.7 ms (Link to these results)

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