A0A5K4F7J0_SCHMA Loading...

Shisa N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F7J0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 250 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	39.1	Very low	62	Low	238 Å²	238	94.5 Å²	94.5	100%	1.172	50%	0.502	S	S	*	.				0	96.5	0	-71.9	-177.7	163.2	0	0	107.9	S3	M1-S3 PolarHBondContact O-N 2.93Å
2	H	45.6	Very low	62.3	Low	194 Å²	194	88.9 Å²	88.9	90%	0.898	47%	0.47	S	S	*	.			trans	-74.8	107.5	176.8	-64.8	-43.3	0	0	0	107.9	L4	H2-L4 PolarHBondContact O-N 3.37Å
3	S	49.4	Very low	62.6	Low	68 Å²	68	82.5 Å²	82.5	48%	0.476	44%	0.437	S	S	.	.			trans	-67.2	119.3	-177.9	-165.8	0	0	0	0	108.8	M1 N5	M1-S3 PolarHBondContact O-N 2.93Å; S3-N5 PolarHBondContact O-N 2.8Å; S3-N5 WeakPolarHBondContact OG-CB 3.42Å; S3-N5 VanDerWaalsContact OG-CG 3.29Å; S3-N5 PolarHBondContact OG-ND2 2.89Å
4	L	58.3	Low	62.8	Low	131 Å²	131	87.8 Å²	87.8	69%	0.686	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-61.9	1.4	171.9	-73.1	158.6	0	0	0	112.6	H2 L6 V7	H2-L4 PolarHBondContact O-N 3.37Å; L4-L6 PolarHBondContact O-N 3.48Å; L4-V7 PolarHBondContact O-N 3.3Å
5	N	61	Low	62.8	Low	120 Å²	120	88.7 Å²	88.7	64%	0.642	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-63.3	-13.9	177.4	-77.6	-12.7	0	0	0	114.8	S3 Y40	S3-N5 PolarHBondContact O-N 2.8Å; S3-N5 WeakPolarHBondContact OG-CB 3.42Å; S3-N5 VanDerWaalsContact OG-CG 3.29Å; S3-N5 PolarHBondContact OG-ND2 2.89Å; N5-Y40 VanDerWaalsContact O-CD1 3.31Å; N5-Y40 WeakPolarHBondContact O-CD1 3.17Å; N5-Y40 WeakPolarHBondContact O-CE1 3.45Å
6	L	67.9	Low	62.5	Low	86 Å²	86	88.6 Å²	88.6	45%	0.45	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-84.4	-14.3	177.6	-75.2	79.9	0	0	0	112.9	L4 E41 Y42	L4-L6 PolarHBondContact O-N 3.48Å; L6-E41 PolarHBondContact O-N 2.99Å; L6-Y42 HydrophobicContact CB-CD2 4.35Å; L6-Y42 PolarHBondContact O-N 3.49Å
7	V	72.1	Confident	62	Low	38 Å²	38	86.9 Å²	86.9	23%	0.23	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	118.5	-172.4	-170.1	0	0	0	0	110.9	L4 I9 Y42 V44	L4-V7 PolarHBondContact O-N 3.3Å; V7-I9 HydrophobicContact CG1-CG1 4.31Å; V7-I9 PolarHBondContact O-N 3.37Å; V7-Y42 CarbonylContact C-O 3.55Å; V7-Y42 WeakPolarHBondContact CA-O 3.39Å; V7-V44 HydrophobicContact CG1-CG2 3.88Å
8	Y	74.3	Confident	61.4	Low	38 Å²	38	89 Å²	89	15%	0.149	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	111.4	168.9	-177.8	-102.8	0	0	0	110.4	P10 F35 Y40 Y42 F43 V44	Y8-P10 HydrophobicContact CD1-CG 4.39Å; Y8-P10 HydrophobicContact CE1-CB 4.4Å; Y8-P10 HydrophobicContact CE1-CG 4.05Å; Y8-F35 HydrophobicContact CD1-CD1 4.05Å; Y8-F35 AromaticContact CD1-CD2 3.77Å; Y8-F35 HydrophobicContact CD1-CD2 3.77Å; Y8-F35 HydrophobicContact CD1-CE1 4.1Å; Y8-F35 AromaticContact CD1-CE2 3.79Å; Y8-F35 HydrophobicContact CD1-CE2 3.79Å; Y8-F35 AromaticContact CD1-CG 3.89Å; Y8-F35 HydrophobicContact CD1-CG 3.89Å; Y8-F35 AromaticContact CD1-CZ 3.97Å; Y8-F35 HydrophobicContact CD1-CZ 3.97Å; Y8-F35 HydrophobicContact CD2-CB 3.59Å; Y8-F35 AromaticContact CD2-CD2 3.9Å; Y8-F35 HydrophobicContact CD2-CD2 3.9Å; Y8-F35 AromaticContact CD2-CG 3.77Å; Y8-F35 HydrophobicContact CD2-CG 3.77Å; Y8-F35 AromaticContact CE1-CD1 3.76Å; Y8-F35 HydrophobicContact CE1-CD1 3.76Å; Y8-F35 HydrophobicContact CE1-CD2 4.31Å; Y8-F35 AromaticContact CE1-CE1 3.93Å; Y8-F35 HydrophobicContact CE1-CE1 3.93Å; Y8-F35 HydrophobicContact CE1-CE2 4.44Å; Y8-F35 AromaticContact CE1-CG 3.96Å; Y8-F35 HydrophobicContact CE1-CG 3.96Å; Y8-F35 HydrophobicContact CE1-CZ 4.27Å; Y8-F35 HydrophobicContact CE2-CB 3.51Å; Y8-F35 HydrophobicContact CE2-CD1 4.24Å; Y8-F35 HydrophobicContact CE2-CD2 4.42Å; Y8-F35 AromaticContact CE2-CG 3.84Å; Y8-F35 HydrophobicContact CE2-CG 3.84Å; Y8-F35 HydrophobicContact CG-CB 4.14Å; Y8-F35 HydrophobicContact CG-CD1 4.41Å; Y8-F35 AromaticContact CG-CD2 3.53Å; Y8-F35 HydrophobicContact CG-CD2 3.53Å; Y8-F35 AromaticContact CG-CE2 3.93Å; Y8-F35 HydrophobicContact CG-CE2 3.93Å; Y8-F35 AromaticContact CG-CG 3.79Å; Y8-F35 HydrophobicContact CG-CG 3.79Å; Y8-F35 AromaticContact CZ-CD1 3.85Å; Y8-F35 AromaticContact CZ-CG 3.92Å; Y8-Y40 AromaticContact CD2-CD2 3.83Å; Y8-Y40 HydrophobicContact CD2-CD2 3.83Å; Y8-Y40 AromaticContact CD2-CE2 3.64Å; Y8-Y40 HydrophobicContact CD2-CE2 3.64Å; Y8-Y40 HydrophobicContact CG-CD2 4.19Å; Y8-Y40 HydrophobicContact CG-CE2 4.43Å; Y8-Y42 PolarHBondContact N-O 3.3Å; Y8-F43 HydrophobicContact CD1-CB 4.48Å; Y8-V44 PolarHBondContact O-N 3.36Å; Y8-V44 VanDerWaalsContact O-N 3.07Å
9	I	73.6	Confident	61	Low	33 Å²	33	88.1 Å²	88.1	17%	0.169	49%	0.487	C	S	.	.			trans	-103.7	114	172.1	-55.2	173.4	0	0	0	108.1	V7 L13 R14 V44	V7-I9 HydrophobicContact CG1-CG1 4.31Å; V7-I9 PolarHBondContact O-N 3.37Å; I9-L13 HydrophobicContact CG2-CB 3.88Å; I9-R14 HydrophobicContact CB-CG 4.21Å; I9-R14 HydrophobicContact CG2-CG 3.8Å; I9-R14 PolarHBondContact O-NE 3Å; I9-V44 HydrophobicContact CG1-CG2 4.35Å
10	P	71.1	Confident	60.7	Low	1 Å²	1	89.5 Å²	89.5	1%	0.006	50%	0.498	C	S	.	.			trans	-53.6	144.5	175.1	-23.2	29.4	0	0	0	112.6	Y8 F12 L13 R14 P46	Y8-P10 HydrophobicContact CD1-CG 4.39Å; Y8-P10 HydrophobicContact CE1-CB 4.4Å; Y8-P10 HydrophobicContact CE1-CG 4.05Å; P10-F12 HydrophobicContact CB-CD1 3.52Å; P10-F12 HydrophobicContact CB-CE1 3.16Å; P10-F12 HydrophobicContact CB-CG 4.37Å; P10-F12 HydrophobicContact CB-CZ 3.77Å; P10-F12 HydrophobicContact CG-CE1 3.9Å; P10-F12 HydrophobicContact CG-CZ 4.11Å; P10-F12 PolarHBondContact O-N 3.23Å; P10-F12 VanDerWaalsContact O-N 3.15Å; P10-L13 HydrophobicContact CG-CD1 4.3Å; P10-L13 PolarHBondContact O-N 3.46Å; P10-R14 PolarHBondContact O-N 3.34Å; P10-P46 WeakPolarHBondContact CG-O 3.19Å
11	S	69.3	Low	60.3	Low	92 Å²	92	92.4 Å²	92.4	64%	0.643	51%	0.508	S	S	*	.	H	α-helix	trans	-56.3	-34.3	-175.6	50.5	0	0	0	0	113.9	L13 R14 S15	S11-L13 VanDerWaalsContact C-N 3.3Å; S11-L13 PolarHBondContact O-N 2.95Å; S11-R14 WeakPolarHBondContact O-CB 3.37Å; S11-R14 PolarHBondContact O-N 2.89Å; S11-S15 PolarHBondContact O-N 3.08Å; S11-S15 VanDerWaalsContact O-N 3.14Å
12	F	66.7	Low	61.1	Low	28 Å²	28	87.1 Å²	87.1	12%	0.123	48%	0.475	C	S	.	.	H	α-helix	trans	-72	-21.5	177.5	67.9	-94.4	0	0	0	114	P10 S15 P46 L49	P10-F12 HydrophobicContact CB-CD1 3.52Å; P10-F12 HydrophobicContact CB-CE1 3.16Å; P10-F12 HydrophobicContact CB-CG 4.37Å; P10-F12 HydrophobicContact CB-CZ 3.77Å; P10-F12 HydrophobicContact CG-CE1 3.9Å; P10-F12 HydrophobicContact CG-CZ 4.11Å; P10-F12 PolarHBondContact O-N 3.23Å; P10-F12 VanDerWaalsContact O-N 3.15Å; F12-S15 PolarHBondContact O-OG 3.38Å; F12-P46 HydrophobicContact CE2-CG 4.1Å; F12-P46 HydrophobicContact CZ-CB 4.41Å; F12-P46 HydrophobicContact CZ-CG 3.9Å; F12-P46 WeakPolarHBondContact CZ-O 3.45Å; F12-L49 HydrophobicContact CB-CD1 3.97Å; F12-L49 HydrophobicContact CD1-CB 4.06Å; F12-L49 HydrophobicContact CD1-CD1 4.35Å; F12-L49 HydrophobicContact CD2-CD1 3.49Å; F12-L49 VanDerWaalsContact CD2-CD1 3.49Å; F12-L49 HydrophobicContact CE1-CB 4.4Å; F12-L49 HydrophobicContact CE2-CD1 3.97Å; F12-L49 HydrophobicContact CG-CB 4.18Å; F12-L49 HydrophobicContact CG-CD1 3.69Å
13	L	65.5	Low	61.8	Low	6 Å²	6	81.5 Å²	81.5	3%	0.031	45%	0.451	C	S	.	.	H	α-helix	trans	-86.4	-32.2	170.8	-65	-176.2	0	0	0	110.9	I9 P10 S11 S15 Q16 G17 Y26 V44	I9-L13 HydrophobicContact CG2-CB 3.88Å; P10-L13 HydrophobicContact CG-CD1 4.3Å; P10-L13 PolarHBondContact O-N 3.46Å; S11-L13 VanDerWaalsContact C-N 3.3Å; S11-L13 PolarHBondContact O-N 2.95Å; L13-S15 VanDerWaalsContact C-N 3.26Å; L13-S15 PolarHBondContact O-N 3.48Å; L13-Q16 CarbonylContact O-C 3.55Å; L13-Q16 PolarHBondContact O-N 3.32Å; L13-G17 PolarHBondContact O-N 3.25Å; L13-Y26 HydrophobicContact CD1-CD1 4.26Å; L13-Y26 HydrophobicContact CD1-CD2 4.4Å; L13-Y26 HydrophobicContact CD1-CE1 4.44Å; L13-Y26 HydrophobicContact CD1-CG 4.23Å; L13-Y26 HydrophobicContact CD2-CD1 4.36Å; L13-Y26 HydrophobicContact CD2-CD2 4.29Å; L13-Y26 HydrophobicContact CD2-CE1 3.75Å; L13-Y26 HydrophobicContact CD2-CE2 3.67Å; L13-Y26 WeakPolarHBondContact CD2-OH 3.28Å; L13-V44 HydrophobicContact CD1-CB 4.27Å; L13-V44 HydrophobicContact CD1-CG1 3.59Å
14	R	66.1	Low	62.3	Low	156 Å²	156	88 Å²	88	59%	0.589	47%	0.466	S	S	*	.	H	α-helix	trans	-59	-38.4	171.6	-70	-171.2	-176.2	-168.8	-3.4	111.8	I9 P10 S11 Q16 G17	I9-R14 HydrophobicContact CB-CG 4.21Å; I9-R14 HydrophobicContact CG2-CG 3.8Å; I9-R14 PolarHBondContact O-NE 3Å; P10-R14 PolarHBondContact O-N 3.34Å; S11-R14 WeakPolarHBondContact O-CB 3.37Å; S11-R14 PolarHBondContact O-N 2.89Å; R14-Q16 PolarHBondContact O-N 2.83Å; R14-G17 WeakPolarHBondContact O-CA 3.22Å; R14-G17 PolarHBondContact O-N 3.2Å
15	S	61.7	Low	62.6	Low	102 Å²	102	86.9 Å²	86.9	71%	0.713	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.4	176.1	59.8	0	0	0	0	114.1	S11 F12 L13 G17	S11-S15 PolarHBondContact O-N 3.08Å; S11-S15 VanDerWaalsContact O-N 3.14Å; F12-S15 PolarHBondContact O-OG 3.38Å; L13-S15 VanDerWaalsContact C-N 3.26Å; L13-S15 PolarHBondContact O-N 3.48Å; S15-G17 VanDerWaalsContact C-N 3.35Å
16	Q	59.1	Low	63.1	Low	87 Å²	87	82.6 Å²	82.6	41%	0.407	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	1.1	171.3	-62	-168	38.9	0	0	112.4	L13 R14 S18	L13-Q16 CarbonylContact O-C 3.55Å; L13-Q16 PolarHBondContact O-N 3.32Å; R14-Q16 PolarHBondContact O-N 2.83Å; Q16-S18 PolarHBondContact O-N 2.76Å; Q16-S18 VanDerWaalsContact O-N 3.09Å
17	G	53.2	Low	63.3	Low	60 Å²	60	79.4 Å²	79.4	62%	0.619	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	41.2	-158.2	0	0	0	0	0	117.4	L13 R14 S15	L13-G17 PolarHBondContact O-N 3.25Å; R14-G17 WeakPolarHBondContact O-CA 3.22Å; R14-G17 PolarHBondContact O-N 3.2Å; S15-G17 VanDerWaalsContact C-N 3.35Å
18	S	51.2	Low	63.7	Low	124 Å²	124	81.4 Å²	81.4	87%	0.867	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-3.9	163.2	-160.6	0	0	0	0	113.4	Q16	Q16-S18 PolarHBondContact O-N 2.76Å; Q16-S18 VanDerWaalsContact O-N 3.09Å
19	D	53.8	Low	63.9	Low	71 Å²	71	79.6 Å²	79.6	38%	0.38	43%	0.425	S	S	.	.			trans	-126.2	89.5	-168.3	-148.2	5.6	0	0	0	109.4	E21 R22	D19-E21 PolarHBondContact O-N 3.06Å; D19-E21 VanDerWaalsContact O-N 3.09Å; D19-R22 HydrophobicContact CB-CG 4.2Å; D19-R22 PolarHBondContact O-N 2.98Å; D19-R22 IonicContact OD2-NE 3.3Å; D19-R22 PolarHBondContact OD2-NE 3.37Å
20	V	55.1	Low	64.2	Low	117 Å²	117	81.3 Å²	81.3	71%	0.709	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-56.7	-26.5	-176.9	-176.4	0	0	0	0	111.2	R22 L23	V20-R22 PolarHBondContact O-N 2.91Å; V20-L23 WeakPolarHBondContact O-CB 3.41Å; V20-L23 PolarHBondContact O-N 3.3Å; V20-L23 VanDerWaalsContact O-N 3.11Å
21	E	53.1	Low	64.3	Low	150 Å²	150	81.7 Å²	81.7	70%	0.701	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-61.7	-27.3	176.6	-73.1	-169.1	149	0	0	113.5	D19 L23	D19-E21 PolarHBondContact O-N 3.06Å; D19-E21 VanDerWaalsContact O-N 3.09Å; E21-L23 VanDerWaalsContact C-N 3.29Å; E21-L23 PolarHBondContact O-N 3.48Å
22	R	56.1	Low	64.5	Low	128 Å²	128	81 Å²	81	48%	0.483	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-77.4	-17.3	178.5	-63.5	-174.8	-174.5	-155.4	-2.9	112.9	D19 V20 Y24 Q25 Y26	D19-R22 HydrophobicContact CB-CG 4.2Å; D19-R22 PolarHBondContact O-N 2.98Å; D19-R22 IonicContact OD2-NE 3.3Å; D19-R22 PolarHBondContact OD2-NE 3.37Å; V20-R22 PolarHBondContact O-N 2.91Å; R22-Y24 VanDerWaalsContact C-N 3.26Å; R22-Y24 PolarHBondContact O-N 3.26Å; R22-Q25 PolarHBondContact O-N 2.75Å; R22-Y26 VanDerWaalsContact O-CD2 3.28Å; R22-Y26 WeakPolarHBondContact O-CD2 3.45Å; R22-Y26 WeakPolarHBondContact O-CE2 3.34Å
23	L	59.6	Low	64.6	Low	75 Å²	75	84.7 Å²	84.7	39%	0.393	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-68.7	-26.6	179	-129	74	0	0	0	112.3	V20 E21 Q25 Y26	V20-L23 WeakPolarHBondContact O-CB 3.41Å; V20-L23 PolarHBondContact O-N 3.3Å; V20-L23 VanDerWaalsContact O-N 3.11Å; E21-L23 VanDerWaalsContact C-N 3.29Å; E21-L23 PolarHBondContact O-N 3.48Å; L23-Q25 PolarHBondContact O-N 2.78Å; L23-Q25 VanDerWaalsContact O-N 3.11Å; L23-Y26 PolarHBondContact O-N 2.89Å
24	Y	60.1	Low	64.8	Low	204 Å²	204	89.5 Å²	89.5	80%	0.8	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-62.3	-17.1	175.4	-73.5	-78.8	0	0	0	113.9	R22 Y26	R22-Y24 VanDerWaalsContact C-N 3.26Å; R22-Y24 PolarHBondContact O-N 3.26Å; Y24-Y26 VanDerWaalsContact C-N 3.31Å
25	Q	64.9	Low	65	Low	108 Å²	108	84 Å²	84	51%	0.505	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-82.9	-10.1	177.2	-61	-172.9	9.2	0	0	113.3	R22 L23	R22-Q25 PolarHBondContact O-N 2.75Å; L23-Q25 PolarHBondContact O-N 2.78Å; L23-Q25 VanDerWaalsContact O-N 3.11Å
26	Y	70.3	Confident	65.3	Low	31 Å²	31	86.7 Å²	86.7	12%	0.122	45%	0.454	C	S	.	.	S	Bend	trans	-112.8	138.3	-175.5	-60.6	-74.1	0	0	0	110.7	L13 R22 L23 Y24 V44 C45	L13-Y26 HydrophobicContact CD1-CD1 4.26Å; L13-Y26 HydrophobicContact CD1-CD2 4.4Å; L13-Y26 HydrophobicContact CD1-CE1 4.44Å; L13-Y26 HydrophobicContact CD1-CG 4.23Å; L13-Y26 HydrophobicContact CD2-CD1 4.36Å; L13-Y26 HydrophobicContact CD2-CD2 4.29Å; L13-Y26 HydrophobicContact CD2-CE1 3.75Å; L13-Y26 HydrophobicContact CD2-CE2 3.67Å; L13-Y26 WeakPolarHBondContact CD2-OH 3.28Å; R22-Y26 VanDerWaalsContact O-CD2 3.28Å; R22-Y26 WeakPolarHBondContact O-CD2 3.45Å; R22-Y26 WeakPolarHBondContact O-CE2 3.34Å; L23-Y26 PolarHBondContact O-N 2.89Å; Y24-Y26 VanDerWaalsContact C-N 3.31Å; Y26-V44 HydrophobicContact CG-CG1 4.34Å; Y26-C45 WeakPolarHBondContact CB-O 3.48Å; Y26-C45 VanDerWaalsContact CD1-O 3.27Å; Y26-C45 WeakPolarHBondContact CD1-O 3.42Å
27	G	72.2	Confident	65.7	Low	18 Å²	18	85.7 Å²	85.7	19%	0.186	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	135.1	175.1	0	0	0	0	0	111.3	C45 R61	G27-C45 PolarHBondContact O-N 2.84Å; G27-R61 WeakPolarHBondContact CA-O 3.04Å; G27-R61 PolarHBondContact N-O 3.32Å
28	V	79.8	Confident	66.5	Low	80 Å²	80	88.4 Å²	88.4	49%	0.485	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.9	171.4	-175.9	0	0	0	0	108.3	Y42 V44 C63	V28-Y42 HydrophobicContact CG1-CD1 4.28Å; V28-V44 HydrophobicContact CG2-CG2 4.41Å; V28-C63 PolarHBondContact O-SG 3.48Å; V28-C63 VanDerWaalsContact O-SG 3.36Å
29	C	80	Confident	67.6	Low	0 Å²	0	88.8 Å²	88.8	0%	0	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	140.5	-177.8	-54.9	0	0	0	0	110.4	Y42 F43 C45 C63 Q70	C29-Y42 CarbonylContact O-C 3.57Å; C29-Y42 WeakPolarHBondContact O-CA 3.34Å; C29-F43 HydrophobicContact CB-CD1 3.86Å; C29-F43 HydrophobicContact CB-CD2 4.25Å; C29-F43 HydrophobicContact CB-CE1 3.24Å; C29-F43 HydrophobicContact CB-CE2 3.76Å; C29-F43 HydrophobicContact CB-CG 4.31Å; C29-F43 HydrophobicContact CB-CZ 3.22Å; C29-F43 PolarHBondContact N-O 2.98Å; C29-F43 WeakPolarHBondContact O-CD1 3.41Å; C29-F43 PolarHBondContact O-N 3.45Å; C29-C45 PolarHBondContact SG-SG 2.89Å; C29-C63 WeakPolarHBondContact CA-SG 3.28Å; C29-C63 HydrophobicContact CB-CB 3.88Å; C29-C63 WeakPolarHBondContact CB-SG 3.47Å; C29-C63 PolarHBondContact N-SG 3.49Å; C29-C63 WeakPolarHBondContact SG-CA 3.29Å; C29-C63 WeakPolarHBondContact SG-CB 3.38Å; C29-C63 CovalentContact SG-SG 2.02Å; C29-C63 PolarHBondContact SG-SG 3.41Å; C29-Q70 VanDerWaalsContact CA-OE1 3.23Å; C29-Q70 HydrophobicContact CB-CB 3.99Å
30	Q	79.8	Confident	68.6	Low	70 Å²	70	86.6 Å²	86.6	33%	0.327	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	98.8	174	-168.9	179.2	23.5	0	0	109.5	E41 Y42 Q70	Q30-E41 PolarHBondContact NE2-OE1 2.87Å; Q30-Y42 HydrophobicContact CB-CD1 3.93Å; Q30-Y42 HydrophobicContact CB-CE1 3.8Å; Q30-Y42 HydrophobicContact CG-CD1 4.05Å; Q30-Y42 HydrophobicContact CG-CE1 3.6Å; Q30-Y42 PolarHBondContact NE2-OH 2.97Å; Q30-Y42 VanDerWaalsContact NE2-OH 3.14Å; Q30-Q70 WeakPolarHBondContact O-CG 3.37Å
31	S	72.4	Confident	69.6	Low	8 Å²	8	84.9 Å²	84.9	6%	0.056	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	121.8	171.5	-172.1	0	0	0	0	107.9	R33 E41 F43 P68 Q70	S31-R33 PolarHBondContact O-N 2.88Å; S31-E41 CarbonylContact C-O 3.5Å; S31-E41 PolarHBondContact N-O 3.06Å; S31-E41 VanDerWaalsContact N-O 3.1Å; S31-F43 VanDerWaalsContact CB-CE1 3.44Å; S31-P68 WeakPolarHBondContact CA-O 3.37Å; S31-P68 VanDerWaalsContact CB-O 3.24Å; S31-P68 WeakPolarHBondContact CB-O 3.29Å; S31-P68 PolarHBondContact OG-O 3.48Å; S31-Q70 WeakPolarHBondContact CB-O 3.48Å
32	P	73.3	Confident	70.9	Confident	78 Å²	78	80.6 Å²	80.6	51%	0.506	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	106.6	169.6	25.1	-31.6	0	0	0	108.3	I39 Y40 P68	P32-I39 HydrophobicContact CB-CG2 4.1Å; P32-Y40 VanDerWaalsContact CA-O 3.3Å; P32-Y40 WeakPolarHBondContact CA-O 3.3Å; P32-P68 WeakPolarHBondContact CD-O 3.45Å; P32-P68 HydrophobicContact CG-CB 4.15Å
33	R	68.8	Low	72.1	Confident	105 Å²	105	74.7 Å²	74.7	40%	0.396	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.2	-178.3	-75.3	-104.3	-173	176.4	1.4	108.5	S31 F35 Y40 F43 Q70	S31-R33 PolarHBondContact O-N 2.88Å; R33-F35 HydrophobicContact CB-CD2 3.85Å; R33-F35 HydrophobicContact CB-CE2 3.35Å; R33-F35 HydrophobicContact CB-CZ 4.02Å; R33-F35 HydrophobicContact CG-CE2 4.2Å; R33-F35 PolarHBondContact O-N 3.24Å; R33-Y40 PolarHBondContact N-O 3.42Å; R33-Y40 VanDerWaalsContact N-O 3.17Å; R33-Y40 PolarHBondContact O-N 3.36Å; R33-Y40 VanDerWaalsContact O-N 3.1Å; R33-F43 HydrophobicContact CG-CD1 4.2Å; R33-F43 HydrophobicContact CG-CE1 4.32Å; R33-Q70 PolarHBondContact NH2-O 3.4Å
34	D	70.9	Confident	73.1	Confident	108 Å²	108	71.1 Å²	71.1	58%	0.578	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	115.3	169	-170.3	-19.1	0	0	0	108.8	G37 Q38	D34-G37 WeakPolarHBondContact OD1-CA 3.26Å; D34-G37 PolarHBondContact OD1-N 3.14Å; D34-Q38 PolarHBondContact OD1-N 3.42Å
35	F	69.7	Low	73.9	Confident	40 Å²	40	61.4 Å²	61.4	18%	0.175	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	114.4	167.2	-67	-79.5	0	0	0	108.1	Y8 R33 G37 Q38 Y40 F43 T47	Y8-F35 HydrophobicContact CD1-CD1 4.05Å; Y8-F35 AromaticContact CD1-CD2 3.77Å; Y8-F35 HydrophobicContact CD1-CD2 3.77Å; Y8-F35 HydrophobicContact CD1-CE1 4.1Å; Y8-F35 AromaticContact CD1-CE2 3.79Å; Y8-F35 HydrophobicContact CD1-CE2 3.79Å; Y8-F35 AromaticContact CD1-CG 3.89Å; Y8-F35 HydrophobicContact CD1-CG 3.89Å; Y8-F35 AromaticContact CD1-CZ 3.97Å; Y8-F35 HydrophobicContact CD1-CZ 3.97Å; Y8-F35 HydrophobicContact CD2-CB 3.59Å; Y8-F35 AromaticContact CD2-CD2 3.9Å; Y8-F35 HydrophobicContact CD2-CD2 3.9Å; Y8-F35 AromaticContact CD2-CG 3.77Å; Y8-F35 HydrophobicContact CD2-CG 3.77Å; Y8-F35 AromaticContact CE1-CD1 3.76Å; Y8-F35 HydrophobicContact CE1-CD1 3.76Å; Y8-F35 HydrophobicContact CE1-CD2 4.31Å; Y8-F35 AromaticContact CE1-CE1 3.93Å; Y8-F35 HydrophobicContact CE1-CE1 3.93Å; Y8-F35 HydrophobicContact CE1-CE2 4.44Å; Y8-F35 AromaticContact CE1-CG 3.96Å; Y8-F35 HydrophobicContact CE1-CG 3.96Å; Y8-F35 HydrophobicContact CE1-CZ 4.27Å; Y8-F35 HydrophobicContact CE2-CB 3.51Å; Y8-F35 HydrophobicContact CE2-CD1 4.24Å; Y8-F35 HydrophobicContact CE2-CD2 4.42Å; Y8-F35 AromaticContact CE2-CG 3.84Å; Y8-F35 HydrophobicContact CE2-CG 3.84Å; Y8-F35 HydrophobicContact CG-CB 4.14Å; Y8-F35 HydrophobicContact CG-CD1 4.41Å; Y8-F35 AromaticContact CG-CD2 3.53Å; Y8-F35 HydrophobicContact CG-CD2 3.53Å; Y8-F35 AromaticContact CG-CE2 3.93Å; Y8-F35 HydrophobicContact CG-CE2 3.93Å; Y8-F35 AromaticContact CG-CG 3.79Å; Y8-F35 HydrophobicContact CG-CG 3.79Å; Y8-F35 AromaticContact CZ-CD1 3.85Å; Y8-F35 AromaticContact CZ-CG 3.92Å; R33-F35 HydrophobicContact CB-CD2 3.85Å; R33-F35 HydrophobicContact CB-CE2 3.35Å; R33-F35 HydrophobicContact CB-CZ 4.02Å; R33-F35 HydrophobicContact CG-CE2 4.2Å; R33-F35 PolarHBondContact O-N 3.24Å; F35-G37 VanDerWaalsContact C-N 3.31Å; F35-G37 PolarHBondContact O-N 3.39Å; F35-Q38 PolarHBondContact N-O 2.78Å; F35-Q38 PolarHBondContact O-N 2.81Å; F35-Y40 HydrophobicContact CB-CD2 4.18Å; F35-Y40 HydrophobicContact CB-CE2 4.22Å; F35-Y40 HydrophobicContact CD2-CD2 4.17Å; F35-F43 HydrophobicContact CE2-CB 3.75Å; F35-F43 HydrophobicContact CE2-CG 4.24Å; F35-F43 HydrophobicContact CZ-CB 4.2Å; F35-F43 HydrophobicContact CZ-CG 4.39Å; F35-T47 HydrophobicContact CE1-CG2 4.35Å; F35-T47 HydrophobicContact CZ-CG2 4.02Å
36	N	66.9	Low	74.2	Confident	159 Å²	159	56.9 Å²	56.9	85%	0.85	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	36.3	178.5	-60.6	-12.5	0	0	0	114.7	Q38	N36-Q38 VanDerWaalsContact C-N 3.33Å
37	G	68.9	Low	74.1	Confident	65 Å²	65	57.5 Å²	57.5	67%	0.67	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	8.6	178.8	0	0	0	0	0	114.2	D34 F35	D34-G37 WeakPolarHBondContact OD1-CA 3.26Å; D34-G37 PolarHBondContact OD1-N 3.14Å; F35-G37 VanDerWaalsContact C-N 3.31Å; F35-G37 PolarHBondContact O-N 3.39Å
38	Q	69.9	Low	73.7	Confident	117 Å²	117	59.9 Å²	59.9	55%	0.547	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.1	172.1	-67.9	-171.5	24.1	0	0	110.1	D34 F35 N36 Y40	D34-Q38 PolarHBondContact OD1-N 3.42Å; F35-Q38 PolarHBondContact N-O 2.78Å; F35-Q38 PolarHBondContact O-N 2.81Å; N36-Q38 VanDerWaalsContact C-N 3.33Å; Q38-Y40 HydrophobicContact CB-CD2 4.34Å; Q38-Y40 HydrophobicContact CB-CE2 3.65Å; Q38-Y40 WeakPolarHBondContact O-CD2 3.4Å; Q38-Y40 PolarHBondContact OE1-OH 2.93Å
39	I	74	Confident	72.8	Confident	132 Å²	132	61.5 Å²	61.5	68%	0.677	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	116.2	176.5	-58	172.8	0	0	0	108.1	P32	P32-I39 HydrophobicContact CB-CG2 4.1Å
40	Y	74.7	Confident	71.5	Confident	25 Å²	25	66.1 Å²	66.1	10%	0.098	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	135.4	172.6	-63.9	-86.5	0	0	0	109.7	N5 Y8 P32 R33 F35 Q38 Y42	N5-Y40 VanDerWaalsContact O-CD1 3.31Å; N5-Y40 WeakPolarHBondContact O-CD1 3.17Å; N5-Y40 WeakPolarHBondContact O-CE1 3.45Å; Y8-Y40 AromaticContact CD2-CD2 3.83Å; Y8-Y40 HydrophobicContact CD2-CD2 3.83Å; Y8-Y40 AromaticContact CD2-CE2 3.64Å; Y8-Y40 HydrophobicContact CD2-CE2 3.64Å; Y8-Y40 HydrophobicContact CG-CD2 4.19Å; Y8-Y40 HydrophobicContact CG-CE2 4.43Å; P32-Y40 VanDerWaalsContact CA-O 3.3Å; P32-Y40 WeakPolarHBondContact CA-O 3.3Å; R33-Y40 PolarHBondContact N-O 3.42Å; R33-Y40 VanDerWaalsContact N-O 3.17Å; R33-Y40 PolarHBondContact O-N 3.36Å; R33-Y40 VanDerWaalsContact O-N 3.1Å; F35-Y40 HydrophobicContact CB-CD2 4.18Å; F35-Y40 HydrophobicContact CB-CE2 4.22Å; F35-Y40 HydrophobicContact CD2-CD2 4.17Å; Q38-Y40 HydrophobicContact CB-CD2 4.34Å; Q38-Y40 HydrophobicContact CB-CE2 3.65Å; Q38-Y40 WeakPolarHBondContact O-CD2 3.4Å; Q38-Y40 PolarHBondContact OE1-OH 2.93Å; Y40-Y42 VanDerWaalsContact C-N 3.33Å
41	E	76.8	Confident	70.1	Confident	81 Å²	81	69.1 Å²	69.1	38%	0.379	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-30.7	178.4	-168.1	-174.4	152.9	0	0	111.6	L6 Q30 S31	L6-E41 PolarHBondContact O-N 2.99Å; Q30-E41 PolarHBondContact NE2-OE1 2.87Å; S31-E41 CarbonylContact C-O 3.5Å; S31-E41 PolarHBondContact N-O 3.06Å; S31-E41 VanDerWaalsContact N-O 3.1Å
42	Y	79.8	Confident	68.9	Low	60 Å²	60	77.6 Å²	77.6	24%	0.235	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.3	178.8	-56.8	-90.6	0	0	0	110.8	L6 V7 Y8 V28 C29 Q30 Y40	L6-Y42 HydrophobicContact CB-CD2 4.35Å; L6-Y42 PolarHBondContact O-N 3.49Å; V7-Y42 CarbonylContact C-O 3.55Å; V7-Y42 WeakPolarHBondContact CA-O 3.39Å; Y8-Y42 PolarHBondContact N-O 3.3Å; V28-Y42 HydrophobicContact CG1-CD1 4.28Å; C29-Y42 CarbonylContact O-C 3.57Å; C29-Y42 WeakPolarHBondContact O-CA 3.34Å; Q30-Y42 HydrophobicContact CB-CD1 3.93Å; Q30-Y42 HydrophobicContact CB-CE1 3.8Å; Q30-Y42 HydrophobicContact CG-CD1 4.05Å; Q30-Y42 HydrophobicContact CG-CE1 3.6Å; Q30-Y42 PolarHBondContact NE2-OH 2.97Å; Q30-Y42 VanDerWaalsContact NE2-OH 3.14Å; Y40-Y42 VanDerWaalsContact C-N 3.33Å
43	F	80.4	Confident	67.8	Low	4 Å²	4	79.2 Å²	79.2	2%	0.018	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	147.9	173.5	68.8	-82.2	0	0	0	111.1	Y8 C29 S31 R33 F35 T47 Q70 C72	Y8-F43 HydrophobicContact CD1-CB 4.48Å; C29-F43 HydrophobicContact CB-CD1 3.86Å; C29-F43 HydrophobicContact CB-CD2 4.25Å; C29-F43 HydrophobicContact CB-CE1 3.24Å; C29-F43 HydrophobicContact CB-CE2 3.76Å; C29-F43 HydrophobicContact CB-CG 4.31Å; C29-F43 HydrophobicContact CB-CZ 3.22Å; C29-F43 PolarHBondContact N-O 2.98Å; C29-F43 WeakPolarHBondContact O-CD1 3.41Å; C29-F43 PolarHBondContact O-N 3.45Å; S31-F43 VanDerWaalsContact CB-CE1 3.44Å; R33-F43 HydrophobicContact CG-CD1 4.2Å; R33-F43 HydrophobicContact CG-CE1 4.32Å; F35-F43 HydrophobicContact CE2-CB 3.75Å; F35-F43 HydrophobicContact CE2-CG 4.24Å; F35-F43 HydrophobicContact CZ-CB 4.2Å; F35-F43 HydrophobicContact CZ-CG 4.39Å; F43-T47 HydrophobicContact CD2-CG2 3.55Å; F43-T47 HydrophobicContact CE2-CG2 4.04Å; F43-Q70 WeakPolarHBondContact CZ-O 3.49Å; F43-C72 VanDerWaalsContact CE2-SG 3.58Å
44	V	80.5	Confident	66.6	Low	1 Å²	1	80.4 Å²	80.4	1%	0.006	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	137.7	-179.6	-174	0	0	0	0	110.6	V7 Y8 I9 L13 Y26 V28 P46	V7-V44 HydrophobicContact CG1-CG2 3.88Å; Y8-V44 PolarHBondContact O-N 3.36Å; Y8-V44 VanDerWaalsContact O-N 3.07Å; I9-V44 HydrophobicContact CG1-CG2 4.35Å; L13-V44 HydrophobicContact CD1-CB 4.27Å; L13-V44 HydrophobicContact CD1-CG1 3.59Å; Y26-V44 HydrophobicContact CG-CG1 4.34Å; V28-V44 HydrophobicContact CG2-CG2 4.41Å; V44-P46 CarbonylContact O-C 3.52Å
45	C	77.4	Confident	65.6	Low	0 Å²	0	77.9 Å²	77.9	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	135.3	176.1	-72.4	0	0	0	0	111.5	Y26 G27 C29 Q60 C72	Y26-C45 WeakPolarHBondContact CB-O 3.48Å; Y26-C45 VanDerWaalsContact CD1-O 3.27Å; Y26-C45 WeakPolarHBondContact CD1-O 3.42Å; G27-C45 PolarHBondContact O-N 2.84Å; C29-C45 PolarHBondContact SG-SG 2.89Å; C45-Q60 CarbonylContact C-O 3.37Å; C45-Q60 WeakPolarHBondContact CB-O 3.26Å; C45-C72 WeakPolarHBondContact CA-SG 3.41Å; C45-C72 HydrophobicContact CB-CB 3.86Å; C45-C72 WeakPolarHBondContact CB-SG 3.31Å; C45-C72 WeakPolarHBondContact SG-CA 3.47Å; C45-C72 WeakPolarHBondContact SG-CB 3.31Å; C45-C72 CovalentContact SG-SG 2.03Å; C45-C72 PolarHBondContact SG-SG 3.41Å
46	P	72.2	Confident	64.8	Low	13 Å²	13	83.3 Å²	83.3	8%	0.084	45%	0.453	C	S	.	.	P	Polyproline II helix	cis	-74.6	152	4	26.2	-27.7	0	0	0	112.2	P10 F12 V44 E59 Q60	P10-P46 WeakPolarHBondContact CG-O 3.19Å; F12-P46 HydrophobicContact CE2-CG 4.1Å; F12-P46 HydrophobicContact CZ-CB 4.41Å; F12-P46 HydrophobicContact CZ-CG 3.9Å; F12-P46 WeakPolarHBondContact CZ-O 3.45Å; V44-P46 CarbonylContact O-C 3.52Å; P46-E59 HydrophobicContact CG-CG 4.34Å; P46-Q60 WeakPolarHBondContact CA-O 3.43Å
47	T	67.7	Low	64.1	Low	44 Å²	44	82 Å²	82	27%	0.27	44%	0.441	S	S	.	.	S	Bend	trans	-86.9	-21.8	176.8	45	0	0	0	0	113.1	F35 F43	F35-T47 HydrophobicContact CE1-CG2 4.35Å; F35-T47 HydrophobicContact CZ-CG2 4.02Å; F43-T47 HydrophobicContact CD2-CG2 3.55Å; F43-T47 HydrophobicContact CE2-CG2 4.04Å
48	S	64.6	Low	63.4	Low	68 Å²	68	79.9 Å²	79.9	48%	0.476	42%	0.416	S	S	.	.	S	Bend	trans	-131.4	137.2	179.1	63.1	0	0	0	0	110.8	N50	S48-N50 PolarHBondContact O-N 2.79Å
49	L	59.5	Low	63.1	Low	114 Å²	114	76.6 Å²	76.6	60%	0.597	40%	0.401	S	S	*	.			trans	-73.1	93.7	172.2	-158.4	85.2	0	0	0	108.9	F12 V51	F12-L49 HydrophobicContact CB-CD1 3.97Å; F12-L49 HydrophobicContact CD1-CB 4.06Å; F12-L49 HydrophobicContact CD1-CD1 4.35Å; F12-L49 HydrophobicContact CD2-CD1 3.49Å; F12-L49 VanDerWaalsContact CD2-CD1 3.49Å; F12-L49 HydrophobicContact CE1-CB 4.4Å; F12-L49 HydrophobicContact CE2-CD1 3.97Å; F12-L49 HydrophobicContact CG-CB 4.18Å; F12-L49 HydrophobicContact CG-CD1 3.69Å; L49-V51 PolarHBondContact O-N 3.31Å
50	N	53.9	Low	62.9	Low	96 Å²	96	73.9 Å²	73.9	51%	0.513	39%	0.385	S	S	.	.			trans	-85	98.6	175.8	-150.7	-21.6	0	0	0	108.1	S48 K52 F53	S48-N50 PolarHBondContact O-N 2.79Å; N50-K52 PolarHBondContact O-N 2.84Å; N50-F53 HydrophobicContact CB-CD2 3.78Å; N50-F53 HydrophobicContact CB-CE2 3.81Å; N50-F53 PolarHBondContact O-N 3.26Å
51	V	48.8	Very low	62.8	Low	134 Å²	134	74.3 Å²	74.3	81%	0.812	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-3.6	-170.9	-170	0	0	0	0	113.5	L49	L49-V51 PolarHBondContact O-N 3.31Å
52	K	48.6	Very low	62.7	Low	186 Å²	186	73 Å²	73	81%	0.809	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	2.7	-174	-93	-176.3	176.2	179.5	0	116.6	N50	N50-K52 PolarHBondContact O-N 2.84Å
53	F	49.2	Very low	62.8	Low	111 Å²	111	71.5 Å²	71.5	49%	0.487	38%	0.378	S	S	.	.			trans	-100.1	98.5	-177.2	-70.4	-54.7	0	0	0	112.2	N50 S55 S58	N50-F53 HydrophobicContact CB-CD2 3.78Å; N50-F53 HydrophobicContact CB-CE2 3.81Å; N50-F53 PolarHBondContact O-N 3.26Å; F53-S55 VanDerWaalsContact C-N 3.29Å; F53-S58 WeakPolarHBondContact CB-OG 3.27Å; F53-S58 WeakPolarHBondContact CD1-OG 3.43Å; F53-S58 VanDerWaalsContact CG-OG 3.22Å; F53-S58 WeakPolarHBondContact CG-OG 3.28Å
54	S	45.2	Very low	62.8	Low	130 Å²	130	72 Å²	72	91%	0.909	38%	0.381	S	S	*	.			trans	-85.5	3.2	174.4	55.5	0	0	0	0	113.6
55	S	49.4	Very low	62.6	Low	56 Å²	56	74.2 Å²	74.2	39%	0.392	41%	0.405	S	S	.	.	S	Bend	trans	-126.4	127.6	178.4	61	0	0	0	0	111.2	F53 E57 S58	F53-S55 VanDerWaalsContact C-N 3.29Å; S55-E57 PolarHBondContact O-N 3.27Å; S55-S58 PolarHBondContact O-N 3.48Å; S55-S58 PolarHBondContact O-OG 3.27Å; S55-S58 PolarHBondContact OG-OG 3.35Å
56	F	52.7	Low	62.5	Low	154 Å²	154	77.5 Å²	77.5	68%	0.675	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-49.5	-24.9	173.1	-118.9	-103.9	0	0	0	113.3	S58	F56-S58 VanDerWaalsContact C-N 3.3Å; F56-S58 PolarHBondContact O-N 2.99Å
57	E	52.1	Low	62.7	Low	131 Å²	131	80.2 Å²	80.2	61%	0.612	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-72.9	-21.3	-178.3	-152.6	176.7	164.6	0	0	113.8	S55 S75	S55-E57 PolarHBondContact O-N 3.27Å; E57-S75 PolarHBondContact O-OG 3.4Å
58	S	53.7	Low	62.8	Low	21 Å²	21	82 Å²	82	15%	0.147	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-99.5	-0.9	-178.6	59.2	0	0	0	0	113.6	F53 S55 F56 Q60	F53-S58 WeakPolarHBondContact CB-OG 3.27Å; F53-S58 WeakPolarHBondContact CD1-OG 3.43Å; F53-S58 VanDerWaalsContact CG-OG 3.22Å; F53-S58 WeakPolarHBondContact CG-OG 3.28Å; S55-S58 PolarHBondContact O-N 3.48Å; S55-S58 PolarHBondContact O-OG 3.27Å; S55-S58 PolarHBondContact OG-OG 3.35Å; F56-S58 VanDerWaalsContact C-N 3.3Å; F56-S58 PolarHBondContact O-N 2.99Å; S58-Q60 PolarHBondContact O-N 3.41Å
59	E	63.7	Low	63.3	Low	48 Å²	48	86.2 Å²	86.2	22%	0.224	47%	0.474	C	S	.	.			trans	-81.5	123.2	-178.9	-151.3	175.9	139.3	0	0	110.5	P46 R61	P46-E59 HydrophobicContact CG-CG 4.34Å; E59-R61 HydrophobicContact CB-CG 4.03Å; E59-R61 VanDerWaalsContact CD-NH2 3.28Å; E59-R61 HydrophobicContact CG-CG 3.9Å; E59-R61 PolarHBondContact O-N 3.33Å; E59-R61 IonicContact OE1-CZ 3.23Å; E59-R61 IonicContact OE1-NE 3.28Å; E59-R61 PolarHBondContact OE1-NE 2.97Å; E59-R61 IonicContact OE1-NH2 2.82Å; E59-R61 PolarHBondContact OE1-NH2 3.4Å; E59-R61 IonicContact OE2-CZ 2.69Å; E59-R61 VanDerWaalsContact OE2-CZ 3.3Å; E59-R61 IonicContact OE2-NE 3.4Å; E59-R61 PolarHBondContact OE2-NE 3.3Å; E59-R61 VanDerWaalsContact OE2-NE 3.13Å; E59-R61 IonicContact OE2-NH2 3.13Å; E59-R61 PolarHBondContact OE2-NH2 2.91Å
60	Q	69.5	Low	64.3	Low	75 Å²	75	82.1 Å²	82.1	35%	0.35	45%	0.452	S	S	.	.			trans	-75.8	78.8	178.2	-64.1	179.9	-6.2	0	0	109.6	C45 P46 S58 C72 C73 T74	C45-Q60 CarbonylContact C-O 3.37Å; C45-Q60 WeakPolarHBondContact CB-O 3.26Å; P46-Q60 WeakPolarHBondContact CA-O 3.43Å; S58-Q60 PolarHBondContact O-N 3.41Å; Q60-C72 HydrophobicContact CB-CB 3.87Å; Q60-C73 CarbonylContact C-O 3.52Å; Q60-C73 VanDerWaalsContact CA-O 3.29Å; Q60-C73 WeakPolarHBondContact CA-O 3.35Å; Q60-T74 HydrophobicContact CG-CG2 3.88Å
61	R	72.8	Confident	65.5	Low	33 Å²	33	82.8 Å²	82.8	13%	0.125	45%	0.448	C	S	.	.			trans	-101.5	-8	-179	-65.1	-176.5	177.2	-169.8	13.1	113.6	G27 E59 C73	G27-R61 WeakPolarHBondContact CA-O 3.04Å; G27-R61 PolarHBondContact N-O 3.32Å; E59-R61 HydrophobicContact CB-CG 4.03Å; E59-R61 VanDerWaalsContact CD-NH2 3.28Å; E59-R61 HydrophobicContact CG-CG 3.9Å; E59-R61 PolarHBondContact O-N 3.33Å; E59-R61 IonicContact OE1-CZ 3.23Å; E59-R61 IonicContact OE1-NE 3.28Å; E59-R61 PolarHBondContact OE1-NE 2.97Å; E59-R61 IonicContact OE1-NH2 2.82Å; E59-R61 PolarHBondContact OE1-NH2 3.4Å; E59-R61 IonicContact OE2-CZ 2.69Å; E59-R61 VanDerWaalsContact OE2-CZ 3.3Å; E59-R61 IonicContact OE2-NE 3.4Å; E59-R61 PolarHBondContact OE2-NE 3.3Å; E59-R61 VanDerWaalsContact OE2-NE 3.13Å; E59-R61 IonicContact OE2-NH2 3.13Å; E59-R61 PolarHBondContact OE2-NH2 2.91Å; R61-C73 PolarHBondContact N-O 2.84Å
62	F	76	Confident	67.1	Low	54 Å²	54	77 Å²	77	24%	0.237	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	155.4	-175.2	-61	-89.7	0	0	0	111.2	C72 C73 F78	F62-C72 CarbonylContact O-C 3.57Å; F62-C72 WeakPolarHBondContact O-CA 3.45Å; F62-C73 PolarHBondContact N-O 3.44Å; F62-C73 VanDerWaalsContact N-O 3.14Å; F62-C73 PolarHBondContact O-N 3.48Å; F62-C73 PolarHBondContact O-SG 2.89Å; F62-F78 HydrophobicContact CB-CB 3.9Å; F62-F78 HydrophobicContact CB-CD2 3.98Å; F62-F78 HydrophobicContact CB-CG 3.93Å; F62-F78 HydrophobicContact CD1-CB 4.43Å; F62-F78 AromaticContact CD1-CD1 3.82Å; F62-F78 HydrophobicContact CD1-CD1 3.82Å; F62-F78 HydrophobicContact CD1-CD2 4.47Å; F62-F78 HydrophobicContact CD1-CE1 4.12Å; F62-F78 HydrophobicContact CD1-CG 4Å; F62-F78 HydrophobicContact CE1-CD1 4.32Å; F62-F78 HydrophobicContact CG-CB 4.05Å; F62-F78 HydrophobicContact CG-CD1 4.3Å; F62-F78 HydrophobicContact CG-CG 4.06Å
63	C	81	Confident	68.5	Low	29 Å²	29	68.2 Å²	68.2	20%	0.196	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120	173.1	-60.4	0	0	0	0	109.5	V28 C29	V28-C63 PolarHBondContact O-SG 3.48Å; V28-C63 VanDerWaalsContact O-SG 3.36Å; C29-C63 WeakPolarHBondContact CA-SG 3.28Å; C29-C63 HydrophobicContact CB-CB 3.88Å; C29-C63 WeakPolarHBondContact CB-SG 3.47Å; C29-C63 PolarHBondContact N-SG 3.49Å; C29-C63 WeakPolarHBondContact SG-CA 3.29Å; C29-C63 WeakPolarHBondContact SG-CB 3.38Å; C29-C63 CovalentContact SG-SG 2.02Å; C29-C63 PolarHBondContact SG-SG 3.41Å
64	C	79.6	Confident	69.9	Low	13 Å²	13	63.7 Å²	63.7	9%	0.088	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	154.5	173.6	-74.1	0	0	0	0	110.6	Q70 Y71 C73	C64-Q70 CarbonylContact O-C 3.54Å; C64-Q70 VanDerWaalsContact O-CA 3.27Å; C64-Q70 WeakPolarHBondContact O-CA 3.42Å; C64-Y71 HydrophobicContact CB-CD1 4.49Å; C64-Y71 HydrophobicContact CB-CD2 4.14Å; C64-Y71 HydrophobicContact CB-CE1 3.97Å; C64-Y71 HydrophobicContact CB-CE2 3.57Å; C64-Y71 VanDerWaalsContact CB-CZ 3.48Å; C64-Y71 PolarHBondContact N-O 2.85Å; C64-Y71 VanDerWaalsContact O-CD1 3.29Å; C64-Y71 WeakPolarHBondContact O-CD1 3.37Å; C64-Y71 PolarHBondContact O-N 3.03Å; C64-C73 HydrophobicContact CB-CB 3.56Å; C64-C73 WeakPolarHBondContact CB-SG 3.39Å; C64-C73 PolarHBondContact N-SG 2.89Å; C64-C73 VanDerWaalsContact N-SG 3.36Å; C64-C73 WeakPolarHBondContact SG-CB 3.36Å; C64-C73 CovalentContact SG-SG 2.01Å; C64-C73 PolarHBondContact SG-SG 3.41Å
65	G	76.8	Confident	71.3	Confident	48 Å²	48	59 Å²	59	50%	0.495	32%	0.324	S	S	.	.	S	Bend	trans	93	169	-176.8	0	0	0	0	0	113.4
66	A	76.1	Confident	72.3	Confident	70 Å²	70	59.9 Å²	59.9	58%	0.579	33%	0.327	S	S	*	.			trans	-91.2	145.3	174.5	0	0	0	0	0	110	Q69	A66-Q69 CarbonylContact O-C 3.52Å; A66-Q69 WeakPolarHBondContact O-CA 3.35Å; A66-Q69 PolarHBondContact O-N 3.49Å
67	P	74.8	Confident	73.3	Confident	70 Å²	70	56.9 Å²	56.9	46%	0.455	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	136.5	164.9	-10.1	20.4	0	0	0	109.4	Q70	P67-Q70 VanDerWaalsContact CG-NE2 3.35Å
68	P	71.1	Confident	74.2	Confident	81 Å²	81	53.4 Å²	53.4	53%	0.526	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93.2	9.4	7.1	36.5	-35.6	0	0	0	114.8	S31 P32	S31-P68 WeakPolarHBondContact CA-O 3.37Å; S31-P68 VanDerWaalsContact CB-O 3.24Å; S31-P68 WeakPolarHBondContact CB-O 3.29Å; S31-P68 PolarHBondContact OG-O 3.48Å; P32-P68 WeakPolarHBondContact CD-O 3.45Å; P32-P68 HydrophobicContact CG-CB 4.15Å
69	Q	74.5	Confident	75	Confident	157 Å²	157	54.2 Å²	54.2	73%	0.734	30%	0.304	S	S	*	.	S	Bend	trans	-104.7	44.6	-173.8	-62.4	-176.1	1.2	0	0	112.6	A66	A66-Q69 CarbonylContact O-C 3.52Å; A66-Q69 WeakPolarHBondContact O-CA 3.35Å; A66-Q69 PolarHBondContact O-N 3.49Å
70	Q	81.2	Confident	74.9	Confident	28 Å²	28	55.3 Å²	55.3	13%	0.131	32%	0.317	C	S	.	.			trans	-76.5	147.8	176.6	-62.6	-171.4	-1.3	0	0	112.1	C29 Q30 S31 R33 F43 C64 P67	C29-Q70 VanDerWaalsContact CA-OE1 3.23Å; C29-Q70 HydrophobicContact CB-CB 3.99Å; Q30-Q70 WeakPolarHBondContact O-CG 3.37Å; S31-Q70 WeakPolarHBondContact CB-O 3.48Å; R33-Q70 PolarHBondContact NH2-O 3.4Å; F43-Q70 WeakPolarHBondContact CZ-O 3.49Å; C64-Q70 CarbonylContact O-C 3.54Å; C64-Q70 VanDerWaalsContact O-CA 3.27Å; C64-Q70 WeakPolarHBondContact O-CA 3.42Å; P67-Q70 VanDerWaalsContact CG-NE2 3.35Å
71	Y	79.7	Confident	74.4	Confident	110 Å²	110	53.7 Å²	53.7	43%	0.431	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	154.4	178.2	61	-87.3	0	0	0	111.1	C64 C73	C64-Y71 HydrophobicContact CB-CD1 4.49Å; C64-Y71 HydrophobicContact CB-CD2 4.14Å; C64-Y71 HydrophobicContact CB-CE1 3.97Å; C64-Y71 HydrophobicContact CB-CE2 3.57Å; C64-Y71 VanDerWaalsContact CB-CZ 3.48Å; C64-Y71 PolarHBondContact N-O 2.85Å; C64-Y71 VanDerWaalsContact O-CD1 3.29Å; C64-Y71 WeakPolarHBondContact O-CD1 3.37Å; C64-Y71 PolarHBondContact O-N 3.03Å; Y71-C73 HydrophobicContact CD2-CB 4.43Å; Y71-C73 HydrophobicContact CE2-CB 4.14Å
72	C	82.1	Confident	73.5	Confident	13 Å²	13	55.5 Å²	55.5	9%	0.088	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	131.6	175	-58.4	0	0	0	0	110.5	F43 C45 Q60 F62	F43-C72 VanDerWaalsContact CE2-SG 3.58Å; C45-C72 WeakPolarHBondContact CA-SG 3.41Å; C45-C72 HydrophobicContact CB-CB 3.86Å; C45-C72 WeakPolarHBondContact CB-SG 3.31Å; C45-C72 WeakPolarHBondContact SG-CA 3.47Å; C45-C72 WeakPolarHBondContact SG-CB 3.31Å; C45-C72 CovalentContact SG-SG 2.03Å; C45-C72 PolarHBondContact SG-SG 3.41Å; Q60-C72 HydrophobicContact CB-CB 3.87Å; F62-C72 CarbonylContact O-C 3.57Å; F62-C72 WeakPolarHBondContact O-CA 3.45Å
73	C	78.2	Confident	72.2	Confident	0 Å²	0	57 Å²	57	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	158.8	177.6	61.1	0	0	0	0	111.4	Q60 R61 F62 C64 Y71 Q77	Q60-C73 CarbonylContact C-O 3.52Å; Q60-C73 VanDerWaalsContact CA-O 3.29Å; Q60-C73 WeakPolarHBondContact CA-O 3.35Å; R61-C73 PolarHBondContact N-O 2.84Å; F62-C73 PolarHBondContact N-O 3.44Å; F62-C73 VanDerWaalsContact N-O 3.14Å; F62-C73 PolarHBondContact O-N 3.48Å; F62-C73 PolarHBondContact O-SG 2.89Å; C64-C73 HydrophobicContact CB-CB 3.56Å; C64-C73 WeakPolarHBondContact CB-SG 3.39Å; C64-C73 PolarHBondContact N-SG 2.89Å; C64-C73 VanDerWaalsContact N-SG 3.36Å; C64-C73 WeakPolarHBondContact SG-CB 3.36Å; C64-C73 CovalentContact SG-SG 2.01Å; C64-C73 PolarHBondContact SG-SG 3.41Å; Y71-C73 HydrophobicContact CD2-CB 4.43Å; Y71-C73 HydrophobicContact CE2-CB 4.14Å; C73-Q77 HydrophobicContact CB-CB 3.92Å
74	T	78.3	Confident	70.6	Confident	17 Å²	17	62.8 Å²	62.8	10%	0.104	37%	0.367	C	S	.	.			trans	-75.4	163	174.7	58.2	0	0	0	0	110.6	Q60 T76 Q77 F78	Q60-T74 HydrophobicContact CG-CG2 3.88Å; T74-T76 PolarHBondContact O-N 2.99Å; T74-T76 PolarHBondContact OG1-OG1 3.4Å; T74-Q77 PolarHBondContact O-N 3.05Å; T74-Q77 VanDerWaalsContact O-N 3.14Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.42Å; T74-Q77 PolarHBondContact OG1-N 3.2Å; T74-F78 WeakPolarHBondContact O-CB 3.5Å; T74-F78 PolarHBondContact O-N 3.03Å
75	S	74.3	Confident	69	Low	31 Å²	31	68.1 Å²	68.1	22%	0.217	40%	0.399	C	S	.	.	H	α-helix	trans	-53.8	-40.6	171.9	55.1	0	0	0	0	111.7	E57 Q77 F78 S79	E57-S75 PolarHBondContact O-OG 3.4Å; S75-Q77 PolarHBondContact O-N 2.73Å; S75-F78 PolarHBondContact O-N 3.42Å; S75-S79 WeakPolarHBondContact O-CB 3.33Å; S75-S79 PolarHBondContact O-N 3.41Å; S75-S79 PolarHBondContact O-OG 2.81Å; S75-S79 VanDerWaalsContact O-OG 3.09Å
76	T	70.5	Confident	67.3	Low	75 Å²	75	71.6 Å²	71.6	46%	0.46	40%	0.402	S	S	.	.	H	α-helix	trans	-63.6	-40.7	178.7	54.2	0	0	0	0	112.5	T74 S80	T74-T76 PolarHBondContact O-N 2.99Å; T74-T76 PolarHBondContact OG1-OG1 3.4Å; T76-S80 VanDerWaalsContact O-CB 3.24Å; T76-S80 WeakPolarHBondContact O-CB 3.24Å; T76-S80 PolarHBondContact O-N 3.07Å; T76-S80 PolarHBondContact O-OG 3.36Å
77	Q	72.5	Confident	65.6	Low	91 Å²	91	72.9 Å²	72.9	43%	0.425	41%	0.407	S	S	.	.	H	α-helix	trans	-71.2	-41.7	176.9	-75.2	-179.8	-3.2	0	0	111.8	C73 T74 S75 S80 G81	C73-Q77 HydrophobicContact CB-CB 3.92Å; T74-Q77 PolarHBondContact O-N 3.05Å; T74-Q77 VanDerWaalsContact O-N 3.14Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.42Å; T74-Q77 PolarHBondContact OG1-N 3.2Å; S75-Q77 PolarHBondContact O-N 2.73Å; Q77-S80 VanDerWaalsContact CA-OG 3.31Å; Q77-S80 WeakPolarHBondContact CA-OG 3.24Å; Q77-S80 PolarHBondContact O-N 3.46Å; Q77-S80 PolarHBondContact O-OG 3.4Å; Q77-G81 PolarHBondContact O-N 3.26Å
78	F	72.7	Confident	64.2	Low	57 Å²	57	75.6 Å²	75.6	25%	0.25	42%	0.418	C	S	.	.	H	α-helix	trans	-61.4	-49	175.7	-173.9	-106.6	0	0	0	111.3	F62 T74 S75 S80 G81 I82	F62-F78 HydrophobicContact CB-CB 3.9Å; F62-F78 HydrophobicContact CB-CD2 3.98Å; F62-F78 HydrophobicContact CB-CG 3.93Å; F62-F78 HydrophobicContact CD1-CB 4.43Å; F62-F78 AromaticContact CD1-CD1 3.82Å; F62-F78 HydrophobicContact CD1-CD1 3.82Å; F62-F78 HydrophobicContact CD1-CD2 4.47Å; F62-F78 HydrophobicContact CD1-CE1 4.12Å; F62-F78 HydrophobicContact CD1-CG 4Å; F62-F78 HydrophobicContact CE1-CD1 4.32Å; F62-F78 HydrophobicContact CG-CB 4.05Å; F62-F78 HydrophobicContact CG-CD1 4.3Å; F62-F78 HydrophobicContact CG-CG 4.06Å; T74-F78 WeakPolarHBondContact O-CB 3.5Å; T74-F78 PolarHBondContact O-N 3.03Å; S75-F78 PolarHBondContact O-N 3.42Å; F78-S80 PolarHBondContact O-N 2.89Å; F78-G81 PolarHBondContact O-N 3.02Å; F78-I82 HydrophobicContact CD1-CD1 3.5Å; F78-I82 HydrophobicContact CD2-CD1 4.43Å; F78-I82 HydrophobicContact CE1-CD1 3.19Å; F78-I82 HydrophobicContact CE2-CD1 4.18Å; F78-I82 HydrophobicContact CG-CD1 4.14Å; F78-I82 HydrophobicContact CZ-CD1 3.57Å; F78-I82 WeakPolarHBondContact O-CG1 3.47Å; F78-I82 PolarHBondContact O-N 2.94Å
79	S	69.4	Low	63.1	Low	39 Å²	39	76.6 Å²	76.6	27%	0.273	42%	0.418	S	S	.	.	H	α-helix	trans	-60.9	-44.5	174.4	-66.1	0	0	0	0	111.3	S75 G81 I82 H83	S75-S79 WeakPolarHBondContact O-CB 3.33Å; S75-S79 PolarHBondContact O-N 3.41Å; S75-S79 PolarHBondContact O-OG 2.81Å; S75-S79 VanDerWaalsContact O-OG 3.09Å; S79-G81 VanDerWaalsContact C-N 3.27Å; S79-G81 PolarHBondContact O-N 2.69Å; S79-I82 CarbonylContact O-C 3.51Å; S79-I82 PolarHBondContact O-N 2.86Å; S79-I82 VanDerWaalsContact O-N 3.09Å; S79-H83 PolarHBondContact O-CD2 3.03Å; S79-H83 PolarHBondContact O-N 2.92Å
80	S	62.6	Low	62.2	Low	70 Å²	70	76.6 Å²	76.6	49%	0.49	42%	0.422	S	S	.	.	H	α-helix	trans	-63.3	-31	178.2	70.6	0	0	0	0	113.4	T76 Q77 F78	T76-S80 VanDerWaalsContact O-CB 3.24Å; T76-S80 WeakPolarHBondContact O-CB 3.24Å; T76-S80 PolarHBondContact O-N 3.07Å; T76-S80 PolarHBondContact O-OG 3.36Å; Q77-S80 VanDerWaalsContact CA-OG 3.31Å; Q77-S80 WeakPolarHBondContact CA-OG 3.24Å; Q77-S80 PolarHBondContact O-N 3.46Å; Q77-S80 PolarHBondContact O-OG 3.4Å; F78-S80 PolarHBondContact O-N 2.89Å
81	G	58.7	Low	61	Low	41 Å²	41	79 Å²	79	42%	0.423	44%	0.435	S	S	.	.	H	α-helix	trans	-74.2	-31.6	173.7	0	0	0	0	0	113	Q77 F78 S79	Q77-G81 PolarHBondContact O-N 3.26Å; F78-G81 PolarHBondContact O-N 3.02Å; S79-G81 VanDerWaalsContact C-N 3.27Å; S79-G81 PolarHBondContact O-N 2.69Å
82	I	54.3	Low	59.5	Low	72 Å²	72	76.7 Å²	76.7	37%	0.369	44%	0.435	S	S	.	.	H	α-helix	trans	-78.3	-26.8	174.5	-64.6	164.4	0	0	0	111.5	F78 S79 I84 V85 Q86	F78-I82 HydrophobicContact CD1-CD1 3.5Å; F78-I82 HydrophobicContact CD2-CD1 4.43Å; F78-I82 HydrophobicContact CE1-CD1 3.19Å; F78-I82 HydrophobicContact CE2-CD1 4.18Å; F78-I82 HydrophobicContact CG-CD1 4.14Å; F78-I82 HydrophobicContact CZ-CD1 3.57Å; F78-I82 WeakPolarHBondContact O-CG1 3.47Å; F78-I82 PolarHBondContact O-N 2.94Å; S79-I82 CarbonylContact O-C 3.51Å; S79-I82 PolarHBondContact O-N 2.86Å; S79-I82 VanDerWaalsContact O-N 3.09Å; I82-I84 PolarHBondContact O-N 2.86Å; I82-V85 PolarHBondContact O-N 3.04Å; I82-Q86 PolarHBondContact O-N 3.41Å; I82-Q86 VanDerWaalsContact O-N 3.11Å
83	H	47.5	Very low	58.6	Low	86 Å²	86	80.2 Å²	80.2	40%	0.398	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-10.9	173.6	-92.7	-81.1	0	0	0	113.5	S79 V85 Q86	S79-H83 PolarHBondContact O-CD2 3.03Å; S79-H83 PolarHBondContact O-N 2.92Å; H83-V85 PolarHBondContact O-N 2.96Å; H83-Q86 VanDerWaalsContact O-O 3.09Å
84	I	47.3	Very low	58.2	Low	150 Å²	150	83.7 Å²	83.7	77%	0.769	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-21.3	168.5	-54.3	173.2	0	0	0	111.5	I82	I82-I84 PolarHBondContact O-N 2.86Å
85	V	46.1	Very low	57.6	Low	125 Å²	125	87.6 Å²	87.6	76%	0.758	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-20	176.9	-159.7	0	0	0	0	112.2	I82 H83 S87	I82-V85 PolarHBondContact O-N 3.04Å; H83-V85 PolarHBondContact O-N 2.96Å; V85-S87 VanDerWaalsContact C-N 3.34Å; V85-S87 PolarHBondContact O-N 3.14Å; V85-S87 VanDerWaalsContact O-N 3.14Å
86	Q	42.1	Very low	57.5	Low	120 Å²	120	92 Å²	92	56%	0.561	52%	0.517	S	S	*	.	S	Bend	trans	-85.1	86.7	169.5	-160.6	157.5	22.7	0	0	107.7	I82 H83 D88	I82-Q86 PolarHBondContact O-N 3.41Å; I82-Q86 VanDerWaalsContact O-N 3.11Å; H83-Q86 VanDerWaalsContact O-O 3.09Å; Q86-D88 PolarHBondContact O-N 2.84Å
87	S	39.9	Very low	57.7	Low	98 Å²	98	94.3 Å²	94.3	69%	0.685	53%	0.525	S	S	*	.			trans	-36.1	114	175.4	-51	0	0	0	0	109.4	V85 L89	V85-S87 VanDerWaalsContact C-N 3.34Å; V85-S87 PolarHBondContact O-N 3.14Å; V85-S87 VanDerWaalsContact O-N 3.14Å; S87-L89 PolarHBondContact O-N 3.19Å
88	D	46.1	Very low	58	Low	127 Å²	127	92 Å²	92	68%	0.679	53%	0.525	S	S	*	.			trans	-64.6	56.2	159.2	-79.5	-31.5	0	0	0	108.4	Q86 L90	Q86-D88 PolarHBondContact O-N 2.84Å; D88-L90 HydrophobicContact CB-CD1 4.36Å; D88-L90 PolarHBondContact O-N 2.82Å
89	L	46.7	Very low	58.5	Low	101 Å²	101	91.4 Å²	91.4	53%	0.529	54%	0.536	S	S	.	.			trans	-81.4	78	167.9	-146.3	77.1	0	0	0	105.1	S87 I91 F96	S87-L89 PolarHBondContact O-N 3.19Å; L89-I91 WeakPolarHBondContact CD2-O 3.5Å; L89-I91 CarbonylContact O-C 3.57Å; L89-I91 PolarHBondContact O-N 3.04Å; L89-F96 HydrophobicContact CD2-CE2 4.45Å
90	L	56.3	Low	59.4	Low	158 Å²	158	93.3 Å²	93.3	83%	0.827	55%	0.549	S	S	*	.			trans	-58.9	-0.7	168.1	-78	123.5	0	0	0	112.7	D88	D88-L90 HydrophobicContact CB-CD1 4.36Å; D88-L90 PolarHBondContact O-N 2.82Å
91	I	55.6	Low	60.7	Low	78 Å²	78	95.2 Å²	95.2	40%	0.4	55%	0.553	S	S	.	*	S	Bend	trans	-102.4	109	166.4	-76.4	87.7	0	0	0	108	L89 I95 F96	L89-I91 WeakPolarHBondContact CD2-O 3.5Å; L89-I91 CarbonylContact O-C 3.57Å; L89-I91 PolarHBondContact O-N 3.04Å; I91-I95 HydrophobicContact CG2-CB 3.78Å; I91-I95 HydrophobicContact CG2-CD1 3.97Å; I91-I95 HydrophobicContact CG2-CG1 4.44Å; I91-I95 HydrophobicContact CG2-CG2 4.06Å; I91-F96 HydrophobicContact CB-CE2 4.26Å; I91-F96 HydrophobicContact CG2-CD2 3.62Å; I91-F96 HydrophobicContact CG2-CE2 3.52Å
92	S	47.8	Very low	62.2	Low	62 Å²	62	95.1 Å²	95.1	43%	0.434	55%	0.552	S	S	.	*			trans	-51.3	135.6	173.1	-162.3	0	0	0	0	110.4	S94 I95	S92-S94 WeakPolarHBondContact CB-OG 3.29Å; S92-S94 PolarHBondContact O-N 3.09Å; S92-S94 PolarHBondContact OG-OG 2.92Å; S92-I95 WeakPolarHBondContact O-CB 3.03Å; S92-I95 PolarHBondContact O-N 3.11Å
93	P	63.7	Low	63.9	Low	87 Å²	87	99.4 Å²	99.4	57%	0.565	57%	0.568	S	S	*	*	H	α-helix	trans	-52.2	-23.7	178.8	-27.2	33.5	0	0	0	114	I95 F96 I97	P93-I95 VanDerWaalsContact C-N 3.29Å; P93-I95 PolarHBondContact O-N 3.23Å; P93-F96 PolarHBondContact O-N 2.78Å; P93-I97 WeakPolarHBondContact O-CG1 3.27Å; P93-I97 PolarHBondContact O-N 3.3Å
94	S	69.2	Low	66.1	Low	73 Å²	73	100.2 Å²	100.2	51%	0.51	58%	0.575	S	S	.	*	H	α-helix	trans	-62.5	-30.3	174.2	54.5	0	0	0	0	113.9	S92 G98	S92-S94 WeakPolarHBondContact CB-OG 3.29Å; S92-S94 PolarHBondContact O-N 3.09Å; S92-S94 PolarHBondContact OG-OG 2.92Å; S94-G98 PolarHBondContact O-N 3.2Å
95	I	67.3	Low	68.3	Low	99 Å²	99	98.2 Å²	98.2	51%	0.508	57%	0.565	S	S	.	*	H	α-helix	trans	-73.7	-35.8	-179.9	-58.7	164.7	0	0	0	110.2	I91 S92 P93 G99	I91-I95 HydrophobicContact CG2-CB 3.78Å; I91-I95 HydrophobicContact CG2-CD1 3.97Å; I91-I95 HydrophobicContact CG2-CG1 4.44Å; I91-I95 HydrophobicContact CG2-CG2 4.06Å; S92-I95 WeakPolarHBondContact O-CB 3.03Å; S92-I95 PolarHBondContact O-N 3.11Å; P93-I95 VanDerWaalsContact C-N 3.29Å; P93-I95 PolarHBondContact O-N 3.23Å; I95-G99 PolarHBondContact O-N 3.32Å
96	F	71.8	Confident	70.5	Confident	124 Å²	124	98.8 Å²	98.8	54%	0.544	56%	0.558	S	S	.	*	H	α-helix	trans	-67.6	-42.2	174.3	-87.4	-80.3	0	0	0	112.1	L89 I91 P93 S100	L89-F96 HydrophobicContact CD2-CE2 4.45Å; I91-F96 HydrophobicContact CB-CE2 4.26Å; I91-F96 HydrophobicContact CG2-CD2 3.62Å; I91-F96 HydrophobicContact CG2-CE2 3.52Å; P93-F96 PolarHBondContact O-N 2.78Å; F96-S100 WeakPolarHBondContact O-CB 3.33Å; F96-S100 PolarHBondContact O-N 3.17Å; F96-S100 PolarHBondContact O-OG 2.78Å
97	I	74.9	Confident	73	Confident	123 Å²	123	94.6 Å²	94.6	63%	0.631	55%	0.547	S	S	*	.	H	α-helix	trans	-66.7	-44.2	176.7	-64.9	161.7	0	0	0	110.2	P93 S100 L101	P93-I97 WeakPolarHBondContact O-CG1 3.27Å; P93-I97 PolarHBondContact O-N 3.3Å; I97-S100 PolarHBondContact O-N 2.62Å; I97-L101 WeakPolarHBondContact O-CB 2.91Å; I97-L101 PolarHBondContact O-N 3.31Å
98	G	77.3	Confident	75.6	Confident	41 Å²	41	94.2 Å²	94.2	42%	0.423	54%	0.536	S	S	.	.	H	α-helix	trans	-64.7	-43.6	177.4	0	0	0	0	0	113.1	S94 L101 G102	S94-G98 PolarHBondContact O-N 3.2Å; G98-L101 PolarHBondContact O-N 2.89Å; G98-G102 PolarHBondContact O-N 2.88Å
99	G	84.8	Confident	77.8	Confident	46 Å²	46	94.7 Å²	94.7	47%	0.474	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-41.7	176.9	0	0	0	0	0	112.3	I95 G102 F103	I95-G99 PolarHBondContact O-N 3.32Å; G99-G102 PolarHBondContact O-N 2.88Å; G99-F103 WeakPolarHBondContact O-CB 3.32Å; G99-F103 PolarHBondContact O-N 3.47Å
100	S	87.9	Confident	80.1	Confident	78 Å²	78	96 Å²	96	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-43.8	177.2	-56.3	0	0	0	0	111.9	F96 I97 F103 L104	F96-S100 WeakPolarHBondContact O-CB 3.33Å; F96-S100 PolarHBondContact O-N 3.17Å; F96-S100 PolarHBondContact O-OG 2.78Å; I97-S100 PolarHBondContact O-N 2.62Å; S100-F103 PolarHBondContact O-N 3.48Å; S100-L104 WeakPolarHBondContact O-CB 3.3Å; S100-L104 PolarHBondContact O-N 3.14Å
101	L	88.7	Confident	81.8	Confident	110 Å²	110	92.3 Å²	92.3	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-65.3	-41.9	177	-167.4	73.2	0	0	0	111.5	I97 G98 L104 L105	I97-L101 WeakPolarHBondContact O-CB 2.91Å; I97-L101 PolarHBondContact O-N 3.31Å; G98-L101 PolarHBondContact O-N 2.89Å; L101-L104 PolarHBondContact O-N 3.25Å; L101-L105 WeakPolarHBondContact O-CG 3.46Å; L101-L105 PolarHBondContact O-N 3.27Å
102	G	90.3	Very high	83.6	Confident	39 Å²	39	93.2 Å²	93.2	40%	0.402	52%	0.523	S	S	.	.	H	α-helix	trans	-62.3	-44.2	175.8	0	0	0	0	0	112.4	G98 G99 L104 L105 F106	G98-G102 PolarHBondContact O-N 2.88Å; G99-G102 PolarHBondContact O-N 2.88Å; G102-L104 PolarHBondContact O-N 3.49Å; G102-L105 PolarHBondContact O-N 2.01Å; G102-F106 VanDerWaalsContact O-CB 3.29Å; G102-F106 WeakPolarHBondContact O-CB 3.34Å; G102-F106 PolarHBondContact O-N 3.36Å
103	F	91.1	Very high	85.7	Confident	162 Å²	162	95.5 Å²	95.5	71%	0.711	53%	0.525	S	S	*	.	H	α-helix	trans	-64.5	-39.6	177.5	-168.9	-95.3	0	0	0	112.1	G99 S100 F106 G107	G99-F103 WeakPolarHBondContact O-CB 3.32Å; G99-F103 PolarHBondContact O-N 3.47Å; S100-F103 PolarHBondContact O-N 3.48Å; F103-F106 PolarHBondContact O-N 2.91Å; F103-G107 PolarHBondContact O-N 3.39Å
104	L	92.8	Very high	87	Confident	103 Å²	103	93.6 Å²	93.6	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-64.6	-45.3	177	-167.6	149.2	0	0	0	111.6	S100 L101 G102 G107 I108	S100-L104 WeakPolarHBondContact O-CB 3.3Å; S100-L104 PolarHBondContact O-N 3.14Å; L101-L104 PolarHBondContact O-N 3.25Å; G102-L104 PolarHBondContact O-N 3.49Å; L104-G107 PolarHBondContact O-N 2.83Å; L104-I108 HydrophobicContact CD2-CD1 3.6Å; L104-I108 HydrophobicContact CD2-CG1 4.49Å; L104-I108 WeakPolarHBondContact O-CG1 3.47Å; L104-I108 PolarHBondContact O-N 3.17Å
105	L	93.2	Very high	88.1	Confident	109 Å²	109	96.8 Å²	96.8	57%	0.571	52%	0.521	S	S	*	.	H	α-helix	trans	-64.9	-41	175.7	-70.7	175.8	0	0	0	112.2	L101 G102 I108 F109	L101-L105 WeakPolarHBondContact O-CG 3.46Å; L101-L105 PolarHBondContact O-N 3.27Å; G102-L105 PolarHBondContact O-N 2.01Å; L105-I108 PolarHBondContact O-N 2.91Å; L105-F109 PolarHBondContact O-N 3.1Å
106	F	93.9	Very high	89.1	Confident	137 Å²	137	94.4 Å²	94.4	60%	0.601	51%	0.513	S	S	*	.	H	α-helix	trans	-64.3	-41.3	176.8	-170.6	-100	0	0	0	111.8	G102 F103 F109 F110	G102-F106 VanDerWaalsContact O-CB 3.29Å; G102-F106 WeakPolarHBondContact O-CB 3.34Å; G102-F106 PolarHBondContact O-N 3.36Å; F103-F106 PolarHBondContact O-N 2.91Å; F106-F109 PolarHBondContact O-N 3.09Å; F106-F110 WeakPolarHBondContact O-CB 3.06Å; F106-F110 PolarHBondContact O-N 2.03Å
107	G	93.5	Very high	89.9	Confident	32 Å²	32	96 Å²	96	33%	0.33	52%	0.516	S	S	.	.	H	α-helix	trans	-59.9	-46.9	174.5	0	0	0	0	0	112.5	F103 L104 F109 F110 V111	F103-G107 PolarHBondContact O-N 3.39Å; L104-G107 PolarHBondContact O-N 2.83Å; G107-F109 PolarHBondContact O-N 2.81Å; G107-F110 PolarHBondContact O-N 3.47Å; G107-V111 WeakPolarHBondContact O-CG2 3.04Å; G107-V111 PolarHBondContact O-N 2.88Å
108	I	94	Very high	90.4	Very high	89 Å²	89	94.6 Å²	94.6	46%	0.456	51%	0.509	S	S	.	.	H	α-helix	trans	-61	-45.7	176.3	-67	168.4	0	0	0	110.8	L104 L105 F110 V111 I112	L104-I108 HydrophobicContact CD2-CD1 3.6Å; L104-I108 HydrophobicContact CD2-CG1 4.49Å; L104-I108 WeakPolarHBondContact O-CG1 3.47Å; L104-I108 PolarHBondContact O-N 3.17Å; L105-I108 PolarHBondContact O-N 2.91Å; I108-F110 VanDerWaalsContact C-N 3.3Å; I108-F110 PolarHBondContact O-N 2.83Å; I108-V111 PolarHBondContact O-N 3.42Å; I108-I112 HydrophobicContact CG2-CD1 3.81Å; I108-I112 HydrophobicContact CG2-CG1 4.45Å; I108-I112 WeakPolarHBondContact O-CG1 3.35Å; I108-I112 PolarHBondContact O-N 3.49Å
109	F	93.7	Very high	90.6	Very high	137 Å²	137	94.7 Å²	94.7	60%	0.601	51%	0.506	S	S	*	.	H	α-helix	trans	-60.5	-41.9	178	-172.4	-95.6	0	0	0	111.6	L105 F106 G107 I112 F113	L105-F109 PolarHBondContact O-N 3.1Å; F106-F109 PolarHBondContact O-N 3.09Å; G107-F109 PolarHBondContact O-N 2.81Å; F109-I112 PolarHBondContact O-N 3.47Å; F109-F113 VanDerWaalsContact O-CB 3.27Å; F109-F113 WeakPolarHBondContact O-CB 3.37Å; F109-F113 PolarHBondContact O-N 2.86Å
110	F	93.4	Very high	90.4	Very high	129 Å²	129	100.9 Å²	100.9	57%	0.566	52%	0.515	S	S	*	.	H	α-helix	trans	-64.3	-40.7	177.9	-161	-90.3	0	0	0	112.1	F106 G107 I108 F113 A114	F106-F110 WeakPolarHBondContact O-CB 3.06Å; F106-F110 PolarHBondContact O-N 2.03Å; G107-F110 PolarHBondContact O-N 3.47Å; I108-F110 VanDerWaalsContact C-N 3.3Å; I108-F110 PolarHBondContact O-N 2.83Å; F110-F113 PolarHBondContact O-N 3.24Å; F110-A114 VanDerWaalsContact O-CB 3.31Å; F110-A114 WeakPolarHBondContact O-CB 3.02Å; F110-A114 PolarHBondContact O-N 2.02Å
111	V	93.2	Very high	89.9	Confident	81 Å²	81	101.2 Å²	101.2	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-62.2	-48.3	174.5	171.8	0	0	0	0	110.8	G107 I108 F113 A114 F115	G107-V111 WeakPolarHBondContact O-CG2 3.04Å; G107-V111 PolarHBondContact O-N 2.88Å; I108-V111 PolarHBondContact O-N 3.42Å; V111-F113 VanDerWaalsContact C-N 3.3Å; V111-F113 PolarHBondContact O-N 3.14Å; V111-A114 PolarHBondContact O-N 3.15Å; V111-F115 HydrophobicContact CG1-CD2 3.76Å; V111-F115 HydrophobicContact CG1-CE2 3.99Å; V111-F115 WeakPolarHBondContact O-CB 2.96Å; V111-F115 WeakPolarHBondContact O-CD2 3.42Å; V111-F115 PolarHBondContact O-N 3.26Å
112	I	92.7	Very high	89.2	Confident	97 Å²	97	101 Å²	101	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-61.8	-40.8	177.5	-65.8	168.7	0	0	0	110.8	I108 F109 F115 S116	I108-I112 HydrophobicContact CG2-CD1 3.81Å; I108-I112 HydrophobicContact CG2-CG1 4.45Å; I108-I112 WeakPolarHBondContact O-CG1 3.35Å; I108-I112 PolarHBondContact O-N 3.49Å; F109-I112 PolarHBondContact O-N 3.47Å; I112-F115 PolarHBondContact O-N 3.47Å; I112-S116 VanDerWaalsContact O-CB 3.28Å; I112-S116 WeakPolarHBondContact O-CB 3.48Å; I112-S116 PolarHBondContact O-N 3.35Å; I112-S116 PolarHBondContact O-OG 3.47Å
113	F	92.9	Very high	88.4	Confident	110 Å²	110	107.6 Å²	107.6	48%	0.482	52%	0.522	S	S	.	.	H	α-helix	trans	-64.8	-45.1	177.6	-177.3	-100	0	0	0	111.7	F109 F110 V111 S116 R117	F109-F113 VanDerWaalsContact O-CB 3.27Å; F109-F113 WeakPolarHBondContact O-CB 3.37Å; F109-F113 PolarHBondContact O-N 2.86Å; F110-F113 PolarHBondContact O-N 3.24Å; V111-F113 VanDerWaalsContact C-N 3.3Å; V111-F113 PolarHBondContact O-N 3.14Å; F113-S116 PolarHBondContact O-N 3.15Å; F113-R117 WeakPolarHBondContact O-CB 3.34Å; F113-R117 PolarHBondContact O-N 2.72Å
114	A	91.1	Very high	87.6	Confident	46 Å²	46	107.2 Å²	107.2	38%	0.38	52%	0.52	S	S	.	.	H	α-helix	trans	-62.1	-46.3	175.5	0	0	0	0	0	111.4	F110 V111 S116 R117 L118	F110-A114 VanDerWaalsContact O-CB 3.31Å; F110-A114 WeakPolarHBondContact O-CB 3.02Å; F110-A114 PolarHBondContact O-N 2.02Å; V111-A114 PolarHBondContact O-N 3.15Å; A114-S116 VanDerWaalsContact C-N 3.34Å; A114-S116 PolarHBondContact O-N 2.99Å; A114-R117 PolarHBondContact O-N 2.96Å; A114-L118 VanDerWaalsContact O-CB 3.26Å; A114-L118 WeakPolarHBondContact O-CB 3.29Å; A114-L118 PolarHBondContact O-N 3.47Å
115	F	91.7	Very high	86.4	Confident	140 Å²	140	104.7 Å²	104.7	61%	0.614	51%	0.514	S	S	*	.	H	α-helix	trans	-60.7	-41.6	174.4	-96.5	-78.1	0	0	0	112.2	V111 I112 L118 A119	V111-F115 HydrophobicContact CG1-CD2 3.76Å; V111-F115 HydrophobicContact CG1-CE2 3.99Å; V111-F115 WeakPolarHBondContact O-CB 2.96Å; V111-F115 WeakPolarHBondContact O-CD2 3.42Å; V111-F115 PolarHBondContact O-N 3.26Å; I112-F115 PolarHBondContact O-N 3.47Å; F115-L118 PolarHBondContact O-N 3.14Å; F115-A119 WeakPolarHBondContact O-CB 2.93Å; F115-A119 PolarHBondContact O-N 3.01Å
116	S	88.8	Confident	85	Confident	49 Å²	49	102.1 Å²	102.1	34%	0.343	51%	0.505	S	S	.	.	H	α-helix	trans	-65.3	-41.7	177.8	-64	0	0	0	0	111.7	I112 F113 A114 R120	I112-S116 VanDerWaalsContact O-CB 3.28Å; I112-S116 WeakPolarHBondContact O-CB 3.48Å; I112-S116 PolarHBondContact O-N 3.35Å; I112-S116 PolarHBondContact O-OG 3.47Å; F113-S116 PolarHBondContact O-N 3.15Å; A114-S116 VanDerWaalsContact C-N 3.34Å; A114-S116 PolarHBondContact O-N 2.99Å; S116-R120 WeakPolarHBondContact O-CB 3.22Å; S116-R120 VanDerWaalsContact O-CG 3.26Å; S116-R120 WeakPolarHBondContact O-CG 3.21Å; S116-R120 PolarHBondContact O-N 3.21Å
117	R	87.7	Confident	83.5	Confident	159 Å²	159	100 Å²	100	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-67.9	-42.8	176.7	-168.9	173.5	-177.5	165.2	-0.8	111.2	F113 A114 R120 N121	F113-R117 WeakPolarHBondContact O-CB 3.34Å; F113-R117 PolarHBondContact O-N 2.72Å; A114-R117 PolarHBondContact O-N 2.96Å; R117-R120 PolarHBondContact O-N 3.36Å; R117-N121 WeakPolarHBondContact O-CB 3.15Å; R117-N121 VanDerWaalsContact O-CG 3.28Å; R117-N121 PolarHBondContact O-N 3.21Å
118	L	85.5	Confident	82	Confident	92 Å²	92	105.5 Å²	105.5	48%	0.482	52%	0.515	S	S	.	.	H	α-helix	trans	-63.4	-46.4	175.9	-172.4	66.1	0	0	0	110.9	A114 F115 R120 N121 L122	A114-L118 VanDerWaalsContact O-CB 3.26Å; A114-L118 WeakPolarHBondContact O-CB 3.29Å; A114-L118 PolarHBondContact O-N 3.47Å; F115-L118 PolarHBondContact O-N 3.14Å; L118-R120 VanDerWaalsContact C-N 3.33Å; L118-R120 PolarHBondContact O-N 3.43Å; L118-N121 PolarHBondContact O-N 3.1Å; L118-N121 VanDerWaalsContact O-N 3.14Å; L118-L122 HydrophobicContact CG-CD1 4.03Å; L118-L122 HydrophobicContact CG-CG 4.37Å; L118-L122 WeakPolarHBondContact O-CB 3.43Å; L118-L122 VanDerWaalsContact O-CG 3.3Å; L118-L122 WeakPolarHBondContact O-CG 3.37Å; L118-L122 PolarHBondContact O-N 2.79Å
119	A	82	Confident	80.4	Confident	43 Å²	43	106.6 Å²	106.6	36%	0.355	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-38.2	176.7	0	0	0	0	0	112.3	F115 R123	F115-A119 WeakPolarHBondContact O-CB 2.93Å; F115-A119 PolarHBondContact O-N 3.01Å; A119-R123 WeakPolarHBondContact O-CB 3.21Å; A119-R123 WeakPolarHBondContact O-CG 3.16Å; A119-R123 PolarHBondContact O-N 3.41Å
120	R	80.4	Confident	78.7	Confident	176 Å²	176	106.9 Å²	106.9	66%	0.664	52%	0.522	S	S	*	.	H	α-helix	trans	-65.9	-42.1	173	-73.9	176.9	-164.9	179.7	5.4	111.8	S116 R117 L118 R123 K124	S116-R120 WeakPolarHBondContact O-CB 3.22Å; S116-R120 VanDerWaalsContact O-CG 3.26Å; S116-R120 WeakPolarHBondContact O-CG 3.21Å; S116-R120 PolarHBondContact O-N 3.21Å; R117-R120 PolarHBondContact O-N 3.36Å; L118-R120 VanDerWaalsContact C-N 3.33Å; L118-R120 PolarHBondContact O-N 3.43Å; R120-R123 PolarHBondContact O-N 2.88Å; R120-K124 WeakPolarHBondContact O-CG 3.15Å; R120-K124 PolarHBondContact O-N 3.07Å
121	N	77.6	Confident	77	Confident	85 Å²	85	109 Å²	109	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-41.5	177.7	-72.8	-10.6	0	0	0	111.5	R117 L118 K124 A125	R117-N121 WeakPolarHBondContact O-CB 3.15Å; R117-N121 VanDerWaalsContact O-CG 3.28Å; R117-N121 PolarHBondContact O-N 3.21Å; L118-N121 PolarHBondContact O-N 3.1Å; L118-N121 VanDerWaalsContact O-N 3.14Å; N121-K124 PolarHBondContact O-N 3.4Å; N121-A125 WeakPolarHBondContact O-CB 3.37Å; N121-A125 PolarHBondContact O-N 3.33Å
122	L	74.4	Confident	75.2	Confident	106 Å²	106	111.3 Å²	111.3	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-64.9	-40.2	174.6	-70.7	174.1	0	0	0	111.6	L118 K124 A125 S126	L118-L122 HydrophobicContact CG-CD1 4.03Å; L118-L122 HydrophobicContact CG-CG 4.37Å; L118-L122 WeakPolarHBondContact O-CB 3.43Å; L118-L122 VanDerWaalsContact O-CG 3.3Å; L118-L122 WeakPolarHBondContact O-CG 3.37Å; L118-L122 PolarHBondContact O-N 2.79Å; L122-K124 VanDerWaalsContact C-N 3.34Å; L122-K124 PolarHBondContact O-N 2.87Å; L122-A125 PolarHBondContact O-N 3.4Å; L122-S126 VanDerWaalsContact O-CB 3.28Å; L122-S126 WeakPolarHBondContact O-CB 3.27Å; L122-S126 PolarHBondContact O-N 3.23Å; L122-S126 PolarHBondContact O-OG 2.97Å
123	R	73.3	Confident	73.4	Confident	178 Å²	178	110.5 Å²	110.5	67%	0.672	53%	0.533	S	S	*	.	H	α-helix	trans	-64.2	-36.9	173	-78.3	-178.9	-174.8	164.6	2.9	112.7	A119 R120 S126 N127	A119-R123 WeakPolarHBondContact O-CB 3.21Å; A119-R123 WeakPolarHBondContact O-CG 3.16Å; A119-R123 PolarHBondContact O-N 3.41Å; R120-R123 PolarHBondContact O-N 2.88Å; R123-S126 WeakPolarHBondContact CA-OG 3.21Å; R123-S126 PolarHBondContact O-OG 2.79Å; R123-S126 VanDerWaalsContact O-OG 3.06Å; R123-N127 VanDerWaalsContact O-CB 3.29Å; R123-N127 WeakPolarHBondContact O-CB 3.34Å; R123-N127 PolarHBondContact O-N 2.84Å; R123-N127 PolarHBondContact O-ND2 3.26Å; R123-N127 PolarHBondContact O-OD1 3.36Å
124	K	72.8	Confident	71.5	Confident	154 Å²	154	110.7 Å²	110.7	67%	0.67	54%	0.539	S	S	*	.	H	α-helix	trans	-67.5	-42.3	174.4	-74.3	179.1	179.3	-173.9	0	111.4	R120 N121 L122 K128	R120-K124 WeakPolarHBondContact O-CG 3.15Å; R120-K124 PolarHBondContact O-N 3.07Å; N121-K124 PolarHBondContact O-N 3.4Å; L122-K124 VanDerWaalsContact C-N 3.34Å; L122-K124 PolarHBondContact O-N 2.87Å; K124-K128 WeakPolarHBondContact O-CB 3.48Å; K124-K128 PolarHBondContact O-N 2.96Å
125	A	67.9	Low	69.7	Low	49 Å²	49	112.4 Å²	112.4	41%	0.405	55%	0.553	S	S	.	*	H	α-helix	trans	-68.2	-41.1	176.6	0	0	0	0	0	112.2	N121 L122 K128 L129	N121-A125 WeakPolarHBondContact O-CB 3.37Å; N121-A125 PolarHBondContact O-N 3.33Å; L122-A125 PolarHBondContact O-N 3.4Å; A125-K128 PolarHBondContact O-N 3.13Å; A125-L129 PolarHBondContact O-N 3.01Å
126	S	63.8	Low	67.3	Low	56 Å²	56	108.9 Å²	108.9	39%	0.392	55%	0.546	S	S	.	.	H	α-helix	trans	-66.7	-42.4	178.2	71.1	0	0	0	0	111.3	L122 R123 K128 L129 F130	L122-S126 VanDerWaalsContact O-CB 3.28Å; L122-S126 WeakPolarHBondContact O-CB 3.27Å; L122-S126 PolarHBondContact O-N 3.23Å; L122-S126 PolarHBondContact O-OG 2.97Å; R123-S126 WeakPolarHBondContact CA-OG 3.21Å; R123-S126 PolarHBondContact O-OG 2.79Å; R123-S126 VanDerWaalsContact O-OG 3.06Å; S126-K128 VanDerWaalsContact C-N 3.31Å; S126-K128 PolarHBondContact O-N 3Å; S126-L129 PolarHBondContact O-N 3.13Å; S126-F130 WeakPolarHBondContact O-CB 3.31Å; S126-F130 PolarHBondContact O-N 3.11Å
127	N	62.8	Low	65.4	Low	93 Å²	93	113.1 Å²	113.1	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-64.6	-40	175.9	-71	-3.3	0	0	0	110.4	R123 F130 Y131	R123-N127 VanDerWaalsContact O-CB 3.29Å; R123-N127 WeakPolarHBondContact O-CB 3.34Å; R123-N127 PolarHBondContact O-N 2.84Å; R123-N127 PolarHBondContact O-ND2 3.26Å; R123-N127 PolarHBondContact O-OD1 3.36Å; N127-F130 PolarHBondContact O-N 2.84Å; N127-Y131 WeakPolarHBondContact O-CD2 3.39Å; N127-Y131 PolarHBondContact O-N 3.24Å
128	K	62.9	Low	63.4	Low	146 Å²	146	109.4 Å²	109.4	64%	0.635	58%	0.576	S	S	*	*	H	α-helix	trans	-61.9	-46	176	-163.8	179.6	179.1	-169.7	0	111.9	K124 A125 S126 F130 Y131 E132	K124-K128 WeakPolarHBondContact O-CB 3.48Å; K124-K128 PolarHBondContact O-N 2.96Å; A125-K128 PolarHBondContact O-N 3.13Å; S126-K128 VanDerWaalsContact C-N 3.31Å; S126-K128 PolarHBondContact O-N 3Å; K128-F130 VanDerWaalsContact C-N 3.35Å; K128-F130 PolarHBondContact O-N 3.17Å; K128-Y131 PolarHBondContact O-N 2.69Å; K128-E132 WeakPolarHBondContact O-CB 3.42Å; K128-E132 PolarHBondContact O-N 3.21Å
129	L	60.3	Low	61.4	Low	112 Å²	112	113.4 Å²	113.4	59%	0.586	59%	0.589	S	S	*	*	H	α-helix	trans	-60.7	-42.7	173.3	-81.3	160.1	0	0	0	111.6	A125 S126 Y131 E132 T133	A125-L129 PolarHBondContact O-N 3.01Å; S126-L129 PolarHBondContact O-N 3.13Å; L129-Y131 VanDerWaalsContact C-N 3.32Å; L129-Y131 PolarHBondContact O-N 3.23Å; L129-E132 PolarHBondContact O-N 2.82Å; L129-T133 PolarHBondContact O-N 3.39Å; L129-T133 PolarHBondContact O-OG1 3.05Å
130	F	58.3	Low	59.5	Low	144 Å²	144	122.9 Å²	122.9	63%	0.632	62%	0.616	S	S	*	*	H	α-helix	trans	-65.8	-33.2	-179.8	-149.9	-95.9	0	0	0	112.7	S126 N127 K128 N134	S126-F130 WeakPolarHBondContact O-CB 3.31Å; S126-F130 PolarHBondContact O-N 3.11Å; N127-F130 PolarHBondContact O-N 2.84Å; K128-F130 VanDerWaalsContact C-N 3.35Å; K128-F130 PolarHBondContact O-N 3.17Å; F130-N134 WeakPolarHBondContact CD1-ND2 3.45Å; F130-N134 VanDerWaalsContact CE1-ND2 3.28Å; F130-N134 WeakPolarHBondContact CE1-ND2 3.44Å; F130-N134 WeakPolarHBondContact O-CB 3.28Å; F130-N134 VanDerWaalsContact O-CG 3.3Å; F130-N134 PolarHBondContact O-N 3.11Å; F130-N134 PolarHBondContact O-ND2 2.92Å
131	Y	56.9	Low	57.7	Low	173 Å²	173	121.5 Å²	121.5	68%	0.678	62%	0.617	S	S	*	*	H	α-helix	trans	-76	-34.4	173	-75.8	-69.8	0	0	0	112.4	N127 K128 L129 N134 A135	N127-Y131 WeakPolarHBondContact O-CD2 3.39Å; N127-Y131 PolarHBondContact O-N 3.24Å; K128-Y131 PolarHBondContact O-N 2.69Å; L129-Y131 VanDerWaalsContact C-N 3.32Å; L129-Y131 PolarHBondContact O-N 3.23Å; Y131-N134 PolarHBondContact O-N 3.15Å; Y131-A135 WeakPolarHBondContact O-CB 3.38Å; Y131-A135 PolarHBondContact O-N 3.44Å
132	E	55.9	Low	55.8	Low	130 Å²	130	123.1 Å²	123.1	61%	0.607	63%	0.632	S	S	*	*	H	α-helix	trans	-70.5	-38.1	177.9	-151	168.5	143.2	0	0	111.8	K128 L129 N134 S136	K128-E132 WeakPolarHBondContact O-CB 3.42Å; K128-E132 PolarHBondContact O-N 3.21Å; L129-E132 PolarHBondContact O-N 2.82Å; E132-N134 VanDerWaalsContact C-N 3.33Å; E132-N134 PolarHBondContact O-N 3.3Å; E132-S136 PolarHBondContact O-N 3.03Å
133	T	55.2	Low	54.5	Low	80 Å²	80	124.1 Å²	124.1	49%	0.491	64%	0.637	S	S	.	*	H	α-helix	trans	-69.8	-28.4	173.8	-40.9	0	0	0	0	112.7	L129	L129-T133 PolarHBondContact O-N 3.39Å; L129-T133 PolarHBondContact O-OG1 3.05Å
134	N	52	Low	52.9	Low	114 Å²	114	123.3 Å²	123.3	61%	0.61	64%	0.641	S	S	*	*	H	α-helix	trans	-90.3	-18.8	178.4	-74.2	-45.3	0	0	0	113.9	F130 Y131 E132	F130-N134 WeakPolarHBondContact CD1-ND2 3.45Å; F130-N134 VanDerWaalsContact CE1-ND2 3.28Å; F130-N134 WeakPolarHBondContact CE1-ND2 3.44Å; F130-N134 WeakPolarHBondContact O-CB 3.28Å; F130-N134 VanDerWaalsContact O-CG 3.3Å; F130-N134 PolarHBondContact O-N 3.11Å; F130-N134 PolarHBondContact O-ND2 2.92Å; Y131-N134 PolarHBondContact O-N 3.15Å; E132-N134 VanDerWaalsContact C-N 3.33Å; E132-N134 PolarHBondContact O-N 3.3Å
135	A	53.1	Low	51.1	Low	82 Å²	82	122.3 Å²	122.3	68%	0.678	64%	0.643	S	S	*	*	H	α-helix	trans	-89.2	-12.3	177.2	0	0	0	0	0	113.4	Y131 P137	Y131-A135 WeakPolarHBondContact O-CB 3.38Å; Y131-A135 PolarHBondContact O-N 3.44Å; A135-P137 WeakPolarHBondContact O-CD 3.47Å
136	S	41.6	Very low	49.9	Very low	66 Å²	66	128.2 Å²	128.2	46%	0.462	67%	0.666	S	S	.	*			trans	-98	110.4	173.8	-164	0	0	0	0	110.4	E132 A138	E132-S136 PolarHBondContact O-N 3.03Å; S136-A138 PolarHBondContact O-N 3.26Å
137	P	48.5	Very low	48.5	Very low	137 Å²	137	133.2 Å²	133.2	89%	0.89	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	14.2	-179.2	28.5	-32.8	0	0	0	114.2	A135	A135-P137 WeakPolarHBondContact O-CD 3.47Å
138	A	46.4	Very low	47.4	Very low	82 Å²	82	136 Å²	136	68%	0.678	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.2	4.1	-170.5	0	0	0	0	0	115.7	S136	S136-A138 PolarHBondContact O-N 3.26Å
139	F	43.6	Very low	46	Very low	175 Å²	175	135.9 Å²	135.9	77%	0.768	70%	0.704	S	S	*	*			trans	-132.2	46.2	-179.5	-139.9	-96.5	0	0	0	113.4
140	R	41.4	Very low	45	Very low	243 Å²	243	136.1 Å²	136.1	92%	0.917	71%	0.71	S	S	*	*			trans	-91	82.8	161.2	-83.5	-166.5	176.5	-173.3	1.1	109.5
141	Q	43.7	Very low	43.9	Very low	146 Å²	146	134.1 Å²	134.1	68%	0.682	71%	0.714	S	S	*	*			trans	-138.2	110	155.1	-81	-169.1	-12	0	0	109.7	I143	Q141-I143 HydrophobicContact CB-CG1 4.18Å; Q141-I143 PolarHBondContact O-N 3.19Å
142	P	38.3	Very low	43.1	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	71%	0.712	S	S	*	*			trans	-80.4	97.5	161.2	31.8	-23.6	0	0	0	106.5	Q144	P142-Q144 PolarHBondContact O-N 2.93Å
143	I	46	Very low	42.2	Very low	128 Å²	128	131 Å²	131	66%	0.656	72%	0.721	S	S	*	*			trans	-81.2	74.6	170.7	-51.6	-179.4	0	0	0	107.5	Q141	Q141-I143 HydrophobicContact CB-CG1 4.18Å; Q141-I143 PolarHBondContact O-N 3.19Å
144	Q	39.4	Very low	41.5	Very low	160 Å²	160	134.3 Å²	134.3	75%	0.748	73%	0.734	S	S	*	*			trans	-59.7	146.6	134.1	-85.2	172.4	-22.6	0	0	106.5	P142	P142-Q144 PolarHBondContact O-N 2.93Å
145	N	36.1	Very low	40.9	Very low	134 Å²	134	137.6 Å²	137.6	72%	0.717	75%	0.745	S	S	*	*			trans	95.1	66.7	178.6	-39.6	-22.8	0	0	0	114.5	E147	N145-E147 VanDerWaalsContact C-N 3.32Å
146	L	41.2	Very low	40.1	Very low	172 Å²	172	138.4 Å²	138.4	90%	0.901	74%	0.744	S	S	*	*			trans	-97.9	69.8	147.6	-157	74.2	0	0	0	107.4	L148	L146-L148 PolarHBondContact O-N 3.24Å
147	E	35.8	Very low	40.1	Very low	162 Å²	162	142.8 Å²	142.8	76%	0.757	76%	0.762	S	S	*	*			trans	-86.9	99.4	172	-159	170.8	132.9	0	0	107	N145 N149	N145-E147 VanDerWaalsContact C-N 3.32Å; E147-N149 PolarHBondContact O-N 3.11Å
148	L	38.7	Very low	40	Very low	150 Å²	150	145 Å²	145	79%	0.785	76%	0.761	S	S	*	*			trans	-79.4	98.8	178.2	-162.6	75	0	0	0	108	L146 T150	L146-L148 PolarHBondContact O-N 3.24Å; L148-T150 PolarHBondContact O-N 3.25Å; L148-T150 VanDerWaalsContact O-N 3.08Å
149	N	33.6	Very low	39.8	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	77%	0.765	S	S	*	*			trans	-59.2	107.5	169.8	-81	-25.5	0	0	0	109.7	E147	E147-N149 PolarHBondContact O-N 3.11Å
150	T	38.5	Very low	40	Very low	116 Å²	116	143.7 Å²	143.7	71%	0.712	76%	0.763	S	S	*	*			trans	-145.4	105.5	160.2	-47.3	0	0	0	0	110	L148	L148-T150 PolarHBondContact O-N 3.25Å; L148-T150 VanDerWaalsContact O-N 3.08Å
151	S	35.6	Very low	40	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	76%	0.759	S	S	*	*			trans	61.1	110.5	146.3	-148.8	0	0	0	0	120.3
152	S	40	Very low	40.1	Very low	92 Å²	92	143 Å²	143	64%	0.643	76%	0.764	S	S	*	*			trans	56.2	117.3	132.3	61.5	0	0	0	0	120.1
153	D	37.8	Very low	40.5	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	76%	0.763	S	S	*	*			trans	93.1	113	134.8	-83.1	-34.8	0	0	0	120.3
154	I	40.8	Very low	40	Very low	150 Å²	150	145.1 Å²	145.1	77%	0.769	77%	0.774	S	S	*	*			trans	102.8	92.3	141.8	-56.1	154.6	0	0	0	117.9
155	Q	38.6	Very low	40.1	Very low	182 Å²	182	145.3 Å²	145.3	85%	0.85	78%	0.779	S	S	*	*			trans	63.8	138.6	136.6	-88.6	-160.3	-1.1	0	0	124.5
156	P	35.9	Very low	40.3	Very low	99 Å²	99	144.9 Å²	144.9	64%	0.643	79%	0.786	S	S	*	*			trans	-101.7	171.4	-169.5	42.6	-34	0	0	0	113.1
157	N	42.8	Very low	40.3	Very low	158 Å²	158	140.7 Å²	140.7	85%	0.845	78%	0.784	S	S	*	*			trans	161.3	116.4	151	-76.4	-28.1	0	0	0	105.4
158	E	46.8	Very low	40.4	Very low	184 Å²	184	136.4 Å²	136.4	86%	0.86	78%	0.784	S	S	*	*			cis	174.5	143.1	46.2	-176.8	-177.7	165.8	0	0	108.2
159	P	40.5	Very low	40.3	Very low	120 Å²	120	134.8 Å²	134.8	78%	0.779	79%	0.785	S	S	*	*			trans	-137.3	-170.3	158.2	38.9	-24.1	0	0	0	112.4
160	P	49.7	Very low	40.5	Very low	110 Å²	110	139.4 Å²	139.4	71%	0.714	79%	0.792	S	S	*	*				-126.3	180	-51.8	36	-19.7	0	0	0	111.4
161	K	41.5	Very low	40.4	Very low	191 Å²	191	141.9 Å²	141.9	83%	0.83	80%	0.8	S	S	*	*			trans	-173.2	130.1	154.6	-109.4	155.5	-165.2	175.6	0	117.5
162	K	44.5	Very low	40.5	Very low	184 Å²	184	144 Å²	144	80%	0.8	81%	0.809	S	S	*	*			trans	96.7	136.1	146	-61.3	165.6	-174.9	-170.7	0	117.6
163	V	45.9	Very low	40.3	Very low	121 Å²	121	149.4 Å²	149.4	73%	0.733	82%	0.82	S	S	*	*			cis	-166.7	144	6.6	139.9	0	0	0	0	108.1
164	L	36.1	Very low	40.3	Very low	170 Å²	170	150.5 Å²	150.5	89%	0.89	83%	0.825	S	S	*	*			trans	-100	145.4	169	-78.3	164.5	0	0	0	110.4
165	L	42.9	Very low	39.9	Very low	164 Å²	164	148.3 Å²	148.3	86%	0.859	82%	0.822	S	S	*	*			trans	-175	112.4	157.5	-89.9	144.3	0	0	0	106.1
166	S	39.8	Very low	39.8	Very low	125 Å²	125	144.4 Å²	144.4	87%	0.874	82%	0.815	S	S	*	*				80.6	126.6	51	-161.3	0	0	0	0	116.2
167	G	40	Very low	39.9	Very low	83 Å²	83	148.2 Å²	148.2	86%	0.856	83%	0.825	S	S	*	*			trans	110	136.1	159.8	0	0	0	0	0	115.3
168	G	38.2	Very low	39.4	Very low	73 Å²	73	148.4 Å²	148.4	75%	0.753	82%	0.818	S	S	*	*			cis	-179.4	134.6	3.4	0	0	0	0	0	107
169	S	37.9	Very low	39	Very low	115 Å²	115	145.1 Å²	145.1	80%	0.804	82%	0.815	S	S	*	*				67	110	88	-139.9	0	0	0	0	115.9
170	R	37.9	Very low	38.7	Very low	242 Å²	242	145.3 Å²	145.3	91%	0.913	81%	0.808	S	S	*	*				162.4	134.9	114.5	-88.3	178.9	174.2	-173.4	-1.4	114.6
171	L	35.6	Very low	38.2	Very low	169 Å²	169	149.8 Å²	149.8	89%	0.885	81%	0.812	S	S	*	*			trans	-70.3	146.3	164.3	-76.1	141.3	0	0	0	111.7
172	T	38.5	Very low	37.9	Very low	147 Å²	147	149 Å²	149	90%	0.902	81%	0.812	S	S	*	*			trans	-161.2	144	140.1	21.4	0	0	0	0	111.3
173	K	34	Very low	37.3	Very low	204 Å²	204	147.4 Å²	147.4	89%	0.887	81%	0.812	S	S	*	*			trans	-116	124.7	-171.6	-177	-171.9	-169.9	-176.3	0	107.2
174	I	39.8	Very low	36.9	Very low	170 Å²	170	146.4 Å²	146.4	87%	0.872	81%	0.808	S	S	*	*			trans	-144.3	143	166.2	-50.1	178.6	0	0	0	109.5
175	S	31.9	Very low	37	Very low	103 Å²	103	143.5 Å²	143.5	72%	0.72	80%	0.802	S	S	*	*			trans	-108.6	165.6	-167.5	171	0	0	0	0	112.3
176	S	36.5	Very low	36.7	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	80%	0.802	S	S	*	*			trans	93.2	130.8	147.1	71.6	0	0	0	0	122.9
177	E	36.7	Very low	36.2	Very low	180 Å²	180	145.3 Å²	145.3	84%	0.841	80%	0.797	S	S	*	*			trans	92.3	145.7	138.7	-155.8	171	162.3	0	0	118
178	K	34.1	Very low	36	Very low	162 Å²	162	147.6 Å²	147.6	70%	0.704	79%	0.794	S	S	*	*			cis	-179.7	129.9	-37.8	172.1	-174.1	177.4	-173.9	0	105.7
179	S	37.9	Very low	35.5	Very low	114 Å²	114	150.5 Å²	150.5	80%	0.797	79%	0.793	S	S	*	*			trans	177	114.7	151.8	49.1	0	0	0	0	107.7
180	I	33.9	Very low	35.4	Very low	125 Å²	125	152 Å²	152	64%	0.641	80%	0.796	S	S	*	*				65	132	66.4	-55.5	-177.9	0	0	0	114.7
181	Y	38.5	Very low	35.2	Very low	203 Å²	203	147.3 Å²	147.3	80%	0.796	79%	0.788	S	S	*	*			trans	113.8	124.8	172.8	-76.9	-80.6	0	0	0	111.8
182	E	35.3	Very low	34.8	Very low	175 Å²	175	143.9 Å²	143.9	82%	0.818	78%	0.778	S	S	*	*			cis	-167.5	155.1	1	-146.8	170.8	177.6	0	0	107.3
183	N	32.1	Very low	34.7	Very low	151 Å²	151	143.8 Å²	143.8	81%	0.807	77%	0.772	S	S	*	*			trans	-104.2	-165.9	-177.6	-138.2	-6.9	0	0	0	108.1
184	P	37.9	Very low	34.6	Very low	100 Å²	100	140.9 Å²	140.9	65%	0.649	77%	0.766	S	S	*	*			cis	-146.6	-169.6	-5	34	-8.7	0	0	0	116.8
185	S	37.2	Very low	34.5	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	77%	0.767	S	S	*	*			trans	99.7	134.9	154	85.2	0	0	0	0	115.9
186	Q	36.5	Very low	34.6	Very low	183 Å²	183	143.3 Å²	143.3	86%	0.855	77%	0.767	S	S	*	*			cis	-149.9	155.6	21.5	-73.8	178.4	-15.8	0	0	112.8
187	N	30.9	Very low	34.3	Very low	143 Å²	143	145.9 Å²	145.9	77%	0.765	77%	0.773	S	S	*	*			trans	-11.5	150.2	155.7	-74.5	-27.2	0	0	0	118.2
188	T	34.1	Very low	34	Very low	132 Å²	132	143.7 Å²	143.7	81%	0.81	77%	0.766	S	S	*	*				-170	147.4	63	-34.3	0	0	0	0	112.8
189	N	29	Very low	34.1	Very low	134 Å²	134	142.6 Å²	142.6	72%	0.717	77%	0.767	S	S	*	*			trans	-60.2	141	179.1	-53.1	-52.3	0	0	0	115.5
190	V	34.7	Very low	33.9	Very low	145 Å²	145	142.4 Å²	142.4	88%	0.879	77%	0.765	S	S	*	*			trans	-149.8	99.8	138.4	-173.6	0	0	0	0	111.6
191	I	34	Very low	33.7	Very low	144 Å²	144	143.7 Å²	143.7	74%	0.738	77%	0.773	S	S	*	*			trans	-0.3	120.2	148.1	-59.1	165	0	0	0	118
192	S	28.1	Very low	33.6	Very low	98 Å²	98	141.3 Å²	141.3	69%	0.685	77%	0.774	S	S	*	*			trans	-73	131.7	158	173.3	0	0	0	0	110.4
193	N	35.4	Very low	33.7	Very low	145 Å²	145	143.2 Å²	143.2	78%	0.775	78%	0.78	S	S	*	*			trans	-132.6	105.8	164.6	-117.5	-1.8	0	0	0	109.7
194	N	31.7	Very low	33.8	Very low	142 Å²	142	145 Å²	145	76%	0.759	78%	0.784	S	S	*	*			trans	-63.2	124.7	167.2	-69.9	-30.3	0	0	0	109.1
195	N	38.4	Very low	33.5	Very low	164 Å²	164	143.6 Å²	143.6	88%	0.877	79%	0.787	S	S	*	*			trans	-132.7	118.2	155.6	-90.1	-22.6	0	0	0	110.1
196	H	32.7	Very low	33.5	Very low	160 Å²	160	147.8 Å²	147.8	74%	0.741	80%	0.795	S	S	*	*			trans	-71	128	178.3	-160.1	-104.2	0	0	0	109.2	L198	H196-L198 VanDerWaalsContact CE1-CD1 3.43Å; H196-L198 WeakPolarHBondContact CE1-CD1 3.49Å
197	L	31.4	Very low	33.8	Very low	155 Å²	155	143.8 Å²	143.8	81%	0.812	79%	0.787	S	S	*	*			trans	-143.7	105.9	158.5	-153.3	83.2	0	0	0	110.4	I199	L197-I199 HydrophobicContact CD2-CD1 4.03Å; L197-I199 HydrophobicContact CD2-CG1 4.41Å
198	L	30.4	Very low	34.4	Very low	134 Å²	134	144.3 Å²	144.3	70%	0.702	79%	0.788	S	S	*	*			trans	-80.7	122.5	168.3	-77.7	156.9	0	0	0	109.2	H196	H196-L198 VanDerWaalsContact CE1-CD1 3.43Å; H196-L198 WeakPolarHBondContact CE1-CD1 3.49Å
199	I	35.1	Very low	34.8	Very low	139 Å²	139	147.2 Å²	147.2	71%	0.713	79%	0.79	S	S	*	*			trans	-148.7	87.4	157.6	-54.8	179.3	0	0	0	105.2	L197	L197-I199 HydrophobicContact CD2-CD1 4.03Å; L197-I199 HydrophobicContact CD2-CG1 4.41Å
200	S	34.2	Very low	35.5	Very low	109 Å²	109	147 Å²	147	76%	0.762	79%	0.788	S	S	*	*				65.3	94.7	93.3	-54.3	0	0	0	0	113.3
201	D	30.8	Very low	35.8	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	78%	0.778	S	S	*	*			trans	-57.9	141	162	-66.6	-52.5	0	0	0	111.2
202	N	36.3	Very low	36.2	Very low	152 Å²	152	145.4 Å²	145.4	81%	0.813	78%	0.78	S	S	*	*			trans	157.8	103	145.1	-80.1	-22.9	0	0	0	108.2
203	F	36.1	Very low	36.9	Very low	216 Å²	216	151.3 Å²	151.3	95%	0.947	79%	0.787	S	S	*	*			trans	-172.1	98.3	134.6	-116.9	-86.3	0	0	0	109.3
204	E	35.8	Very low	37.2	Very low	188 Å²	188	152.2 Å²	152.2	88%	0.879	79%	0.787	S	S	*	*			trans	-56.4	151.1	163.1	-74.5	168.7	102.1	0	0	111.8
205	G	30.9	Very low	37.6	Very low	70 Å²	70	154 Å²	154	72%	0.722	79%	0.79	S	S	*	*	S	Bend	trans	78.8	130	136.5	0	0	0	0	0	118
206	E	36.3	Very low	37.5	Very low	198 Å²	198	155.2 Å²	155.2	93%	0.925	79%	0.788	S	S	*	*			trans	95.3	-2	147.9	-140.9	165.4	-160.1	0	0	120.9
207	S	43.2	Very low	37.5	Very low	98 Å²	98	152.9 Å²	152.9	69%	0.685	79%	0.79	S	S	*	*			trans	-89.7	-16.4	-174.6	-175.4	0	0	0	0	117.3	K209	S207-K209 PolarHBondContact O-N 3.14Å
208	I	44.3	Very low	37.6	Very low	155 Å²	155	156.5 Å²	156.5	80%	0.795	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-14.6	-164.7	-57.2	177.9	0	0	0	114.3
209	K	42.2	Very low	37.8	Very low	193 Å²	193	158.4 Å²	158.4	84%	0.839	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-12	-178	-73.7	-179	179.2	175.8	0	115.2	S207	S207-K209 PolarHBondContact O-N 3.14Å
210	N	43.4	Very low	37.7	Very low	129 Å²	129	157.4 Å²	157.4	69%	0.69	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-10.7	-179.2	-77.2	-26.7	0	0	0	114.7	V212	N210-V212 VanDerWaalsContact C-N 3.34Å; N210-V212 PolarHBondContact O-N 3.27Å
211	L	41.7	Very low	37.8	Very low	126 Å²	126	161.4 Å²	161.4	66%	0.66	80%	0.803	S	S	*	*	G	3₁₀ helix	trans	-76.2	-21	-179.8	-157.4	68.7	0	0	0	113.3	R213	L211-R213 PolarHBondContact O-N 3.37Å
212	V	41.9	Very low	37.9	Very low	129 Å²	129	164.1 Å²	164.1	78%	0.782	81%	0.807	S	S	*	*	G	3₁₀ helix	trans	-81.4	-12.3	-175.7	-179	0	0	0	0	113.2	N210	N210-V212 VanDerWaalsContact C-N 3.34Å; N210-V212 PolarHBondContact O-N 3.27Å
213	R	42.2	Very low	38	Very low	223 Å²	223	163.8 Å²	163.8	84%	0.842	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-99.9	-7.4	-178.9	-78.5	-174.1	-176.2	179.9	2.4	115.7	L211	L211-R213 PolarHBondContact O-N 3.37Å
214	Q	41.8	Very low	38.1	Very low	164 Å²	164	160.9 Å²	160.9	77%	0.766	80%	0.798	S	S	*	*	S	Bend	trans	-93.6	-5.2	-176.9	-81.2	-168.9	-16.1	0	0	115.8	K216	Q214-K216 PolarHBondContact O-N 3.2Å
215	H	40.1	Very low	38.2	Very low	179 Å²	179	158.1 Å²	158.1	83%	0.829	79%	0.79	S	S	*	*	S	Bend	trans	-82.8	14.9	179.6	-91.2	-82.2	0	0	0	115.4
216	K	36.3	Very low	38.8	Very low	190 Å²	190	162.4 Å²	162.4	83%	0.826	80%	0.796	S	S	*	*	S	Bend	trans	-114.4	106.3	176.8	-132.1	174.2	-175.8	178.7	0	109.4	Q214	Q214-K216 PolarHBondContact O-N 3.2Å
217	S	33.8	Very low	38.8	Very low	111 Å²	111	161 Å²	161	78%	0.776	80%	0.795	S	S	*	*	S	Bend	trans	113.3	140.3	169.3	87.1	0	0	0	0	115.7
218	R	33.2	Very low	38.7	Very low	230 Å²	230	161.9 Å²	161.9	87%	0.868	80%	0.801	S	S	*	*			trans	92.2	68.4	173.9	-59.8	-175.9	170.9	-175.7	-2.3	117.2
219	H	34.6	Very low	38.3	Very low	174 Å²	174	157.9 Å²	157.9	81%	0.806	80%	0.798	S	S	*	*			trans	-103	90.2	142.6	-106	-77.2	0	0	0	109.3	Y221	H219-Y221 AromaticContact ND1-CD2 3.83Å
220	S	31.8	Very low	38.1	Very low	119 Å²	119	158.3 Å²	158.3	83%	0.832	80%	0.8	S	S	*	*			trans	-129.7	99.8	158	-90.7	0	0	0	0	106.8
221	Y	36.8	Very low	38	Very low	193 Å²	193	161.7 Å²	161.7	76%	0.757	81%	0.808	S	S	*	*			trans	-105.2	111.5	167.6	-81.6	-82.7	0	0	0	108.8	H219	H219-Y221 AromaticContact ND1-CD2 3.83Å
222	K	33.8	Very low	37.6	Very low	209 Å²	209	165.7 Å²	165.7	91%	0.909	82%	0.82	S	S	*	*			trans	-69	120.4	159	-87.2	179.7	173	179.2	0	107.4
223	I	38.5	Very low	37.6	Very low	145 Å²	145	171.3 Å²	171.3	74%	0.744	83%	0.828	S	S	*	*			trans	-93.8	114.1	170.5	-61.9	174.9	0	0	0	107.3
224	N	37.8	Very low	37.2	Very low	155 Å²	155	169.7 Å²	169.7	83%	0.829	83%	0.827	S	S	*	*			trans	-98	113.3	171	-147.3	14.6	0	0	0	107.4
225	N	36.8	Very low	37.1	Very low	131 Å²	131	169.2 Å²	169.2	70%	0.701	83%	0.829	S	S	*	*			trans	-93.9	111	-179.6	-85.5	-14	0	0	0	109.8
226	N	43.9	Very low	37	Very low	160 Å²	160	168.2 Å²	168.2	86%	0.856	83%	0.825	S	S	*	*			trans	-125.8	118.2	156.7	-89.1	-16.9	0	0	0	109.7
227	N	36.4	Very low	37.1	Very low	169 Å²	169	166.4 Å²	166.4	90%	0.904	82%	0.824	S	S	*	*			trans	-72.3	130.2	180	-80.5	-33.4	0	0	0	111.5
228	S	41.4	Very low	37.4	Very low	116 Å²	116	166.4 Å²	166.4	81%	0.811	82%	0.824	S	S	*	*			trans	-147.4	113.4	147.7	64.4	0	0	0	0	108.9
229	G	35.4	Very low	37.9	Very low	71 Å²	71	162.7 Å²	162.7	73%	0.732	82%	0.82	S	S	*	*			trans	-72.4	161.8	-173.3	0	0	0	0	0	114.4
230	K	38.6	Very low	38.1	Very low	201 Å²	201	159.9 Å²	159.9	87%	0.874	82%	0.817	S	S	*	*				170.8	136.6	125.3	-94.7	168.3	-176.6	175.4	0	110.2
231	K	41.4	Very low	38.8	Very low	201 Å²	201	159.2 Å²	159.2	87%	0.874	80%	0.803	S	S	*	*			trans	77.5	101.7	152.2	-68.8	179.9	175.9	-178.4	0	119.3
232	K	33.2	Very low	38.8	Very low	209 Å²	209	159.4 Å²	159.4	91%	0.909	81%	0.808	S	S	*	*			trans	-40.9	126.3	152.4	-71.1	173.1	171.7	175.9	0	112.5
233	R	41	Very low	39.2	Very low	248 Å²	248	153.5 Å²	153.5	94%	0.936	80%	0.798	S	S	*	*			trans	-130	116.4	147	-95.4	-176.4	172.2	169.5	-2.9	107.6	N235	R233-N235 PolarHBondContact O-N 3.04Å
234	K	35.4	Very low	39.3	Very low	189 Å²	189	157.8 Å²	157.8	82%	0.822	81%	0.805	S	S	*	*			trans	-62.6	124.8	170.5	-74.8	178.5	171.5	-174.6	0	107.8
235	N	39.4	Very low	39.4	Very low	153 Å²	153	156.1 Å²	156.1	82%	0.818	80%	0.803	S	S	*	*			trans	-112.4	94.1	162.9	-148.8	9.7	0	0	0	106.3	R233 N237	R233-N235 PolarHBondContact O-N 3.04Å; N235-N237 PolarHBondContact O-N 3.45Å
236	E	37.8	Very low	39.6	Very low	159 Å²	159	156.3 Å²	156.3	74%	0.743	81%	0.808	S	S	*	*			trans	-70.1	103.7	167.5	-78.3	170.4	153.5	0	0	106.8
237	N	38.7	Very low	39.2	Very low	151 Å²	151	156.8 Å²	156.8	81%	0.807	81%	0.81	S	S	*	*			trans	-171.3	28.4	159.1	-94	-12.3	0	0	0	113.3	N235 I239	N235-N237 PolarHBondContact O-N 3.45Å; N237-I239 PolarHBondContact O-N 3Å
238	S	40.1	Very low	39.2	Very low	111 Å²	111	156.2 Å²	156.2	78%	0.776	81%	0.806	S	S	*	*			trans	-87.3	99.6	171.3	60.5	0	0	0	0	110.1
239	I	43.4	Very low	39.2	Very low	152 Å²	152	160.5 Å²	160.5	78%	0.779	81%	0.81	S	S	*	*			trans	-62.6	124.6	168.8	-59.3	168.9	0	0	0	107.6	N237 I241	N237-I239 PolarHBondContact O-N 3Å; I239-I241 PolarHBondContact O-N 2.98Å; I239-I241 VanDerWaalsContact O-N 3.15Å
240	P	39.1	Very low	39.3	Very low	115 Å²	115	172.4 Å²	172.4	75%	0.747	83%	0.833	S	S	*	*			trans	-69.3	114.7	177.7	27	-31	0	0	0	109.2	K242	P240-K242 PolarHBondContact O-N 3.18Å
241	I	45.6	Very low	39.3	Very low	106 Å²	106	171 Å²	171	54%	0.544	83%	0.831	S	S	.	*			trans	-67.6	104	171.6	-59.5	174	0	0	0	107.3	I239 A243	I239-I241 PolarHBondContact O-N 2.98Å; I239-I241 VanDerWaalsContact O-N 3.15Å; I241-A243 PolarHBondContact O-N 3.04Å; I241-A243 VanDerWaalsContact O-N 3.13Å
242	K	36.2	Very low	39.2	Very low	196 Å²	196	169.4 Å²	169.4	85%	0.852	83%	0.829	S	S	*	*			trans	-66.7	103.9	177.5	-159.7	173.6	-172.5	177.3	0	108.8	P240 R244	P240-K242 PolarHBondContact O-N 3.18Å; K242-R244 PolarHBondContact O-N 3.35Å
243	A	44.3	Very low	39.6	Very low	86 Å²	86	167.2 Å²	167.2	71%	0.711	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-61.6	128.3	172.9	0	0	0	0	0	109.8	I241	I241-A243 PolarHBondContact O-N 3.04Å; I241-A243 VanDerWaalsContact O-N 3.13Å
244	R	40	Very low	39.5	Very low	234 Å²	234	162.4 Å²	162.4	88%	0.883	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-77.5	140.6	178.5	-76.8	-176.2	176.8	-176.1	-0.6	110.4	K242	K242-R244 PolarHBondContact O-N 3.35Å
245	P	38.5	Very low	39.7	Very low	121 Å²	121	160.8 Å²	160.8	79%	0.786	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-68.3	134	171.6	28.2	-31.4	0	0	0	110.2	L247	P245-L247 PolarHBondContact O-N 3.09Å
246	V	42.1	Very low	39.8	Very low	134 Å²	134	161.3 Å²	161.3	81%	0.812	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-70	118.6	170	178.8	0	0	0	0	107.7	L248	V246-L248 PolarHBondContact O-N 3.28Å; V246-L248 VanDerWaalsContact O-N 3.11Å
247	L	35.3	Very low	39.9	Very low	170 Å²	170	161.4 Å²	161.4	89%	0.89	82%	0.823	S	S	*	*			trans	-64.7	106.5	169.6	-77	166.3	0	0	0	108.9	P245 K249	P245-L247 PolarHBondContact O-N 3.09Å; L247-K249 PolarHBondContact O-N 3.09Å
248	L	37.3	Very low	40	Very low	157 Å²	157	162.2 Å²	162.2	82%	0.822	82%	0.824	S	S	*	*			trans	-71	118.4	160.3	-93.1	133.2	0	0	0	108.3	V246	V246-L248 PolarHBondContact O-N 3.28Å; V246-L248 VanDerWaalsContact O-N 3.11Å
249	K	41.3	Very low	40	Very low	207 Å²	207	166.5 Å²	166.5	90%	0.9	83%	0.828	S	S	*	*			trans	-75.1	136.8	169.8	-150.5	173	-177.7	-178.7	0	107.7	L247	L247-K249 PolarHBondContact O-N 3.09Å
250	R	36.8	Very low	39.7	Very low	320 Å²	320	167.8 Å²	167.8	100%	1.208	83%	0.832	S	S	*	*			trans	-45	0	-178.9	-85.3	-178.5	178.4	159	-1.4	114.5

Retrieved 250 of 250 residues in 91.5 ms (Link to these results)

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