A0A077ZAR2_TRITR Loading...

PAN 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZAR2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 247 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	32.5	Very low	34.2	Very low	211 Å²	211	129 Å²	129	100%	1.039	73%	0.725	S	S	*	*				0	134.9	0	-81.5	172.1	-90.3	0	0	107.5
2	F	30.1	Very low	34.1	Very low	165 Å²	165	131.3 Å²	131.3	72%	0.724	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-84.2	140	167.4	-63.4	-83.5	0	0	0	107.9	H4	F2-H4 PolarHBondContact O-N 3.27Å
3	A	35.2	Very low	34.1	Very low	69 Å²	69	133 Å²	133	57%	0.57	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-70.7	128.6	173.2	0	0	0	0	0	109.6	A11	A3-A11 HydrophobicContact CB-CB 4.05Å
4	H	28.1	Very low	34	Very low	146 Å²	146	131.7 Å²	131.7	68%	0.676	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-90.5	151	169.5	-72.5	-74.5	0	0	0	110.4	F2 G6 D7	F2-H4 PolarHBondContact O-N 3.27Å; H4-G6 PolarHBondContact O-N 3.12Å; H4-D7 PolarHBondContact N-OD2 3.33Å; H4-D7 PolarHBondContact O-N 2.9Å; H4-D7 VanDerWaalsContact O-N 3.17Å
5	R	29.8	Very low	34.1	Very low	265 Å²	265	130.5 Å²	130.5	100%	1	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	94.5	176.7	-174.3	-179.4	-175.8	173.3	1.9	109.4
6	G	35.4	Very low	34.1	Very low	70 Å²	70	126.3 Å²	126.3	72%	0.722	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	143.7	-12.8	-175.8	0	0	0	0	0	114.2	H4 V8	H4-G6 PolarHBondContact O-N 3.12Å; G6-V8 PolarHBondContact O-N 2.87Å
7	D	35	Very low	34.4	Very low	92 Å²	92	126.5 Å²	126.5	49%	0.492	72%	0.721	S	S	.	*			trans	-67.4	127.1	-179.7	-64.2	-25.9	0	0	0	111.6	H4 A9	H4-D7 PolarHBondContact N-OD2 3.33Å; H4-D7 PolarHBondContact O-N 2.9Å; H4-D7 VanDerWaalsContact O-N 3.17Å; D7-A9 PolarHBondContact O-N 2.89Å
8	V	40.6	Very low	34.4	Very low	158 Å²	158	126.5 Å²	126.5	96%	0.958	71%	0.713	S	S	*	*	S	Bend	trans	-79.4	-1.4	-171.7	-143.6	0	0	0	0	113.6	G6	G6-V8 PolarHBondContact O-N 2.87Å
9	A	38.2	Very low	34.6	Very low	71 Å²	71	122.3 Å²	122.3	59%	0.587	69%	0.687	S	S	*	*	S	Bend	trans	-136.7	140	179.8	0	0	0	0	0	110.3	D7	D7-A9 PolarHBondContact O-N 2.89Å
10	P	34.6	Very low	34.9	Very low	119 Å²	119	117 Å²	117	77%	0.773	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-65	136.3	178.4	27.3	-33.9	0	0	0	110.9	I12	P10-I12 PolarHBondContact O-N 2.89Å
11	A	36.5	Very low	35.2	Very low	53 Å²	53	117.1 Å²	117.1	44%	0.438	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-67.2	122.4	-179.9	0	0	0	0	0	111.4	A3 L13	A3-A11 HydrophobicContact CB-CB 4.05Å; A11-L13 PolarHBondContact O-N 3.29Å
12	I	33.7	Very low	35.5	Very low	157 Å²	157	111.6 Å²	111.6	81%	0.805	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-78.2	118.6	174	-59.4	175.9	0	0	0	108.5	P10	P10-I12 PolarHBondContact O-N 2.89Å
13	L	33.5	Very low	36	Very low	153 Å²	153	109.7 Å²	109.7	80%	0.801	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-79.3	129.5	176.3	-61.3	176.5	0	0	0	109.8	A11	A11-L13 PolarHBondContact O-N 3.29Å
14	V	33.3	Very low	36.1	Very low	115 Å²	115	111.8 Å²	111.8	70%	0.697	62%	0.615	S	S	*	*			trans	-108.3	125.8	176.2	-175.5	0	0	0	0	108.4
15	P	35.3	Very low	36.4	Very low	114 Å²	114	108.8 Å²	108.8	74%	0.74	60%	0.603	S	S	*	*			trans	-62.7	136.7	174.5	-18.9	31.3	0	0	0	110.8
16	T	33.9	Very low	37.2	Very low	63 Å²	63	101.5 Å²	101.5	39%	0.387	59%	0.593	S	S	.	*			trans	-134.4	142.8	164.7	55.6	0	0	0	0	109.4	Q18 H19	T16-Q18 PolarHBondContact O-N 2.72Å; T16-Q18 VanDerWaalsContact O-N 3.08Å; T16-H19 WeakPolarHBondContact CB-CE1 3.44Å; T16-H19 PolarHBondContact OG1-CE1 2.95Å; T16-H19 PolarHBondContact OG1-ND1 2.88Å
17	P	38.6	Very low	37.6	Very low	130 Å²	130	103.7 Å²	103.7	84%	0.844	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-9.7	-163.5	-23.6	35.7	0	0	0	116.7
18	Q	35.8	Very low	37.3	Very low	126 Å²	126	106.3 Å²	106.3	59%	0.589	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.3	48.3	-164.2	-73.3	152.8	18.6	0	0	112	T16 I37 S39	T16-Q18 PolarHBondContact O-N 2.72Å; T16-Q18 VanDerWaalsContact O-N 3.08Å; Q18-I37 CarbonylContact C-O 3.46Å; Q18-S39 PolarHBondContact O-N 2.68Å; Q18-S39 PolarHBondContact O-OG 2.76Å
19	H	38.4	Very low	37.1	Very low	47 Å²	47	103.4 Å²	103.4	22%	0.218	58%	0.58	C	S	.	*			trans	-138.5	122.1	179.3	-69	106.9	0	0	0	117.1	T16 Y21 I37 F38 S39	T16-H19 WeakPolarHBondContact CB-CE1 3.44Å; T16-H19 PolarHBondContact OG1-CE1 2.95Å; T16-H19 PolarHBondContact OG1-ND1 2.88Å; H19-Y21 WeakPolarHBondContact O-CD2 3.15Å; H19-Y21 WeakPolarHBondContact O-CE2 3.26Å; H19-I37 CarbonylContact C-O 2.82Å; H19-I37 WeakPolarHBondContact CA-O 3.38Å; H19-I37 PolarHBondContact N-O 2.78Å; H19-F38 HydrophobicContact CB-CD2 3.66Å; H19-F38 HydrophobicContact CB-CE2 3.96Å; H19-F38 AromaticContact CD2-CD2 3.38Å; H19-F38 WeakPolarHBondContact CD2-CD2 3.34Å; H19-F38 AromaticContact CD2-CE2 3.45Å; H19-F38 VanDerWaalsContact CD2-CE2 3.45Å; H19-F38 WeakPolarHBondContact CD2-CE2 3.01Å; H19-F38 AromaticContact CG-CD2 3.89Å; H19-F38 AromaticContact CG-CE2 3.99Å; H19-S39 PolarHBondContact CD2-N 3.19Å
20	D	39.4	Very low	36.9	Very low	15 Å²	15	108.1 Å²	108.1	8%	0.08	58%	0.583	C	S	.	*			trans	-71.1	133.6	158	-38.6	-26.7	0	0	0	113.1	K31 D36 I37 F38	D20-K31 WeakPolarHBondContact OD2-CE 3.43Å; D20-K31 IonicContact OD2-NZ 2.66Å; D20-K31 PolarHBondContact OD2-NZ 3.47Å; D20-D36 WeakPolarHBondContact OD1-CA 2.98Å; D20-I37 PolarHBondContact N-O 3.04Å; D20-I37 WeakPolarHBondContact OD1-CA 3.39Å; D20-I37 PolarHBondContact OD1-N 2.96Å; D20-F38 HydrophobicContact CB-CB 3.65Å; D20-F38 HydrophobicContact CB-CD2 4.42Å; D20-F38 HydrophobicContact CB-CG 4.39Å; D20-F38 VanDerWaalsContact CG-CB 3.43Å; D20-F38 WeakPolarHBondContact O-CD2 3.42Å; D20-F38 WeakPolarHBondContact O-CE2 3.42Å; D20-F38 PolarHBondContact OD1-N 2.65Å; D20-F38 WeakPolarHBondContact OD2-CB 3.43Å; D20-F38 PolarHBondContact OD2-N 2.98Å
21	Y	42.1	Very low	37.1	Very low	121 Å²	121	106.2 Å²	106.2	48%	0.475	56%	0.563	S	S	.	*			trans	-90	153.9	-170.9	-61.1	-97.5	0	0	0	114.1	H19 S32	H19-Y21 WeakPolarHBondContact O-CD2 3.15Å; H19-Y21 WeakPolarHBondContact O-CE2 3.26Å; Y21-S32 VanDerWaalsContact O-CB 3.23Å; Y21-S32 WeakPolarHBondContact O-CB 3.29Å; Y21-S32 PolarHBondContact O-N 2.95Å
22	Y	38	Very low	37.4	Very low	94 Å²	94	105.5 Å²	105.5	37%	0.369	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.4	134	174.1	-72	-96.4	0	0	0	111.7	R30 K31 W40	Y22-R30 WeakPolarHBondContact CA-O 3.35Å; Y22-K31 HydrophobicContact CD1-CB 4.13Å; Y22-K31 HydrophobicContact CE1-CB 3.62Å; Y22-K31 HydrophobicContact CE1-CG 3.91Å; Y22-K31 HydrophobicContact CE2-CG 4.43Å; Y22-W40 HydrophobicContact CE2-CH2 4.43Å
23	E	40.5	Very low	37.8	Very low	126 Å²	126	104.7 Å²	104.7	59%	0.589	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.9	139.9	179	-173.3	175	-156.5	0	0	110.7	I25 C29 R30	E23-I25 HydrophobicContact CG-CG1 4.43Å; E23-C29 WeakPolarHBondContact O-CA 3.47Å; E23-R30 PolarHBondContact N-O 2.86Å; E23-R30 PolarHBondContact O-N 2.89Å
24	V	36.9	Very low	38.3	Very low	112 Å²	112	107.5 Å²	107.5	68%	0.679	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.6	114.5	178.7	-179.2	0	0	0	0	109.2
25	I	35.9	Very low	38.3	Very low	83 Å²	83	108.4 Å²	108.4	43%	0.426	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.1	105.5	176.9	-55.9	176	0	0	0	108.1	E23 D27 K28 R30	E23-I25 HydrophobicContact CG-CG1 4.43Å; I25-D27 PolarHBondContact O-N 3.49Å; I25-K28 PolarHBondContact N-O 3.32Å; I25-K28 PolarHBondContact O-N 2.03Å; I25-R30 HydrophobicContact CD1-CB 4.38Å
26	S	45.4	Very low	38	Very low	112 Å²	112	107.7 Å²	107.7	78%	0.783	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	-59.8	175.1	51.6	0	0	0	0	118.4
27	D	44.3	Very low	37.7	Very low	116 Å²	116	111 Å²	111	62%	0.62	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.9	-8.4	-171.3	61.2	-59	0	0	0	112.9	I25	I25-D27 PolarHBondContact O-N 3.49Å
28	K	29.2	Very low	37.2	Very low	148 Å²	148	107.2 Å²	107.2	64%	0.643	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	150.9	-174.2	-68.9	169	-170.8	156.6	0	112.6	I25	I25-K28 PolarHBondContact N-O 3.32Å; I25-K28 PolarHBondContact O-N 2.03Å
29	C	35.5	Very low	36.6	Very low	96 Å²	96	103.8 Å²	103.8	65%	0.649	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	138.6	176.2	-57.5	0	0	0	0	111	E23	E23-C29 WeakPolarHBondContact O-CA 3.47Å
30	R	33.7	Very low	36.1	Very low	170 Å²	170	110.2 Å²	110.2	64%	0.642	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	135.7	173.4	-172.2	178.7	178.3	171.9	1.3	110.6	Y22 E23 I25 S32	Y22-R30 WeakPolarHBondContact CA-O 3.35Å; E23-R30 PolarHBondContact N-O 2.86Å; E23-R30 PolarHBondContact O-N 2.89Å; I25-R30 HydrophobicContact CD1-CB 4.38Å; R30-S32 PolarHBondContact O-N 3.34Å
31	K	39.2	Very low	35.5	Very low	80 Å²	80	114.6 Å²	114.6	35%	0.348	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.1	127.7	169.3	-167.3	-177.6	-175	-171.4	0	109.3	D20 Y22	D20-K31 WeakPolarHBondContact OD2-CE 3.43Å; D20-K31 IonicContact OD2-NZ 2.66Å; D20-K31 PolarHBondContact OD2-NZ 3.47Å; Y22-K31 HydrophobicContact CD1-CB 4.13Å; Y22-K31 HydrophobicContact CE1-CB 3.62Å; Y22-K31 HydrophobicContact CE1-CG 3.91Å; Y22-K31 HydrophobicContact CE2-CG 4.43Å
32	S	43.2	Very low	34.8	Very low	37 Å²	37	115 Å²	115	26%	0.259	58%	0.582	S	S	.	*			trans	-81.1	124.7	173.9	-175.7	0	0	0	0	109.7	Y21 R30 R34	Y21-S32 VanDerWaalsContact O-CB 3.23Å; Y21-S32 WeakPolarHBondContact O-CB 3.29Å; Y21-S32 PolarHBondContact O-N 2.95Å; R30-S32 PolarHBondContact O-N 3.34Å; S32-R34 PolarHBondContact O-N 3.29Å
33	N	41	Very low	34.6	Very low	141 Å²	141	115.8 Å²	115.8	75%	0.754	60%	0.6	S	S	*	*			trans	-84.1	19.7	176	-69.6	2.8	0	0	0	112.7	L35	N33-L35 PolarHBondContact O-N 3.46Å; N33-L35 VanDerWaalsContact O-N 3.13Å
34	R	44.2	Very low	33.8	Very low	211 Å²	211	118.2 Å²	118.2	80%	0.796	61%	0.609	S	S	*	*	S	Bend	trans	-81	79.5	161.5	-81.2	-176.3	164.2	179.3	-5.3	108.6	S32	S32-R34 PolarHBondContact O-N 3.29Å
35	L	34.2	Very low	33.4	Very low	135 Å²	135	118.6 Å²	118.6	71%	0.707	61%	0.614	S	S	*	*			trans	23.2	100.3	162.3	-56.4	173.5	0	0	0	115.9	N33	N33-L35 PolarHBondContact O-N 3.46Å; N33-L35 VanDerWaalsContact O-N 3.13Å
36	D	29.8	Very low	33.3	Very low	98 Å²	98	117.9 Å²	117.9	52%	0.524	62%	0.621	S	S	.	*				78.7	112.2	84.5	-67.3	-22.3	0	0	0	111.6	D20	D20-D36 WeakPolarHBondContact OD1-CA 2.98Å
37	I	26.5	Very low	32.9	Very low	134 Å²	134	116.9 Å²	116.9	69%	0.687	62%	0.619	S	S	*	*			cis	-132.7	143.3	28.3	-56.7	104.3	0	0	0	111.8	Q18 H19 D20	Q18-I37 CarbonylContact C-O 3.46Å; H19-I37 CarbonylContact C-O 2.82Å; H19-I37 WeakPolarHBondContact CA-O 3.38Å; H19-I37 PolarHBondContact N-O 2.78Å; D20-I37 PolarHBondContact N-O 3.04Å; D20-I37 WeakPolarHBondContact OD1-CA 3.39Å; D20-I37 PolarHBondContact OD1-N 2.96Å
38	F	28	Very low	32.4	Very low	49 Å²	49	118.7 Å²	118.7	22%	0.215	63%	0.629	C	S	.	*			trans	-96.2	116.3	-178.6	-160.8	-110.2	0	0	0	118	H19 D20 W40	H19-F38 HydrophobicContact CB-CD2 3.66Å; H19-F38 HydrophobicContact CB-CE2 3.96Å; H19-F38 AromaticContact CD2-CD2 3.38Å; H19-F38 WeakPolarHBondContact CD2-CD2 3.34Å; H19-F38 AromaticContact CD2-CE2 3.45Å; H19-F38 VanDerWaalsContact CD2-CE2 3.45Å; H19-F38 WeakPolarHBondContact CD2-CE2 3.01Å; H19-F38 AromaticContact CG-CD2 3.89Å; H19-F38 AromaticContact CG-CE2 3.99Å; D20-F38 HydrophobicContact CB-CB 3.65Å; D20-F38 HydrophobicContact CB-CD2 4.42Å; D20-F38 HydrophobicContact CB-CG 4.39Å; D20-F38 VanDerWaalsContact CG-CB 3.43Å; D20-F38 WeakPolarHBondContact O-CD2 3.42Å; D20-F38 WeakPolarHBondContact O-CE2 3.42Å; D20-F38 PolarHBondContact OD1-N 2.65Å; D20-F38 WeakPolarHBondContact OD2-CB 3.43Å; D20-F38 PolarHBondContact OD2-N 2.98Å; F38-W40 HydrophobicContact CD1-CB 4.26Å; F38-W40 AromaticContact CD1-CD1 3.76Å; F38-W40 AromaticContact CD1-CD2 3.44Å; F38-W40 HydrophobicContact CD1-CD2 3.44Å; F38-W40 VanDerWaalsContact CD1-CD2 3.44Å; F38-W40 AromaticContact CD1-CE2 3.5Å; F38-W40 VanDerWaalsContact CD1-CE2 3.5Å; F38-W40 AromaticContact CD1-CE3 3.94Å; F38-W40 HydrophobicContact CD1-CE3 3.94Å; F38-W40 AromaticContact CD1-CG 3.59Å; F38-W40 HydrophobicContact CD1-CG 3.59Å; F38-W40 HydrophobicContact CD1-CH2 4.39Å; F38-W40 AromaticContact CD1-CZ2 3.99Å; F38-W40 HydrophobicContact CD1-CZ2 3.99Å; F38-W40 HydrophobicContact CD1-CZ3 4.38Å; F38-W40 AromaticContact CD1-NE1 3.7Å; F38-W40 HydrophobicContact CE1-CB 4.06Å; F38-W40 AromaticContact CE1-CD2 3.41Å; F38-W40 HydrophobicContact CE1-CD2 3.41Å; F38-W40 VanDerWaalsContact CE1-CD2 3.41Å; F38-W40 AromaticContact CE1-CE2 3.93Å; F38-W40 AromaticContact CE1-CE3 3.45Å; F38-W40 HydrophobicContact CE1-CE3 3.45Å; F38-W40 VanDerWaalsContact CE1-CE3 3.45Å; F38-W40 AromaticContact CE1-CG 3.71Å; F38-W40 HydrophobicContact CE1-CG 3.71Å; F38-W40 HydrophobicContact CE1-CH2 4.36Å; F38-W40 HydrophobicContact CE1-CZ2 4.37Å; F38-W40 AromaticContact CE1-CZ3 3.94Å; F38-W40 HydrophobicContact CE1-CZ3 3.94Å
39	S	24.1	Very low	32.7	Very low	55 Å²	55	115.8 Å²	115.8	39%	0.385	62%	0.623	S	S	.	*			trans	-101.7	61.6	171.7	65.3	0	0	0	0	114.9	Q18 H19 T41	Q18-S39 PolarHBondContact O-N 2.68Å; Q18-S39 PolarHBondContact O-OG 2.76Å; H19-S39 PolarHBondContact CD2-N 3.19Å; S39-T41 PolarHBondContact O-N 2.85Å; S39-T41 VanDerWaalsContact O-N 3.14Å
40	W	26.9	Very low	32.9	Very low	182 Å²	182	114.7 Å²	114.7	69%	0.689	62%	0.616	S	S	*	*			trans	-5.3	98.7	168	-52.6	85.4	0	0	0	116.7	Y22 F38	Y22-W40 HydrophobicContact CE2-CH2 4.43Å; F38-W40 HydrophobicContact CD1-CB 4.26Å; F38-W40 AromaticContact CD1-CD1 3.76Å; F38-W40 AromaticContact CD1-CD2 3.44Å; F38-W40 HydrophobicContact CD1-CD2 3.44Å; F38-W40 VanDerWaalsContact CD1-CD2 3.44Å; F38-W40 AromaticContact CD1-CE2 3.5Å; F38-W40 VanDerWaalsContact CD1-CE2 3.5Å; F38-W40 AromaticContact CD1-CE3 3.94Å; F38-W40 HydrophobicContact CD1-CE3 3.94Å; F38-W40 AromaticContact CD1-CG 3.59Å; F38-W40 HydrophobicContact CD1-CG 3.59Å; F38-W40 HydrophobicContact CD1-CH2 4.39Å; F38-W40 AromaticContact CD1-CZ2 3.99Å; F38-W40 HydrophobicContact CD1-CZ2 3.99Å; F38-W40 HydrophobicContact CD1-CZ3 4.38Å; F38-W40 AromaticContact CD1-NE1 3.7Å; F38-W40 HydrophobicContact CE1-CB 4.06Å; F38-W40 AromaticContact CE1-CD2 3.41Å; F38-W40 HydrophobicContact CE1-CD2 3.41Å; F38-W40 VanDerWaalsContact CE1-CD2 3.41Å; F38-W40 AromaticContact CE1-CE2 3.93Å; F38-W40 AromaticContact CE1-CE3 3.45Å; F38-W40 HydrophobicContact CE1-CE3 3.45Å; F38-W40 VanDerWaalsContact CE1-CE3 3.45Å; F38-W40 AromaticContact CE1-CG 3.71Å; F38-W40 HydrophobicContact CE1-CG 3.71Å; F38-W40 HydrophobicContact CE1-CH2 4.36Å; F38-W40 HydrophobicContact CE1-CZ2 4.37Å; F38-W40 AromaticContact CE1-CZ3 3.94Å; F38-W40 HydrophobicContact CE1-CZ3 3.94Å
41	T	27.7	Very low	33.1	Very low	106 Å²	106	111.1 Å²	111.1	65%	0.65	62%	0.618	S	S	*	*			trans	-88.2	134.1	169.1	86.7	0	0	0	0	110.3	S39	S39-T41 PolarHBondContact O-N 2.85Å; S39-T41 VanDerWaalsContact O-N 3.14Å
42	T	26.4	Very low	32.9	Very low	131 Å²	131	110.3 Å²	110.3	80%	0.804	62%	0.622	S	S	*	*			trans	-95	105.7	174.7	47.6	0	0	0	0	109.5	K44	T42-K44 VanDerWaalsContact C-N 3.28Å; T42-K44 PolarHBondContact O-N 3.35Å
43	S	33.4	Very low	32.5	Very low	109 Å²	109	110.7 Å²	110.7	76%	0.762	63%	0.627	S	S	*	*			trans	-72.6	82.8	173.5	58.8	0	0	0	0	110.5
44	K	25.2	Very low	32.1	Very low	177 Å²	177	110.7 Å²	110.7	77%	0.77	62%	0.618	S	S	*	*			trans	-57.4	133.5	152.4	-77.5	-177.1	177.6	176.8	0	107	T42 A46	T42-K44 VanDerWaalsContact C-N 3.28Å; T42-K44 PolarHBondContact O-N 3.35Å; K44-A46 PolarHBondContact O-N 3.17Å
45	P	28.3	Very low	31.8	Very low	120 Å²	120	105.2 Å²	105.2	78%	0.779	60%	0.604	S	S	*	*			trans	-60.3	113.2	169.5	25.9	-32.1	0	0	0	107	A47	P45-A47 PolarHBondContact O-N 3.28Å
46	A	34.1	Very low	32	Very low	69 Å²	69	101.4 Å²	101.4	57%	0.57	58%	0.584	S	S	*	*			trans	-77.5	74.7	178.7	0	0	0	0	0	107.9	K44 N48 V49	K44-A46 PolarHBondContact O-N 3.17Å; A46-N48 PolarHBondContact O-N 3.41Å; A46-V49 HydrophobicContact CB-CB 4.36Å; A46-V49 HydrophobicContact CB-CG2 3.53Å; A46-V49 PolarHBondContact O-N 2.88Å; A46-V49 VanDerWaalsContact O-N 3.11Å
47	A	36.5	Very low	32.3	Very low	90 Å²	90	100.6 Å²	100.6	74%	0.744	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	-17.3	-169.5	0	0	0	0	0	114.4	P45	P45-A47 PolarHBondContact O-N 3.28Å
48	N	34.1	Very low	33	Very low	155 Å²	155	97.4 Å²	97.4	83%	0.829	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	16.7	-172.6	-56	-1.9	0	0	0	113.4	A46 S50	A46-N48 PolarHBondContact O-N 3.41Å; N48-S50 PolarHBondContact O-N 2.75Å
49	V	35.5	Very low	33.7	Very low	86 Å²	86	100.3 Å²	100.3	52%	0.521	58%	0.577	S	S	.	*			trans	-76.8	93.9	170.7	176.5	0	0	0	0	108.4	A46 S51 A53	A46-V49 HydrophobicContact CB-CB 4.36Å; A46-V49 HydrophobicContact CB-CG2 3.53Å; A46-V49 PolarHBondContact O-N 2.88Å; A46-V49 VanDerWaalsContact O-N 3.11Å; V49-S51 PolarHBondContact O-N 3.13Å; V49-A53 HydrophobicContact CG1-CB 4.27Å
50	S	38.5	Very low	34.5	Very low	73 Å²	73	104.4 Å²	104.4	51%	0.51	58%	0.583	S	S	.	*			trans	-48.3	138.1	168.2	172.5	0	0	0	0	110.1	N48 S52 A53 Y54	N48-S50 PolarHBondContact O-N 2.75Å; S50-S52 PolarHBondContact O-N 3.47Å; S50-S52 PolarHBondContact OG-N 3.34Å; S50-A53 WeakPolarHBondContact O-CB 3.49Å; S50-A53 PolarHBondContact O-N 3.02Å; S50-Y54 PolarHBondContact O-N 2.9Å
51	S	38.8	Very low	35.4	Very low	95 Å²	95	99 Å²	99	66%	0.664	57%	0.568	S	S	*	*	H	α-helix	trans	-53.9	-27.1	176.8	46.5	0	0	0	0	112.9	V49 L55	V49-S51 PolarHBondContact O-N 3.13Å; S51-L55 WeakPolarHBondContact O-CG 3.46Å; S51-L55 PolarHBondContact O-N 3.16Å; S51-L55 VanDerWaalsContact O-N 3.13Å
52	S	34.1	Very low	36.3	Very low	63 Å²	63	97.6 Å²	97.6	44%	0.441	56%	0.556	S	S	.	*	H	α-helix	trans	-57.8	-51.3	169.9	-166.6	0	0	0	0	111.9	S50 Y54 L55 D56	S50-S52 PolarHBondContact O-N 3.47Å; S50-S52 PolarHBondContact OG-N 3.34Å; S52-Y54 VanDerWaalsContact C-N 3.27Å; S52-Y54 PolarHBondContact O-N 3.06Å; S52-L55 PolarHBondContact O-N 2.82Å; S52-L55 VanDerWaalsContact O-N 3.13Å; S52-D56 WeakPolarHBondContact O-CB 3.26Å; S52-D56 PolarHBondContact O-N 3.41Å; S52-D56 PolarHBondContact OG-OD2 2.9Å; S52-D56 VanDerWaalsContact OG-OD2 3.1Å
53	A	35.1	Very low	37.3	Very low	45 Å²	45	95 Å²	95	37%	0.372	54%	0.54	S	S	.	.	H	α-helix	trans	-65.1	-31.6	-175.4	0	0	0	0	0	112.5	V49 S50 E57	V49-A53 HydrophobicContact CG1-CB 4.27Å; S50-A53 WeakPolarHBondContact O-CB 3.49Å; S50-A53 PolarHBondContact O-N 3.02Å; A53-E57 WeakPolarHBondContact O-CB 3.35Å; A53-E57 PolarHBondContact O-N 2.84Å
54	Y	32	Very low	37.9	Very low	142 Å²	142	92.3 Å²	92.3	56%	0.557	52%	0.521	S	S	*	.	H	α-helix	trans	-66.9	-48.5	171.7	177.8	-104.3	0	0	0	111.8	S50 S52 D56 E57 V58	S50-Y54 PolarHBondContact O-N 2.9Å; S52-Y54 VanDerWaalsContact C-N 3.27Å; S52-Y54 PolarHBondContact O-N 3.06Å; Y54-D56 VanDerWaalsContact C-N 3.26Å; Y54-D56 PolarHBondContact O-N 2.03Å; Y54-E57 PolarHBondContact O-N 3.38Å; Y54-V58 HydrophobicContact CE1-CG2 4.22Å; Y54-V58 HydrophobicContact CE2-CG2 4.32Å; Y54-V58 WeakPolarHBondContact O-CG2 3.29Å; Y54-V58 PolarHBondContact O-N 3.25Å
55	L	38.6	Very low	39	Very low	96 Å²	96	90.9 Å²	90.9	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-61.1	-36.6	174.8	-69.4	175.5	0	0	0	111.7	S51 S52 V58 K59	S51-L55 WeakPolarHBondContact O-CG 3.46Å; S51-L55 PolarHBondContact O-N 3.16Å; S51-L55 VanDerWaalsContact O-N 3.13Å; S52-L55 PolarHBondContact O-N 2.82Å; S52-L55 VanDerWaalsContact O-N 3.13Å; L55-V58 PolarHBondContact O-N 3.11Å; L55-K59 WeakPolarHBondContact O-CB 3.48Å; L55-K59 WeakPolarHBondContact O-CG 3.32Å; L55-K59 PolarHBondContact O-N 2.73Å
56	D	37.8	Very low	40.4	Very low	54 Å²	54	86 Å²	86	29%	0.289	49%	0.486	S	S	.	.	H	α-helix	trans	-74.8	-26.6	179.3	-61.9	-33.2	0	0	0	112.7	S52 Y54 K59 R60	S52-D56 WeakPolarHBondContact O-CB 3.26Å; S52-D56 PolarHBondContact O-N 3.41Å; S52-D56 PolarHBondContact OG-OD2 2.9Å; S52-D56 VanDerWaalsContact OG-OD2 3.1Å; Y54-D56 VanDerWaalsContact C-N 3.26Å; Y54-D56 PolarHBondContact O-N 2.03Å; D56-K59 IonicContact OD1-NZ 3.17Å; D56-K59 PolarHBondContact OD1-NZ 3.11Å; D56-R60 VanDerWaalsContact O-CB 3.23Å; D56-R60 WeakPolarHBondContact O-CB 3.43Å; D56-R60 VanDerWaalsContact O-CG 3.23Å; D56-R60 WeakPolarHBondContact O-CG 3.3Å; D56-R60 PolarHBondContact O-N 3.35Å; D56-R60 PolarHBondContact O-NE 3.13Å
57	E	37	Very low	40.9	Very low	81 Å²	81	86.3 Å²	86.3	38%	0.379	48%	0.484	S	S	.	.	H	α-helix	trans	-75.5	-39.3	169.3	-169.9	62.3	-130.6	0	0	111.8	A53 Y54 R60 N61	A53-E57 WeakPolarHBondContact O-CB 3.35Å; A53-E57 PolarHBondContact O-N 2.84Å; Y54-E57 PolarHBondContact O-N 3.38Å; E57-R60 PolarHBondContact O-N 2.85Å; E57-R60 IonicContact OE1-NH1 2.66Å; E57-R60 IonicContact OE2-CZ 2.73Å; E57-R60 IonicContact OE2-NH1 3.18Å; E57-R60 PolarHBondContact OE2-NH1 3.26Å; E57-R60 IonicContact OE2-NH2 3.48Å; E57-R60 PolarHBondContact OE2-NH2 2.84Å; E57-N61 WeakPolarHBondContact O-CB 3.25Å; E57-N61 PolarHBondContact O-N 2.99Å; E57-N61 PolarHBondContact O-ND2 3.02Å; E57-N61 PolarHBondContact OE1-ND2 3.17Å
58	V	41.1	Very low	41.5	Very low	68 Å²	68	91.1 Å²	91.1	41%	0.412	49%	0.488	S	S	.	.	H	α-helix	trans	-64.3	-47.1	173.1	173.4	0	0	0	0	110.7	Y54 L55 R60 N61 L62	Y54-V58 HydrophobicContact CE1-CG2 4.22Å; Y54-V58 HydrophobicContact CE2-CG2 4.32Å; Y54-V58 WeakPolarHBondContact O-CG2 3.29Å; Y54-V58 PolarHBondContact O-N 3.25Å; L55-V58 PolarHBondContact O-N 3.11Å; V58-R60 VanDerWaalsContact C-N 3.34Å; V58-R60 PolarHBondContact O-N 3.01Å; V58-N61 PolarHBondContact O-N 3.18Å; V58-L62 WeakPolarHBondContact O-CB 3.09Å; V58-L62 PolarHBondContact O-N 3.48Å
59	K	41.7	Very low	43	Very low	110 Å²	110	87 Å²	87	48%	0.478	47%	0.465	S	S	.	.	H	α-helix	trans	-55.5	-47.8	171.4	-71.9	168.6	-156.3	161.8	0	110.9	L55 D56 N61 L62 V63	L55-K59 WeakPolarHBondContact O-CB 3.48Å; L55-K59 WeakPolarHBondContact O-CG 3.32Å; L55-K59 PolarHBondContact O-N 2.73Å; D56-K59 IonicContact OD1-NZ 3.17Å; D56-K59 PolarHBondContact OD1-NZ 3.11Å; K59-N61 PolarHBondContact O-N 3.18Å; K59-L62 PolarHBondContact O-N 3.09Å; K59-V63 VanDerWaalsContact O-CB 3.27Å; K59-V63 WeakPolarHBondContact O-CB 3.4Å; K59-V63 WeakPolarHBondContact O-CG2 3.04Å; K59-V63 PolarHBondContact O-N 2.83Å
60	R	42.9	Very low	45.1	Very low	140 Å²	140	85.9 Å²	85.9	53%	0.528	46%	0.455	S	S	.	.	H	α-helix	trans	-64.2	-36.7	179.6	-83.4	-176.5	-70.7	122.8	2	113	D56 E57 V58 S64	D56-R60 VanDerWaalsContact O-CB 3.23Å; D56-R60 WeakPolarHBondContact O-CB 3.43Å; D56-R60 VanDerWaalsContact O-CG 3.23Å; D56-R60 WeakPolarHBondContact O-CG 3.3Å; D56-R60 PolarHBondContact O-N 3.35Å; D56-R60 PolarHBondContact O-NE 3.13Å; E57-R60 PolarHBondContact O-N 2.85Å; E57-R60 IonicContact OE1-NH1 2.66Å; E57-R60 IonicContact OE2-CZ 2.73Å; E57-R60 IonicContact OE2-NH1 3.18Å; E57-R60 PolarHBondContact OE2-NH1 3.26Å; E57-R60 IonicContact OE2-NH2 3.48Å; E57-R60 PolarHBondContact OE2-NH2 2.84Å; V58-R60 VanDerWaalsContact C-N 3.34Å; V58-R60 PolarHBondContact O-N 3.01Å; R60-S64 WeakPolarHBondContact O-CA 2.83Å; R60-S64 WeakPolarHBondContact O-CB 3.21Å; R60-S64 PolarHBondContact O-N 3.5Å; R60-S64 PolarHBondContact O-OG 3.04Å
61	N	45.5	Very low	47.4	Very low	69 Å²	69	84.7 Å²	84.7	37%	0.369	44%	0.443	S	S	.	.	H	α-helix	trans	-73.8	-37.8	177.3	-80.2	-73.2	0	0	0	113.1	E57 V58 K59 S64 H65	E57-N61 WeakPolarHBondContact O-CB 3.25Å; E57-N61 PolarHBondContact O-N 2.99Å; E57-N61 PolarHBondContact O-ND2 3.02Å; E57-N61 PolarHBondContact OE1-ND2 3.17Å; V58-N61 PolarHBondContact O-N 3.18Å; K59-N61 PolarHBondContact O-N 3.18Å; N61-S64 WeakPolarHBondContact CA-OG 3.36Å; N61-S64 PolarHBondContact O-N 3.05Å; N61-S64 PolarHBondContact O-OG 3.4Å; N61-H65 PolarHBondContact O-N 2.88Å; N61-H65 PolarHBondContact O-ND1 2.8Å
62	L	45.6	Very low	49.9	Very low	76 Å²	76	85.1 Å²	85.1	40%	0.398	43%	0.43	S	S	.	.	H	α-helix	trans	-69	-40.2	176.1	-145.1	65.6	0	0	0	110.8	V58 K59 C66 L99	V58-L62 WeakPolarHBondContact O-CB 3.09Å; V58-L62 PolarHBondContact O-N 3.48Å; K59-L62 PolarHBondContact O-N 3.09Å; L62-C66 PolarHBondContact O-SG 2.99Å; L62-L99 WeakPolarHBondContact CD2-O 3.16Å
63	V	46.9	Very low	52.8	Low	76 Å²	76	83.5 Å²	83.5	46%	0.461	42%	0.416	S	S	.	.	H	α-helix	trans	-69.8	-37.8	173.1	173.1	0	0	0	0	111.5	K59 C66 S67	K59-V63 VanDerWaalsContact O-CB 3.27Å; K59-V63 WeakPolarHBondContact O-CB 3.4Å; K59-V63 WeakPolarHBondContact O-CG2 3.04Å; K59-V63 PolarHBondContact O-N 2.83Å; V63-C66 CarbonylContact O-C 3.59Å; V63-C66 PolarHBondContact O-N 2.84Å; V63-C66 VanDerWaalsContact O-N 3.17Å; V63-S67 WeakPolarHBondContact O-CA 3.02Å; V63-S67 WeakPolarHBondContact O-CB 3.2Å; V63-S67 PolarHBondContact O-N 2.82Å
64	S	47	Very low	55.6	Low	54 Å²	54	85.8 Å²	85.8	38%	0.378	43%	0.426	S	S	.	.	H	α-helix	trans	-65.7	-47	-175.2	66.3	0	0	0	0	112.8	R60 N61 C66 S67	R60-S64 WeakPolarHBondContact O-CA 2.83Å; R60-S64 WeakPolarHBondContact O-CB 3.21Å; R60-S64 PolarHBondContact O-N 3.5Å; R60-S64 PolarHBondContact O-OG 3.04Å; N61-S64 WeakPolarHBondContact CA-OG 3.36Å; N61-S64 PolarHBondContact O-N 3.05Å; N61-S64 PolarHBondContact O-OG 3.4Å; S64-C66 PolarHBondContact O-N 2.79Å; S64-C66 VanDerWaalsContact O-N 3.15Å; S64-S67 WeakPolarHBondContact O-CB 3.22Å; S64-S67 PolarHBondContact O-N 3.12Å; S64-S67 VanDerWaalsContact O-N 3.16Å; S64-S67 PolarHBondContact O-OG 3.46Å
65	H	48.9	Very low	58.5	Low	147 Å²	147	82.3 Å²	82.3	68%	0.681	41%	0.414	S	S	*	.	H	α-helix	trans	-62.5	-19.3	175.6	-69.4	84.6	0	0	0	113	N61	N61-H65 PolarHBondContact O-N 2.88Å; N61-H65 PolarHBondContact O-ND1 2.8Å
66	C	55.9	Low	61.1	Low	17 Å²	17	80.1 Å²	80.1	12%	0.115	40%	0.401	C	S	.	.	H	α-helix	trans	-107.4	-3	179.4	-69.9	0	0	0	0	114.3	L62 V63 S64 K68 L99 C152	L62-C66 PolarHBondContact O-SG 2.99Å; V63-C66 CarbonylContact O-C 3.59Å; V63-C66 PolarHBondContact O-N 2.84Å; V63-C66 VanDerWaalsContact O-N 3.17Å; S64-C66 PolarHBondContact O-N 2.79Å; S64-C66 VanDerWaalsContact O-N 3.15Å; C66-K68 PolarHBondContact O-N 3.46Å; C66-L99 HydrophobicContact CB-CD2 3.58Å; C66-L99 WeakPolarHBondContact SG-CD2 3.47Å; C66-C152 WeakPolarHBondContact CA-SG 3.21Å; C66-C152 HydrophobicContact CB-CB 4.3Å; C66-C152 WeakPolarHBondContact CB-SG 3.27Å; C66-C152 WeakPolarHBondContact SG-CB 3.39Å; C66-C152 CovalentContact SG-SG 2.02Å; C66-C152 PolarHBondContact SG-SG 2.95Å
67	S	45.5	Very low	63.7	Low	76 Å²	76	77.8 Å²	77.8	53%	0.531	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-8.3	-155.1	54.1	0	0	0	0	116.5	V63 S64	V63-S67 WeakPolarHBondContact O-CA 3.02Å; V63-S67 WeakPolarHBondContact O-CB 3.2Å; V63-S67 PolarHBondContact O-N 2.82Å; S64-S67 WeakPolarHBondContact O-CB 3.22Å; S64-S67 PolarHBondContact O-N 3.12Å; S64-S67 VanDerWaalsContact O-N 3.16Å; S64-S67 PolarHBondContact O-OG 3.46Å
68	K	49.8	Very low	66.3	Low	191 Å²	191	74.2 Å²	74.2	83%	0.83	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	-0.3	-169.1	-77.2	-162.6	174.1	-175.4	0	118.7	C66	C66-K68 PolarHBondContact O-N 3.46Å
69	I	64.8	Low	68.5	Low	67 Å²	67	71 Å²	71	34%	0.344	35%	0.352	S	S	.	.			trans	-141.3	90.2	169.6	-26.5	164	0	0	0	111	L151	I69-L151 HydrophobicContact CB-CB 4.1Å; I69-L151 HydrophobicContact CB-CD1 3.94Å; I69-L151 HydrophobicContact CB-CG 4.16Å; I69-L151 HydrophobicContact CD1-CD1 4.46Å; I69-L151 HydrophobicContact CG2-CD1 3.46Å; I69-L151 VanDerWaalsContact CG2-CD1 3.46Å; I69-L151 HydrophobicContact CG2-CG 4.08Å; I69-L151 PolarHBondContact O-N 3.47Å; I69-L151 VanDerWaalsContact O-N 3.13Å
70	I	80.7	Confident	70.3	Confident	63 Å²	63	66.3 Å²	66.3	32%	0.323	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	113.5	161.3	-62.2	156.9	0	0	0	105.7	R72 I95 F148 Q149 L150	I70-R72 HydrophobicContact CG2-CG 4.23Å; I70-I95 HydrophobicContact CD1-CD1 4.45Å; I70-I95 HydrophobicContact CD1-CG2 3.76Å; I70-I95 HydrophobicContact CG2-CD1 4.21Å; I70-F148 HydrophobicContact CG2-CB 4.19Å; I70-Q149 CarbonylContact C-O 3.45Å; I70-Q149 VanDerWaalsContact CA-O 3.28Å; I70-Q149 WeakPolarHBondContact CA-O 3.37Å; I70-L150 HydrophobicContact CG1-CD2 4.11Å
71	L	86.4	Confident	72.3	Confident	49 Å²	49	60 Å²	60	26%	0.257	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	141.4	168.5	173.9	74	0	0	0	108.3	K130 F148 Q149	L71-K130 HydrophobicContact CD2-CD 3.88Å; L71-K130 VanDerWaalsContact CD2-NZ 3.33Å; L71-F148 CarbonylContact O-C 3.32Å; L71-F148 VanDerWaalsContact O-CA 3.26Å; L71-F148 WeakPolarHBondContact O-CA 3.43Å; L71-Q149 HydrophobicContact CB-CB 4.29Å; L71-Q149 PolarHBondContact N-O 3.34Å; L71-Q149 PolarHBondContact O-N 2.92Å
72	R	91.5	Very high	74.4	Confident	104 Å²	104	57 Å²	57	39%	0.392	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.9	174	-66.6	176	-178.6	-122.7	7	109.5	I70 S91 E146 Y147 F148	I70-R72 HydrophobicContact CG2-CG 4.23Å; R72-S91 PolarHBondContact NH1-OG 3.48Å; R72-E146 HydrophobicContact CB-CG 4.29Å; R72-E146 WeakPolarHBondContact CD-OE1 3.45Å; R72-E146 IonicContact CZ-OE2 2.8Å; R72-E146 IonicContact NE-OE2 3.68Å; R72-E146 IonicContact NH1-OE1 2.66Å; R72-E146 IonicContact NH1-OE2 3.29Å; R72-E146 PolarHBondContact NH1-OE2 3.36Å; R72-Y147 CarbonylContact C-O 3.05Å; R72-Y147 WeakPolarHBondContact CA-O 3.45Å; R72-F148 HydrophobicContact CG-CB 4.35Å
73	E	93.1	Very high	76.5	Confident	29 Å²	29	55 Å²	55	14%	0.136	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	107.5	173.9	-65.4	-170.2	-132.6	0	0	108.9	K76 K130 Y147	E73-K76 HydrophobicContact CB-CB 4.41Å; E73-K76 HydrophobicContact CB-CD 4.01Å; E73-K76 HydrophobicContact CB-CG 4.38Å; E73-K76 WeakPolarHBondContact OE2-CD 3.45Å; E73-K76 WeakPolarHBondContact OE2-CE 3.07Å; E73-K76 IonicContact OE2-NZ 3.07Å; E73-K76 PolarHBondContact OE2-NZ 3.23Å; E73-K130 WeakPolarHBondContact OE1-CD 3.36Å; E73-K130 WeakPolarHBondContact OE1-CE 3.46Å; E73-K130 IonicContact OE1-NZ 2.75Å; E73-K130 PolarHBondContact OE1-NZ 2.93Å; E73-Y147 HydrophobicContact CB-CD1 4.3Å; E73-Y147 PolarHBondContact N-O 3.42Å; E73-Y147 PolarHBondContact O-N 2.98Å
74	P	94.5	Very high	78.6	Confident	92 Å²	92	51.4 Å²	51.4	60%	0.597	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	155.2	176.7	30.4	-35.4	0	0	0	110.6	K76	P74-K76 PolarHBondContact O-N 2.91Å
75	K	93.6	Very high	80.8	Confident	69 Å²	69	48.9 Å²	48.9	30%	0.3	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	33.2	178.8	-59.9	-72.8	173.4	172.6	0	113.3	E139 D140 N143 V145	K75-E139 CarbonylContact O-C 3.58Å; K75-E139 VanDerWaalsContact O-CA 3.26Å; K75-E139 WeakPolarHBondContact O-CA 3.44Å; K75-D140 WeakPolarHBondContact CB-O 3.06Å; K75-D140 WeakPolarHBondContact CD-O 3.45Å; K75-D140 PolarHBondContact O-N 3.22Å; K75-N143 WeakPolarHBondContact CD-O 3.43Å; K75-N143 WeakPolarHBondContact CE-O 3.42Å; K75-N143 VanDerWaalsContact NZ-C 3.31Å; K75-N143 PolarHBondContact NZ-O 3.23Å; K75-V145 PolarHBondContact N-O 3.31Å
76	K	92.7	Very high	82.8	Confident	50 Å²	50	42 Å²	42	22%	0.217	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.1	177.7	-65.2	-162.8	-174.9	179.6	0	114.2	E73 P74 L137 V138 Y147	E73-K76 HydrophobicContact CB-CB 4.41Å; E73-K76 HydrophobicContact CB-CD 4.01Å; E73-K76 HydrophobicContact CB-CG 4.38Å; E73-K76 WeakPolarHBondContact OE2-CD 3.45Å; E73-K76 WeakPolarHBondContact OE2-CE 3.07Å; E73-K76 IonicContact OE2-NZ 3.07Å; E73-K76 PolarHBondContact OE2-NZ 3.23Å; P74-K76 PolarHBondContact O-N 2.91Å; K76-L137 HydrophobicContact CB-CD1 4.15Å; K76-L137 HydrophobicContact CB-CG 4.27Å; K76-L137 HydrophobicContact CD-CD2 3.68Å; K76-L137 HydrophobicContact CD-CG 3.89Å; K76-V138 CarbonylContact C-O 3.53Å; K76-V138 WeakPolarHBondContact CA-O 3.41Å; K76-Y147 WeakPolarHBondContact O-CB 3.39Å; K76-Y147 PolarHBondContact O-N 3.49Å
77	I	93	Very high	84.5	Confident	6 Å²	6	44.8 Å²	44.8	3%	0.031	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	136.3	-179.6	-57.4	178.3	0	0	0	108.8	V113 Y115 L137 V138 D140 V145	I77-V113 HydrophobicContact CG1-CG1 4.15Å; I77-V113 HydrophobicContact CG2-CG2 4.33Å; I77-Y115 HydrophobicContact CD1-CE1 4.29Å; I77-Y115 WeakPolarHBondContact CD1-OH 3.46Å; I77-L137 CarbonylContact O-C 3.58Å; I77-L137 WeakPolarHBondContact O-CA 3.24Å; I77-V138 HydrophobicContact CB-CG2 4.32Å; I77-V138 PolarHBondContact N-O 3.3Å; I77-V138 PolarHBondContact O-N 2.91Å; I77-D140 HydrophobicContact CD1-CB 3.69Å; I77-D140 WeakPolarHBondContact CD1-OD2 3.35Å; I77-D140 HydrophobicContact CG1-CB 4.11Å; I77-V145 HydrophobicContact CG1-CG1 4.24Å; I77-V145 HydrophobicContact CG1-CG2 4.2Å
78	L	90.7	Very high	86.8	Confident	6 Å²	6	41.6 Å²	41.6	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	116.2	171	-179.1	64.7	0	0	0	109.8	H133 L136 L137 Y147	L78-H133 HydrophobicContact CD1-CB 4.07Å; L78-L136 HydrophobicContact CD1-CB 4.2Å; L78-L137 HydrophobicContact CB-CD1 4.22Å; L78-Y147 HydrophobicContact CB-CD2 4.1Å; L78-Y147 HydrophobicContact CB-CE2 3.85Å; L78-Y147 HydrophobicContact CD2-CE2 4.18Å
79	I	87.1	Confident	88.8	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	20%	0.202	C	C	.	.			trans	-76.9	145.2	-174.9	-57.8	165	0	0	0	111.6	Y81 L136 V138 I185 F221	I79-Y81 VanDerWaalsContact C-N 3.32Å; I79-Y81 WeakPolarHBondContact O-CD2 3.29Å; I79-Y81 PolarHBondContact O-N 3.02Å; I79-Y81 VanDerWaalsContact O-N 3.09Å; I79-L136 PolarHBondContact N-O 2.91Å; I79-V138 HydrophobicContact CD1-CB 4.25Å; I79-V138 HydrophobicContact CD1-CG1 3.47Å; I79-V138 VanDerWaalsContact CD1-CG1 3.47Å; I79-V138 HydrophobicContact CD1-CG2 3.74Å; I79-V138 HydrophobicContact CG1-CG1 4.39Å; I79-V138 HydrophobicContact CG1-CG2 3.92Å; I79-I185 HydrophobicContact CD1-CD1 4.34Å; I79-I185 HydrophobicContact CD1-CG1 4.22Å; I79-I185 HydrophobicContact CG2-CG2 4.14Å; I79-F221 HydrophobicContact CD1-CD1 3.47Å; I79-F221 VanDerWaalsContact CD1-CD1 3.47Å; I79-F221 HydrophobicContact CD1-CE1 3.93Å; I79-F221 HydrophobicContact CD1-CG 4.39Å; I79-F221 HydrophobicContact CG1-CD1 4.13Å
80	G	79.4	Confident	90	Very high	11 Å²	11	41 Å²	41	11%	0.113	20%	0.202	C	C	.	.	S	Bend	trans	86.8	-47.6	165.3	0	0	0	0	0	114.9	A82 A192	G80-A82 PolarHBondContact O-N 2.78Å; G80-A192 WeakPolarHBondContact O-CB 3.34Å
81	Y	85.8	Confident	90.5	Very high	6 Å²	6	39.3 Å²	39.3	2%	0.024	20%	0.195	C	C	.	.			trans	-80.8	19.2	-166.9	-63.6	-74.9	0	0	0	116.4	I79 R83 N126 S127 E128 H133 L136 A188 I191	I79-Y81 VanDerWaalsContact C-N 3.32Å; I79-Y81 WeakPolarHBondContact O-CD2 3.29Å; I79-Y81 PolarHBondContact O-N 3.02Å; I79-Y81 VanDerWaalsContact O-N 3.09Å; Y81-R83 PolarHBondContact O-N 3.32Å; Y81-N126 VanDerWaalsContact O-CA 3.24Å; Y81-N126 WeakPolarHBondContact O-CA 3.31Å; Y81-N126 WeakPolarHBondContact O-CB 3.44Å; Y81-S127 PolarHBondContact O-N 3.43Å; Y81-E128 HydrophobicContact CD1-CB 4.23Å; Y81-E128 HydrophobicContact CD1-CG 3.33Å; Y81-E128 HydrophobicContact CD2-CB 4.37Å; Y81-E128 HydrophobicContact CD2-CG 4.29Å; Y81-E128 HydrophobicContact CE1-CG 3.85Å; Y81-E128 HydrophobicContact CG-CB 3.98Å; Y81-E128 HydrophobicContact CG-CG 3.58Å; Y81-H133 AromaticContact CD2-CD2 3.77Å; Y81-H133 AromaticContact CE1-NE2 3.96Å; Y81-H133 HydrophobicContact CE2-CB 4.21Å; Y81-H133 AromaticContact CE2-CD2 3.3Å; Y81-H133 WeakPolarHBondContact CE2-CD2 3.27Å; Y81-H133 AromaticContact CE2-CE1 3.95Å; Y81-H133 AromaticContact CE2-CG 3.5Å; Y81-H133 AromaticContact CE2-ND1 3.88Å; Y81-H133 AromaticContact CE2-NE2 3.62Å; Y81-H133 AromaticContact CZ-CD2 3.64Å; Y81-H133 AromaticContact CZ-CE1 3.66Å; Y81-H133 AromaticContact CZ-NE2 3.4Å; Y81-H133 PolarHBondContact OH-CE1 3.21Å; Y81-H133 PolarHBondContact OH-NE2 2.78Å; Y81-L136 HydrophobicContact CE2-CD1 3.88Å; Y81-A188 HydrophobicContact CE2-CB 3.86Å; Y81-I191 HydrophobicContact CE1-CB 4.32Å; Y81-I191 HydrophobicContact CE1-CG2 3.9Å
82	A	90.4	Very high	90.7	Very high	6 Å²	6	45.3 Å²	45.3	5%	0.05	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	123.1	177.7	0	0	0	0	0	111.9	G80 I124 N126 I223	G80-A82 PolarHBondContact O-N 2.78Å; A82-I124 HydrophobicContact CB-CG2 3.45Å; A82-I124 VanDerWaalsContact CB-CG2 3.45Å; A82-N126 VanDerWaalsContact CA-OD1 3.3Å; A82-N126 WeakPolarHBondContact CA-OD1 3.45Å; A82-I223 HydrophobicContact CB-CB 4.3Å; A82-I223 HydrophobicContact CB-CD1 3.66Å; A82-I223 HydrophobicContact CB-CG2 3.93Å
83	R	89.1	Confident	90.7	Very high	35 Å²	35	43.8 Å²	43.8	13%	0.132	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-33.5	-176.8	-68.5	-73.7	-67.5	159.9	-11.6	112.8	Y81 Y107 L125 I195 I201	Y81-R83 PolarHBondContact O-N 3.32Å; R83-Y107 HydrophobicContact CB-CD1 4.43Å; R83-Y107 HydrophobicContact CB-CD2 4.07Å; R83-Y107 HydrophobicContact CB-CE1 3.84Å; R83-Y107 HydrophobicContact CB-CE2 3.47Å; R83-Y107 VanDerWaalsContact CB-CE2 3.47Å; R83-Y107 HydrophobicContact CG-CD2 4Å; R83-Y107 HydrophobicContact CG-CE2 3.76Å; R83-L125 PolarHBondContact N-O 3.15Å; R83-I195 PolarHBondContact NH1-O 2.82Å; R83-I201 PolarHBondContact O-N 3.49Å
84	T	90	Very high	90.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	143.9	-179.8	-44.8	0	0	0	0	109.6	V86 Y105 Y107 L125	T84-V86 HydrophobicContact CG2-CG1 3.71Å; T84-Y105 HydrophobicContact CG2-CD1 4.23Å; T84-Y105 HydrophobicContact CG2-CD2 4.49Å; T84-Y105 HydrophobicContact CG2-CE1 4.15Å; T84-Y105 HydrophobicContact CG2-CE2 4.43Å; T84-Y105 HydrophobicContact CG2-CG 4.43Å; T84-Y107 WeakPolarHBondContact CB-OH 3.31Å; T84-Y107 VanDerWaalsContact OG1-CE1 3.22Å; T84-Y107 WeakPolarHBondContact OG1-CE1 3.27Å; T84-Y107 PolarHBondContact OG1-OH 3.45Å; T84-L125 PolarHBondContact N-O 3.44Å; T84-L125 PolarHBondContact O-N 3.21Å
85	V	93.5	Very high	90.5	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.5	170	-171.8	0	0	0	0	107.7	L121 C123 I124 S203 Y215 I223 R224	V85-L121 HydrophobicContact CG1-CB 3.83Å; V85-L121 HydrophobicContact CG1-CD2 4.26Å; V85-L121 VanDerWaalsContact CG1-O 3.31Å; V85-L121 WeakPolarHBondContact CG1-O 3.5Å; V85-C123 CarbonylContact C-O 3.54Å; V85-C123 WeakPolarHBondContact CA-O 3.45Å; V85-I124 HydrophobicContact CG1-CG1 4.34Å; V85-I124 HydrophobicContact CG2-CG1 4.31Å; V85-S203 VanDerWaalsContact O-CB 3.25Å; V85-S203 WeakPolarHBondContact O-CB 3.26Å; V85-Y215 HydrophobicContact CB-CD2 4.05Å; V85-Y215 HydrophobicContact CB-CE2 3.8Å; V85-Y215 HydrophobicContact CG1-CE2 3.99Å; V85-Y215 HydrophobicContact CG2-CD2 3.69Å; V85-Y215 HydrophobicContact CG2-CE2 3.87Å; V85-I223 HydrophobicContact CG2-CG2 3.86Å; V85-R224 HydrophobicContact CG1-CG 4.32Å
86	V	92.2	Very high	90.3	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.018	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	152.1	-174.9	-54.1	0	0	0	0	111.4	T84 I88 Q97 L121 N122 C123 P204	T84-V86 HydrophobicContact CG2-CG1 3.71Å; V86-I88 HydrophobicContact CG2-CG1 4.46Å; V86-I88 HydrophobicContact CG2-CG2 4.08Å; V86-Q97 HydrophobicContact CG2-CG 4.35Å; V86-L121 CarbonylContact O-C 3.56Å; V86-L121 WeakPolarHBondContact O-CA 3.47Å; V86-N122 PolarHBondContact O-N 3.48Å; V86-C123 HydrophobicContact CG2-CB 3.63Å; V86-C123 VanDerWaalsContact CG2-SG 3.58Å; V86-C123 PolarHBondContact N-O 3.28Å; V86-C123 PolarHBondContact O-N 3.2Å; V86-P204 HydrophobicContact CG1-CG 4.19Å
87	E	91.6	Very high	90.1	Very high	75 Å²	75	37.5 Å²	37.5	35%	0.35	18%	0.176	S	C	.	.			trans	-94.9	124.6	172	178	176.5	123.1	0	0	110	S120	E87-S120 WeakPolarHBondContact OE2-CA 3.24Å; E87-S120 VanDerWaalsContact OE2-CB 3.29Å; E87-S120 WeakPolarHBondContact OE2-CB 3.14Å
88	I	92.4	Very high	90	Very high	9 Å²	9	37.2 Å²	37.2	5%	0.046	18%	0.175	C	C	.	.			trans	-149.7	169.2	-178.6	53.2	86.4	0	0	0	110.2	V86 S90 E93 C94 Q97 F114 N122 C123	V86-I88 HydrophobicContact CG2-CG1 4.46Å; V86-I88 HydrophobicContact CG2-CG2 4.08Å; I88-S90 WeakPolarHBondContact CD1-O 3.45Å; I88-E93 HydrophobicContact CB-CB 4.15Å; I88-E93 HydrophobicContact CB-CG 3.86Å; I88-E93 HydrophobicContact CD1-CB 4.3Å; I88-E93 HydrophobicContact CG2-CG 3.84Å; I88-C94 HydrophobicContact CD1-CB 3.72Å; I88-C94 HydrophobicContact CG1-CB 4.2Å; I88-Q97 HydrophobicContact CG2-CG 3.94Å; I88-F114 HydrophobicContact CD1-CD2 3.61Å; I88-F114 HydrophobicContact CD1-CE2 3.25Å; I88-F114 HydrophobicContact CD1-CZ 4.14Å; I88-F114 HydrophobicContact CG1-CE2 4.39Å; I88-N122 PolarHBondContact N-OD1 2.99Å; I88-N122 VanDerWaalsContact N-OD1 3.09Å; I88-N122 PolarHBondContact O-ND2 3.01Å; I88-N122 PolarHBondContact O-OD1 3.49Å; I88-C123 HydrophobicContact CD1-CB 3.91Å; I88-C123 HydrophobicContact CG1-CB 3.38Å
89	K	91.5	Very high	89.7	Confident	197 Å²	197	38.1 Å²	38.1	86%	0.857	18%	0.18	S	C	*	.	S	Bend	trans	-101.1	-7.2	-168.7	-61.8	-177.9	179.8	-179.5	0	115.7	E93	K89-E93 PolarHBondContact N-OE2 3.07Å
90	S	91.7	Very high	89.6	Confident	49 Å²	49	41.6 Å²	41.6	34%	0.343	20%	0.195	S	C	.	.	S	Bend	trans	-164.3	152.5	-177.6	62.3	0	0	0	0	113.3	I88 R92 E93 C94	I88-S90 WeakPolarHBondContact CD1-O 3.45Å; S90-R92 PolarHBondContact O-N 2.99Å; S90-E93 WeakPolarHBondContact O-CA 3.47Å; S90-E93 WeakPolarHBondContact O-CB 3.14Å; S90-E93 PolarHBondContact O-N 3.09Å; S90-E93 PolarHBondContact OG-N 3.12Å; S90-C94 PolarHBondContact O-N 2.86Å; S90-C94 VanDerWaalsContact O-N 3.1Å
91	S	91.4	Very high	89.8	Confident	27 Å²	27	41.1 Å²	41.1	19%	0.189	19%	0.19	C	C	.	.	H	α-helix	trans	-51.8	-34.7	175.2	61.8	0	0	0	0	113.2	R72 C94 I95 F114	R72-S91 PolarHBondContact NH1-OG 3.48Å; S91-C94 WeakPolarHBondContact O-CB 3.46Å; S91-C94 PolarHBondContact O-N 3.02Å; S91-I95 WeakPolarHBondContact O-CD1 3.02Å; S91-I95 WeakPolarHBondContact O-CG1 3.28Å; S91-I95 PolarHBondContact O-N 3.29Å; S91-F114 VanDerWaalsContact CB-CD1 3.5Å; S91-F114 VanDerWaalsContact N-CE1 3.26Å
92	R	89.6	Confident	89.6	Confident	175 Å²	175	43.8 Å²	43.8	66%	0.66	21%	0.208	S	C	*	.	H	α-helix	trans	-58.4	-48.2	171.7	178.6	-176.8	171.1	135.8	5.8	112.4	S90 C94 I95 E96	S90-R92 PolarHBondContact O-N 2.99Å; R92-C94 VanDerWaalsContact C-N 3.3Å; R92-C94 PolarHBondContact O-N 3.13Å; R92-I95 PolarHBondContact O-N 3.44Å; R92-E96 IonicContact CZ-OE1 3.14Å; R92-E96 IonicContact NE-OE1 2.7Å; R92-E96 PolarHBondContact NE-OE1 2.85Å; R92-E96 IonicContact NH2-OE1 2.72Å; R92-E96 PolarHBondContact NH2-OE1 3.23Å; R92-E96 WeakPolarHBondContact O-CG 3.11Å; R92-E96 PolarHBondContact O-N 3.11Å
93	E	91.6	Very high	89.2	Confident	72 Å²	72	48.2 Å²	48.2	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-66.2	-34.5	179.7	-169.2	175.2	-161.7	0	0	111.2	I88 K89 S90 E96 Q97	I88-E93 HydrophobicContact CB-CB 4.15Å; I88-E93 HydrophobicContact CB-CG 3.86Å; I88-E93 HydrophobicContact CD1-CB 4.3Å; I88-E93 HydrophobicContact CG2-CG 3.84Å; K89-E93 PolarHBondContact N-OE2 3.07Å; S90-E93 WeakPolarHBondContact O-CA 3.47Å; S90-E93 WeakPolarHBondContact O-CB 3.14Å; S90-E93 PolarHBondContact O-N 3.09Å; S90-E93 PolarHBondContact OG-N 3.12Å; E93-E96 CarbonylContact O-C 3.59Å; E93-E96 PolarHBondContact O-N 2.97Å; E93-Q97 WeakPolarHBondContact O-CG 3.45Å; E93-Q97 PolarHBondContact O-N 2.83Å
94	C	92.9	Very high	88.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.9	-47.4	172.6	-167.4	0	0	0	0	112.2	I88 S90 S91 R92 E96 Q97 C98 F114 C123 F148	I88-C94 HydrophobicContact CD1-CB 3.72Å; I88-C94 HydrophobicContact CG1-CB 4.2Å; S90-C94 PolarHBondContact O-N 2.86Å; S90-C94 VanDerWaalsContact O-N 3.1Å; S91-C94 WeakPolarHBondContact O-CB 3.46Å; S91-C94 PolarHBondContact O-N 3.02Å; R92-C94 VanDerWaalsContact C-N 3.3Å; R92-C94 PolarHBondContact O-N 3.13Å; C94-E96 VanDerWaalsContact C-N 3.31Å; C94-E96 PolarHBondContact O-N 3.13Å; C94-Q97 WeakPolarHBondContact O-CB 3.22Å; C94-Q97 PolarHBondContact O-N 2.87Å; C94-Q97 VanDerWaalsContact O-N 3.15Å; C94-C98 PolarHBondContact O-N 2.86Å; C94-F114 HydrophobicContact CB-CB 4.36Å; C94-F114 HydrophobicContact CB-CD2 4.14Å; C94-F114 HydrophobicContact CB-CG 4.45Å; C94-C123 WeakPolarHBondContact CA-SG 3.22Å; C94-C123 HydrophobicContact CB-CB 3.78Å; C94-C123 WeakPolarHBondContact CB-SG 3.47Å; C94-C123 WeakPolarHBondContact SG-CB 3.49Å; C94-C123 CovalentContact SG-SG 2.03Å; C94-C123 PolarHBondContact SG-SG 3.44Å; C94-F148 HydrophobicContact CB-CE1 4.28Å; C94-F148 WeakPolarHBondContact SG-CE1 3.21Å
95	I	90.7	Very high	88.6	Confident	9 Å²	9	52.4 Å²	52.4	5%	0.046	26%	0.261	C	S	.	.	H	α-helix	trans	-60.2	-42.4	174.1	-69.8	158.5	0	0	0	110.7	I70 S91 R92 Q97 C98 L99 F148 L150	I70-I95 HydrophobicContact CD1-CD1 4.45Å; I70-I95 HydrophobicContact CD1-CG2 3.76Å; I70-I95 HydrophobicContact CG2-CD1 4.21Å; S91-I95 WeakPolarHBondContact O-CD1 3.02Å; S91-I95 WeakPolarHBondContact O-CG1 3.28Å; S91-I95 PolarHBondContact O-N 3.29Å; R92-I95 PolarHBondContact O-N 3.44Å; I95-Q97 VanDerWaalsContact C-N 3.32Å; I95-Q97 PolarHBondContact O-N 2.03Å; I95-C98 WeakPolarHBondContact O-CB 3.33Å; I95-C98 PolarHBondContact O-N 3.45Å; I95-L99 HydrophobicContact CG2-CD1 4.2Å; I95-L99 WeakPolarHBondContact O-CG 3.3Å; I95-L99 PolarHBondContact O-N 3.24Å; I95-F148 HydrophobicContact CB-CE2 4.4Å; I95-F148 HydrophobicContact CD1-CD2 4.48Å; I95-F148 HydrophobicContact CD1-CG 4.37Å; I95-F148 HydrophobicContact CG1-CB 4.43Å; I95-F148 HydrophobicContact CG1-CD1 4.15Å; I95-F148 HydrophobicContact CG1-CD2 3.56Å; I95-F148 HydrophobicContact CG1-CE1 4.32Å; I95-F148 HydrophobicContact CG1-CE2 3.76Å; I95-F148 HydrophobicContact CG1-CG 3.77Å; I95-F148 HydrophobicContact CG1-CZ 4.13Å; I95-L150 HydrophobicContact CG2-CD2 4.22Å
96	E	89.5	Confident	88	Confident	64 Å²	64	55.5 Å²	55.5	30%	0.299	29%	0.294	S	S	.	.	H	α-helix	trans	-65.4	-32	176.1	-75	-169.4	-152.5	0	0	113.1	R92 E93 C94 K100	R92-E96 IonicContact CZ-OE1 3.14Å; R92-E96 IonicContact NE-OE1 2.7Å; R92-E96 PolarHBondContact NE-OE1 2.85Å; R92-E96 IonicContact NH2-OE1 2.72Å; R92-E96 PolarHBondContact NH2-OE1 3.23Å; R92-E96 WeakPolarHBondContact O-CG 3.11Å; R92-E96 PolarHBondContact O-N 3.11Å; E93-E96 CarbonylContact O-C 3.59Å; E93-E96 PolarHBondContact O-N 2.97Å; C94-E96 VanDerWaalsContact C-N 3.31Å; C94-E96 PolarHBondContact O-N 3.13Å; E96-K100 WeakPolarHBondContact O-CB 3.48Å; E96-K100 WeakPolarHBondContact O-CD 3.36Å; E96-K100 VanDerWaalsContact O-CE 3.31Å; E96-K100 WeakPolarHBondContact O-CE 3.03Å; E96-K100 WeakPolarHBondContact O-CG 3.45Å; E96-K100 PolarHBondContact O-N 3.07Å; E96-K100 IonicContact OE2-NZ 3.49Å; E96-K100 PolarHBondContact OE2-NZ 2.75Å
97	Q	89.2	Confident	87.5	Confident	34 Å²	34	56.3 Å²	56.3	16%	0.159	30%	0.296	C	S	.	.	H	α-helix	trans	-69.7	-41.9	171.1	-69.1	-66.6	-5.7	0	0	111.5	V86 I88 E93 C94 I95 L99 K100 A101 Y105 L125	V86-Q97 HydrophobicContact CG2-CG 4.35Å; I88-Q97 HydrophobicContact CG2-CG 3.94Å; E93-Q97 WeakPolarHBondContact O-CG 3.45Å; E93-Q97 PolarHBondContact O-N 2.83Å; C94-Q97 WeakPolarHBondContact O-CB 3.22Å; C94-Q97 PolarHBondContact O-N 2.87Å; C94-Q97 VanDerWaalsContact O-N 3.15Å; I95-Q97 VanDerWaalsContact C-N 3.32Å; I95-Q97 PolarHBondContact O-N 2.03Å; Q97-L99 PolarHBondContact O-N 2.93Å; Q97-K100 CarbonylContact O-C 3.56Å; Q97-K100 PolarHBondContact O-N 3.26Å; Q97-K100 VanDerWaalsContact O-N 3.12Å; Q97-A101 PolarHBondContact O-N 3.15Å; Q97-Y105 PolarHBondContact OE1-OH 3.05Å; Q97-L125 HydrophobicContact CB-CD1 4.13Å
98	C	89.9	Confident	87.1	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.007	31%	0.308	C	S	.	.	H	α-helix	trans	-57.3	-49.2	174.2	-170.3	0	0	0	0	111.3	C94 I95 K100 A101 C109 L125 F148 L150	C94-C98 PolarHBondContact O-N 2.86Å; I95-C98 WeakPolarHBondContact O-CB 3.33Å; I95-C98 PolarHBondContact O-N 3.45Å; C98-K100 PolarHBondContact O-N 3.43Å; C98-A101 WeakPolarHBondContact O-CB 3.04Å; C98-A101 PolarHBondContact O-N 2.82Å; C98-C109 WeakPolarHBondContact CA-SG 3.37Å; C98-C109 HydrophobicContact CB-CB 3.97Å; C98-C109 WeakPolarHBondContact CB-SG 3.49Å; C98-C109 WeakPolarHBondContact O-CB 3.14Å; C98-C109 WeakPolarHBondContact SG-CB 3.17Å; C98-C109 CovalentContact SG-SG 2.04Å; C98-C109 PolarHBondContact SG-SG 3.33Å; C98-L125 HydrophobicContact CB-CD2 3.78Å; C98-F148 HydrophobicContact CB-CE2 3.84Å; C98-F148 HydrophobicContact CB-CZ 3.95Å; C98-L150 HydrophobicContact CB-CD1 4.26Å; C98-L150 VanDerWaalsContact SG-CD1 3.5Å
99	L	85.3	Confident	86.9	Confident	25 Å²	25	57.2 Å²	57.2	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-57.8	-36.3	175.9	-70.6	168	0	0	0	112.5	L62 C66 I95 Q97 A101 L150	L62-L99 WeakPolarHBondContact CD2-O 3.16Å; C66-L99 HydrophobicContact CB-CD2 3.58Å; C66-L99 WeakPolarHBondContact SG-CD2 3.47Å; I95-L99 HydrophobicContact CG2-CD1 4.2Å; I95-L99 WeakPolarHBondContact O-CG 3.3Å; I95-L99 PolarHBondContact O-N 3.24Å; Q97-L99 PolarHBondContact O-N 2.93Å; L99-A101 VanDerWaalsContact C-N 3.35Å; L99-L150 HydrophobicContact CD2-CD1 3.73Å; L99-L150 HydrophobicContact CD2-CD2 4.3Å; L99-L150 HydrophobicContact CG-CD1 4.16Å
100	K	84.4	Confident	86.8	Confident	74 Å²	74	49.2 Å²	49.2	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-85	-2.9	179.2	-63.4	161.2	-159.3	161.8	0	113.2	E96 Q97 C98 P102 S103 L104	E96-K100 WeakPolarHBondContact O-CB 3.48Å; E96-K100 WeakPolarHBondContact O-CD 3.36Å; E96-K100 VanDerWaalsContact O-CE 3.31Å; E96-K100 WeakPolarHBondContact O-CE 3.03Å; E96-K100 WeakPolarHBondContact O-CG 3.45Å; E96-K100 PolarHBondContact O-N 3.07Å; E96-K100 IonicContact OE2-NZ 3.49Å; E96-K100 PolarHBondContact OE2-NZ 2.75Å; Q97-K100 CarbonylContact O-C 3.56Å; Q97-K100 PolarHBondContact O-N 3.26Å; Q97-K100 VanDerWaalsContact O-N 3.12Å; C98-K100 PolarHBondContact O-N 3.43Å; K100-P102 VanDerWaalsContact C-CD 3.44Å; K100-S103 PolarHBondContact O-N 3.02Å; K100-S103 VanDerWaalsContact O-N 3.09Å; K100-S103 PolarHBondContact O-OG 2.75Å; K100-S103 VanDerWaalsContact O-OG 3.07Å; K100-L104 HydrophobicContact CB-CD1 3.51Å; K100-L104 HydrophobicContact CB-CG 3.95Å; K100-L104 HydrophobicContact CD-CD1 4.42Å; K100-L104 WeakPolarHBondContact O-CG 3.04Å; K100-L104 PolarHBondContact O-N 3.02Å
101	A	83	Confident	86.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-55.7	-37	-174.9	0	0	0	0	0	115.2	Q97 C98 L99 S103 L104 Y105 G106 Y107 C109	Q97-A101 PolarHBondContact O-N 3.15Å; C98-A101 WeakPolarHBondContact O-CB 3.04Å; C98-A101 PolarHBondContact O-N 2.82Å; L99-A101 VanDerWaalsContact C-N 3.35Å; A101-S103 VanDerWaalsContact C-N 3.28Å; A101-S103 PolarHBondContact O-N 3.1Å; A101-L104 PolarHBondContact O-N 2.87Å; A101-Y105 HydrophobicContact CB-CD2 3.81Å; A101-Y105 HydrophobicContact CB-CE2 4.44Å; A101-Y105 CarbonylContact O-C 3.52Å; A101-Y105 WeakPolarHBondContact O-CA 3.49Å; A101-Y105 PolarHBondContact O-N 2.87Å; A101-G106 PolarHBondContact O-N 3.1Å; A101-G106 VanDerWaalsContact O-N 3.15Å; A101-Y107 CarbonylContact C-O 3.55Å; A101-Y107 HydrophobicContact CB-CE2 4.35Å; A101-Y107 WeakPolarHBondContact CB-O 3.48Å; A101-C109 HydrophobicContact CB-CB 3.49Å; A101-C109 VanDerWaalsContact CB-CB 3.49Å
102	P	81.9	Confident	87.1	Confident	62 Å²	62	45.6 Å²	45.6	40%	0.403	25%	0.251	S	S	.	.	H	α-helix	trans	-59.8	-36	177	-26.9	35.4	0	0	0	113.6	K100 G106 Y107	K100-P102 VanDerWaalsContact C-CD 3.44Å; P102-G106 WeakPolarHBondContact O-CA 3.37Å; P102-G106 PolarHBondContact O-N 2.83Å; P102-Y107 WeakPolarHBondContact CA-O 3.36Å
103	S	81.7	Confident	87.4	Confident	100 Å²	100	37.3 Å²	37.3	70%	0.699	22%	0.22	S	C	*	.	H	α-helix	trans	-93.2	-25.8	-178.8	57.4	0	0	0	0	113.9	K100 A101	K100-S103 PolarHBondContact O-N 3.02Å; K100-S103 VanDerWaalsContact O-N 3.09Å; K100-S103 PolarHBondContact O-OG 2.75Å; K100-S103 VanDerWaalsContact O-OG 3.07Å; A101-S103 VanDerWaalsContact C-N 3.28Å; A101-S103 PolarHBondContact O-N 3.1Å
104	L	82.7	Confident	87.6	Confident	91 Å²	91	34.2 Å²	34.2	48%	0.476	21%	0.206	S	C	.	.	H	α-helix	trans	-89.3	-35.6	179.3	-64.4	179.1	0	0	0	113.6	K100 A101	K100-L104 HydrophobicContact CB-CD1 3.51Å; K100-L104 HydrophobicContact CB-CG 3.95Å; K100-L104 HydrophobicContact CD-CD1 4.42Å; K100-L104 WeakPolarHBondContact O-CG 3.04Å; K100-L104 PolarHBondContact O-N 3.02Å; A101-L104 PolarHBondContact O-N 2.87Å
105	Y	83.8	Confident	87.8	Confident	31 Å²	31	34.3 Å²	34.3	12%	0.122	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-5.3	-169.7	-46.4	-54.5	0	0	0	113.8	T84 Q97 A101 Y107 L125 I201 P204	T84-Y105 HydrophobicContact CG2-CD1 4.23Å; T84-Y105 HydrophobicContact CG2-CD2 4.49Å; T84-Y105 HydrophobicContact CG2-CE1 4.15Å; T84-Y105 HydrophobicContact CG2-CE2 4.43Å; T84-Y105 HydrophobicContact CG2-CG 4.43Å; Q97-Y105 PolarHBondContact OE1-OH 3.05Å; A101-Y105 HydrophobicContact CB-CD2 3.81Å; A101-Y105 HydrophobicContact CB-CE2 4.44Å; A101-Y105 CarbonylContact O-C 3.52Å; A101-Y105 WeakPolarHBondContact O-CA 3.49Å; A101-Y105 PolarHBondContact O-N 2.87Å; Y105-Y107 HydrophobicContact CD2-CE1 4.03Å; Y105-Y107 HydrophobicContact CG-CE1 4.02Å; Y105-L125 HydrophobicContact CD2-CD1 4.2Å; Y105-L125 HydrophobicContact CE2-CD1 3.65Å; Y105-I201 WeakPolarHBondContact O-CD1 3.41Å; Y105-P204 HydrophobicContact CE1-CG 4.12Å
106	G	82.2	Confident	87.9	Confident	68 Å²	68	37.2 Å²	37.2	70%	0.701	22%	0.222	S	C	*	.	S	Bend	trans	74.3	21.8	176.4	0	0	0	0	0	115.1	A101 P102	A101-G106 PolarHBondContact O-N 3.1Å; A101-G106 VanDerWaalsContact O-N 3.15Å; P102-G106 WeakPolarHBondContact O-CA 3.37Å; P102-G106 PolarHBondContact O-N 2.83Å
107	Y	81.3	Confident	88	Confident	19 Å²	19	40.9 Å²	40.9	8%	0.075	24%	0.239	C	C	.	.	S	Bend	trans	-142.7	155.9	172.2	73.8	-83.2	0	0	0	111.5	R83 T84 A101 P102 Y105 C109 L125 I201	R83-Y107 HydrophobicContact CB-CD1 4.43Å; R83-Y107 HydrophobicContact CB-CD2 4.07Å; R83-Y107 HydrophobicContact CB-CE1 3.84Å; R83-Y107 HydrophobicContact CB-CE2 3.47Å; R83-Y107 VanDerWaalsContact CB-CE2 3.47Å; R83-Y107 HydrophobicContact CG-CD2 4Å; R83-Y107 HydrophobicContact CG-CE2 3.76Å; T84-Y107 WeakPolarHBondContact CB-OH 3.31Å; T84-Y107 VanDerWaalsContact OG1-CE1 3.22Å; T84-Y107 WeakPolarHBondContact OG1-CE1 3.27Å; T84-Y107 PolarHBondContact OG1-OH 3.45Å; A101-Y107 CarbonylContact C-O 3.55Å; A101-Y107 HydrophobicContact CB-CE2 4.35Å; A101-Y107 WeakPolarHBondContact CB-O 3.48Å; P102-Y107 WeakPolarHBondContact CA-O 3.36Å; Y105-Y107 HydrophobicContact CD2-CE1 4.03Å; Y105-Y107 HydrophobicContact CG-CE1 4.02Å; Y107-C109 HydrophobicContact CE2-CB 3.91Å; Y107-C109 PolarHBondContact O-N 3.48Å; Y107-L125 WeakPolarHBondContact OH-CB 3.14Å; Y107-I201 HydrophobicContact CD1-CD1 3.57Å; Y107-I201 HydrophobicContact CE1-CD1 3.78Å
108	T	83.3	Confident	88.1	Confident	97 Å²	97	42.8 Å²	42.8	60%	0.595	25%	0.248	S	C	*	.			trans	-78.3	117.9	172	-54.3	0	0	0	0	109.9
109	C	87.9	Confident	87.9	Confident	6 Å²	6	49.8 Å²	49.8	4%	0.041	29%	0.285	C	S	.	.			trans	-84.8	132.7	168.6	174.7	0	0	0	0	109.3	C98 A101 Y107 S111 N126	C98-C109 WeakPolarHBondContact CA-SG 3.37Å; C98-C109 HydrophobicContact CB-CB 3.97Å; C98-C109 WeakPolarHBondContact CB-SG 3.49Å; C98-C109 WeakPolarHBondContact O-CB 3.14Å; C98-C109 WeakPolarHBondContact SG-CB 3.17Å; C98-C109 CovalentContact SG-SG 2.04Å; C98-C109 PolarHBondContact SG-SG 3.33Å; A101-C109 HydrophobicContact CB-CB 3.49Å; A101-C109 VanDerWaalsContact CB-CB 3.49Å; Y107-C109 HydrophobicContact CE2-CB 3.91Å; Y107-C109 PolarHBondContact O-N 3.48Å; C109-S111 PolarHBondContact SG-O 3.32Å; C109-N126 WeakPolarHBondContact CA-O 3.34Å
110	S	89	Confident	87.9	Confident	29 Å²	29	51.1 Å²	51.1	20%	0.203	30%	0.296	C	S	.	.			trans	-116.1	-30.2	-175.2	-51.9	0	0	0	0	112.2	N126 S127 L150	S110-N126 PolarHBondContact N-O 3.34Å; S110-S127 WeakPolarHBondContact CB-O 3.41Å; S110-S127 PolarHBondContact OG-O 2.98Å; S110-L150 PolarHBondContact O-N 2.9Å
111	S	93.7	Very high	88	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	174.5	173.6	75.8	0	0	0	0	110.9	C109 N126 E128 Y147 F148	C109-S111 PolarHBondContact SG-O 3.32Å; S111-N126 WeakPolarHBondContact O-CB 3.47Å; S111-N126 PolarHBondContact O-N 2.96Å; S111-N126 WeakPolarHBondContact OG-CB 3.24Å; S111-N126 PolarHBondContact OG-ND2 3.27Å; S111-N126 VanDerWaalsContact OG-ND2 3.13Å; S111-E128 WeakPolarHBondContact CB-O 3.38Å; S111-E128 PolarHBondContact OG-O 3.47Å; S111-Y147 WeakPolarHBondContact CB-OH 3.43Å; S111-Y147 WeakPolarHBondContact OG-CE2 3.4Å; S111-F148 CarbonylContact C-O 3.52Å; S111-F148 VanDerWaalsContact CA-O 3.26Å; S111-F148 WeakPolarHBondContact CA-O 3.42Å; S111-F148 VanDerWaalsContact CB-O 3.25Å; S111-F148 WeakPolarHBondContact CB-O 3.48Å
112	G	95.3	Very high	88.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	178	172.1	0	0	0	0	0	112.1	I124 Y147 F148	G112-I124 CarbonylContact C-O 3.44Å; G112-I124 WeakPolarHBondContact CA-O 3.35Å; G112-Y147 WeakPolarHBondContact O-CA 3.37Å; G112-F148 VanDerWaalsContact CA-CE1 3.41Å; G112-F148 PolarHBondContact N-O 2.82Å; G112-F148 WeakPolarHBondContact O-CD1 3.38Å; G112-F148 PolarHBondContact O-N 2.66Å
113	V	96	Very high	89.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.9	-178.3	179.2	0	0	0	0	107.7	I77 Y115 I124 V145 E146 Y147	I77-V113 HydrophobicContact CG1-CG1 4.15Å; I77-V113 HydrophobicContact CG2-CG2 4.33Å; V113-Y115 HydrophobicContact CG1-CE2 4.05Å; V113-I124 HydrophobicContact CB-CB 4.25Å; V113-I124 PolarHBondContact N-O 3.45Å; V113-I124 PolarHBondContact O-N 2.94Å; V113-V145 HydrophobicContact CG1-CG2 3.21Å; V113-E146 CarbonylContact C-O 3.39Å; V113-E146 WeakPolarHBondContact CA-O 3.43Å; V113-Y147 HydrophobicContact CG2-CD2 4.23Å
114	F	96.1	Very high	89.8	Confident	8 Å²	8	41 Å²	41	4%	0.035	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.2	177.5	179.5	-110.7	0	0	0	111.1	I88 S91 C94 N116 N122 C123 V145 E146	I88-F114 HydrophobicContact CD1-CD2 3.61Å; I88-F114 HydrophobicContact CD1-CE2 3.25Å; I88-F114 HydrophobicContact CD1-CZ 4.14Å; I88-F114 HydrophobicContact CG1-CE2 4.39Å; S91-F114 VanDerWaalsContact CB-CD1 3.5Å; S91-F114 VanDerWaalsContact N-CE1 3.26Å; C94-F114 HydrophobicContact CB-CB 4.36Å; C94-F114 HydrophobicContact CB-CD2 4.14Å; C94-F114 HydrophobicContact CB-CG 4.45Å; F114-N116 VanDerWaalsContact CD1-OD1 3.23Å; F114-N116 WeakPolarHBondContact CD1-OD1 3.23Å; F114-N116 HydrophobicContact CE1-CB 4.34Å; F114-N116 WeakPolarHBondContact CE1-OD1 3.43Å; F114-N122 CarbonylContact C-O 3.53Å; F114-N122 WeakPolarHBondContact CA-O 3.38Å; F114-N122 WeakPolarHBondContact CD2-O 3.39Å; F114-N122 HydrophobicContact CE2-CB 4.21Å; F114-C123 HydrophobicContact CD2-CB 4.27Å; F114-V145 CarbonylContact O-C 3.56Å; F114-V145 VanDerWaalsContact O-CA 3.31Å; F114-V145 WeakPolarHBondContact O-CA 3.42Å; F114-E146 PolarHBondContact N-O 3.33Å; F114-E146 PolarHBondContact O-N 3.23Å
115	Y	96.1	Very high	90.4	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	114.8	173.8	-63.9	-93	0	0	0	109.7	I77 V113 E118 N122 I124 N143 D144 V145 D222	I77-Y115 HydrophobicContact CD1-CE1 4.29Å; I77-Y115 WeakPolarHBondContact CD1-OH 3.46Å; V113-Y115 HydrophobicContact CG1-CE2 4.05Å; Y115-E118 HydrophobicContact CG-CG 4.34Å; Y115-N122 PolarHBondContact N-O 2.74Å; Y115-I124 HydrophobicContact CE2-CD1 3.73Å; Y115-I124 HydrophobicContact CE2-CG1 4.4Å; Y115-N143 HydrophobicContact CD1-CB 3.99Å; Y115-N143 HydrophobicContact CE1-CB 4.09Å; Y115-D144 CarbonylContact C-O 3.6Å; Y115-D144 WeakPolarHBondContact CA-O 3.13Å; Y115-V145 HydrophobicContact CD1-CB 3.73Å; Y115-V145 HydrophobicContact CD1-CG2 3.63Å; Y115-V145 HydrophobicContact CD2-CG2 4.28Å; Y115-V145 HydrophobicContact CE1-CB 3.92Å; Y115-V145 HydrophobicContact CE1-CG2 3.61Å; Y115-V145 HydrophobicContact CE2-CG2 4.29Å; Y115-V145 HydrophobicContact CG-CB 4.39Å; Y115-V145 HydrophobicContact CG-CG2 3.98Å; Y115-D222 PolarHBondContact OH-OD1 2.77Å; Y115-D222 PolarHBondContact OH-OD2 3.27Å
116	N	93.2	Very high	90.8	Very high	71 Å²	71	35.2 Å²	35.2	38%	0.38	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-34	-172.3	-65	-60.5	0	0	0	113.3	F114 D144	F114-N116 VanDerWaalsContact CD1-OD1 3.23Å; F114-N116 WeakPolarHBondContact CD1-OD1 3.23Å; F114-N116 HydrophobicContact CE1-CB 4.34Å; F114-N116 WeakPolarHBondContact CE1-OD1 3.43Å; N116-D144 HydrophobicContact CB-CB 4.24Å; N116-D144 VanDerWaalsContact CB-OD2 3.24Å; N116-D144 WeakPolarHBondContact CB-OD2 3.46Å; N116-D144 PolarHBondContact N-O 2.95Å; N116-D144 VanDerWaalsContact ND2-CG 3.26Å; N116-D144 PolarHBondContact ND2-OD1 3.45Å; N116-D144 PolarHBondContact ND2-OD2 2.85Å
117	E	92.6	Very high	91	Very high	141 Å²	141	32.8 Å²	32.8	66%	0.659	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-3.6	-175.8	-70.6	176.1	154.3	0	0	113.6	D144	E117-D144 HydrophobicContact CG-CB 3.91Å
118	E	90.6	Very high	91.3	Very high	74 Å²	74	33.5 Å²	33.5	35%	0.346	18%	0.183	S	C	.	.			trans	-98.3	129.6	-173.6	-70.9	-86.4	-135.1	0	0	111.5	Y115 N122 R224	Y115-E118 HydrophobicContact CG-CG 4.34Å; E118-N122 HydrophobicContact CB-CB 3.78Å; E118-N122 VanDerWaalsContact O-CB 3.29Å; E118-N122 WeakPolarHBondContact O-CB 3.37Å; E118-N122 PolarHBondContact O-ND2 2.98Å; E118-R224 VanDerWaalsContact CD-NH1 3.33Å; E118-R224 IonicContact OE1-CZ 3.13Å; E118-R224 IonicContact OE1-NH1 2.65Å; E118-R224 PolarHBondContact OE1-NH1 3.43Å; E118-R224 IonicContact OE1-NH2 3.19Å; E118-R224 PolarHBondContact OE1-NH2 3.08Å
119	N	85.5	Confident	91.5	Very high	147 Å²	147	29.6 Å²	29.6	79%	0.786	16%	0.159	S	C	*	.	S	Bend	trans	-90.1	-16.5	-172.8	-68.3	-66.9	0	0	0	114.3
120	S	86.4	Confident	91.6	Very high	53 Å²	53	31.7 Å²	31.7	37%	0.371	17%	0.167	S	C	.	.	S	Bend	trans	-135.5	142.4	-179.5	68.3	0	0	0	0	110.8	E87 N122	E87-S120 WeakPolarHBondContact OE2-CA 3.24Å; E87-S120 VanDerWaalsContact OE2-CB 3.29Å; E87-S120 WeakPolarHBondContact OE2-CB 3.14Å; S120-N122 PolarHBondContact O-N 3.44Å; S120-N122 VanDerWaalsContact O-N 3.13Å
121	L	84.9	Confident	91.4	Very high	11 Å²	11	34.7 Å²	34.7	6%	0.058	18%	0.178	C	C	.	.	S	Bend	trans	52.8	38.2	172.4	-61.5	163.4	0	0	0	112.7	V85 V86 K213 Y215 R224	V85-L121 HydrophobicContact CG1-CB 3.83Å; V85-L121 HydrophobicContact CG1-CD2 4.26Å; V85-L121 VanDerWaalsContact CG1-O 3.31Å; V85-L121 WeakPolarHBondContact CG1-O 3.5Å; V86-L121 CarbonylContact O-C 3.56Å; V86-L121 WeakPolarHBondContact O-CA 3.47Å; L121-K213 HydrophobicContact CD1-CD 3.66Å; L121-K213 HydrophobicContact CD1-CG 4.42Å; L121-Y215 WeakPolarHBondContact CD1-OH 3.45Å; L121-R224 WeakPolarHBondContact O-CD 3.23Å
122	N	92.8	Very high	91	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.032	20%	0.199	C	C	.	.			trans	-91.3	-4.8	-169.1	58.5	-6.5	0	0	0	113.8	V86 I88 F114 Y115 E118 S120	V86-N122 PolarHBondContact O-N 3.48Å; I88-N122 PolarHBondContact N-OD1 2.99Å; I88-N122 VanDerWaalsContact N-OD1 3.09Å; I88-N122 PolarHBondContact O-ND2 3.01Å; I88-N122 PolarHBondContact O-OD1 3.49Å; F114-N122 CarbonylContact C-O 3.53Å; F114-N122 WeakPolarHBondContact CA-O 3.38Å; F114-N122 WeakPolarHBondContact CD2-O 3.39Å; F114-N122 HydrophobicContact CE2-CB 4.21Å; Y115-N122 PolarHBondContact N-O 2.74Å; E118-N122 HydrophobicContact CB-CB 3.78Å; E118-N122 VanDerWaalsContact O-CB 3.29Å; E118-N122 WeakPolarHBondContact O-CB 3.37Å; E118-N122 PolarHBondContact O-ND2 2.98Å; S120-N122 PolarHBondContact O-N 3.44Å; S120-N122 VanDerWaalsContact O-N 3.13Å
123	C	96	Very high	90.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.6	177.1	171.4	0	0	0	0	110.6	V85 V86 I88 C94 F114	V85-C123 CarbonylContact C-O 3.54Å; V85-C123 WeakPolarHBondContact CA-O 3.45Å; V86-C123 HydrophobicContact CG2-CB 3.63Å; V86-C123 VanDerWaalsContact CG2-SG 3.58Å; V86-C123 PolarHBondContact N-O 3.28Å; V86-C123 PolarHBondContact O-N 3.2Å; I88-C123 HydrophobicContact CD1-CB 3.91Å; I88-C123 HydrophobicContact CG1-CB 3.38Å; C94-C123 WeakPolarHBondContact CA-SG 3.22Å; C94-C123 HydrophobicContact CB-CB 3.78Å; C94-C123 WeakPolarHBondContact CB-SG 3.47Å; C94-C123 WeakPolarHBondContact SG-CB 3.49Å; C94-C123 CovalentContact SG-SG 2.03Å; C94-C123 PolarHBondContact SG-SG 3.44Å; F114-C123 HydrophobicContact CD2-CB 4.27Å
124	I	96.4	Very high	90.1	Very high	6 Å²	6	44.4 Å²	44.4	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131.6	174.5	-55.4	173	0	0	0	108.2	A82 V85 G112 V113 Y115 I223 R224	A82-I124 HydrophobicContact CB-CG2 3.45Å; A82-I124 VanDerWaalsContact CB-CG2 3.45Å; V85-I124 HydrophobicContact CG1-CG1 4.34Å; V85-I124 HydrophobicContact CG2-CG1 4.31Å; G112-I124 CarbonylContact C-O 3.44Å; G112-I124 WeakPolarHBondContact CA-O 3.35Å; V113-I124 HydrophobicContact CB-CB 4.25Å; V113-I124 PolarHBondContact N-O 3.45Å; V113-I124 PolarHBondContact O-N 2.94Å; Y115-I124 HydrophobicContact CE2-CD1 3.73Å; Y115-I124 HydrophobicContact CE2-CG1 4.4Å; I124-I223 HydrophobicContact CD1-CG2 3.92Å; I124-I223 HydrophobicContact CG1-CG2 4.4Å; I124-I223 HydrophobicContact CG2-CG2 4.36Å; I124-R224 HydrophobicContact CD1-CG 4.46Å
125	L	94.7	Very high	89.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.9	179.7	-58.4	-175.6	0	0	0	110.1	R83 T84 Q97 C98 Y105 Y107 F148	R83-L125 PolarHBondContact N-O 3.15Å; T84-L125 PolarHBondContact N-O 3.44Å; T84-L125 PolarHBondContact O-N 3.21Å; Q97-L125 HydrophobicContact CB-CD1 4.13Å; C98-L125 HydrophobicContact CB-CD2 3.78Å; Y105-L125 HydrophobicContact CD2-CD1 4.2Å; Y105-L125 HydrophobicContact CE2-CD1 3.65Å; Y107-L125 WeakPolarHBondContact OH-CB 3.14Å; L125-F148 HydrophobicContact CD2-CZ 4.29Å
126	N	92.3	Very high	89.3	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.4	-174.1	-53.7	-39	0	0	0	112	Y81 A82 C109 S110 S111	Y81-N126 VanDerWaalsContact O-CA 3.24Å; Y81-N126 WeakPolarHBondContact O-CA 3.31Å; Y81-N126 WeakPolarHBondContact O-CB 3.44Å; A82-N126 VanDerWaalsContact CA-OD1 3.3Å; A82-N126 WeakPolarHBondContact CA-OD1 3.45Å; C109-N126 WeakPolarHBondContact CA-O 3.34Å; S110-N126 PolarHBondContact N-O 3.34Å; S111-N126 WeakPolarHBondContact O-CB 3.47Å; S111-N126 PolarHBondContact O-N 2.96Å; S111-N126 WeakPolarHBondContact OG-CB 3.24Å; S111-N126 PolarHBondContact OG-ND2 3.27Å; S111-N126 VanDerWaalsContact OG-ND2 3.13Å
127	S	86.6	Confident	89.3	Confident	17 Å²	17	45.3 Å²	45.3	12%	0.119	24%	0.24	C	C	.	.	S	Bend	trans	-81.7	-25.2	171.6	56.2	0	0	0	0	113.8	Y81 S110	Y81-S127 PolarHBondContact O-N 3.43Å; S110-S127 WeakPolarHBondContact CB-O 3.41Å; S110-S127 PolarHBondContact OG-O 2.98Å
128	E	88.3	Confident	89.3	Confident	35 Å²	35	40.4 Å²	40.4	16%	0.164	22%	0.22	C	C	.	.	S	Bend	trans	-111	174.4	-174.2	-44.3	-47.8	129.4	0	0	113	Y81 S111 Q132	Y81-E128 HydrophobicContact CD1-CB 4.23Å; Y81-E128 HydrophobicContact CD1-CG 3.33Å; Y81-E128 HydrophobicContact CD2-CB 4.37Å; Y81-E128 HydrophobicContact CD2-CG 4.29Å; Y81-E128 HydrophobicContact CE1-CG 3.85Å; Y81-E128 HydrophobicContact CG-CB 3.98Å; Y81-E128 HydrophobicContact CG-CG 3.58Å; S111-E128 WeakPolarHBondContact CB-O 3.38Å; S111-E128 PolarHBondContact OG-O 3.47Å; E128-Q132 VanDerWaalsContact CA-OE1 3.31Å; E128-Q132 PolarHBondContact OE2-NE2 2.96Å; E128-Q132 PolarHBondContact OE2-OE1 3.41Å
129	T	88.1	Confident	89.3	Confident	15 Å²	15	43.1 Å²	43.1	9%	0.092	23%	0.232	C	C	.	.			trans	-124.2	172.4	-179.7	81.2	0	0	0	0	113.7	E131 Q132 H133 Q149	T129-E131 VanDerWaalsContact C-N 3.33Å; T129-E131 WeakPolarHBondContact CB-OE2 3.08Å; T129-E131 PolarHBondContact O-N 2.85Å; T129-E131 PolarHBondContact OG1-N 3.09Å; T129-E131 PolarHBondContact OG1-OE2 3.37Å; T129-Q132 PolarHBondContact O-N 3.24Å; T129-Q132 PolarHBondContact OG1-OE1 2.9Å; T129-H133 PolarHBondContact O-N 2.97Å; T129-Q149 VanDerWaalsContact CB-CD 3.46Å; T129-Q149 HydrophobicContact CG2-CG 3.86Å
130	K	88.7	Confident	89.5	Confident	49 Å²	49	37.1 Å²	37.1	21%	0.213	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-26.4	174.3	78.5	177.6	-171.4	166.3	0	113.7	L71 E73 Q132 H133 A134 L137 Y147	L71-K130 HydrophobicContact CD2-CD 3.88Å; L71-K130 VanDerWaalsContact CD2-NZ 3.33Å; E73-K130 WeakPolarHBondContact OE1-CD 3.36Å; E73-K130 WeakPolarHBondContact OE1-CE 3.46Å; E73-K130 IonicContact OE1-NZ 2.75Å; E73-K130 PolarHBondContact OE1-NZ 2.93Å; K130-Q132 VanDerWaalsContact C-N 3.25Å; K130-Q132 PolarHBondContact O-N 2.82Å; K130-H133 CarbonylContact O-C 3.46Å; K130-H133 VanDerWaalsContact O-C 3.32Å; K130-H133 PolarHBondContact O-N 3.13Å; K130-A134 WeakPolarHBondContact O-CA 3.48Å; K130-A134 VanDerWaalsContact O-CB 3.23Å; K130-A134 WeakPolarHBondContact O-CB 3.05Å; K130-A134 PolarHBondContact O-N 2.04Å; K130-L137 HydrophobicContact CB-CB 4.38Å; K130-L137 HydrophobicContact CB-CD2 3.88Å; K130-L137 HydrophobicContact CD-CD2 3.97Å; K130-Y147 HydrophobicContact CB-CE1 4.43Å; K130-Y147 HydrophobicContact CD-CE1 4.36Å; K130-Y147 PolarHBondContact N-OH 2.88Å; K130-Y147 VanDerWaalsContact N-OH 3.08Å
131	E	85.9	Confident	89.6	Confident	92 Å²	92	41.1 Å²	41.1	43%	0.43	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-29.7	179.1	-65.6	70.9	-158.7	0	0	110.7	T129 Q149	T129-E131 VanDerWaalsContact C-N 3.33Å; T129-E131 WeakPolarHBondContact CB-OE2 3.08Å; T129-E131 PolarHBondContact O-N 2.85Å; T129-E131 PolarHBondContact OG1-N 3.09Å; T129-E131 PolarHBondContact OG1-OE2 3.37Å; E131-Q149 VanDerWaalsContact CD-NE2 3.32Å; E131-Q149 PolarHBondContact OE1-NE2 3.48Å; E131-Q149 PolarHBondContact OE2-NE2 2.97Å; E131-Q149 PolarHBondContact OE2-OE1 3.04Å
132	Q	84	Confident	89.8	Confident	98 Å²	98	49 Å²	49	46%	0.458	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-33.4	171.7	-58.6	169.3	-83.5	0	0	111.2	E128 T129 K130	E128-Q132 VanDerWaalsContact CA-OE1 3.31Å; E128-Q132 PolarHBondContact OE2-NE2 2.96Å; E128-Q132 PolarHBondContact OE2-OE1 3.41Å; T129-Q132 PolarHBondContact O-N 3.24Å; T129-Q132 PolarHBondContact OG1-OE1 2.9Å; K130-Q132 VanDerWaalsContact C-N 3.25Å; K130-Q132 PolarHBondContact O-N 2.82Å
133	H	85.9	Confident	89.7	Confident	37 Å²	37	51.3 Å²	51.3	17%	0.171	26%	0.262	C	S	.	.			trans	-141.9	49.9	-165.2	-62.8	-50.4	0	0	0	114.1	L78 Y81 T129 K130 D135 L136 L137	L78-H133 HydrophobicContact CD1-CB 4.07Å; Y81-H133 AromaticContact CD2-CD2 3.77Å; Y81-H133 AromaticContact CE1-NE2 3.96Å; Y81-H133 HydrophobicContact CE2-CB 4.21Å; Y81-H133 AromaticContact CE2-CD2 3.3Å; Y81-H133 WeakPolarHBondContact CE2-CD2 3.27Å; Y81-H133 AromaticContact CE2-CE1 3.95Å; Y81-H133 AromaticContact CE2-CG 3.5Å; Y81-H133 AromaticContact CE2-ND1 3.88Å; Y81-H133 AromaticContact CE2-NE2 3.62Å; Y81-H133 AromaticContact CZ-CD2 3.64Å; Y81-H133 AromaticContact CZ-CE1 3.66Å; Y81-H133 AromaticContact CZ-NE2 3.4Å; Y81-H133 PolarHBondContact OH-CE1 3.21Å; Y81-H133 PolarHBondContact OH-NE2 2.78Å; T129-H133 PolarHBondContact O-N 2.97Å; K130-H133 CarbonylContact O-C 3.46Å; K130-H133 VanDerWaalsContact O-C 3.32Å; K130-H133 PolarHBondContact O-N 3.13Å; H133-D135 PolarHBondContact O-N 2.83Å; H133-D135 VanDerWaalsContact O-N 3.15Å; H133-L136 HydrophobicContact CB-CB 4.29Å; H133-L136 HydrophobicContact CB-CD1 4.06Å; H133-L136 PolarHBondContact O-N 2.95Å; H133-L137 PolarHBondContact O-N 2.88Å
134	A	87.7	Confident	89.6	Confident	71 Å²	71	54 Å²	54	59%	0.587	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-63	-26	-171.8	0	0	0	0	0	113.6	K130 L136	K130-A134 WeakPolarHBondContact O-CA 3.48Å; K130-A134 VanDerWaalsContact O-CB 3.23Å; K130-A134 WeakPolarHBondContact O-CB 3.05Å; K130-A134 PolarHBondContact O-N 2.04Å; A134-L136 VanDerWaalsContact C-N 3.3Å
135	D	86.9	Confident	89.5	Confident	67 Å²	67	53.7 Å²	53.7	36%	0.358	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-81.6	-6.1	177.8	60.5	-41.3	0	0	0	114.3	H133 R184	H133-D135 PolarHBondContact O-N 2.83Å; H133-D135 VanDerWaalsContact O-N 3.15Å; D135-R184 VanDerWaalsContact CG-NH1 3.31Å; D135-R184 WeakPolarHBondContact OD2-CD 3.4Å; D135-R184 IonicContact OD2-CZ 3.11Å; D135-R184 IonicContact OD2-NE 2.83Å; D135-R184 PolarHBondContact OD2-NE 3.46Å; D135-R184 IonicContact OD2-NH1 2.88Å; D135-R184 PolarHBondContact OD2-NH1 3.15Å
136	L	88.8	Confident	89.4	Confident	7 Å²	7	55.2 Å²	55.2	4%	0.037	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-111	0.4	175.9	-61.1	167.8	0	0	0	112.2	L78 I79 Y81 H133 A134 V138 R184 I185 A188	L78-L136 HydrophobicContact CD1-CB 4.2Å; I79-L136 PolarHBondContact N-O 2.91Å; Y81-L136 HydrophobicContact CE2-CD1 3.88Å; H133-L136 HydrophobicContact CB-CB 4.29Å; H133-L136 HydrophobicContact CB-CD1 4.06Å; H133-L136 PolarHBondContact O-N 2.95Å; A134-L136 VanDerWaalsContact C-N 3.3Å; L136-V138 PolarHBondContact O-N 3.24Å; L136-R184 HydrophobicContact CD2-CB 4.28Å; L136-I185 HydrophobicContact CD2-CG1 3.88Å; L136-A188 HydrophobicContact CD1-CB 3.43Å; L136-A188 VanDerWaalsContact CD1-CB 3.43Å; L136-A188 HydrophobicContact CD2-CB 4.31Å
137	L	92.3	Very high	89.6	Confident	24 Å²	24	55.1 Å²	55.1	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	93.9	168.3	-172.3	76.5	0	0	0	108.7	K76 I77 L78 K130 H133 Y147	K76-L137 HydrophobicContact CB-CD1 4.15Å; K76-L137 HydrophobicContact CB-CG 4.27Å; K76-L137 HydrophobicContact CD-CD2 3.68Å; K76-L137 HydrophobicContact CD-CG 3.89Å; I77-L137 CarbonylContact O-C 3.58Å; I77-L137 WeakPolarHBondContact O-CA 3.24Å; L78-L137 HydrophobicContact CB-CD1 4.22Å; K130-L137 HydrophobicContact CB-CB 4.38Å; K130-L137 HydrophobicContact CB-CD2 3.88Å; K130-L137 HydrophobicContact CD-CD2 3.97Å; H133-L137 PolarHBondContact O-N 2.88Å; L137-Y147 HydrophobicContact CD1-CD1 3.97Å; L137-Y147 HydrophobicContact CD1-CD2 3.7Å; L137-Y147 HydrophobicContact CD1-CE1 4.22Å; L137-Y147 HydrophobicContact CD1-CE2 3.94Å; L137-Y147 HydrophobicContact CD1-CG 3.7Å
138	V	91.8	Very high	89.9	Confident	38 Å²	38	54.3 Å²	54.3	23%	0.23	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	159.9	-176.6	-63.2	0	0	0	0	112.2	K76 I77 I79 L136	K76-V138 CarbonylContact C-O 3.53Å; K76-V138 WeakPolarHBondContact CA-O 3.41Å; I77-V138 HydrophobicContact CB-CG2 4.32Å; I77-V138 PolarHBondContact N-O 3.3Å; I77-V138 PolarHBondContact O-N 2.91Å; I79-V138 HydrophobicContact CD1-CB 4.25Å; I79-V138 HydrophobicContact CD1-CG1 3.47Å; I79-V138 VanDerWaalsContact CD1-CG1 3.47Å; I79-V138 HydrophobicContact CD1-CG2 3.74Å; I79-V138 HydrophobicContact CG1-CG1 4.39Å; I79-V138 HydrophobicContact CG1-CG2 3.92Å; L136-V138 PolarHBondContact O-N 3.24Å
139	E	92.4	Very high	90	Very high	131 Å²	131	52.7 Å²	52.7	61%	0.612	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	136	170.7	-65.4	-173	179.9	0	0	111.6	K75 Q141	K75-E139 CarbonylContact O-C 3.58Å; K75-E139 VanDerWaalsContact O-CA 3.26Å; K75-E139 WeakPolarHBondContact O-CA 3.44Å; E139-Q141 PolarHBondContact OE2-NE2 2.97Å
140	D	89.7	Confident	89.9	Confident	22 Å²	22	52.7 Å²	52.7	12%	0.118	27%	0.268	C	S	.	.			trans	-115	104.9	166	-177.2	-13.6	0	0	0	108.7	K75 I77 Q142 N143 V145	K75-D140 WeakPolarHBondContact CB-O 3.06Å; K75-D140 WeakPolarHBondContact CD-O 3.45Å; K75-D140 PolarHBondContact O-N 3.22Å; I77-D140 HydrophobicContact CD1-CB 3.69Å; I77-D140 WeakPolarHBondContact CD1-OD2 3.35Å; I77-D140 HydrophobicContact CG1-CB 4.11Å; D140-Q142 WeakPolarHBondContact OD1-CA 3.45Å; D140-Q142 PolarHBondContact OD1-N 3.28Å; D140-N143 PolarHBondContact OD1-N 3.44Å; D140-N143 WeakPolarHBondContact OD2-CB 3.5Å; D140-N143 PolarHBondContact OD2-ND2 2.86Å; D140-V145 HydrophobicContact CB-CG1 3.89Å
141	Q	87.2	Confident	89.2	Confident	137 Å²	137	51.5 Å²	51.5	64%	0.64	26%	0.264	S	S	*	.	S	Bend	trans	-82.6	-16.1	-179.8	-64.7	-70.9	-20.5	0	0	112.5	E139	E139-Q141 PolarHBondContact OE2-NE2 2.97Å
142	Q	89.1	Confident	88.2	Confident	175 Å²	175	49.7 Å²	49.7	82%	0.818	26%	0.26	S	S	*	.	S	Bend	trans	-88.6	-50.2	-172.5	-64.3	-175.7	-7.3	0	0	111.7	D140	D140-Q142 WeakPolarHBondContact OD1-CA 3.45Å; D140-Q142 PolarHBondContact OD1-N 3.28Å
143	N	91.5	Very high	86.8	Confident	56 Å²	56	47 Å²	47	30%	0.299	26%	0.26	S	S	.	.	S	Bend	trans	-92.2	145	-172.9	-57.5	-64.5	0	0	0	111.8	K75 Y115 D140 V145	K75-N143 WeakPolarHBondContact CD-O 3.43Å; K75-N143 WeakPolarHBondContact CE-O 3.42Å; K75-N143 VanDerWaalsContact NZ-C 3.31Å; K75-N143 PolarHBondContact NZ-O 3.23Å; Y115-N143 HydrophobicContact CD1-CB 3.99Å; Y115-N143 HydrophobicContact CE1-CB 4.09Å; D140-N143 PolarHBondContact OD1-N 3.44Å; D140-N143 WeakPolarHBondContact OD2-CB 3.5Å; D140-N143 PolarHBondContact OD2-ND2 2.86Å; N143-V145 PolarHBondContact O-N 2.85Å; N143-V145 VanDerWaalsContact O-N 3.12Å
144	D	93.7	Very high	85	Confident	56 Å²	56	52 Å²	52	30%	0.299	29%	0.287	S	S	.	.			trans	-74.4	98.8	165.6	-173	12.5	0	0	0	110.1	Y115 N116 E117	Y115-D144 CarbonylContact C-O 3.6Å; Y115-D144 WeakPolarHBondContact CA-O 3.13Å; N116-D144 HydrophobicContact CB-CB 4.24Å; N116-D144 VanDerWaalsContact CB-OD2 3.24Å; N116-D144 WeakPolarHBondContact CB-OD2 3.46Å; N116-D144 PolarHBondContact N-O 2.95Å; N116-D144 VanDerWaalsContact ND2-CG 3.26Å; N116-D144 PolarHBondContact ND2-OD1 3.45Å; N116-D144 PolarHBondContact ND2-OD2 2.85Å; E117-D144 HydrophobicContact CG-CB 3.91Å
145	V	94.4	Very high	82.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.4	-170.8	67.5	0	0	0	0	111.1	K75 I77 V113 F114 Y115 D140 N143	K75-V145 PolarHBondContact N-O 3.31Å; I77-V145 HydrophobicContact CG1-CG1 4.24Å; I77-V145 HydrophobicContact CG1-CG2 4.2Å; V113-V145 HydrophobicContact CG1-CG2 3.21Å; F114-V145 CarbonylContact O-C 3.56Å; F114-V145 VanDerWaalsContact O-CA 3.31Å; F114-V145 WeakPolarHBondContact O-CA 3.42Å; Y115-V145 HydrophobicContact CD1-CB 3.73Å; Y115-V145 HydrophobicContact CD1-CG2 3.63Å; Y115-V145 HydrophobicContact CD2-CG2 4.28Å; Y115-V145 HydrophobicContact CE1-CB 3.92Å; Y115-V145 HydrophobicContact CE1-CG2 3.61Å; Y115-V145 HydrophobicContact CE2-CG2 4.29Å; Y115-V145 HydrophobicContact CG-CB 4.39Å; Y115-V145 HydrophobicContact CG-CG2 3.98Å; D140-V145 HydrophobicContact CB-CG1 3.89Å; N143-V145 PolarHBondContact O-N 2.85Å; N143-V145 VanDerWaalsContact O-N 3.12Å
146	E	93.3	Very high	80.9	Confident	31 Å²	31	51.7 Å²	51.7	15%	0.145	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	120.5	176.5	-179.4	176.5	-109.3	0	0	110.5	R72 V113 F114	R72-E146 HydrophobicContact CB-CG 4.29Å; R72-E146 WeakPolarHBondContact CD-OE1 3.45Å; R72-E146 IonicContact CZ-OE2 2.8Å; R72-E146 IonicContact NE-OE2 3.68Å; R72-E146 IonicContact NH1-OE1 2.66Å; R72-E146 IonicContact NH1-OE2 3.29Å; R72-E146 PolarHBondContact NH1-OE2 3.36Å; V113-E146 CarbonylContact C-O 3.39Å; V113-E146 WeakPolarHBondContact CA-O 3.43Å; F114-E146 PolarHBondContact N-O 3.33Å; F114-E146 PolarHBondContact O-N 3.23Å
147	Y	94.9	Very high	78.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	133.8	162.1	170.5	-96.3	0	0	0	108.8	R72 E73 K76 L78 S111 G112 V113 K130 L137 Q149	R72-Y147 CarbonylContact C-O 3.05Å; R72-Y147 WeakPolarHBondContact CA-O 3.45Å; E73-Y147 HydrophobicContact CB-CD1 4.3Å; E73-Y147 PolarHBondContact N-O 3.42Å; E73-Y147 PolarHBondContact O-N 2.98Å; K76-Y147 WeakPolarHBondContact O-CB 3.39Å; K76-Y147 PolarHBondContact O-N 3.49Å; L78-Y147 HydrophobicContact CB-CD2 4.1Å; L78-Y147 HydrophobicContact CB-CE2 3.85Å; L78-Y147 HydrophobicContact CD2-CE2 4.18Å; S111-Y147 WeakPolarHBondContact CB-OH 3.43Å; S111-Y147 WeakPolarHBondContact OG-CE2 3.4Å; G112-Y147 WeakPolarHBondContact O-CA 3.37Å; V113-Y147 HydrophobicContact CG2-CD2 4.23Å; K130-Y147 HydrophobicContact CB-CE1 4.43Å; K130-Y147 HydrophobicContact CD-CE1 4.36Å; K130-Y147 PolarHBondContact N-OH 2.88Å; K130-Y147 VanDerWaalsContact N-OH 3.08Å; L137-Y147 HydrophobicContact CD1-CD1 3.97Å; L137-Y147 HydrophobicContact CD1-CD2 3.7Å; L137-Y147 HydrophobicContact CD1-CE1 4.22Å; L137-Y147 HydrophobicContact CD1-CE2 3.94Å; L137-Y147 HydrophobicContact CD1-CG 3.7Å; Y147-Q149 HydrophobicContact CE1-CB 3.86Å; Y147-Q149 PolarHBondContact OH-OE1 2.88Å
148	F	92.7	Very high	75.7	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	155.4	170.5	72.7	-89.1	0	0	0	110.9	I70 L71 R72 C94 I95 C98 S111 G112 L125 L150	I70-F148 HydrophobicContact CG2-CB 4.19Å; L71-F148 CarbonylContact O-C 3.32Å; L71-F148 VanDerWaalsContact O-CA 3.26Å; L71-F148 WeakPolarHBondContact O-CA 3.43Å; R72-F148 HydrophobicContact CG-CB 4.35Å; C94-F148 HydrophobicContact CB-CE1 4.28Å; C94-F148 WeakPolarHBondContact SG-CE1 3.21Å; I95-F148 HydrophobicContact CB-CE2 4.4Å; I95-F148 HydrophobicContact CD1-CD2 4.48Å; I95-F148 HydrophobicContact CD1-CG 4.37Å; I95-F148 HydrophobicContact CG1-CB 4.43Å; I95-F148 HydrophobicContact CG1-CD1 4.15Å; I95-F148 HydrophobicContact CG1-CD2 3.56Å; I95-F148 HydrophobicContact CG1-CE1 4.32Å; I95-F148 HydrophobicContact CG1-CE2 3.76Å; I95-F148 HydrophobicContact CG1-CG 3.77Å; I95-F148 HydrophobicContact CG1-CZ 4.13Å; C98-F148 HydrophobicContact CB-CE2 3.84Å; C98-F148 HydrophobicContact CB-CZ 3.95Å; S111-F148 CarbonylContact C-O 3.52Å; S111-F148 VanDerWaalsContact CA-O 3.26Å; S111-F148 WeakPolarHBondContact CA-O 3.42Å; S111-F148 VanDerWaalsContact CB-O 3.25Å; S111-F148 WeakPolarHBondContact CB-O 3.48Å; G112-F148 VanDerWaalsContact CA-CE1 3.41Å; G112-F148 PolarHBondContact N-O 2.82Å; G112-F148 WeakPolarHBondContact O-CD1 3.38Å; G112-F148 PolarHBondContact O-N 2.66Å; L125-F148 HydrophobicContact CD2-CZ 4.29Å; F148-L150 HydrophobicContact CD2-CD2 4.5Å
149	Q	90.5	Very high	73.1	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	138.5	179	-178	-176	-39.6	0	0	112	I70 L71 T129 E131 Y147 L151	I70-Q149 CarbonylContact C-O 3.45Å; I70-Q149 VanDerWaalsContact CA-O 3.28Å; I70-Q149 WeakPolarHBondContact CA-O 3.37Å; L71-Q149 HydrophobicContact CB-CB 4.29Å; L71-Q149 PolarHBondContact N-O 3.34Å; L71-Q149 PolarHBondContact O-N 2.92Å; T129-Q149 VanDerWaalsContact CB-CD 3.46Å; T129-Q149 HydrophobicContact CG2-CG 3.86Å; E131-Q149 VanDerWaalsContact CD-NE2 3.32Å; E131-Q149 PolarHBondContact OE1-NE2 3.48Å; E131-Q149 PolarHBondContact OE2-NE2 2.97Å; E131-Q149 PolarHBondContact OE2-OE1 3.04Å; Y147-Q149 HydrophobicContact CE1-CB 3.86Å; Y147-Q149 PolarHBondContact OH-OE1 2.88Å; Q149-L151 HydrophobicContact CG-CD2 4.05Å
150	L	86.3	Confident	70.5	Confident	16 Å²	16	63.7 Å²	63.7	8%	0.084	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	116.8	175.3	-57	-171.8	0	0	0	109.4	I70 I95 C98 L99 S110 F148 C152	I70-L150 HydrophobicContact CG1-CD2 4.11Å; I95-L150 HydrophobicContact CG2-CD2 4.22Å; C98-L150 HydrophobicContact CB-CD1 4.26Å; C98-L150 VanDerWaalsContact SG-CD1 3.5Å; L99-L150 HydrophobicContact CD2-CD1 3.73Å; L99-L150 HydrophobicContact CD2-CD2 4.3Å; L99-L150 HydrophobicContact CG-CD1 4.16Å; S110-L150 PolarHBondContact O-N 2.9Å; F148-L150 HydrophobicContact CD2-CD2 4.5Å; L150-C152 PolarHBondContact O-N 2.97Å
151	L	74.8	Confident	67.6	Low	24 Å²	24	68.2 Å²	68.2	13%	0.126	39%	0.386	C	S	.	.			trans	-88.4	40.4	172.3	-48.2	-167.7	0	0	0	111.6	I69 Q149 G153 H156	I69-L151 HydrophobicContact CB-CB 4.1Å; I69-L151 HydrophobicContact CB-CD1 3.94Å; I69-L151 HydrophobicContact CB-CG 4.16Å; I69-L151 HydrophobicContact CD1-CD1 4.46Å; I69-L151 HydrophobicContact CG2-CD1 3.46Å; I69-L151 VanDerWaalsContact CG2-CD1 3.46Å; I69-L151 HydrophobicContact CG2-CG 4.08Å; I69-L151 PolarHBondContact O-N 3.47Å; I69-L151 VanDerWaalsContact O-N 3.13Å; Q149-L151 HydrophobicContact CG-CD2 4.05Å; L151-G153 PolarHBondContact O-N 3.2Å; L151-H156 HydrophobicContact CB-CB 4.17Å
152	C	63.6	Low	65	Low	53 Å²	53	64.9 Å²	64.9	36%	0.358	38%	0.382	S	S	.	.			trans	-82.4	109.8	-176.3	-47.9	0	0	0	0	110.9	C66 L150	C66-C152 WeakPolarHBondContact CA-SG 3.21Å; C66-C152 HydrophobicContact CB-CB 4.3Å; C66-C152 WeakPolarHBondContact CB-SG 3.27Å; C66-C152 WeakPolarHBondContact SG-CB 3.39Å; C66-C152 CovalentContact SG-SG 2.02Å; C66-C152 PolarHBondContact SG-SG 2.95Å; L150-C152 PolarHBondContact O-N 2.97Å
153	G	56	Low	62.2	Low	43 Å²	43	64.8 Å²	64.8	44%	0.443	39%	0.387	S	S	.	.	S	Bend	trans	144.9	156.8	171.6	0	0	0	0	0	113.4	L151 A155 H156	L151-G153 PolarHBondContact O-N 3.2Å; G153-A155 PolarHBondContact O-N 2.66Å; G153-H156 PolarHBondContact O-N 2.84Å
154	D	47.3	Very low	59.6	Low	140 Å²	140	70.1 Å²	70.1	75%	0.749	41%	0.41	S	S	*	.	H	α-helix	trans	-58.8	-23.1	-176.1	-64.1	-40.7	0	0	0	113.6	H156	D154-H156 VanDerWaalsContact C-N 3.31Å; D154-H156 PolarHBondContact O-N 2.87Å
155	A	44.6	Very low	56.5	Low	88 Å²	88	75.8 Å²	75.8	73%	0.727	44%	0.435	S	S	*	.	H	α-helix	trans	-61.3	-33.1	179.1	0	0	0	0	0	113.7	G153	G153-A155 PolarHBondContact O-N 2.66Å
156	H	43.9	Very low	53.6	Low	44 Å²	44	84.5 Å²	84.5	20%	0.204	48%	0.478	C	S	.	.	H	α-helix	trans	-90.8	-22.4	-174.2	-102.6	-73.3	0	0	0	114.7	L151 G153 D154 N158 S159	L151-H156 HydrophobicContact CB-CB 4.17Å; G153-H156 PolarHBondContact O-N 2.84Å; D154-H156 VanDerWaalsContact C-N 3.31Å; D154-H156 PolarHBondContact O-N 2.87Å; H156-N158 PolarHBondContact O-N 2.74Å; H156-S159 PolarHBondContact ND1-OG 2.84Å; H156-S159 VanDerWaalsContact ND1-OG 3.15Å; H156-S159 PolarHBondContact O-N 3.12Å; H156-S159 VanDerWaalsContact O-N 3.09Å; H156-S159 PolarHBondContact O-OG 2.95Å
157	L	38.8	Very low	50.6	Low	124 Å²	124	87.5 Å²	87.5	65%	0.649	51%	0.508	S	S	*	.	H	α-helix	trans	-64	-24.2	178.2	-69.8	177.5	0	0	0	112.7
158	N	34.2	Very low	47.5	Very low	146 Å²	146	96.3 Å²	96.3	78%	0.781	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-7.6	176.1	-68.9	-24.2	0	0	0	114.1	H156	H156-N158 PolarHBondContact O-N 2.74Å
159	S	36.4	Very low	44.9	Very low	53 Å²	53	101.8 Å²	101.8	37%	0.371	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-86.2	-15.6	-178.8	79.3	0	0	0	0	113.9	H156 S161 A162	H156-S159 PolarHBondContact ND1-OG 2.84Å; H156-S159 VanDerWaalsContact ND1-OG 3.15Å; H156-S159 PolarHBondContact O-N 3.12Å; H156-S159 VanDerWaalsContact O-N 3.09Å; H156-S159 PolarHBondContact O-OG 2.95Å; S159-S161 PolarHBondContact O-N 2.67Å; S159-S161 VanDerWaalsContact O-N 3.12Å; S159-A162 PolarHBondContact O-N 3.18Å
160	H	36.7	Very low	42.1	Very low	129 Å²	129	110.4 Å²	110.4	60%	0.597	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-74.9	9.3	178.8	-78.3	-68	0	0	0	115
161	S	30.5	Very low	39.7	Very low	118 Å²	118	115.1 Å²	115.1	83%	0.825	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-120.3	43.3	167.5	-167.8	0	0	0	0	112.5	S159	S159-S161 PolarHBondContact O-N 2.67Å; S159-S161 VanDerWaalsContact O-N 3.12Å
162	A	32.4	Very low	38	Very low	67 Å²	67	120.1 Å²	120.1	55%	0.554	68%	0.683	S	S	*	*			trans	-121.4	110	158.9	0	0	0	0	0	109.5	S159 H164	S159-A162 PolarHBondContact O-N 3.18Å; A162-H164 PolarHBondContact O-N 2.75Å
163	N	30.3	Very low	36.9	Very low	173 Å²	173	121 Å²	121	93%	0.925	70%	0.701	S	S	*	*			trans	-68.2	76.8	165.6	-71.5	-30.6	0	0	0	108.5	E165	N163-E165 VanDerWaalsContact C-N 3.31Å; N163-E165 PolarHBondContact O-N 2.92Å
164	H	35.6	Very low	36.1	Very low	168 Å²	168	124.1 Å²	124.1	78%	0.778	71%	0.707	S	S	*	*			trans	-82.7	87.5	172.8	-138	-59.9	0	0	0	108.9	A162 M166	A162-H164 PolarHBondContact O-N 2.75Å; H164-M166 PolarHBondContact O-N 3.29Å
165	E	29.8	Very low	36.3	Very low	175 Å²	175	121.6 Å²	121.6	82%	0.818	71%	0.706	S	S	*	*			trans	-48.6	129.7	169	-163.8	168	178.6	0	0	109.2	N163 A167	N163-E165 VanDerWaalsContact C-N 3.31Å; N163-E165 PolarHBondContact O-N 2.92Å; E165-A167 PolarHBondContact O-N 2.97Å
166	M	34	Very low	36.5	Very low	182 Å²	182	124.5 Å²	124.5	90%	0.897	70%	0.704	S	S	*	*			trans	-72.3	94.7	-171.8	-64.1	169.4	92.4	0	0	109.3	H164 K168	H164-M166 PolarHBondContact O-N 3.29Å; M166-K168 VanDerWaalsContact C-N 3.26Å; M166-K168 PolarHBondContact O-N 3.26Å
167	A	29.1	Very low	36.7	Very low	94 Å²	94	128.4 Å²	128.4	78%	0.777	72%	0.722	S	S	*	*			trans	-63.4	91.3	166.4	0	0	0	0	0	108.8	E165 P169	E165-A167 PolarHBondContact O-N 2.97Å; A167-P169 WeakPolarHBondContact O-CD 3.23Å
168	K	30.4	Very low	37.5	Very low	186 Å²	186	127.3 Å²	127.3	81%	0.809	72%	0.721	S	S	*	*			trans	-58.9	119.9	174	-177.2	-178.2	-178.3	-176.9	0	108.2	M166 E170	M166-K168 VanDerWaalsContact C-N 3.26Å; M166-K168 PolarHBondContact O-N 3.26Å; K168-E170 PolarHBondContact O-N 2.87Å
169	P	38.4	Very low	38.5	Very low	114 Å²	114	125.6 Å²	125.6	74%	0.74	71%	0.708	S	S	*	*			trans	-64	125.7	176.2	25.1	-32	0	0	0	109.3	A167 S171	A167-P169 WeakPolarHBondContact O-CD 3.23Å; P169-S171 PolarHBondContact O-N 3.01Å
170	E	31.2	Very low	39.8	Very low	181 Å²	181	128.7 Å²	128.7	85%	0.846	72%	0.715	S	S	*	*			trans	-73.5	113.3	175.4	-67.1	-169.7	144.8	0	0	109.6	K168 N172	K168-E170 PolarHBondContact O-N 2.87Å; E170-N172 PolarHBondContact O-N 2.93Å
171	S	35.7	Very low	41.3	Very low	116 Å²	116	125 Å²	125	81%	0.811	70%	0.703	S	S	*	*			trans	-66.4	95.3	174.9	160.9	0	0	0	0	111.1	P169	P169-S171 PolarHBondContact O-N 3.01Å
172	N	39.7	Very low	43.3	Very low	129 Å²	129	122.5 Å²	122.5	69%	0.69	69%	0.686	S	S	*	*			trans	-125.7	82.4	158.2	-93.3	-30.7	0	0	0	108.7	E170 N174	E170-N172 PolarHBondContact O-N 2.93Å; N172-N174 PolarHBondContact O-N 3.38Å
173	G	40.9	Very low	45.5	Very low	70 Å²	70	124.3 Å²	124.3	72%	0.722	68%	0.683	S	S	*	*			trans	-60	104	-176.7	0	0	0	0	0	112.3
174	N	38.9	Very low	47.7	Very low	110 Å²	110	121 Å²	121	59%	0.588	66%	0.657	S	S	*	*			trans	-115.5	145.6	171.5	-78.7	-41	0	0	0	109.1	N172 H176 E177	N172-N174 PolarHBondContact O-N 3.38Å; N174-H176 PolarHBondContact O-N 3.45Å; N174-E177 WeakPolarHBondContact O-CB 3.23Å; N174-E177 PolarHBondContact O-N 3.43Å
175	A	51.4	Low	49.7	Very low	86 Å²	86	113.9 Å²	113.9	71%	0.711	63%	0.625	S	S	*	*	H	α-helix	trans	-54.1	-26	-174.2	0	0	0	0	0	114.8	E177 V178 E179	A175-E177 PolarHBondContact O-N 3.23Å; A175-V178 PolarHBondContact O-N 3.39Å; A175-E179 PolarHBondContact O-N 3.32Å
176	H	47.6	Very low	52	Low	150 Å²	150	108.4 Å²	108.4	69%	0.694	61%	0.606	S	S	*	*	H	α-helix	trans	-58.2	-27.1	173.2	-75.5	-63.7	0	0	0	114.7	N174 K180	N174-H176 PolarHBondContact O-N 3.45Å; H176-K180 VanDerWaalsContact O-CB 3.32Å; H176-K180 WeakPolarHBondContact O-CB 3.39Å; H176-K180 PolarHBondContact O-N 2.72Å
177	E	48.7	Very low	54.2	Low	125 Å²	125	104.3 Å²	104.3	58%	0.584	59%	0.588	S	S	*	*	H	α-helix	trans	-75.9	-37.7	179.6	-170.3	163.8	-147.5	0	0	111.8	N174 A175 K180 S181	N174-E177 WeakPolarHBondContact O-CB 3.23Å; N174-E177 PolarHBondContact O-N 3.43Å; A175-E177 PolarHBondContact O-N 3.23Å; E177-K180 PolarHBondContact O-N 3.47Å; E177-S181 WeakPolarHBondContact O-CB 3.36Å; E177-S181 PolarHBondContact O-N 3.33Å
178	V	55.7	Low	56.4	Low	102 Å²	102	100 Å²	100	62%	0.618	55%	0.552	S	S	*	*	H	α-helix	trans	-63.2	-49.2	175.6	-177	0	0	0	0	110.5	A175 K180 S181 S182	A175-V178 PolarHBondContact O-N 3.39Å; V178-K180 VanDerWaalsContact C-N 3.33Å; V178-K180 PolarHBondContact O-N 3.26Å; V178-S181 WeakPolarHBondContact O-CB 3.49Å; V178-S181 PolarHBondContact O-N 3.05Å; V178-S182 PolarHBondContact O-N 3.14Å; V178-S182 PolarHBondContact O-OG 3Å
179	E	56.3	Low	58.7	Low	109 Å²	109	91.4 Å²	91.4	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-59.3	-43.8	178.5	-171.3	-174.4	175.2	0	0	111.9	A175 S181 S182 Q183	A175-E179 PolarHBondContact O-N 3.32Å; E179-S181 VanDerWaalsContact C-N 3.33Å; E179-S181 PolarHBondContact O-N 3.09Å; E179-S182 PolarHBondContact O-N 3.32Å; E179-Q183 WeakPolarHBondContact O-CG 3.13Å; E179-Q183 PolarHBondContact O-N 3.2Å; E179-Q183 PolarHBondContact OE1-NE2 3.42Å
180	K	62.5	Low	60.5	Low	118 Å²	118	90.8 Å²	90.8	51%	0.513	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-39.2	178.1	-168.8	178.2	-176.2	-177.7	0	111.9	H176 E177 V178 R184	H176-K180 VanDerWaalsContact O-CB 3.32Å; H176-K180 WeakPolarHBondContact O-CB 3.39Å; H176-K180 PolarHBondContact O-N 2.72Å; E177-K180 PolarHBondContact O-N 3.47Å; V178-K180 VanDerWaalsContact C-N 3.33Å; V178-K180 PolarHBondContact O-N 3.26Å; K180-R184 VanDerWaalsContact O-CD 3.27Å; K180-R184 WeakPolarHBondContact O-CD 3.42Å; K180-R184 VanDerWaalsContact O-CG 3.29Å; K180-R184 WeakPolarHBondContact O-CG 3.31Å; K180-R184 PolarHBondContact O-N 2.99Å; K180-R184 VanDerWaalsContact O-N 3.14Å
181	S	69	Low	62.4	Low	52 Å²	52	85.6 Å²	85.6	36%	0.364	48%	0.482	S	S	.	.	H	α-helix	trans	-63.3	-48.6	174.3	-175.4	0	0	0	0	111.7	E177 V178 E179 Q183 R184 I185	E177-S181 WeakPolarHBondContact O-CB 3.36Å; E177-S181 PolarHBondContact O-N 3.33Å; V178-S181 WeakPolarHBondContact O-CB 3.49Å; V178-S181 PolarHBondContact O-N 3.05Å; E179-S181 VanDerWaalsContact C-N 3.33Å; E179-S181 PolarHBondContact O-N 3.09Å; S181-Q183 VanDerWaalsContact C-N 3.32Å; S181-Q183 PolarHBondContact O-N 3.2Å; S181-R184 WeakPolarHBondContact O-CB 3.44Å; S181-R184 PolarHBondContact O-N 2.99Å; S181-R184 VanDerWaalsContact O-N 3.09Å; S181-I185 WeakPolarHBondContact O-CG1 3.41Å; S181-I185 PolarHBondContact O-N 3.46Å
182	S	72.8	Confident	64.4	Low	65 Å²	65	80.3 Å²	80.3	46%	0.455	45%	0.445	S	S	.	.	H	α-helix	trans	-58.9	-39.7	177.4	-58.3	0	0	0	0	113	V178 E179 S186	V178-S182 PolarHBondContact O-N 3.14Å; V178-S182 PolarHBondContact O-OG 3Å; E179-S182 PolarHBondContact O-N 3.32Å; S182-S186 WeakPolarHBondContact O-CB 3.4Å; S182-S186 PolarHBondContact O-N 3.29Å; S182-S186 PolarHBondContact O-OG 3.18Å
183	Q	78.2	Confident	66.1	Low	106 Å²	106	78.4 Å²	78.4	50%	0.495	43%	0.431	S	S	.	.	H	α-helix	trans	-65.9	-38.4	175.5	-70.1	175.5	10.6	0	0	112.4	E179 S181 S186 N187	E179-Q183 WeakPolarHBondContact O-CG 3.13Å; E179-Q183 PolarHBondContact O-N 3.2Å; E179-Q183 PolarHBondContact OE1-NE2 3.42Å; S181-Q183 VanDerWaalsContact C-N 3.32Å; S181-Q183 PolarHBondContact O-N 3.2Å; Q183-S186 WeakPolarHBondContact O-CB 3.27Å; Q183-S186 PolarHBondContact O-N 3.38Å; Q183-N187 VanDerWaalsContact O-CG 3.28Å; Q183-N187 PolarHBondContact O-N 2.62Å
184	R	75.3	Confident	67.8	Low	102 Å²	102	82.4 Å²	82.4	39%	0.385	43%	0.431	S	S	.	.	H	α-helix	trans	-67.6	-45.3	178.1	-76.3	160	162.7	-139.4	-4.2	112.3	D135 L136 K180 S181 S186 N187 A188	D135-R184 VanDerWaalsContact CG-NH1 3.31Å; D135-R184 WeakPolarHBondContact OD2-CD 3.4Å; D135-R184 IonicContact OD2-CZ 3.11Å; D135-R184 IonicContact OD2-NE 2.83Å; D135-R184 PolarHBondContact OD2-NE 3.46Å; D135-R184 IonicContact OD2-NH1 2.88Å; D135-R184 PolarHBondContact OD2-NH1 3.15Å; L136-R184 HydrophobicContact CD2-CB 4.28Å; K180-R184 VanDerWaalsContact O-CD 3.27Å; K180-R184 WeakPolarHBondContact O-CD 3.42Å; K180-R184 VanDerWaalsContact O-CG 3.29Å; K180-R184 WeakPolarHBondContact O-CG 3.31Å; K180-R184 PolarHBondContact O-N 2.99Å; K180-R184 VanDerWaalsContact O-N 3.14Å; S181-R184 WeakPolarHBondContact O-CB 3.44Å; S181-R184 PolarHBondContact O-N 2.99Å; S181-R184 VanDerWaalsContact O-N 3.09Å; R184-S186 VanDerWaalsContact C-N 3.32Å; R184-S186 PolarHBondContact O-N 3.45Å; R184-N187 PolarHBondContact O-N 2.67Å; R184-A188 PolarHBondContact O-N 3.4Å
185	I	78.7	Confident	69.5	Low	19 Å²	19	80.7 Å²	80.7	10%	0.097	42%	0.421	C	S	.	.	H	α-helix	trans	-58.1	-47.4	172.5	-66.2	161.1	0	0	0	109.9	I79 L136 S181 N187 A188 V189 F221	I79-I185 HydrophobicContact CD1-CD1 4.34Å; I79-I185 HydrophobicContact CD1-CG1 4.22Å; I79-I185 HydrophobicContact CG2-CG2 4.14Å; L136-I185 HydrophobicContact CD2-CG1 3.88Å; S181-I185 WeakPolarHBondContact O-CG1 3.41Å; S181-I185 PolarHBondContact O-N 3.46Å; I185-N187 VanDerWaalsContact C-N 3.33Å; I185-N187 PolarHBondContact O-N 2.87Å; I185-A188 PolarHBondContact O-N 2.7Å; I185-V189 HydrophobicContact CG2-CG2 4.28Å; I185-V189 WeakPolarHBondContact O-CB 3.29Å; I185-V189 VanDerWaalsContact O-CG2 3.22Å; I185-V189 WeakPolarHBondContact O-CG2 3.46Å; I185-V189 PolarHBondContact O-N 3.08Å; I185-F221 HydrophobicContact CD1-CE1 4.01Å
186	S	78.4	Confident	70.7	Confident	61 Å²	61	77.1 Å²	77.1	43%	0.427	39%	0.392	S	S	.	.	H	α-helix	trans	-56.6	-44.5	177.6	-59	0	0	0	0	112.4	S182 Q183 R184 V189 I190	S182-S186 WeakPolarHBondContact O-CB 3.4Å; S182-S186 PolarHBondContact O-N 3.29Å; S182-S186 PolarHBondContact O-OG 3.18Å; Q183-S186 WeakPolarHBondContact O-CB 3.27Å; Q183-S186 PolarHBondContact O-N 3.38Å; R184-S186 VanDerWaalsContact C-N 3.32Å; R184-S186 PolarHBondContact O-N 3.45Å; S186-V189 PolarHBondContact O-N 2.9Å; S186-I190 WeakPolarHBondContact O-CD1 3.48Å; S186-I190 VanDerWaalsContact O-CG1 3.27Å; S186-I190 WeakPolarHBondContact O-CG1 3.45Å; S186-I190 PolarHBondContact O-N 3.47Å
187	N	79.2	Confident	72.4	Confident	96 Å²	96	77 Å²	77	51%	0.513	40%	0.396	S	S	.	.	H	α-helix	trans	-66	-42.9	177.5	-70.9	-14.1	0	0	0	112.5	Q183 R184 I185 V189 I190 I191	Q183-N187 VanDerWaalsContact O-CG 3.28Å; Q183-N187 PolarHBondContact O-N 2.62Å; R184-N187 PolarHBondContact O-N 2.67Å; I185-N187 VanDerWaalsContact C-N 3.33Å; I185-N187 PolarHBondContact O-N 2.87Å; N187-V189 VanDerWaalsContact C-N 3.32Å; N187-V189 PolarHBondContact O-N 2.02Å; N187-I190 WeakPolarHBondContact O-CB 3.5Å; N187-I190 PolarHBondContact O-N 3.45Å; N187-I191 WeakPolarHBondContact O-CG1 3.3Å; N187-I191 PolarHBondContact O-N 3.44Å
188	A	75.6	Confident	74.2	Confident	2 Å²	2	71.9 Å²	71.9	2%	0.017	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-42.3	176.3	0	0	0	0	0	112.1	Y81 L136 R184 I185 I190 I191 A192	Y81-A188 HydrophobicContact CE2-CB 3.86Å; L136-A188 HydrophobicContact CD1-CB 3.43Å; L136-A188 VanDerWaalsContact CD1-CB 3.43Å; L136-A188 HydrophobicContact CD2-CB 4.31Å; R184-A188 PolarHBondContact O-N 3.4Å; I185-A188 PolarHBondContact O-N 2.7Å; A188-I190 VanDerWaalsContact C-N 3.34Å; A188-I190 PolarHBondContact O-N 2.81Å; A188-I191 PolarHBondContact O-N 2.78Å; A188-A192 VanDerWaalsContact O-CB 3.28Å; A188-A192 WeakPolarHBondContact O-CB 3.17Å; A188-A192 PolarHBondContact O-N 2.88Å
189	V	77.8	Confident	75.9	Confident	6 Å²	6	69.5 Å²	69.5	4%	0.036	36%	0.356	C	S	.	.	H	α-helix	trans	-66.1	-35.1	176.4	171.2	0	0	0	0	111.5	I185 S186 N187 K193 V217 C218	I185-V189 HydrophobicContact CG2-CG2 4.28Å; I185-V189 WeakPolarHBondContact O-CB 3.29Å; I185-V189 VanDerWaalsContact O-CG2 3.22Å; I185-V189 WeakPolarHBondContact O-CG2 3.46Å; I185-V189 PolarHBondContact O-N 3.08Å; S186-V189 PolarHBondContact O-N 2.9Å; N187-V189 VanDerWaalsContact C-N 3.32Å; N187-V189 PolarHBondContact O-N 2.02Å; V189-K193 HydrophobicContact CG1-CD 4.11Å; V189-K193 VanDerWaalsContact O-CB 3.27Å; V189-K193 WeakPolarHBondContact O-CB 3.35Å; V189-K193 WeakPolarHBondContact O-CD 3.26Å; V189-K193 WeakPolarHBondContact O-CG 3.25Å; V189-K193 PolarHBondContact O-N 2.77Å; V189-V217 HydrophobicContact CG1-CG1 4.38Å; V189-C218 WeakPolarHBondContact CG2-O 3.37Å
190	I	76.9	Confident	77.4	Confident	101 Å²	101	64.5 Å²	64.5	52%	0.518	33%	0.333	S	S	.	.	H	α-helix	trans	-64.6	-49.9	172.4	-70.9	161.9	0	0	0	110.7	S186 N187 A188 A192 K193 E194	S186-I190 WeakPolarHBondContact O-CD1 3.48Å; S186-I190 VanDerWaalsContact O-CG1 3.27Å; S186-I190 WeakPolarHBondContact O-CG1 3.45Å; S186-I190 PolarHBondContact O-N 3.47Å; N187-I190 WeakPolarHBondContact O-CB 3.5Å; N187-I190 PolarHBondContact O-N 3.45Å; A188-I190 VanDerWaalsContact C-N 3.34Å; A188-I190 PolarHBondContact O-N 2.81Å; I190-A192 PolarHBondContact O-N 3.32Å; I190-K193 WeakPolarHBondContact O-CB 3.5Å; I190-K193 PolarHBondContact O-N 3.01Å; I190-E194 PolarHBondContact O-N 2.83Å
191	I	72.3	Confident	78.6	Confident	73 Å²	73	61.3 Å²	61.3	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-61.3	-45.3	179.3	-65.2	163.3	0	0	0	110.6	Y81 N187 A188 K193 E194 I195	Y81-I191 HydrophobicContact CE1-CB 4.32Å; Y81-I191 HydrophobicContact CE1-CG2 3.9Å; N187-I191 WeakPolarHBondContact O-CG1 3.3Å; N187-I191 PolarHBondContact O-N 3.44Å; A188-I191 PolarHBondContact O-N 2.78Å; I191-K193 PolarHBondContact O-N 2.99Å; I191-E194 WeakPolarHBondContact O-CB 2.95Å; I191-E194 PolarHBondContact O-N 3.17Å; I191-E194 VanDerWaalsContact O-N 3.12Å; I191-I195 HydrophobicContact CG2-CD1 3.68Å; I191-I195 HydrophobicContact CG2-CG1 4.36Å; I191-I195 WeakPolarHBondContact O-CG1 3.04Å; I191-I195 PolarHBondContact O-N 2.82Å
192	A	76.1	Confident	79.5	Confident	5 Å²	5	61.6 Å²	61.6	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-66.2	-35.8	177.6	0	0	0	0	0	112.6	G80 A188 I190 E194 I195 A196 V217	G80-A192 WeakPolarHBondContact O-CB 3.34Å; A188-A192 VanDerWaalsContact O-CB 3.28Å; A188-A192 WeakPolarHBondContact O-CB 3.17Å; A188-A192 PolarHBondContact O-N 2.88Å; I190-A192 PolarHBondContact O-N 3.32Å; A192-E194 VanDerWaalsContact C-N 3.3Å; A192-E194 PolarHBondContact O-N 3.2Å; A192-I195 PolarHBondContact O-N 3.34Å; A192-A196 WeakPolarHBondContact O-CB 3.32Å; A192-A196 PolarHBondContact O-N 3.48Å; A192-V217 HydrophobicContact CB-CG1 3.68Å
193	K	75.9	Confident	80.2	Confident	89 Å²	89	59 Å²	59	39%	0.387	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-37.5	170	-79.8	169.5	-179.5	175.1	0	111.7	V189 I190 I191 N197 G198 V217	V189-K193 HydrophobicContact CG1-CD 4.11Å; V189-K193 VanDerWaalsContact O-CB 3.27Å; V189-K193 WeakPolarHBondContact O-CB 3.35Å; V189-K193 WeakPolarHBondContact O-CD 3.26Å; V189-K193 WeakPolarHBondContact O-CG 3.25Å; V189-K193 PolarHBondContact O-N 2.77Å; I190-K193 WeakPolarHBondContact O-CB 3.5Å; I190-K193 PolarHBondContact O-N 3.01Å; I191-K193 PolarHBondContact O-N 2.99Å; K193-N197 CarbonylContact O-C 3.59Å; K193-N197 WeakPolarHBondContact O-CA 3.39Å; K193-N197 PolarHBondContact O-N 3.04Å; K193-G198 PolarHBondContact O-N 1.91Å; K193-V217 WeakPolarHBondContact CE-O 3.4Å; K193-V217 HydrophobicContact CG-CB 3.82Å; K193-V217 HydrophobicContact CG-CG1 3.92Å
194	E	77.5	Confident	80.6	Confident	153 Å²	153	56.9 Å²	56.9	72%	0.715	29%	0.291	S	S	*	.	H	α-helix	trans	-68.9	-51.8	175.7	-169.9	172.4	-177.3	0	0	111.4	I190 I191 A192 A196 N197	I190-E194 PolarHBondContact O-N 2.83Å; I191-E194 WeakPolarHBondContact O-CB 2.95Å; I191-E194 PolarHBondContact O-N 3.17Å; I191-E194 VanDerWaalsContact O-N 3.12Å; A192-E194 VanDerWaalsContact C-N 3.3Å; A192-E194 PolarHBondContact O-N 3.2Å; E194-A196 PolarHBondContact O-N 2.8Å; E194-N197 PolarHBondContact O-N 2.8Å
195	I	74.6	Confident	81.3	Confident	74 Å²	74	55 Å²	55	38%	0.379	29%	0.293	S	S	.	.	H	α-helix	trans	-61.2	-31.8	179.9	-66.4	170.8	0	0	0	112.3	R83 I191 A192	R83-I195 PolarHBondContact NH1-O 2.82Å; I191-I195 HydrophobicContact CG2-CD1 3.68Å; I191-I195 HydrophobicContact CG2-CG1 4.36Å; I191-I195 WeakPolarHBondContact O-CG1 3.04Å; I191-I195 PolarHBondContact O-N 2.82Å; A192-I195 PolarHBondContact O-N 3.34Å
196	A	76.6	Confident	81.5	Confident	12 Å²	12	55.9 Å²	55.9	10%	0.099	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	8.2	-175.5	0	0	0	0	0	114.3	A192 E194 G198 W199 V217	A192-A196 WeakPolarHBondContact O-CB 3.32Å; A192-A196 PolarHBondContact O-N 3.48Å; E194-A196 PolarHBondContact O-N 2.8Å; A196-G198 PolarHBondContact O-N 2.85Å; A196-G198 VanDerWaalsContact O-N 3.13Å; A196-W199 WeakPolarHBondContact CB-O 3.21Å; A196-W199 PolarHBondContact O-N 3.14Å; A196-V217 HydrophobicContact CB-CG2 4.06Å
197	N	82.9	Confident	81.6	Confident	148 Å²	148	59.9 Å²	59.9	79%	0.791	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	37.6	-172	-67.3	1.4	0	0	0	112.9	K193 E194 W199	K193-N197 CarbonylContact O-C 3.59Å; K193-N197 WeakPolarHBondContact O-CA 3.39Å; K193-N197 PolarHBondContact O-N 3.04Å; E194-N197 PolarHBondContact O-N 2.8Å; N197-W199 PolarHBondContact O-N 3.29Å
198	G	85.8	Confident	81.7	Confident	16 Å²	16	58.8 Å²	58.8	17%	0.165	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	-6.9	179.6	0	0	0	0	0	116.3	K193 A196 V217	K193-G198 PolarHBondContact O-N 1.91Å; A196-G198 PolarHBondContact O-N 2.85Å; A196-G198 VanDerWaalsContact O-N 3.13Å; G198-V217 PolarHBondContact O-N 2.98Å
199	W	91.1	Very high	82.2	Confident	53 Å²	53	61.5 Å²	61.5	20%	0.201	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-140.4	144.3	-171.3	-70.4	88.2	0	0	0	112.5	A196 N197 R214 Y215 Q216 E229	A196-W199 WeakPolarHBondContact CB-O 3.21Å; A196-W199 PolarHBondContact O-N 3.14Å; N197-W199 PolarHBondContact O-N 3.29Å; W199-R214 HydrophobicContact CE3-CB 4.47Å; W199-R214 HydrophobicContact CE3-CG 3.79Å; W199-R214 HydrophobicContact CZ3-CG 4.31Å; W199-Y215 CarbonylContact C-O 3.59Å; W199-Y215 WeakPolarHBondContact CA-O 3.26Å; W199-Q216 HydrophobicContact CD2-CB 4.22Å; W199-Q216 HydrophobicContact CD2-CG 4.45Å; W199-Q216 HydrophobicContact CE3-CB 3.99Å; W199-Q216 VanDerWaalsContact CE3-N 3.27Å; W199-Q216 HydrophobicContact CH2-CB 3.77Å; W199-Q216 HydrophobicContact CH2-CG 4.36Å; W199-Q216 HydrophobicContact CZ2-CB 4.02Å; W199-Q216 HydrophobicContact CZ2-CG 4.11Å; W199-Q216 HydrophobicContact CZ3-CB 3.76Å; W199-Q216 VanDerWaalsContact CZ3-N 3.31Å; W199-E229 HydrophobicContact CH2-CG 3.71Å; W199-E229 HydrophobicContact CZ2-CG 4.41Å; W199-E229 HydrophobicContact CZ3-CB 4.25Å; W199-E229 HydrophobicContact CZ3-CG 3.87Å
200	T	88	Confident	82.7	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.018	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-57.1	154.1	165.5	69.7	0	0	0	0	110.2	R214 Y215 I223	T200-R214 WeakPolarHBondContact O-CB 3.06Å; T200-R214 WeakPolarHBondContact OG1-CA 3.23Å; T200-Y215 PolarHBondContact N-O 2.66Å; T200-Y215 PolarHBondContact OG1-N 2.7Å; T200-I223 HydrophobicContact CG2-CD1 3.47Å; T200-I223 VanDerWaalsContact CG2-CD1 3.47Å; T200-I223 HydrophobicContact CG2-CG1 4.43Å
201	I	88	Confident	83.4	Confident	52 Å²	52	59.7 Å²	59.7	27%	0.267	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-59	144.8	164.2	-59.3	176.1	0	0	0	107.6	R83 Y105 Y107 S203	R83-I201 PolarHBondContact O-N 3.49Å; Y105-I201 WeakPolarHBondContact O-CD1 3.41Å; Y107-I201 HydrophobicContact CD1-CD1 3.57Å; Y107-I201 HydrophobicContact CE1-CD1 3.78Å; I201-S203 PolarHBondContact O-N 2.95Å
202	W	88.8	Confident	84.4	Confident	57 Å²	57	60 Å²	60	22%	0.216	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-52.7	134.7	172.8	-74.3	104.8	0	0	0	110.8	R212 K213 R214 E229 E231	W202-R212 HydrophobicContact CD2-CG 4.23Å; W202-R212 HydrophobicContact CE3-CB 4.13Å; W202-R212 HydrophobicContact CE3-CG 3.67Å; W202-R212 HydrophobicContact CZ3-CG 4.14Å; W202-R212 WeakPolarHBondContact CZ3-O 3.28Å; W202-K213 VanDerWaalsContact CE3-C 3.47Å; W202-R214 HydrophobicContact CD2-CB 4.14Å; W202-R214 HydrophobicContact CD2-CG 3.94Å; W202-R214 VanDerWaalsContact CE2-CD 3.5Å; W202-R214 HydrophobicContact CE3-CB 3.97Å; W202-R214 HydrophobicContact CE3-CG 3.84Å; W202-R214 HydrophobicContact CH2-CG 3.86Å; W202-R214 HydrophobicContact CZ2-CG 3.94Å; W202-R214 HydrophobicContact CZ3-CB 4.34Å; W202-R214 HydrophobicContact CZ3-CG 3.8Å; W202-E229 HydrophobicContact CH2-CB 3.88Å; W202-E229 HydrophobicContact CZ3-CB 4.44Å; W202-E231 HydrophobicContact CH2-CB 3.83Å; W202-E231 HydrophobicContact CZ2-CB 4.41Å; W202-E231 HydrophobicContact CZ3-CB 4.05Å
203	S	86.8	Confident	85.2	Confident	11 Å²	11	61.3 Å²	61.3	8%	0.077	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-56.3	158.1	167.1	74.7	0	0	0	0	110.4	V85 I201 R212 K213	V85-S203 VanDerWaalsContact O-CB 3.25Å; V85-S203 WeakPolarHBondContact O-CB 3.26Å; I201-S203 PolarHBondContact O-N 2.95Å; S203-R212 WeakPolarHBondContact O-CB 3.37Å; S203-R212 WeakPolarHBondContact OG-CA 3.37Å; S203-K213 PolarHBondContact N-O 3.37Å; S203-K213 PolarHBondContact OG-N 3.19Å
204	P	87.3	Confident	86	Confident	61 Å²	61	59.8 Å²	59.8	40%	0.396	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-51.9	160.1	156	-22.9	34.3	0	0	0	111.2	V86 Y105 E206	V86-P204 HydrophobicContact CG1-CG 4.19Å; Y105-P204 HydrophobicContact CE1-CG 4.12Å; P204-E206 PolarHBondContact O-N 2.91Å
205	C	88.7	Confident	86.7	Confident	62 Å²	62	53 Å²	53	42%	0.419	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-66.3	122.8	172.7	-54.4	0	0	0	0	109.8	T207 C233	C205-T207 PolarHBondContact O-N 2.77Å; C205-C233 HydrophobicContact CB-CB 3.88Å; C205-C233 WeakPolarHBondContact CB-SG 3.17Å; C205-C233 WeakPolarHBondContact SG-CB 3.38Å; C205-C233 CovalentContact SG-SG 2.03Å; C205-C233 PolarHBondContact SG-SG 2.92Å
206	E	84	Confident	87.6	Confident	38 Å²	38	53.1 Å²	53.1	18%	0.178	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-65.8	127.5	174.8	-172.4	-168.9	144.4	0	0	109.4	P204 G208 T209 N210 I211 K213	P204-E206 PolarHBondContact O-N 2.91Å; E206-G208 VanDerWaalsContact C-N 3.29Å; E206-G208 PolarHBondContact O-N 2.72Å; E206-T209 WeakPolarHBondContact CB-OG1 3.19Å; E206-T209 WeakPolarHBondContact OE1-CG2 3.15Å; E206-T209 PolarHBondContact OE1-OG1 3.47Å; E206-T209 PolarHBondContact OE2-OG1 2.71Å; E206-N210 VanDerWaalsContact O-CA 3.29Å; E206-N210 WeakPolarHBondContact O-CA 3.11Å; E206-N210 PolarHBondContact O-N 3.26Å; E206-I211 WeakPolarHBondContact CB-O 3.46Å; E206-I211 PolarHBondContact N-O 3.39Å; E206-K213 IonicContact OE2-NZ 3.8Å; E206-K213 PolarHBondContact OE2-NZ 3.13Å
207	T	79.5	Confident	88.2	Confident	146 Å²	146	52.6 Å²	52.6	90%	0.896	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-22.8	-169.8	52.6	0	0	0	0	114.1	C205	C205-T207 PolarHBondContact O-N 2.77Å
208	G	81.6	Confident	88.5	Confident	72 Å²	72	46.5 Å²	46.5	74%	0.742	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-39.4	178.1	0	0	0	0	0	114.3	E206	E206-G208 VanDerWaalsContact C-N 3.29Å; E206-G208 PolarHBondContact O-N 2.72Å
209	T	86.2	Confident	88.5	Confident	60 Å²	60	50.5 Å²	50.5	37%	0.368	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-16.3	-174	61.7	0	0	0	0	113.9	E206 I211	E206-T209 WeakPolarHBondContact CB-OG1 3.19Å; E206-T209 WeakPolarHBondContact OE1-CG2 3.15Å; E206-T209 PolarHBondContact OE1-OG1 3.47Å; E206-T209 PolarHBondContact OE2-OG1 2.71Å; T209-I211 PolarHBondContact O-N 3.23Å; T209-I211 PolarHBondContact OG1-N 2.66Å
210	N	89.5	Confident	88.2	Confident	42 Å²	42	52.3 Å²	52.3	23%	0.225	29%	0.29	C	S	.	.			trans	55.3	28.3	-168.8	-154.7	17.6	0	0	0	114	E206 C233 D236	E206-N210 VanDerWaalsContact O-CA 3.29Å; E206-N210 WeakPolarHBondContact O-CA 3.11Å; E206-N210 PolarHBondContact O-N 3.26Å; N210-C233 PolarHBondContact O-N 2.98Å; N210-C233 WeakPolarHBondContact OD1-CB 3.43Å; N210-D236 WeakPolarHBondContact ND2-CB 3.45Å; N210-D236 PolarHBondContact ND2-OD2 3.25Å
211	I	90.9	Very high	88	Confident	27 Å²	27	58.1 Å²	58.1	14%	0.138	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	144.3	177	-66.5	171	0	0	0	108.8	E206 T209 K213 M230 E231 Y232	E206-I211 WeakPolarHBondContact CB-O 3.46Å; E206-I211 PolarHBondContact N-O 3.39Å; T209-I211 PolarHBondContact O-N 3.23Å; T209-I211 PolarHBondContact OG1-N 2.66Å; I211-K213 HydrophobicContact CG2-CG 3.95Å; I211-M230 HydrophobicContact CG2-CB 3.92Å; I211-M230 HydrophobicContact CG2-CG 4.44Å; I211-E231 WeakPolarHBondContact CA-O 2.91Å; I211-Y232 HydrophobicContact CD1-CE1 3.97Å; I211-Y232 HydrophobicContact CG1-CD1 3.81Å; I211-Y232 HydrophobicContact CG1-CE1 3.75Å
212	R	92.1	Very high	87.9	Confident	79 Å²	79	56.2 Å²	56.2	30%	0.298	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	148.9	161.5	58.6	179.7	-170.6	179.3	1.9	109.8	W202 S203 M230 E231	W202-R212 HydrophobicContact CD2-CG 4.23Å; W202-R212 HydrophobicContact CE3-CB 4.13Å; W202-R212 HydrophobicContact CE3-CG 3.67Å; W202-R212 HydrophobicContact CZ3-CG 4.14Å; W202-R212 WeakPolarHBondContact CZ3-O 3.28Å; S203-R212 WeakPolarHBondContact O-CB 3.37Å; S203-R212 WeakPolarHBondContact OG-CA 3.37Å; R212-M230 WeakPolarHBondContact O-CA 3.14Å; R212-E231 HydrophobicContact CG-CB 4.15Å; R212-E231 WeakPolarHBondContact CG-O 3.41Å; R212-E231 IonicContact CZ-OE2 3.86Å; R212-E231 PolarHBondContact N-O 3.39Å; R212-E231 IonicContact NE-OE2 2.92Å; R212-E231 PolarHBondContact NE-OE2 3.12Å; R212-E231 IonicContact NH2-OE1 3.59Å; R212-E231 IonicContact NH2-OE2 3.04Å; R212-E231 PolarHBondContact NH2-OE2 3.26Å; R212-E231 PolarHBondContact O-N 2.66Å
213	K	93	Very high	87.9	Confident	32 Å²	32	54 Å²	54	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154.7	-177.6	-48	-169.4	-162	144.5	0	111	L121 W202 S203 E206 I211 E229 M230	L121-K213 HydrophobicContact CD1-CD 3.66Å; L121-K213 HydrophobicContact CD1-CG 4.42Å; W202-K213 VanDerWaalsContact CE3-C 3.47Å; S203-K213 PolarHBondContact N-O 3.37Å; S203-K213 PolarHBondContact OG-N 3.19Å; E206-K213 IonicContact OE2-NZ 3.8Å; E206-K213 PolarHBondContact OE2-NZ 3.13Å; I211-K213 HydrophobicContact CG2-CG 3.95Å; K213-E229 VanDerWaalsContact CA-O 3.26Å; K213-E229 WeakPolarHBondContact CA-O 2.84Å; K213-M230 HydrophobicContact CD-CG 3.97Å; K213-M230 HydrophobicContact CD-SD 3.94Å; K213-M230 HydrophobicContact CG-CG 3.93Å; K213-M230 HydrophobicContact CG-SD 4.47Å
214	R	93	Very high	88.1	Confident	58 Å²	58	55.1 Å²	55.1	22%	0.219	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	149.2	167.9	62.4	175.2	-176.5	154.8	5.6	110.5	W199 T200 W202 Q228 E229	W199-R214 HydrophobicContact CE3-CB 4.47Å; W199-R214 HydrophobicContact CE3-CG 3.79Å; W199-R214 HydrophobicContact CZ3-CG 4.31Å; T200-R214 WeakPolarHBondContact O-CB 3.06Å; T200-R214 WeakPolarHBondContact OG1-CA 3.23Å; W202-R214 HydrophobicContact CD2-CB 4.14Å; W202-R214 HydrophobicContact CD2-CG 3.94Å; W202-R214 VanDerWaalsContact CE2-CD 3.5Å; W202-R214 HydrophobicContact CE3-CB 3.97Å; W202-R214 HydrophobicContact CE3-CG 3.84Å; W202-R214 HydrophobicContact CH2-CG 3.86Å; W202-R214 HydrophobicContact CZ2-CG 3.94Å; W202-R214 HydrophobicContact CZ3-CB 4.34Å; W202-R214 HydrophobicContact CZ3-CG 3.8Å; R214-Q228 CarbonylContact O-C 3.45Å; R214-Q228 VanDerWaalsContact O-CA 3.26Å; R214-Q228 WeakPolarHBondContact O-CA 2.97Å; R214-E229 HydrophobicContact CG-CB 4Å; R214-E229 IonicContact CZ-OE2 2.67Å; R214-E229 PolarHBondContact N-O 3.2Å; R214-E229 IonicContact NE-OE2 3.52Å; R214-E229 PolarHBondContact NE-OE2 3.29Å; R214-E229 VanDerWaalsContact NH2-CD 3.28Å; R214-E229 IonicContact NH2-OE1 3.18Å; R214-E229 PolarHBondContact NH2-OE1 3.14Å; R214-E229 IonicContact NH2-OE2 3.93Å; R214-E229 PolarHBondContact NH2-OE2 3.13Å; R214-E229 PolarHBondContact O-N 3.09Å
215	Y	93.1	Very high	88.3	Confident	10 Å²	10	57.7 Å²	57.7	4%	0.039	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.8	-177.6	-62.8	-88.4	0	0	0	110.4	V85 L121 W199 T200 I223 R224 Q228	V85-Y215 HydrophobicContact CB-CD2 4.05Å; V85-Y215 HydrophobicContact CB-CE2 3.8Å; V85-Y215 HydrophobicContact CG1-CE2 3.99Å; V85-Y215 HydrophobicContact CG2-CD2 3.69Å; V85-Y215 HydrophobicContact CG2-CE2 3.87Å; L121-Y215 WeakPolarHBondContact CD1-OH 3.45Å; W199-Y215 CarbonylContact C-O 3.59Å; W199-Y215 WeakPolarHBondContact CA-O 3.26Å; T200-Y215 PolarHBondContact N-O 2.66Å; T200-Y215 PolarHBondContact OG1-N 2.7Å; Y215-I223 VanDerWaalsContact CD1-O 3.3Å; Y215-I223 WeakPolarHBondContact CD1-O 3.46Å; Y215-R224 HydrophobicContact CE1-CB 4.33Å; Y215-R224 WeakPolarHBondContact CE1-O 3.5Å; Y215-Q228 HydrophobicContact CD1-CB 3.74Å; Y215-Q228 HydrophobicContact CE1-CB 3.84Å; Y215-Q228 HydrophobicContact CG-CB 4.48Å
216	Q	92.9	Very high	88.6	Confident	76 Å²	76	55 Å²	55	36%	0.355	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-71.8	131	170.9	-166.7	177.6	14.1	0	0	107.9	W199 C218 C226 P227	W199-Q216 HydrophobicContact CD2-CB 4.22Å; W199-Q216 HydrophobicContact CD2-CG 4.45Å; W199-Q216 HydrophobicContact CE3-CB 3.99Å; W199-Q216 VanDerWaalsContact CE3-N 3.27Å; W199-Q216 HydrophobicContact CH2-CB 3.77Å; W199-Q216 HydrophobicContact CH2-CG 4.36Å; W199-Q216 HydrophobicContact CZ2-CB 4.02Å; W199-Q216 HydrophobicContact CZ2-CG 4.11Å; W199-Q216 HydrophobicContact CZ3-CB 3.76Å; W199-Q216 VanDerWaalsContact CZ3-N 3.31Å; Q216-C218 PolarHBondContact O-N 3.16Å; Q216-C218 VanDerWaalsContact O-N 3.16Å; Q216-C226 WeakPolarHBondContact O-CB 3.34Å; Q216-C226 PolarHBondContact O-SG 3.21Å; Q216-C226 VanDerWaalsContact O-SG 3.38Å; Q216-P227 HydrophobicContact CB-CB 4.2Å; Q216-P227 WeakPolarHBondContact CB-O 3.48Å; Q216-P227 PolarHBondContact N-O 2.96Å
217	V	89.2	Confident	89.2	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.006	31%	0.308	C	S	.	.			trans	-65.7	119.8	176	179.9	0	0	0	0	108.2	V189 A192 K193 A196 G198	V189-V217 HydrophobicContact CG1-CG1 4.38Å; A192-V217 HydrophobicContact CB-CG1 3.68Å; K193-V217 WeakPolarHBondContact CE-O 3.4Å; K193-V217 HydrophobicContact CG-CB 3.82Å; K193-V217 HydrophobicContact CG-CG1 3.92Å; A196-V217 HydrophobicContact CB-CG2 4.06Å; G198-V217 PolarHBondContact O-N 2.98Å
218	C	89.1	Confident	89.9	Confident	20 Å²	20	54.3 Å²	54.3	14%	0.135	29%	0.286	C	S	.	.			trans	-140.4	-178.3	-174.3	89.1	0	0	0	0	112.1	V189 Q216 Q220 C226	V189-C218 WeakPolarHBondContact CG2-O 3.37Å; Q216-C218 PolarHBondContact O-N 3.16Å; Q216-C218 VanDerWaalsContact O-N 3.16Å; C218-Q220 VanDerWaalsContact SG-CG 3.5Å; C218-C226 HydrophobicContact CB-CB 3.86Å; C218-C226 WeakPolarHBondContact CB-SG 3.42Å; C218-C226 WeakPolarHBondContact SG-CA 3.32Å; C218-C226 WeakPolarHBondContact SG-CB 3.18Å; C218-C226 CovalentContact SG-SG 2.03Å; C218-C226 PolarHBondContact SG-SG 3.05Å
219	D	85	Confident	90.6	Very high	100 Å²	100	54.3 Å²	54.3	54%	0.535	27%	0.267	S	S	.	.	S	Bend	trans	-84.8	-0.4	-173.9	61.1	-2.5	0	0	0	115.4
220	Q	86.7	Confident	91	Very high	91 Å²	91	57.2 Å²	57.2	43%	0.425	28%	0.278	S	S	.	.			trans	-70.5	144.3	175.9	-58.8	-53.1	-69.9	0	0	111.2	C218 N225	C218-Q220 VanDerWaalsContact SG-CG 3.5Å; Q220-N225 HydrophobicContact CB-CB 4.31Å; Q220-N225 HydrophobicContact CG-CB 4.35Å
221	F	83.2	Confident	91.1	Very high	126 Å²	126	57.9 Å²	57.9	55%	0.553	28%	0.279	S	S	*	.	S	Bend	trans	-62.7	-43.2	178.4	-57.6	-34.8	0	0	0	112.2	I79 I185	I79-F221 HydrophobicContact CD1-CD1 3.47Å; I79-F221 VanDerWaalsContact CD1-CD1 3.47Å; I79-F221 HydrophobicContact CD1-CE1 3.93Å; I79-F221 HydrophobicContact CD1-CG 4.39Å; I79-F221 HydrophobicContact CG1-CD1 4.13Å; I185-F221 HydrophobicContact CD1-CE1 4.01Å
222	D	85.3	Confident	91.2	Very high	11 Å²	11	64.6 Å²	64.6	6%	0.059	30%	0.304	C	S	.	.	S	Bend	trans	-97.9	115.9	170.7	-178.3	7.5	0	0	0	109.4	Y115 R224 N225	Y115-D222 PolarHBondContact OH-OD1 2.77Å; Y115-D222 PolarHBondContact OH-OD2 3.27Å; D222-R224 PolarHBondContact O-N 3.15Å; D222-R224 VanDerWaalsContact O-N 3.11Å; D222-R224 WeakPolarHBondContact OD1-CB 2.89Å; D222-R224 VanDerWaalsContact OD1-CG 3.24Å; D222-R224 WeakPolarHBondContact OD1-CG 3.08Å; D222-R224 PolarHBondContact OD1-N 3.29Å; D222-R224 IonicContact OD1-NE 3.21Å; D222-R224 PolarHBondContact OD1-NE 2.82Å; D222-R224 VanDerWaalsContact OD1-NE 3.11Å; D222-R224 IonicContact OD2-CZ 2.68Å; D222-R224 IonicContact OD2-NE 2.96Å; D222-R224 PolarHBondContact OD2-NE 3.46Å; D222-R224 IonicContact OD2-NH2 2.76Å; D222-R224 PolarHBondContact OD2-NH2 2.94Å; D222-N225 WeakPolarHBondContact O-CB 3.03Å; D222-N225 PolarHBondContact O-N 2.93Å
223	I	89.3	Confident	91.1	Very high	12 Å²	12	61.5 Å²	61.5	6%	0.062	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-61.4	-20.5	178.8	-164.5	164.9	0	0	0	112.6	A82 V85 I124 T200 Y215 N225 C226	A82-I223 HydrophobicContact CB-CB 4.3Å; A82-I223 HydrophobicContact CB-CD1 3.66Å; A82-I223 HydrophobicContact CB-CG2 3.93Å; V85-I223 HydrophobicContact CG2-CG2 3.86Å; I124-I223 HydrophobicContact CD1-CG2 3.92Å; I124-I223 HydrophobicContact CG1-CG2 4.4Å; I124-I223 HydrophobicContact CG2-CG2 4.36Å; T200-I223 HydrophobicContact CG2-CD1 3.47Å; T200-I223 VanDerWaalsContact CG2-CD1 3.47Å; T200-I223 HydrophobicContact CG2-CG1 4.43Å; Y215-I223 VanDerWaalsContact CD1-O 3.3Å; Y215-I223 WeakPolarHBondContact CD1-O 3.46Å; I223-N225 PolarHBondContact O-N 3.02Å; I223-C226 HydrophobicContact CG1-CB 4.37Å; I223-C226 WeakPolarHBondContact O-CB 3.36Å; I223-C226 PolarHBondContact O-N 3.35Å
224	R	90.3	Very high	90.3	Very high	33 Å²	33	68.9 Å²	68.9	13%	0.125	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-66.5	-19.5	176.3	-55.6	175.2	-54.4	145.4	9.7	112.5	V85 E118 L121 I124 Y215 D222	V85-R224 HydrophobicContact CG1-CG 4.32Å; E118-R224 VanDerWaalsContact CD-NH1 3.33Å; E118-R224 IonicContact OE1-CZ 3.13Å; E118-R224 IonicContact OE1-NH1 2.65Å; E118-R224 PolarHBondContact OE1-NH1 3.43Å; E118-R224 IonicContact OE1-NH2 3.19Å; E118-R224 PolarHBondContact OE1-NH2 3.08Å; L121-R224 WeakPolarHBondContact O-CD 3.23Å; I124-R224 HydrophobicContact CD1-CG 4.46Å; Y215-R224 HydrophobicContact CE1-CB 4.33Å; Y215-R224 WeakPolarHBondContact CE1-O 3.5Å; D222-R224 PolarHBondContact O-N 3.15Å; D222-R224 VanDerWaalsContact O-N 3.11Å; D222-R224 WeakPolarHBondContact OD1-CB 2.89Å; D222-R224 VanDerWaalsContact OD1-CG 3.24Å; D222-R224 WeakPolarHBondContact OD1-CG 3.08Å; D222-R224 PolarHBondContact OD1-N 3.29Å; D222-R224 IonicContact OD1-NE 3.21Å; D222-R224 PolarHBondContact OD1-NE 2.82Å; D222-R224 VanDerWaalsContact OD1-NE 3.11Å; D222-R224 IonicContact OD2-CZ 2.68Å; D222-R224 IonicContact OD2-NE 2.96Å; D222-R224 PolarHBondContact OD2-NE 3.46Å; D222-R224 IonicContact OD2-NH2 2.76Å; D222-R224 PolarHBondContact OD2-NH2 2.94Å
225	N	92.9	Very high	88.8	Confident	115 Å²	115	68.8 Å²	68.8	62%	0.615	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-87.5	-4.7	172.7	-64.9	-34.4	0	0	0	113.5	Q220 D222 I223	Q220-N225 HydrophobicContact CB-CB 4.31Å; Q220-N225 HydrophobicContact CG-CB 4.35Å; D222-N225 WeakPolarHBondContact O-CB 3.03Å; D222-N225 PolarHBondContact O-N 2.93Å; I223-N225 PolarHBondContact O-N 3.02Å
226	C	93.8	Very high	86.7	Confident	7 Å²	7	72.4 Å²	72.4	5%	0.047	36%	0.363	C	S	.	.	S	Bend	trans	-73.8	160.8	171.8	-63.9	0	0	0	0	111.9	Q216 C218 I223 Q228	Q216-C226 WeakPolarHBondContact O-CB 3.34Å; Q216-C226 PolarHBondContact O-SG 3.21Å; Q216-C226 VanDerWaalsContact O-SG 3.38Å; C218-C226 HydrophobicContact CB-CB 3.86Å; C218-C226 WeakPolarHBondContact CB-SG 3.42Å; C218-C226 WeakPolarHBondContact SG-CA 3.32Å; C218-C226 WeakPolarHBondContact SG-CB 3.18Å; C218-C226 CovalentContact SG-SG 2.03Å; C218-C226 PolarHBondContact SG-SG 3.05Å; I223-C226 HydrophobicContact CG1-CB 4.37Å; I223-C226 WeakPolarHBondContact O-CB 3.36Å; I223-C226 PolarHBondContact O-N 3.35Å; C226-Q228 PolarHBondContact O-N 3.15Å
227	P	96.2	Very high	84.5	Confident	74 Å²	74	74.5 Å²	74.5	48%	0.481	38%	0.376	S	S	.	.			trans	-52.1	138.8	170.7	-26.1	35.1	0	0	0	111.9	Q216	Q216-P227 HydrophobicContact CB-CB 4.2Å; Q216-P227 WeakPolarHBondContact CB-O 3.48Å; Q216-P227 PolarHBondContact N-O 2.96Å
228	Q	95.3	Very high	82.3	Confident	95 Å²	95	81.2 Å²	81.2	44%	0.444	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	149.6	-176.6	66.2	179.9	-40.6	0	0	112.6	R214 Y215 C226	R214-Q228 CarbonylContact O-C 3.45Å; R214-Q228 VanDerWaalsContact O-CA 3.26Å; R214-Q228 WeakPolarHBondContact O-CA 2.97Å; Y215-Q228 HydrophobicContact CD1-CB 3.74Å; Y215-Q228 HydrophobicContact CE1-CB 3.84Å; Y215-Q228 HydrophobicContact CG-CB 4.48Å; C226-Q228 PolarHBondContact O-N 3.15Å
229	E	96	Very high	80.2	Confident	72 Å²	72	84.1 Å²	84.1	34%	0.336	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	152.1	166	-75.5	179.5	-170.5	0	0	110.4	W199 W202 K213 R214	W199-E229 HydrophobicContact CH2-CG 3.71Å; W199-E229 HydrophobicContact CZ2-CG 4.41Å; W199-E229 HydrophobicContact CZ3-CB 4.25Å; W199-E229 HydrophobicContact CZ3-CG 3.87Å; W202-E229 HydrophobicContact CH2-CB 3.88Å; W202-E229 HydrophobicContact CZ3-CB 4.44Å; K213-E229 VanDerWaalsContact CA-O 3.26Å; K213-E229 WeakPolarHBondContact CA-O 2.84Å; R214-E229 HydrophobicContact CG-CB 4Å; R214-E229 IonicContact CZ-OE2 2.67Å; R214-E229 PolarHBondContact N-O 3.2Å; R214-E229 IonicContact NE-OE2 3.52Å; R214-E229 PolarHBondContact NE-OE2 3.29Å; R214-E229 VanDerWaalsContact NH2-CD 3.28Å; R214-E229 IonicContact NH2-OE1 3.18Å; R214-E229 PolarHBondContact NH2-OE1 3.14Å; R214-E229 IonicContact NH2-OE2 3.93Å; R214-E229 PolarHBondContact NH2-OE2 3.13Å; R214-E229 PolarHBondContact O-N 3.09Å
230	M	93.4	Very high	78	Confident	121 Å²	121	82.9 Å²	82.9	60%	0.596	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	136.4	177.6	-57.6	-169	-71.3	0	0	109.8	I211 R212 K213	I211-M230 HydrophobicContact CG2-CB 3.92Å; I211-M230 HydrophobicContact CG2-CG 4.44Å; R212-M230 WeakPolarHBondContact O-CA 3.14Å; K213-M230 HydrophobicContact CD-CG 3.97Å; K213-M230 HydrophobicContact CD-SD 3.94Å; K213-M230 HydrophobicContact CG-CG 3.93Å; K213-M230 HydrophobicContact CG-SD 4.47Å
231	E	92.3	Very high	75.7	Confident	56 Å²	56	86.2 Å²	86.2	26%	0.262	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.2	175.1	-166	-167.3	174.7	0	0	109.8	W202 I211 R212	W202-E231 HydrophobicContact CH2-CB 3.83Å; W202-E231 HydrophobicContact CZ2-CB 4.41Å; W202-E231 HydrophobicContact CZ3-CB 4.05Å; I211-E231 WeakPolarHBondContact CA-O 2.91Å; R212-E231 HydrophobicContact CG-CB 4.15Å; R212-E231 WeakPolarHBondContact CG-O 3.41Å; R212-E231 IonicContact CZ-OE2 3.86Å; R212-E231 PolarHBondContact N-O 3.39Å; R212-E231 IonicContact NE-OE2 2.92Å; R212-E231 PolarHBondContact NE-OE2 3.12Å; R212-E231 IonicContact NH2-OE1 3.59Å; R212-E231 IonicContact NH2-OE2 3.04Å; R212-E231 PolarHBondContact NH2-OE2 3.26Å; R212-E231 PolarHBondContact O-N 2.66Å
232	Y	92.7	Very high	73.6	Confident	168 Å²	168	88.2 Å²	88.2	66%	0.659	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	133.4	167.3	-70.2	-76.3	0	0	0	110.5	I211	I211-Y232 HydrophobicContact CD1-CE1 3.97Å; I211-Y232 HydrophobicContact CG1-CD1 3.81Å; I211-Y232 HydrophobicContact CG1-CE1 3.75Å
233	C	90	Very high	71.4	Confident	13 Å²	13	94.9 Å²	94.9	9%	0.088	50%	0.498	C	S	.	.			trans	-68.6	137.9	177	-74.8	0	0	0	0	111.9	C205 N210 G235	C205-C233 HydrophobicContact CB-CB 3.88Å; C205-C233 WeakPolarHBondContact CB-SG 3.17Å; C205-C233 WeakPolarHBondContact SG-CB 3.38Å; C205-C233 CovalentContact SG-SG 2.03Å; C205-C233 PolarHBondContact SG-SG 2.92Å; N210-C233 PolarHBondContact O-N 2.98Å; N210-C233 WeakPolarHBondContact OD1-CB 3.43Å; C233-G235 VanDerWaalsContact C-N 3.29Å; C233-G235 PolarHBondContact O-N 2.82Å
234	K	76.6	Confident	69.1	Low	188 Å²	188	101.7 Å²	101.7	82%	0.817	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	80.4	179.5	-64.8	-180	-175.4	175.5	0	109.7
235	G	62.4	Low	66.7	Low	55 Å²	55	106.1 Å²	106.1	57%	0.567	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.3	-48	-178.2	0	0	0	0	0	114.6	C233	C233-G235 VanDerWaalsContact C-N 3.29Å; C233-G235 PolarHBondContact O-N 2.82Å
236	D	49.3	Very low	64.1	Low	86 Å²	86	110.4 Å²	110.4	46%	0.46	58%	0.58	S	S	.	*			trans	-108.7	21.9	-165.5	-65.8	-76.5	0	0	0	116.6	N210 N238 S239	N210-D236 WeakPolarHBondContact ND2-CB 3.45Å; N210-D236 PolarHBondContact ND2-OD2 3.25Å; D236-N238 PolarHBondContact O-N 3.07Å; D236-S239 PolarHBondContact O-N 3.36Å; D236-S239 VanDerWaalsContact O-N 3.12Å
237	I	45.9	Very low	61.5	Low	120 Å²	120	117.1 Å²	117.1	62%	0.615	65%	0.651	S	S	*	*	H	α-helix	trans	-65.5	-24.1	173.1	-63.9	179.8	0	0	0	111.5	S239	I237-S239 PolarHBondContact O-N 2.82Å
238	N	43.3	Very low	59.8	Low	143 Å²	143	119.3 Å²	119.3	77%	0.765	66%	0.659	S	S	*	*	H	α-helix	trans	-74.1	-8.5	174.6	-77.3	-5.7	0	0	0	114.5	D236	D236-N238 PolarHBondContact O-N 3.07Å
239	S	44.3	Very low	57.9	Low	80 Å²	80	120.6 Å²	120.6	56%	0.559	67%	0.671	S	S	*	*	H	α-helix	trans	-93.2	-24.3	178.6	-55.8	0	0	0	0	112.8	D236 I237	D236-S239 PolarHBondContact O-N 3.36Å; D236-S239 VanDerWaalsContact O-N 3.12Å; I237-S239 PolarHBondContact O-N 2.82Å
240	A	39.3	Very low	55.8	Low	75 Å²	75	123.3 Å²	123.3	62%	0.62	69%	0.689	S	S	*	*	H	α-helix	trans	-96.1	-23.5	-174	0	0	0	0	0	114.7
241	Q	38.8	Very low	53.6	Low	160 Å²	160	123.4 Å²	123.4	75%	0.748	70%	0.695	S	S	*	*	S	Bend	trans	-96.5	0.8	-175.9	-75.3	-165	-34.4	0	0	115.9
242	Q	39.2	Very low	51.2	Low	169 Å²	169	127.6 Å²	127.6	79%	0.79	72%	0.722	S	S	*	*	S	Bend	trans	-93.2	-5.7	173.9	-82.1	-168.9	-17.9	0	0	115.6
243	N	38.1	Very low	48.4	Very low	150 Å²	150	124.9 Å²	124.9	80%	0.802	73%	0.726	S	S	*	*	S	Bend	trans	-105	21.7	-179.1	-79.6	-19.2	0	0	0	115
244	L	41.6	Very low	45.4	Very low	155 Å²	155	132.9 Å²	132.9	81%	0.812	77%	0.772	S	S	*	*	S	Bend	trans	-131.8	12.8	179.3	-99.6	165.3	0	0	0	115.7
245	V	38.8	Very low	43	Very low	127 Å²	127	128.7 Å²	128.7	77%	0.77	77%	0.768	S	S	*	*	S	Bend	trans	-135.1	56.6	168	-162.4	0	0	0	0	111.2
246	H	38.8	Very low	41.4	Very low	204 Å²	204	134.8 Å²	134.8	94%	0.944	79%	0.785	S	S	*	*			trans	-145.1	93.1	154.4	-100.3	-42.7	0	0	0	109.7
247	G	39.6	Very low	40.7	Very low	149 Å²	149	139.3 Å²	139.3	100%	1.536	82%	0.815	S	S	*	*			trans	-175.3	0	178.7	0	0	0	0	0	109

Retrieved 247 of 247 residues in 168.3 ms (Link to these results)

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