A0A077ZGW6_TRITR Loading...

Cpn60 TCP1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGW6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 234 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.6	Very low	59.9	Low	112 Å²	112	59.9 Å²	59.9	55%	0.552	31%	0.314	S	S	*	.				0	-29	0	-76.1	-172.3	-164.7	0	0	114.2	M3 A4 V5 H227	M1-M3 VanDerWaalsContact C-N 3.32Å; M1-M3 PolarHBondContact O-N 3.38Å; M1-A4 PolarHBondContact O-N 2.87Å; M1-V5 WeakPolarHBondContact O-CG2 3.41Å; M1-V5 PolarHBondContact O-N 3.02Å; M1-H227 VanDerWaalsContact CB-CE1 3.48Å; M1-H227 WeakPolarHBondContact CB-CE1 3.31Å; M1-H227 WeakPolarHBondContact CB-NE2 3.47Å; M1-H227 HydrophobicContact CE-CB 3.5Å; M1-H227 VanDerWaalsContact CE-CB 3.5Å; M1-H227 WeakPolarHBondContact CE-CD2 3.21Å; M1-H227 HydrophobicContact CG-CB 4.25Å; M1-H227 VanDerWaalsContact CG-CD2 3.41Å; M1-H227 WeakPolarHBondContact CG-CD2 3.05Å; M1-H227 VanDerWaalsContact CG-CG 3.46Å; M1-H227 WeakPolarHBondContact CG-NE2 3.41Å; M1-H227 PolarHBondContact N-CE1 2.83Å; M1-H227 PolarHBondContact N-ND1 2.99Å; M1-H227 HydrophobicContact SD-CB 4.46Å; M1-H227 PolarHBondContact SD-CD2 3.32Å
2	H	58	Low	59.7	Low	115 Å²	115	56.8 Å²	56.8	53%	0.532	30%	0.304	S	S	.	.	H	α-helix	trans	-53.9	-42.7	-176.5	-71.8	-78.8	0	0	0	114.1	A4 V5 D6 F231	H2-A4 PolarHBondContact O-N 2.79Å; H2-V5 PolarHBondContact O-N 3.32Å; H2-D6 VanDerWaalsContact O-CB 3.28Å; H2-D6 WeakPolarHBondContact O-CB 3.31Å; H2-D6 PolarHBondContact O-N 2.84Å; H2-F231 AromaticContact CD2-CE2 3.75Å; H2-F231 AromaticContact CD2-CZ 3.73Å
3	M	63.2	Low	59.6	Low	81 Å²	81	59.1 Å²	59.1	40%	0.399	32%	0.32	S	S	.	.	H	α-helix	trans	-56.9	-50.2	-177.6	-63	-162.5	-67.6	0	0	114.5	M1 A7 S46 S48	M1-M3 VanDerWaalsContact C-N 3.32Å; M1-M3 PolarHBondContact O-N 3.38Å; M3-A7 WeakPolarHBondContact O-CB 3.3Å; M3-A7 PolarHBondContact O-N 3.17Å; M3-A7 VanDerWaalsContact O-N 3.15Å; M3-S46 VanDerWaalsContact SD-O 3.36Å; M3-S48 WeakPolarHBondContact CA-OG 3.44Å
4	A	57.6	Low	59.4	Low	57 Å²	57	59.4 Å²	59.4	47%	0.471	32%	0.322	S	S	.	.	H	α-helix	trans	-72	-41.6	-177.5	0	0	0	0	0	111.2	M1 H2 D6 A7 I8	M1-A4 PolarHBondContact O-N 2.87Å; H2-A4 PolarHBondContact O-N 2.79Å; A4-D6 VanDerWaalsContact C-N 3.35Å; A4-D6 PolarHBondContact O-N 3.31Å; A4-A7 PolarHBondContact O-N 2.87Å; A4-I8 WeakPolarHBondContact O-CB 3.48Å; A4-I8 VanDerWaalsContact O-CD1 3.32Å; A4-I8 WeakPolarHBondContact O-CD1 3.38Å; A4-I8 WeakPolarHBondContact O-CG1 3.29Å; A4-I8 PolarHBondContact O-N 3.02Å
5	V	64	Low	59	Low	63 Å²	63	58.3 Å²	58.3	38%	0.382	32%	0.318	S	S	.	.	H	α-helix	trans	-64.4	-41.3	180	173.8	0	0	0	0	111	M1 H2 I8 K9	M1-V5 WeakPolarHBondContact O-CG2 3.41Å; M1-V5 PolarHBondContact O-N 3.02Å; H2-V5 PolarHBondContact O-N 3.32Å; V5-I8 PolarHBondContact O-N 2.75Å; V5-K9 HydrophobicContact CG1-CD 4.06Å; V5-K9 HydrophobicContact CG1-CG 4.36Å; V5-K9 WeakPolarHBondContact O-CB 3.23Å; V5-K9 VanDerWaalsContact O-CG 3.25Å; V5-K9 WeakPolarHBondContact O-CG 3.28Å; V5-K9 PolarHBondContact O-N 3.28Å
6	D	62.9	Low	58.4	Low	40 Å²	40	63.5 Å²	63.5	21%	0.214	34%	0.344	C	S	.	.	H	α-helix	trans	-70.5	-38.6	-179.8	-68.6	-22.9	0	0	0	111.9	H2 A4 K9 L10	H2-D6 VanDerWaalsContact O-CB 3.28Å; H2-D6 WeakPolarHBondContact O-CB 3.31Å; H2-D6 PolarHBondContact O-N 2.84Å; A4-D6 VanDerWaalsContact C-N 3.35Å; A4-D6 PolarHBondContact O-N 3.31Å; D6-K9 PolarHBondContact O-N 3.34Å; D6-K9 IonicContact OD1-NZ 2.7Å; D6-L10 PolarHBondContact O-N 2.85Å; D6-L10 VanDerWaalsContact O-N 3.16Å
7	A	60.2	Low	57.8	Low	4 Å²	4	71.4 Å²	71.4	3%	0.033	38%	0.375	C	S	.	.	H	α-helix	trans	-61.8	-45.6	171.7	0	0	0	0	0	111.5	M3 A4 L10 V11 L33 L149	M3-A7 WeakPolarHBondContact O-CB 3.3Å; M3-A7 PolarHBondContact O-N 3.17Å; M3-A7 VanDerWaalsContact O-N 3.15Å; A4-A7 PolarHBondContact O-N 2.87Å; A7-L10 PolarHBondContact O-N 3.29Å; A7-V11 WeakPolarHBondContact O-CG2 3.47Å; A7-V11 PolarHBondContact O-N 2.9Å; A7-L33 HydrophobicContact CB-CD1 4.19Å; A7-L149 HydrophobicContact CB-CD2 4.45Å
8	I	63.7	Low	57.2	Low	38 Å²	38	68.9 Å²	68.9	20%	0.195	37%	0.369	C	S	.	.	H	α-helix	trans	-65.8	-42.2	179.4	-68.3	161.9	0	0	0	111.3	A4 V5 L10 V11 A12 V173 F177	A4-I8 WeakPolarHBondContact O-CB 3.48Å; A4-I8 VanDerWaalsContact O-CD1 3.32Å; A4-I8 WeakPolarHBondContact O-CD1 3.38Å; A4-I8 WeakPolarHBondContact O-CG1 3.29Å; A4-I8 PolarHBondContact O-N 3.02Å; V5-I8 PolarHBondContact O-N 2.75Å; I8-L10 VanDerWaalsContact C-N 3.28Å; I8-L10 PolarHBondContact O-N 2.86Å; I8-V11 PolarHBondContact O-N 2.84Å; I8-A12 WeakPolarHBondContact O-CB 3.11Å; I8-A12 PolarHBondContact O-N 3.29Å; I8-V173 HydrophobicContact CD1-CG1 3.76Å; I8-V173 HydrophobicContact CG1-CG1 4.05Å; I8-V173 HydrophobicContact CG2-CG1 4.45Å; I8-F177 HydrophobicContact CG2-CD2 4.22Å; I8-F177 HydrophobicContact CG2-CE1 4.28Å; I8-F177 HydrophobicContact CG2-CE2 3.63Å; I8-F177 HydrophobicContact CG2-CZ 3.67Å
9	K	65.3	Low	56.4	Low	122 Å²	122	75.3 Å²	75.3	53%	0.53	39%	0.393	S	S	.	.	H	α-helix	trans	-57.2	-43.5	176.5	-80.3	172.2	-179.5	170.7	0	111.3	V5 D6 A12 V13	V5-K9 HydrophobicContact CG1-CD 4.06Å; V5-K9 HydrophobicContact CG1-CG 4.36Å; V5-K9 WeakPolarHBondContact O-CB 3.23Å; V5-K9 VanDerWaalsContact O-CG 3.25Å; V5-K9 WeakPolarHBondContact O-CG 3.28Å; V5-K9 PolarHBondContact O-N 3.28Å; D6-K9 PolarHBondContact O-N 3.34Å; D6-K9 IonicContact OD1-NZ 2.7Å; K9-A12 PolarHBondContact O-N 3.37Å; K9-V13 WeakPolarHBondContact O-CG2 3.33Å; K9-V13 PolarHBondContact O-N 3.02Å
10	L	63	Low	55.6	Low	23 Å²	23	81 Å²	81	12%	0.12	42%	0.418	C	S	.	.	H	α-helix	trans	-61.6	-48.1	178.8	-157.8	93.4	0	0	0	111.2	D6 A7 I8 A12 V13 D14 I32 A144 A146 C147	D6-L10 PolarHBondContact O-N 2.85Å; D6-L10 VanDerWaalsContact O-N 3.16Å; A7-L10 PolarHBondContact O-N 3.29Å; I8-L10 VanDerWaalsContact C-N 3.28Å; I8-L10 PolarHBondContact O-N 2.86Å; L10-A12 VanDerWaalsContact C-N 3.32Å; L10-A12 PolarHBondContact O-N 3.36Å; L10-V13 PolarHBondContact O-N 3.07Å; L10-D14 PolarHBondContact O-N 2.7Å; L10-I32 HydrophobicContact CD2-CG2 4.08Å; L10-A144 HydrophobicContact CD1-CB 3.99Å; L10-A144 VanDerWaalsContact CD1-O 3.32Å; L10-A144 WeakPolarHBondContact CD1-O 3.45Å; L10-A144 HydrophobicContact CD2-CB 4.39Å; L10-A144 WeakPolarHBondContact CD2-O 3.36Å; L10-A144 WeakPolarHBondContact CG-O 3.4Å; L10-A146 VanDerWaalsContact CD2-C 3.43Å; L10-C147 HydrophobicContact CD2-CB 3.79Å
11	V	61.5	Low	54.9	Low	4 Å²	4	81.9 Å²	81.9	2%	0.024	43%	0.427	C	S	.	.	H	α-helix	trans	-68.7	-34.9	-178.6	-168.2	0	0	0	0	111.9	A7 I8 V13 D14 T15 F29 I32	A7-V11 WeakPolarHBondContact O-CG2 3.47Å; A7-V11 PolarHBondContact O-N 2.9Å; I8-V11 PolarHBondContact O-N 2.84Å; V11-V13 VanDerWaalsContact C-N 3.31Å; V11-V13 PolarHBondContact O-N 3.45Å; V11-D14 PolarHBondContact O-N 3.07Å; V11-T15 HydrophobicContact CG1-CG2 4.3Å; V11-T15 WeakPolarHBondContact O-CG2 3.39Å; V11-T15 PolarHBondContact O-N 3.38Å; V11-T15 VanDerWaalsContact O-N 3.13Å; V11-T15 PolarHBondContact O-OG1 3.49Å; V11-F29 HydrophobicContact CB-CD1 4.18Å; V11-F29 HydrophobicContact CB-CE1 3.52Å; V11-F29 HydrophobicContact CB-CZ 3.86Å; V11-F29 HydrophobicContact CG1-CD1 3.54Å; V11-F29 HydrophobicContact CG1-CD2 4.03Å; V11-F29 HydrophobicContact CG1-CE1 3.08Å; V11-F29 HydrophobicContact CG1-CE2 3.62Å; V11-F29 HydrophobicContact CG1-CG 4Å; V11-F29 HydrophobicContact CG1-CZ 3.12Å; V11-F29 HydrophobicContact CG2-CD1 4Å; V11-F29 HydrophobicContact CG2-CE1 3.74Å; V11-I32 HydrophobicContact CG1-CD1 3.86Å; V11-I32 HydrophobicContact CG2-CB 4.37Å; V11-I32 HydrophobicContact CG2-CG2 3.76Å
12	A	57.8	Low	54.9	Low	23 Å²	23	83.4 Å²	83.4	19%	0.19	44%	0.437	C	S	.	.	H	α-helix	trans	-59.5	-41.9	176.8	0	0	0	0	0	111.8	I8 K9 L10 D14 T15 L16	I8-A12 WeakPolarHBondContact O-CB 3.11Å; I8-A12 PolarHBondContact O-N 3.29Å; K9-A12 PolarHBondContact O-N 3.37Å; L10-A12 VanDerWaalsContact C-N 3.32Å; L10-A12 PolarHBondContact O-N 3.36Å; A12-D14 PolarHBondContact O-N 2.85Å; A12-T15 WeakPolarHBondContact CA-OG1 3.48Å; A12-T15 PolarHBondContact O-N 3Å; A12-T15 PolarHBondContact O-OG1 3.49Å; A12-L16 VanDerWaalsContact O-CG 3.31Å; A12-L16 WeakPolarHBondContact O-CG 3.49Å; A12-L16 PolarHBondContact O-N 3.3Å; A12-L16 VanDerWaalsContact O-N 3.15Å
13	V	58.5	Low	54.2	Low	86 Å²	86	89.3 Å²	89.3	52%	0.521	46%	0.455	S	S	.	.	H	α-helix	trans	-62.2	-43.7	-179.8	173.1	0	0	0	0	111.7	K9 L10 V11 T15 L16	K9-V13 WeakPolarHBondContact O-CG2 3.33Å; K9-V13 PolarHBondContact O-N 3.02Å; L10-V13 PolarHBondContact O-N 3.07Å; V11-V13 VanDerWaalsContact C-N 3.31Å; V11-V13 PolarHBondContact O-N 3.45Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 2.99Å; V13-L16 PolarHBondContact O-N 3.44Å
14	D	55.8	Low	53.5	Low	63 Å²	63	92 Å²	92	34%	0.337	47%	0.465	S	S	.	.	H	α-helix	trans	-69.8	-31	178.6	-83.7	-19.1	0	0	0	112.8	L10 V11 A12 I32	L10-D14 PolarHBondContact O-N 2.7Å; V11-D14 PolarHBondContact O-N 3.07Å; A12-D14 PolarHBondContact O-N 2.85Å; D14-I32 HydrophobicContact CB-CD1 3.99Å
15	T	53.9	Low	53.2	Low	44 Å²	44	91.4 Å²	91.4	27%	0.27	46%	0.455	S	S	.	.	H	α-helix	trans	-75	-27.3	178.3	53.8	0	0	0	0	113.8	V11 A12 V13 F17 G18 F29	V11-T15 HydrophobicContact CG1-CG2 4.3Å; V11-T15 WeakPolarHBondContact O-CG2 3.39Å; V11-T15 PolarHBondContact O-N 3.38Å; V11-T15 VanDerWaalsContact O-N 3.13Å; V11-T15 PolarHBondContact O-OG1 3.49Å; A12-T15 WeakPolarHBondContact CA-OG1 3.48Å; A12-T15 PolarHBondContact O-N 3Å; A12-T15 PolarHBondContact O-OG1 3.49Å; V13-T15 VanDerWaalsContact C-N 3.34Å; V13-T15 PolarHBondContact O-N 2.99Å; T15-F17 VanDerWaalsContact C-N 3.27Å; T15-F17 PolarHBondContact O-N 2.93Å; T15-G18 PolarHBondContact O-N 3.17Å; T15-F29 HydrophobicContact CG2-CE2 4.3Å
16	L	48.9	Very low	52.6	Low	141 Å²	141	92.3 Å²	92.3	74%	0.738	46%	0.458	S	S	*	.	H	α-helix	trans	-67.5	-24.2	-177.5	-75.9	163.8	0	0	0	113.6	A12 V13	A12-L16 VanDerWaalsContact O-CG 3.31Å; A12-L16 WeakPolarHBondContact O-CG 3.49Å; A12-L16 PolarHBondContact O-N 3.3Å; A12-L16 VanDerWaalsContact O-N 3.15Å; V13-L16 PolarHBondContact O-N 3.44Å
17	F	48.7	Very low	52.3	Low	198 Å²	198	94.2 Å²	94.2	87%	0.868	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-6.7	177	-77.5	-83.1	0	0	0	113.9	T15	T15-F17 VanDerWaalsContact C-N 3.27Å; T15-F17 PolarHBondContact O-N 2.93Å
18	G	47.4	Very low	52.2	Low	26 Å²	26	100.3 Å²	100.3	27%	0.268	49%	0.493	S	S	.	.	S	Bend	trans	-89.4	116.4	179.2	0	0	0	0	0	111.6	T15 Q20	T15-G18 PolarHBondContact O-N 3.17Å; G18-Q20 PolarHBondContact O-N 3.15Å
19	K	41.6	Very low	52.2	Low	190 Å²	190	100.1 Å²	100.1	83%	0.826	49%	0.491	S	S	*	.			trans	-35.7	125.1	174	-69.9	-178.4	176.2	-178.1	0	112.6	T21	K19-T21 PolarHBondContact O-N 3.42Å
20	Q	41.3	Very low	52.1	Low	190 Å²	190	101.5 Å²	101.5	89%	0.888	50%	0.497	S	S	*	.			trans	-55	98.4	167.5	-76.6	-168.5	7.1	0	0	109.6	G18	G18-Q20 PolarHBondContact O-N 3.15Å
21	T	39.7	Very low	52.2	Low	100 Å²	100	106.6 Å²	106.6	61%	0.613	52%	0.518	S	S	*	.			trans	-158.3	107.1	161.1	46.5	0	0	0	0	108.4	K19	K19-T21 PolarHBondContact O-N 3.42Å
22	D	39.7	Very low	52.8	Low	143 Å²	143	107.2 Å²	107.2	77%	0.765	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.5	132.7	137.4	-61.3	-37.5	0	0	0	120.9	F24	D22-F24 WeakPolarHBondContact O-CD2 3.32Å; D22-F24 PolarHBondContact O-N 3.12Å
23	R	43.3	Very low	53.7	Low	239 Å²	239	107 Å²	107	90%	0.902	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	-25.4	170	-82.3	-179.8	173.9	175.2	-1.1	119.1
24	F	49.3	Very low	54.8	Low	139 Å²	139	104 Å²	104	61%	0.61	50%	0.497	S	S	*	.			trans	-87.1	-5.3	-173.7	-77.1	-81.2	0	0	0	115.7	D22 L26 T27 R28	D22-F24 WeakPolarHBondContact O-CD2 3.32Å; D22-F24 PolarHBondContact O-N 3.12Å; F24-L26 PolarHBondContact O-N 3.11Å; F24-T27 PolarHBondContact O-N 2.86Å; F24-R28 PolarHBondContact O-N 3.37Å
25	V	51.5	Low	56.2	Low	44 Å²	44	102.9 Å²	102.9	27%	0.267	49%	0.491	S	S	.	.	H	α-helix	trans	-66.2	-39.2	-170.5	-171.4	0	0	0	0	112.3	T27 R28 F29 L178	V25-T27 VanDerWaalsContact C-N 3.33Å; V25-T27 PolarHBondContact O-N 3.23Å; V25-R28 WeakPolarHBondContact O-CB 3.19Å; V25-R28 PolarHBondContact O-N 3.41Å; V25-R28 VanDerWaalsContact O-N 3.1Å; V25-F29 HydrophobicContact CG1-CD2 3.92Å; V25-F29 HydrophobicContact CG1-CE2 3.93Å; V25-F29 PolarHBondContact O-N 3.43Å; V25-L178 HydrophobicContact CB-CD1 4.07Å; V25-L178 HydrophobicContact CG1-CD1 3.4Å; V25-L178 VanDerWaalsContact CG1-CD1 3.4Å; V25-L178 HydrophobicContact CG1-CD2 4.18Å; V25-L178 HydrophobicContact CG1-CG 4.4Å; V25-L178 HydrophobicContact CG2-CD1 4.27Å
26	L	51.1	Low	57.8	Low	82 Å²	82	101.8 Å²	101.8	43%	0.429	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-39.6	178.8	-67.6	168.3	0	0	0	112.5	F24 R28 F29 K30 H171	F24-L26 PolarHBondContact O-N 3.11Å; L26-R28 PolarHBondContact O-N 3.23Å; L26-F29 PolarHBondContact O-N 3.36Å; L26-K30 PolarHBondContact O-N 3.08Å; L26-H171 VanDerWaalsContact CD2-CE1 3.47Å; L26-H171 WeakPolarHBondContact CD2-CE1 3.45Å; L26-H171 WeakPolarHBondContact CD2-ND1 3.44Å
27	T	56.5	Low	59.7	Low	79 Å²	79	98.2 Å²	98.2	49%	0.485	47%	0.465	S	S	.	.	H	α-helix	trans	-67.4	-29.2	177.7	-39.6	0	0	0	0	111.2	F24 V25 K31	F24-T27 PolarHBondContact O-N 2.86Å; V25-T27 VanDerWaalsContact C-N 3.33Å; V25-T27 PolarHBondContact O-N 3.23Å; T27-K31 WeakPolarHBondContact O-CG 3.34Å
28	R	57.1	Low	61.5	Low	132 Å²	132	89 Å²	89	50%	0.498	43%	0.425	S	S	.	.	H	α-helix	trans	-74.9	-39.5	175.2	-70.8	-173	-179.5	-177.3	3.3	112.6	F24 V25 L26 K30 K31 I32	F24-R28 PolarHBondContact O-N 3.37Å; V25-R28 WeakPolarHBondContact O-CB 3.19Å; V25-R28 PolarHBondContact O-N 3.41Å; V25-R28 VanDerWaalsContact O-N 3.1Å; L26-R28 PolarHBondContact O-N 3.23Å; R28-K30 PolarHBondContact O-N 3.24Å; R28-K31 WeakPolarHBondContact O-CA 3.41Å; R28-K31 WeakPolarHBondContact O-CB 2.93Å; R28-K31 PolarHBondContact O-N 2.97Å; R28-I32 PolarHBondContact O-N 3.22Å; R28-I32 VanDerWaalsContact O-N 3.15Å
29	F	63.4	Low	63.3	Low	35 Å²	35	90.2 Å²	90.2	15%	0.154	43%	0.428	C	S	.	.	H	α-helix	trans	-60.1	-44.4	177.8	-97.9	-92.9	0	0	0	112.4	V11 T15 V25 L26 K31 I32 L33 C174	V11-F29 HydrophobicContact CB-CD1 4.18Å; V11-F29 HydrophobicContact CB-CE1 3.52Å; V11-F29 HydrophobicContact CB-CZ 3.86Å; V11-F29 HydrophobicContact CG1-CD1 3.54Å; V11-F29 HydrophobicContact CG1-CD2 4.03Å; V11-F29 HydrophobicContact CG1-CE1 3.08Å; V11-F29 HydrophobicContact CG1-CE2 3.62Å; V11-F29 HydrophobicContact CG1-CG 4Å; V11-F29 HydrophobicContact CG1-CZ 3.12Å; V11-F29 HydrophobicContact CG2-CD1 4Å; V11-F29 HydrophobicContact CG2-CE1 3.74Å; T15-F29 HydrophobicContact CG2-CE2 4.3Å; V25-F29 HydrophobicContact CG1-CD2 3.92Å; V25-F29 HydrophobicContact CG1-CE2 3.93Å; V25-F29 PolarHBondContact O-N 3.43Å; L26-F29 PolarHBondContact O-N 3.36Å; F29-K31 PolarHBondContact O-N 3.42Å; F29-I32 PolarHBondContact O-N 3.06Å; F29-I32 VanDerWaalsContact O-N 3.09Å; F29-L33 PolarHBondContact O-N 3.46Å; F29-C174 WeakPolarHBondContact CD1-SG 3.43Å; F29-C174 HydrophobicContact CD2-CB 4.47Å; F29-C174 VanDerWaalsContact CD2-SG 3.6Å; F29-C174 WeakPolarHBondContact CE1-SG 3.2Å; F29-C174 HydrophobicContact CE2-CB 4.04Å; F29-C174 WeakPolarHBondContact CE2-SG 3.46Å; F29-C174 VanDerWaalsContact CG-SG 3.57Å; F29-C174 HydrophobicContact CZ-CB 4.08Å; F29-C174 WeakPolarHBondContact CZ-SG 3.28Å
30	K	63.6	Low	65.3	Low	151 Å²	151	84 Å²	84	66%	0.657	41%	0.409	S	S	*	.	H	α-helix	trans	-61.2	-24.5	174.4	-72.3	-170.2	176	-174.1	0	113.1	L26 R28 R100	L26-K30 PolarHBondContact O-N 3.08Å; R28-K30 PolarHBondContact O-N 3.24Å; K30-R100 PolarHBondContact O-NH2 3.36Å
31	K	66.7	Low	67.4	Low	129 Å²	129	76.5 Å²	76.5	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-76.7	-37.7	174.9	-70.5	179.4	177.6	-168.7	0	111.8	T27 R28 F29 R100	T27-K31 WeakPolarHBondContact O-CG 3.34Å; R28-K31 WeakPolarHBondContact O-CA 3.41Å; R28-K31 WeakPolarHBondContact O-CB 2.93Å; R28-K31 PolarHBondContact O-N 2.97Å; F29-K31 PolarHBondContact O-N 3.42Å; K31-R100 WeakPolarHBondContact O-CG 3.34Å; K31-R100 PolarHBondContact O-NE 2.87Å
32	I	72.4	Confident	69.5	Low	18 Å²	18	77.3 Å²	77.3	9%	0.092	38%	0.379	C	S	.	.	H	α-helix	trans	-81.7	-39.1	-174.8	-62.1	163.9	0	0	0	111.7	L10 V11 D14 R28 F29 A146 C147	L10-I32 HydrophobicContact CD2-CG2 4.08Å; V11-I32 HydrophobicContact CG1-CD1 3.86Å; V11-I32 HydrophobicContact CG2-CB 4.37Å; V11-I32 HydrophobicContact CG2-CG2 3.76Å; D14-I32 HydrophobicContact CB-CD1 3.99Å; R28-I32 PolarHBondContact O-N 3.22Å; R28-I32 VanDerWaalsContact O-N 3.15Å; F29-I32 PolarHBondContact O-N 3.06Å; F29-I32 VanDerWaalsContact O-N 3.09Å; I32-A146 CarbonylContact O-C 3.48Å; I32-A146 WeakPolarHBondContact O-CA 3.41Å; I32-A146 WeakPolarHBondContact O-CB 3.48Å; I32-C147 PolarHBondContact O-N 2.98Å
33	L	77.3	Confident	71.5	Confident	17 Å²	17	74.5 Å²	74.5	9%	0.089	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.1	-179.3	-165.3	70.3	0	0	0	111.1	A7 F29 R100 C147 L149 L170	A7-L33 HydrophobicContact CB-CD1 4.19Å; F29-L33 PolarHBondContact O-N 3.46Å; L33-R100 PolarHBondContact O-NH2 2.98Å; L33-C147 WeakPolarHBondContact CA-O 3.42Å; L33-C147 HydrophobicContact CD1-CB 4.12Å; L33-L149 HydrophobicContact CD1-CD1 3.92Å; L33-L149 HydrophobicContact CD1-CG 3.92Å; L33-L149 HydrophobicContact CD2-CD1 3.99Å; L33-L149 HydrophobicContact CG-CD1 4.31Å; L33-L170 HydrophobicContact CD2-CD1 3.26Å; L33-L170 HydrophobicContact CD2-CD2 4.24Å; L33-L170 HydrophobicContact CD2-CG 4.4Å
34	L	82.4	Confident	73.3	Confident	24 Å²	24	70.4 Å²	70.4	13%	0.126	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.4	169.9	172.8	62	0	0	0	108.9	V36 V52 V53 C147 T148 L149	L34-V36 HydrophobicContact CD1-CG2 4.34Å; L34-V36 HydrophobicContact CD2-CG2 3.97Å; L34-V36 HydrophobicContact CG-CG2 3.88Å; L34-V52 HydrophobicContact CD2-CG1 4.32Å; L34-V53 WeakPolarHBondContact CD2-O 3.16Å; L34-C147 PolarHBondContact N-O 2.95Å; L34-T148 HydrophobicContact CB-CG2 4.21Å; L34-T148 HydrophobicContact CD2-CG2 3.97Å; L34-T148 HydrophobicContact CG-CG2 3.95Å; L34-T148 CarbonylContact O-C 3.51Å; L34-T148 VanDerWaalsContact O-CA 3.24Å; L34-T148 WeakPolarHBondContact O-CA 3.37Å; L34-L149 PolarHBondContact O-N 3.41Å
35	L	84.7	Confident	75	Confident	40 Å²	40	67 Å²	67	21%	0.209	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	123.8	170.2	-77.9	148.2	0	0	0	108	L149 L151 D163 L166	L35-L149 HydrophobicContact CD2-CB 3.81Å; L35-L149 HydrophobicContact CD2-CD1 4.07Å; L35-L151 HydrophobicContact CD2-CD1 3.8Å; L35-L151 HydrophobicContact CD2-CG 4.31Å; L35-D163 WeakPolarHBondContact CD1-OD1 3.23Å; L35-L166 HydrophobicContact CD2-CD1 4.04Å
36	V	87.1	Confident	76.5	Confident	20 Å²	20	65.4 Å²	65.4	12%	0.121	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116	174.7	179.1	0	0	0	0	107.9	L34 I38 V53 F135 T148 L149 L150 L151	L34-V36 HydrophobicContact CD1-CG2 4.34Å; L34-V36 HydrophobicContact CD2-CG2 3.97Å; L34-V36 HydrophobicContact CG-CG2 3.88Å; V36-I38 HydrophobicContact CG1-CD1 4.48Å; V36-I38 HydrophobicContact CG1-CG1 4.04Å; V36-V53 HydrophobicContact CG2-CB 4.3Å; V36-F135 HydrophobicContact CG1-CE1 4.14Å; V36-T148 HydrophobicContact CB-CG2 4.26Å; V36-T148 HydrophobicContact CG2-CG2 3.55Å; V36-L149 PolarHBondContact N-O 3.37Å; V36-L150 HydrophobicContact CB-CD1 3.85Å; V36-L150 HydrophobicContact CG1-CD1 3.7Å; V36-L151 PolarHBondContact O-N 2.89Å
37	L	88.3	Confident	78	Confident	66 Å²	66	67.5 Å²	67.5	35%	0.346	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.4	178.5	-52.1	179.5	0	0	0	108.5	L151 L159 D163	L37-L151 HydrophobicContact CD2-CB 4Å; L37-L151 HydrophobicContact CD2-CD1 3.74Å; L37-L151 HydrophobicContact CD2-CG 4.34Å; L37-L159 HydrophobicContact CB-CB 4.44Å; L37-L159 HydrophobicContact CB-CD1 4.38Å; L37-L159 HydrophobicContact CD1-CB 4.45Å; L37-L159 HydrophobicContact CD2-CB 4.36Å; L37-L159 HydrophobicContact CD2-CD2 4.5Å; L37-D163 HydrophobicContact CD1-CB 4.31Å; L37-D163 HydrophobicContact CD2-CB 4.34Å
38	I	88.2	Confident	79.2	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.8	175.4	-61.4	-171.6	0	0	0	108.6	V36 C40 I130 F135 L150 L151 R152 S153 L159	V36-I38 HydrophobicContact CG1-CD1 4.48Å; V36-I38 HydrophobicContact CG1-CG1 4.04Å; I38-C40 HydrophobicContact CG2-CB 4.23Å; I38-C40 PolarHBondContact O-N 3.4Å; I38-I130 HydrophobicContact CD1-CB 4.37Å; I38-I130 HydrophobicContact CD1-CD1 3.57Å; I38-I130 HydrophobicContact CD1-CG2 4.09Å; I38-I130 HydrophobicContact CG2-CG2 3.69Å; I38-F135 HydrophobicContact CD1-CD1 4.5Å; I38-F135 HydrophobicContact CD1-CD2 4.26Å; I38-F135 HydrophobicContact CD1-CE1 4.08Å; I38-F135 HydrophobicContact CD1-CE2 3.82Å; I38-F135 HydrophobicContact CD1-CZ 3.71Å; I38-F135 HydrophobicContact CG1-CE1 4.35Å; I38-F135 HydrophobicContact CG1-CE2 4.44Å; I38-F135 HydrophobicContact CG1-CZ 3.94Å; I38-L150 HydrophobicContact CD1-CD1 3.44Å; I38-L150 VanDerWaalsContact CD1-CD1 3.44Å; I38-L150 HydrophobicContact CD1-CD2 4.39Å; I38-L150 HydrophobicContact CD1-CG 4.21Å; I38-L150 HydrophobicContact CG1-CD1 3.88Å; I38-L151 PolarHBondContact N-O 3.12Å; I38-R152 HydrophobicContact CB-CG 4.14Å; I38-S153 PolarHBondContact O-N 3.23Å; I38-L159 WeakPolarHBondContact O-CD1 3.39Å
39	P	84.2	Confident	80.5	Confident	52 Å²	52	60 Å²	60	34%	0.338	31%	0.308	S	S	.	.	S	Bend	trans	-77	31.8	-176.3	34.6	-38.1	0	0	0	113.9	S153 R156 L159	P39-S153 CarbonylContact C-O 3.22Å; P39-S153 WeakPolarHBondContact CA-O 3.45Å; P39-R156 HydrophobicContact CB-CG 3.73Å; P39-L159 HydrophobicContact CB-CD1 4.42Å
40	C	84.2	Confident	81.3	Confident	61 Å²	61	62.6 Å²	62.6	41%	0.412	32%	0.319	S	S	.	.	S	Bend	trans	-143.9	145.3	-178.9	-61	0	0	0	0	110.1	I38 R152 S153	I38-C40 HydrophobicContact CG2-CB 4.23Å; I38-C40 PolarHBondContact O-N 3.4Å; C40-R152 WeakPolarHBondContact O-CB 3.16Å; C40-S153 PolarHBondContact N-O 2.86Å
41	G	83.9	Confident	82.2	Confident	31 Å²	31	55.4 Å²	55.4	32%	0.32	29%	0.288	S	S	.	.	S	Bend	trans	98.5	178.4	179	0	0	0	0	0	113.5	S153 S154	G41-S153 CarbonylContact O-C 3.34Å; G41-S153 VanDerWaalsContact O-C 3.22Å; G41-S153 WeakPolarHBondContact O-CA 3.36Å; G41-S154 PolarHBondContact O-N 3.2Å; G41-S154 VanDerWaalsContact O-N 3.07Å
42	Q	84.9	Confident	83.1	Confident	118 Å²	118	49.4 Å²	49.4	55%	0.551	26%	0.262	S	S	*	.			trans	-91.4	161.5	175	-61.4	-59.7	-47.1	0	0	109.8	E44 D45 R152	Q42-E44 PolarHBondContact O-N 2.87Å; Q42-D45 PolarHBondContact N-OD2 2.83Å; Q42-D45 WeakPolarHBondContact O-CB 3.38Å; Q42-D45 PolarHBondContact O-N 3.32Å; Q42-D45 VanDerWaalsContact O-N 3.07Å; Q42-R152 WeakPolarHBondContact O-CB 3.46Å
43	I	81.2	Confident	83.8	Confident	83 Å²	83	48.8 Å²	48.8	43%	0.426	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-61	-31.4	178	-63	170.5	0	0	0	111.2	D45 S46 R152 I158 M162	I43-D45 PolarHBondContact O-N 3.37Å; I43-S46 WeakPolarHBondContact O-CB 3.22Å; I43-S46 PolarHBondContact O-N 3.29Å; I43-S46 VanDerWaalsContact O-N 3.11Å; I43-S46 PolarHBondContact O-OG 3.11Å; I43-R152 VanDerWaalsContact CA-O 3.27Å; I43-R152 WeakPolarHBondContact CA-O 3.13Å; I43-I158 HydrophobicContact CD1-CG2 4.44Å; I43-M162 HydrophobicContact CG2-CE 4.07Å
44	E	82.2	Confident	84.3	Confident	153 Å²	153	48.3 Å²	48.3	72%	0.715	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-60.9	-26.1	176.7	-64	173.8	179.3	0	0	113	Q42 S46	Q42-E44 PolarHBondContact O-N 2.87Å; E44-S46 PolarHBondContact O-N 3.34Å
45	D	83.7	Confident	84.4	Confident	67 Å²	67	51.9 Å²	51.9	36%	0.358	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-78.8	-2.1	179.1	-61.1	-47.2	0	0	0	113.2	Q42 I43 R152	Q42-D45 PolarHBondContact N-OD2 2.83Å; Q42-D45 WeakPolarHBondContact O-CB 3.38Å; Q42-D45 PolarHBondContact O-N 3.32Å; Q42-D45 VanDerWaalsContact O-N 3.07Å; I43-D45 PolarHBondContact O-N 3.37Å; D45-R152 HydrophobicContact CB-CB 4.28Å; D45-R152 VanDerWaalsContact O-CZ 3.24Å; D45-R152 PolarHBondContact O-NE 2.99Å; D45-R152 PolarHBondContact O-NH2 3.47Å
46	S	82.5	Confident	84.1	Confident	12 Å²	12	52.6 Å²	52.6	8%	0.084	28%	0.277	C	S	.	.			trans	-68	135.3	178.5	-58.1	0	0	0	0	110.8	M3 I43 E44 L150 R152	M3-S46 VanDerWaalsContact SD-O 3.36Å; I43-S46 WeakPolarHBondContact O-CB 3.22Å; I43-S46 PolarHBondContact O-N 3.29Å; I43-S46 VanDerWaalsContact O-N 3.11Å; I43-S46 PolarHBondContact O-OG 3.11Å; E44-S46 PolarHBondContact O-N 3.34Å; S46-L150 CarbonylContact C-O 3.53Å; S46-L150 WeakPolarHBondContact CA-O 3.49Å; S46-L150 VanDerWaalsContact CB-O 3.24Å; S46-L150 WeakPolarHBondContact CB-O 3.22Å; S46-R152 PolarHBondContact OG-N 3.11Å
47	K	83.9	Confident	83.3	Confident	125 Å²	125	56 Å²	56	54%	0.543	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	145.5	-173.5	-68.8	179.4	-177.1	-178.3	0	111.5	L150	K47-L150 PolarHBondContact N-O 3.29Å; K47-L150 WeakPolarHBondContact O-CB 3.19Å; K47-L150 PolarHBondContact O-N 3.41Å
48	S	82.1	Confident	82.2	Confident	35 Å²	35	53.1 Å²	53.1	25%	0.245	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.6	166.7	58.6	0	0	0	0	110.2	M3	M3-S48 WeakPolarHBondContact CA-OG 3.44Å
49	I	83.5	Confident	81	Confident	20 Å²	20	56 Å²	56	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	129.7	179.4	-66.3	152.2	0	0	0	108.9	G51 V53 F137 I139 C147 T148 L150	I49-G51 PolarHBondContact O-N 3.27Å; I49-G51 VanDerWaalsContact O-N 3.09Å; I49-V53 HydrophobicContact CD1-CG2 3.89Å; I49-F137 HydrophobicContact CD1-CD1 3.55Å; I49-F137 HydrophobicContact CD1-CE1 3.47Å; I49-F137 VanDerWaalsContact CD1-CE1 3.47Å; I49-I139 HydrophobicContact CG2-CG1 4.07Å; I49-C147 WeakPolarHBondContact O-CA 3.34Å; I49-C147 PolarHBondContact O-SG 2.83Å; I49-T148 PolarHBondContact N-O 2.87Å; I49-T148 PolarHBondContact O-N 3.42Å; I49-L150 HydrophobicContact CD1-CB 4.44Å
50	K	80.4	Confident	79.8	Confident	88 Å²	88	56 Å²	56	38%	0.383	30%	0.296	S	S	.	.	S	Bend	trans	-80.3	87.5	171.8	-67.5	179.6	-175.8	172.5	0	108.6	N140 A144	K50-N140 PolarHBondContact O-N 3.25Å; K50-A144 HydrophobicContact CB-CB 4.19Å
51	G	81.8	Confident	78.5	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154	-163.5	-173.8	0	0	0	0	0	113.2	I49 V138 A146 C147 T148	I49-G51 PolarHBondContact O-N 3.27Å; I49-G51 VanDerWaalsContact O-N 3.09Å; G51-V138 CarbonylContact C-O 3.52Å; G51-V138 WeakPolarHBondContact CA-O 3.36Å; G51-A146 WeakPolarHBondContact CA-O 3.42Å; G51-A146 PolarHBondContact N-O 3.09Å; G51-C147 CarbonylContact O-C 3.6Å; G51-T148 PolarHBondContact O-N 3.4Å; G51-T148 PolarHBondContact O-OG1 2.8Å
52	V	85.9	Confident	76.9	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.012	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.5	-175.7	-175.9	0	0	0	0	109.2	L34 L54 R100 L101 V138 A146 T148	L34-V52 HydrophobicContact CD2-CG1 4.32Å; V52-L54 HydrophobicContact CG1-CD2 3.79Å; V52-L54 HydrophobicContact CG1-CG 4.3Å; V52-R100 HydrophobicContact CG2-CB 3.73Å; V52-L101 HydrophobicContact CB-CD2 3.8Å; V52-L101 HydrophobicContact CB-CG 4.31Å; V52-L101 HydrophobicContact CG1-CD2 4.27Å; V52-L101 HydrophobicContact CG1-CG 4.37Å; V52-L101 HydrophobicContact CG2-CD2 4Å; V52-L101 HydrophobicContact CG2-CG 4.26Å; V52-V138 PolarHBondContact N-O 3.45Å; V52-V138 VanDerWaalsContact N-O 3.09Å; V52-V138 PolarHBondContact O-N 3.08Å; V52-A146 HydrophobicContact CG2-CB 4.05Å; V52-T148 WeakPolarHBondContact CA-OG1 3.49Å
53	V	88.1	Confident	75.3	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.036	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	127.3	171.2	-175.9	0	0	0	0	109	L34 V36 I49 F135 T136 F137 T148	L34-V53 WeakPolarHBondContact CD2-O 3.16Å; V36-V53 HydrophobicContact CG2-CB 4.3Å; I49-V53 HydrophobicContact CD1-CG2 3.89Å; V53-F135 HydrophobicContact CG1-CB 4.17Å; V53-F135 HydrophobicContact CG1-CD1 3.92Å; V53-F135 HydrophobicContact CG1-CG 4.48Å; V53-T136 WeakPolarHBondContact CA-O 3.32Å; V53-F137 HydrophobicContact CB-CD1 4.4Å; V53-F137 HydrophobicContact CB-CE1 4.39Å; V53-F137 HydrophobicContact CG1-CD1 4.1Å; V53-F137 HydrophobicContact CG1-CE1 3.8Å; V53-F137 HydrophobicContact CG1-CZ 4.08Å; V53-F137 HydrophobicContact CG2-CD1 3.5Å; V53-F137 HydrophobicContact CG2-CE1 3.62Å; V53-F137 HydrophobicContact CG2-CG 4.46Å; V53-T148 HydrophobicContact CB-CG2 3.89Å; V53-T148 HydrophobicContact CG2-CG2 3.61Å; V53-T148 PolarHBondContact N-OG1 3.15Å
54	L	87.3	Confident	74	Confident	6 Å²	6	64.9 Å²	64.9	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.2	178.8	-58.3	177.3	0	0	0	110	V52 K56 F69 I90 D97 L101 F135 T136	V52-L54 HydrophobicContact CG1-CD2 3.79Å; V52-L54 HydrophobicContact CG1-CG 4.3Å; L54-K56 PolarHBondContact O-N 3.45Å; L54-F69 HydrophobicContact CD1-CD1 3.94Å; L54-F69 HydrophobicContact CD1-CE1 3.67Å; L54-I90 HydrophobicContact CD1-CD1 4.41Å; L54-I90 HydrophobicContact CD1-CG2 4.28Å; L54-D97 HydrophobicContact CD2-CB 3.87Å; L54-L101 HydrophobicContact CD1-CD1 4.19Å; L54-F135 WeakPolarHBondContact O-CA 3.4Å; L54-T136 PolarHBondContact N-O 3.45Å; L54-T136 PolarHBondContact O-N 2.89Å
55	N	84.5	Confident	72.9	Confident	99 Å²	99	69 Å²	69	53%	0.529	34%	0.34	S	S	.	.			trans	-80	71.8	168.3	-178.6	-6.3	0	0	0	109.3	V133 F135	N55-V133 WeakPolarHBondContact OD1-CG1 3.13Å; N55-F135 HydrophobicContact CB-CD1 4.11Å; N55-F135 HydrophobicContact CB-CE1 3.81Å
56	K	78.4	Confident	72.3	Confident	56 Å²	56	66.9 Å²	66.9	24%	0.243	33%	0.334	C	S	.	.			trans	-149.9	142.3	171.4	-71.6	-140.4	-152.7	90.8	0	111.9	L54 I90 R91 R92 I93 T136	L54-K56 PolarHBondContact O-N 3.45Å; K56-I90 HydrophobicContact CB-CG2 4.01Å; K56-R91 WeakPolarHBondContact CD-O 3.36Å; K56-R91 WeakPolarHBondContact CE-O 3.47Å; K56-R91 PolarHBondContact NZ-O 3.31Å; K56-R92 WeakPolarHBondContact CE-O 3.47Å; K56-R92 PolarHBondContact NZ-O 2.85Å; K56-I93 VanDerWaalsContact NZ-N 3.14Å; K56-T136 PolarHBondContact O-OG1 3.43Å
57	N	69.4	Low	72.1	Confident	91 Å²	91	68.7 Å²	68.7	49%	0.487	34%	0.34	S	S	.	.			trans	-75	137.1	172.8	-55.7	7.3	0	0	0	110.2	Y134	N57-Y134 HydrophobicContact CB-CD2 4.49Å; N57-Y134 WeakPolarHBondContact ND2-CD2 3.47Å; N57-Y134 WeakPolarHBondContact OD1-CB 3.31Å; N57-Y134 WeakPolarHBondContact OD1-CD2 3.49Å
58	S	65.9	Low	71.9	Confident	6 Å²	6	66.4 Å²	66.4	4%	0.042	33%	0.334	C	S	.	.			trans	-72.3	137.1	158.8	177.1	0	0	0	0	108.4	N60 S88	S58-N60 PolarHBondContact O-N 2.88Å; S58-N60 PolarHBondContact OG-N 3.48Å; S58-N60 PolarHBondContact OG-O 3.49Å; S58-S88 WeakPolarHBondContact OG-CB 3.49Å
59	T	62.7	Low	72	Confident	63 Å²	63	67.5 Å²	67.5	39%	0.387	33%	0.334	S	S	.	.	S	Bend	trans	-72.1	-11.4	175.4	59.2	0	0	0	0	113	R91	T59-R91 VanDerWaalsContact CB-NH2 3.27Å; T59-R91 PolarHBondContact OG1-NH2 3.39Å
60	N	59.2	Low	72	Confident	54 Å²	54	67.9 Å²	67.9	29%	0.289	34%	0.338	S	S	.	.			trans	-126.3	106.5	174.7	-68.8	-50.2	0	0	0	108.9	S58 K62 R64 S88	S58-N60 PolarHBondContact O-N 2.88Å; S58-N60 PolarHBondContact OG-N 3.48Å; S58-N60 PolarHBondContact OG-O 3.49Å; N60-K62 VanDerWaalsContact C-N 3.27Å; N60-K62 PolarHBondContact O-N 3.4Å; N60-R64 PolarHBondContact ND2-NH1 3.35Å; N60-S88 PolarHBondContact O-OG 3.31Å
61	L	56	Low	72.3	Confident	112 Å²	112	67.6 Å²	67.6	59%	0.586	34%	0.338	S	S	*	.			trans	-82.9	3.3	179.6	-78.6	152.8	0	0	0	113.6	Y134	L61-Y134 HydrophobicContact CD2-CD1 4.37Å; L61-Y134 HydrophobicContact CD2-CE1 4.16Å
62	K	51.3	Low	72.5	Confident	162 Å²	162	75.9 Å²	75.9	70%	0.704	37%	0.374	S	S	*	.	S	Bend	trans	-81.5	127	175.4	-71.3	-174.4	177.4	-177.4	0	109.4	N60 R64	N60-K62 VanDerWaalsContact C-N 3.27Å; N60-K62 PolarHBondContact O-N 3.4Å; K62-R64 WeakPolarHBondContact O-CB 3.33Å; K62-R64 VanDerWaalsContact O-CG 3.23Å; K62-R64 WeakPolarHBondContact O-CG 3.45Å; K62-R64 PolarHBondContact O-N 3.37Å
63	V	50.8	Low	72.4	Confident	154 Å²	154	77.9 Å²	77.9	93%	0.933	40%	0.395	S	S	*	.			trans	-48.4	119	175.7	-174.6	0	0	0	0	109.2
64	R	55.5	Low	71.9	Confident	51 Å²	51	78.7 Å²	78.7	19%	0.192	40%	0.4	C	S	.	.			trans	-141.9	142.8	-169.8	-86.8	172.7	-173	-162.9	2.2	109.5	N60 K62 G66 M84 K85 N86	N60-R64 PolarHBondContact ND2-NH1 3.35Å; K62-R64 WeakPolarHBondContact O-CB 3.33Å; K62-R64 VanDerWaalsContact O-CG 3.23Å; K62-R64 WeakPolarHBondContact O-CG 3.45Å; K62-R64 PolarHBondContact O-N 3.37Å; R64-G66 PolarHBondContact O-N 3.39Å; R64-G66 VanDerWaalsContact O-N 3.09Å; R64-M84 PolarHBondContact NH1-O 2.85Å; R64-K85 PolarHBondContact NE-O 3.47Å; R64-K85 PolarHBondContact NH1-O 3.25Å; R64-K85 PolarHBondContact NH2-O 3.31Å; R64-N86 WeakPolarHBondContact CB-O 3.43Å
65	Y	59.1	Low	71.3	Confident	238 Å²	238	82.3 Å²	82.3	93%	0.933	42%	0.424	S	S	*	.	S	Bend	trans	-67.8	-7.6	-168.6	-62.4	-83.3	0	0	0	114.9
66	G	70.8	Confident	70.5	Confident	23 Å²	23	82.8 Å²	82.8	24%	0.237	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	154	-177.4	0	0	0	0	0	114.1	R64 I87 S88	R64-G66 PolarHBondContact O-N 3.39Å; R64-G66 VanDerWaalsContact O-N 3.09Å; G66-I87 WeakPolarHBondContact O-CA 3.28Å; G66-S88 PolarHBondContact O-N 3.45Å
67	F	76.7	Confident	69.8	Low	50 Å²	50	87 Å²	87	22%	0.219	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134	177.4	-65.1	-92.9	0	0	0	110.1	F69 S88 F125	F67-F69 HydrophobicContact CB-CE2 4.01Å; F67-F69 HydrophobicContact CB-CZ 4.22Å; F67-S88 CarbonylContact C-O 3.52Å; F67-S88 VanDerWaalsContact CA-O 3.31Å; F67-S88 WeakPolarHBondContact CA-O 3.13Å; F67-F125 HydrophobicContact CB-CE1 4.41Å; F67-F125 HydrophobicContact CD2-CB 3.84Å; F67-F125 AromaticContact CD2-CD1 3.81Å; F67-F125 HydrophobicContact CD2-CD1 3.81Å; F67-F125 AromaticContact CD2-CD2 3.55Å; F67-F125 HydrophobicContact CD2-CD2 3.55Å; F67-F125 HydrophobicContact CD2-CE1 4.2Å; F67-F125 AromaticContact CD2-CE2 3.92Å; F67-F125 HydrophobicContact CD2-CE2 3.92Å; F67-F125 AromaticContact CD2-CG 3.47Å; F67-F125 HydrophobicContact CD2-CG 3.47Å; F67-F125 VanDerWaalsContact CD2-CG 3.47Å; F67-F125 HydrophobicContact CD2-CZ 4.25Å; F67-F125 HydrophobicContact CE1-CB 4.22Å; F67-F125 HydrophobicContact CE2-CB 3.21Å; F67-F125 HydrophobicContact CE2-CD1 4.1Å; F67-F125 AromaticContact CE2-CD2 3.63Å; F67-F125 HydrophobicContact CE2-CD2 3.63Å; F67-F125 HydrophobicContact CE2-CE2 4.45Å; F67-F125 AromaticContact CE2-CG 3.41Å; F67-F125 HydrophobicContact CE2-CG 3.41Å; F67-F125 VanDerWaalsContact CE2-CG 3.41Å; F67-F125 HydrophobicContact CG-CD1 4.06Å; F67-F125 HydrophobicContact CG-CE1 4.33Å; F67-F125 HydrophobicContact CG-CG 4.17Å; F67-F125 HydrophobicContact CZ-CB 3.44Å; F67-F125 VanDerWaalsContact CZ-CB 3.44Å; F67-F125 HydrophobicContact CZ-CG 4.03Å
68	L	80.3	Confident	69.1	Low	77 Å²	77	87.1 Å²	87.1	40%	0.403	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125	173.9	-179.4	67.4	0	0	0	109.2	I87 S88 V89 I90	L68-I87 HydrophobicContact CB-CG2 3.73Å; L68-S88 PolarHBondContact N-O 3.14Å; L68-V89 HydrophobicContact CB-CG2 4.27Å; L68-V89 HydrophobicContact CD2-CG1 4.33Å; L68-V89 HydrophobicContact CD2-CG2 4.29Å; L68-V89 CarbonylContact O-C 3.59Å; L68-V89 WeakPolarHBondContact O-CA 3.47Å; L68-I90 PolarHBondContact O-N 3.49Å
69	F	84.4	Confident	68.5	Low	59 Å²	59	95.2 Å²	95.2	26%	0.259	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	118.6	178.4	-64.9	-79.7	0	0	0	108.8	L54 F67 I90 I93 L101 F125 V138	L54-F69 HydrophobicContact CD1-CD1 3.94Å; L54-F69 HydrophobicContact CD1-CE1 3.67Å; F67-F69 HydrophobicContact CB-CE2 4.01Å; F67-F69 HydrophobicContact CB-CZ 4.22Å; F69-I90 HydrophobicContact CD1-CB 4.08Å; F69-I90 HydrophobicContact CD1-CD1 3.96Å; F69-I90 HydrophobicContact CD1-CG2 4.48Å; F69-I90 HydrophobicContact CE1-CB 4.45Å; F69-I90 HydrophobicContact CE1-CD1 3.45Å; F69-I90 VanDerWaalsContact CE1-CD1 3.45Å; F69-I90 HydrophobicContact CE1-CG1 4.47Å; F69-I90 HydrophobicContact CZ-CD1 4.26Å; F69-I93 HydrophobicContact CB-CD1 3.37Å; F69-I93 HydrophobicContact CD1-CD1 3.48Å; F69-I93 VanDerWaalsContact CD1-CD1 3.48Å; F69-I93 HydrophobicContact CG-CD1 3.89Å; F69-L101 HydrophobicContact CD1-CD1 3.87Å; F69-L101 HydrophobicContact CE1-CD1 4.14Å; F69-L101 HydrophobicContact CG-CD1 4.11Å; F69-F125 HydrophobicContact CE2-CE1 4.04Å; F69-F125 HydrophobicContact CZ-CD1 4.49Å; F69-F125 AromaticContact CZ-CE1 3.83Å; F69-F125 HydrophobicContact CZ-CE1 3.83Å; F69-V138 HydrophobicContact CE1-CG2 4.21Å; F69-V138 HydrophobicContact CZ-CG2 3.79Å
70	C	84.5	Confident	68.2	Low	27 Å²	27	100.7 Å²	100.7	18%	0.182	50%	0.502	C	S	.	.			trans	-117.6	130.1	178.2	-61.8	0	0	0	0	111	K72 V74 I90 R91 R92 I93	C70-K72 VanDerWaalsContact C-N 3.31Å; C70-V74 HydrophobicContact CB-CG2 4Å; C70-I90 PolarHBondContact N-O 2.91Å; C70-R91 CarbonylContact O-C 3.59Å; C70-R92 PolarHBondContact O-N 3.46Å; C70-I93 PolarHBondContact O-N 2.92Å
71	E	86.6	Confident	68.3	Low	83 Å²	83	102.6 Å²	102.6	39%	0.388	51%	0.508	S	S	.	.	S	Bend	trans	-69.5	-32	171.5	-63.5	-167.3	162.6	0	0	111.8	R92 I93 S98	E71-R92 CarbonylContact O-C 3.57Å; E71-R92 VanDerWaalsContact O-CA 3.23Å; E71-R92 WeakPolarHBondContact O-CA 3.21Å; E71-I93 WeakPolarHBondContact CA-O 3.34Å; E71-S98 WeakPolarHBondContact OE1-CB 3.37Å; E71-S98 PolarHBondContact OE1-OG 2.99Å; E71-S98 VanDerWaalsContact OE1-OG 3.12Å
72	K	85.7	Confident	68.4	Low	175 Å²	175	101.5 Å²	101.5	76%	0.761	51%	0.507	S	S	*	.	S	Bend	trans	-88.9	168	175.6	-65.6	-174.7	-179.2	174.7	0	111.8	C70 R92	C70-K72 VanDerWaalsContact C-N 3.31Å; K72-R92 PolarHBondContact O-N 2.82Å
73	G	82.3	Confident	68.9	Low	43 Å²	43	99 Å²	99	44%	0.443	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-70.1	138.8	166.8	0	0	0	0	0	110.3
74	V	78.4	Confident	69.4	Low	24 Å²	24	94 Å²	94	15%	0.145	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-100.5	137.1	166.9	179	0	0	0	0	107.2	C70 M84 V89 R91	C70-V74 HydrophobicContact CB-CG2 4Å; V74-M84 HydrophobicContact CG1-CE 3.75Å; V74-M84 HydrophobicContact CG1-SD 4.32Å; V74-V89 HydrophobicContact CB-CG1 4.35Å; V74-V89 HydrophobicContact CG2-CG1 3.87Å; V74-R91 HydrophobicContact CB-CG 3.89Å; V74-R91 HydrophobicContact CG2-CG 4.04Å; V74-R91 WeakPolarHBondContact O-CD 3.45Å; V74-R91 VanDerWaalsContact O-CZ 3.3Å; V74-R91 PolarHBondContact O-NE 3.42Å; V74-R91 PolarHBondContact O-NH1 2.94Å
75	P	75.4	Confident	69.7	Low	82 Å²	82	97.9 Å²	97.9	53%	0.532	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-64.8	146.7	176	26.3	-33.9	0	0	0	111.3	F77	P75-F77 VanDerWaalsContact C-N 3.34Å; P75-F77 PolarHBondContact O-N 3.44Å
76	D	67.4	Low	70.1	Confident	108 Å²	108	91.9 Å²	91.9	58%	0.578	48%	0.475	S	S	*	.			trans	-78.4	-11.3	-174.5	-81.2	-58.1	0	0	0	115.2	P78 R91	D76-P78 WeakPolarHBondContact O-CD 3.26Å; D76-P78 WeakPolarHBondContact O-CG 3.39Å; D76-R91 IonicContact OD1-CZ 3.07Å; D76-R91 IonicContact OD1-NH1 3.92Å; D76-R91 PolarHBondContact OD1-NH1 2.86Å; D76-R91 IonicContact OD1-NH2 2.76Å; D76-R91 PolarHBondContact OD1-NH2 3.31Å; D76-R91 IonicContact OD2-NH1 3.09Å; D76-R91 PolarHBondContact OD2-NH1 2.94Å
77	F	62.6	Low	70.2	Confident	146 Å²	146	93.4 Å²	93.4	64%	0.64	48%	0.477	S	S	*	.			trans	-66	102.8	-172.2	-67.6	-74.9	0	0	0	111.7	P75 H79 Y80	P75-F77 VanDerWaalsContact C-N 3.34Å; P75-F77 PolarHBondContact O-N 3.44Å; F77-H79 PolarHBondContact O-N 3.24Å; F77-Y80 HydrophobicContact CB-CD2 3.97Å; F77-Y80 HydrophobicContact CB-CE2 4.38Å
78	P	55.8	Low	70.2	Confident	92 Å²	92	91.2 Å²	91.2	60%	0.597	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-16.2	-171.1	-11	27.8	0	0	0	112.7	D76 Y80	D76-P78 WeakPolarHBondContact O-CD 3.26Å; D76-P78 WeakPolarHBondContact O-CG 3.39Å; P78-Y80 PolarHBondContact O-N 3Å
79	H	53.4	Low	70.1	Confident	177 Å²	177	87.6 Å²	87.6	82%	0.819	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-28.1	-172.4	-77.4	90	0	0	0	113.4	F77	F77-H79 PolarHBondContact O-N 3.24Å
80	Y	55.9	Low	70.1	Confident	177 Å²	177	84.9 Å²	84.9	69%	0.694	44%	0.437	S	S	*	.	S	Bend	trans	-83.5	-22.2	-174.7	-71.9	-78.4	0	0	0	114	F77 P78 P82	F77-Y80 HydrophobicContact CB-CD2 3.97Å; F77-Y80 HydrophobicContact CB-CE2 4.38Å; P78-Y80 PolarHBondContact O-N 3Å; Y80-P82 WeakPolarHBondContact O-CD 3.47Å
81	F	62.3	Low	70.1	Confident	94 Å²	94	85.3 Å²	85.3	41%	0.412	44%	0.435	S	S	.	.			trans	-124.7	82.4	-172	-59.1	-74	0	0	0	110.9	V83 M84	F81-V83 PolarHBondContact O-N 2.72Å; F81-V83 VanDerWaalsContact O-N 3.15Å; F81-M84 HydrophobicContact CB-CB 4.14Å; F81-M84 HydrophobicContact CB-CE 3.88Å; F81-M84 HydrophobicContact CB-CG 3.62Å; F81-M84 HydrophobicContact CB-SD 3.69Å; F81-M84 HydrophobicContact CD1-CE 4.3Å; F81-M84 HydrophobicContact CD2-CE 3.69Å; F81-M84 HydrophobicContact CD2-SD 4.04Å; F81-M84 HydrophobicContact CE2-CE 4.31Å; F81-M84 HydrophobicContact CG-CE 3.69Å; F81-M84 HydrophobicContact CG-CG 4.47Å; F81-M84 HydrophobicContact CG-SD 4.07Å; F81-M84 WeakPolarHBondContact O-CB 3.41Å; F81-M84 PolarHBondContact O-N 3.06Å
82	P	58	Low	70.2	Confident	89 Å²	89	90.3 Å²	90.3	58%	0.578	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-58.1	-27.3	173.9	22.5	-31.5	0	0	0	112	Y80 M84 K85	Y80-P82 WeakPolarHBondContact O-CD 3.47Å; P82-M84 PolarHBondContact O-N 3.1Å; P82-K85 VanDerWaalsContact O-CB 3.25Å; P82-K85 WeakPolarHBondContact O-CB 3.42Å; P82-K85 WeakPolarHBondContact O-CG 3.16Å; P82-K85 PolarHBondContact O-N 3.27Å
83	V	61.7	Low	70.3	Confident	111 Å²	111	82.5 Å²	82.5	67%	0.673	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-59.7	-30.7	173.8	-175.6	0	0	0	0	112.2	F81 K85 I87	F81-V83 PolarHBondContact O-N 2.72Å; F81-V83 VanDerWaalsContact O-N 3.15Å; V83-K85 PolarHBondContact O-N 3.13Å; V83-I87 HydrophobicContact CG1-CD1 4.42Å
84	M	60.3	Low	70.5	Confident	48 Å²	48	87.4 Å²	87.4	24%	0.236	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-74.1	-4.7	177.3	-66.4	-177.6	-173.1	0	0	113.3	R64 V74 F81 P82 N86	R64-M84 PolarHBondContact NH1-O 2.85Å; V74-M84 HydrophobicContact CG1-CE 3.75Å; V74-M84 HydrophobicContact CG1-SD 4.32Å; F81-M84 HydrophobicContact CB-CB 4.14Å; F81-M84 HydrophobicContact CB-CE 3.88Å; F81-M84 HydrophobicContact CB-CG 3.62Å; F81-M84 HydrophobicContact CB-SD 3.69Å; F81-M84 HydrophobicContact CD1-CE 4.3Å; F81-M84 HydrophobicContact CD2-CE 3.69Å; F81-M84 HydrophobicContact CD2-SD 4.04Å; F81-M84 HydrophobicContact CE2-CE 4.31Å; F81-M84 HydrophobicContact CG-CE 3.69Å; F81-M84 HydrophobicContact CG-CG 4.47Å; F81-M84 HydrophobicContact CG-SD 4.07Å; F81-M84 WeakPolarHBondContact O-CB 3.41Å; F81-M84 PolarHBondContact O-N 3.06Å; P82-M84 PolarHBondContact O-N 3.1Å; M84-N86 PolarHBondContact O-N 3.2Å
85	K	62.4	Low	70.9	Confident	133 Å²	133	94.1 Å²	94.1	58%	0.578	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-70	-14.2	178.2	-70.8	-176.8	-180	179.7	0	114.1	R64 P82 V83	R64-K85 PolarHBondContact NE-O 3.47Å; R64-K85 PolarHBondContact NH1-O 3.25Å; R64-K85 PolarHBondContact NH2-O 3.31Å; P82-K85 VanDerWaalsContact O-CB 3.25Å; P82-K85 WeakPolarHBondContact O-CB 3.42Å; P82-K85 WeakPolarHBondContact O-CG 3.16Å; P82-K85 PolarHBondContact O-N 3.27Å; V83-K85 PolarHBondContact O-N 3.13Å
86	N	66.8	Low	71.2	Confident	112 Å²	112	94.1 Å²	94.1	60%	0.599	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-123.6	7	-179.7	-69.9	-11.9	0	0	0	113.8	R64 M84	R64-N86 WeakPolarHBondContact CB-O 3.43Å; M84-N86 PolarHBondContact O-N 3.2Å
87	I	74.1	Confident	72	Confident	55 Å²	55	90.2 Å²	90.2	28%	0.282	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136	-177.2	-56.6	173.8	0	0	0	109.3	G66 L68 V83	G66-I87 WeakPolarHBondContact O-CA 3.28Å; L68-I87 HydrophobicContact CB-CG2 3.73Å; V83-I87 HydrophobicContact CG1-CD1 4.42Å
88	S	75.8	Confident	73.1	Confident	3 Å²	3	84 Å²	84	2%	0.021	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.7	170.9	-73.4	0	0	0	0	109.3	S58 N60 G66 F67 L68	S58-S88 WeakPolarHBondContact OG-CB 3.49Å; N60-S88 PolarHBondContact O-OG 3.31Å; G66-S88 PolarHBondContact O-N 3.45Å; F67-S88 CarbonylContact C-O 3.52Å; F67-S88 VanDerWaalsContact CA-O 3.31Å; F67-S88 WeakPolarHBondContact CA-O 3.13Å; L68-S88 PolarHBondContact N-O 3.14Å
89	V	79.1	Confident	74.3	Confident	2 Å²	2	82.9 Å²	82.9	1%	0.012	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.1	-175.6	-173.4	0	0	0	0	110	L68 V74 R91	L68-V89 HydrophobicContact CB-CG2 4.27Å; L68-V89 HydrophobicContact CD2-CG1 4.33Å; L68-V89 HydrophobicContact CD2-CG2 4.29Å; L68-V89 CarbonylContact O-C 3.59Å; L68-V89 WeakPolarHBondContact O-CA 3.47Å; V74-V89 HydrophobicContact CB-CG1 4.35Å; V74-V89 HydrophobicContact CG2-CG1 3.87Å; V89-R91 HydrophobicContact CG1-CG 3.95Å
90	I	84.1	Confident	75.5	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	116.6	172.6	-63.5	166.6	0	0	0	107.8	L54 K56 L68 F69 C70 I93 T136	L54-I90 HydrophobicContact CD1-CD1 4.41Å; L54-I90 HydrophobicContact CD1-CG2 4.28Å; K56-I90 HydrophobicContact CB-CG2 4.01Å; L68-I90 PolarHBondContact O-N 3.49Å; F69-I90 HydrophobicContact CD1-CB 4.08Å; F69-I90 HydrophobicContact CD1-CD1 3.96Å; F69-I90 HydrophobicContact CD1-CG2 4.48Å; F69-I90 HydrophobicContact CE1-CB 4.45Å; F69-I90 HydrophobicContact CE1-CD1 3.45Å; F69-I90 VanDerWaalsContact CE1-CD1 3.45Å; F69-I90 HydrophobicContact CE1-CG1 4.47Å; F69-I90 HydrophobicContact CZ-CD1 4.26Å; C70-I90 PolarHBondContact N-O 2.91Å; I90-I93 HydrophobicContact CB-CD1 4.19Å; I90-I93 HydrophobicContact CG2-CD1 3.81Å; I90-I93 HydrophobicContact CG2-CG1 3.82Å; I90-T136 HydrophobicContact CD1-CG2 3.77Å
91	R	84.5	Confident	76.7	Confident	37 Å²	37	68.5 Å²	68.5	14%	0.14	33%	0.329	C	S	.	.			trans	-99.4	163.7	-171.2	-52.4	173.6	-169.9	174	13.3	110.9	K56 T59 C70 V74 D76 V89 I93	K56-R91 WeakPolarHBondContact CD-O 3.36Å; K56-R91 WeakPolarHBondContact CE-O 3.47Å; K56-R91 PolarHBondContact NZ-O 3.31Å; T59-R91 VanDerWaalsContact CB-NH2 3.27Å; T59-R91 PolarHBondContact OG1-NH2 3.39Å; C70-R91 CarbonylContact O-C 3.59Å; V74-R91 HydrophobicContact CB-CG 3.89Å; V74-R91 HydrophobicContact CG2-CG 4.04Å; V74-R91 WeakPolarHBondContact O-CD 3.45Å; V74-R91 VanDerWaalsContact O-CZ 3.3Å; V74-R91 PolarHBondContact O-NE 3.42Å; V74-R91 PolarHBondContact O-NH1 2.94Å; D76-R91 IonicContact OD1-CZ 3.07Å; D76-R91 IonicContact OD1-NH1 3.92Å; D76-R91 PolarHBondContact OD1-NH1 2.86Å; D76-R91 IonicContact OD1-NH2 2.76Å; D76-R91 PolarHBondContact OD1-NH2 3.31Å; D76-R91 IonicContact OD2-NH1 3.09Å; D76-R91 PolarHBondContact OD2-NH1 2.94Å; V89-R91 HydrophobicContact CG1-CG 3.95Å; R91-I93 PolarHBondContact O-N 3.34Å
92	R	87.2	Confident	76.7	Confident	188 Å²	188	65.2 Å²	65.2	71%	0.709	32%	0.318	S	S	*	.	S	Bend	trans	59.2	34.6	170.8	-59.2	-178.7	179.2	-103.6	1.4	115.2	K56 C70 E71 K72	K56-R92 WeakPolarHBondContact CE-O 3.47Å; K56-R92 PolarHBondContact NZ-O 2.85Å; C70-R92 PolarHBondContact O-N 3.46Å; E71-R92 CarbonylContact O-C 3.57Å; E71-R92 VanDerWaalsContact O-CA 3.23Å; E71-R92 WeakPolarHBondContact O-CA 3.21Å; K72-R92 PolarHBondContact O-N 2.82Å
93	I	88.7	Confident	77	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.051	30%	0.299	C	S	.	.			trans	-68.8	137.2	-178.1	-61.6	165.7	0	0	0	110.7	K56 F69 C70 E71 I90 R91 D97	K56-I93 VanDerWaalsContact NZ-N 3.14Å; F69-I93 HydrophobicContact CB-CD1 3.37Å; F69-I93 HydrophobicContact CD1-CD1 3.48Å; F69-I93 VanDerWaalsContact CD1-CD1 3.48Å; F69-I93 HydrophobicContact CG-CD1 3.89Å; C70-I93 PolarHBondContact O-N 2.92Å; E71-I93 WeakPolarHBondContact CA-O 3.34Å; I90-I93 HydrophobicContact CB-CD1 4.19Å; I90-I93 HydrophobicContact CG2-CD1 3.81Å; I90-I93 HydrophobicContact CG2-CG1 3.82Å; R91-I93 PolarHBondContact O-N 3.34Å; I93-D97 HydrophobicContact CG2-CB 4.02Å
94	K	87.5	Confident	76.9	Confident	147 Å²	147	59.3 Å²	59.3	64%	0.639	28%	0.284	S	S	*	.			trans	-68.1	137.7	173.8	-67.6	-179.6	178.4	176.7	0	108.2	T96 D97 S98	K94-T96 PolarHBondContact O-N 3.34Å; K94-T96 VanDerWaalsContact O-N 3.11Å; K94-D97 WeakPolarHBondContact O-CA 3.44Å; K94-D97 PolarHBondContact O-N 3.1Å; K94-S98 PolarHBondContact O-N 2.89Å
95	R	85	Confident	77.1	Confident	164 Å²	164	59.3 Å²	59.3	62%	0.619	29%	0.287	S	S	*	.	H	α-helix	trans	-51.9	-36.4	177.2	-170	173.8	-178.4	171.6	4.5	113.3	D97 S98 D99	R95-D97 VanDerWaalsContact C-N 3.29Å; R95-D97 PolarHBondContact O-N 3Å; R95-S98 WeakPolarHBondContact O-CB 3.14Å; R95-S98 PolarHBondContact O-N 3.46Å; R95-D99 PolarHBondContact O-N 3.39Å
96	T	82.6	Confident	77.9	Confident	82 Å²	82	56.2 Å²	56.2	50%	0.503	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-34.3	175.8	52.9	0	0	0	0	113.4	K94 R100	K94-T96 PolarHBondContact O-N 3.34Å; K94-T96 VanDerWaalsContact O-N 3.11Å; T96-R100 WeakPolarHBondContact O-CD 3.44Å; T96-R100 VanDerWaalsContact O-CG 3.32Å; T96-R100 WeakPolarHBondContact O-CG 3.39Å; T96-R100 PolarHBondContact O-N 3.41Å
97	D	84.9	Confident	78.6	Confident	26 Å²	26	53.2 Å²	53.2	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-82.1	-33.7	179.4	-59.2	-29.2	0	0	0	110.7	L54 I93 K94 R95 R100 L101	L54-D97 HydrophobicContact CD2-CB 3.87Å; I93-D97 HydrophobicContact CG2-CB 4.02Å; K94-D97 WeakPolarHBondContact O-CA 3.44Å; K94-D97 PolarHBondContact O-N 3.1Å; R95-D97 VanDerWaalsContact C-N 3.29Å; R95-D97 PolarHBondContact O-N 3Å; D97-R100 WeakPolarHBondContact O-CB 3.33Å; D97-R100 PolarHBondContact O-N 3.11Å; D97-R100 IonicContact OD1-NH1 3.31Å; D97-R100 PolarHBondContact OD1-NH1 3.19Å; D97-R100 VanDerWaalsContact OD1-NH1 3.09Å; D97-L101 VanDerWaalsContact O-CG 3.32Å; D97-L101 WeakPolarHBondContact O-CG 3.49Å; D97-L101 PolarHBondContact O-N 2.78Å
98	S	83.9	Confident	79.1	Confident	17 Å²	17	59.6 Å²	59.6	12%	0.119	28%	0.283	C	S	.	.	H	α-helix	trans	-55.6	-49	168.2	-170.7	0	0	0	0	111.3	E71 K94 R95 R100 L101 A102	E71-S98 WeakPolarHBondContact OE1-CB 3.37Å; E71-S98 PolarHBondContact OE1-OG 2.99Å; E71-S98 VanDerWaalsContact OE1-OG 3.12Å; K94-S98 PolarHBondContact O-N 2.89Å; R95-S98 WeakPolarHBondContact O-CB 3.14Å; R95-S98 PolarHBondContact O-N 3.46Å; S98-R100 PolarHBondContact O-N 3.36Å; S98-L101 CarbonylContact O-C 3.48Å; S98-L101 WeakPolarHBondContact O-CB 3.32Å; S98-L101 PolarHBondContact O-N 2.82Å; S98-L101 VanDerWaalsContact O-N 3.11Å; S98-A102 PolarHBondContact O-N 3.35Å
99	D	81.9	Confident	79.4	Confident	67 Å²	67	64.1 Å²	64.1	36%	0.358	31%	0.308	S	S	.	.	H	α-helix	trans	-62.1	-27.6	177.8	-72.9	-21.4	0	0	0	114	R95 A102 K145	R95-D99 PolarHBondContact O-N 3.39Å; D99-A102 WeakPolarHBondContact O-CB 3.31Å; D99-K145 PolarHBondContact O-NZ 3.36Å
100	R	79.4	Confident	79.4	Confident	36 Å²	36	69.7 Å²	69.7	14%	0.136	34%	0.344	C	S	.	.	H	α-helix	trans	-80	-36.8	175.7	-73.6	168.8	172.4	164.1	-8.8	112	K30 K31 L33 V52 T96 D97 S98 A102 A146	K30-R100 PolarHBondContact O-NH2 3.36Å; K31-R100 WeakPolarHBondContact O-CG 3.34Å; K31-R100 PolarHBondContact O-NE 2.87Å; L33-R100 PolarHBondContact O-NH2 2.98Å; V52-R100 HydrophobicContact CG2-CB 3.73Å; T96-R100 WeakPolarHBondContact O-CD 3.44Å; T96-R100 VanDerWaalsContact O-CG 3.32Å; T96-R100 WeakPolarHBondContact O-CG 3.39Å; T96-R100 PolarHBondContact O-N 3.41Å; D97-R100 WeakPolarHBondContact O-CB 3.33Å; D97-R100 PolarHBondContact O-N 3.11Å; D97-R100 IonicContact OD1-NH1 3.31Å; D97-R100 PolarHBondContact OD1-NH1 3.19Å; D97-R100 VanDerWaalsContact OD1-NH1 3.09Å; S98-R100 PolarHBondContact O-N 3.36Å; R100-A102 PolarHBondContact O-N 3.18Å; R100-A146 HydrophobicContact CB-CB 3.89Å; R100-A146 HydrophobicContact CG-CB 4.07Å
101	L	80.2	Confident	79.4	Confident	17 Å²	17	74.1 Å²	74.1	9%	0.089	38%	0.38	C	S	.	.	H	α-helix	trans	-69.8	-13.7	170.7	-68.8	166.1	0	0	0	112.3	V52 L54 F69 D97 S98 N103 A104 V138	V52-L101 HydrophobicContact CB-CD2 3.8Å; V52-L101 HydrophobicContact CB-CG 4.31Å; V52-L101 HydrophobicContact CG1-CD2 4.27Å; V52-L101 HydrophobicContact CG1-CG 4.37Å; V52-L101 HydrophobicContact CG2-CD2 4Å; V52-L101 HydrophobicContact CG2-CG 4.26Å; L54-L101 HydrophobicContact CD1-CD1 4.19Å; F69-L101 HydrophobicContact CD1-CD1 3.87Å; F69-L101 HydrophobicContact CE1-CD1 4.14Å; F69-L101 HydrophobicContact CG-CD1 4.11Å; D97-L101 VanDerWaalsContact O-CG 3.32Å; D97-L101 WeakPolarHBondContact O-CG 3.49Å; D97-L101 PolarHBondContact O-N 2.78Å; S98-L101 CarbonylContact O-C 3.48Å; S98-L101 WeakPolarHBondContact O-CB 3.32Å; S98-L101 PolarHBondContact O-N 2.82Å; S98-L101 VanDerWaalsContact O-N 3.11Å; L101-N103 CarbonylContact O-C 3.08Å; L101-N103 WeakPolarHBondContact O-CA 3.43Å; L101-N103 PolarHBondContact O-N 2.98Å; L101-A104 PolarHBondContact O-N 2.94Å; L101-V138 HydrophobicContact CD2-CB 4.12Å; L101-V138 HydrophobicContact CD2-CG1 4.03Å; L101-V138 HydrophobicContact CD2-CG2 4Å
102	A	63.5	Low	79.3	Confident	24 Å²	24	77.5 Å²	77.5	20%	0.198	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	13.8	-171.3	0	0	0	0	0	116.9	S98 D99 R100 A104 I106	S98-A102 PolarHBondContact O-N 3.35Å; D99-A102 WeakPolarHBondContact O-CB 3.31Å; R100-A102 PolarHBondContact O-N 3.18Å; A102-A104 CarbonylContact C-O 3.49Å; A102-A104 VanDerWaalsContact C-O 3.3Å; A102-A104 VanDerWaalsContact CA-O 3.27Å; A102-A104 WeakPolarHBondContact CA-O 3.22Å; A102-A104 PolarHBondContact O-N 3.42Å; A102-I106 HydrophobicContact CB-CD1 4.15Å
103	N	62.5	Low	78.9	Confident	34 Å²	34	73.4 Å²	73.4	18%	0.182	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-14.3	144.8	-76.9	-14.2	0	0	0	112.2	L101 R119 V143 K145	L101-N103 CarbonylContact O-C 3.08Å; L101-N103 WeakPolarHBondContact O-CA 3.43Å; L101-N103 PolarHBondContact O-N 2.98Å; N103-R119 WeakPolarHBondContact O-CD 3.47Å; N103-R119 PolarHBondContact O-NH1 3.5Å; N103-V143 PolarHBondContact ND2-O 3.09Å; N103-K145 PolarHBondContact ND2-N 2.97Å
104	A	60.4	Low	78.4	Confident	43 Å²	43	76.2 Å²	76.2	36%	0.355	41%	0.41	S	S	.	.	S	Bend	trans	-89.8	143.4	161.7	0	0	0	0	0	110.7	L101 A102	L101-A104 PolarHBondContact O-N 2.94Å; A102-A104 CarbonylContact C-O 3.49Å; A102-A104 VanDerWaalsContact C-O 3.3Å; A102-A104 VanDerWaalsContact CA-O 3.27Å; A102-A104 WeakPolarHBondContact CA-O 3.22Å; A102-A104 PolarHBondContact O-N 3.42Å
105	T	65.4	Low	78	Confident	48 Å²	48	77.7 Å²	77.7	29%	0.294	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-69.1	134.5	170.1	44.5	0	0	0	0	109	D117	T105-D117 VanDerWaalsContact CB-OD1 3.24Å; T105-D117 WeakPolarHBondContact CB-OD1 3.35Å; T105-D117 WeakPolarHBondContact OG1-CA 3.37Å; T105-D117 WeakPolarHBondContact OG1-CB 3.18Å; T105-D117 PolarHBondContact OG1-O 3.15Å; T105-D117 PolarHBondContact OG1-OD1 3.25Å
106	I	78.3	Confident	77.4	Confident	67 Å²	67	78 Å²	78	34%	0.344	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-92	117	176.5	-59.6	171.9	0	0	0	106.4	A102	A102-I106 HydrophobicContact CB-CD1 4.15Å
107	V	82.6	Confident	76.9	Confident	49 Å²	49	75.8 Å²	75.8	30%	0.297	41%	0.413	S	S	.	.			trans	-107	132.1	176.1	-176.6	0	0	0	0	108.1	D109 D112 L113 D117	V107-D109 WeakPolarHBondContact CG1-O 3.29Å; V107-D112 HydrophobicContact CG1-CB 4.22Å; V107-L113 HydrophobicContact CG2-CD1 4.02Å; V107-D117 HydrophobicContact CG2-CB 4.21Å
108	Y	83.8	Confident	76.2	Confident	189 Å²	189	79.4 Å²	79.4	74%	0.741	44%	0.436	S	S	*	.	S	Bend	trans	-83.6	-48	-179.1	-67	-77.4	0	0	0	111.8
109	D	82.4	Confident	75.3	Confident	99 Å²	99	83.8 Å²	83.8	53%	0.529	45%	0.45	S	S	.	.	S	Bend	trans	-104.3	125.5	-179.8	-71	-46.6	0	0	0	110.5	V107 A111 D112	V107-D109 WeakPolarHBondContact CG1-O 3.29Å; D109-A111 PolarHBondContact O-N 3.48Å; D109-A111 VanDerWaalsContact O-N 3.09Å; D109-D112 PolarHBondContact O-N 3.37Å
110	P	79	Confident	74.4	Confident	118 Å²	118	87.2 Å²	87.2	77%	0.766	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-65.3	-16.4	-177.3	27.4	-35.2	0	0	0	113.3	D112 L113	P110-D112 VanDerWaalsContact C-N 3.3Å; P110-L113 WeakPolarHBondContact O-CB 3.33Å
111	A	83.2	Confident	73.7	Confident	94 Å²	94	92 Å²	92	78%	0.777	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-71.8	-25	175.3	0	0	0	0	0	112.8	D109 L113	D109-A111 PolarHBondContact O-N 3.48Å; D109-A111 VanDerWaalsContact O-N 3.09Å; A111-L113 VanDerWaalsContact C-N 3.26Å; A111-L113 PolarHBondContact O-N 3.48Å
112	D	83.7	Confident	73.1	Confident	108 Å²	108	92.2 Å²	92.2	58%	0.578	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-87.9	4.3	-179.6	-64.2	-20.2	0	0	0	112.4	V107 D109 P110 T114	V107-D112 HydrophobicContact CG1-CB 4.22Å; D109-D112 PolarHBondContact O-N 3.37Å; P110-D112 VanDerWaalsContact C-N 3.3Å; D112-T114 PolarHBondContact O-N 3.4Å; D112-T114 VanDerWaalsContact O-N 3.15Å
113	L	78.6	Confident	73.3	Confident	103 Å²	103	93.9 Å²	93.9	54%	0.539	51%	0.509	S	S	.	.			trans	-69	113.7	-177.2	-172.2	70.3	0	0	0	110.3	V107 P110 A111 D117	V107-L113 HydrophobicContact CG2-CD1 4.02Å; P110-L113 WeakPolarHBondContact O-CB 3.33Å; A111-L113 VanDerWaalsContact C-N 3.26Å; A111-L113 PolarHBondContact O-N 3.48Å; L113-D117 HydrophobicContact CD1-CB 3.94Å
114	T	78	Confident	73.9	Confident	68 Å²	68	97.8 Å²	97.8	42%	0.417	53%	0.527	S	S	.	.			trans	-100.7	161	175.3	67.9	0	0	0	0	111.6	D112 H116 D117	D112-T114 PolarHBondContact O-N 3.4Å; D112-T114 VanDerWaalsContact O-N 3.15Å; T114-H116 PolarHBondContact O-N 3.33Å; T114-D117 PolarHBondContact N-OD2 3.43Å; T114-D117 VanDerWaalsContact N-OD2 3.14Å; T114-D117 WeakPolarHBondContact O-CB 3.27Å; T114-D117 PolarHBondContact O-N 3.18Å; T114-D117 PolarHBondContact OG1-OD2 3.39Å
115	E	77.8	Confident	74.8	Confident	179 Å²	179	99.3 Å²	99.3	84%	0.836	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-60.5	-25.4	174.5	-64	-175.8	175.1	0	0	112.4	D117 V118	E115-D117 PolarHBondContact O-N 3.15Å; E115-V118 PolarHBondContact O-N 2.87Å
116	H	73.1	Confident	75.5	Confident	169 Å²	169	99.2 Å²	99.2	78%	0.782	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-68.8	-23.3	176.4	-59.2	-55.9	0	0	0	113.4	T114	T114-H116 PolarHBondContact O-N 3.33Å
117	D	72.1	Confident	75.8	Confident	37 Å²	37	98.5 Å²	98.5	20%	0.198	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-79.3	-22.6	178.6	-67.4	-54.3	0	0	0	112.6	T105 V107 L113 T114 E115 R119	T105-D117 VanDerWaalsContact CB-OD1 3.24Å; T105-D117 WeakPolarHBondContact CB-OD1 3.35Å; T105-D117 WeakPolarHBondContact OG1-CA 3.37Å; T105-D117 WeakPolarHBondContact OG1-CB 3.18Å; T105-D117 PolarHBondContact OG1-O 3.15Å; T105-D117 PolarHBondContact OG1-OD1 3.25Å; V107-D117 HydrophobicContact CG2-CB 4.21Å; L113-D117 HydrophobicContact CD1-CB 3.94Å; T114-D117 PolarHBondContact N-OD2 3.43Å; T114-D117 VanDerWaalsContact N-OD2 3.14Å; T114-D117 WeakPolarHBondContact O-CB 3.27Å; T114-D117 PolarHBondContact O-N 3.18Å; T114-D117 PolarHBondContact OG1-OD2 3.39Å; E115-D117 PolarHBondContact O-N 3.15Å; D117-R119 PolarHBondContact O-N 3.38Å
118	V	70.2	Confident	75.8	Confident	101 Å²	101	100.4 Å²	100.4	61%	0.612	53%	0.528	S	S	*	.			trans	-74.3	96.7	177.1	-174	0	0	0	0	109	E115	E115-V118 PolarHBondContact O-N 2.87Å
119	R	65.5	Low	75.8	Confident	109 Å²	109	95.5 Å²	95.5	41%	0.411	52%	0.515	S	S	.	.			trans	-94.8	119.1	-178.9	-71.4	-176.8	176.8	177.2	5	112.4	N103 D117 K121	N103-R119 WeakPolarHBondContact O-CD 3.47Å; N103-R119 PolarHBondContact O-NH1 3.5Å; D117-R119 PolarHBondContact O-N 3.38Å; R119-K121 HydrophobicContact CB-CG 4.42Å; R119-K121 PolarHBondContact O-N 3.43Å; R119-K121 VanDerWaalsContact O-N 3.15Å
120	T	62.7	Low	75.9	Confident	139 Å²	139	91.8 Å²	91.8	85%	0.853	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	22.8	170.9	-31.5	0	0	0	0	113.4
121	K	64.3	Low	76	Confident	136 Å²	136	88.3 Å²	88.3	59%	0.591	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-16.7	-168.3	-72	-171.3	-179.7	-178.7	0	114.6	R119 N140	R119-K121 HydrophobicContact CB-CG 4.42Å; R119-K121 PolarHBondContact O-N 3.43Å; R119-K121 VanDerWaalsContact O-N 3.15Å; K121-N140 PolarHBondContact O-OD1 2.86Å
122	A	67.9	Low	75.9	Confident	22 Å²	22	91.6 Å²	91.6	18%	0.182	49%	0.485	C	S	.	.			trans	-77.3	126.3	173.4	0	0	0	0	0	109.9	F125 V138 N140	A122-F125 HydrophobicContact CB-CD2 4.07Å; A122-F125 HydrophobicContact CB-CE1 4.15Å; A122-F125 HydrophobicContact CB-CE2 3.25Å; A122-F125 HydrophobicContact CB-CZ 3.28Å; A122-V138 HydrophobicContact CB-CG1 4.44Å; A122-N140 WeakPolarHBondContact CA-OD1 3.24Å
123	S	67	Low	75.9	Confident	59 Å²	59	89 Å²	89	41%	0.413	47%	0.473	S	S	.	.	S	Bend	trans	-73.4	-45.6	178.5	40	0	0	0	0	109.8	I139 D141	S123-I139 PolarHBondContact N-O 3.31Å; S123-I139 VanDerWaalsContact N-O 3.14Å; S123-I139 PolarHBondContact OG-O 3.05Å; S123-D141 WeakPolarHBondContact CB-OD2 2.95Å; S123-D141 PolarHBondContact OG-N 3.11Å; S123-D141 PolarHBondContact OG-OD2 3.1Å
124	E	75.5	Confident	76.2	Confident	116 Å²	116	87.7 Å²	87.7	54%	0.542	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	138.3	-173.3	-60.6	-177.9	172	0	0	111.6	I139	E124-I139 HydrophobicContact CB-CB 4.24Å; E124-I139 HydrophobicContact CB-CD1 4.46Å; E124-I139 PolarHBondContact N-O 3.36Å; E124-I139 PolarHBondContact O-N 3.23Å
125	F	79.4	Confident	76.7	Confident	75 Å²	75	85 Å²	85	33%	0.329	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	113.2	168.8	-70.8	-83.4	0	0	0	107.9	F67 F69 A122 F137 V138	F67-F125 HydrophobicContact CB-CE1 4.41Å; F67-F125 HydrophobicContact CD2-CB 3.84Å; F67-F125 AromaticContact CD2-CD1 3.81Å; F67-F125 HydrophobicContact CD2-CD1 3.81Å; F67-F125 AromaticContact CD2-CD2 3.55Å; F67-F125 HydrophobicContact CD2-CD2 3.55Å; F67-F125 HydrophobicContact CD2-CE1 4.2Å; F67-F125 AromaticContact CD2-CE2 3.92Å; F67-F125 HydrophobicContact CD2-CE2 3.92Å; F67-F125 AromaticContact CD2-CG 3.47Å; F67-F125 HydrophobicContact CD2-CG 3.47Å; F67-F125 VanDerWaalsContact CD2-CG 3.47Å; F67-F125 HydrophobicContact CD2-CZ 4.25Å; F67-F125 HydrophobicContact CE1-CB 4.22Å; F67-F125 HydrophobicContact CE2-CB 3.21Å; F67-F125 HydrophobicContact CE2-CD1 4.1Å; F67-F125 AromaticContact CE2-CD2 3.63Å; F67-F125 HydrophobicContact CE2-CD2 3.63Å; F67-F125 HydrophobicContact CE2-CE2 4.45Å; F67-F125 AromaticContact CE2-CG 3.41Å; F67-F125 HydrophobicContact CE2-CG 3.41Å; F67-F125 VanDerWaalsContact CE2-CG 3.41Å; F67-F125 HydrophobicContact CG-CD1 4.06Å; F67-F125 HydrophobicContact CG-CE1 4.33Å; F67-F125 HydrophobicContact CG-CG 4.17Å; F67-F125 HydrophobicContact CZ-CB 3.44Å; F67-F125 VanDerWaalsContact CZ-CB 3.44Å; F67-F125 HydrophobicContact CZ-CG 4.03Å; F69-F125 HydrophobicContact CE2-CE1 4.04Å; F69-F125 HydrophobicContact CZ-CD1 4.49Å; F69-F125 AromaticContact CZ-CE1 3.83Å; F69-F125 HydrophobicContact CZ-CE1 3.83Å; A122-F125 HydrophobicContact CB-CD2 4.07Å; A122-F125 HydrophobicContact CB-CE1 4.15Å; A122-F125 HydrophobicContact CB-CE2 3.25Å; A122-F125 HydrophobicContact CB-CZ 3.28Å; F125-F137 WeakPolarHBondContact CA-O 3.44Å; F125-V138 HydrophobicContact CD1-CB 4.25Å; F125-V138 HydrophobicContact CD1-CG1 4.06Å; F125-V138 HydrophobicContact CD1-CG2 3.83Å; F125-V138 HydrophobicContact CE1-CB 4.07Å; F125-V138 HydrophobicContact CE1-CG1 3.46Å; F125-V138 VanDerWaalsContact CE1-CG1 3.46Å; F125-V138 HydrophobicContact CE1-CG2 3.73Å; F125-V138 HydrophobicContact CZ-CG1 4.13Å
126	C	79.8	Confident	77.1	Confident	47 Å²	47	76.5 Å²	76.5	32%	0.318	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	138.9	178.2	-169.2	0	0	0	0	109.4	E128 T136 F137	C126-E128 WeakPolarHBondContact SG-CG 3.35Å; C126-T136 CarbonylContact O-C 3.53Å; C126-F137 HydrophobicContact CB-CB 4.24Å; C126-F137 PolarHBondContact N-O 2.86Å; C126-F137 PolarHBondContact O-N 3.39Å
127	I	84.2	Confident	77.7	Confident	51 Å²	51	68.9 Å²	68.9	26%	0.262	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	111.2	167.2	-59.3	173.7	0	0	0	105.7	Y134 F135 T136	I127-Y134 HydrophobicContact CG2-CD1 4.05Å; I127-F135 WeakPolarHBondContact CA-O 3.49Å; I127-T136 HydrophobicContact CG1-CG2 4.3Å
128	E	83.5	Confident	78.3	Confident	90 Å²	90	67.3 Å²	67.3	42%	0.421	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140.5	175.5	-51	-175.3	163.2	0	0	109.3	C126 F135 F137	C126-E128 WeakPolarHBondContact SG-CG 3.35Å; E128-F135 PolarHBondContact N-O 2.83Å; E128-F135 PolarHBondContact O-N 3.39Å; E128-F137 HydrophobicContact CB-CD2 4.24Å; E128-F137 HydrophobicContact CB-CE2 3.77Å; E128-F137 HydrophobicContact CG-CD2 3.9Å; E128-F137 HydrophobicContact CG-CE2 3.82Å
129	N	84.1	Confident	79	Confident	86 Å²	86	64.1 Å²	64.1	46%	0.46	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	122.3	167.7	-172.4	12.8	0	0	0	108.6	G131 V133 Y134	N129-G131 PolarHBondContact ND2-O 3.45Å; N129-G131 PolarHBondContact OD1-O 3.2Å; N129-V133 PolarHBondContact OD1-N 3.41Å; N129-V133 PolarHBondContact OD1-O 3.31Å; N129-V133 VanDerWaalsContact OD1-O 3.11Å; N129-Y134 HydrophobicContact CB-CD1 4.08Å; N129-Y134 HydrophobicContact CB-CE1 4.05Å
130	I	84.6	Confident	79.6	Confident	20 Å²	20	59.6 Å²	59.6	10%	0.103	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	105	174.5	-53.7	173.8	0	0	0	107.3	I38 D132 V133 F135 F137	I38-I130 HydrophobicContact CD1-CB 4.37Å; I38-I130 HydrophobicContact CD1-CD1 3.57Å; I38-I130 HydrophobicContact CD1-CG2 4.09Å; I38-I130 HydrophobicContact CG2-CG2 3.69Å; I130-D132 PolarHBondContact O-N 2.95Å; I130-V133 PolarHBondContact N-O 2.99Å; I130-V133 PolarHBondContact O-N 2.86Å; I130-F135 HydrophobicContact CB-CD2 3.77Å; I130-F135 HydrophobicContact CB-CE2 3.87Å; I130-F135 HydrophobicContact CD1-CB 4.5Å; I130-F135 HydrophobicContact CD1-CD2 3.87Å; I130-F135 HydrophobicContact CD1-CE2 4.43Å; I130-F135 HydrophobicContact CD1-CG 4.32Å; I130-F135 HydrophobicContact CG1-CD2 3.96Å; I130-F137 HydrophobicContact CD1-CE2 4.34Å; I130-F137 HydrophobicContact CD1-CZ 3.92Å
131	G	80	Confident	80	Confident	46 Å²	46	57.4 Å²	57.4	47%	0.474	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	-121.3	-168.9	0	0	0	0	0	110.9	N129	N129-G131 PolarHBondContact ND2-O 3.45Å; N129-G131 PolarHBondContact OD1-O 3.2Å
132	D	81.2	Confident	80.2	Confident	163 Å²	163	60.5 Å²	60.5	87%	0.872	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	10.9	179.6	-58.7	-41.3	0	0	0	112.8	I130	I130-D132 PolarHBondContact O-N 2.95Å
133	V	84.8	Confident	80.3	Confident	53 Å²	53	64.5 Å²	64.5	32%	0.321	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	129.1	-169.8	-177.9	0	0	0	0	110.2	N55 N129 I130 F135	N55-V133 WeakPolarHBondContact OD1-CG1 3.13Å; N129-V133 PolarHBondContact OD1-N 3.41Å; N129-V133 PolarHBondContact OD1-O 3.31Å; N129-V133 VanDerWaalsContact OD1-O 3.11Å; I130-V133 PolarHBondContact N-O 2.99Å; I130-V133 PolarHBondContact O-N 2.86Å; V133-F135 HydrophobicContact CB-CE2 3.86Å; V133-F135 HydrophobicContact CB-CZ 4.4Å; V133-F135 HydrophobicContact CG1-CD2 4.27Å; V133-F135 HydrophobicContact CG1-CE2 3.75Å; V133-F135 HydrophobicContact CG1-CZ 3.95Å; V133-F135 WeakPolarHBondContact O-CD2 3.5Å
134	Y	84.8	Confident	80.4	Confident	76 Å²	76	62 Å²	62	30%	0.298	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	125.8	173.8	-60.2	-89.7	0	0	0	110.9	N57 L61 I127 N129	N57-Y134 HydrophobicContact CB-CD2 4.49Å; N57-Y134 WeakPolarHBondContact ND2-CD2 3.47Å; N57-Y134 WeakPolarHBondContact OD1-CB 3.31Å; N57-Y134 WeakPolarHBondContact OD1-CD2 3.49Å; L61-Y134 HydrophobicContact CD2-CD1 4.37Å; L61-Y134 HydrophobicContact CD2-CE1 4.16Å; I127-Y134 HydrophobicContact CG2-CD1 4.05Å; N129-Y134 HydrophobicContact CB-CD1 4.08Å; N129-Y134 HydrophobicContact CB-CE1 4.05Å
135	F	87.5	Confident	80.2	Confident	12 Å²	12	60.6 Å²	60.6	5%	0.053	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.7	172.6	-69.4	-89.1	0	0	0	109.1	V36 I38 V53 L54 N55 I127 E128 I130 V133 F137	V36-F135 HydrophobicContact CG1-CE1 4.14Å; I38-F135 HydrophobicContact CD1-CD1 4.5Å; I38-F135 HydrophobicContact CD1-CD2 4.26Å; I38-F135 HydrophobicContact CD1-CE1 4.08Å; I38-F135 HydrophobicContact CD1-CE2 3.82Å; I38-F135 HydrophobicContact CD1-CZ 3.71Å; I38-F135 HydrophobicContact CG1-CE1 4.35Å; I38-F135 HydrophobicContact CG1-CE2 4.44Å; I38-F135 HydrophobicContact CG1-CZ 3.94Å; V53-F135 HydrophobicContact CG1-CB 4.17Å; V53-F135 HydrophobicContact CG1-CD1 3.92Å; V53-F135 HydrophobicContact CG1-CG 4.48Å; L54-F135 WeakPolarHBondContact O-CA 3.4Å; N55-F135 HydrophobicContact CB-CD1 4.11Å; N55-F135 HydrophobicContact CB-CE1 3.81Å; I127-F135 WeakPolarHBondContact CA-O 3.49Å; E128-F135 PolarHBondContact N-O 2.83Å; E128-F135 PolarHBondContact O-N 3.39Å; I130-F135 HydrophobicContact CB-CD2 3.77Å; I130-F135 HydrophobicContact CB-CE2 3.87Å; I130-F135 HydrophobicContact CD1-CB 4.5Å; I130-F135 HydrophobicContact CD1-CD2 3.87Å; I130-F135 HydrophobicContact CD1-CE2 4.43Å; I130-F135 HydrophobicContact CD1-CG 4.32Å; I130-F135 HydrophobicContact CG1-CD2 3.96Å; V133-F135 HydrophobicContact CB-CE2 3.86Å; V133-F135 HydrophobicContact CB-CZ 4.4Å; V133-F135 HydrophobicContact CG1-CD2 4.27Å; V133-F135 HydrophobicContact CG1-CE2 3.75Å; V133-F135 HydrophobicContact CG1-CZ 3.95Å; V133-F135 WeakPolarHBondContact O-CD2 3.5Å; F135-F137 HydrophobicContact CB-CD2 4.31Å; F135-F137 HydrophobicContact CB-CE2 3.52Å; F135-F137 HydrophobicContact CB-CZ 3.92Å
136	T	86.2	Confident	80.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	119.5	168.9	-54.1	0	0	0	0	108.9	V53 L54 K56 I90 C126 I127 V138	V53-T136 WeakPolarHBondContact CA-O 3.32Å; L54-T136 PolarHBondContact N-O 3.45Å; L54-T136 PolarHBondContact O-N 2.89Å; K56-T136 PolarHBondContact O-OG1 3.43Å; I90-T136 HydrophobicContact CD1-CG2 3.77Å; C126-T136 CarbonylContact O-C 3.53Å; I127-T136 HydrophobicContact CG1-CG2 4.3Å; T136-V138 HydrophobicContact CG2-CG2 4.4Å
137	F	86.7	Confident	80.2	Confident	8 Å²	8	55 Å²	55	4%	0.035	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.6	173.8	-63.9	-93	0	0	0	109.3	I49 V53 F125 C126 E128 I130 F135 L150	I49-F137 HydrophobicContact CD1-CD1 3.55Å; I49-F137 HydrophobicContact CD1-CE1 3.47Å; I49-F137 VanDerWaalsContact CD1-CE1 3.47Å; V53-F137 HydrophobicContact CB-CD1 4.4Å; V53-F137 HydrophobicContact CB-CE1 4.39Å; V53-F137 HydrophobicContact CG1-CD1 4.1Å; V53-F137 HydrophobicContact CG1-CE1 3.8Å; V53-F137 HydrophobicContact CG1-CZ 4.08Å; V53-F137 HydrophobicContact CG2-CD1 3.5Å; V53-F137 HydrophobicContact CG2-CE1 3.62Å; V53-F137 HydrophobicContact CG2-CG 4.46Å; F125-F137 WeakPolarHBondContact CA-O 3.44Å; C126-F137 HydrophobicContact CB-CB 4.24Å; C126-F137 PolarHBondContact N-O 2.86Å; C126-F137 PolarHBondContact O-N 3.39Å; E128-F137 HydrophobicContact CB-CD2 4.24Å; E128-F137 HydrophobicContact CB-CE2 3.77Å; E128-F137 HydrophobicContact CG-CD2 3.9Å; E128-F137 HydrophobicContact CG-CE2 3.82Å; I130-F137 HydrophobicContact CD1-CE2 4.34Å; I130-F137 HydrophobicContact CD1-CZ 3.92Å; F135-F137 HydrophobicContact CB-CD2 4.31Å; F135-F137 HydrophobicContact CB-CE2 3.52Å; F135-F137 HydrophobicContact CB-CZ 3.92Å; F137-L150 HydrophobicContact CE1-CD2 4.39Å
138	V	84.8	Confident	80.2	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.024	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	104.5	172.1	-178.1	0	0	0	0	107.6	G51 V52 F69 L101 A122 F125 T136	G51-V138 CarbonylContact C-O 3.52Å; G51-V138 WeakPolarHBondContact CA-O 3.36Å; V52-V138 PolarHBondContact N-O 3.45Å; V52-V138 VanDerWaalsContact N-O 3.09Å; V52-V138 PolarHBondContact O-N 3.08Å; F69-V138 HydrophobicContact CE1-CG2 4.21Å; F69-V138 HydrophobicContact CZ-CG2 3.79Å; L101-V138 HydrophobicContact CD2-CB 4.12Å; L101-V138 HydrophobicContact CD2-CG1 4.03Å; L101-V138 HydrophobicContact CD2-CG2 4Å; A122-V138 HydrophobicContact CB-CG1 4.44Å; F125-V138 HydrophobicContact CD1-CB 4.25Å; F125-V138 HydrophobicContact CD1-CG1 4.06Å; F125-V138 HydrophobicContact CD1-CG2 3.83Å; F125-V138 HydrophobicContact CE1-CB 4.07Å; F125-V138 HydrophobicContact CE1-CG1 3.46Å; F125-V138 VanDerWaalsContact CE1-CG1 3.46Å; F125-V138 HydrophobicContact CE1-CG2 3.73Å; F125-V138 HydrophobicContact CZ-CG1 4.13Å; T136-V138 HydrophobicContact CG2-CG2 4.4Å
139	I	84	Confident	80.3	Confident	35 Å²	35	49 Å²	49	18%	0.179	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.6	-175.7	-53.8	177.9	0	0	0	109.5	I49 S123 E124	I49-I139 HydrophobicContact CG2-CG1 4.07Å; S123-I139 PolarHBondContact N-O 3.31Å; S123-I139 VanDerWaalsContact N-O 3.14Å; S123-I139 PolarHBondContact OG-O 3.05Å; E124-I139 HydrophobicContact CB-CB 4.24Å; E124-I139 HydrophobicContact CB-CD1 4.46Å; E124-I139 PolarHBondContact N-O 3.36Å; E124-I139 PolarHBondContact O-N 3.23Å
140	N	79.2	Confident	80.5	Confident	14 Å²	14	45.1 Å²	45.1	8%	0.075	24%	0.239	C	C	.	.			trans	-128.3	101.3	178.5	-76.5	-46	0	0	0	109.1	K50 K121 A122 A144	K50-N140 PolarHBondContact O-N 3.25Å; K121-N140 PolarHBondContact O-OD1 2.86Å; A122-N140 WeakPolarHBondContact CA-OD1 3.24Å; N140-A144 HydrophobicContact CB-CB 4.03Å
141	D	69.5	Low	80.6	Confident	93 Å²	93	44.7 Å²	44.7	50%	0.497	24%	0.237	S	C	.	.	S	Bend	trans	-76.4	-31	-175.2	-65.2	-47	0	0	0	114.4	S123	S123-D141 WeakPolarHBondContact CB-OD2 2.95Å; S123-D141 PolarHBondContact OG-N 3.11Å; S123-D141 PolarHBondContact OG-OD2 3.1Å
142	K	69.2	Low	81	Confident	200 Å²	200	44.5 Å²	44.5	87%	0.87	22%	0.222	S	C	*	.	S	Bend	trans	-79.9	-58.9	-170	-65.1	-176	-179.9	179	0	112.8
143	V	69.4	Low	81.4	Confident	107 Å²	107	36.9 Å²	36.9	65%	0.648	18%	0.181	S	C	*	.			trans	-146.2	92.7	-178.7	-177.8	0	0	0	0	107.2	N103	N103-V143 PolarHBondContact ND2-O 3.09Å
144	A	69.3	Low	81.6	Confident	7 Å²	7	38.4 Å²	38.4	6%	0.058	19%	0.194	C	C	.	.			trans	-86	130.7	172.8	0	0	0	0	0	109.3	L10 K50 N140 A146	L10-A144 HydrophobicContact CD1-CB 3.99Å; L10-A144 VanDerWaalsContact CD1-O 3.32Å; L10-A144 WeakPolarHBondContact CD1-O 3.45Å; L10-A144 HydrophobicContact CD2-CB 4.39Å; L10-A144 WeakPolarHBondContact CD2-O 3.36Å; L10-A144 WeakPolarHBondContact CG-O 3.4Å; K50-A144 HydrophobicContact CB-CB 4.19Å; N140-A144 HydrophobicContact CB-CB 4.03Å; A144-A146 VanDerWaalsContact C-N 3.26Å; A144-A146 WeakPolarHBondContact CB-O 3.23Å
145	K	72.4	Confident	81.7	Confident	85 Å²	85	38 Å²	38	37%	0.37	20%	0.197	S	C	.	.	S	Bend	trans	-78.1	-15.8	171.2	-171.1	-178.2	176.5	-165	0	112.4	D99 N103	D99-K145 PolarHBondContact O-NZ 3.36Å; N103-K145 PolarHBondContact ND2-N 2.97Å
146	A	77.3	Confident	81.8	Confident	2 Å²	2	45.8 Å²	45.8	2%	0.017	23%	0.226	C	C	.	.			trans	-139.5	147	-178.7	0	0	0	0	0	110.7	L10 I32 G51 V52 R100 A144	L10-A146 VanDerWaalsContact CD2-C 3.43Å; I32-A146 CarbonylContact O-C 3.48Å; I32-A146 WeakPolarHBondContact O-CA 3.41Å; I32-A146 WeakPolarHBondContact O-CB 3.48Å; G51-A146 WeakPolarHBondContact CA-O 3.42Å; G51-A146 PolarHBondContact N-O 3.09Å; V52-A146 HydrophobicContact CG2-CB 4.05Å; R100-A146 HydrophobicContact CB-CB 3.89Å; R100-A146 HydrophobicContact CG-CB 4.07Å; A144-A146 VanDerWaalsContact C-N 3.26Å; A144-A146 WeakPolarHBondContact CB-O 3.23Å
147	C	81.6	Confident	82	Confident	2 Å²	2	51 Å²	51	1%	0.014	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138	170.6	-179.1	0	0	0	0	108.4	L10 I32 L33 L34 I49 G51	L10-C147 HydrophobicContact CD2-CB 3.79Å; I32-C147 PolarHBondContact O-N 2.98Å; L33-C147 WeakPolarHBondContact CA-O 3.42Å; L33-C147 HydrophobicContact CD1-CB 4.12Å; L34-C147 PolarHBondContact N-O 2.95Å; I49-C147 WeakPolarHBondContact O-CA 3.34Å; I49-C147 PolarHBondContact O-SG 2.83Å; G51-C147 CarbonylContact O-C 3.6Å
148	T	84.8	Confident	82.1	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.5	172.3	-56.6	0	0	0	0	109.9	L34 V36 I49 G51 V52 V53	L34-T148 HydrophobicContact CB-CG2 4.21Å; L34-T148 HydrophobicContact CD2-CG2 3.97Å; L34-T148 HydrophobicContact CG-CG2 3.95Å; L34-T148 CarbonylContact O-C 3.51Å; L34-T148 VanDerWaalsContact O-CA 3.24Å; L34-T148 WeakPolarHBondContact O-CA 3.37Å; V36-T148 HydrophobicContact CB-CG2 4.26Å; V36-T148 HydrophobicContact CG2-CG2 3.55Å; I49-T148 PolarHBondContact N-O 2.87Å; I49-T148 PolarHBondContact O-N 3.42Å; G51-T148 PolarHBondContact O-N 3.4Å; G51-T148 PolarHBondContact O-OG1 2.8Å; V52-T148 WeakPolarHBondContact CA-OG1 3.49Å; V53-T148 HydrophobicContact CB-CG2 3.89Å; V53-T148 HydrophobicContact CG2-CG2 3.61Å; V53-T148 PolarHBondContact N-OG1 3.15Å
149	L	85	Confident	82.2	Confident	16 Å²	16	53.9 Å²	53.9	8%	0.084	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.1	168.3	-68.7	175.5	0	0	0	108.5	A7 L33 L34 L35 V36	A7-L149 HydrophobicContact CB-CD2 4.45Å; L33-L149 HydrophobicContact CD1-CD1 3.92Å; L33-L149 HydrophobicContact CD1-CG 3.92Å; L33-L149 HydrophobicContact CD2-CD1 3.99Å; L33-L149 HydrophobicContact CG-CD1 4.31Å; L34-L149 PolarHBondContact O-N 3.41Å; L35-L149 HydrophobicContact CD2-CB 3.81Å; L35-L149 HydrophobicContact CD2-CD1 4.07Å; V36-L149 PolarHBondContact N-O 3.37Å
150	L	87.3	Confident	82.4	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	110.2	174.7	-167.8	69.4	0	0	0	108.6	V36 I38 S46 K47 I49 F137	V36-L150 HydrophobicContact CB-CD1 3.85Å; V36-L150 HydrophobicContact CG1-CD1 3.7Å; I38-L150 HydrophobicContact CD1-CD1 3.44Å; I38-L150 VanDerWaalsContact CD1-CD1 3.44Å; I38-L150 HydrophobicContact CD1-CD2 4.39Å; I38-L150 HydrophobicContact CD1-CG 4.21Å; I38-L150 HydrophobicContact CG1-CD1 3.88Å; S46-L150 CarbonylContact C-O 3.53Å; S46-L150 WeakPolarHBondContact CA-O 3.49Å; S46-L150 VanDerWaalsContact CB-O 3.24Å; S46-L150 WeakPolarHBondContact CB-O 3.22Å; K47-L150 PolarHBondContact N-O 3.29Å; K47-L150 WeakPolarHBondContact O-CB 3.19Å; K47-L150 PolarHBondContact O-N 3.41Å; I49-L150 HydrophobicContact CD1-CB 4.44Å; F137-L150 HydrophobicContact CE1-CD2 4.39Å
151	L	87.3	Confident	82.7	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.063	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.2	176.1	-59.2	179.1	0	0	0	109.4	L35 V36 L37 I38 L159 M162 L166	L35-L151 HydrophobicContact CD2-CD1 3.8Å; L35-L151 HydrophobicContact CD2-CG 4.31Å; V36-L151 PolarHBondContact O-N 2.89Å; L37-L151 HydrophobicContact CD2-CB 4Å; L37-L151 HydrophobicContact CD2-CD1 3.74Å; L37-L151 HydrophobicContact CD2-CG 4.34Å; I38-L151 PolarHBondContact N-O 3.12Å; L151-L159 HydrophobicContact CB-CD2 3.96Å; L151-M162 HydrophobicContact CD1-CB 4.45Å; L151-L166 HydrophobicContact CD1-CD1 3.53Å; L151-L166 HydrophobicContact CD2-CD1 4.14Å; L151-L166 HydrophobicContact CG-CD1 4.43Å
152	R	88.5	Confident	83.4	Confident	41 Å²	41	59 Å²	59	16%	0.155	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.1	178.3	-72.3	-162.3	-96.4	-173	-1	110.1	I38 C40 Q42 I43 D45 S46	I38-R152 HydrophobicContact CB-CG 4.14Å; C40-R152 WeakPolarHBondContact O-CB 3.16Å; Q42-R152 WeakPolarHBondContact O-CB 3.46Å; I43-R152 VanDerWaalsContact CA-O 3.27Å; I43-R152 WeakPolarHBondContact CA-O 3.13Å; D45-R152 HydrophobicContact CB-CB 4.28Å; D45-R152 VanDerWaalsContact O-CZ 3.24Å; D45-R152 PolarHBondContact O-NE 2.99Å; D45-R152 PolarHBondContact O-NH2 3.47Å; S46-R152 PolarHBondContact OG-N 3.11Å
153	S	89.3	Confident	84	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.021	26%	0.259	C	S	.	.			trans	-163.9	152	172.2	-174.2	0	0	0	0	108.7	I38 P39 C40 G41 N155	I38-S153 PolarHBondContact O-N 3.23Å; P39-S153 CarbonylContact C-O 3.22Å; P39-S153 WeakPolarHBondContact CA-O 3.45Å; C40-S153 PolarHBondContact N-O 2.86Å; G41-S153 CarbonylContact O-C 3.34Å; G41-S153 VanDerWaalsContact O-C 3.22Å; G41-S153 WeakPolarHBondContact O-CA 3.36Å; S153-N155 VanDerWaalsContact C-N 3.28Å; S153-N155 PolarHBondContact OG-N 3.36Å
154	S	88.9	Confident	84.5	Confident	86 Å²	86	53.9 Å²	53.9	60%	0.601	26%	0.257	S	S	*	.	S	Bend	trans	-70.8	-26.5	174.7	57.3	0	0	0	0	112.5	G41	G41-S154 PolarHBondContact O-N 3.2Å; G41-S154 VanDerWaalsContact O-N 3.07Å
155	N	88.4	Confident	85.1	Confident	67 Å²	67	58.9 Å²	58.9	36%	0.358	28%	0.283	S	S	.	.			trans	-108.2	124.5	-177.7	-170	-12.4	0	0	0	111.4	S153 D157 I158 L159	S153-N155 VanDerWaalsContact C-N 3.28Å; S153-N155 PolarHBondContact OG-N 3.36Å; N155-D157 VanDerWaalsContact C-N 3.32Å; N155-D157 PolarHBondContact O-N 3.03Å; N155-D157 PolarHBondContact OD1-N 2.92Å; N155-I158 HydrophobicContact CB-CB 4.31Å; N155-I158 HydrophobicContact CB-CD1 3.78Å; N155-I158 HydrophobicContact CB-CG1 3.87Å; N155-I158 PolarHBondContact O-N 2.91Å; N155-L159 PolarHBondContact O-N 3.21Å
156	R	89.4	Confident	85.4	Confident	176 Å²	176	57.4 Å²	57.4	66%	0.664	28%	0.279	S	S	*	.	H	α-helix	trans	-64	-35.2	178	-69.9	-174.5	-176.3	-161.1	2.7	112.8	P39 I158 L159 I160	P39-R156 HydrophobicContact CB-CG 3.73Å; R156-I158 VanDerWaalsContact C-N 3.33Å; R156-I158 PolarHBondContact O-N 3.35Å; R156-L159 WeakPolarHBondContact O-CB 3.43Å; R156-L159 PolarHBondContact O-N 3.2Å; R156-I160 WeakPolarHBondContact O-CG1 3.27Å; R156-I160 PolarHBondContact O-N 3.5Å; R156-I160 VanDerWaalsContact O-N 3.1Å
157	D	90.8	Very high	85.2	Confident	108 Å²	108	61.4 Å²	61.4	58%	0.578	30%	0.297	S	S	*	.	H	α-helix	trans	-66.5	-40.8	-178.6	-62.3	-36.2	0	0	0	110.7	N155 L159 I160 E161	N155-D157 VanDerWaalsContact C-N 3.32Å; N155-D157 PolarHBondContact O-N 3.03Å; N155-D157 PolarHBondContact OD1-N 2.92Å; D157-L159 VanDerWaalsContact C-N 3.31Å; D157-L159 PolarHBondContact O-N 3.39Å; D157-I160 PolarHBondContact O-N 3.48Å; D157-E161 PolarHBondContact O-N 3.26Å
158	I	88.5	Confident	84.8	Confident	69 Å²	69	63.2 Å²	63.2	35%	0.354	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-41.5	174.4	-59.7	179.5	0	0	0	110.4	I43 N155 R156 I160 E161 M162	I43-I158 HydrophobicContact CD1-CG2 4.44Å; N155-I158 HydrophobicContact CB-CB 4.31Å; N155-I158 HydrophobicContact CB-CD1 3.78Å; N155-I158 HydrophobicContact CB-CG1 3.87Å; N155-I158 PolarHBondContact O-N 2.91Å; R156-I158 VanDerWaalsContact C-N 3.33Å; R156-I158 PolarHBondContact O-N 3.35Å; I158-I160 VanDerWaalsContact C-N 3.35Å; I158-I160 PolarHBondContact O-N 2.87Å; I158-E161 PolarHBondContact O-N 3.36Å; I158-M162 HydrophobicContact CG2-CG 4.22Å; I158-M162 HydrophobicContact CG2-SD 3.96Å; I158-M162 WeakPolarHBondContact O-CB 3.15Å; I158-M162 WeakPolarHBondContact O-CG 3.39Å; I158-M162 PolarHBondContact O-N 3.2Å
159	L	87	Confident	84.2	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.021	34%	0.337	C	S	.	.	H	α-helix	trans	-62.5	-40.5	177.4	-69.7	170.3	0	0	0	112.5	L37 I38 P39 L151 N155 R156 D157 M162 D163	L37-L159 HydrophobicContact CB-CB 4.44Å; L37-L159 HydrophobicContact CB-CD1 4.38Å; L37-L159 HydrophobicContact CD1-CB 4.45Å; L37-L159 HydrophobicContact CD2-CB 4.36Å; L37-L159 HydrophobicContact CD2-CD2 4.5Å; I38-L159 WeakPolarHBondContact O-CD1 3.39Å; P39-L159 HydrophobicContact CB-CD1 4.42Å; L151-L159 HydrophobicContact CB-CD2 3.96Å; N155-L159 PolarHBondContact O-N 3.21Å; R156-L159 WeakPolarHBondContact O-CB 3.43Å; R156-L159 PolarHBondContact O-N 3.2Å; D157-L159 VanDerWaalsContact C-N 3.31Å; D157-L159 PolarHBondContact O-N 3.39Å; L159-M162 PolarHBondContact O-N 3.42Å; L159-D163 WeakPolarHBondContact O-CB 3.25Å; L159-D163 PolarHBondContact O-N 3.16Å
160	I	88.2	Confident	83.4	Confident	77 Å²	77	66.8 Å²	66.8	40%	0.395	34%	0.343	S	S	.	.	H	α-helix	trans	-66.8	-40.3	178	-66.1	167.5	0	0	0	110.5	R156 D157 I158 R164	R156-I160 WeakPolarHBondContact O-CG1 3.27Å; R156-I160 PolarHBondContact O-N 3.5Å; R156-I160 VanDerWaalsContact O-N 3.1Å; D157-I160 PolarHBondContact O-N 3.48Å; I158-I160 VanDerWaalsContact C-N 3.35Å; I158-I160 PolarHBondContact O-N 2.87Å; I160-R164 WeakPolarHBondContact O-CG 3.24Å; I160-R164 PolarHBondContact O-N 2.85Å; I160-R164 VanDerWaalsContact O-N 3.14Å
161	E	84.1	Confident	82.5	Confident	124 Å²	124	70.3 Å²	70.3	58%	0.579	36%	0.359	S	S	*	.	H	α-helix	trans	-66.2	-41.8	174.4	-69.2	-149.7	150.2	0	0	112.4	D157 I158 D163 R164 N165	D157-E161 PolarHBondContact O-N 3.26Å; I158-E161 PolarHBondContact O-N 3.36Å; E161-D163 PolarHBondContact O-N 3.42Å; E161-R164 PolarHBondContact O-N 3.43Å; E161-N165 WeakPolarHBondContact O-CB 3.32Å; E161-N165 PolarHBondContact O-N 3.46Å; E161-N165 PolarHBondContact O-ND2 2.99Å
162	M	84.5	Confident	81.5	Confident	48 Å²	48	74 Å²	74	24%	0.236	38%	0.382	C	S	.	.	H	α-helix	trans	-61.8	-43.2	176.1	-72.3	179.5	84.9	0	0	112	I43 L151 I158 L159 N165 L166	I43-M162 HydrophobicContact CG2-CE 4.07Å; L151-M162 HydrophobicContact CD1-CB 4.45Å; I158-M162 HydrophobicContact CG2-CG 4.22Å; I158-M162 HydrophobicContact CG2-SD 3.96Å; I158-M162 WeakPolarHBondContact O-CB 3.15Å; I158-M162 WeakPolarHBondContact O-CG 3.39Å; I158-M162 PolarHBondContact O-N 3.2Å; L159-M162 PolarHBondContact O-N 3.42Å; M162-N165 PolarHBondContact O-N 2.91Å; M162-L166 WeakPolarHBondContact O-CB 3.47Å; M162-L166 VanDerWaalsContact O-CG 3.29Å; M162-L166 WeakPolarHBondContact O-CG 3.41Å; M162-L166 PolarHBondContact O-N 3.44Å
163	D	82.3	Confident	80.4	Confident	36 Å²	36	74.3 Å²	74.3	19%	0.193	39%	0.388	C	S	.	.	H	α-helix	trans	-58.7	-47.5	175.2	179.2	47.2	0	0	0	111.4	L35 L37 L159 E161 N165 L166 Q167	L35-D163 WeakPolarHBondContact CD1-OD1 3.23Å; L37-D163 HydrophobicContact CD1-CB 4.31Å; L37-D163 HydrophobicContact CD2-CB 4.34Å; L159-D163 WeakPolarHBondContact O-CB 3.25Å; L159-D163 PolarHBondContact O-N 3.16Å; E161-D163 PolarHBondContact O-N 3.42Å; D163-N165 PolarHBondContact O-N 3.33Å; D163-L166 PolarHBondContact O-N 2.9Å; D163-Q167 WeakPolarHBondContact O-CB 3.45Å; D163-Q167 VanDerWaalsContact O-CG 3.26Å; D163-Q167 WeakPolarHBondContact O-CG 3.03Å; D163-Q167 PolarHBondContact O-N 2.69Å; D163-Q167 PolarHBondContact OD1-NE2 2.81Å; D163-Q167 PolarHBondContact OD2-NE2 3.04Å
164	R	78.9	Confident	79	Confident	164 Å²	164	74.3 Å²	74.3	62%	0.619	39%	0.388	S	S	*	.	H	α-helix	trans	-60.4	-45.6	176.5	-71.2	175.3	-177.6	178.9	2.2	112.1	I160 E161 Q167 G168	I160-R164 WeakPolarHBondContact O-CG 3.24Å; I160-R164 PolarHBondContact O-N 2.85Å; I160-R164 VanDerWaalsContact O-N 3.14Å; E161-R164 PolarHBondContact O-N 3.43Å; R164-Q167 PolarHBondContact O-N 2.88Å; R164-G168 PolarHBondContact O-N 2.85Å; R164-G168 VanDerWaalsContact O-N 3.1Å
165	N	82.3	Confident	77.7	Confident	112 Å²	112	72.1 Å²	72.1	60%	0.599	37%	0.37	S	S	*	.	H	α-helix	trans	-65.3	-42	179.9	-71.3	-18.6	0	0	0	112	E161 M162 D163 G168 A169	E161-N165 WeakPolarHBondContact O-CB 3.32Å; E161-N165 PolarHBondContact O-N 3.46Å; E161-N165 PolarHBondContact O-ND2 2.99Å; M162-N165 PolarHBondContact O-N 2.91Å; D163-N165 PolarHBondContact O-N 3.33Å; N165-G168 PolarHBondContact O-N 2.99Å; N165-A169 WeakPolarHBondContact O-CB 3.16Å; N165-A169 PolarHBondContact O-N 3.01Å
166	L	78.7	Confident	76.5	Confident	54 Å²	54	72.1 Å²	72.1	28%	0.283	37%	0.372	S	S	.	.	H	α-helix	trans	-66	-41.4	177	-76.6	167.8	0	0	0	111.7	L35 L151 M162 D163 G168 A169 L170	L35-L166 HydrophobicContact CD2-CD1 4.04Å; L151-L166 HydrophobicContact CD1-CD1 3.53Å; L151-L166 HydrophobicContact CD2-CD1 4.14Å; L151-L166 HydrophobicContact CG-CD1 4.43Å; M162-L166 WeakPolarHBondContact O-CB 3.47Å; M162-L166 VanDerWaalsContact O-CG 3.29Å; M162-L166 WeakPolarHBondContact O-CG 3.41Å; M162-L166 PolarHBondContact O-N 3.44Å; D163-L166 PolarHBondContact O-N 2.9Å; L166-G168 VanDerWaalsContact C-N 3.33Å; L166-G168 PolarHBondContact O-N 3.19Å; L166-A169 PolarHBondContact O-N 2.94Å; L166-L170 VanDerWaalsContact O-CB 3.28Å; L166-L170 WeakPolarHBondContact O-CB 3.47Å; L166-L170 WeakPolarHBondContact O-CD1 3.38Å; L166-L170 WeakPolarHBondContact O-CG 3.49Å; L166-L170 PolarHBondContact O-N 2.72Å
167	Q	74.3	Confident	75.2	Confident	86 Å²	86	67.7 Å²	67.7	40%	0.402	36%	0.358	S	S	.	.	H	α-helix	trans	-60.9	-42.6	175.8	-72.7	176.6	29.1	0	0	111.8	D163 R164 H171	D163-Q167 WeakPolarHBondContact O-CB 3.45Å; D163-Q167 VanDerWaalsContact O-CG 3.26Å; D163-Q167 WeakPolarHBondContact O-CG 3.03Å; D163-Q167 PolarHBondContact O-N 2.69Å; D163-Q167 PolarHBondContact OD1-NE2 2.81Å; D163-Q167 PolarHBondContact OD2-NE2 3.04Å; R164-Q167 PolarHBondContact O-N 2.88Å; Q167-H171 PolarHBondContact O-N 3.49Å; Q167-H171 VanDerWaalsContact O-N 3.08Å
168	G	72.6	Confident	73.7	Confident	40 Å²	40	65.5 Å²	65.5	41%	0.412	35%	0.346	S	S	.	.	H	α-helix	trans	-62.9	-48	174.2	0	0	0	0	0	112.8	R164 N165 L166 L170 H171 V172	R164-G168 PolarHBondContact O-N 2.85Å; R164-G168 VanDerWaalsContact O-N 3.1Å; N165-G168 PolarHBondContact O-N 2.99Å; L166-G168 VanDerWaalsContact C-N 3.33Å; L166-G168 PolarHBondContact O-N 3.19Å; G168-L170 PolarHBondContact O-N 2.81Å; G168-H171 WeakPolarHBondContact O-CB 3.46Å; G168-H171 PolarHBondContact O-N 3.41Å; G168-V172 PolarHBondContact O-N 3.32Å
169	A	72	Confident	72.2	Confident	54 Å²	54	65.1 Å²	65.1	45%	0.446	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-43.8	178.7	0	0	0	0	0	112.3	N165 L166 H171 V172 V173	N165-A169 WeakPolarHBondContact O-CB 3.16Å; N165-A169 PolarHBondContact O-N 3.01Å; L166-A169 PolarHBondContact O-N 2.94Å; A169-H171 VanDerWaalsContact C-N 3.32Å; A169-H171 PolarHBondContact O-N 3.17Å; A169-V172 PolarHBondContact O-N 3.33Å; A169-V173 VanDerWaalsContact O-CG2 3.31Å; A169-V173 WeakPolarHBondContact O-CG2 3.27Å; A169-V173 PolarHBondContact O-N 3.35Å
170	L	69.4	Low	70.7	Confident	38 Å²	38	65.7 Å²	65.7	20%	0.199	35%	0.349	C	S	.	.	H	α-helix	trans	-61.3	-41.8	177	-73.7	166.1	0	0	0	111.2	L33 L166 G168 V172 V173 C174	L33-L170 HydrophobicContact CD2-CD1 3.26Å; L33-L170 HydrophobicContact CD2-CD2 4.24Å; L33-L170 HydrophobicContact CD2-CG 4.4Å; L166-L170 VanDerWaalsContact O-CB 3.28Å; L166-L170 WeakPolarHBondContact O-CB 3.47Å; L166-L170 WeakPolarHBondContact O-CD1 3.38Å; L166-L170 WeakPolarHBondContact O-CG 3.49Å; L166-L170 PolarHBondContact O-N 2.72Å; G168-L170 PolarHBondContact O-N 2.81Å; L170-V172 VanDerWaalsContact C-N 3.34Å; L170-V172 PolarHBondContact O-N 2.93Å; L170-V173 PolarHBondContact O-N 2.87Å; L170-C174 WeakPolarHBondContact O-CB 3.49Å; L170-C174 PolarHBondContact O-N 3.09Å; L170-C174 PolarHBondContact O-SG 3.05Å
171	H	66.8	Low	69.2	Low	78 Å²	78	68.4 Å²	68.4	36%	0.361	36%	0.358	S	S	.	.	H	α-helix	trans	-57.7	-46.1	177.5	-173.5	86.3	0	0	0	112.1	L26 Q167 G168 A169 C174 N175	L26-H171 VanDerWaalsContact CD2-CE1 3.47Å; L26-H171 WeakPolarHBondContact CD2-CE1 3.45Å; L26-H171 WeakPolarHBondContact CD2-ND1 3.44Å; Q167-H171 PolarHBondContact O-N 3.49Å; Q167-H171 VanDerWaalsContact O-N 3.08Å; G168-H171 WeakPolarHBondContact O-CB 3.46Å; G168-H171 PolarHBondContact O-N 3.41Å; A169-H171 VanDerWaalsContact C-N 3.32Å; A169-H171 PolarHBondContact O-N 3.17Å; H171-C174 WeakPolarHBondContact O-CB 3.5Å; H171-C174 PolarHBondContact O-N 3.24Å; H171-N175 PolarHBondContact CD2-ND2 3.12Å; H171-N175 PolarHBondContact NE2-ND2 3.32Å; H171-N175 VanDerWaalsContact NE2-ND2 3.12Å; H171-N175 VanDerWaalsContact O-CG 3.27Å; H171-N175 PolarHBondContact O-N 2.83Å; H171-N175 PolarHBondContact O-OD1 3.15Å
172	V	66	Low	67.8	Low	90 Å²	90	65.7 Å²	65.7	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-46.4	177.1	178.1	0	0	0	0	110.8	G168 A169 L170 C174 N175 V176	G168-V172 PolarHBondContact O-N 3.32Å; A169-V172 PolarHBondContact O-N 3.33Å; L170-V172 VanDerWaalsContact C-N 3.34Å; L170-V172 PolarHBondContact O-N 2.93Å; V172-C174 VanDerWaalsContact C-N 3.33Å; V172-C174 PolarHBondContact O-N 3.06Å; V172-N175 PolarHBondContact O-N 2.7Å; V172-V176 HydrophobicContact CG1-CG2 4.45Å; V172-V176 WeakPolarHBondContact O-CG2 3.46Å; V172-V176 PolarHBondContact O-N 3.09Å
173	V	65.7	Low	66.5	Low	46 Å²	46	67.9 Å²	67.9	28%	0.279	37%	0.365	S	S	.	.	H	α-helix	trans	-59.8	-43.8	177.7	172.5	0	0	0	0	111	I8 A169 L170 N175 V176 F177	I8-V173 HydrophobicContact CD1-CG1 3.76Å; I8-V173 HydrophobicContact CG1-CG1 4.05Å; I8-V173 HydrophobicContact CG2-CG1 4.45Å; A169-V173 VanDerWaalsContact O-CG2 3.31Å; A169-V173 WeakPolarHBondContact O-CG2 3.27Å; A169-V173 PolarHBondContact O-N 3.35Å; L170-V173 PolarHBondContact O-N 2.87Å; V173-N175 PolarHBondContact O-N 2.71Å; V173-V176 PolarHBondContact O-N 2.74Å; V173-F177 HydrophobicContact CG1-CD2 3.55Å; V173-F177 HydrophobicContact CG1-CE2 3.72Å; V173-F177 WeakPolarHBondContact O-CB 3.24Å; V173-F177 WeakPolarHBondContact O-CD2 3.32Å; V173-F177 PolarHBondContact O-N 2.75Å
174	C	61.3	Low	65.5	Low	4 Å²	4	70.1 Å²	70.1	3%	0.027	37%	0.374	C	S	.	.	H	α-helix	trans	-57.1	-49.9	176.2	-64.7	0	0	0	0	111.2	F29 L170 H171 V172 V176 F177 L178	F29-C174 WeakPolarHBondContact CD1-SG 3.43Å; F29-C174 HydrophobicContact CD2-CB 4.47Å; F29-C174 VanDerWaalsContact CD2-SG 3.6Å; F29-C174 WeakPolarHBondContact CE1-SG 3.2Å; F29-C174 HydrophobicContact CE2-CB 4.04Å; F29-C174 WeakPolarHBondContact CE2-SG 3.46Å; F29-C174 VanDerWaalsContact CG-SG 3.57Å; F29-C174 HydrophobicContact CZ-CB 4.08Å; F29-C174 WeakPolarHBondContact CZ-SG 3.28Å; L170-C174 WeakPolarHBondContact O-CB 3.49Å; L170-C174 PolarHBondContact O-N 3.09Å; L170-C174 PolarHBondContact O-SG 3.05Å; H171-C174 WeakPolarHBondContact O-CB 3.5Å; H171-C174 PolarHBondContact O-N 3.24Å; V172-C174 VanDerWaalsContact C-N 3.33Å; V172-C174 PolarHBondContact O-N 3.06Å; C174-V176 VanDerWaalsContact C-N 3.31Å; C174-V176 PolarHBondContact O-N 3.24Å; C174-F177 PolarHBondContact O-N 3.09Å; C174-L178 HydrophobicContact CB-CD1 4.47Å; C174-L178 WeakPolarHBondContact O-CB 3.16Å; C174-L178 WeakPolarHBondContact O-CD1 3.17Å; C174-L178 WeakPolarHBondContact O-CG 3.4Å; C174-L178 PolarHBondContact O-N 3.22Å
175	N	61.4	Low	64.6	Low	40 Å²	40	67.9 Å²	67.9	21%	0.214	38%	0.379	C	S	.	.	H	α-helix	trans	-61.7	-42	-178.3	-67.3	-7.5	0	0	0	110.9	H171 V172 V173 N179 I194	H171-N175 PolarHBondContact CD2-ND2 3.12Å; H171-N175 PolarHBondContact NE2-ND2 3.32Å; H171-N175 VanDerWaalsContact NE2-ND2 3.12Å; H171-N175 VanDerWaalsContact O-CG 3.27Å; H171-N175 PolarHBondContact O-N 2.83Å; H171-N175 PolarHBondContact O-OD1 3.15Å; V172-N175 PolarHBondContact O-N 2.7Å; V173-N175 PolarHBondContact O-N 2.71Å; N175-N179 VanDerWaalsContact O-CB 3.29Å; N175-N179 WeakPolarHBondContact O-CB 2.91Å; N175-N179 PolarHBondContact O-N 3.45Å; N175-I194 HydrophobicContact CB-CD1 4.17Å; N175-I194 WeakPolarHBondContact O-CD1 3.27Å
176	V	63.2	Low	63.7	Low	66 Å²	66	67.1 Å²	67.1	40%	0.4	38%	0.375	S	S	.	.	I	π-helix	trans	-64.1	-47.2	175.3	175	0	0	0	0	111.1	V172 V173 C174 L178 A180 I194	V172-V176 HydrophobicContact CG1-CG2 4.45Å; V172-V176 WeakPolarHBondContact O-CG2 3.46Å; V172-V176 PolarHBondContact O-N 3.09Å; V173-V176 PolarHBondContact O-N 2.74Å; C174-V176 VanDerWaalsContact C-N 3.31Å; C174-V176 PolarHBondContact O-N 3.24Å; V176-L178 VanDerWaalsContact C-N 3.35Å; V176-L178 PolarHBondContact O-N 2.7Å; V176-A180 HydrophobicContact CG1-CB 3.92Å; V176-A180 WeakPolarHBondContact O-CA 3.12Å; V176-A180 WeakPolarHBondContact O-CB 3.45Å; V176-A180 PolarHBondContact O-N 3.14Å; V176-I194 HydrophobicContact CG2-CD1 4.18Å
177	F	61.5	Low	62.8	Low	84 Å²	84	68.5 Å²	68.5	37%	0.368	39%	0.394	S	S	.	.	I	π-helix	trans	-65.4	-36.4	-178.4	-93.5	-87.7	0	0	0	113.4	I8 V173 C174 K181	I8-F177 HydrophobicContact CG2-CD2 4.22Å; I8-F177 HydrophobicContact CG2-CE1 4.28Å; I8-F177 HydrophobicContact CG2-CE2 3.63Å; I8-F177 HydrophobicContact CG2-CZ 3.67Å; V173-F177 HydrophobicContact CG1-CD2 3.55Å; V173-F177 HydrophobicContact CG1-CE2 3.72Å; V173-F177 WeakPolarHBondContact O-CB 3.24Å; V173-F177 WeakPolarHBondContact O-CD2 3.32Å; V173-F177 PolarHBondContact O-N 2.75Å; C174-F177 PolarHBondContact O-N 3.09Å; F177-K181 HydrophobicContact CD1-CD 4.37Å
178	L	59.8	Low	62.2	Low	62 Å²	62	73 Å²	73	33%	0.325	42%	0.415	S	S	.	.	I	π-helix	trans	-77.3	-46.6	-179	-65.7	162.3	0	0	0	112	V25 C174 V176	V25-L178 HydrophobicContact CB-CD1 4.07Å; V25-L178 HydrophobicContact CG1-CD1 3.4Å; V25-L178 VanDerWaalsContact CG1-CD1 3.4Å; V25-L178 HydrophobicContact CG1-CD2 4.18Å; V25-L178 HydrophobicContact CG1-CG 4.4Å; V25-L178 HydrophobicContact CG2-CD1 4.27Å; C174-L178 HydrophobicContact CB-CD1 4.47Å; C174-L178 WeakPolarHBondContact O-CB 3.16Å; C174-L178 WeakPolarHBondContact O-CD1 3.17Å; C174-L178 WeakPolarHBondContact O-CG 3.4Å; C174-L178 PolarHBondContact O-N 3.22Å; V176-L178 VanDerWaalsContact C-N 3.35Å; V176-L178 PolarHBondContact O-N 2.7Å
179	N	57.1	Low	61.7	Low	61 Å²	61	73.3 Å²	73.3	33%	0.326	41%	0.407	S	S	.	.	I	π-helix	trans	-94.2	-39.4	-170.9	-62.2	-21.8	0	0	0	112.2	N175 A182 I194 M201	N175-N179 VanDerWaalsContact O-CB 3.29Å; N175-N179 WeakPolarHBondContact O-CB 2.91Å; N175-N179 PolarHBondContact O-N 3.45Å; N179-A182 PolarHBondContact O-N 2.9Å; N179-I194 HydrophobicContact CB-CD1 4.05Å; N179-I194 HydrophobicContact CB-CG1 4.44Å; N179-M201 HydrophobicContact CB-CG 4.18Å; N179-M201 HydrophobicContact CB-SD 3.88Å; N179-M201 VanDerWaalsContact O-SD 3.33Å
180	A	55.3	Low	61.4	Low	15 Å²	15	78.8 Å²	78.8	12%	0.124	42%	0.421	C	S	.	.	I	π-helix	trans	-74.4	-36.3	-171.6	0	0	0	0	0	112.1	V176 A182 K183 H184	V176-A180 HydrophobicContact CG1-CB 3.92Å; V176-A180 WeakPolarHBondContact O-CA 3.12Å; V176-A180 WeakPolarHBondContact O-CB 3.45Å; V176-A180 PolarHBondContact O-N 3.14Å; A180-A182 VanDerWaalsContact C-N 3.29Å; A180-A182 PolarHBondContact O-N 3.19Å; A180-K183 PolarHBondContact O-N 3.07Å; A180-H184 WeakPolarHBondContact O-CB 3.37Å; A180-H184 PolarHBondContact O-CD2 3.05Å; A180-H184 PolarHBondContact O-N 3.44Å; A180-H184 VanDerWaalsContact O-N 3.15Å
181	K	57.2	Low	61.4	Low	134 Å²	134	79 Å²	79	58%	0.583	42%	0.424	S	S	*	.	H	α-helix	trans	-65	-31.4	177.6	-79.7	-168.7	175.1	-173.8	0	113.4	F177 T185	F177-K181 HydrophobicContact CD1-CD 4.37Å; K181-T185 PolarHBondContact O-OG1 3.07Å; K181-T185 VanDerWaalsContact O-OG1 3.11Å
182	A	54.3	Low	61.6	Low	67 Å²	67	76.3 Å²	76.3	55%	0.554	41%	0.412	S	S	*	.	H	α-helix	trans	-75.6	-26.9	-176.1	0	0	0	0	0	113.4	N179 A180	N179-A182 PolarHBondContact O-N 2.9Å; A180-A182 VanDerWaalsContact C-N 3.29Å; A180-A182 PolarHBondContact O-N 3.19Å
183	K	56	Low	61.8	Low	95 Å²	95	74.9 Å²	74.9	41%	0.413	40%	0.401	S	S	.	.	H	α-helix	trans	-113.2	-19.1	-173.3	-55.9	-160.3	-165.8	173.1	0	115.3	A180 T185 N189 L192 M201	A180-K183 PolarHBondContact O-N 3.07Å; K183-T185 VanDerWaalsContact C-N 3.33Å; K183-N189 VanDerWaalsContact O-CB 3.28Å; K183-N189 WeakPolarHBondContact O-CB 3.43Å; K183-N189 PolarHBondContact O-ND2 3Å; K183-L192 HydrophobicContact CB-CD1 4.23Å; K183-L192 HydrophobicContact CD-CD1 4.45Å; K183-M201 HydrophobicContact CB-CE 4.16Å; K183-M201 HydrophobicContact CB-SD 4.1Å; K183-M201 HydrophobicContact CD-CE 4.4Å; K183-M201 HydrophobicContact CD-SD 3.38Å; K183-M201 WeakPolarHBondContact CD-SD 3.14Å; K183-M201 VanDerWaalsContact CE-SD 3.53Å; K183-M201 HydrophobicContact CG-CE 4.44Å; K183-M201 HydrophobicContact CG-SD 3.72Å
184	H	61.6	Low	62.1	Low	82 Å²	82	74.3 Å²	74.3	38%	0.38	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-2.9	177.7	-75.4	-59.7	0	0	0	114.8	A180 D186 N189 L192	A180-H184 WeakPolarHBondContact O-CB 3.37Å; A180-H184 PolarHBondContact O-CD2 3.05Å; A180-H184 PolarHBondContact O-N 3.44Å; A180-H184 VanDerWaalsContact O-N 3.15Å; H184-D186 PolarHBondContact O-N 3.25Å; H184-N189 PolarHBondContact CE1-O 2.82Å; H184-N189 PolarHBondContact ND1-O 3.32Å; H184-L192 PolarHBondContact CE1-O 2.91Å; H184-L192 PolarHBondContact NE2-O 3.28Å
185	T	59.5	Low	62.5	Low	117 Å²	117	75.5 Å²	75.5	72%	0.718	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-25.5	174.8	-41.8	0	0	0	0	111.5	K181 K183	K181-T185 PolarHBondContact O-OG1 3.07Å; K181-T185 VanDerWaalsContact O-OG1 3.11Å; K183-T185 VanDerWaalsContact C-N 3.33Å
186	D	63.5	Low	62.9	Low	97 Å²	97	77.5 Å²	77.5	52%	0.519	43%	0.433	S	S	.	.	S	Bend	trans	-82.6	125.7	175.9	-58.2	-38.4	0	0	0	110.7	H184 E188 N189	H184-D186 PolarHBondContact O-N 3.25Å; D186-E188 PolarHBondContact O-N 3.25Å; D186-N189 PolarHBondContact O-N 2.8Å
187	A	59.9	Low	63.3	Low	82 Å²	82	80.4 Å²	80.4	68%	0.678	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.9	-175.4	0	0	0	0	0	114	N189 K190	A187-N189 VanDerWaalsContact C-N 3.35Å; A187-K190 WeakPolarHBondContact O-CE 2.91Å
188	E	61.8	Low	63.7	Low	182 Å²	182	80.2 Å²	80.2	85%	0.85	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-20.3	178.6	-62.3	-172.9	163.7	0	0	112.6	D186 K190	D186-E188 PolarHBondContact O-N 3.25Å; E188-K190 PolarHBondContact O-N 3.11Å
189	N	63.5	Low	64.1	Low	46 Å²	46	79.1 Å²	79.1	25%	0.246	46%	0.46	C	S	.	.			trans	-99.7	37	-169.9	-77.1	-18.4	0	0	0	113.9	K183 H184 D186 A187 T191 L192	K183-N189 VanDerWaalsContact O-CB 3.28Å; K183-N189 WeakPolarHBondContact O-CB 3.43Å; K183-N189 PolarHBondContact O-ND2 3Å; H184-N189 PolarHBondContact CE1-O 2.82Å; H184-N189 PolarHBondContact ND1-O 3.32Å; D186-N189 PolarHBondContact O-N 2.8Å; A187-N189 VanDerWaalsContact C-N 3.35Å; N189-T191 PolarHBondContact O-N 2.85Å; N189-L192 HydrophobicContact CB-CD1 3.65Å; N189-L192 HydrophobicContact CB-CG 4.15Å
190	K	64.2	Low	64.6	Low	168 Å²	168	82.6 Å²	82.6	73%	0.73	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-20.6	-179.5	-67.4	178.1	-174.5	174.7	0	113.7	A187 E188	A187-K190 WeakPolarHBondContact O-CE 2.91Å; E188-K190 PolarHBondContact O-N 3.11Å
191	T	69.9	Low	65.2	Low	44 Å²	44	83.2 Å²	83.2	27%	0.27	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-6	-173.6	51.7	0	0	0	0	114.4	N189 D203 R204	N189-T191 PolarHBondContact O-N 2.85Å; T191-D203 PolarHBondContact OG1-OD1 3.17Å; T191-R204 WeakPolarHBondContact O-CB 3.4Å; T191-R204 PolarHBondContact O-N 3.14Å
192	L	70.5	Confident	65.8	Low	20 Å²	20	79.4 Å²	79.4	11%	0.105	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	138.8	173.7	-68.8	179.2	0	0	0	109.6	K183 H184 N189 D203	K183-L192 HydrophobicContact CB-CD1 4.23Å; K183-L192 HydrophobicContact CD-CD1 4.45Å; H184-L192 PolarHBondContact CE1-O 2.91Å; H184-L192 PolarHBondContact NE2-O 3.28Å; N189-L192 HydrophobicContact CB-CD1 3.65Å; N189-L192 HydrophobicContact CB-CG 4.15Å; L192-D203 VanDerWaalsContact CD2-OD1 3.23Å; L192-D203 WeakPolarHBondContact CD2-OD1 3.48Å
193	D	71.6	Confident	66.7	Low	60 Å²	60	77.9 Å²	77.9	32%	0.321	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	169.3	177.3	-146.7	-23.3	0	0	0	108.9	M201 D202 R204	D193-M201 CarbonylContact O-C 3.3Å; D193-M201 VanDerWaalsContact O-CA 3.3Å; D193-M201 WeakPolarHBondContact O-CA 3.19Å; D193-D202 PolarHBondContact N-O 3.35Å; D193-D202 PolarHBondContact O-N 2.89Å; D193-R204 HydrophobicContact CB-CB 4.43Å; D193-R204 IonicContact OD2-CZ 3.13Å; D193-R204 VanDerWaalsContact OD2-CZ 3.31Å; D193-R204 IonicContact OD2-NE 2.65Å; D193-R204 PolarHBondContact OD2-NE 2.8Å; D193-R204 IonicContact OD2-NH2 3.2Å; D193-R204 PolarHBondContact OD2-NH2 3.43Å
194	I	71.2	Confident	67.5	Low	35 Å²	35	76.1 Å²	76.1	18%	0.179	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.2	175.4	-59.5	167.1	0	0	0	107.9	N175 V176 N179 G196 M201	N175-I194 HydrophobicContact CB-CD1 4.17Å; N175-I194 WeakPolarHBondContact O-CD1 3.27Å; V176-I194 HydrophobicContact CG2-CD1 4.18Å; N179-I194 HydrophobicContact CB-CD1 4.05Å; N179-I194 HydrophobicContact CB-CG1 4.44Å; I194-G196 PolarHBondContact O-N 3Å; I194-M201 HydrophobicContact CG1-CG 4.3Å
195	N	69.7	Low	68	Low	29 Å²	29	76 Å²	76	16%	0.155	44%	0.436	C	S	.	.			trans	-74.3	124.2	176	-173.6	-8.7	0	0	0	109.9	T197 T198 G199 E200 D202	N195-T197 PolarHBondContact O-N 2.85Å; N195-T197 PolarHBondContact OD1-N 2.85Å; N195-T197 PolarHBondContact OD1-OG1 2.97Å; N195-T198 WeakPolarHBondContact CB-OG1 3.48Å; N195-G199 VanDerWaalsContact O-CA 3.31Å; N195-G199 WeakPolarHBondContact O-CA 3.41Å; N195-G199 PolarHBondContact O-N 3.02Å; N195-E200 PolarHBondContact N-O 2.92Å; N195-D202 HydrophobicContact CB-CB 4.23Å; N195-D202 VanDerWaalsContact CB-OD2 3.31Å; N195-D202 WeakPolarHBondContact CB-OD2 3.11Å; N195-D202 PolarHBondContact ND2-OD2 2.97Å
196	G	69.2	Low	68.7	Low	82 Å²	82	78.3 Å²	78.3	85%	0.845	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.1	-174.5	0	0	0	0	0	114.9	I194	I194-G196 PolarHBondContact O-N 3Å
197	T	72.6	Confident	69	Low	127 Å²	127	76.2 Å²	76.2	78%	0.779	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-39.3	178.6	54.7	0	0	0	0	112.8	N195	N195-T197 PolarHBondContact O-N 2.85Å; N195-T197 PolarHBondContact OD1-N 2.85Å; N195-T197 PolarHBondContact OD1-OG1 2.97Å
198	T	69.4	Low	69.3	Low	80 Å²	80	78.6 Å²	78.6	49%	0.491	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-25.2	-177.7	59	0	0	0	0	112.9	N195 E200	N195-T198 WeakPolarHBondContact CB-OG1 3.48Å; T198-E200 PolarHBondContact O-N 3.23Å; T198-E200 PolarHBondContact OG1-N 3.1Å
199	G	67.4	Low	69.7	Low	38 Å²	38	74.3 Å²	74.3	39%	0.392	42%	0.415	S	S	.	.			trans	73.1	2.5	-170.7	0	0	0	0	0	113.9	N195	N195-G199 VanDerWaalsContact O-CA 3.31Å; N195-G199 WeakPolarHBondContact O-CA 3.41Å; N195-G199 PolarHBondContact O-N 3.02Å
200	E	69.2	Low	69.9	Low	134 Å²	134	79.7 Å²	79.7	63%	0.626	43%	0.431	S	S	*	.	S	Bend	trans	-87.7	162.6	177.3	-62.7	-170.9	162.3	0	0	111.3	N195 T198	N195-E200 PolarHBondContact N-O 2.92Å; T198-E200 PolarHBondContact O-N 3.23Å; T198-E200 PolarHBondContact OG1-N 3.1Å
201	M	67.5	Low	70.1	Confident	29 Å²	29	76 Å²	76	14%	0.143	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115.4	176	-67.1	-167.1	90.9	0	0	110.2	N179 K183 D193 I194	N179-M201 HydrophobicContact CB-CG 4.18Å; N179-M201 HydrophobicContact CB-SD 3.88Å; N179-M201 VanDerWaalsContact O-SD 3.33Å; K183-M201 HydrophobicContact CB-CE 4.16Å; K183-M201 HydrophobicContact CB-SD 4.1Å; K183-M201 HydrophobicContact CD-CE 4.4Å; K183-M201 HydrophobicContact CD-SD 3.38Å; K183-M201 WeakPolarHBondContact CD-SD 3.14Å; K183-M201 VanDerWaalsContact CE-SD 3.53Å; K183-M201 HydrophobicContact CG-CE 4.44Å; K183-M201 HydrophobicContact CG-SD 3.72Å; D193-M201 CarbonylContact O-C 3.3Å; D193-M201 VanDerWaalsContact O-CA 3.3Å; D193-M201 WeakPolarHBondContact O-CA 3.19Å; I194-M201 HydrophobicContact CG1-CG 4.3Å
202	D	69.7	Low	69.9	Low	53 Å²	53	77.6 Å²	77.6	28%	0.283	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	152.6	178.8	-78.9	-39.5	0	0	0	111	D193 N195 R204 V207	D193-D202 PolarHBondContact N-O 3.35Å; D193-D202 PolarHBondContact O-N 2.89Å; N195-D202 HydrophobicContact CB-CB 4.23Å; N195-D202 VanDerWaalsContact CB-OD2 3.31Å; N195-D202 WeakPolarHBondContact CB-OD2 3.11Å; N195-D202 PolarHBondContact ND2-OD2 2.97Å; D202-R204 PolarHBondContact O-N 3.43Å; D202-V207 HydrophobicContact CB-CG2 3.46Å; D202-V207 VanDerWaalsContact CB-CG2 3.46Å
203	D	73.2	Confident	69.9	Low	35 Å²	35	83.1 Å²	83.1	19%	0.187	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	122.9	167.9	-81.6	-54.2	0	0	0	110.2	T191 L192 N205 K206 V207	T191-D203 PolarHBondContact OG1-OD1 3.17Å; L192-D203 VanDerWaalsContact CD2-OD1 3.23Å; L192-D203 WeakPolarHBondContact CD2-OD1 3.48Å; D203-N205 PolarHBondContact O-N 3.49Å; D203-K206 HydrophobicContact CB-CB 4.14Å; D203-K206 HydrophobicContact CB-CD 3.96Å; D203-K206 HydrophobicContact CB-CG 3.87Å; D203-K206 PolarHBondContact O-N 3.47Å; D203-K206 WeakPolarHBondContact OD2-CE 3.43Å; D203-K206 IonicContact OD2-NZ 2.79Å; D203-K206 PolarHBondContact OD2-NZ 3.34Å; D203-V207 PolarHBondContact O-N 3.15Å; D203-V207 VanDerWaalsContact O-N 3.17Å
204	R	71.6	Confident	69.6	Low	58 Å²	58	85.7 Å²	85.7	22%	0.219	48%	0.478	C	S	.	.	H	α-helix	trans	-53.3	-30.6	174.3	-166.2	-174.6	-64.8	139.7	3.7	112.5	T191 D193 D202 N208 V209 R210 R216	T191-R204 WeakPolarHBondContact O-CB 3.4Å; T191-R204 PolarHBondContact O-N 3.14Å; D193-R204 HydrophobicContact CB-CB 4.43Å; D193-R204 IonicContact OD2-CZ 3.13Å; D193-R204 VanDerWaalsContact OD2-CZ 3.31Å; D193-R204 IonicContact OD2-NE 2.65Å; D193-R204 PolarHBondContact OD2-NE 2.8Å; D193-R204 IonicContact OD2-NH2 3.2Å; D193-R204 PolarHBondContact OD2-NH2 3.43Å; D202-R204 PolarHBondContact O-N 3.43Å; R204-N208 PolarHBondContact O-N 3.38Å; R204-V209 WeakPolarHBondContact CG-O 3.37Å; R204-R210 HydrophobicContact CG-CG 4.25Å; R204-R216 VanDerWaalsContact CZ-NH2 3.29Å
205	N	72.5	Confident	69.5	Low	80 Å²	80	87.3 Å²	87.3	43%	0.428	49%	0.489	S	S	.	.	H	α-helix	trans	-71.6	-31.9	177.9	-68.7	-17	0	0	0	113	D203 R210	D203-N205 PolarHBondContact O-N 3.49Å; N205-R210 PolarHBondContact OD1-NH2 3.18Å
206	K	73.8	Confident	69.5	Low	166 Å²	166	90.1 Å²	90.1	72%	0.722	50%	0.497	S	S	*	.	H	α-helix	trans	-79.6	-39.3	179.1	-68.4	179	-176.5	141.7	0	111.8	D203 N208	D203-K206 HydrophobicContact CB-CB 4.14Å; D203-K206 HydrophobicContact CB-CD 3.96Å; D203-K206 HydrophobicContact CB-CG 3.87Å; D203-K206 PolarHBondContact O-N 3.47Å; D203-K206 WeakPolarHBondContact OD2-CE 3.43Å; D203-K206 IonicContact OD2-NZ 2.79Å; D203-K206 PolarHBondContact OD2-NZ 3.34Å; K206-N208 PolarHBondContact O-N 3.04Å
207	V	70.4	Confident	69.4	Low	53 Å²	53	90.4 Å²	90.4	32%	0.321	48%	0.483	S	S	.	.	H	α-helix	trans	-78.6	-10.4	-178.2	-169.3	0	0	0	0	112.1	D202 D203 V209	D202-V207 HydrophobicContact CB-CG2 3.46Å; D202-V207 VanDerWaalsContact CB-CG2 3.46Å; D203-V207 PolarHBondContact O-N 3.15Å; D203-V207 VanDerWaalsContact O-N 3.17Å; V207-V209 HydrophobicContact CG1-CB 4.32Å; V207-V209 HydrophobicContact CG1-CG2 3.8Å; V207-V209 PolarHBondContact O-N 3Å
208	N	67.1	Low	69.2	Low	131 Å²	131	89.2 Å²	89.2	70%	0.701	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	23	-177.5	-153.2	15	0	0	0	114.3	R204 K206	R204-N208 PolarHBondContact O-N 3.38Å; K206-N208 PolarHBondContact O-N 3.04Å
209	V	70	Confident	69.4	Low	93 Å²	93	89.6 Å²	89.6	56%	0.564	47%	0.471	S	S	*	.			trans	-94.9	100.5	174.1	173.5	0	0	0	0	107.1	R204 V207	R204-V209 WeakPolarHBondContact CG-O 3.37Å; V207-V209 HydrophobicContact CG1-CB 4.32Å; V207-V209 HydrophobicContact CG1-CG2 3.8Å; V207-V209 PolarHBondContact O-N 3Å
210	R	66.6	Low	69.3	Low	158 Å²	158	93.7 Å²	93.7	60%	0.596	48%	0.479	S	S	*	.			trans	-123.2	126.5	176.7	-69.2	-177.8	176.3	174.9	0.6	109.7	R204 N205	R204-R210 HydrophobicContact CG-CG 4.25Å; N205-R210 PolarHBondContact OD1-NH2 3.18Å
211	N	67.9	Low	68.8	Low	90 Å²	90	92.7 Å²	92.7	48%	0.481	47%	0.473	S	S	.	.			trans	-76.5	133.1	167.9	-60.9	38.6	0	0	0	108.1	R216	N211-R216 HydrophobicContact CB-CG 4.16Å
212	P	66.9	Low	68.9	Low	79 Å²	79	93.9 Å²	93.9	51%	0.513	48%	0.482	S	S	.	.			trans	-59.5	144.1	175.4	24.2	-32.5	0	0	0	110.3	T214 V215 R216	P212-T214 PolarHBondContact O-N 3.46Å; P212-V215 HydrophobicContact CG-CB 3.99Å; P212-V215 HydrophobicContact CG-CG2 3.6Å; P212-V215 PolarHBondContact O-N 3.44Å; P212-V215 VanDerWaalsContact O-N 3.08Å; P212-R216 PolarHBondContact O-N 3.11Å
213	L	70.4	Confident	68.8	Low	135 Å²	135	93.8 Å²	93.8	71%	0.707	49%	0.488	S	S	*	.	H	α-helix	trans	-57.6	-38	-176.9	-165.2	75.9	0	0	0	111.3	V215 R216 V217	L213-V215 VanDerWaalsContact C-N 3.32Å; L213-V215 PolarHBondContact O-N 2.99Å; L213-R216 WeakPolarHBondContact O-CB 3.43Å; L213-R216 PolarHBondContact O-N 3.01Å; L213-R216 VanDerWaalsContact O-N 3.11Å; L213-V217 HydrophobicContact CG-CG2 4.36Å; L213-V217 WeakPolarHBondContact O-CG2 3.12Å; L213-V217 PolarHBondContact O-N 3.33Å
214	T	66.1	Low	68.2	Low	114 Å²	114	96.4 Å²	96.4	70%	0.699	50%	0.501	S	S	*	.	H	α-helix	trans	-57.2	-42.7	177.6	-44.9	0	0	0	0	112.3	P212 V217 Q218	P212-T214 PolarHBondContact O-N 3.46Å; T214-V217 PolarHBondContact O-N 3.2Å; T214-Q218 VanDerWaalsContact O-CB 3.22Å; T214-Q218 WeakPolarHBondContact O-CB 3.41Å; T214-Q218 PolarHBondContact O-N 2.65Å
215	V	68.6	Low	67.3	Low	69 Å²	69	98.3 Å²	98.3	42%	0.418	51%	0.513	S	S	.	.	H	α-helix	trans	-68.9	-39.9	177.9	173	0	0	0	0	110.3	P212 L213 Q218 V219	P212-V215 HydrophobicContact CG-CB 3.99Å; P212-V215 HydrophobicContact CG-CG2 3.6Å; P212-V215 PolarHBondContact O-N 3.44Å; P212-V215 VanDerWaalsContact O-N 3.08Å; L213-V215 VanDerWaalsContact C-N 3.32Å; L213-V215 PolarHBondContact O-N 2.99Å; V215-Q218 PolarHBondContact O-N 3.5Å; V215-V219 HydrophobicContact CG1-CG2 4.13Å; V215-V219 WeakPolarHBondContact O-CB 3.35Å; V215-V219 WeakPolarHBondContact O-CG2 3.5Å; V215-V219 PolarHBondContact O-N 2.93Å
216	R	69	Low	66.9	Low	88 Å²	88	98.2 Å²	98.2	33%	0.332	52%	0.515	S	S	.	.	H	α-helix	trans	-61.7	-49.1	175.7	-68.7	-175.1	170.8	-166.8	-4.1	111.3	R204 N211 P212 L213 Q218 V219 H220	R204-R216 VanDerWaalsContact CZ-NH2 3.29Å; N211-R216 HydrophobicContact CB-CG 4.16Å; P212-R216 PolarHBondContact O-N 3.11Å; L213-R216 WeakPolarHBondContact O-CB 3.43Å; L213-R216 PolarHBondContact O-N 3.01Å; L213-R216 VanDerWaalsContact O-N 3.11Å; R216-Q218 VanDerWaalsContact C-N 3.35Å; R216-Q218 PolarHBondContact O-N 3.17Å; R216-V219 PolarHBondContact O-N 2.96Å; R216-H220 PolarHBondContact O-N 2.84Å; R216-H220 VanDerWaalsContact O-N 3.11Å; R216-H220 PolarHBondContact O-ND1 2.64Å
217	V	67.3	Low	65.8	Low	89 Å²	89	92.3 Å²	92.3	54%	0.539	49%	0.49	S	S	.	.	H	α-helix	trans	-61.3	-44.8	178.5	173.8	0	0	0	0	110.7	L213 T214 H220 K221	L213-V217 HydrophobicContact CG-CG2 4.36Å; L213-V217 WeakPolarHBondContact O-CG2 3.12Å; L213-V217 PolarHBondContact O-N 3.33Å; T214-V217 PolarHBondContact O-N 3.2Å; V217-H220 PolarHBondContact O-N 2.75Å; V217-K221 WeakPolarHBondContact O-CB 3.4Å; V217-K221 PolarHBondContact O-N 2.72Å
218	Q	69.2	Low	64.3	Low	102 Å²	102	96.3 Å²	96.3	48%	0.477	50%	0.503	S	S	.	.	H	α-helix	trans	-64.4	-46.1	179.9	-174.1	64.9	8	0	0	112.1	T214 V215 R216 H220 K221 T222	T214-Q218 VanDerWaalsContact O-CB 3.22Å; T214-Q218 WeakPolarHBondContact O-CB 3.41Å; T214-Q218 PolarHBondContact O-N 2.65Å; V215-Q218 PolarHBondContact O-N 3.5Å; R216-Q218 VanDerWaalsContact C-N 3.35Å; R216-Q218 PolarHBondContact O-N 3.17Å; Q218-H220 VanDerWaalsContact C-N 3.28Å; Q218-H220 PolarHBondContact O-N 2.81Å; Q218-K221 PolarHBondContact O-N 2.85Å; Q218-T222 WeakPolarHBondContact O-CB 3.31Å; Q218-T222 PolarHBondContact O-N 3.23Å; Q218-T222 PolarHBondContact O-OG1 3.28Å
219	V	72.2	Confident	63	Low	88 Å²	88	92.9 Å²	92.9	53%	0.533	49%	0.49	S	S	.	.	H	α-helix	trans	-60.1	-40.8	178.3	171.3	0	0	0	0	111	V215 R216 A223	V215-V219 HydrophobicContact CG1-CG2 4.13Å; V215-V219 WeakPolarHBondContact O-CB 3.35Å; V215-V219 WeakPolarHBondContact O-CG2 3.5Å; V215-V219 PolarHBondContact O-N 2.93Å; R216-V219 PolarHBondContact O-N 2.96Å; V219-A223 WeakPolarHBondContact O-CB 3.41Å; V219-A223 PolarHBondContact O-N 3.5Å
220	H	65.5	Low	61.7	Low	124 Å²	124	93.8 Å²	93.8	57%	0.574	49%	0.491	S	S	*	.	H	α-helix	trans	-68.3	-43.1	176.1	-72.3	73.2	0	0	0	111.7	R216 V217 Q218 A223 I224	R216-H220 PolarHBondContact O-N 2.84Å; R216-H220 VanDerWaalsContact O-N 3.11Å; R216-H220 PolarHBondContact O-ND1 2.64Å; V217-H220 PolarHBondContact O-N 2.75Å; Q218-H220 VanDerWaalsContact C-N 3.28Å; Q218-H220 PolarHBondContact O-N 2.81Å; H220-A223 PolarHBondContact O-N 3.23Å; H220-I224 WeakPolarHBondContact O-CB 3.39Å; H220-I224 WeakPolarHBondContact O-CD1 3.38Å; H220-I224 WeakPolarHBondContact O-CG1 3.4Å; H220-I224 PolarHBondContact O-N 3.03Å
221	K	59.7	Low	60.5	Low	113 Å²	113	91.6 Å²	91.6	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-60	-51.2	177.1	-176.7	176.2	174.8	179.6	0	111.2	V217 Q218 A223 I224 E225	V217-K221 WeakPolarHBondContact O-CB 3.4Å; V217-K221 PolarHBondContact O-N 2.72Å; Q218-K221 PolarHBondContact O-N 2.85Å; K221-A223 PolarHBondContact O-N 3.36Å; K221-I224 PolarHBondContact O-N 2.97Å; K221-E225 WeakPolarHBondContact CE-OE1 3.36Å; K221-E225 HydrophobicContact CG-CG 4.49Å; K221-E225 WeakPolarHBondContact O-CB 3.46Å; K221-E225 WeakPolarHBondContact O-CG 3.46Å; K221-E225 PolarHBondContact O-N 2.89Å
222	T	68.3	Low	59	Low	54 Å²	54	93 Å²	93	33%	0.331	50%	0.497	S	S	.	.	H	α-helix	trans	-64.7	-38.4	178	-50.1	0	0	0	0	111.5	Q218 I224 E225 V226	Q218-T222 WeakPolarHBondContact O-CB 3.31Å; Q218-T222 PolarHBondContact O-N 3.23Å; Q218-T222 PolarHBondContact O-OG1 3.28Å; T222-I224 VanDerWaalsContact C-N 3.33Å; T222-I224 PolarHBondContact O-N 3.46Å; T222-E225 PolarHBondContact O-N 2.76Å; T222-V226 HydrophobicContact CG2-CG2 4.04Å; T222-V226 VanDerWaalsContact O-CB 3.27Å; T222-V226 WeakPolarHBondContact O-CB 3.4Å; T222-V226 WeakPolarHBondContact O-CG2 3.44Å; T222-V226 PolarHBondContact O-N 3.43Å
223	A	68.6	Low	57.6	Low	51 Å²	51	98.8 Å²	98.8	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-38.8	175.3	0	0	0	0	0	112.4	V219 H220 K221 H227	V219-A223 WeakPolarHBondContact O-CB 3.41Å; V219-A223 PolarHBondContact O-N 3.5Å; H220-A223 PolarHBondContact O-N 3.23Å; K221-A223 PolarHBondContact O-N 3.36Å; A223-H227 VanDerWaalsContact O-CB 3.23Å; A223-H227 WeakPolarHBondContact O-CB 3.15Å; A223-H227 PolarHBondContact O-N 2.93Å
224	I	60.7	Low	56	Low	89 Å²	89	99 Å²	99	46%	0.456	52%	0.522	S	S	.	.	H	α-helix	trans	-69.7	-46.7	175.5	-68	164.8	0	0	0	110.4	H220 K221 T222 H227 F228	H220-I224 WeakPolarHBondContact O-CB 3.39Å; H220-I224 WeakPolarHBondContact O-CD1 3.38Å; H220-I224 WeakPolarHBondContact O-CG1 3.4Å; H220-I224 PolarHBondContact O-N 3.03Å; K221-I224 PolarHBondContact O-N 2.97Å; T222-I224 VanDerWaalsContact C-N 3.33Å; T222-I224 PolarHBondContact O-N 3.46Å; I224-H227 WeakPolarHBondContact O-CB 3.34Å; I224-H227 PolarHBondContact O-N 3.29Å; I224-F228 HydrophobicContact CG2-CD2 3.73Å; I224-F228 HydrophobicContact CG2-CE2 3.88Å; I224-F228 WeakPolarHBondContact O-CD2 2.95Å; I224-F228 PolarHBondContact O-N 3.26Å
225	E	52.6	Low	55.5	Low	98 Å²	98	98.3 Å²	98.3	46%	0.458	51%	0.513	S	S	.	.	H	α-helix	trans	-61.8	-47.2	178.9	-75.1	172	173.3	0	0	112.1	K221 T222 H227 F228 S229	K221-E225 WeakPolarHBondContact CE-OE1 3.36Å; K221-E225 HydrophobicContact CG-CG 4.49Å; K221-E225 WeakPolarHBondContact O-CB 3.46Å; K221-E225 WeakPolarHBondContact O-CG 3.46Å; K221-E225 PolarHBondContact O-N 2.89Å; T222-E225 PolarHBondContact O-N 2.76Å; E225-H227 VanDerWaalsContact C-N 3.26Å; E225-H227 PolarHBondContact O-N 3.15Å; E225-F228 PolarHBondContact O-N 3.46Å; E225-S229 VanDerWaalsContact O-CB 3.27Å; E225-S229 WeakPolarHBondContact O-CB 3.37Å; E225-S229 PolarHBondContact O-N 3.31Å
226	V	63.9	Low	54.8	Low	78 Å²	78	99.8 Å²	99.8	47%	0.473	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-38.6	175.3	171.7	0	0	0	0	110.1	T222 S229 L230	T222-V226 HydrophobicContact CG2-CG2 4.04Å; T222-V226 VanDerWaalsContact O-CB 3.27Å; T222-V226 WeakPolarHBondContact O-CB 3.4Å; T222-V226 WeakPolarHBondContact O-CG2 3.44Å; T222-V226 PolarHBondContact O-N 3.43Å; V226-S229 PolarHBondContact O-N 3.09Å; V226-L230 HydrophobicContact CG1-CD1 3.73Å; V226-L230 WeakPolarHBondContact O-CB 3.39Å; V226-L230 WeakPolarHBondContact O-CD1 3.23Å; V226-L230 WeakPolarHBondContact O-CG 3.25Å; V226-L230 PolarHBondContact O-N 3.22Å
227	H	50.6	Low	54	Low	43 Å²	43	100.5 Å²	100.5	20%	0.199	53%	0.528	C	S	.	.	H	α-helix	trans	-65	-45.2	176.6	-174.9	28.4	0	0	0	113	M1 A223 I224 E225 F231	M1-H227 VanDerWaalsContact CB-CE1 3.48Å; M1-H227 WeakPolarHBondContact CB-CE1 3.31Å; M1-H227 WeakPolarHBondContact CB-NE2 3.47Å; M1-H227 HydrophobicContact CE-CB 3.5Å; M1-H227 VanDerWaalsContact CE-CB 3.5Å; M1-H227 WeakPolarHBondContact CE-CD2 3.21Å; M1-H227 HydrophobicContact CG-CB 4.25Å; M1-H227 VanDerWaalsContact CG-CD2 3.41Å; M1-H227 WeakPolarHBondContact CG-CD2 3.05Å; M1-H227 VanDerWaalsContact CG-CG 3.46Å; M1-H227 WeakPolarHBondContact CG-NE2 3.41Å; M1-H227 PolarHBondContact N-CE1 2.83Å; M1-H227 PolarHBondContact N-ND1 2.99Å; M1-H227 HydrophobicContact SD-CB 4.46Å; M1-H227 PolarHBondContact SD-CD2 3.32Å; A223-H227 VanDerWaalsContact O-CB 3.23Å; A223-H227 WeakPolarHBondContact O-CB 3.15Å; A223-H227 PolarHBondContact O-N 2.93Å; I224-H227 WeakPolarHBondContact O-CB 3.34Å; I224-H227 PolarHBondContact O-N 3.29Å; E225-H227 VanDerWaalsContact C-N 3.26Å; E225-H227 PolarHBondContact O-N 3.15Å; H227-F231 AromaticContact CE1-CD2 3.86Å; H227-F231 PolarHBondContact O-N 2.89Å
228	F	38.8	Very low	53.3	Low	136 Å²	136	101.2 Å²	101.2	60%	0.596	53%	0.528	S	S	*	.	H	α-helix	trans	-66.7	-40.7	176.2	-90.5	-77.1	0	0	0	111.7	I224 E225 L230 F231 V232	I224-F228 HydrophobicContact CG2-CD2 3.73Å; I224-F228 HydrophobicContact CG2-CE2 3.88Å; I224-F228 WeakPolarHBondContact O-CD2 2.95Å; I224-F228 PolarHBondContact O-N 3.26Å; E225-F228 PolarHBondContact O-N 3.46Å; F228-L230 VanDerWaalsContact C-N 3.35Å; F228-L230 PolarHBondContact O-N 2.98Å; F228-F231 PolarHBondContact O-N 3.02Å; F228-F231 VanDerWaalsContact O-N 3.1Å; F228-V232 WeakPolarHBondContact O-CG2 3.47Å; F228-V232 PolarHBondContact O-N 3.19Å
229	S	41	Very low	52.3	Low	60 Å²	60	101.1 Å²	101.1	42%	0.42	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-38.4	179.2	-175.3	0	0	0	0	112.5	E225 V226 F231	E225-S229 VanDerWaalsContact O-CB 3.27Å; E225-S229 WeakPolarHBondContact O-CB 3.37Å; E225-S229 PolarHBondContact O-N 3.31Å; V226-S229 PolarHBondContact O-N 3.09Å; S229-F231 VanDerWaalsContact C-N 3.27Å; S229-F231 PolarHBondContact O-N 3.04Å
230	L	41.9	Very low	50.9	Low	112 Å²	112	102 Å²	102	59%	0.586	53%	0.531	S	S	*	.	H	α-helix	trans	-70.2	-20.1	174.4	-82.6	159.2	0	0	0	113.5	V226 F228	V226-L230 HydrophobicContact CG1-CD1 3.73Å; V226-L230 WeakPolarHBondContact O-CB 3.39Å; V226-L230 WeakPolarHBondContact O-CD1 3.23Å; V226-L230 WeakPolarHBondContact O-CG 3.25Å; V226-L230 PolarHBondContact O-N 3.22Å; F228-L230 VanDerWaalsContact C-N 3.35Å; F228-L230 PolarHBondContact O-N 2.98Å
231	F	41.4	Very low	49.9	Very low	112 Å²	112	100.4 Å²	100.4	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-95.8	-22.4	-179.5	-126.8	-97.4	0	0	0	113.5	H2 H227 F228 S229 S234	H2-F231 AromaticContact CD2-CE2 3.75Å; H2-F231 AromaticContact CD2-CZ 3.73Å; H227-F231 AromaticContact CE1-CD2 3.86Å; H227-F231 PolarHBondContact O-N 2.89Å; F228-F231 PolarHBondContact O-N 3.02Å; F228-F231 VanDerWaalsContact O-N 3.1Å; S229-F231 VanDerWaalsContact C-N 3.27Å; S229-F231 PolarHBondContact O-N 3.04Å; F231-S234 PolarHBondContact O-OG 2.95Å
232	V	36.6	Very low	49.2	Very low	119 Å²	119	99.5 Å²	99.5	72%	0.721	53%	0.53	S	S	*	.	H	α-helix	trans	-86.4	-9.9	177.1	175.5	0	0	0	0	112	F228	F228-V232 WeakPolarHBondContact O-CG2 3.47Å; F228-V232 PolarHBondContact O-N 3.19Å
233	R	36.5	Very low	47.6	Very low	200 Å²	200	103.3 Å²	103.3	76%	0.755	55%	0.547	S	S	*	.			trans	-97.2	-1.7	176	-90	-172.2	162.4	118.5	-1.8	115.3
234	S	38.1	Very low	45.7	Very low	141 Å²	141	108 Å²	108	99%	0.986	56%	0.558	S	S	*	*			trans	-107.1	0	171.2	49.6	0	0	0	0	110.3	F231	F231-S234 PolarHBondContact O-OG 2.95Å

Retrieved 234 of 234 residues in 418.7 ms (Link to these results)

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