A0A077ZM43_TRITR Loading...

Thiolase C and Thiolase N domain containing prote in

AlphaFold DB , UniProt , Accession A0A077ZM43, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 280 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	85.9	Confident	71.8	Confident	23 Å²	23	51.2 Å²	51.2	11%	0.113	26%	0.257	C	S	.	.				0	151	0	-72.4	-179.5	156	0	0	108.7	L3 L143 A144 K146 A149 Y156 V159	M1-L3 HydrophobicContact CB-CD2 4.43Å; M1-L143 CarbonylContact O-C 3.6Å; M1-L143 VanDerWaalsContact O-CA 3.23Å; M1-L143 WeakPolarHBondContact O-CA 3.49Å; M1-A144 PolarHBondContact N-O 3.29Å; M1-A144 PolarHBondContact O-N 3.05Å; M1-K146 HydrophobicContact CE-CB 3.8Å; M1-K146 HydrophobicContact CE-CD 3.55Å; M1-K146 HydrophobicContact CE-CG 3.37Å; M1-K146 HydrophobicContact CG-CB 4.33Å; M1-K146 HydrophobicContact SD-CB 3.85Å; M1-K146 HydrophobicContact SD-CG 3.91Å; M1-A149 HydrophobicContact SD-CB 3.99Å; M1-Y156 HydrophobicContact CB-CG 4.32Å; M1-Y156 HydrophobicContact CE-CD1 3.76Å; M1-Y156 HydrophobicContact CE-CD2 4.16Å; M1-Y156 HydrophobicContact CE-CE1 3.45Å; M1-Y156 VanDerWaalsContact CE-CE1 3.45Å; M1-Y156 HydrophobicContact CE-CE2 3.91Å; M1-Y156 HydrophobicContact CE-CG 4.11Å; M1-Y156 HydrophobicContact CG-CD2 4.47Å; M1-Y156 HydrophobicContact CG-CG 4.25Å; M1-Y156 HydrophobicContact SD-CD1 3.47Å; M1-Y156 WeakPolarHBondContact SD-CD1 3.11Å; M1-Y156 HydrophobicContact SD-CD2 4.26Å; M1-Y156 HydrophobicContact SD-CE1 3.81Å; M1-Y156 HydrophobicContact SD-CG 3.72Å; M1-V159 HydrophobicContact CE-CG2 4.14Å; M1-V159 HydrophobicContact CG-CG2 4.3Å
2	I	83.6	Confident	70.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	111	171.3	-63.1	173.6	0	0	0	107.7	V141 V142 L143 Y156 L157 A158 I160 V243 I247 L279	I2-V141 HydrophobicContact CG2-CB 4.03Å; I2-V141 HydrophobicContact CG2-CG1 4.13Å; I2-V142 CarbonylContact C-O 3.53Å; I2-V142 WeakPolarHBondContact CA-O 3.32Å; I2-L143 HydrophobicContact CD1-CD2 4.47Å; I2-L143 HydrophobicContact CG1-CD2 3.66Å; I2-Y156 CarbonylContact O-C 3.49Å; I2-Y156 VanDerWaalsContact O-CA 3.3Å; I2-Y156 WeakPolarHBondContact O-CA 3.36Å; I2-Y156 WeakPolarHBondContact O-CB 3.41Å; I2-L157 PolarHBondContact O-N 3.4Å; I2-A158 PolarHBondContact N-O 2.93Å; I2-I160 HydrophobicContact CD1-CD1 4.22Å; I2-I160 HydrophobicContact CD1-CG1 4.15Å; I2-I160 HydrophobicContact CG1-CD1 4.27Å; I2-I160 HydrophobicContact CG1-CG1 4.37Å; I2-V243 HydrophobicContact CD1-CG1 3.98Å; I2-I247 HydrophobicContact CB-CD1 4.4Å; I2-I247 HydrophobicContact CD1-CD1 3.45Å; I2-I247 VanDerWaalsContact CD1-CD1 3.45Å; I2-I247 HydrophobicContact CG1-CD1 4.49Å; I2-I247 HydrophobicContact CG2-CD1 4.04Å; I2-L279 HydrophobicContact CD1-CD2 4.27Å
3	L	78	Confident	70.6	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	131.4	-177.5	-57.5	-171.2	0	0	0	110.5	M1 A39 I41 V142 A144 A149 L154 T155	M1-L3 HydrophobicContact CB-CD2 4.43Å; L3-A39 HydrophobicContact CB-CB 3.81Å; L3-I41 HydrophobicContact CD1-CG2 4.32Å; L3-V142 HydrophobicContact CB-CB 4.18Å; L3-V142 HydrophobicContact CB-CG1 4.09Å; L3-V142 HydrophobicContact CD1-CG1 3.98Å; L3-V142 HydrophobicContact CG-CG1 4.25Å; L3-V142 PolarHBondContact N-O 3.29Å; L3-A144 HydrophobicContact CD1-CB 3.48Å; L3-A144 VanDerWaalsContact CD1-CB 3.48Å; L3-A144 HydrophobicContact CD2-CB 3.98Å; L3-A144 HydrophobicContact CG-CB 3.68Å; L3-A149 HydrophobicContact CD2-CB 3.84Å; L3-L154 HydrophobicContact CD1-CB 4.25Å; L3-L154 HydrophobicContact CD1-CD1 3.68Å; L3-L154 HydrophobicContact CD2-CB 4.24Å; L3-T155 WeakPolarHBondContact CA-O 3.34Å
4	S	79.9	Confident	70.6	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.028	27%	0.272	C	S	.	.			trans	-175.7	139.2	168.3	-167.3	0	0	0	0	109.7	T6 R38 T155 L157	S4-T6 WeakPolarHBondContact CB-O 3.29Å; S4-T6 PolarHBondContact OG-O 3.39Å; S4-R38 CarbonylContact C-O 3.52Å; S4-R38 WeakPolarHBondContact CA-O 3.25Å; S4-R38 WeakPolarHBondContact OG-CB 3.34Å; S4-T155 PolarHBondContact N-O 3.48Å; S4-T155 VanDerWaalsContact N-O 3.1Å; S4-L157 WeakPolarHBondContact O-CD2 3.36Å; S4-L157 WeakPolarHBondContact O-CG 3.22Å
5	K	61.2	Low	70.3	Confident	121 Å²	121	50.3 Å²	50.3	53%	0.526	27%	0.271	S	S	.	.	S	Bend	trans	-81.2	-26.3	172.9	-158.4	-151	-161.8	89.3	0	112.6	R38 E40	K5-R38 PolarHBondContact N-O 2.85Å; K5-E40 HydrophobicContact CB-CG 4.35Å; K5-E40 WeakPolarHBondContact CD-OE2 3.32Å; K5-E40 WeakPolarHBondContact CG-OE2 3.39Å; K5-E40 IonicContact NZ-OE1 2.82Å; K5-E40 PolarHBondContact NZ-OE1 2.9Å; K5-E40 IonicContact NZ-OE2 2.7Å; K5-E40 PolarHBondContact NZ-OE2 3.44Å
6	T	65.4	Low	70.5	Confident	71 Å²	71	53.8 Å²	53.8	44%	0.436	30%	0.295	S	S	.	.	S	Bend	trans	-128.1	168	-178.5	64.5	0	0	0	0	110.7	S4 V8 R38 L157	S4-T6 WeakPolarHBondContact CB-O 3.29Å; S4-T6 PolarHBondContact OG-O 3.39Å; T6-V8 PolarHBondContact O-N 2.86Å; T6-R38 WeakPolarHBondContact OG1-CD 3.37Å; T6-L157 WeakPolarHBondContact O-CD1 3.49Å
7	N	68.6	Low	71.1	Confident	68 Å²	68	52 Å²	52	36%	0.364	29%	0.292	S	S	.	.			trans	-50.3	144.5	175.9	-72.1	-6.9	0	0	0	113.3
8	V	67.3	Low	71.9	Confident	15 Å²	15	59.7 Å²	59.7	9%	0.091	32%	0.322	C	S	.	.			trans	-74.5	142.5	172.4	-160.5	0	0	0	0	108.7	T6 V141 L157 T244 I247 S248	T6-V8 PolarHBondContact O-N 2.86Å; V8-V141 HydrophobicContact CG1-CG1 4.2Å; V8-L157 HydrophobicContact CG2-CD1 3.87Å; V8-T244 HydrophobicContact CB-CG2 3.84Å; V8-T244 HydrophobicContact CG1-CG2 3.26Å; V8-I247 HydrophobicContact CG2-CD1 4.4Å; V8-I247 HydrophobicContact CG2-CG2 4.41Å; V8-S248 PolarHBondContact O-OG 3.44Å
9	K	64.6	Low	72.8	Confident	136 Å²	136	58 Å²	58	59%	0.591	31%	0.312	S	S	*	.			trans	-123.2	136.6	179.5	-57.8	-169.2	-170.3	-179.4	0	110.3	R38	K9-R38 VanDerWaalsContact CB-NH1 3.29Å; K9-R38 VanDerWaalsContact CD-NH2 3.34Å
10	F	70.5	Confident	73.5	Confident	44 Å²	44	56.5 Å²	56.5	19%	0.193	31%	0.308	C	S	.	.			trans	-95.9	143.8	166.3	163.4	-111.6	0	0	0	109.1	A138 P234 R241	F10-A138 WeakPolarHBondContact CD2-O 3.35Å; F10-P234 HydrophobicContact CE2-CG 3.79Å; F10-P234 HydrophobicContact CZ-CG 3.74Å; F10-R241 HydrophobicContact CB-CG 4.04Å; F10-R241 HydrophobicContact CD1-CG 3.68Å; F10-R241 HydrophobicContact CD2-CB 3.77Å; F10-R241 HydrophobicContact CD2-CG 3.54Å; F10-R241 HydrophobicContact CE1-CG 3.94Å; F10-R241 HydrophobicContact CE2-CB 4.08Å; F10-R241 HydrophobicContact CE2-CG 3.81Å; F10-R241 HydrophobicContact CG-CB 4.12Å; F10-R241 HydrophobicContact CG-CG 3.45Å; F10-R241 VanDerWaalsContact CG-CG 3.45Å; F10-R241 HydrophobicContact CZ-CG 3.99Å
11	V	64.7	Low	74.2	Confident	76 Å²	76	59.7 Å²	59.7	46%	0.461	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.5	168.9	176.7	0	0	0	0	107.6	L19 G137 A138	V11-L19 HydrophobicContact CG1-CD1 3.97Å; V11-G137 CarbonylContact O-C 3.45Å; V11-G137 WeakPolarHBondContact O-CA 3.45Å; V11-A138 PolarHBondContact N-O 3.31Å; V11-A138 PolarHBondContact O-N 3.13Å
12	G	59.4	Low	74.5	Confident	26 Å²	26	60.2 Å²	60.2	27%	0.268	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	157.9	169.2	0	0	0	0	0	112.9	D136	G12-D136 CarbonylContact C-O 3.6Å; G12-D136 WeakPolarHBondContact CA-O 3.32Å
13	V	68.2	Low	75	Confident	40 Å²	40	61.4 Å²	61.4	24%	0.242	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	165.4	179.9	-59.2	0	0	0	0	110.2	L19 N135 D136	V13-L19 HydrophobicContact CB-CG 4.47Å; V13-L19 HydrophobicContact CG1-CD1 4.19Å; V13-L19 HydrophobicContact CG1-CG 4.13Å; V13-L19 HydrophobicContact CG2-CB 3.62Å; V13-L19 HydrophobicContact CG2-CD1 3.85Å; V13-L19 HydrophobicContact CG2-CG 3.55Å; V13-N135 WeakPolarHBondContact O-CA 3.28Å; V13-N135 VanDerWaalsContact O-CB 3.23Å; V13-N135 WeakPolarHBondContact O-CB 3.34Å; V13-N135 PolarHBondContact O-ND2 3.14Å; V13-D136 HydrophobicContact CG2-CB 4.49Å; V13-D136 PolarHBondContact N-O 3.11Å; V13-D136 PolarHBondContact O-N 3.48Å; V13-D136 VanDerWaalsContact O-N 3.09Å
14	S	70.7	Confident	75.8	Confident	68 Å²	68	61.2 Å²	61.2	48%	0.476	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	152.6	172.7	56.5	0	0	0	0	112.3	G17 N135	S14-G17 WeakPolarHBondContact O-CA 3.3Å; S14-G17 PolarHBondContact O-N 3.47Å; S14-N135 VanDerWaalsContact CA-ND2 3.31Å; S14-N135 WeakPolarHBondContact CA-ND2 3.39Å; S14-N135 PolarHBondContact N-ND2 3.21Å
15	F	67.3	Low	76.6	Confident	58 Å²	58	61.2 Å²	61.2	25%	0.254	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.4	138.5	166	-179.1	-106.1	0	0	0	111.2	G17 M116 L124 L134	F15-G17 PolarHBondContact O-N 2.89Å; F15-M116 HydrophobicContact CD2-CB 4.29Å; F15-M116 VanDerWaalsContact CE2-O 3.3Å; F15-M116 WeakPolarHBondContact CE2-O 3.41Å; F15-L124 HydrophobicContact CE1-CD1 3.71Å; F15-L124 HydrophobicContact CE2-CD1 4.41Å; F15-L124 HydrophobicContact CZ-CD1 3.42Å; F15-L124 VanDerWaalsContact CZ-CD1 3.42Å; F15-L134 HydrophobicContact CB-CB 4.28Å; F15-L134 VanDerWaalsContact CB-O 3.26Å; F15-L134 WeakPolarHBondContact CB-O 3.41Å; F15-L134 PolarHBondContact N-O 2.63Å
16	T	72.6	Confident	78.2	Confident	105 Å²	105	59.9 Å²	59.9	64%	0.644	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	17.8	-173.4	60.9	0	0	0	0	114.9	S117	T16-S117 PolarHBondContact N-OG 2.83Å
17	G	80.5	Confident	79.7	Confident	24 Å²	24	56.8 Å²	56.8	25%	0.247	32%	0.318	C	S	.	.	S	Bend	trans	-84.5	-159.4	178.4	0	0	0	0	0	114	S14 F15 L19 A20	S14-G17 WeakPolarHBondContact O-CA 3.3Å; S14-G17 PolarHBondContact O-N 3.47Å; F15-G17 PolarHBondContact O-N 2.89Å; G17-L19 PolarHBondContact O-N 2.87Å; G17-L19 VanDerWaalsContact O-N 3.07Å; G17-A20 VanDerWaalsContact O-CB 3.29Å; G17-A20 WeakPolarHBondContact O-CB 3.5Å; G17-A20 PolarHBondContact O-N 2.82Å; G17-A20 VanDerWaalsContact O-N 3.09Å
18	K	86	Confident	81.1	Confident	191 Å²	191	53.6 Å²	53.6	83%	0.83	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-17.9	-174.5	-65.8	-174.5	179.1	-178.8	0	115.3
19	L	88.3	Confident	82.5	Confident	27 Å²	27	53.7 Å²	53.7	14%	0.141	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	3.6	-179	-58	179.1	0	0	0	112.6	V11 V13 G17 T21 V22 L27 N115 D136	V11-L19 HydrophobicContact CG1-CD1 3.97Å; V13-L19 HydrophobicContact CB-CG 4.47Å; V13-L19 HydrophobicContact CG1-CD1 4.19Å; V13-L19 HydrophobicContact CG1-CG 4.13Å; V13-L19 HydrophobicContact CG2-CB 3.62Å; V13-L19 HydrophobicContact CG2-CD1 3.85Å; V13-L19 HydrophobicContact CG2-CG 3.55Å; G17-L19 PolarHBondContact O-N 2.87Å; G17-L19 VanDerWaalsContact O-N 3.07Å; L19-T21 PolarHBondContact O-N 2.69Å; L19-V22 HydrophobicContact CD2-CG2 4.44Å; L19-V22 PolarHBondContact O-N 3.27Å; L19-L27 HydrophobicContact CB-CD2 4.5Å; L19-L27 HydrophobicContact CD1-CD2 3.94Å; L19-L27 HydrophobicContact CD2-CD2 4.15Å; L19-L27 HydrophobicContact CG-CD2 4.42Å; L19-N115 PolarHBondContact O-ND2 2.93Å; L19-D136 HydrophobicContact CB-CB 3.91Å
20	A	86.4	Confident	84	Confident	28 Å²	28	51.9 Å²	51.9	23%	0.231	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-23.9	-176.5	0	0	0	0	0	113.8	G17 Q118	G17-A20 VanDerWaalsContact O-CB 3.29Å; G17-A20 WeakPolarHBondContact O-CB 3.5Å; G17-A20 PolarHBondContact O-N 2.82Å; G17-A20 VanDerWaalsContact O-N 3.09Å; A20-Q118 VanDerWaalsContact O-CG 3.26Å; A20-Q118 WeakPolarHBondContact O-CG 3.15Å; A20-Q118 PolarHBondContact O-NE2 2.86Å
21	T	88.7	Confident	85.3	Confident	124 Å²	124	50.6 Å²	50.6	76%	0.761	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-4.6	178.6	56.2	0	0	0	0	114.2	L19 Q118	L19-T21 PolarHBondContact O-N 2.69Å; T21-Q118 VanDerWaalsContact C-NE2 3.32Å; T21-Q118 PolarHBondContact O-NE2 2.92Å
22	V	92.4	Very high	86.8	Confident	34 Å²	34	47 Å²	47	21%	0.206	27%	0.272	C	S	.	.	S	Bend	trans	-102.3	121.7	-176.1	-174.1	0	0	0	0	109.7	L19 E26 L27 N115	L19-V22 HydrophobicContact CD2-CG2 4.44Å; L19-V22 PolarHBondContact O-N 3.27Å; V22-E26 HydrophobicContact CG1-CB 3.63Å; V22-L27 HydrophobicContact CB-CD2 4.16Å; V22-L27 HydrophobicContact CB-CG 4.36Å; V22-L27 HydrophobicContact CG1-CD2 3.75Å; V22-L27 HydrophobicContact CG1-CG 3.89Å; V22-N115 PolarHBondContact O-ND2 3.01Å
23	S	93.4	Very high	88.6	Confident	25 Å²	25	50.8 Å²	50.8	18%	0.175	28%	0.282	C	S	.	.			trans	-61.8	154.4	-177.9	63	0	0	0	0	112.9	V25 E26 L27	S23-V25 PolarHBondContact O-N 2.81Å; S23-E26 PolarHBondContact N-OE2 3.48Å; S23-E26 PolarHBondContact O-N 3.34Å; S23-E26 WeakPolarHBondContact OG-CB 3.48Å; S23-E26 VanDerWaalsContact OG-CD 3.31Å; S23-E26 WeakPolarHBondContact OG-CG 3.42Å; S23-E26 PolarHBondContact OG-N 2.89Å; S23-E26 VanDerWaalsContact OG-N 3.13Å; S23-E26 PolarHBondContact OG-OE2 3.36Å; S23-L27 WeakPolarHBondContact O-CG 3.28Å; S23-L27 PolarHBondContact O-N 3.22Å
24	A	94.9	Very high	89.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.6	-36.5	173.7	0	0	0	0	0	111.1	E26 L27 G28 T113 N115	A24-E26 PolarHBondContact O-N 3.03Å; A24-L27 PolarHBondContact O-N 3.1Å; A24-G28 PolarHBondContact O-N 3.34Å; A24-T113 HydrophobicContact CB-CG2 4.26Å; A24-T113 VanDerWaalsContact O-CG2 3.32Å; A24-T113 WeakPolarHBondContact O-CG2 3.25Å; A24-T113 PolarHBondContact O-OG1 2.88Å; A24-N115 HydrophobicContact CB-CB 4.1Å
25	V	96.8	Very high	91.1	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-57.8	-50.4	173.3	176	0	0	0	0	111.1	S23 L27 G28 V29 N59 V63 Q66 K70	S23-V25 PolarHBondContact O-N 2.81Å; V25-L27 PolarHBondContact O-N 3.15Å; V25-G28 WeakPolarHBondContact O-CA 3.31Å; V25-G28 PolarHBondContact O-N 3.39Å; V25-G28 VanDerWaalsContact O-N 3.17Å; V25-V29 WeakPolarHBondContact O-CG2 3.31Å; V25-V29 PolarHBondContact O-N 3.21Å; V25-N59 HydrophobicContact CG2-CB 4.42Å; V25-V63 HydrophobicContact CG2-CG1 4.02Å; V25-V63 HydrophobicContact CG2-CG2 4.31Å; V25-Q66 HydrophobicContact CG1-CB 3.63Å; V25-Q66 HydrophobicContact CG2-CB 4.24Å; V25-K70 HydrophobicContact CG1-CD 3.92Å
26	E	96.2	Very high	92.5	Very high	93 Å²	93	47.1 Å²	47.1	44%	0.435	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-39.1	-179.7	-74.8	165.3	146.7	0	0	112.9	V22 S23 A24 G28 V29 I30	V22-E26 HydrophobicContact CG1-CB 3.63Å; S23-E26 PolarHBondContact N-OE2 3.48Å; S23-E26 PolarHBondContact O-N 3.34Å; S23-E26 WeakPolarHBondContact OG-CB 3.48Å; S23-E26 VanDerWaalsContact OG-CD 3.31Å; S23-E26 WeakPolarHBondContact OG-CG 3.42Å; S23-E26 PolarHBondContact OG-N 2.89Å; S23-E26 VanDerWaalsContact OG-N 3.13Å; S23-E26 PolarHBondContact OG-OE2 3.36Å; A24-E26 PolarHBondContact O-N 3.03Å; E26-G28 VanDerWaalsContact C-N 3.3Å; E26-G28 PolarHBondContact O-N 3.38Å; E26-V29 WeakPolarHBondContact O-CB 3.18Å; E26-V29 PolarHBondContact O-N 3.47Å; E26-I30 WeakPolarHBondContact O-CG1 3.3Å; E26-I30 PolarHBondContact O-N 3.19Å
27	L	96.3	Very high	93.6	Very high	7 Å²	7	49.2 Å²	49.2	4%	0.037	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-43.9	172.3	-66.3	176.4	0	0	0	110.8	L19 V22 S23 A24 V25 I30 A31 N115 D136 A138	L19-L27 HydrophobicContact CB-CD2 4.5Å; L19-L27 HydrophobicContact CD1-CD2 3.94Å; L19-L27 HydrophobicContact CD2-CD2 4.15Å; L19-L27 HydrophobicContact CG-CD2 4.42Å; V22-L27 HydrophobicContact CB-CD2 4.16Å; V22-L27 HydrophobicContact CB-CG 4.36Å; V22-L27 HydrophobicContact CG1-CD2 3.75Å; V22-L27 HydrophobicContact CG1-CG 3.89Å; S23-L27 WeakPolarHBondContact O-CG 3.28Å; S23-L27 PolarHBondContact O-N 3.22Å; A24-L27 PolarHBondContact O-N 3.1Å; V25-L27 PolarHBondContact O-N 3.15Å; L27-I30 PolarHBondContact O-N 3.42Å; L27-A31 PolarHBondContact O-N 3.09Å; L27-N115 HydrophobicContact CD1-CB 4.34Å; L27-D136 HydrophobicContact CD1-CB 4.38Å; L27-A138 VanDerWaalsContact C-CB 3.49Å; L27-A138 HydrophobicContact CB-CB 3.8Å; L27-A138 VanDerWaalsContact O-CB 3.26Å; L27-A138 WeakPolarHBondContact O-CB 3.47Å
28	G	97.2	Very high	94.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-46.4	173.2	0	0	0	0	0	112.7	A24 V25 E26 I30 A31 V32	A24-G28 PolarHBondContact O-N 3.34Å; V25-G28 WeakPolarHBondContact O-CA 3.31Å; V25-G28 PolarHBondContact O-N 3.39Å; V25-G28 VanDerWaalsContact O-N 3.17Å; E26-G28 VanDerWaalsContact C-N 3.3Å; E26-G28 PolarHBondContact O-N 3.38Å; G28-I30 PolarHBondContact O-N 3.47Å; G28-A31 PolarHBondContact O-N 3.41Å; G28-V32 WeakPolarHBondContact O-CB 3.47Å; G28-V32 VanDerWaalsContact O-CG2 3.26Å; G28-V32 WeakPolarHBondContact O-CG2 3.43Å; G28-V32 PolarHBondContact O-N 2.81Å
29	V	97.7	Very high	94.6	Very high	17 Å²	17	40.6 Å²	40.6	10%	0.103	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-47.6	176.7	174.8	0	0	0	0	111.4	V25 E26 A31 V32 K33 K70	V25-V29 WeakPolarHBondContact O-CG2 3.31Å; V25-V29 PolarHBondContact O-N 3.21Å; E26-V29 WeakPolarHBondContact O-CB 3.18Å; E26-V29 PolarHBondContact O-N 3.47Å; V29-A31 VanDerWaalsContact C-N 3.35Å; V29-A31 PolarHBondContact O-N 3.41Å; V29-V32 PolarHBondContact O-N 2.95Å; V29-K33 HydrophobicContact CG1-CD 4.12Å; V29-K33 HydrophobicContact CG1-CG 4.36Å; V29-K33 WeakPolarHBondContact O-CB 3.26Å; V29-K33 WeakPolarHBondContact O-CG 3.29Å; V29-K33 PolarHBondContact O-N 2.9Å; V29-K70 HydrophobicContact CB-CB 4.48Å; V29-K70 HydrophobicContact CG1-CB 4.19Å; V29-K70 HydrophobicContact CG2-CB 3.38Å; V29-K70 HydrophobicContact CG2-CD 4.02Å; V29-K70 HydrophobicContact CG2-CG 4.35Å
30	I	96.4	Very high	94.9	Very high	99 Å²	99	44.1 Å²	44.1	51%	0.508	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-46.8	-180	-67.8	164.3	0	0	0	110.2	E26 L27 G28 E34	E26-I30 WeakPolarHBondContact O-CG1 3.3Å; E26-I30 PolarHBondContact O-N 3.19Å; L27-I30 PolarHBondContact O-N 3.42Å; G28-I30 PolarHBondContact O-N 3.47Å; I30-E34 WeakPolarHBondContact O-CB 3.4Å; I30-E34 PolarHBondContact O-N 3.33Å
31	A	96.3	Very high	95.4	Very high	16 Å²	16	43.1 Å²	43.1	13%	0.132	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-44.7	179.6	0	0	0	0	0	112.2	L27 G28 V29 E34 A35 A138 A140	L27-A31 PolarHBondContact O-N 3.09Å; G28-A31 PolarHBondContact O-N 3.41Å; V29-A31 VanDerWaalsContact C-N 3.35Å; V29-A31 PolarHBondContact O-N 3.41Å; A31-E34 PolarHBondContact O-N 2.7Å; A31-A35 VanDerWaalsContact O-CB 3.31Å; A31-A35 WeakPolarHBondContact O-CB 3.22Å; A31-A35 PolarHBondContact O-N 3.46Å; A31-A138 HydrophobicContact CB-CB 3.78Å; A31-A140 HydrophobicContact CB-CB 3.98Å
32	V	97.6	Very high	95.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-48.5	179.5	171.1	0	0	0	0	111.2	G28 V29 E34 A35 I36 M51 A71 I73 I109 A140	G28-V32 WeakPolarHBondContact O-CB 3.47Å; G28-V32 VanDerWaalsContact O-CG2 3.26Å; G28-V32 WeakPolarHBondContact O-CG2 3.43Å; G28-V32 PolarHBondContact O-N 2.81Å; V29-V32 PolarHBondContact O-N 2.95Å; V32-E34 VanDerWaalsContact C-N 3.31Å; V32-E34 PolarHBondContact O-N 2.8Å; V32-A35 PolarHBondContact O-N 3.18Å; V32-I36 HydrophobicContact CG1-CD1 4.05Å; V32-I36 WeakPolarHBondContact O-CG1 3.48Å; V32-I36 PolarHBondContact O-N 2.82Å; V32-M51 HydrophobicContact CG2-CE 4.2Å; V32-M51 HydrophobicContact CG2-SD 4.07Å; V32-A71 HydrophobicContact CB-CB 4Å; V32-A71 HydrophobicContact CG1-CB 3.47Å; V32-A71 VanDerWaalsContact CG1-CB 3.47Å; V32-I73 HydrophobicContact CG1-CD1 3.85Å; V32-I109 HydrophobicContact CG1-CD1 3.85Å; V32-I109 HydrophobicContact CG1-CG2 4.32Å; V32-I109 HydrophobicContact CG2-CG2 4.09Å; V32-A140 HydrophobicContact CG2-CB 4.37Å
33	K	97.2	Very high	96	Very high	107 Å²	107	43 Å²	43	47%	0.465	21%	0.211	S	C	.	.	H	α-helix	trans	-58.2	-44.7	178	-76.4	-172	177.9	-172.7	0	111.9	V29 I36 K37 K70 A71	V29-K33 HydrophobicContact CG1-CD 4.12Å; V29-K33 HydrophobicContact CG1-CG 4.36Å; V29-K33 WeakPolarHBondContact O-CB 3.26Å; V29-K33 WeakPolarHBondContact O-CG 3.29Å; V29-K33 PolarHBondContact O-N 2.9Å; K33-I36 PolarHBondContact O-N 3.36Å; K33-K37 WeakPolarHBondContact O-CB 3.45Å; K33-K37 PolarHBondContact O-N 3.14Å; K33-K70 WeakPolarHBondContact CE-O 3.37Å; K33-K70 PolarHBondContact NZ-O 2.96Å; K33-A71 VanDerWaalsContact CE-CA 3.5Å; K33-A71 HydrophobicContact CG-CB 3.88Å
34	E	95.8	Very high	96.1	Very high	62 Å²	62	47.4 Å²	47.4	29%	0.29	23%	0.233	S	C	.	.	H	α-helix	trans	-70.3	-33.5	-179.8	-173.8	63.7	-171.9	0	0	112	I30 A31 V32 R38	I30-E34 WeakPolarHBondContact O-CB 3.4Å; I30-E34 PolarHBondContact O-N 3.33Å; A31-E34 PolarHBondContact O-N 2.7Å; V32-E34 VanDerWaalsContact C-N 3.31Å; V32-E34 PolarHBondContact O-N 2.8Å; E34-R38 HydrophobicContact CG-CG 4.48Å; E34-R38 VanDerWaalsContact CG-NH2 3.28Å; E34-R38 WeakPolarHBondContact O-CB 3.43Å; E34-R38 VanDerWaalsContact O-CG 3.31Å; E34-R38 WeakPolarHBondContact O-CG 3.49Å; E34-R38 PolarHBondContact O-N 2.94Å; E34-R38 IonicContact OE1-CZ 2.58Å; E34-R38 IonicContact OE1-NE 3.15Å; E34-R38 PolarHBondContact OE1-NE 2.78Å; E34-R38 IonicContact OE1-NH2 2.8Å; E34-R38 PolarHBondContact OE1-NH2 2.73Å
35	A	95.5	Very high	96.3	Very high	11 Å²	11	49.8 Å²	49.8	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-46.6	174.5	0	0	0	0	0	111.7	A31 V32 R38 A39 A140 V142	A31-A35 VanDerWaalsContact O-CB 3.31Å; A31-A35 WeakPolarHBondContact O-CB 3.22Å; A31-A35 PolarHBondContact O-N 3.46Å; V32-A35 PolarHBondContact O-N 3.18Å; A35-R38 PolarHBondContact O-N 2.95Å; A35-A39 VanDerWaalsContact O-CB 3.27Å; A35-A39 WeakPolarHBondContact O-CB 3.43Å; A35-A39 PolarHBondContact O-N 2.9Å; A35-A140 HydrophobicContact CB-CB 3.97Å; A35-V142 HydrophobicContact CB-CG2 4.09Å
36	I	96.1	Very high	96.3	Very high	16 Å²	16	49.8 Å²	49.8	8%	0.082	24%	0.244	C	C	.	.	H	α-helix	trans	-57.6	-52.2	174.2	-69.6	172.6	0	0	0	110.1	V32 K33 R38 A39 E40 I41 A43 I73 I109	V32-I36 HydrophobicContact CG1-CD1 4.05Å; V32-I36 WeakPolarHBondContact O-CG1 3.48Å; V32-I36 PolarHBondContact O-N 2.82Å; K33-I36 PolarHBondContact O-N 3.36Å; I36-R38 VanDerWaalsContact C-N 3.31Å; I36-R38 PolarHBondContact O-N 3.19Å; I36-A39 PolarHBondContact O-N 3.33Å; I36-A39 VanDerWaalsContact O-N 3.12Å; I36-E40 PolarHBondContact O-N 2.85Å; I36-E40 VanDerWaalsContact O-N 3.1Å; I36-I41 HydrophobicContact CG2-CG1 4.2Å; I36-I41 WeakPolarHBondContact CG2-O 3.15Å; I36-A43 HydrophobicContact CD1-CB 4.49Å; I36-I73 HydrophobicContact CD1-CD1 4.2Å; I36-I73 HydrophobicContact CD1-CG1 4.05Å; I36-I109 HydrophobicContact CD1-CD1 3.64Å; I36-I109 HydrophobicContact CG1-CD1 3.52Å
37	K	95.5	Very high	96.4	Very high	149 Å²	149	48.6 Å²	48.6	65%	0.648	24%	0.24	S	C	*	.	H	α-helix	trans	-56.5	-43.9	-179.5	-179.2	-177.2	175.6	-173.5	0	112.4	K33 E40	K33-K37 WeakPolarHBondContact O-CB 3.45Å; K33-K37 PolarHBondContact O-N 3.14Å; K37-E40 PolarHBondContact O-N 3.36Å
38	R	94.1	Very high	96.5	Very high	31 Å²	31	49.7 Å²	49.7	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-74.9	-29	179.6	-72.2	-178.6	-175.5	144.4	9.3	113.1	S4 K5 T6 K9 E34 A35 I36 E40	S4-R38 CarbonylContact C-O 3.52Å; S4-R38 WeakPolarHBondContact CA-O 3.25Å; S4-R38 WeakPolarHBondContact OG-CB 3.34Å; K5-R38 PolarHBondContact N-O 2.85Å; T6-R38 WeakPolarHBondContact OG1-CD 3.37Å; K9-R38 VanDerWaalsContact CB-NH1 3.29Å; K9-R38 VanDerWaalsContact CD-NH2 3.34Å; E34-R38 HydrophobicContact CG-CG 4.48Å; E34-R38 VanDerWaalsContact CG-NH2 3.28Å; E34-R38 WeakPolarHBondContact O-CB 3.43Å; E34-R38 VanDerWaalsContact O-CG 3.31Å; E34-R38 WeakPolarHBondContact O-CG 3.49Å; E34-R38 PolarHBondContact O-N 2.94Å; E34-R38 IonicContact OE1-CZ 2.58Å; E34-R38 IonicContact OE1-NE 3.15Å; E34-R38 PolarHBondContact OE1-NE 2.78Å; E34-R38 IonicContact OE1-NH2 2.8Å; E34-R38 PolarHBondContact OE1-NH2 2.73Å; A35-R38 PolarHBondContact O-N 2.95Å; I36-R38 VanDerWaalsContact C-N 3.31Å; I36-R38 PolarHBondContact O-N 3.19Å; R38-E40 PolarHBondContact O-N 3.28Å
39	A	94.6	Very high	96.6	Very high	2 Å²	2	49.7 Å²	49.7	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-73.7	-12.5	174	0	0	0	0	0	113.1	L3 A35 I36 I41 V142	L3-A39 HydrophobicContact CB-CB 3.81Å; A35-A39 VanDerWaalsContact O-CB 3.27Å; A35-A39 WeakPolarHBondContact O-CB 3.43Å; A35-A39 PolarHBondContact O-N 2.9Å; I36-A39 PolarHBondContact O-N 3.33Å; I36-A39 VanDerWaalsContact O-N 3.12Å; A39-I41 VanDerWaalsContact C-N 3.29Å; A39-I41 HydrophobicContact CB-CG1 4.12Å; A39-I41 HydrophobicContact CB-CG2 4.48Å; A39-I41 PolarHBondContact O-N 3.01Å; A39-V142 HydrophobicContact CB-CB 3.75Å; A39-V142 HydrophobicContact CB-CG1 4Å; A39-V142 HydrophobicContact CB-CG2 3.6Å
40	E	94.5	Very high	96.6	Very high	102 Å²	102	49.3 Å²	49.3	48%	0.477	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	43.5	-177.5	-58.9	-172.6	120.5	0	0	112	K5 I36 K37 R38	K5-E40 HydrophobicContact CB-CG 4.35Å; K5-E40 WeakPolarHBondContact CD-OE2 3.32Å; K5-E40 WeakPolarHBondContact CG-OE2 3.39Å; K5-E40 IonicContact NZ-OE1 2.82Å; K5-E40 PolarHBondContact NZ-OE1 2.9Å; K5-E40 IonicContact NZ-OE2 2.7Å; K5-E40 PolarHBondContact NZ-OE2 3.44Å; I36-E40 PolarHBondContact O-N 2.85Å; I36-E40 VanDerWaalsContact O-N 3.1Å; K37-E40 PolarHBondContact O-N 3.36Å; R38-E40 PolarHBondContact O-N 3.28Å
41	I	96.1	Very high	96.7	Very high	7 Å²	7	44.6 Å²	44.6	4%	0.036	22%	0.218	C	C	.	.			trans	-117.8	157.9	173.1	64.5	166.6	0	0	0	110.4	L3 I36 A39 Q45 V46 V107 V142 L154	L3-I41 HydrophobicContact CD1-CG2 4.32Å; I36-I41 HydrophobicContact CG2-CG1 4.2Å; I36-I41 WeakPolarHBondContact CG2-O 3.15Å; A39-I41 VanDerWaalsContact C-N 3.29Å; A39-I41 HydrophobicContact CB-CG1 4.12Å; A39-I41 HydrophobicContact CB-CG2 4.48Å; A39-I41 PolarHBondContact O-N 3.01Å; I41-Q45 VanDerWaalsContact CA-OE1 3.32Å; I41-V46 HydrophobicContact CD1-CG2 4.12Å; I41-V107 HydrophobicContact CD1-CG1 3.65Å; I41-V142 HydrophobicContact CD1-CG1 3.69Å; I41-V142 HydrophobicContact CD1-CG2 4.39Å; I41-L154 HydrophobicContact CG2-CD1 3.72Å; I41-L154 HydrophobicContact CG2-CD2 3.96Å
42	E	96.6	Very high	96.8	Very high	135 Å²	135	43.8 Å²	43.8	63%	0.631	21%	0.212	S	C	*	.			trans	-85.4	155.5	169.8	-62.7	-55.8	141	0	0	111.1	D44 Q45	E42-D44 VanDerWaalsContact C-N 3.25Å; E42-D44 WeakPolarHBondContact CB-OD1 3.47Å; E42-D44 PolarHBondContact O-N 2.81Å; E42-Q45 HydrophobicContact CB-CG 4.28Å; E42-Q45 WeakPolarHBondContact O-CB 3.23Å; E42-Q45 PolarHBondContact O-N 2.89Å
43	A	97	Very high	96.7	Very high	21 Å²	21	43.8 Å²	43.8	17%	0.174	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-68.7	-24.4	-174.1	0	0	0	0	0	113.4	I36 Q45 G72 I73 P74	I36-A43 HydrophobicContact CD1-CB 4.49Å; A43-Q45 VanDerWaalsContact C-N 3.3Å; A43-G72 WeakPolarHBondContact CB-O 3.26Å; A43-I73 HydrophobicContact CB-CG1 4.41Å; A43-P74 VanDerWaalsContact O-CD 3.29Å; A43-P74 WeakPolarHBondContact O-CD 3.3Å
44	D	96.7	Very high	96.5	Very high	117 Å²	117	39.5 Å²	39.5	63%	0.626	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-78.7	-11.3	176.5	64.3	-9.9	0	0	0	113.7	E42 V46 P74	E42-D44 VanDerWaalsContact C-N 3.25Å; E42-D44 WeakPolarHBondContact CB-OD1 3.47Å; E42-D44 PolarHBondContact O-N 2.81Å; D44-V46 PolarHBondContact O-N 2.83Å; D44-P74 HydrophobicContact CB-CG 4.02Å
45	Q	97.4	Very high	96.3	Very high	50 Å²	50	39.7 Å²	39.7	23%	0.234	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-79.6	-6.1	172.4	-61	-177.8	-74.3	0	0	112.7	I41 E42 A43 V107 Y148	I41-Q45 VanDerWaalsContact CA-OE1 3.32Å; E42-Q45 HydrophobicContact CB-CG 4.28Å; E42-Q45 WeakPolarHBondContact O-CB 3.23Å; E42-Q45 PolarHBondContact O-N 2.89Å; A43-Q45 VanDerWaalsContact C-N 3.3Å; Q45-V107 VanDerWaalsContact O-CB 3.25Å; Q45-V107 WeakPolarHBondContact O-CB 3.43Å; Q45-Y148 PolarHBondContact NE2-OH 3.29Å
46	V	98.3	Very high	96	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.018	21%	0.207	C	C	.	.			trans	-87.2	121	-177.7	-179.6	0	0	0	0	110.3	I41 D44 Q48 V49 I73 V77 V107 I109	I41-V46 HydrophobicContact CD1-CG2 4.12Å; D44-V46 PolarHBondContact O-N 2.83Å; V46-Q48 WeakPolarHBondContact CG1-O 3.37Å; V46-V49 HydrophobicContact CG1-CG2 4.01Å; V46-I73 HydrophobicContact CB-CG2 4.46Å; V46-V77 HydrophobicContact CG1-CG1 4.21Å; V46-V77 WeakPolarHBondContact O-CG1 3.47Å; V46-V77 WeakPolarHBondContact O-CG2 3.33Å; V46-V107 HydrophobicContact CG2-CG1 4.49Å; V46-I109 HydrophobicContact CG1-CD1 4.1Å; V46-I109 HydrophobicContact CG1-CG1 3.89Å; V46-I109 HydrophobicContact CG2-CD1 3.78Å; V46-I109 HydrophobicContact CG2-CG1 4.05Å
47	D	98.3	Very high	95.7	Very high	68 Å²	68	45 Å²	45	36%	0.364	23%	0.233	S	C	.	.			trans	-85.5	-29.3	179.6	-56.5	-63.6	0	0	0	112.7	P78 A105 S106 V107	D47-P78 VanDerWaalsContact O-CD 3.3Å; D47-P78 WeakPolarHBondContact O-CD 3.3Å; D47-P78 WeakPolarHBondContact O-CG 3.48Å; D47-A105 HydrophobicContact CB-CB 3.72Å; D47-S106 WeakPolarHBondContact OD2-CA 3.33Å; D47-S106 PolarHBondContact OD2-N 2.75Å; D47-V107 WeakPolarHBondContact CB-O 3.25Å; D47-V107 PolarHBondContact N-O 2.87Å; D47-V107 PolarHBondContact OD2-N 2.98Å
48	Q	98.2	Very high	95.3	Very high	30 Å²	30	42.2 Å²	42.2	14%	0.14	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	154.7	-178.4	-161.8	158.1	43.8	0	0	113	V46 F50 P78 Q99 V108 I109	V46-Q48 WeakPolarHBondContact CG1-O 3.37Å; Q48-F50 HydrophobicContact CB-CE2 4.29Å; Q48-F50 HydrophobicContact CG-CD2 4.32Å; Q48-F50 HydrophobicContact CG-CE2 3.66Å; Q48-F50 HydrophobicContact CG-CZ 3.77Å; Q48-F50 VanDerWaalsContact OE1-CE2 3.26Å; Q48-P78 WeakPolarHBondContact CA-O 3.34Å; Q48-P78 HydrophobicContact CB-CG 4.35Å; Q48-P78 HydrophobicContact CG-CB 4.37Å; Q48-P78 HydrophobicContact CG-CG 3.96Å; Q48-Q99 VanDerWaalsContact OE1-CG 3.23Å; Q48-V108 HydrophobicContact CB-CG1 4.39Å; Q48-V108 HydrophobicContact CB-CG2 4.27Å; Q48-V108 WeakPolarHBondContact O-CA 3.41Å; Q48-V108 WeakPolarHBondContact O-CG1 3.2Å; Q48-I109 PolarHBondContact O-N 3.16Å
49	V	98.8	Very high	95.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.7	175.2	-174.8	0	0	0	0	111.1	V46 M51 A68 I73 V77 P78 A79 T80 I109	V46-V49 HydrophobicContact CG1-CG2 4.01Å; V49-M51 HydrophobicContact CG1-CG 4.06Å; V49-A68 HydrophobicContact CB-CB 4.29Å; V49-A68 HydrophobicContact CG1-CB 4.31Å; V49-A68 HydrophobicContact CG2-CB 3.95Å; V49-I73 HydrophobicContact CG2-CD1 3.58Å; V49-I73 HydrophobicContact CG2-CG2 4.46Å; V49-V77 HydrophobicContact CG2-CG1 4.33Å; V49-P78 PolarHBondContact N-O 3.4Å; V49-A79 HydrophobicContact CB-CB 3.95Å; V49-A79 CarbonylContact O-C 3.51Å; V49-A79 VanDerWaalsContact O-CA 3.25Å; V49-A79 WeakPolarHBondContact O-CA 3.39Å; V49-T80 PolarHBondContact O-N 3.37Å; V49-I109 CarbonylContact C-O 3.58Å; V49-I109 WeakPolarHBondContact CA-O 3.12Å; V49-I109 HydrophobicContact CG1-CB 4.27Å; V49-I109 HydrophobicContact CG1-CG2 4.29Å; V49-I109 HydrophobicContact CG2-CB 4.26Å
50	F	98.7	Very high	95	Very high	9 Å²	9	43.6 Å²	43.6	4%	0.039	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.4	170.3	-63.8	-76.8	0	0	0	110.1	Q48 T80 I82 S92 F95 Q99 V108 I109 A110 G111	Q48-F50 HydrophobicContact CB-CE2 4.29Å; Q48-F50 HydrophobicContact CG-CD2 4.32Å; Q48-F50 HydrophobicContact CG-CE2 3.66Å; Q48-F50 HydrophobicContact CG-CZ 3.77Å; Q48-F50 VanDerWaalsContact OE1-CE2 3.26Å; F50-T80 WeakPolarHBondContact CA-O 3.44Å; F50-T80 HydrophobicContact CD1-CG2 4.38Å; F50-T80 HydrophobicContact CE1-CG2 4.45Å; F50-I82 HydrophobicContact CB-CD1 4.2Å; F50-I82 HydrophobicContact CD1-CD1 4.01Å; F50-I82 HydrophobicContact CD1-CG1 4.48Å; F50-I82 HydrophobicContact CG-CD1 4.43Å; F50-S92 WeakPolarHBondContact O-CB 3.39Å; F50-F95 HydrophobicContact CD1-CB 4.09Å; F50-F95 HydrophobicContact CD1-CD2 4.08Å; F50-F95 HydrophobicContact CD2-CB 4.08Å; F50-F95 HydrophobicContact CE1-CB 4.05Å; F50-F95 AromaticContact CE1-CD2 3.98Å; F50-F95 HydrophobicContact CE1-CD2 3.98Å; F50-F95 HydrophobicContact CE2-CB 4.03Å; F50-F95 HydrophobicContact CG-CB 4.1Å; F50-F95 HydrophobicContact CZ-CB 4.01Å; F50-Q99 HydrophobicContact CE2-CG 3.98Å; F50-Q99 HydrophobicContact CZ-CG 4.11Å; F50-V108 HydrophobicContact CD2-CG1 3.69Å; F50-V108 HydrophobicContact CE2-CG1 4.04Å; F50-I109 PolarHBondContact N-O 3.13Å; F50-A110 CarbonylContact O-C 3.57Å; F50-A110 WeakPolarHBondContact O-CA 3.4Å; F50-G111 PolarHBondContact O-N 3.42Å
51	M	98.4	Very high	94.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	128	175.5	-62.8	-70.3	-72.3	0	0	111.2	V32 V49 A64 T80 T81 I82 G111	V32-M51 HydrophobicContact CG2-CE 4.2Å; V32-M51 HydrophobicContact CG2-SD 4.07Å; V49-M51 HydrophobicContact CG1-CG 4.06Å; M51-A64 HydrophobicContact CB-CB 3.69Å; M51-A64 HydrophobicContact CG-CB 4.02Å; M51-T80 PolarHBondContact N-O 3.09Å; M51-T80 VanDerWaalsContact N-O 3.13Å; M51-T81 VanDerWaalsContact O-CA 3.3Å; M51-T81 WeakPolarHBondContact O-CA 3.43Å; M51-I82 PolarHBondContact O-N 3.34Å; M51-G111 CarbonylContact C-O 3.59Å; M51-G111 WeakPolarHBondContact CA-O 3.47Å; M51-G111 VanDerWaalsContact SD-CA 3.52Å
52	G	97.3	Very high	95	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	128.8	170	0	0	0	0	0	112.1	I82 S92 G111 G112 T113	G52-I82 WeakPolarHBondContact CA-O 3.42Å; G52-S92 PolarHBondContact N-OG 2.8Å; G52-S92 VanDerWaalsContact N-OG 3.14Å; G52-G111 PolarHBondContact N-O 3.19Å; G52-G112 CarbonylContact O-C 3.57Å; G52-G112 WeakPolarHBondContact O-CA 3.37Å; G52-T113 PolarHBondContact O-N 3.46Å
53	N	96.3	Very high	95	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	27%	0.266	C	S	.	.			trans	-151.6	125.7	166.5	-179.4	-115.5	0	0	0	109.9	Q56 V63 T81 I82 T113 E114	N53-Q56 HydrophobicContact CB-CG 4.39Å; N53-Q56 PolarHBondContact O-NE2 3.19Å; N53-Q56 WeakPolarHBondContact OD1-CG 3.35Å; N53-V63 HydrophobicContact CB-CB 4.25Å; N53-V63 HydrophobicContact CB-CG1 4.22Å; N53-V63 HydrophobicContact CB-CG2 4.43Å; N53-T81 HydrophobicContact CB-CG2 4.13Å; N53-I82 PolarHBondContact N-O 2.86Å; N53-T113 HydrophobicContact CB-CG2 4.4Å; N53-T113 PolarHBondContact ND2-O 3.15Å; N53-E114 PolarHBondContact ND2-OE1 3Å
54	V	93	Very high	95.1	Very high	16 Å²	16	42.3 Å²	42.3	10%	0.097	26%	0.258	C	S	.	.	S	Bend	trans	-96.5	-52.7	-168.4	179.2	0	0	0	0	110.8	Q56 N83 V85 S88 E114 I235	V54-Q56 PolarHBondContact O-N 3.4Å; V54-N83 PolarHBondContact O-ND2 3.31Å; V54-V85 WeakPolarHBondContact CG2-O 3.47Å; V54-S88 WeakPolarHBondContact CG2-OG 3.41Å; V54-E114 WeakPolarHBondContact CB-OE2 3.26Å; V54-E114 PolarHBondContact N-OE2 2.98Å; V54-E114 VanDerWaalsContact N-OE2 3.07Å; V54-I235 HydrophobicContact CB-CG2 4.28Å; V54-I235 HydrophobicContact CG1-CG2 4.41Å; V54-I235 HydrophobicContact CG2-CB 4.32Å; V54-I235 HydrophobicContact CG2-CG2 3.76Å
55	L	90.1	Very high	95.2	Very high	66 Å²	66	40.3 Å²	40.3	35%	0.346	24%	0.242	S	C	.	.			trans	-95	80.4	-177.9	-60	-179.8	0	0	0	109.8	A57 N59 E114 M116 I119	L55-A57 PolarHBondContact O-N 2.74Å; L55-N59 PolarHBondContact O-ND2 3.02Å; L55-N59 VanDerWaalsContact O-ND2 3.14Å; L55-E114 PolarHBondContact N-OE2 3.2Å; L55-M116 HydrophobicContact CD1-CE 3.89Å; L55-I119 HydrophobicContact CB-CG2 4.03Å; L55-I119 HydrophobicContact CD1-CD1 4.29Å; L55-I119 HydrophobicContact CD1-CG2 3.64Å; L55-I119 HydrophobicContact CG-CG2 4.49Å
56	Q	90.8	Very high	95.2	Very high	63 Å²	63	40.4 Å²	40.4	29%	0.294	24%	0.242	S	C	.	.			trans	-79.8	-11.9	-173	-70.9	173.6	50	0	0	114.6	N53 V54 G58 N59 V63 T81	N53-Q56 HydrophobicContact CB-CG 4.39Å; N53-Q56 PolarHBondContact O-NE2 3.19Å; N53-Q56 WeakPolarHBondContact OD1-CG 3.35Å; V54-Q56 PolarHBondContact O-N 3.4Å; Q56-G58 PolarHBondContact O-N 2.95Å; Q56-N59 WeakPolarHBondContact O-CB 2.86Å; Q56-N59 PolarHBondContact O-N 3.48Å; Q56-V63 HydrophobicContact CG-CG2 4.48Å; Q56-T81 HydrophobicContact CG-CG2 4.48Å
57	A	88.7	Confident	95.2	Very high	77 Å²	77	40.2 Å²	40.2	64%	0.636	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	128.3	179.8	0	0	0	0	0	110.5	L55 N59	L55-A57 PolarHBondContact O-N 2.74Å; A57-N59 VanDerWaalsContact C-N 3.27Å; A57-N59 PolarHBondContact O-N 3.5Å
58	G	87.3	Confident	95.2	Very high	89 Å²	89	37.1 Å²	37.1	92%	0.918	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.6	-16.5	-176.2	0	0	0	0	0	115.4	Q56	Q56-G58 PolarHBondContact O-N 2.95Å
59	N	90.6	Very high	95.2	Very high	17 Å²	17	37.5 Å²	37.5	9%	0.091	23%	0.229	C	C	.	.	S	Bend	trans	-85.8	-5.4	179.4	-70.9	-52.8	0	0	0	113.8	V25 L55 Q56 A57 V63 Q66	V25-N59 HydrophobicContact CG2-CB 4.42Å; L55-N59 PolarHBondContact O-ND2 3.02Å; L55-N59 VanDerWaalsContact O-ND2 3.14Å; Q56-N59 WeakPolarHBondContact O-CB 2.86Å; Q56-N59 PolarHBondContact O-N 3.48Å; A57-N59 VanDerWaalsContact C-N 3.27Å; A57-N59 PolarHBondContact O-N 3.5Å; N59-V63 HydrophobicContact CB-CG2 3.7Å; N59-Q66 PolarHBondContact O-NE2 3.39Å
60	G	91.2	Very high	95.2	Very high	45 Å²	45	42.7 Å²	42.7	46%	0.464	25%	0.252	S	S	.	.			trans	79.1	-174.6	-174.2	0	0	0	0	0	113.5
61	Q	93.6	Very high	95.1	Very high	181 Å²	181	42.8 Å²	42.8	85%	0.846	26%	0.255	S	S	*	.	S	Bend	trans	-78.3	142.1	-179.1	-65.8	178.9	-23.2	0	0	111.1	Q66	Q61-Q66 PolarHBondContact O-NE2 3.46Å
62	N	97.2	Very high	95.1	Very high	58 Å²	58	45.2 Å²	45.2	31%	0.31	28%	0.279	S	S	.	.			trans	45.6	73.1	172.5	-166.8	-13.9	0	0	0	113.7	A64 R65 Q66 A79 T81	N62-A64 PolarHBondContact O-N 3.26Å; N62-A64 VanDerWaalsContact O-N 3.13Å; N62-A64 PolarHBondContact OD1-N 2.91Å; N62-R65 HydrophobicContact CB-CB 3.99Å; N62-R65 VanDerWaalsContact CG-CB 3.42Å; N62-R65 WeakPolarHBondContact O-CB 3.44Å; N62-R65 PolarHBondContact O-N 3.37Å; N62-R65 PolarHBondContact OD1-N 3.45Å; N62-Q66 PolarHBondContact O-N 3.12Å; N62-A79 PolarHBondContact ND2-O 3.09Å; N62-T81 PolarHBondContact OD1-N 3.3Å; N62-T81 PolarHBondContact OD1-OG1 3.03Å
63	V	98	Very high	95.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-51.8	-33.4	177.1	175	0	0	0	0	112.7	V25 N53 Q56 N59 Q66 S67 T81 T113	V25-V63 HydrophobicContact CG2-CG1 4.02Å; V25-V63 HydrophobicContact CG2-CG2 4.31Å; N53-V63 HydrophobicContact CB-CB 4.25Å; N53-V63 HydrophobicContact CB-CG1 4.22Å; N53-V63 HydrophobicContact CB-CG2 4.43Å; Q56-V63 HydrophobicContact CG-CG2 4.48Å; N59-V63 HydrophobicContact CB-CG2 3.7Å; V63-Q66 PolarHBondContact O-N 3.1Å; V63-S67 WeakPolarHBondContact O-CB 3.42Å; V63-S67 PolarHBondContact O-N 2.73Å; V63-S67 PolarHBondContact O-OG 2.99Å; V63-T81 PolarHBondContact N-OG1 3.06Å; V63-T113 HydrophobicContact CG1-CG2 3.71Å
64	A	98.4	Very high	95.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.7	-45.8	177	0	0	0	0	0	110.9	M51 N62 S67 A68 A79 T80 T81	M51-A64 HydrophobicContact CB-CB 3.69Å; M51-A64 HydrophobicContact CG-CB 4.02Å; N62-A64 PolarHBondContact O-N 3.26Å; N62-A64 VanDerWaalsContact O-N 3.13Å; N62-A64 PolarHBondContact OD1-N 2.91Å; A64-S67 PolarHBondContact O-N 2.66Å; A64-A68 WeakPolarHBondContact O-CB 3.38Å; A64-A68 PolarHBondContact O-N 3.46Å; A64-A79 HydrophobicContact CB-CB 4.39Å; A64-T80 VanDerWaalsContact CB-O 3.26Å; A64-T80 WeakPolarHBondContact CB-O 3.4Å; A64-T81 PolarHBondContact N-OG1 3.02Å
65	R	98.6	Very high	95.5	Very high	74 Å²	74	54 Å²	54	28%	0.279	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-43.8	176.6	179.7	58.6	176.2	-164.1	-6.4	112.3	N62 S67 A68 V69 Y75 V77 A79	N62-R65 HydrophobicContact CB-CB 3.99Å; N62-R65 VanDerWaalsContact CG-CB 3.42Å; N62-R65 WeakPolarHBondContact O-CB 3.44Å; N62-R65 PolarHBondContact O-N 3.37Å; N62-R65 PolarHBondContact OD1-N 3.45Å; R65-S67 VanDerWaalsContact C-N 3.3Å; R65-S67 PolarHBondContact O-N 3.08Å; R65-A68 PolarHBondContact O-N 3.45Å; R65-V69 WeakPolarHBondContact O-CG2 3.15Å; R65-V69 PolarHBondContact O-N 3.36Å; R65-Y75 PolarHBondContact NH1-O 2.85Å; R65-Y75 PolarHBondContact NH2-O 3.3Å; R65-V77 PolarHBondContact NH1-O 3Å; R65-A79 HydrophobicContact CB-CB 3.96Å
66	Q	98.5	Very high	95.9	Very high	52 Å²	52	58.2 Å²	58.2	24%	0.243	33%	0.334	C	S	.	.	H	α-helix	trans	-61.5	-41.9	175.8	-64.6	-176.9	57	0	0	111.6	V25 N59 Q61 N62 V63 K70	V25-Q66 HydrophobicContact CG1-CB 3.63Å; V25-Q66 HydrophobicContact CG2-CB 4.24Å; N59-Q66 PolarHBondContact O-NE2 3.39Å; Q61-Q66 PolarHBondContact O-NE2 3.46Å; N62-Q66 PolarHBondContact O-N 3.12Å; V63-Q66 PolarHBondContact O-N 3.1Å; Q66-K70 VanDerWaalsContact O-CB 3.28Å; Q66-K70 WeakPolarHBondContact O-CB 3.43Å; Q66-K70 VanDerWaalsContact O-CG 3.27Å; Q66-K70 WeakPolarHBondContact O-CG 3.36Å; Q66-K70 PolarHBondContact O-N 2.96Å; Q66-K70 VanDerWaalsContact O-N 3.11Å
67	S	97.8	Very high	96.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.5	-45	177.5	-56.9	0	0	0	0	111.6	V63 A64 R65 A71	V63-S67 WeakPolarHBondContact O-CB 3.42Å; V63-S67 PolarHBondContact O-N 2.73Å; V63-S67 PolarHBondContact O-OG 2.99Å; A64-S67 PolarHBondContact O-N 2.66Å; R65-S67 VanDerWaalsContact C-N 3.3Å; R65-S67 PolarHBondContact O-N 3.08Å; S67-A71 WeakPolarHBondContact O-CB 3.36Å; S67-A71 PolarHBondContact O-N 3.02Å
68	A	98.3	Very high	96.7	Very high	2 Å²	2	55 Å²	55	2%	0.017	31%	0.312	C	S	.	.	H	α-helix	trans	-61.2	-53.2	179.9	0	0	0	0	0	112.1	V49 A64 R65 K70 A71 G72 I73 A79	V49-A68 HydrophobicContact CB-CB 4.29Å; V49-A68 HydrophobicContact CG1-CB 4.31Å; V49-A68 HydrophobicContact CG2-CB 3.95Å; A64-A68 WeakPolarHBondContact O-CB 3.38Å; A64-A68 PolarHBondContact O-N 3.46Å; R65-A68 PolarHBondContact O-N 3.45Å; A68-K70 PolarHBondContact O-N 3.13Å; A68-A71 WeakPolarHBondContact O-CA 3.41Å; A68-A71 WeakPolarHBondContact O-CB 3.48Å; A68-A71 PolarHBondContact O-N 3.24Å; A68-A71 VanDerWaalsContact O-N 3.08Å; A68-G72 PolarHBondContact O-N 2.83Å; A68-I73 HydrophobicContact CB-CB 4.24Å; A68-I73 HydrophobicContact CB-CD1 3.98Å; A68-I73 WeakPolarHBondContact O-CB 3.4Å; A68-I73 PolarHBondContact O-N 2.9Å; A68-A79 HydrophobicContact CB-CB 4.09Å
69	V	98.4	Very high	97.2	Very high	39 Å²	39	51.2 Å²	51.2	24%	0.236	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-47.1	-179.2	170.1	0	0	0	0	111	R65 A71 G72 Y75	R65-V69 WeakPolarHBondContact O-CG2 3.15Å; R65-V69 PolarHBondContact O-N 3.36Å; V69-A71 PolarHBondContact O-N 2.87Å; V69-G72 PolarHBondContact O-N 2.93Å; V69-Y75 HydrophobicContact CB-CE1 4.36Å; V69-Y75 HydrophobicContact CG1-CD1 4.34Å; V69-Y75 HydrophobicContact CG1-CE1 3.5Å; V69-Y75 VanDerWaalsContact CG1-CE1 3.5Å; V69-Y75 HydrophobicContact CG2-CD1 3.92Å; V69-Y75 HydrophobicContact CG2-CE1 3.86Å
70	K	98.1	Very high	97.6	Very high	108 Å²	108	53.1 Å²	53.1	47%	0.47	28%	0.284	S	S	.	.	H	α-helix	trans	-68.8	-20.5	177.9	-70	176.1	-178.7	-177.1	0	112.9	V25 V29 K33 Q66 A68 G72	V25-K70 HydrophobicContact CG1-CD 3.92Å; V29-K70 HydrophobicContact CB-CB 4.48Å; V29-K70 HydrophobicContact CG1-CB 4.19Å; V29-K70 HydrophobicContact CG2-CB 3.38Å; V29-K70 HydrophobicContact CG2-CD 4.02Å; V29-K70 HydrophobicContact CG2-CG 4.35Å; K33-K70 WeakPolarHBondContact CE-O 3.37Å; K33-K70 PolarHBondContact NZ-O 2.96Å; Q66-K70 VanDerWaalsContact O-CB 3.28Å; Q66-K70 WeakPolarHBondContact O-CB 3.43Å; Q66-K70 VanDerWaalsContact O-CG 3.27Å; Q66-K70 WeakPolarHBondContact O-CG 3.36Å; Q66-K70 PolarHBondContact O-N 2.96Å; Q66-K70 VanDerWaalsContact O-N 3.11Å; A68-K70 PolarHBondContact O-N 3.13Å; K70-G72 VanDerWaalsContact C-N 3.28Å
71	A	97.8	Very high	98	Very high	12 Å²	12	52.2 Å²	52.2	10%	0.099	27%	0.269	C	S	.	.	H	α-helix	trans	-77.1	-12.7	171.7	0	0	0	0	0	113.4	V32 K33 S67 A68 V69	V32-A71 HydrophobicContact CB-CB 4Å; V32-A71 HydrophobicContact CG1-CB 3.47Å; V32-A71 VanDerWaalsContact CG1-CB 3.47Å; K33-A71 VanDerWaalsContact CE-CA 3.5Å; K33-A71 HydrophobicContact CG-CB 3.88Å; S67-A71 WeakPolarHBondContact O-CB 3.36Å; S67-A71 PolarHBondContact O-N 3.02Å; A68-A71 WeakPolarHBondContact O-CA 3.41Å; A68-A71 WeakPolarHBondContact O-CB 3.48Å; A68-A71 PolarHBondContact O-N 3.24Å; A68-A71 VanDerWaalsContact O-N 3.08Å; V69-A71 PolarHBondContact O-N 2.87Å
72	G	98	Very high	98.1	Very high	50 Å²	50	44.2 Å²	44.2	52%	0.515	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	10	-178.3	0	0	0	0	0	114.1	A43 A68 V69 K70	A43-G72 WeakPolarHBondContact CB-O 3.26Å; A68-G72 PolarHBondContact O-N 2.83Å; V69-G72 PolarHBondContact O-N 2.93Å; K70-G72 VanDerWaalsContact C-N 3.28Å
73	I	98.4	Very high	97.9	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	24%	0.239	C	C	.	.			trans	-72	136	175	-58.8	175.4	0	0	0	109	V32 I36 A43 V46 V49 A68 V77 I109	V32-I73 HydrophobicContact CG1-CD1 3.85Å; I36-I73 HydrophobicContact CD1-CD1 4.2Å; I36-I73 HydrophobicContact CD1-CG1 4.05Å; A43-I73 HydrophobicContact CB-CG1 4.41Å; V46-I73 HydrophobicContact CB-CG2 4.46Å; V49-I73 HydrophobicContact CG2-CD1 3.58Å; V49-I73 HydrophobicContact CG2-CG2 4.46Å; A68-I73 HydrophobicContact CB-CB 4.24Å; A68-I73 HydrophobicContact CB-CD1 3.98Å; A68-I73 WeakPolarHBondContact O-CB 3.4Å; A68-I73 PolarHBondContact O-N 2.9Å; I73-V77 HydrophobicContact CG2-CB 3.62Å; I73-V77 HydrophobicContact CG2-CG1 3.72Å; I73-V77 HydrophobicContact CG2-CG2 3.75Å; I73-I109 HydrophobicContact CD1-CD1 3.64Å
74	P	98.4	Very high	97.6	Very high	28 Å²	28	47.2 Å²	47.2	18%	0.182	25%	0.247	C	C	.	.			trans	-56.7	154.1	-176.7	-25.2	33.3	0	0	0	114.3	A43 D44 E76 V77	A43-P74 VanDerWaalsContact O-CD 3.29Å; A43-P74 WeakPolarHBondContact O-CD 3.3Å; D44-P74 HydrophobicContact CB-CG 4.02Å; P74-E76 VanDerWaalsContact C-N 3.27Å; P74-E76 HydrophobicContact CB-CG 4.09Å; P74-E76 VanDerWaalsContact CB-OE1 3.28Å; P74-E76 WeakPolarHBondContact CB-OE1 3.47Å; P74-E76 VanDerWaalsContact CB-OE2 3.29Å; P74-E76 WeakPolarHBondContact CB-OE2 3.32Å; P74-E76 PolarHBondContact O-N 3.1Å; P74-V77 HydrophobicContact CB-CG2 4.16Å; P74-V77 HydrophobicContact CG-CG2 4.37Å; P74-V77 WeakPolarHBondContact O-CB 3.27Å; P74-V77 PolarHBondContact O-N 2.91Å
75	Y	98.1	Very high	97.2	Very high	167 Å²	167	49.7 Å²	49.7	66%	0.655	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-25.3	-174.5	-76.8	-74.3	0	0	0	113.1	R65 V69 V77	R65-Y75 PolarHBondContact NH1-O 2.85Å; R65-Y75 PolarHBondContact NH2-O 3.3Å; V69-Y75 HydrophobicContact CB-CE1 4.36Å; V69-Y75 HydrophobicContact CG1-CD1 4.34Å; V69-Y75 HydrophobicContact CG1-CE1 3.5Å; V69-Y75 VanDerWaalsContact CG1-CE1 3.5Å; V69-Y75 HydrophobicContact CG2-CD1 3.92Å; V69-Y75 HydrophobicContact CG2-CE1 3.86Å; Y75-V77 VanDerWaalsContact C-N 3.26Å; Y75-V77 PolarHBondContact O-N 2.95Å
76	E	97.7	Very high	96.8	Very high	154 Å²	154	47 Å²	47	72%	0.72	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-22.6	175.6	57.5	-89.5	-150.8	0	0	112.8	P74 P78	P74-E76 VanDerWaalsContact C-N 3.27Å; P74-E76 HydrophobicContact CB-CG 4.09Å; P74-E76 VanDerWaalsContact CB-OE1 3.28Å; P74-E76 WeakPolarHBondContact CB-OE1 3.47Å; P74-E76 VanDerWaalsContact CB-OE2 3.29Å; P74-E76 WeakPolarHBondContact CB-OE2 3.32Å; P74-E76 PolarHBondContact O-N 3.1Å; E76-P78 WeakPolarHBondContact O-CD 3.5Å
77	V	98.5	Very high	96.4	Very high	11 Å²	11	44.5 Å²	44.5	7%	0.067	24%	0.243	C	C	.	.	S	Bend	trans	-73.1	119.5	-176.8	179.7	0	0	0	0	110.7	V46 V49 R65 I73 P74 Y75	V46-V77 HydrophobicContact CG1-CG1 4.21Å; V46-V77 WeakPolarHBondContact O-CG1 3.47Å; V46-V77 WeakPolarHBondContact O-CG2 3.33Å; V49-V77 HydrophobicContact CG2-CG1 4.33Å; R65-V77 PolarHBondContact NH1-O 3Å; I73-V77 HydrophobicContact CG2-CB 3.62Å; I73-V77 HydrophobicContact CG2-CG1 3.72Å; I73-V77 HydrophobicContact CG2-CG2 3.75Å; P74-V77 HydrophobicContact CB-CG2 4.16Å; P74-V77 HydrophobicContact CG-CG2 4.37Å; P74-V77 WeakPolarHBondContact O-CB 3.27Å; P74-V77 PolarHBondContact O-N 2.91Å; Y75-V77 VanDerWaalsContact C-N 3.26Å; Y75-V77 PolarHBondContact O-N 2.95Å
78	P	98.3	Very high	96.2	Very high	62 Å²	62	44.5 Å²	44.5	40%	0.403	24%	0.243	S	C	.	.			trans	-64.5	141	178	23.5	-32.3	0	0	0	112.1	D47 Q48 V49 E76	D47-P78 VanDerWaalsContact O-CD 3.3Å; D47-P78 WeakPolarHBondContact O-CD 3.3Å; D47-P78 WeakPolarHBondContact O-CG 3.48Å; Q48-P78 WeakPolarHBondContact CA-O 3.34Å; Q48-P78 HydrophobicContact CB-CG 4.35Å; Q48-P78 HydrophobicContact CG-CB 4.37Å; Q48-P78 HydrophobicContact CG-CG 3.96Å; V49-P78 PolarHBondContact N-O 3.4Å; E76-P78 WeakPolarHBondContact O-CD 3.5Å
79	A	98.6	Very high	95.9	Very high	10 Å²	10	44.4 Å²	44.4	8%	0.083	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	131.1	177.7	0	0	0	0	0	111.2	V49 N62 A64 R65 A68	V49-A79 HydrophobicContact CB-CB 3.95Å; V49-A79 CarbonylContact O-C 3.51Å; V49-A79 VanDerWaalsContact O-CA 3.25Å; V49-A79 WeakPolarHBondContact O-CA 3.39Å; N62-A79 PolarHBondContact ND2-O 3.09Å; A64-A79 HydrophobicContact CB-CB 4.39Å; R65-A79 HydrophobicContact CB-CB 3.96Å; A68-A79 HydrophobicContact CB-CB 4.09Å
80	T	98.6	Very high	95.7	Very high	56 Å²	56	42.5 Å²	42.5	34%	0.344	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.8	-173.1	-57.9	0	0	0	0	111.5	V49 F50 M51 A64 I82	V49-T80 PolarHBondContact O-N 3.37Å; F50-T80 WeakPolarHBondContact CA-O 3.44Å; F50-T80 HydrophobicContact CD1-CG2 4.38Å; F50-T80 HydrophobicContact CE1-CG2 4.45Å; M51-T80 PolarHBondContact N-O 3.09Å; M51-T80 VanDerWaalsContact N-O 3.13Å; A64-T80 VanDerWaalsContact CB-O 3.26Å; A64-T80 WeakPolarHBondContact CB-O 3.4Å; T80-I82 HydrophobicContact CG2-CG1 4.47Å
81	T	98.4	Very high	95.5	Very high	26 Å²	26	38.5 Å²	38.5	16%	0.16	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.5	167.4	-67.3	0	0	0	0	110.4	M51 N53 Q56 N62 V63 A64	M51-T81 VanDerWaalsContact O-CA 3.3Å; M51-T81 WeakPolarHBondContact O-CA 3.43Å; N53-T81 HydrophobicContact CB-CG2 4.13Å; Q56-T81 HydrophobicContact CG-CG2 4.48Å; N62-T81 PolarHBondContact OD1-N 3.3Å; N62-T81 PolarHBondContact OD1-OG1 3.03Å; V63-T81 PolarHBondContact N-OG1 3.06Å; A64-T81 PolarHBondContact N-OG1 3.02Å
82	I	95.8	Very high	95.4	Very high	14 Å²	14	38 Å²	38	7%	0.072	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	133.6	176.6	-54.6	179.2	0	0	0	109.3	F50 M51 G52 N53 T80 S88 K91 F95	F50-I82 HydrophobicContact CB-CD1 4.2Å; F50-I82 HydrophobicContact CD1-CD1 4.01Å; F50-I82 HydrophobicContact CD1-CG1 4.48Å; F50-I82 HydrophobicContact CG-CD1 4.43Å; M51-I82 PolarHBondContact O-N 3.34Å; G52-I82 WeakPolarHBondContact CA-O 3.42Å; N53-I82 PolarHBondContact N-O 2.86Å; T80-I82 HydrophobicContact CG2-CG1 4.47Å; I82-S88 WeakPolarHBondContact O-CB 3.3Å; I82-K91 HydrophobicContact CD1-CB 4.25Å; I82-K91 HydrophobicContact CD1-CG 4.01Å; I82-K91 HydrophobicContact CG2-CB 3.88Å; I82-K91 HydrophobicContact CG2-CG 3.76Å; I82-F95 HydrophobicContact CD1-CB 4.42Å; I82-F95 HydrophobicContact CD1-CD2 3.31Å; I82-F95 HydrophobicContact CD1-CE2 3.78Å; I82-F95 HydrophobicContact CD1-CG 4.06Å; I82-F95 HydrophobicContact CG1-CD2 4.26Å; I82-F95 HydrophobicContact CG1-CE2 4.4Å
83	N	93.3	Very high	95.3	Very high	84 Å²	84	35.6 Å²	35.6	45%	0.449	18%	0.184	S	C	.	.			trans	-124.2	106.3	169.4	-171.9	-9.9	0	0	0	109.7	V54 V85	V54-N83 PolarHBondContact O-ND2 3.31Å; N83-V85 PolarHBondContact OD1-N 2.83Å
84	E	91.1	Very high	95.1	Very high	37 Å²	37	35.3 Å²	35.3	17%	0.173	18%	0.183	C	C	.	.			trans	-133.2	37.1	173	-143.5	-169.6	61.7	0	0	109.2	C86 G87 S88 K91 I264 R275	E84-C86 PolarHBondContact O-N 3.2Å; E84-G87 WeakPolarHBondContact O-CA 3.07Å; E84-G87 PolarHBondContact O-N 2.67Å; E84-S88 PolarHBondContact N-OG 3.42Å; E84-K91 VanDerWaalsContact OE2-CE 3.3Å; E84-K91 WeakPolarHBondContact OE2-CE 3.36Å; E84-K91 IonicContact OE2-NZ 3.96Å; E84-I264 HydrophobicContact CB-CG2 4.31Å; E84-I264 VanDerWaalsContact CD-CG2 3.41Å; E84-I264 HydrophobicContact CG-CG2 3.43Å; E84-I264 VanDerWaalsContact CG-CG2 3.43Å; E84-I264 WeakPolarHBondContact OE1-CG2 3.35Å; E84-R275 VanDerWaalsContact CD-NH2 3.35Å; E84-R275 IonicContact OE1-CZ 2.73Å; E84-R275 IonicContact OE1-NH1 3.23Å; E84-R275 PolarHBondContact OE1-NH1 2.98Å; E84-R275 IonicContact OE1-NH2 3.2Å; E84-R275 PolarHBondContact OE1-NH2 3.14Å; E84-R275 IonicContact OE2-NH2 3.53Å; E84-R275 PolarHBondContact OE2-NH2 2.58Å
85	V	90.8	Very high	95	Very high	51 Å²	51	37 Å²	37	31%	0.309	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	51.4	-130.5	-172.1	-163.7	0	0	0	0	110.1	V54 N83 G87 S88 I235 G265	V54-V85 WeakPolarHBondContact CG2-O 3.47Å; N83-V85 PolarHBondContact OD1-N 2.83Å; V85-G87 PolarHBondContact O-N 3.09Å; V85-S88 PolarHBondContact N-OG 3.04Å; V85-S88 WeakPolarHBondContact O-CB 3.46Å; V85-S88 PolarHBondContact O-N 2.79Å; V85-S88 VanDerWaalsContact O-N 3.11Å; V85-S88 PolarHBondContact O-OG 3.09Å; V85-I235 HydrophobicContact CG1-CG2 3.98Å; V85-G265 WeakPolarHBondContact CG2-O 2.95Å
86	C	89.8	Confident	95	Very high	17 Å²	17	29 Å²	29	12%	0.115	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-54.8	-31.8	-178.6	-48.7	0	0	0	0	111.6	E84 S88 H233 I235 L262 C263	E84-C86 PolarHBondContact O-N 3.2Å; C86-S88 PolarHBondContact O-N 2.96Å; C86-H233 PolarHBondContact SG-NE2 2.8Å; C86-I235 HydrophobicContact CB-CG2 4.31Å; C86-L262 VanDerWaalsContact C-CD2 3.48Å; C86-L262 HydrophobicContact CB-CD2 4.33Å; C86-L262 HydrophobicContact CB-CG 4.49Å; C86-L262 WeakPolarHBondContact O-CD2 3.48Å; C86-C263 WeakPolarHBondContact CB-O 3.33Å
87	G	89.5	Confident	94.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-68.5	-15	-176.7	0	0	0	0	0	115.1	E84 V85 G89 M90 K91 L262 C263 R275	E84-G87 WeakPolarHBondContact O-CA 3.07Å; E84-G87 PolarHBondContact O-N 2.67Å; V85-G87 PolarHBondContact O-N 3.09Å; G87-G89 PolarHBondContact O-N 3.04Å; G87-M90 CarbonylContact O-C 3.47Å; G87-M90 PolarHBondContact O-N 3.33Å; G87-M90 VanDerWaalsContact O-N 3.13Å; G87-K91 PolarHBondContact O-N 3.39Å; G87-L262 VanDerWaalsContact CA-CD2 3.48Å; G87-C263 PolarHBondContact N-O 3.15Å; G87-R275 PolarHBondContact O-NH1 3.2Å; G87-R275 VanDerWaalsContact O-NH1 3.09Å
88	S	93.9	Very high	94.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.4	-48.2	-167.6	-54.5	0	0	0	0	114	V54 I82 E84 V85 C86 M90 K91 S92	V54-S88 WeakPolarHBondContact CG2-OG 3.41Å; I82-S88 WeakPolarHBondContact O-CB 3.3Å; E84-S88 PolarHBondContact N-OG 3.42Å; V85-S88 PolarHBondContact N-OG 3.04Å; V85-S88 WeakPolarHBondContact O-CB 3.46Å; V85-S88 PolarHBondContact O-N 2.79Å; V85-S88 VanDerWaalsContact O-N 3.11Å; V85-S88 PolarHBondContact O-OG 3.09Å; C86-S88 PolarHBondContact O-N 2.96Å; S88-M90 PolarHBondContact O-N 2.73Å; S88-K91 WeakPolarHBondContact O-CB 2.99Å; S88-K91 PolarHBondContact O-N 3.26Å; S88-S92 PolarHBondContact O-N 3.07Å; S88-S92 PolarHBondContact O-OG 3.25Å
89	G	93.3	Very high	94.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-37.8	179.7	0	0	0	0	0	112.7	G87 S92 I93 G236 T240	G87-G89 PolarHBondContact O-N 3.04Å; G89-S92 WeakPolarHBondContact O-CB 3.42Å; G89-S92 PolarHBondContact O-N 2.83Å; G89-I93 PolarHBondContact O-N 3.14Å; G89-G236 WeakPolarHBondContact CA-O 3.43Å; G89-G236 PolarHBondContact N-O 2.94Å; G89-T240 WeakPolarHBondContact CA-OG1 3.48Å; G89-T240 PolarHBondContact O-OG1 2.55Å; G89-T240 VanDerWaalsContact O-OG1 3.11Å
90	M	92.7	Very high	94.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-73.9	-31.4	176	-160.6	176.1	-76.5	0	0	111.5	G87 S88 S92 I93 I94 V243 A260 L262 R275 I277	G87-M90 CarbonylContact O-C 3.47Å; G87-M90 PolarHBondContact O-N 3.33Å; G87-M90 VanDerWaalsContact O-N 3.13Å; S88-M90 PolarHBondContact O-N 2.73Å; M90-S92 VanDerWaalsContact C-N 3.29Å; M90-I93 PolarHBondContact O-N 3.41Å; M90-I94 PolarHBondContact O-N 2.92Å; M90-I94 VanDerWaalsContact O-N 3.09Å; M90-V243 HydrophobicContact CE-CG2 4.33Å; M90-A260 HydrophobicContact CE-CB 4Å; M90-L262 HydrophobicContact CE-CB 3.92Å; M90-R275 HydrophobicContact CG-CG 3.96Å; M90-R275 HydrophobicContact SD-CB 3.89Å; M90-R275 HydrophobicContact SD-CG 3.53Å; M90-R275 VanDerWaalsContact SD-CG 3.53Å; M90-I277 HydrophobicContact CG-CD1 3.8Å; M90-I277 HydrophobicContact CG-CG1 4.35Å; M90-I277 HydrophobicContact SD-CD1 4.5Å; M90-I277 HydrophobicContact SD-CG1 4.49Å
91	K	94.1	Very high	94.5	Very high	24 Å²	24	27.7 Å²	27.7	10%	0.104	14%	0.142	C	C	.	.	H	α-helix	trans	-62.4	-41.5	172.7	-167.7	59.7	157.3	172.8	0	110.7	I82 E84 G87 S88 I93 I94 F95 E165 R275	I82-K91 HydrophobicContact CD1-CB 4.25Å; I82-K91 HydrophobicContact CD1-CG 4.01Å; I82-K91 HydrophobicContact CG2-CB 3.88Å; I82-K91 HydrophobicContact CG2-CG 3.76Å; E84-K91 VanDerWaalsContact OE2-CE 3.3Å; E84-K91 WeakPolarHBondContact OE2-CE 3.36Å; E84-K91 IonicContact OE2-NZ 3.96Å; G87-K91 PolarHBondContact O-N 3.39Å; S88-K91 WeakPolarHBondContact O-CB 2.99Å; S88-K91 PolarHBondContact O-N 3.26Å; K91-I93 VanDerWaalsContact C-N 3.27Å; K91-I93 PolarHBondContact O-N 3.44Å; K91-I94 PolarHBondContact O-N 3.44Å; K91-I94 VanDerWaalsContact O-N 3.09Å; K91-F95 HydrophobicContact CD-CD1 4.09Å; K91-F95 HydrophobicContact CD-CE1 3.8Å; K91-F95 HydrophobicContact CD-CZ 4.15Å; K91-F95 HydrophobicContact CG-CD1 4.25Å; K91-F95 HydrophobicContact CG-CD2 4.44Å; K91-F95 HydrophobicContact CG-CE1 4.11Å; K91-F95 HydrophobicContact CG-CE2 4.23Å; K91-F95 HydrophobicContact CG-CG 4.44Å; K91-F95 HydrophobicContact CG-CZ 4.08Å; K91-F95 PolarHBondContact O-N 3.29Å; K91-E165 IonicContact NZ-OE1 2.83Å; K91-E165 PolarHBondContact NZ-OE1 3.31Å; K91-R275 VanDerWaalsContact CA-NH1 3.26Å; K91-R275 VanDerWaalsContact CD-CZ 3.47Å; K91-R275 VanDerWaalsContact CD-NH2 3.31Å; K91-R275 VanDerWaalsContact N-NH1 3.19Å
92	S	96.3	Very high	94.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.1	-42	177.4	-58.5	0	0	0	0	111.3	F50 G52 S88 G89 M90 G96 A110 G111	F50-S92 WeakPolarHBondContact O-CB 3.39Å; G52-S92 PolarHBondContact N-OG 2.8Å; G52-S92 VanDerWaalsContact N-OG 3.14Å; S88-S92 PolarHBondContact O-N 3.07Å; S88-S92 PolarHBondContact O-OG 3.25Å; G89-S92 WeakPolarHBondContact O-CB 3.42Å; G89-S92 PolarHBondContact O-N 2.83Å; M90-S92 VanDerWaalsContact C-N 3.29Å; S92-G96 PolarHBondContact O-N 2.88Å; S92-A110 WeakPolarHBondContact O-CB 3.27Å; S92-G111 WeakPolarHBondContact CB-O 3.12Å; S92-G111 PolarHBondContact OG-O 2.74Å
93	I	95.6	Very high	94.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-43.5	175	-64.4	170.7	0	0	0	111.3	G89 M90 K91 G96 M97 A110 V141 L143 I160 T240 V243 I277	G89-I93 PolarHBondContact O-N 3.14Å; M90-I93 PolarHBondContact O-N 3.41Å; K91-I93 VanDerWaalsContact C-N 3.27Å; K91-I93 PolarHBondContact O-N 3.44Å; I93-G96 PolarHBondContact O-N 3.11Å; I93-M97 WeakPolarHBondContact O-CB 3.28Å; I93-M97 PolarHBondContact O-N 3.17Å; I93-A110 HydrophobicContact CB-CB 4.35Å; I93-A110 HydrophobicContact CG1-CB 3.87Å; I93-V141 HydrophobicContact CD1-CG2 4.19Å; I93-V141 HydrophobicContact CG1-CG2 4.01Å; I93-L143 HydrophobicContact CG2-CD1 4.15Å; I93-L143 HydrophobicContact CG2-CD2 4.42Å; I93-L143 WeakPolarHBondContact O-CD1 3.4Å; I93-I160 HydrophobicContact CG2-CD1 3.55Å; I93-T240 HydrophobicContact CD1-CG2 4.13Å; I93-V243 HydrophobicContact CD1-CB 3.97Å; I93-V243 HydrophobicContact CD1-CG1 4.07Å; I93-V243 HydrophobicContact CD1-CG2 3.83Å; I93-I277 HydrophobicContact CB-CD1 4.1Å; I93-I277 HydrophobicContact CG2-CD1 3.56Å
94	I	94.3	Very high	94.7	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-43.5	178.8	-70.2	-171.1	0	0	0	111.9	M90 K91 M97 Q98 Y163 R275 I277	M90-I94 PolarHBondContact O-N 2.92Å; M90-I94 VanDerWaalsContact O-N 3.09Å; K91-I94 PolarHBondContact O-N 3.44Å; K91-I94 VanDerWaalsContact O-N 3.09Å; I94-M97 PolarHBondContact O-N 3.05Å; I94-Q98 HydrophobicContact CG2-CG 4.2Å; I94-Q98 WeakPolarHBondContact O-CB 2.86Å; I94-Q98 VanDerWaalsContact O-CG 3.25Å; I94-Q98 WeakPolarHBondContact O-CG 3.19Å; I94-Q98 PolarHBondContact O-N 2.98Å; I94-Y163 HydrophobicContact CD1-CD1 4.42Å; I94-Y163 HydrophobicContact CD1-CD2 3.37Å; I94-Y163 HydrophobicContact CD1-CE2 3.97Å; I94-Y163 HydrophobicContact CD1-CG 3.6Å; I94-Y163 HydrophobicContact CG1-CD2 4.37Å; I94-Y163 HydrophobicContact CG1-CG 4.22Å; I94-Y163 HydrophobicContact CG2-CD2 4.35Å; I94-Y163 HydrophobicContact CG2-CE1 4.26Å; I94-Y163 HydrophobicContact CG2-CE2 4.04Å; I94-R275 HydrophobicContact CD1-CG 3.54Å; I94-R275 VanDerWaalsContact CD1-NE 3.27Å; I94-I277 HydrophobicContact CG1-CD1 4.5Å
95	F	96.8	Very high	95	Very high	63 Å²	63	39.5 Å²	39.5	28%	0.276	20%	0.201	S	C	.	.	H	α-helix	trans	-61	-47.3	176.6	-80	3.4	0	0	0	110.5	F50 I82 K91 M97 Q98 Q99	F50-F95 HydrophobicContact CD1-CB 4.09Å; F50-F95 HydrophobicContact CD1-CD2 4.08Å; F50-F95 HydrophobicContact CD2-CB 4.08Å; F50-F95 HydrophobicContact CE1-CB 4.05Å; F50-F95 AromaticContact CE1-CD2 3.98Å; F50-F95 HydrophobicContact CE1-CD2 3.98Å; F50-F95 HydrophobicContact CE2-CB 4.03Å; F50-F95 HydrophobicContact CG-CB 4.1Å; F50-F95 HydrophobicContact CZ-CB 4.01Å; I82-F95 HydrophobicContact CD1-CB 4.42Å; I82-F95 HydrophobicContact CD1-CD2 3.31Å; I82-F95 HydrophobicContact CD1-CE2 3.78Å; I82-F95 HydrophobicContact CD1-CG 4.06Å; I82-F95 HydrophobicContact CG1-CD2 4.26Å; I82-F95 HydrophobicContact CG1-CE2 4.4Å; K91-F95 HydrophobicContact CD-CD1 4.09Å; K91-F95 HydrophobicContact CD-CE1 3.8Å; K91-F95 HydrophobicContact CD-CZ 4.15Å; K91-F95 HydrophobicContact CG-CD1 4.25Å; K91-F95 HydrophobicContact CG-CD2 4.44Å; K91-F95 HydrophobicContact CG-CE1 4.11Å; K91-F95 HydrophobicContact CG-CE2 4.23Å; K91-F95 HydrophobicContact CG-CG 4.44Å; K91-F95 HydrophobicContact CG-CZ 4.08Å; K91-F95 PolarHBondContact O-N 3.29Å; F95-M97 VanDerWaalsContact C-N 3.32Å; F95-M97 PolarHBondContact O-N 3.33Å; F95-Q98 WeakPolarHBondContact O-CB 3.46Å; F95-Q98 PolarHBondContact O-N 2.8Å; F95-Q98 VanDerWaalsContact O-N 3.09Å; F95-Q99 VanDerWaalsContact O-CG 3.28Å; F95-Q99 WeakPolarHBondContact O-CG 3.42Å; F95-Q99 PolarHBondContact O-N 3.45Å
96	G	97	Very high	95.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-40.6	175.6	0	0	0	0	0	113.5	S92 I93 Q98 Q99 I100 V108	S92-G96 PolarHBondContact O-N 2.88Å; I93-G96 PolarHBondContact O-N 3.11Å; G96-Q98 VanDerWaalsContact C-N 3.35Å; G96-Q98 PolarHBondContact O-N 2.97Å; G96-Q99 PolarHBondContact O-N 3.46Å; G96-I100 WeakPolarHBondContact O-CG1 3.48Å; G96-I100 PolarHBondContact O-N 2.8Å; G96-I100 VanDerWaalsContact O-N 3.14Å; G96-V108 VanDerWaalsContact CA-CG1 3.49Å
97	M	95.3	Very high	95.7	Very high	23 Å²	23	38.6 Å²	38.6	11%	0.113	20%	0.198	C	C	.	.	H	α-helix	trans	-62.2	-41.3	173.4	-173.6	-162	68.4	0	0	112.1	I93 I94 F95 I100 L101 I160 Y163	I93-M97 WeakPolarHBondContact O-CB 3.28Å; I93-M97 PolarHBondContact O-N 3.17Å; I94-M97 PolarHBondContact O-N 3.05Å; F95-M97 VanDerWaalsContact C-N 3.32Å; F95-M97 PolarHBondContact O-N 3.33Å; M97-I100 PolarHBondContact O-N 2.85Å; M97-L101 HydrophobicContact CE-CD1 3.84Å; M97-L101 HydrophobicContact CG-CD1 3.95Å; M97-L101 HydrophobicContact CG-CG 4.38Å; M97-L101 WeakPolarHBondContact O-CB 3.17Å; M97-L101 VanDerWaalsContact O-CG 3.26Å; M97-L101 WeakPolarHBondContact O-CG 2.89Å; M97-L101 PolarHBondContact O-N 3.06Å; M97-L101 HydrophobicContact SD-CD1 4.23Å; M97-I160 HydrophobicContact CG-CG2 4.49Å; M97-I160 HydrophobicContact SD-CB 4.3Å; M97-I160 HydrophobicContact SD-CG2 3.41Å; M97-I160 WeakPolarHBondContact SD-CG2 3.37Å; M97-Y163 HydrophobicContact CE-CD1 3.22Å; M97-Y163 HydrophobicContact CE-CE1 3.35Å; M97-Y163 HydrophobicContact CE-CG 4.36Å; M97-Y163 HydrophobicContact SD-CD1 4.42Å
98	Q	96.5	Very high	96.2	Very high	51 Å²	51	38.6 Å²	38.6	24%	0.238	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-42.4	178.2	-75.7	172.1	-20.9	0	0	111.8	I94 F95 G96 I100 L101 L102 Y163	I94-Q98 HydrophobicContact CG2-CG 4.2Å; I94-Q98 WeakPolarHBondContact O-CB 2.86Å; I94-Q98 VanDerWaalsContact O-CG 3.25Å; I94-Q98 WeakPolarHBondContact O-CG 3.19Å; I94-Q98 PolarHBondContact O-N 2.98Å; F95-Q98 WeakPolarHBondContact O-CB 3.46Å; F95-Q98 PolarHBondContact O-N 2.8Å; F95-Q98 VanDerWaalsContact O-N 3.09Å; G96-Q98 VanDerWaalsContact C-N 3.35Å; G96-Q98 PolarHBondContact O-N 2.97Å; Q98-I100 VanDerWaalsContact C-N 3.29Å; Q98-I100 PolarHBondContact O-N 3.5Å; Q98-L101 PolarHBondContact O-N 3.49Å; Q98-L102 WeakPolarHBondContact O-CB 3.45Å; Q98-L102 WeakPolarHBondContact O-CG 3.38Å; Q98-L102 PolarHBondContact O-N 3.48Å; Q98-Y163 PolarHBondContact NE2-OH 3.11Å
99	Q	97.9	Very high	96.4	Very high	50 Å²	50	38.6 Å²	38.6	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-42	176.4	-62.6	-65.9	-43.6	0	0	111.1	Q48 F50 F95 G96 L102 N103 E104 A105 V108	Q48-Q99 VanDerWaalsContact OE1-CG 3.23Å; F50-Q99 HydrophobicContact CE2-CG 3.98Å; F50-Q99 HydrophobicContact CZ-CG 4.11Å; F95-Q99 VanDerWaalsContact O-CG 3.28Å; F95-Q99 WeakPolarHBondContact O-CG 3.42Å; F95-Q99 PolarHBondContact O-N 3.45Å; G96-Q99 PolarHBondContact O-N 3.46Å; Q99-L102 PolarHBondContact O-N 2.86Å; Q99-N103 PolarHBondContact O-N 2.91Å; Q99-E104 PolarHBondContact O-N 3.07Å; Q99-A105 HydrophobicContact CB-CB 3.93Å; Q99-A105 PolarHBondContact O-N 3.49Å; Q99-V108 HydrophobicContact CB-CG2 4.43Å
100	I	97.3	Very high	96.6	Very high	21 Å²	21	38.6 Å²	38.6	11%	0.108	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-44	174.3	-68.2	164.1	0	0	0	112	G96 M97 Q98 L102 N103 A105 V108 L143 A145	G96-I100 WeakPolarHBondContact O-CG1 3.48Å; G96-I100 PolarHBondContact O-N 2.8Å; G96-I100 VanDerWaalsContact O-N 3.14Å; M97-I100 PolarHBondContact O-N 2.85Å; Q98-I100 VanDerWaalsContact C-N 3.29Å; Q98-I100 PolarHBondContact O-N 3.5Å; I100-L102 VanDerWaalsContact C-N 3.3Å; I100-L102 PolarHBondContact O-N 2.89Å; I100-N103 PolarHBondContact O-N 3.29Å; I100-N103 VanDerWaalsContact O-N 3.14Å; I100-A105 VanDerWaalsContact CA-O 3.31Å; I100-A105 WeakPolarHBondContact CA-O 3.41Å; I100-V108 HydrophobicContact CD1-CB 4.48Å; I100-V108 HydrophobicContact CD1-CG2 4.31Å; I100-V108 HydrophobicContact CG1-CG2 4.19Å; I100-L143 HydrophobicContact CD1-CB 3.68Å; I100-A145 HydrophobicContact CG2-CB 3.82Å
101	L	95.4	Very high	96.8	Very high	119 Å²	119	38.6 Å²	38.6	62%	0.623	20%	0.198	S	C	*	.	H	α-helix	trans	-69	-28.2	179.6	-72.5	171.3	0	0	0	113.2	M97 Q98 N103	M97-L101 HydrophobicContact CE-CD1 3.84Å; M97-L101 HydrophobicContact CG-CD1 3.95Å; M97-L101 HydrophobicContact CG-CG 4.38Å; M97-L101 WeakPolarHBondContact O-CB 3.17Å; M97-L101 VanDerWaalsContact O-CG 3.26Å; M97-L101 WeakPolarHBondContact O-CG 2.89Å; M97-L101 PolarHBondContact O-N 3.06Å; M97-L101 HydrophobicContact SD-CD1 4.23Å; Q98-L101 PolarHBondContact O-N 3.49Å; L101-N103 VanDerWaalsContact C-N 3.26Å
102	L	97.3	Very high	96.9	Very high	114 Å²	114	37.5 Å²	37.5	60%	0.597	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-4.2	174.6	-67.3	170	0	0	0	112.5	Q98 Q99 I100 E104	Q98-L102 WeakPolarHBondContact O-CB 3.45Å; Q98-L102 WeakPolarHBondContact O-CG 3.38Å; Q98-L102 PolarHBondContact O-N 3.48Å; Q99-L102 PolarHBondContact O-N 2.86Å; I100-L102 VanDerWaalsContact C-N 3.3Å; I100-L102 PolarHBondContact O-N 2.89Å; L102-E104 HydrophobicContact CB-CG 3.97Å; L102-E104 PolarHBondContact O-N 3.38Å
103	N	96.7	Very high	97	Very high	146 Å²	146	37.5 Å²	37.5	78%	0.781	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	27.6	-172.7	-50.3	-65.6	0	0	0	113.8	Q99 I100 L101	Q99-N103 PolarHBondContact O-N 2.91Å; I100-N103 PolarHBondContact O-N 3.29Å; I100-N103 VanDerWaalsContact O-N 3.14Å; L101-N103 VanDerWaalsContact C-N 3.26Å
104	E	97.1	Very high	96.9	Very high	142 Å²	142	37.5 Å²	37.5	66%	0.664	19%	0.193	S	C	*	.	S	Bend	trans	-88.8	-13.1	173.3	-63.7	-67.3	164.3	0	0	111.9	Q99 L102	Q99-E104 PolarHBondContact O-N 3.07Å; L102-E104 HydrophobicContact CB-CG 3.97Å; L102-E104 PolarHBondContact O-N 3.38Å
105	A	97.8	Very high	96.9	Very high	7 Å²	7	37.5 Å²	37.5	6%	0.058	19%	0.193	C	C	.	.			trans	-149.3	148.9	175.5	0	0	0	0	0	110.9	D47 Q99 I100 V108	D47-A105 HydrophobicContact CB-CB 3.72Å; Q99-A105 HydrophobicContact CB-CB 3.93Å; Q99-A105 PolarHBondContact O-N 3.49Å; I100-A105 VanDerWaalsContact CA-O 3.31Å; I100-A105 WeakPolarHBondContact CA-O 3.41Å; A105-V108 HydrophobicContact CB-CG2 3.52Å
106	S	97.5	Very high	96.4	Very high	50 Å²	50	34.8 Å²	34.8	35%	0.35	18%	0.181	S	C	.	.	S	Bend	trans	-99.5	-36	169.5	-67.2	0	0	0	0	112.1	D47 A144 A145	D47-S106 WeakPolarHBondContact OD2-CA 3.33Å; D47-S106 PolarHBondContact OD2-N 2.75Å; S106-A144 CarbonylContact O-C 3.5Å; S106-A144 WeakPolarHBondContact O-CA 3.33Å; S106-A145 PolarHBondContact O-N 3.5Å
107	V	98.1	Very high	95.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.7	-178.5	-177.7	0	0	0	0	109.9	I41 Q45 V46 D47 V142 L143 A144 Y148	I41-V107 HydrophobicContact CD1-CG1 3.65Å; Q45-V107 VanDerWaalsContact O-CB 3.25Å; Q45-V107 WeakPolarHBondContact O-CB 3.43Å; V46-V107 HydrophobicContact CG2-CG1 4.49Å; D47-V107 WeakPolarHBondContact CB-O 3.25Å; D47-V107 PolarHBondContact N-O 2.87Å; D47-V107 PolarHBondContact OD2-N 2.98Å; V107-V142 HydrophobicContact CG1-CG1 3.84Å; V107-L143 CarbonylContact C-O 3.49Å; V107-L143 WeakPolarHBondContact CA-O 3.34Å; V107-A144 HydrophobicContact CG2-CB 4.32Å; V107-Y148 HydrophobicContact CG2-CD1 3.63Å; V107-Y148 HydrophobicContact CG2-CE1 3.29Å; V107-Y148 HydrophobicContact CG2-CE2 4.22Å; V107-Y148 HydrophobicContact CG2-CG 4.24Å
108	V	98.5	Very high	95.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.8	-179.5	178	0	0	0	0	109.9	Q48 F50 G96 Q99 I100 A105 L143	Q48-V108 HydrophobicContact CB-CG1 4.39Å; Q48-V108 HydrophobicContact CB-CG2 4.27Å; Q48-V108 WeakPolarHBondContact O-CA 3.41Å; Q48-V108 WeakPolarHBondContact O-CG1 3.2Å; F50-V108 HydrophobicContact CD2-CG1 3.69Å; F50-V108 HydrophobicContact CE2-CG1 4.04Å; G96-V108 VanDerWaalsContact CA-CG1 3.49Å; Q99-V108 HydrophobicContact CB-CG2 4.43Å; I100-V108 HydrophobicContact CD1-CB 4.48Å; I100-V108 HydrophobicContact CD1-CG2 4.31Å; I100-V108 HydrophobicContact CG1-CG2 4.19Å; A105-V108 HydrophobicContact CB-CG2 3.52Å; V108-L143 HydrophobicContact CB-CB 4.46Å; V108-L143 PolarHBondContact N-O 3.11Å; V108-L143 PolarHBondContact O-N 2.94Å
109	I	98.4	Very high	94.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.5	167.8	-62.7	-176.7	0	0	0	108.7	V32 I36 V46 Q48 V49 F50 I73 V142	V32-I109 HydrophobicContact CG1-CD1 3.85Å; V32-I109 HydrophobicContact CG1-CG2 4.32Å; V32-I109 HydrophobicContact CG2-CG2 4.09Å; I36-I109 HydrophobicContact CD1-CD1 3.64Å; I36-I109 HydrophobicContact CG1-CD1 3.52Å; V46-I109 HydrophobicContact CG1-CD1 4.1Å; V46-I109 HydrophobicContact CG1-CG1 3.89Å; V46-I109 HydrophobicContact CG2-CD1 3.78Å; V46-I109 HydrophobicContact CG2-CG1 4.05Å; Q48-I109 PolarHBondContact O-N 3.16Å; V49-I109 CarbonylContact C-O 3.58Å; V49-I109 WeakPolarHBondContact CA-O 3.12Å; V49-I109 HydrophobicContact CG1-CB 4.27Å; V49-I109 HydrophobicContact CG1-CG2 4.29Å; V49-I109 HydrophobicContact CG2-CB 4.26Å; F50-I109 PolarHBondContact N-O 3.13Å; I73-I109 HydrophobicContact CD1-CD1 3.64Å; I109-V142 HydrophobicContact CG1-CG2 4.42Å
110	A	98.1	Very high	93.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.7	177.9	0	0	0	0	0	110.5	F50 S92 I93 A140 V141 L143	F50-A110 CarbonylContact O-C 3.57Å; F50-A110 WeakPolarHBondContact O-CA 3.4Å; S92-A110 WeakPolarHBondContact O-CB 3.27Å; I93-A110 HydrophobicContact CB-CB 4.35Å; I93-A110 HydrophobicContact CG1-CB 3.87Å; A110-A140 CarbonylContact O-C 3.55Å; A110-A140 WeakPolarHBondContact O-CA 3.28Å; A110-V141 HydrophobicContact CB-CG2 4.23Å; A110-V141 PolarHBondContact N-O 2.85Å; A110-V141 WeakPolarHBondContact O-CG2 3.5Å; A110-V141 PolarHBondContact O-N 2.97Å; A110-L143 HydrophobicContact CB-CD1 3.93Å; A110-L143 HydrophobicContact CB-CG 4.25Å
111	G	97	Very high	91.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	-159.9	-179.1	0	0	0	0	0	114.3	F50 M51 G52 S92 S139 T240	F50-G111 PolarHBondContact O-N 3.42Å; M51-G111 CarbonylContact C-O 3.59Å; M51-G111 WeakPolarHBondContact CA-O 3.47Å; M51-G111 VanDerWaalsContact SD-CA 3.52Å; G52-G111 PolarHBondContact N-O 3.19Å; S92-G111 WeakPolarHBondContact CB-O 3.12Å; S92-G111 PolarHBondContact OG-O 2.74Å; G111-S139 CarbonylContact C-O 3.54Å; G111-S139 WeakPolarHBondContact CA-O 3.32Å; G111-T240 VanDerWaalsContact C-OG1 3.25Å; G111-T240 WeakPolarHBondContact CA-OG1 3.21Å
112	G	97.2	Very high	89.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	161.4	168.9	0	0	0	0	0	111.6	G52 A138 S139 G236 A237	G52-G112 CarbonylContact O-C 3.57Å; G52-G112 WeakPolarHBondContact O-CA 3.37Å; G112-A138 VanDerWaalsContact O-CA 3.29Å; G112-A138 WeakPolarHBondContact O-CA 3.38Å; G112-S139 PolarHBondContact N-O 3.39Å; G112-S139 PolarHBondContact O-N 3Å; G112-G236 WeakPolarHBondContact CA-O 3.4Å; G112-A237 VanDerWaalsContact C-CB 3.46Å; G112-A237 VanDerWaalsContact O-CB 3.25Å; G112-A237 WeakPolarHBondContact O-CB 3.33Å
113	T	97.1	Very high	87.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	146.9	179.4	-176.7	0	0	0	0	110	A24 G52 N53 V63 G137	A24-T113 HydrophobicContact CB-CG2 4.26Å; A24-T113 VanDerWaalsContact O-CG2 3.32Å; A24-T113 WeakPolarHBondContact O-CG2 3.25Å; A24-T113 PolarHBondContact O-OG1 2.88Å; G52-T113 PolarHBondContact O-N 3.46Å; N53-T113 HydrophobicContact CB-CG2 4.4Å; N53-T113 PolarHBondContact ND2-O 3.15Å; V63-T113 HydrophobicContact CG1-CG2 3.71Å; T113-G137 CarbonylContact C-O 3.48Å; T113-G137 WeakPolarHBondContact CA-O 3.44Å
114	E	94.9	Very high	85.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	143.1	170.8	-162.4	59.6	-90.1	0	0	109.9	N53 V54 L55 M116 D136 G137 P234	N53-E114 PolarHBondContact ND2-OE1 3Å; V54-E114 WeakPolarHBondContact CB-OE2 3.26Å; V54-E114 PolarHBondContact N-OE2 2.98Å; V54-E114 VanDerWaalsContact N-OE2 3.07Å; L55-E114 PolarHBondContact N-OE2 3.2Å; E114-M116 HydrophobicContact CG-CG 3.59Å; E114-M116 HydrophobicContact CG-SD 4.44Å; E114-D136 CarbonylContact O-C 3.43Å; E114-D136 WeakPolarHBondContact O-CA 3.34Å; E114-G137 PolarHBondContact N-O 2.91Å; E114-G137 PolarHBondContact O-N 3.28Å; E114-P234 HydrophobicContact CB-CB 4.03Å
115	N	92.4	Very high	83.7	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.011	25%	0.252	C	S	.	.			trans	-128.9	100.4	162.5	-170.3	-53.5	0	0	0	107.6	L19 V22 A24 L27 S117 Q118 D136	L19-N115 PolarHBondContact O-ND2 2.93Å; V22-N115 PolarHBondContact O-ND2 3.01Å; A24-N115 HydrophobicContact CB-CB 4.1Å; L27-N115 HydrophobicContact CD1-CB 4.34Å; N115-S117 WeakPolarHBondContact OD1-CA 3.31Å; N115-S117 WeakPolarHBondContact OD1-CB 3.31Å; N115-S117 PolarHBondContact OD1-N 3.39Å; N115-Q118 WeakPolarHBondContact OD1-CG 3.41Å; N115-Q118 PolarHBondContact OD1-N 2.96Å; N115-D136 WeakPolarHBondContact CA-OD1 3.46Å; N115-D136 PolarHBondContact OD1-OD1 2.77Å
116	M	87.4	Confident	81.8	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.025	29%	0.291	C	S	.	.	S	Bend	trans	-79.3	-24.7	180	-61.5	-162.2	77.9	0	0	111.6	F15 L55 E114 Q118 I119 L134 N135 D136 I235	F15-M116 HydrophobicContact CD2-CB 4.29Å; F15-M116 VanDerWaalsContact CE2-O 3.3Å; F15-M116 WeakPolarHBondContact CE2-O 3.41Å; L55-M116 HydrophobicContact CD1-CE 3.89Å; E114-M116 HydrophobicContact CG-CG 3.59Å; E114-M116 HydrophobicContact CG-SD 4.44Å; M116-Q118 PolarHBondContact O-N 3.14Å; M116-I119 WeakPolarHBondContact O-CD1 3.42Å; M116-I119 WeakPolarHBondContact O-CG1 3.13Å; M116-I119 WeakPolarHBondContact O-CG2 3.5Å; M116-I119 PolarHBondContact O-N 2.87Å; M116-L134 HydrophobicContact CB-CB 4.27Å; M116-L134 HydrophobicContact CE-CB 4.07Å; M116-L134 HydrophobicContact CE-CD1 3.77Å; M116-L134 HydrophobicContact CE-CD2 3.58Å; M116-L134 HydrophobicContact CE-CG 3.98Å; M116-L134 HydrophobicContact SD-CB 3.64Å; M116-L134 HydrophobicContact SD-CD1 4.47Å; M116-L134 HydrophobicContact SD-CD2 3.76Å; M116-L134 HydrophobicContact SD-CG 4.12Å; M116-N135 WeakPolarHBondContact CG-O 3.37Å; M116-D136 PolarHBondContact N-OD1 3.01Å; M116-I235 HydrophobicContact CE-CD1 3.58Å; M116-I235 HydrophobicContact CE-CG1 4.21Å; M116-I235 HydrophobicContact SD-CD1 3.91Å; M116-I235 HydrophobicContact SD-CG1 3.84Å
117	S	86.4	Confident	79.8	Confident	26 Å²	26	49.7 Å²	49.7	18%	0.182	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.7	175.6	-61.1	0	0	0	0	114.1	T16 N115 D136	T16-S117 PolarHBondContact N-OG 2.83Å; N115-S117 WeakPolarHBondContact OD1-CA 3.31Å; N115-S117 WeakPolarHBondContact OD1-CB 3.31Å; N115-S117 PolarHBondContact OD1-N 3.39Å; S117-D136 VanDerWaalsContact CB-OD2 3.26Å; S117-D136 WeakPolarHBondContact CB-OD2 3.06Å; S117-D136 PolarHBondContact N-OD1 3.04Å; S117-D136 VanDerWaalsContact OG-CG 3.25Å; S117-D136 PolarHBondContact OG-OD1 3.13Å; S117-D136 PolarHBondContact OG-OD2 3.41Å
118	Q	85.2	Confident	78.1	Confident	81 Å²	81	54.1 Å²	54.1	38%	0.379	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	5.6	-179.3	-67.4	-173.5	-11.7	0	0	113.9	A20 T21 N115 M116	A20-Q118 VanDerWaalsContact O-CG 3.26Å; A20-Q118 WeakPolarHBondContact O-CG 3.15Å; A20-Q118 PolarHBondContact O-NE2 2.86Å; T21-Q118 VanDerWaalsContact C-NE2 3.32Å; T21-Q118 PolarHBondContact O-NE2 2.92Å; N115-Q118 WeakPolarHBondContact OD1-CG 3.41Å; N115-Q118 PolarHBondContact OD1-N 2.96Å; M116-Q118 PolarHBondContact O-N 3.14Å
119	I	79.4	Confident	76.7	Confident	38 Å²	38	59.7 Å²	59.7	20%	0.195	38%	0.383	C	S	.	.	S	Bend	trans	-68	146.4	176.8	73.2	-171.5	0	0	0	109.8	L55 M116 P121	L55-I119 HydrophobicContact CB-CG2 4.03Å; L55-I119 HydrophobicContact CD1-CD1 4.29Å; L55-I119 HydrophobicContact CD1-CG2 3.64Å; L55-I119 HydrophobicContact CG-CG2 4.49Å; M116-I119 WeakPolarHBondContact O-CD1 3.42Å; M116-I119 WeakPolarHBondContact O-CG1 3.13Å; M116-I119 WeakPolarHBondContact O-CG2 3.5Å; M116-I119 PolarHBondContact O-N 2.87Å; I119-P121 WeakPolarHBondContact O-CD 3.32Å; I119-P121 VanDerWaalsContact O-N 3.11Å
120	V	69.9	Low	75.9	Confident	102 Å²	102	63 Å²	63	62%	0.618	40%	0.4	S	S	*	.			trans	-59.5	116.4	176.8	-176.5	0	0	0	0	108.8	I122	V120-I122 HydrophobicContact CG1-CD1 4.37Å; V120-I122 HydrophobicContact CG1-CG1 4.36Å; V120-I122 PolarHBondContact O-N 3.2Å
121	P	61.1	Low	75.2	Confident	109 Å²	109	64.5 Å²	64.5	71%	0.708	41%	0.413	S	S	*	.			trans	-74.4	99.4	-175.4	-9.9	25	0	0	0	109.5	I119	I119-P121 WeakPolarHBondContact O-CD 3.32Å; I119-P121 VanDerWaalsContact O-N 3.11Å
122	I	55.6	Low	74.5	Confident	154 Å²	154	65.5 Å²	65.5	79%	0.79	42%	0.42	S	S	*	.	S	Bend	trans	-100.8	-27.9	176.4	-87.2	168.8	0	0	0	113.2	V120	V120-I122 HydrophobicContact CG1-CD1 4.37Å; V120-I122 HydrophobicContact CG1-CG1 4.36Å; V120-I122 PolarHBondContact O-N 3.2Å
123	A	53.9	Low	73.9	Confident	88 Å²	88	68.9 Å²	68.9	73%	0.727	44%	0.441	S	S	*	.			trans	179.3	101.7	164.6	0	0	0	0	0	107.5	S125	A123-S125 PolarHBondContact O-N 2.81Å
124	L	56.6	Low	73.2	Confident	97 Å²	97	72 Å²	72	51%	0.508	46%	0.457	S	S	.	.			trans	-80.8	108.1	165.8	-66.1	167.8	0	0	0	106.4	F15	F15-L124 HydrophobicContact CE1-CD1 3.71Å; F15-L124 HydrophobicContact CE2-CD1 4.41Å; F15-L124 HydrophobicContact CZ-CD1 3.42Å; F15-L124 VanDerWaalsContact CZ-CD1 3.42Å
125	S	54.8	Low	72.9	Confident	106 Å²	106	72.2 Å²	72.2	74%	0.741	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-78.5	149.1	166.2	56.8	0	0	0	0	109.5	A123 G127	A123-S125 PolarHBondContact O-N 2.81Å; S125-G127 PolarHBondContact O-N 2.54Å; S125-G127 VanDerWaalsContact O-N 3.17Å
126	D	57.8	Low	72.9	Confident	163 Å²	163	72.1 Å²	72.1	87%	0.872	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-49.9	123.5	173.6	-62.9	-30.8	0	0	0	110.2
127	G	57.2	Low	73.3	Confident	72 Å²	72	71.9 Å²	71.9	74%	0.742	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-63.1	139.5	178.6	0	0	0	0	0	110.7	S125	S125-G127 PolarHBondContact O-N 2.54Å; S125-G127 VanDerWaalsContact O-N 3.17Å
128	T	61.1	Low	73.7	Confident	94 Å²	94	70.9 Å²	70.9	58%	0.577	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-68.9	136.4	173.3	61.1	0	0	0	0	109.9	N130 A131	T128-N130 PolarHBondContact O-N 3.5Å; T128-A131 PolarHBondContact O-N 3.41Å
129	A	69.4	Low	74.3	Confident	117 Å²	117	67 Å²	67	97%	0.967	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-10.6	-175.5	0	0	0	0	0	116
130	N	80.6	Confident	75.1	Confident	68 Å²	68	65.4 Å²	65.4	36%	0.364	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-8.2	-179.5	-171.8	39.2	0	0	0	113.8	T128 F204 A205 A206	T128-N130 PolarHBondContact O-N 3.5Å; N130-F204 CarbonylContact O-C 3.35Å; N130-F204 VanDerWaalsContact O-CA 3.32Å; N130-F204 WeakPolarHBondContact O-CA 3.47Å; N130-A205 PolarHBondContact O-N 2.97Å; N130-A205 WeakPolarHBondContact OD1-CA 3.43Å; N130-A205 WeakPolarHBondContact OD1-CB 3.35Å; N130-A205 PolarHBondContact OD1-N 2.91Å; N130-A206 WeakPolarHBondContact ND2-CB 3.36Å; N130-A206 PolarHBondContact OD1-N 3.34Å; N130-A206 VanDerWaalsContact OD1-N 3.14Å
131	A	83.9	Confident	76.4	Confident	33 Å²	33	60.7 Å²	60.7	27%	0.273	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-93.5	153.9	-177.3	0	0	0	0	0	111.8	T128 A203 F204	T128-A131 PolarHBondContact O-N 3.41Å; A131-A203 WeakPolarHBondContact CA-O 3.26Å; A131-F204 HydrophobicContact CB-CD1 3.88Å; A131-F204 HydrophobicContact CB-CE1 3.84Å
132	S	82.8	Confident	78.1	Confident	20 Å²	20	55.6 Å²	55.6	14%	0.14	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-62.7	156.9	169	62	0	0	0	0	111.8	A203 A228 H233	S132-A203 PolarHBondContact N-O 2.89Å; S132-A228 WeakPolarHBondContact CB-O 3.43Å; S132-H233 WeakPolarHBondContact OG-CB 3.44Å
133	T	84	Confident	80.1	Confident	71 Å²	71	48.3 Å²	48.3	44%	0.436	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-71	159.3	172.6	53.1	0	0	0	0	111.9	N135 H233	T133-N135 PolarHBondContact O-OD1 3.04Å; T133-N135 PolarHBondContact OG1-ND2 3.19Å; T133-N135 PolarHBondContact OG1-OD1 3.35Å; T133-H233 WeakPolarHBondContact O-CB 3.36Å; T133-H233 PolarHBondContact O-N 2.83Å
134	L	82.2	Confident	82.2	Confident	65 Å²	65	44.1 Å²	44.1	34%	0.34	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-83.2	141.3	165	-58.2	-173.3	0	0	0	108.5	F15 M116	F15-L134 HydrophobicContact CB-CB 4.28Å; F15-L134 VanDerWaalsContact CB-O 3.26Å; F15-L134 WeakPolarHBondContact CB-O 3.41Å; F15-L134 PolarHBondContact N-O 2.63Å; M116-L134 HydrophobicContact CB-CB 4.27Å; M116-L134 HydrophobicContact CE-CB 4.07Å; M116-L134 HydrophobicContact CE-CD1 3.77Å; M116-L134 HydrophobicContact CE-CD2 3.58Å; M116-L134 HydrophobicContact CE-CG 3.98Å; M116-L134 HydrophobicContact SD-CB 3.64Å; M116-L134 HydrophobicContact SD-CD1 4.47Å; M116-L134 HydrophobicContact SD-CD2 3.76Å; M116-L134 HydrophobicContact SD-CG 4.12Å
135	N	89.5	Confident	84.1	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.027	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	153.3	-169.5	-63	86.2	0	0	0	113	V13 S14 M116 T133 G232 H233 P234	V13-N135 WeakPolarHBondContact O-CA 3.28Å; V13-N135 VanDerWaalsContact O-CB 3.23Å; V13-N135 WeakPolarHBondContact O-CB 3.34Å; V13-N135 PolarHBondContact O-ND2 3.14Å; S14-N135 VanDerWaalsContact CA-ND2 3.31Å; S14-N135 WeakPolarHBondContact CA-ND2 3.39Å; S14-N135 PolarHBondContact N-ND2 3.21Å; M116-N135 WeakPolarHBondContact CG-O 3.37Å; T133-N135 PolarHBondContact O-OD1 3.04Å; T133-N135 PolarHBondContact OG1-ND2 3.19Å; T133-N135 PolarHBondContact OG1-OD1 3.35Å; N135-G232 WeakPolarHBondContact ND2-CA 3.46Å; N135-G232 VanDerWaalsContact OD1-C 3.27Å; N135-G232 WeakPolarHBondContact OD1-CA 3.43Å; N135-H233 PolarHBondContact OD1-N 3.27Å; N135-P234 HydrophobicContact CB-CB 4.33Å; N135-P234 WeakPolarHBondContact O-CA 3.02Å
136	D	92.6	Very high	85.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.2	170.3	-49.1	-33.5	0	0	0	107.9	G12 V13 L19 L27 E114 N115 M116 S117	G12-D136 CarbonylContact C-O 3.6Å; G12-D136 WeakPolarHBondContact CA-O 3.32Å; V13-D136 HydrophobicContact CG2-CB 4.49Å; V13-D136 PolarHBondContact N-O 3.11Å; V13-D136 PolarHBondContact O-N 3.48Å; V13-D136 VanDerWaalsContact O-N 3.09Å; L19-D136 HydrophobicContact CB-CB 3.91Å; L27-D136 HydrophobicContact CD1-CB 4.38Å; E114-D136 CarbonylContact O-C 3.43Å; E114-D136 WeakPolarHBondContact O-CA 3.34Å; N115-D136 WeakPolarHBondContact CA-OD1 3.46Å; N115-D136 PolarHBondContact OD1-OD1 2.77Å; M116-D136 PolarHBondContact N-OD1 3.01Å; S117-D136 VanDerWaalsContact CB-OD2 3.26Å; S117-D136 WeakPolarHBondContact CB-OD2 3.06Å; S117-D136 PolarHBondContact N-OD1 3.04Å; S117-D136 VanDerWaalsContact OG-CG 3.25Å; S117-D136 PolarHBondContact OG-OD1 3.13Å; S117-D136 PolarHBondContact OG-OD2 3.41Å
137	G	94.6	Very high	87.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.1	168.6	176.6	0	0	0	0	0	114.6	V11 T113 E114	V11-G137 CarbonylContact O-C 3.45Å; V11-G137 WeakPolarHBondContact O-CA 3.45Å; T113-G137 CarbonylContact C-O 3.48Å; T113-G137 WeakPolarHBondContact CA-O 3.44Å; E114-G137 PolarHBondContact N-O 2.91Å; E114-G137 PolarHBondContact O-N 3.28Å
138	A	96.4	Very high	89.4	Confident	5 Å²	5	35.4 Å²	35.4	4%	0.041	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	151.8	174.8	0	0	0	0	0	111.4	F10 V11 L27 A31 G112	F10-A138 WeakPolarHBondContact CD2-O 3.35Å; V11-A138 PolarHBondContact N-O 3.31Å; V11-A138 PolarHBondContact O-N 3.13Å; L27-A138 VanDerWaalsContact C-CB 3.49Å; L27-A138 HydrophobicContact CB-CB 3.8Å; L27-A138 VanDerWaalsContact O-CB 3.26Å; L27-A138 WeakPolarHBondContact O-CB 3.47Å; A31-A138 HydrophobicContact CB-CB 3.78Å; G112-A138 VanDerWaalsContact O-CA 3.29Å; G112-A138 WeakPolarHBondContact O-CA 3.38Å
139	S	96.3	Very high	91	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	142.7	171.9	-176.8	0	0	0	0	108.9	G111 G112 T240 T244	G111-S139 CarbonylContact C-O 3.54Å; G111-S139 WeakPolarHBondContact CA-O 3.32Å; G112-S139 PolarHBondContact N-O 3.39Å; G112-S139 PolarHBondContact O-N 3Å; S139-T240 WeakPolarHBondContact OG-CG2 3.38Å; S139-T244 WeakPolarHBondContact OG-CG2 3.28Å; S139-T244 PolarHBondContact OG-OG1 3.04Å
140	A	97	Very high	92.1	Very high	5 Å²	5	30.7 Å²	30.7	4%	0.041	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	149.1	175.6	0	0	0	0	0	109.9	A31 V32 A35 A110	A31-A140 HydrophobicContact CB-CB 3.98Å; V32-A140 HydrophobicContact CG2-CB 4.37Å; A35-A140 HydrophobicContact CB-CB 3.97Å; A110-A140 CarbonylContact O-C 3.55Å; A110-A140 WeakPolarHBondContact O-CA 3.28Å
141	V	96.8	Very high	92.8	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	148.8	173.8	-68.1	0	0	0	0	109.3	I2 V8 I93 A110 L143 T240 T244	I2-V141 HydrophobicContact CG2-CB 4.03Å; I2-V141 HydrophobicContact CG2-CG1 4.13Å; V8-V141 HydrophobicContact CG1-CG1 4.2Å; I93-V141 HydrophobicContact CD1-CG2 4.19Å; I93-V141 HydrophobicContact CG1-CG2 4.01Å; A110-V141 HydrophobicContact CB-CG2 4.23Å; A110-V141 PolarHBondContact N-O 2.85Å; A110-V141 WeakPolarHBondContact O-CG2 3.5Å; A110-V141 PolarHBondContact O-N 2.97Å; V141-L143 HydrophobicContact CG2-CD2 4Å; V141-L143 HydrophobicContact CG2-CG 4.47Å; V141-T240 HydrophobicContact CG1-CG2 4.34Å; V141-T240 HydrophobicContact CG2-CG2 4.39Å; V141-T244 HydrophobicContact CG1-CG2 3.56Å
142	V	97.8	Very high	93.4	Very high	1 Å²	1	37 Å²	37	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	119.7	169.8	179.2	0	0	0	0	108.1	I2 L3 A35 A39 I41 V107 I109	I2-V142 CarbonylContact C-O 3.53Å; I2-V142 WeakPolarHBondContact CA-O 3.32Å; L3-V142 HydrophobicContact CB-CB 4.18Å; L3-V142 HydrophobicContact CB-CG1 4.09Å; L3-V142 HydrophobicContact CD1-CG1 3.98Å; L3-V142 HydrophobicContact CG-CG1 4.25Å; L3-V142 PolarHBondContact N-O 3.29Å; A35-V142 HydrophobicContact CB-CG2 4.09Å; A39-V142 HydrophobicContact CB-CB 3.75Å; A39-V142 HydrophobicContact CB-CG1 4Å; A39-V142 HydrophobicContact CB-CG2 3.6Å; I41-V142 HydrophobicContact CD1-CG1 3.69Å; I41-V142 HydrophobicContact CD1-CG2 4.39Å; V107-V142 HydrophobicContact CG1-CG1 3.84Å; I109-V142 HydrophobicContact CG1-CG2 4.42Å
143	L	97.6	Very high	93.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	137.6	172.6	-54.3	-177.7	0	0	0	109	M1 I2 I93 I100 V107 V108 A110 V141 I160	M1-L143 CarbonylContact O-C 3.6Å; M1-L143 VanDerWaalsContact O-CA 3.23Å; M1-L143 WeakPolarHBondContact O-CA 3.49Å; I2-L143 HydrophobicContact CD1-CD2 4.47Å; I2-L143 HydrophobicContact CG1-CD2 3.66Å; I93-L143 HydrophobicContact CG2-CD1 4.15Å; I93-L143 HydrophobicContact CG2-CD2 4.42Å; I93-L143 WeakPolarHBondContact O-CD1 3.4Å; I100-L143 HydrophobicContact CD1-CB 3.68Å; V107-L143 CarbonylContact C-O 3.49Å; V107-L143 WeakPolarHBondContact CA-O 3.34Å; V108-L143 HydrophobicContact CB-CB 4.46Å; V108-L143 PolarHBondContact N-O 3.11Å; V108-L143 PolarHBondContact O-N 2.94Å; A110-L143 HydrophobicContact CB-CD1 3.93Å; A110-L143 HydrophobicContact CB-CG 4.25Å; V141-L143 HydrophobicContact CG2-CD2 4Å; V141-L143 HydrophobicContact CG2-CG 4.47Å; L143-I160 HydrophobicContact CD2-CD1 3.87Å
144	A	97.5	Very high	94.4	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	153.7	170.6	0	0	0	0	0	113.2	M1 L3 S106 V107 Y148	M1-A144 PolarHBondContact N-O 3.29Å; M1-A144 PolarHBondContact O-N 3.05Å; L3-A144 HydrophobicContact CD1-CB 3.48Å; L3-A144 VanDerWaalsContact CD1-CB 3.48Å; L3-A144 HydrophobicContact CD2-CB 3.98Å; L3-A144 HydrophobicContact CG-CB 3.68Å; S106-A144 CarbonylContact O-C 3.5Å; S106-A144 WeakPolarHBondContact O-CA 3.33Å; V107-A144 HydrophobicContact CG2-CB 4.32Å; A144-Y148 HydrophobicContact CB-CD1 4.36Å
145	A	95.8	Very high	94.9	Very high	15 Å²	15	37.3 Å²	37.3	12%	0.124	21%	0.212	C	C	.	.			trans	-57.5	144.5	165.4	0	0	0	0	0	110.1	I100 S106 S147 Y148 A149	I100-A145 HydrophobicContact CG2-CB 3.82Å; S106-A145 PolarHBondContact O-N 3.5Å; A145-S147 VanDerWaalsContact C-N 3.33Å; A145-S147 PolarHBondContact O-N 3.33Å; A145-Y148 PolarHBondContact O-N 3.44Å; A145-A149 PolarHBondContact O-N 2.69Å
146	K	92.1	Very high	95	Very high	129 Å²	129	42 Å²	42	56%	0.561	23%	0.23	S	C	*	.	H	α-helix	trans	-63.3	-41.6	178.3	173.1	170.6	-171.3	-175.2	0	111.9	M1 A149 I150	M1-K146 HydrophobicContact CE-CB 3.8Å; M1-K146 HydrophobicContact CE-CD 3.55Å; M1-K146 HydrophobicContact CE-CG 3.37Å; M1-K146 HydrophobicContact CG-CB 4.33Å; M1-K146 HydrophobicContact SD-CB 3.85Å; M1-K146 HydrophobicContact SD-CG 3.91Å; K146-A149 PolarHBondContact O-N 2.76Å; K146-I150 HydrophobicContact CD-CD1 4.41Å; K146-I150 HydrophobicContact CG-CD1 3.75Å; K146-I150 VanDerWaalsContact O-CG1 3.3Å; K146-I150 WeakPolarHBondContact O-CG1 3.13Å; K146-I150 PolarHBondContact O-N 2.83Å; K146-I150 VanDerWaalsContact O-N 3.1Å
147	S	94.3	Very high	95	Very high	84 Å²	84	43.9 Å²	43.9	59%	0.587	24%	0.24	S	C	*	.	H	α-helix	trans	-57.9	-51.1	175.7	42.5	0	0	0	0	110.9	A145 A149 I150 E151	A145-S147 VanDerWaalsContact C-N 3.33Å; A145-S147 PolarHBondContact O-N 3.33Å; S147-A149 PolarHBondContact O-N 2.99Å; S147-I150 PolarHBondContact O-N 3.05Å; S147-E151 WeakPolarHBondContact O-CB 3.27Å; S147-E151 PolarHBondContact O-N 3.43Å
148	Y	96.1	Very high	94.8	Very high	27 Å²	27	44 Å²	44	11%	0.106	24%	0.241	C	C	.	.	H	α-helix	trans	-57.1	-48.1	178.8	-174.2	-85.8	0	0	0	112.2	Q45 V107 A144 A145 I150 E151 H152 L154	Q45-Y148 PolarHBondContact NE2-OH 3.29Å; V107-Y148 HydrophobicContact CG2-CD1 3.63Å; V107-Y148 HydrophobicContact CG2-CE1 3.29Å; V107-Y148 HydrophobicContact CG2-CE2 4.22Å; V107-Y148 HydrophobicContact CG2-CG 4.24Å; A144-Y148 HydrophobicContact CB-CD1 4.36Å; A145-Y148 PolarHBondContact O-N 3.44Å; Y148-I150 VanDerWaalsContact C-N 3.33Å; Y148-I150 PolarHBondContact O-N 3.27Å; Y148-E151 PolarHBondContact O-N 2.95Å; Y148-H152 AromaticContact CD1-ND1 3.91Å; Y148-H152 AromaticContact CD2-CE1 3.58Å; Y148-H152 AromaticContact CD2-ND1 3.72Å; Y148-H152 HydrophobicContact CE1-CB 4.49Å; Y148-H152 AromaticContact CE1-ND1 3.85Å; Y148-H152 AromaticContact CE2-CE1 3.31Å; Y148-H152 WeakPolarHBondContact CE2-CE1 3.45Å; Y148-H152 AromaticContact CE2-ND1 3.68Å; Y148-H152 AromaticContact CE2-NE2 3.83Å; Y148-H152 AromaticContact CG-ND1 3.84Å; Y148-H152 AromaticContact CZ-CE1 3.69Å; Y148-H152 AromaticContact CZ-ND1 3.74Å; Y148-H152 AromaticContact CZ-NE2 3.91Å; Y148-H152 WeakPolarHBondContact O-CB 3.14Å; Y148-H152 PolarHBondContact O-N 2.78Å; Y148-H152 PolarHBondContact O-ND1 3.15Å; Y148-L154 HydrophobicContact CD1-CD1 4.06Å; Y148-L154 HydrophobicContact CE1-CD1 3.73Å
149	A	93.9	Very high	94.7	Very high	1 Å²	1	46 Å²	46	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-41.6	179.6	0	0	0	0	0	112.3	M1 L3 A145 K146 S147 G153 L154	M1-A149 HydrophobicContact SD-CB 3.99Å; L3-A149 HydrophobicContact CD2-CB 3.84Å; A145-A149 PolarHBondContact O-N 2.69Å; K146-A149 PolarHBondContact O-N 2.76Å; S147-A149 PolarHBondContact O-N 2.99Å; A149-G153 PolarHBondContact O-N 3Å; A149-G153 VanDerWaalsContact O-N 3.15Å; A149-L154 HydrophobicContact CB-CB 4.37Å; A149-L154 PolarHBondContact O-N 2.78Å
150	I	93.2	Very high	94.5	Very high	110 Å²	110	47 Å²	47	56%	0.564	26%	0.257	S	S	*	.	H	α-helix	trans	-69	-45.8	178.3	-68.2	168.7	0	0	0	111	K146 S147 Y148 H152 G153	K146-I150 HydrophobicContact CD-CD1 4.41Å; K146-I150 HydrophobicContact CG-CD1 3.75Å; K146-I150 VanDerWaalsContact O-CG1 3.3Å; K146-I150 WeakPolarHBondContact O-CG1 3.13Å; K146-I150 PolarHBondContact O-N 2.83Å; K146-I150 VanDerWaalsContact O-N 3.1Å; S147-I150 PolarHBondContact O-N 3.05Å; Y148-I150 VanDerWaalsContact C-N 3.33Å; Y148-I150 PolarHBondContact O-N 3.27Å; I150-H152 VanDerWaalsContact C-N 3.27Å; I150-H152 PolarHBondContact O-N 2.87Å; I150-G153 PolarHBondContact O-N 2.9Å
151	E	95.4	Very high	94.1	Very high	151 Å²	151	50.5 Å²	50.5	71%	0.706	28%	0.275	S	S	*	.	H	α-helix	trans	-58.6	-39.4	179.7	-179.6	177.9	-176.1	0	0	112.2	S147 Y148	S147-E151 WeakPolarHBondContact O-CB 3.27Å; S147-E151 PolarHBondContact O-N 3.43Å; Y148-E151 PolarHBondContact O-N 2.95Å
152	H	95.5	Very high	93.7	Very high	82 Å²	82	52 Å²	52	38%	0.38	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	6.1	-178.1	-63.8	78.4	0	0	0	113.5	Y148 I150 L154	Y148-H152 AromaticContact CD1-ND1 3.91Å; Y148-H152 AromaticContact CD2-CE1 3.58Å; Y148-H152 AromaticContact CD2-ND1 3.72Å; Y148-H152 HydrophobicContact CE1-CB 4.49Å; Y148-H152 AromaticContact CE1-ND1 3.85Å; Y148-H152 AromaticContact CE2-CE1 3.31Å; Y148-H152 WeakPolarHBondContact CE2-CE1 3.45Å; Y148-H152 AromaticContact CE2-ND1 3.68Å; Y148-H152 AromaticContact CE2-NE2 3.83Å; Y148-H152 AromaticContact CG-ND1 3.84Å; Y148-H152 AromaticContact CZ-CE1 3.69Å; Y148-H152 AromaticContact CZ-ND1 3.74Å; Y148-H152 AromaticContact CZ-NE2 3.91Å; Y148-H152 WeakPolarHBondContact O-CB 3.14Å; Y148-H152 PolarHBondContact O-N 2.78Å; Y148-H152 PolarHBondContact O-ND1 3.15Å; I150-H152 VanDerWaalsContact C-N 3.27Å; I150-H152 PolarHBondContact O-N 2.87Å; H152-L154 HydrophobicContact CB-CD1 3.89Å; H152-L154 HydrophobicContact CB-CG 3.83Å; H152-L154 PolarHBondContact O-N 3.47Å
153	G	94.2	Very high	93.4	Very high	67 Å²	67	54.1 Å²	54.1	69%	0.691	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	26.9	179.6	0	0	0	0	0	114.4	A149 I150	A149-G153 PolarHBondContact O-N 3Å; A149-G153 VanDerWaalsContact O-N 3.15Å; I150-G153 PolarHBondContact O-N 2.9Å
154	L	94.3	Very high	93	Very high	25 Å²	25	54.1 Å²	54.1	13%	0.131	29%	0.291	C	S	.	.			trans	-82.7	134.6	-175.4	-60.3	171.8	0	0	0	111.4	L3 I41 Y148 A149 H152	L3-L154 HydrophobicContact CD1-CB 4.25Å; L3-L154 HydrophobicContact CD1-CD1 3.68Å; L3-L154 HydrophobicContact CD2-CB 4.24Å; I41-L154 HydrophobicContact CG2-CD1 3.72Å; I41-L154 HydrophobicContact CG2-CD2 3.96Å; Y148-L154 HydrophobicContact CD1-CD1 4.06Å; Y148-L154 HydrophobicContact CE1-CD1 3.73Å; A149-L154 HydrophobicContact CB-CB 4.37Å; A149-L154 PolarHBondContact O-N 2.78Å; H152-L154 HydrophobicContact CB-CD1 3.89Å; H152-L154 HydrophobicContact CB-CG 3.83Å; H152-L154 PolarHBondContact O-N 3.47Å
155	T	91.6	Very high	92.6	Very high	72 Å²	72	56.6 Å²	56.6	44%	0.442	30%	0.303	S	S	.	.			trans	-78.5	135.9	176.1	-59.1	0	0	0	0	110.6	L3 S4	L3-T155 WeakPolarHBondContact CA-O 3.34Å; S4-T155 PolarHBondContact N-O 3.48Å; S4-T155 VanDerWaalsContact N-O 3.1Å
156	Y	92.4	Very high	92.1	Very high	103 Å²	103	57 Å²	57	40%	0.404	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	144.8	173.5	65.9	-91.9	0	0	0	110.9	M1 I2 V159	M1-Y156 HydrophobicContact CB-CG 4.32Å; M1-Y156 HydrophobicContact CE-CD1 3.76Å; M1-Y156 HydrophobicContact CE-CD2 4.16Å; M1-Y156 HydrophobicContact CE-CE1 3.45Å; M1-Y156 VanDerWaalsContact CE-CE1 3.45Å; M1-Y156 HydrophobicContact CE-CE2 3.91Å; M1-Y156 HydrophobicContact CE-CG 4.11Å; M1-Y156 HydrophobicContact CG-CD2 4.47Å; M1-Y156 HydrophobicContact CG-CG 4.25Å; M1-Y156 HydrophobicContact SD-CD1 3.47Å; M1-Y156 WeakPolarHBondContact SD-CD1 3.11Å; M1-Y156 HydrophobicContact SD-CD2 4.26Å; M1-Y156 HydrophobicContact SD-CE1 3.81Å; M1-Y156 HydrophobicContact SD-CG 3.72Å; I2-Y156 CarbonylContact O-C 3.49Å; I2-Y156 VanDerWaalsContact O-CA 3.3Å; I2-Y156 WeakPolarHBondContact O-CA 3.36Å; I2-Y156 WeakPolarHBondContact O-CB 3.41Å; Y156-V159 HydrophobicContact CD2-CG2 4.16Å; Y156-V159 HydrophobicContact CE2-CG2 3.89Å
157	L	91.2	Very high	91.9	Very high	40 Å²	40	51.9 Å²	51.9	21%	0.209	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-28.8	179	-66.9	-173.1	0	0	0	113.5	I2 S4 T6 V8 I247 I251	I2-L157 PolarHBondContact O-N 3.4Å; S4-L157 WeakPolarHBondContact O-CD2 3.36Å; S4-L157 WeakPolarHBondContact O-CG 3.22Å; T6-L157 WeakPolarHBondContact O-CD1 3.49Å; V8-L157 HydrophobicContact CG2-CD1 3.87Å; L157-I247 HydrophobicContact CB-CG2 3.77Å; L157-I247 HydrophobicContact CD1-CG2 3.9Å; L157-I251 HydrophobicContact CB-CD1 4.08Å; L157-I251 HydrophobicContact CD1-CD1 3.89Å; L157-I251 HydrophobicContact CD2-CD1 3.83Å; L157-I251 HydrophobicContact CG-CD1 4.14Å
158	A	92.2	Very high	91.4	Very high	3 Å²	3	49 Å²	49	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	155.7	-174.8	0	0	0	0	0	111.9	I2 I247 L279 K280	I2-A158 PolarHBondContact N-O 2.93Å; A158-I247 HydrophobicContact CB-CD1 4.25Å; A158-I247 HydrophobicContact CB-CG1 3.92Å; A158-L279 HydrophobicContact CB-CD1 4.41Å; A158-L279 HydrophobicContact CB-CD2 4.35Å; A158-K280 CarbonylContact C-O 3.57Å; A158-K280 WeakPolarHBondContact CA-O 3.35Å
159	V	92.9	Very high	90.9	Very high	45 Å²	45	51.9 Å²	51.9	27%	0.273	28%	0.283	S	S	.	.			trans	-114.6	122.5	173.6	-174.7	0	0	0	0	108.7	M1 Y156 N161 L279 K280	M1-V159 HydrophobicContact CE-CG2 4.14Å; M1-V159 HydrophobicContact CG-CG2 4.3Å; Y156-V159 HydrophobicContact CD2-CG2 4.16Å; Y156-V159 HydrophobicContact CE2-CG2 3.89Å; V159-N161 PolarHBondContact O-N 2.87Å; V159-L279 WeakPolarHBondContact O-CA 3.42Å; V159-K280 PolarHBondContact N-O 2.86Å; V159-K280 PolarHBondContact O-N 2.79Å
160	I	92.4	Very high	90.4	Very high	23 Å²	23	54.6 Å²	54.6	12%	0.118	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	114.4	168.3	-61.3	168.5	0	0	0	107.7	I2 I93 M97 L143 I277 L279	I2-I160 HydrophobicContact CD1-CD1 4.22Å; I2-I160 HydrophobicContact CD1-CG1 4.15Å; I2-I160 HydrophobicContact CG1-CD1 4.27Å; I2-I160 HydrophobicContact CG1-CG1 4.37Å; I93-I160 HydrophobicContact CG2-CD1 3.55Å; M97-I160 HydrophobicContact CG-CG2 4.49Å; M97-I160 HydrophobicContact SD-CB 4.3Å; M97-I160 HydrophobicContact SD-CG2 3.41Å; M97-I160 WeakPolarHBondContact SD-CG2 3.37Å; L143-I160 HydrophobicContact CD2-CD1 3.87Å; I160-I277 HydrophobicContact CB-CG2 4.45Å; I160-I277 HydrophobicContact CG1-CG2 4.1Å; I160-I277 HydrophobicContact CG2-CG2 3.87Å; I160-L279 HydrophobicContact CB-CD2 4.49Å; I160-L279 HydrophobicContact CG1-CD2 3.77Å
161	N	87.9	Confident	90.1	Very high	77 Å²	77	54 Å²	54	41%	0.412	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-54.2	-178	-178.5	-15.1	0	0	0	111.3	V159 C278	V159-N161 PolarHBondContact O-N 2.87Å; N161-C278 HydrophobicContact CB-CB 4.3Å; N161-C278 PolarHBondContact N-O 3.38Å
162	N	88.8	Confident	89.7	Confident	35 Å²	35	51.2 Å²	51.2	19%	0.187	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	165.2	-178	-145.1	-36.5	0	0	0	110.4	L184 K187 C278	N162-L184 HydrophobicContact CB-CD1 3.95Å; N162-K187 PolarHBondContact ND2-O 3.34Å; N162-K187 PolarHBondContact OD1-NZ 3.41Å; N162-K187 VanDerWaalsContact OD1-NZ 3.16Å; N162-C278 PolarHBondContact O-N 3.16Å
163	Y	92.7	Very high	89.1	Confident	46 Å²	46	49.5 Å²	49.5	18%	0.18	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	161.7	170.9	76.6	-85.7	0	0	0	110.7	I94 M97 Q98 E165 K187 M276	I94-Y163 HydrophobicContact CD1-CD1 4.42Å; I94-Y163 HydrophobicContact CD1-CD2 3.37Å; I94-Y163 HydrophobicContact CD1-CE2 3.97Å; I94-Y163 HydrophobicContact CD1-CG 3.6Å; I94-Y163 HydrophobicContact CG1-CD2 4.37Å; I94-Y163 HydrophobicContact CG1-CG 4.22Å; I94-Y163 HydrophobicContact CG2-CD2 4.35Å; I94-Y163 HydrophobicContact CG2-CE1 4.26Å; I94-Y163 HydrophobicContact CG2-CE2 4.04Å; M97-Y163 HydrophobicContact CE-CD1 3.22Å; M97-Y163 HydrophobicContact CE-CE1 3.35Å; M97-Y163 HydrophobicContact CE-CG 4.36Å; M97-Y163 HydrophobicContact SD-CD1 4.42Å; Q98-Y163 PolarHBondContact NE2-OH 3.11Å; Y163-E165 HydrophobicContact CD2-CG 4.45Å; Y163-K187 PolarHBondContact O-NZ 2.92Å; Y163-M276 WeakPolarHBondContact CA-O 3.34Å; Y163-M276 WeakPolarHBondContact CB-O 3.34Å
164	S	89	Confident	88.7	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.014	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	154.4	163.9	63	0	0	0	0	112	A180 L184 R275 M276	S164-A180 PolarHBondContact OG-O 3.14Å; S164-L184 WeakPolarHBondContact OG-CA 3.15Å; S164-L184 WeakPolarHBondContact OG-CB 3.14Å; S164-L184 PolarHBondContact OG-N 3.22Å; S164-R275 WeakPolarHBondContact O-CA 3.49Å; S164-M276 PolarHBondContact N-O 3.15Å; S164-M276 WeakPolarHBondContact O-CE 2.82Å; S164-M276 PolarHBondContact O-N 2.91Å; S164-M276 WeakPolarHBondContact OG-CE 3.39Å
165	E	88.9	Confident	88.5	Confident	51 Å²	51	48.9 Å²	48.9	24%	0.238	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	137.1	174.8	-65.9	160.3	136.7	0	0	109.3	K91 Y163 K183 W274 R275	K91-E165 IonicContact NZ-OE1 2.83Å; K91-E165 PolarHBondContact NZ-OE1 3.31Å; Y163-E165 HydrophobicContact CD2-CG 4.45Å; E165-K183 PolarHBondContact O-NZ 2.82Å; E165-W274 CarbonylContact C-O 3.57Å; E165-W274 WeakPolarHBondContact CA-O 3.49Å; E165-R275 HydrophobicContact CG-CB 4.38Å; E165-R275 HydrophobicContact CG-CG 4.32Å; E165-R275 IonicContact OE1-CZ 2.66Å; E165-R275 VanDerWaalsContact OE1-CZ 3.23Å; E165-R275 IonicContact OE1-NE 2.67Å; E165-R275 PolarHBondContact OE1-NE 3.25Å; E165-R275 VanDerWaalsContact OE1-NE 3.15Å; E165-R275 IonicContact OE1-NH2 3.18Å; E165-R275 PolarHBondContact OE1-NH2 3.17Å
166	V	85.7	Confident	88.3	Confident	23 Å²	23	45.4 Å²	45.4	14%	0.139	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	132.7	179.2	176.4	0	0	0	0	110.3	A180 K183 L273 W274	V166-A180 HydrophobicContact CB-CB 4.05Å; V166-A180 HydrophobicContact CG2-CB 4.08Å; V166-K183 HydrophobicContact CG2-CB 4.1Å; V166-K183 HydrophobicContact CG2-CD 3.36Å; V166-K183 HydrophobicContact CG2-CG 4.38Å; V166-L273 CarbonylContact O-C 3.52Å; V166-L273 WeakPolarHBondContact O-CA 3.26Å; V166-W274 PolarHBondContact N-O 3.09Å; V166-W274 VanDerWaalsContact N-O 3.07Å; V166-W274 PolarHBondContact O-N 3.12Å
167	G	86.1	Confident	88.1	Confident	23 Å²	23	40.6 Å²	40.6	24%	0.237	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.5	166.2	0	0	0	0	0	110.6	Q271 R272	G167-Q271 VanDerWaalsContact CA-OE1 3.3Å; G167-Q271 PolarHBondContact O-OE1 2.91Å; G167-R272 WeakPolarHBondContact CA-O 3.21Å
168	I	85.1	Confident	88.1	Confident	22 Å²	22	39.5 Å²	39.5	11%	0.113	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	159.7	173.9	-175.5	169.6	0	0	0	110.4	I172 A176 Q271 R272	I168-I172 HydrophobicContact CD1-CD1 3.51Å; I168-I172 HydrophobicContact CD1-CG1 3.6Å; I168-I172 HydrophobicContact CG1-CD1 3.79Å; I168-I172 HydrophobicContact CG1-CG1 3.72Å; I168-A176 HydrophobicContact CB-CB 4.33Å; I168-A176 HydrophobicContact CG2-CB 3.35Å; I168-Q271 CarbonylContact O-C 3.55Å; I168-Q271 WeakPolarHBondContact O-CA 3.26Å; I168-Q271 VanDerWaalsContact O-CB 3.28Å; I168-Q271 WeakPolarHBondContact O-CB 3.31Å; I168-R272 PolarHBondContact N-O 3.21Å; I168-R272 VanDerWaalsContact N-O 3.15Å; I168-R272 PolarHBondContact O-N 2.87Å
169	D	86.4	Confident	88.1	Confident	88 Å²	88	42 Å²	42	47%	0.471	25%	0.245	S	C	.	.			trans	-49.9	128.9	169.9	-171.4	-51	0	0	0	111.8	S171 I172 M173	D169-S171 VanDerWaalsContact CG-OG 3.28Å; D169-S171 PolarHBondContact O-N 3.38Å; D169-S171 VanDerWaalsContact OD1-CB 3.28Å; D169-S171 WeakPolarHBondContact OD1-CB 3.24Å; D169-S171 PolarHBondContact OD1-N 3.3Å; D169-S171 PolarHBondContact OD1-OG 3Å; D169-I172 HydrophobicContact CB-CG1 4.11Å; D169-I172 PolarHBondContact O-N 3.05Å; D169-I172 VanDerWaalsContact O-N 3.15Å; D169-M173 PolarHBondContact O-N 3.13Å
170	P	83.3	Confident	87.9	Confident	58 Å²	58	39.8 Å²	39.8	38%	0.377	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-54.1	-31	178.1	-31.7	40.1	0	0	0	115.9	I172 M173 G270	P170-I172 PolarHBondContact O-N 3.48Å; P170-M173 WeakPolarHBondContact O-CG 3.36Å; P170-M173 PolarHBondContact O-N 3.48Å; P170-G270 WeakPolarHBondContact CD-O 2.91Å; P170-G270 WeakPolarHBondContact CG-O 3.35Å
171	S	85.3	Confident	87.8	Confident	99 Å²	99	38.7 Å²	38.7	69%	0.692	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-64.3	-25.5	-179.2	62.8	0	0	0	0	112.7	D169	D169-S171 VanDerWaalsContact CG-OG 3.28Å; D169-S171 PolarHBondContact O-N 3.38Å; D169-S171 VanDerWaalsContact OD1-CB 3.28Å; D169-S171 WeakPolarHBondContact OD1-CB 3.24Å; D169-S171 PolarHBondContact OD1-N 3.3Å; D169-S171 PolarHBondContact OD1-OG 3Å
172	I	86.8	Confident	88.1	Confident	92 Å²	92	39 Å²	39	47%	0.472	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-121.8	21	-179.5	59.8	170	0	0	0	112.4	I168 D169 P170 G174 M175	I168-I172 HydrophobicContact CD1-CD1 3.51Å; I168-I172 HydrophobicContact CD1-CG1 3.6Å; I168-I172 HydrophobicContact CG1-CD1 3.79Å; I168-I172 HydrophobicContact CG1-CG1 3.72Å; D169-I172 HydrophobicContact CB-CG1 4.11Å; D169-I172 PolarHBondContact O-N 3.05Å; D169-I172 VanDerWaalsContact O-N 3.15Å; P170-I172 PolarHBondContact O-N 3.48Å; I172-G174 PolarHBondContact O-N 3Å; I172-M175 PolarHBondContact O-N 3.37Å
173	M	84.8	Confident	88.3	Confident	46 Å²	46	41.9 Å²	41.9	23%	0.227	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-54.6	-26.2	-174.7	59.8	121.2	172.7	0	0	115.3	D169 P170 M175 A176 R272 W274	D169-M173 PolarHBondContact O-N 3.13Å; P170-M173 WeakPolarHBondContact O-CG 3.36Å; P170-M173 PolarHBondContact O-N 3.48Å; M173-M175 PolarHBondContact O-N 3.17Å; M173-A176 WeakPolarHBondContact O-CB 3.29Å; M173-A176 PolarHBondContact O-N 2.89Å; M173-R272 HydrophobicContact CB-CB 3.88Å; M173-R272 HydrophobicContact CB-CG 3.77Å; M173-R272 VanDerWaalsContact CE-CZ 3.4Å; M173-R272 VanDerWaalsContact CE-NH1 3.28Å; M173-R272 HydrophobicContact CG-CG 4.47Å; M173-R272 WeakPolarHBondContact SD-CD 3.47Å; M173-R272 PolarHBondContact SD-NE 3.28Å; M173-R272 VanDerWaalsContact SD-NE 3.35Å; M173-R272 PolarHBondContact SD-NH1 2.8Å; M173-W274 PolarHBondContact O-NE1 2.92Å
174	G	84.8	Confident	88.2	Confident	21 Å²	21	39.7 Å²	39.7	22%	0.216	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63.5	-23	176	0	0	0	0	0	113.5	I172 P177 V211	I172-G174 PolarHBondContact O-N 3Å; G174-P177 WeakPolarHBondContact O-CD 3.47Å; G174-V211 WeakPolarHBondContact O-CG2 3.33Å
175	M	90.1	Very high	88.3	Confident	57 Å²	57	40 Å²	40	28%	0.281	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-92.9	-7	-179.2	-64.7	-52.3	-63.8	0	0	114.1	I172 M173 P177 V178 A210 V211 E214	I172-M175 PolarHBondContact O-N 3.37Å; M173-M175 PolarHBondContact O-N 3.17Å; M175-P177 VanDerWaalsContact C-N 3.29Å; M175-V178 HydrophobicContact CE-CG2 3.79Å; M175-V178 VanDerWaalsContact O-CB 3.29Å; M175-V178 WeakPolarHBondContact O-CB 3.34Å; M175-V178 WeakPolarHBondContact O-CG2 3.48Å; M175-V178 PolarHBondContact O-N 3.43Å; M175-A210 HydrophobicContact SD-CB 3.64Å; M175-V211 HydrophobicContact SD-CG2 4.46Å; M175-E214 HydrophobicContact CE-CB 3.63Å; M175-E214 HydrophobicContact CE-CG 3.86Å
176	A	87.5	Confident	88.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-54.8	-32.9	-178.9	0	0	0	0	0	115.7	I168 M173 V178 S179 A180 W274	I168-A176 HydrophobicContact CB-CB 4.33Å; I168-A176 HydrophobicContact CG2-CB 3.35Å; M173-A176 WeakPolarHBondContact O-CB 3.29Å; M173-A176 PolarHBondContact O-N 2.89Å; A176-V178 PolarHBondContact O-N 3.49Å; A176-V178 VanDerWaalsContact O-N 3.12Å; A176-S179 PolarHBondContact O-N 3.23Å; A176-S179 VanDerWaalsContact O-N 3.15Å; A176-A180 VanDerWaalsContact O-CB 3.26Å; A176-A180 WeakPolarHBondContact O-CB 3.39Å; A176-A180 PolarHBondContact O-N 2.99Å; A176-W274 HydrophobicContact CB-CB 4.24Å; A176-W274 HydrophobicContact CB-CD2 3.91Å; A176-W274 HydrophobicContact CB-CG 3.45Å; A176-W274 VanDerWaalsContact CB-CG 3.45Å
177	P	89	Confident	88.8	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.013	27%	0.271	C	S	.	.	H	α-helix	trans	-50.7	-35.9	173.6	-32.3	39.2	0	0	0	113	G174 M175 A180 I181 I200 V211 W274	G174-P177 WeakPolarHBondContact O-CD 3.47Å; M175-P177 VanDerWaalsContact C-N 3.29Å; P177-A180 PolarHBondContact O-N 3.37Å; P177-I181 VanDerWaalsContact O-CB 3.24Å; P177-I181 WeakPolarHBondContact O-CB 3.32Å; P177-I181 WeakPolarHBondContact O-CG1 3.38Å; P177-I181 PolarHBondContact O-N 2.79Å; P177-I200 HydrophobicContact CB-CG2 4.44Å; P177-I200 HydrophobicContact CG-CG2 4.44Å; P177-V211 HydrophobicContact CB-CB 4.43Å; P177-V211 HydrophobicContact CB-CG1 3.64Å; P177-V211 HydrophobicContact CB-CG2 3.88Å; P177-V211 HydrophobicContact CG-CG1 4.29Å; P177-V211 HydrophobicContact CG-CG2 3.74Å; P177-W274 HydrophobicContact CB-CE3 4.38Å; P177-W274 HydrophobicContact CB-CZ3 4.4Å; P177-W274 HydrophobicContact CG-CD2 3.96Å; P177-W274 HydrophobicContact CG-CE3 3.52Å; P177-W274 HydrophobicContact CG-CH2 3.43Å; P177-W274 VanDerWaalsContact CG-CH2 3.43Å; P177-W274 HydrophobicContact CG-CZ2 3.88Å; P177-W274 HydrophobicContact CG-CZ3 3.3Å
178	V	91.3	Very high	88.9	Confident	16 Å²	16	49.4 Å²	49.4	10%	0.097	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-54.5	179.7	-177.8	0	0	0	0	110.2	M175 A176 A180 I181 N182 V211 E214 L215	M175-V178 HydrophobicContact CE-CG2 3.79Å; M175-V178 VanDerWaalsContact O-CB 3.29Å; M175-V178 WeakPolarHBondContact O-CB 3.34Å; M175-V178 WeakPolarHBondContact O-CG2 3.48Å; M175-V178 PolarHBondContact O-N 3.43Å; A176-V178 PolarHBondContact O-N 3.49Å; A176-V178 VanDerWaalsContact O-N 3.12Å; V178-A180 VanDerWaalsContact C-N 3.26Å; V178-A180 PolarHBondContact O-N 3.27Å; V178-I181 PolarHBondContact O-N 2.91Å; V178-N182 WeakPolarHBondContact O-CB 3.36Å; V178-N182 VanDerWaalsContact O-CG 3.24Å; V178-N182 PolarHBondContact O-N 3.04Å; V178-N182 PolarHBondContact O-ND2 3.4Å; V178-V211 HydrophobicContact CG2-CB 4.45Å; V178-V211 HydrophobicContact CG2-CG1 4.25Å; V178-V211 HydrophobicContact CG2-CG2 4.26Å; V178-E214 HydrophobicContact CB-CG 4.45Å; V178-E214 HydrophobicContact CG1-CG 3.8Å; V178-E214 HydrophobicContact CG2-CB 3.99Å; V178-E214 HydrophobicContact CG2-CG 3.91Å; V178-L215 HydrophobicContact CB-CD2 4.4Å; V178-L215 HydrophobicContact CG1-CD2 3.93Å; V178-L215 HydrophobicContact CG1-CG 4.42Å; V178-L215 HydrophobicContact CG2-CD2 4.48Å; V178-L215 HydrophobicContact CG2-CG 4.12Å
179	S	90.8	Very high	89.2	Confident	55 Å²	55	55.3 Å²	55.3	39%	0.385	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-39.4	178.6	-52.5	0	0	0	0	111.8	A176 K183	A176-S179 PolarHBondContact O-N 3.23Å; A176-S179 VanDerWaalsContact O-N 3.15Å; S179-K183 WeakPolarHBondContact O-CB 3.37Å; S179-K183 PolarHBondContact O-N 3.45Å
180	A	88.9	Confident	89.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-70.2	-50.9	-177.2	0	0	0	0	0	110.5	S164 V166 A176 P177 V178 N182 K183 L184 W274 M276	S164-A180 PolarHBondContact OG-O 3.14Å; V166-A180 HydrophobicContact CB-CB 4.05Å; V166-A180 HydrophobicContact CG2-CB 4.08Å; A176-A180 VanDerWaalsContact O-CB 3.26Å; A176-A180 WeakPolarHBondContact O-CB 3.39Å; A176-A180 PolarHBondContact O-N 2.99Å; P177-A180 PolarHBondContact O-N 3.37Å; V178-A180 VanDerWaalsContact C-N 3.26Å; V178-A180 PolarHBondContact O-N 3.27Å; A180-N182 VanDerWaalsContact C-N 3.35Å; A180-N182 PolarHBondContact O-N 3.4Å; A180-K183 WeakPolarHBondContact O-CB 3.46Å; A180-K183 PolarHBondContact O-N 2.97Å; A180-K183 VanDerWaalsContact O-N 3.14Å; A180-L184 PolarHBondContact O-N 3.24Å; A180-W274 HydrophobicContact CB-CB 3.86Å; A180-M276 HydrophobicContact CB-CE 3.39Å; A180-M276 HydrophobicContact CB-SD 3.14Å; A180-M276 WeakPolarHBondContact CB-SD 3.32Å; A180-M276 WeakPolarHBondContact O-CE 3.45Å
181	I	91.4	Very high	89.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.2	-46	176.1	-72.2	167.2	0	0	0	110.7	P177 V178 K183 L184 L185 F198 I200 L215 V259 M276	P177-I181 VanDerWaalsContact O-CB 3.24Å; P177-I181 WeakPolarHBondContact O-CB 3.32Å; P177-I181 WeakPolarHBondContact O-CG1 3.38Å; P177-I181 PolarHBondContact O-N 2.79Å; V178-I181 PolarHBondContact O-N 2.91Å; I181-K183 VanDerWaalsContact C-N 3.3Å; I181-K183 PolarHBondContact O-N 2.7Å; I181-L184 WeakPolarHBondContact O-CB 3.29Å; I181-L184 PolarHBondContact O-N 3.48Å; I181-L184 VanDerWaalsContact O-N 3.11Å; I181-L185 HydrophobicContact CG2-CD1 3.84Å; I181-L185 HydrophobicContact CG2-CG 4.17Å; I181-L185 WeakPolarHBondContact O-CG 3.26Å; I181-L185 PolarHBondContact O-N 2.87Å; I181-F198 HydrophobicContact CD1-CD1 4.15Å; I181-F198 HydrophobicContact CD1-CE1 4.43Å; I181-F198 HydrophobicContact CG2-CE1 3.98Å; I181-I200 HydrophobicContact CD1-CD1 3.81Å; I181-I200 HydrophobicContact CD1-CG1 4.49Å; I181-L215 HydrophobicContact CD1-CD1 3.61Å; I181-L215 HydrophobicContact CG2-CD2 4.49Å; I181-V259 HydrophobicContact CG1-CG1 4.15Å; I181-M276 HydrophobicContact CG1-CG 3.94Å; I181-M276 HydrophobicContact CG1-SD 4.42Å
182	N	92.6	Very high	90.3	Very high	82 Å²	82	53.8 Å²	53.8	44%	0.439	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-39.8	177.6	-73.4	-24.6	0	0	0	112.2	V178 A180 K186	V178-N182 WeakPolarHBondContact O-CB 3.36Å; V178-N182 VanDerWaalsContact O-CG 3.24Å; V178-N182 PolarHBondContact O-N 3.04Å; V178-N182 PolarHBondContact O-ND2 3.4Å; A180-N182 VanDerWaalsContact C-N 3.35Å; A180-N182 PolarHBondContact O-N 3.4Å; N182-K186 WeakPolarHBondContact O-CB 3.34Å; N182-K186 PolarHBondContact O-N 3Å
183	K	92.8	Very high	90.7	Very high	97 Å²	97	55.6 Å²	55.6	42%	0.422	28%	0.284	S	S	.	.	H	α-helix	trans	-64.9	-43	173.8	-176.4	179.8	179.2	179.7	0	111.8	E165 V166 S179 A180 I181 K186 K187	E165-K183 PolarHBondContact O-NZ 2.82Å; V166-K183 HydrophobicContact CG2-CB 4.1Å; V166-K183 HydrophobicContact CG2-CD 3.36Å; V166-K183 HydrophobicContact CG2-CG 4.38Å; S179-K183 WeakPolarHBondContact O-CB 3.37Å; S179-K183 PolarHBondContact O-N 3.45Å; A180-K183 WeakPolarHBondContact O-CB 3.46Å; A180-K183 PolarHBondContact O-N 2.97Å; A180-K183 VanDerWaalsContact O-N 3.14Å; I181-K183 VanDerWaalsContact C-N 3.3Å; I181-K183 PolarHBondContact O-N 2.7Å; K183-K186 PolarHBondContact O-N 3.33Å; K183-K187 WeakPolarHBondContact O-CB 3.39Å; K183-K187 WeakPolarHBondContact O-CG 3.42Å; K183-K187 PolarHBondContact O-N 3.42Å
184	L	90.9	Very high	91.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-50.2	177.3	173.7	64.3	0	0	0	111	N162 S164 A180 I181 K186 K187 A188 V259 M276 C278	N162-L184 HydrophobicContact CB-CD1 3.95Å; S164-L184 WeakPolarHBondContact OG-CA 3.15Å; S164-L184 WeakPolarHBondContact OG-CB 3.14Å; S164-L184 PolarHBondContact OG-N 3.22Å; A180-L184 PolarHBondContact O-N 3.24Å; I181-L184 WeakPolarHBondContact O-CB 3.29Å; I181-L184 PolarHBondContact O-N 3.48Å; I181-L184 VanDerWaalsContact O-N 3.11Å; L184-K186 VanDerWaalsContact C-N 3.34Å; L184-K186 PolarHBondContact O-N 3.28Å; L184-K187 PolarHBondContact O-N 3.01Å; L184-A188 WeakPolarHBondContact O-CB 3.25Å; L184-A188 PolarHBondContact O-N 2.83Å; L184-V259 HydrophobicContact CD2-CG1 3.93Å; L184-V259 HydrophobicContact CD2-CG2 4.13Å; L184-M276 HydrophobicContact CB-CE 3.9Å; L184-M276 HydrophobicContact CD2-CB 3.46Å; L184-M276 VanDerWaalsContact CD2-CB 3.46Å; L184-M276 HydrophobicContact CD2-CG 4.32Å; L184-C278 HydrophobicContact CD1-CB 4.28Å; L184-C278 HydrophobicContact CD2-CB 4.04Å; L184-C278 HydrophobicContact CG-CB 4.42Å
185	L	91.7	Very high	91.5	Very high	8 Å²	8	55.3 Å²	55.3	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-42.8	-178.9	-67.6	179.2	0	0	0	111.4	I181 K187 A188 N189 R190 I192 I195	I181-L185 HydrophobicContact CG2-CD1 3.84Å; I181-L185 HydrophobicContact CG2-CG 4.17Å; I181-L185 WeakPolarHBondContact O-CG 3.26Å; I181-L185 PolarHBondContact O-N 2.87Å; L185-K187 PolarHBondContact O-N 3.3Å; L185-A188 CarbonylContact O-C 3.49Å; L185-A188 PolarHBondContact O-N 3.33Å; L185-N189 PolarHBondContact O-N 3.37Å; L185-R190 HydrophobicContact CD2-CB 4.17Å; L185-R190 PolarHBondContact O-N 3.18Å; L185-I192 HydrophobicContact CD1-CB 3.95Å; L185-I192 HydrophobicContact CD1-CG1 4.18Å; L185-I195 HydrophobicContact CD2-CD1 3.76Å; L185-I195 HydrophobicContact CD2-CG1 3.69Å
186	K	93.4	Very high	91.8	Very high	180 Å²	180	55 Å²	55	78%	0.783	28%	0.276	S	S	*	.	H	α-helix	trans	-59.8	-46.3	173	-174.5	176	-179.1	176.8	0	112.1	N182 K183 L184 A188 N189	N182-K186 WeakPolarHBondContact O-CB 3.34Å; N182-K186 PolarHBondContact O-N 3Å; K183-K186 PolarHBondContact O-N 3.33Å; L184-K186 VanDerWaalsContact C-N 3.34Å; L184-K186 PolarHBondContact O-N 3.28Å; K186-A188 VanDerWaalsContact C-N 3.27Å; K186-A188 PolarHBondContact O-N 3.07Å; K186-N189 PolarHBondContact O-N 2.87Å; K186-N189 VanDerWaalsContact O-N 3.15Å
187	K	90.8	Very high	92.2	Very high	100 Å²	100	55 Å²	55	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-33.5	176.3	-78.5	-174.9	71.7	-165.3	0	112.7	N162 Y163 K183 L184 L185 N189	N162-K187 PolarHBondContact ND2-O 3.34Å; N162-K187 PolarHBondContact OD1-NZ 3.41Å; N162-K187 VanDerWaalsContact OD1-NZ 3.16Å; Y163-K187 PolarHBondContact O-NZ 2.92Å; K183-K187 WeakPolarHBondContact O-CB 3.39Å; K183-K187 WeakPolarHBondContact O-CG 3.42Å; K183-K187 PolarHBondContact O-N 3.42Å; L184-K187 PolarHBondContact O-N 3.01Å; L185-K187 PolarHBondContact O-N 3.3Å; K187-N189 VanDerWaalsContact C-N 3.28Å
188	A	88.2	Confident	92.4	Very high	15 Å²	15	54.9 Å²	54.9	12%	0.124	28%	0.275	C	S	.	.	H	α-helix	trans	-82.6	-5.2	178.1	0	0	0	0	0	113.2	L184 L185 K186 R190	L184-A188 WeakPolarHBondContact O-CB 3.25Å; L184-A188 PolarHBondContact O-N 2.83Å; L185-A188 CarbonylContact O-C 3.49Å; L185-A188 PolarHBondContact O-N 3.33Å; K186-A188 VanDerWaalsContact C-N 3.27Å; K186-A188 PolarHBondContact O-N 3.07Å; A188-R190 HydrophobicContact CB-CB 4.36Å; A188-R190 HydrophobicContact CB-CG 3.87Å; A188-R190 WeakPolarHBondContact O-CG 3.14Å
189	N	91.8	Very high	92.6	Very high	146 Å²	146	54.2 Å²	54.2	78%	0.781	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	54.2	-169.3	-167.6	44.4	0	0	0	111.9	L185 K186 K187	L185-N189 PolarHBondContact O-N 3.37Å; K186-N189 PolarHBondContact O-N 2.87Å; K186-N189 VanDerWaalsContact O-N 3.15Å; K187-N189 VanDerWaalsContact C-N 3.28Å
190	R	91.6	Very high	92.7	Very high	98 Å²	98	51.8 Å²	51.8	37%	0.37	25%	0.254	S	S	.	.			trans	-132.6	156.6	-176.9	-63.8	-66.1	169.6	-169.3	-6.3	111.5	L185 A188 E194	L185-R190 HydrophobicContact CD2-CB 4.17Å; L185-R190 PolarHBondContact O-N 3.18Å; A188-R190 HydrophobicContact CB-CB 4.36Å; A188-R190 HydrophobicContact CB-CG 3.87Å; A188-R190 WeakPolarHBondContact O-CG 3.14Å; R190-E194 WeakPolarHBondContact CD-OE1 3.48Å; R190-E194 IonicContact CZ-OE1 3.6Å; R190-E194 IonicContact NE-OE1 3.65Å; R190-E194 IonicContact NH1-OE1 2.74Å; R190-E194 PolarHBondContact NH1-OE1 2.75Å
191	T	94.2	Very high	92.8	Very high	71 Å²	71	52.1 Å²	52.1	44%	0.436	26%	0.255	S	S	.	.			trans	-98.5	165.6	168.9	63.3	0	0	0	0	111.3	D193 E194	T191-D193 VanDerWaalsContact C-N 3.28Å; T191-D193 PolarHBondContact O-N 2.84Å; T191-E194 PolarHBondContact N-OE2 3.29Å; T191-E194 PolarHBondContact O-N 3.29Å; T191-E194 WeakPolarHBondContact OG1-CG 3.34Å; T191-E194 PolarHBondContact OG1-OE2 3.16Å
192	I	93	Very high	92.7	Very high	43 Å²	43	53.7 Å²	53.7	22%	0.221	26%	0.263	C	S	.	.	S	Bend	trans	-68	-30.7	178.9	-160.1	171.4	0	0	0	112.1	L185 E194 I195 F198 L215 L217	L185-I192 HydrophobicContact CD1-CB 3.95Å; L185-I192 HydrophobicContact CD1-CG1 4.18Å; I192-E194 VanDerWaalsContact C-N 3.27Å; I192-E194 PolarHBondContact O-N 2.74Å; I192-I195 PolarHBondContact O-N 2.89Å; I192-I195 VanDerWaalsContact O-N 3.16Å; I192-F198 HydrophobicContact CD1-CZ 4.42Å; I192-F198 HydrophobicContact CG1-CE2 4.34Å; I192-F198 HydrophobicContact CG1-CZ 3.68Å; I192-L215 HydrophobicContact CD1-CB 3.98Å; I192-L215 HydrophobicContact CD1-CD2 3.96Å; I192-L215 HydrophobicContact CD1-CG 4.49Å; I192-L215 WeakPolarHBondContact CD1-O 3.4Å; I192-L217 HydrophobicContact CD1-CD2 3.78Å; I192-L217 HydrophobicContact CG1-CD2 4.08Å
193	D	94.1	Very high	92.3	Very high	130 Å²	130	50.8 Å²	50.8	70%	0.695	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-26.1	-178.3	-62.6	-44.5	0	0	0	112.7	T191 I195 K221	T191-D193 VanDerWaalsContact C-N 3.28Å; T191-D193 PolarHBondContact O-N 2.84Å; D193-I195 PolarHBondContact O-N 3.49Å; D193-K221 PolarHBondContact O-NZ 2.88Å
194	E	93.3	Very high	92.1	Very high	62 Å²	62	50.6 Å²	50.6	29%	0.29	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-8	174.7	-70.6	170.2	64.4	0	0	113.7	R190 T191 I192 R257	R190-E194 WeakPolarHBondContact CD-OE1 3.48Å; R190-E194 IonicContact CZ-OE1 3.6Å; R190-E194 IonicContact NE-OE1 3.65Å; R190-E194 IonicContact NH1-OE1 2.74Å; R190-E194 PolarHBondContact NH1-OE1 2.75Å; T191-E194 PolarHBondContact N-OE2 3.29Å; T191-E194 PolarHBondContact O-N 3.29Å; T191-E194 WeakPolarHBondContact OG1-CG 3.34Å; T191-E194 PolarHBondContact OG1-OE2 3.16Å; I192-E194 VanDerWaalsContact C-N 3.27Å; I192-E194 PolarHBondContact O-N 2.74Å; E194-R257 WeakPolarHBondContact O-CD 3.36Å
195	I	94.6	Very high	92	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.			trans	-93.9	127	176.5	-51.8	-55.3	0	0	0	109.3	L185 I192 D193 T197 F198 K221 R257 V259	L185-I195 HydrophobicContact CD2-CD1 3.76Å; L185-I195 HydrophobicContact CD2-CG1 3.69Å; I192-I195 PolarHBondContact O-N 2.89Å; I192-I195 VanDerWaalsContact O-N 3.16Å; D193-I195 PolarHBondContact O-N 3.49Å; I195-T197 WeakPolarHBondContact CG2-O 3.39Å; I195-F198 HydrophobicContact CB-CE1 4.25Å; I195-F198 HydrophobicContact CB-CE2 3.65Å; I195-F198 HydrophobicContact CB-CZ 3.44Å; I195-F198 VanDerWaalsContact CB-CZ 3.44Å; I195-F198 HydrophobicContact CG1-CE1 4.38Å; I195-F198 HydrophobicContact CG1-CZ 3.83Å; I195-F198 HydrophobicContact CG2-CD1 4.36Å; I195-F198 HydrophobicContact CG2-CD2 4Å; I195-F198 HydrophobicContact CG2-CE1 3.9Å; I195-F198 HydrophobicContact CG2-CE2 3.51Å; I195-F198 HydrophobicContact CG2-CG 4.4Å; I195-F198 HydrophobicContact CG2-CZ 3.45Å; I195-F198 VanDerWaalsContact CG2-CZ 3.45Å; I195-K221 PolarHBondContact O-NZ 3.43Å; I195-R257 HydrophobicContact CD1-CB 4.39Å; I195-V259 HydrophobicContact CD1-CG2 4.02Å; I195-V259 HydrophobicContact CG1-CG2 4.09Å; I195-V259 HydrophobicContact CG2-CB 4.31Å; I195-V259 HydrophobicContact CG2-CG2 3.84Å
196	D	95.5	Very high	91.9	Very high	49 Å²	49	54.5 Å²	54.5	26%	0.262	28%	0.283	S	S	.	.			trans	-81.8	-33.9	-175.4	-56.7	-48.2	0	0	0	111.9	K255 Q256 R257	D196-K255 HydrophobicContact CB-CB 3.8Å; D196-K255 HydrophobicContact CB-CD 3.83Å; D196-K255 HydrophobicContact CB-CG 3.86Å; D196-Q256 PolarHBondContact OD2-N 3.32Å; D196-R257 WeakPolarHBondContact CB-O 3.26Å; D196-R257 PolarHBondContact N-O 2.86Å; D196-R257 PolarHBondContact OD2-N 3.29Å
197	T	95.4	Very high	91.6	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	153	178.6	-165.9	0	0	0	0	113.2	I195 K221 L246 E249 L250 R257 G258 V259	I195-T197 WeakPolarHBondContact CG2-O 3.39Å; T197-K221 CarbonylContact C-O 3.43Å; T197-K221 WeakPolarHBondContact CA-O 3.48Å; T197-L246 HydrophobicContact CG2-CD1 3.52Å; T197-E249 WeakPolarHBondContact CB-OE1 3.19Å; T197-E249 HydrophobicContact CG2-CG 4.24Å; T197-E249 PolarHBondContact OG1-OE1 3.1Å; T197-E249 PolarHBondContact OG1-OE2 2.96Å; T197-L250 HydrophobicContact CG2-CD2 3.99Å; T197-R257 PolarHBondContact N-O 2.56Å; T197-G258 WeakPolarHBondContact O-CA 3.45Å; T197-V259 PolarHBondContact O-N 3.21Å
198	F	94.8	Very high	91.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126	-179.2	-65.8	-98	0	0	0	109.4	I181 I192 I195 I200 L217 K221 I222 N223 V259	I181-F198 HydrophobicContact CD1-CD1 4.15Å; I181-F198 HydrophobicContact CD1-CE1 4.43Å; I181-F198 HydrophobicContact CG2-CE1 3.98Å; I192-F198 HydrophobicContact CD1-CZ 4.42Å; I192-F198 HydrophobicContact CG1-CE2 4.34Å; I192-F198 HydrophobicContact CG1-CZ 3.68Å; I195-F198 HydrophobicContact CB-CE1 4.25Å; I195-F198 HydrophobicContact CB-CE2 3.65Å; I195-F198 HydrophobicContact CB-CZ 3.44Å; I195-F198 VanDerWaalsContact CB-CZ 3.44Å; I195-F198 HydrophobicContact CG1-CE1 4.38Å; I195-F198 HydrophobicContact CG1-CZ 3.83Å; I195-F198 HydrophobicContact CG2-CD1 4.36Å; I195-F198 HydrophobicContact CG2-CD2 4Å; I195-F198 HydrophobicContact CG2-CE1 3.9Å; I195-F198 HydrophobicContact CG2-CE2 3.51Å; I195-F198 HydrophobicContact CG2-CG 4.4Å; I195-F198 HydrophobicContact CG2-CZ 3.45Å; I195-F198 VanDerWaalsContact CG2-CZ 3.45Å; F198-I200 HydrophobicContact CB-CD1 4.37Å; F198-I200 HydrophobicContact CB-CG1 4.15Å; F198-L217 HydrophobicContact CB-CD1 4.22Å; F198-L217 HydrophobicContact CD1-CD1 4.33Å; F198-L217 HydrophobicContact CD2-CD1 3.79Å; F198-L217 HydrophobicContact CD2-CD2 3.81Å; F198-L217 HydrophobicContact CD2-CG 4.43Å; F198-L217 HydrophobicContact CE2-CD1 4.22Å; F198-L217 HydrophobicContact CE2-CD2 3.49Å; F198-L217 VanDerWaalsContact CE2-CD2 3.49Å; F198-L217 HydrophobicContact CG-CD1 3.86Å; F198-L217 HydrophobicContact CZ-CD2 4.04Å; F198-K221 WeakPolarHBondContact CB-O 3.28Å; F198-K221 WeakPolarHBondContact CD2-O 3.47Å; F198-K221 PolarHBondContact N-O 2.86Å; F198-I222 HydrophobicContact CB-CG1 4.49Å; F198-I222 CarbonylContact O-C 3.56Å; F198-I222 VanDerWaalsContact O-CA 3.32Å; F198-I222 WeakPolarHBondContact O-CA 3.4Å; F198-N223 PolarHBondContact O-N 3.28Å; F198-V259 CarbonylContact C-O 3.58Å; F198-V259 WeakPolarHBondContact CA-O 3.22Å; F198-V259 HydrophobicContact CD1-CB 3.67Å; F198-V259 HydrophobicContact CD1-CG1 4.05Å; F198-V259 HydrophobicContact CD1-CG2 4.35Å; F198-V259 HydrophobicContact CE1-CB 3.89Å; F198-V259 HydrophobicContact CE1-CG1 4.31Å; F198-V259 HydrophobicContact CE1-CG2 4.05Å
199	Q	94.1	Very high	91.8	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.009	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	95.5	172.1	-72.8	-71.8	-30.9	0	0	107.9	N223 I242 L246 E249 V259 A260 S261	Q199-N223 WeakPolarHBondContact CA-OD1 3.29Å; Q199-I242 HydrophobicContact CB-CG2 3.69Å; Q199-I242 WeakPolarHBondContact O-CG2 3.08Å; Q199-L246 HydrophobicContact CB-CB 4.36Å; Q199-L246 HydrophobicContact CB-CD1 4.35Å; Q199-L246 HydrophobicContact CG-CB 3.97Å; Q199-L246 HydrophobicContact CG-CD1 3.75Å; Q199-L246 HydrophobicContact CG-CG 4.45Å; Q199-E249 PolarHBondContact NE2-OE2 3.47Å; Q199-V259 PolarHBondContact N-O 3.09Å; Q199-A260 CarbonylContact O-C 3.48Å; Q199-A260 WeakPolarHBondContact O-CA 3.17Å; Q199-S261 PolarHBondContact O-N 2.81Å
200	I	92.9	Very high	91.9	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.7	-175.9	-52.7	-173.1	0	0	0	109	P177 I181 F198 E202 V211 L215 I222 N223 S261	P177-I200 HydrophobicContact CB-CG2 4.44Å; P177-I200 HydrophobicContact CG-CG2 4.44Å; I181-I200 HydrophobicContact CD1-CD1 3.81Å; I181-I200 HydrophobicContact CD1-CG1 4.49Å; F198-I200 HydrophobicContact CB-CD1 4.37Å; F198-I200 HydrophobicContact CB-CG1 4.15Å; I200-E202 WeakPolarHBondContact O-CG 3.36Å; I200-E202 PolarHBondContact O-N 3.39Å; I200-E202 VanDerWaalsContact O-N 3.17Å; I200-V211 HydrophobicContact CD1-CG1 3.84Å; I200-L215 HydrophobicContact CD1-CD1 4.47Å; I200-I222 HydrophobicContact CD1-CD1 3.86Å; I200-I222 HydrophobicContact CD1-CG1 4.5Å; I200-I222 HydrophobicContact CG1-CD1 4.27Å; I200-I222 HydrophobicContact CG1-CG1 4.48Å; I200-N223 PolarHBondContact N-OD1 3.13Å; I200-N223 PolarHBondContact O-ND2 3.29Å; I200-N223 PolarHBondContact O-OD1 3.27Å; I200-S261 CarbonylContact C-O 3.6Å; I200-S261 WeakPolarHBondContact CA-O 3.3Å
201	N	90.7	Very high	92	Very high	7 Å²	7	36.9 Å²	36.9	4%	0.037	22%	0.221	C	C	.	.			trans	-59.9	118.9	-179.8	-170.6	57.3	0	0	0	112.4	A203 A228 I242 S261 L262	N201-A203 PolarHBondContact O-N 3.41Å; N201-A228 WeakPolarHBondContact OD1-CB 3.47Å; N201-I242 HydrophobicContact CB-CD1 3.57Å; N201-S261 PolarHBondContact N-O 2.89Å; N201-L262 HydrophobicContact CB-CB 3.9Å; N201-L262 HydrophobicContact CB-CD1 3.72Å; N201-L262 HydrophobicContact CB-CG 3.91Å
202	E	89.3	Confident	92	Very high	34 Å²	34	35.4 Å²	35.4	16%	0.159	21%	0.208	C	C	.	.			trans	-92.3	65.4	-178.9	-50.9	-173.1	122.8	0	0	111.2	I200 F204 S208 N223 G227 A228 I229	I200-E202 WeakPolarHBondContact O-CG 3.36Å; I200-E202 PolarHBondContact O-N 3.39Å; I200-E202 VanDerWaalsContact O-N 3.17Å; E202-F204 PolarHBondContact O-N 3.1Å; E202-S208 WeakPolarHBondContact CA-OG 3.38Å; E202-S208 WeakPolarHBondContact CB-OG 3.39Å; E202-S208 WeakPolarHBondContact CG-OG 3.36Å; E202-N223 WeakPolarHBondContact CG-ND2 3.45Å; E202-N223 PolarHBondContact OE1-ND2 3.38Å; E202-G227 WeakPolarHBondContact OE2-CA 3.28Å; E202-G227 PolarHBondContact OE2-N 2.92Å; E202-G227 VanDerWaalsContact OE2-N 3.09Å; E202-A228 HydrophobicContact CB-CB 4.42Å; E202-I229 HydrophobicContact CB-CD1 3.83Å; E202-I229 HydrophobicContact CB-CG1 3.8Å; E202-I229 WeakPolarHBondContact O-CG1 3.22Å
203	A	86.2	Confident	92.2	Very high	20 Å²	20	41.7 Å²	41.7	17%	0.165	23%	0.234	C	C	.	.	S	Bend	trans	-62.9	-33.5	174.5	0	0	0	0	0	111.6	A131 S132 N201	A131-A203 WeakPolarHBondContact CA-O 3.26Å; S132-A203 PolarHBondContact N-O 2.89Å; N201-A203 PolarHBondContact O-N 3.41Å
204	F	87.6	Confident	92.2	Very high	93 Å²	93	41.2 Å²	41.2	41%	0.408	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-141.7	127.7	176.1	-57.3	-79.9	0	0	0	110.1	N130 A131 E202 A206 A207 S208	N130-F204 CarbonylContact O-C 3.35Å; N130-F204 VanDerWaalsContact O-CA 3.32Å; N130-F204 WeakPolarHBondContact O-CA 3.47Å; A131-F204 HydrophobicContact CB-CD1 3.88Å; A131-F204 HydrophobicContact CB-CE1 3.84Å; E202-F204 PolarHBondContact O-N 3.1Å; F204-A206 VanDerWaalsContact C-N 3.34Å; F204-A206 PolarHBondContact O-N 3.5Å; F204-A207 HydrophobicContact CB-CB 4.41Å; F204-A207 PolarHBondContact O-N 3.49Å; F204-A207 VanDerWaalsContact O-N 3.14Å; F204-S208 PolarHBondContact O-N 3.06Å
205	A	88.4	Confident	92.3	Very high	30 Å²	30	38.8 Å²	38.8	25%	0.248	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-42.4	-173.7	0	0	0	0	0	112.2	N130 A207 S208 V209 I229	N130-A205 PolarHBondContact O-N 2.97Å; N130-A205 WeakPolarHBondContact OD1-CA 3.43Å; N130-A205 WeakPolarHBondContact OD1-CB 3.35Å; N130-A205 PolarHBondContact OD1-N 2.91Å; A205-A207 VanDerWaalsContact C-N 3.27Å; A205-A207 PolarHBondContact O-N 3.44Å; A205-S208 WeakPolarHBondContact O-CB 3.35Å; A205-S208 PolarHBondContact O-N 3.31Å; A205-S208 VanDerWaalsContact O-N 3.09Å; A205-V209 WeakPolarHBondContact O-CG2 3.32Å; A205-V209 PolarHBondContact O-N 3.2Å; A205-I229 HydrophobicContact CB-CD1 3.31Å
206	A	89.7	Confident	92.4	Very high	61 Å²	61	47.9 Å²	47.9	50%	0.504	26%	0.256	S	S	.	.	H	α-helix	trans	-56.1	-38.2	177.8	0	0	0	0	0	113.4	N130 F204 A210	N130-A206 WeakPolarHBondContact ND2-CB 3.36Å; N130-A206 PolarHBondContact OD1-N 3.34Å; N130-A206 VanDerWaalsContact OD1-N 3.14Å; F204-A206 VanDerWaalsContact C-N 3.34Å; F204-A206 PolarHBondContact O-N 3.5Å; A206-A210 WeakPolarHBondContact O-CB 3.41Å; A206-A210 PolarHBondContact O-N 3.43Å; A206-A210 VanDerWaalsContact O-N 3.15Å
207	A	88.2	Confident	92.4	Very high	26 Å²	26	46.3 Å²	46.3	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-70.2	-41.1	177.2	0	0	0	0	0	111.3	F204 A205 V209 A210 V211	F204-A207 HydrophobicContact CB-CB 4.41Å; F204-A207 PolarHBondContact O-N 3.49Å; F204-A207 VanDerWaalsContact O-N 3.14Å; A205-A207 VanDerWaalsContact C-N 3.27Å; A205-A207 PolarHBondContact O-N 3.44Å; A207-V209 PolarHBondContact O-N 3.31Å; A207-A210 PolarHBondContact O-N 3.15Å; A207-V211 WeakPolarHBondContact O-CB 3.44Å; A207-V211 VanDerWaalsContact O-CG2 3.28Å; A207-V211 WeakPolarHBondContact O-CG2 3.2Å; A207-V211 PolarHBondContact O-N 2.88Å
208	S	89.8	Confident	92.3	Very high	10 Å²	10	49.2 Å²	49.2	7%	0.07	27%	0.268	C	S	.	.	H	α-helix	trans	-59	-46.4	175.7	-58.2	0	0	0	0	112.1	E202 F204 A205 A210 V211 Q212	E202-S208 WeakPolarHBondContact CA-OG 3.38Å; E202-S208 WeakPolarHBondContact CB-OG 3.39Å; E202-S208 WeakPolarHBondContact CG-OG 3.36Å; F204-S208 PolarHBondContact O-N 3.06Å; A205-S208 WeakPolarHBondContact O-CB 3.35Å; A205-S208 PolarHBondContact O-N 3.31Å; A205-S208 VanDerWaalsContact O-N 3.09Å; S208-A210 PolarHBondContact O-N 2.9Å; S208-V211 PolarHBondContact O-N 2.9Å; S208-Q212 WeakPolarHBondContact O-CB 3.37Å; S208-Q212 PolarHBondContact O-N 2.86Å
209	V	93.3	Very high	92.2	Very high	92 Å²	92	55.1 Å²	55.1	56%	0.558	30%	0.3	S	S	*	.	H	α-helix	trans	-62.3	-42.9	178.1	174.5	0	0	0	0	111.3	A205 A207 Q212 K213	A205-V209 WeakPolarHBondContact O-CG2 3.32Å; A205-V209 PolarHBondContact O-N 3.2Å; A207-V209 PolarHBondContact O-N 3.31Å; V209-Q212 PolarHBondContact O-N 3.11Å; V209-K213 WeakPolarHBondContact O-CB 3.33Å; V209-K213 PolarHBondContact O-N 2.89Å
210	A	93.3	Very high	92	Very high	39 Å²	39	62.7 Å²	62.7	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-44.5	178.4	0	0	0	0	0	112	M175 A206 A207 S208 K213 E214	M175-A210 HydrophobicContact SD-CB 3.64Å; A206-A210 WeakPolarHBondContact O-CB 3.41Å; A206-A210 PolarHBondContact O-N 3.43Å; A206-A210 VanDerWaalsContact O-N 3.15Å; A207-A210 PolarHBondContact O-N 3.15Å; S208-A210 PolarHBondContact O-N 2.9Å; A210-K213 PolarHBondContact O-N 2.73Å; A210-E214 WeakPolarHBondContact O-CB 3.43Å; A210-E214 PolarHBondContact O-N 2.91Å
211	V	92.9	Very high	92.1	Very high	2 Å²	2	65.2 Å²	65.2	1%	0.012	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-45.3	176.6	166.8	0	0	0	0	111.5	G174 M175 P177 V178 I200 A207 S208 K213 E214 L215	G174-V211 WeakPolarHBondContact O-CG2 3.33Å; M175-V211 HydrophobicContact SD-CG2 4.46Å; P177-V211 HydrophobicContact CB-CB 4.43Å; P177-V211 HydrophobicContact CB-CG1 3.64Å; P177-V211 HydrophobicContact CB-CG2 3.88Å; P177-V211 HydrophobicContact CG-CG1 4.29Å; P177-V211 HydrophobicContact CG-CG2 3.74Å; V178-V211 HydrophobicContact CG2-CB 4.45Å; V178-V211 HydrophobicContact CG2-CG1 4.25Å; V178-V211 HydrophobicContact CG2-CG2 4.26Å; I200-V211 HydrophobicContact CD1-CG1 3.84Å; A207-V211 WeakPolarHBondContact O-CB 3.44Å; A207-V211 VanDerWaalsContact O-CG2 3.28Å; A207-V211 WeakPolarHBondContact O-CG2 3.2Å; A207-V211 PolarHBondContact O-N 2.88Å; S208-V211 PolarHBondContact O-N 2.9Å; V211-K213 VanDerWaalsContact C-N 3.33Å; V211-K213 PolarHBondContact O-N 2.9Å; V211-E214 PolarHBondContact O-N 3.36Å; V211-L215 HydrophobicContact CG1-CD1 3.76Å; V211-L215 WeakPolarHBondContact O-CB 3.38Å; V211-L215 WeakPolarHBondContact O-CG 3.47Å; V211-L215 PolarHBondContact O-N 3.34Å
212	Q	94.7	Very high	92.2	Very high	39 Å²	39	65.5 Å²	65.5	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-58.5	-46.2	178.1	-176.4	-173.6	-6.9	0	0	111.2	S208 V209 L215 K216 L217 D219 I222	S208-Q212 WeakPolarHBondContact O-CB 3.37Å; S208-Q212 PolarHBondContact O-N 2.86Å; V209-Q212 PolarHBondContact O-N 3.11Å; Q212-L215 PolarHBondContact O-N 3.14Å; Q212-K216 PolarHBondContact O-N 2.84Å; Q212-L217 HydrophobicContact CG-CB 4.08Å; Q212-L217 WeakPolarHBondContact CG-O 3.18Å; Q212-L217 PolarHBondContact NE2-O 3.09Å; Q212-L217 VanDerWaalsContact NE2-O 3.15Å; Q212-L217 PolarHBondContact O-N 2.73Å; Q212-L217 VanDerWaalsContact O-N 3.08Å; Q212-D219 PolarHBondContact NE2-OD1 2.86Å; Q212-I222 HydrophobicContact CB-CD1 4.11Å; Q212-I222 HydrophobicContact CG-CD1 4.31Å; Q212-I222 HydrophobicContact CG-CG2 4.08Å
213	K	96.3	Very high	92.4	Very high	175 Å²	175	64.6 Å²	64.6	76%	0.761	34%	0.344	S	S	*	.	H	α-helix	trans	-63.9	-44.3	179.8	-173.2	177.7	-179.8	179.8	0	112	V209 A210 V211 K216	V209-K213 WeakPolarHBondContact O-CB 3.33Å; V209-K213 PolarHBondContact O-N 2.89Å; A210-K213 PolarHBondContact O-N 2.73Å; V211-K213 VanDerWaalsContact C-N 3.33Å; V211-K213 PolarHBondContact O-N 2.9Å; K213-K216 PolarHBondContact O-N 3.42Å; K213-K216 VanDerWaalsContact O-N 3.17Å
214	E	96.1	Very high	92.6	Very high	120 Å²	120	66.2 Å²	66.2	56%	0.561	35%	0.354	S	S	*	.	H	α-helix	trans	-66.6	-40.5	-180	-173.7	61.1	-157.1	0	0	111.9	M175 V178 A210 V211 K216	M175-E214 HydrophobicContact CE-CB 3.63Å; M175-E214 HydrophobicContact CE-CG 3.86Å; V178-E214 HydrophobicContact CB-CG 4.45Å; V178-E214 HydrophobicContact CG1-CG 3.8Å; V178-E214 HydrophobicContact CG2-CB 3.99Å; V178-E214 HydrophobicContact CG2-CG 3.91Å; A210-E214 WeakPolarHBondContact O-CB 3.43Å; A210-E214 PolarHBondContact O-N 2.91Å; V211-E214 PolarHBondContact O-N 3.36Å; E214-K216 PolarHBondContact O-N 3.39Å
215	L	94.6	Very high	92.8	Very high	12 Å²	12	66.5 Å²	66.5	6%	0.063	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.2	174.8	-69	173.6	0	0	0	113.4	V178 I181 I192 I200 V211 Q212 L217	V178-L215 HydrophobicContact CB-CD2 4.4Å; V178-L215 HydrophobicContact CG1-CD2 3.93Å; V178-L215 HydrophobicContact CG1-CG 4.42Å; V178-L215 HydrophobicContact CG2-CD2 4.48Å; V178-L215 HydrophobicContact CG2-CG 4.12Å; I181-L215 HydrophobicContact CD1-CD1 3.61Å; I181-L215 HydrophobicContact CG2-CD2 4.49Å; I192-L215 HydrophobicContact CD1-CB 3.98Å; I192-L215 HydrophobicContact CD1-CD2 3.96Å; I192-L215 HydrophobicContact CD1-CG 4.49Å; I192-L215 WeakPolarHBondContact CD1-O 3.4Å; I200-L215 HydrophobicContact CD1-CD1 4.47Å; V211-L215 HydrophobicContact CG1-CD1 3.76Å; V211-L215 WeakPolarHBondContact O-CB 3.38Å; V211-L215 WeakPolarHBondContact O-CG 3.47Å; V211-L215 PolarHBondContact O-N 3.34Å; Q212-L215 PolarHBondContact O-N 3.14Å; L215-L217 HydrophobicContact CB-CD1 4.02Å; L215-L217 HydrophobicContact CB-CD2 4.36Å; L215-L217 HydrophobicContact CB-CG 3.72Å; L215-L217 HydrophobicContact CD1-CD1 4.11Å; L215-L217 PolarHBondContact O-N 2.71Å
216	K	96.3	Very high	92.8	Very high	190 Å²	190	66 Å²	66	83%	0.826	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	38.7	-178.3	-54.9	177.9	-177	176.4	0	112.9	Q212 K213 E214	Q212-K216 PolarHBondContact O-N 2.84Å; K213-K216 PolarHBondContact O-N 3.42Å; K213-K216 VanDerWaalsContact O-N 3.17Å; E214-K216 PolarHBondContact O-N 3.39Å
217	L	94.9	Very high	92.8	Very high	16 Å²	16	63.1 Å²	63.1	8%	0.084	33%	0.327	C	S	.	.			trans	-82.1	135.7	179.5	-59.2	177.4	0	0	0	110.6	I192 F198 Q212 L215 I222	I192-L217 HydrophobicContact CD1-CD2 3.78Å; I192-L217 HydrophobicContact CG1-CD2 4.08Å; F198-L217 HydrophobicContact CB-CD1 4.22Å; F198-L217 HydrophobicContact CD1-CD1 4.33Å; F198-L217 HydrophobicContact CD2-CD1 3.79Å; F198-L217 HydrophobicContact CD2-CD2 3.81Å; F198-L217 HydrophobicContact CD2-CG 4.43Å; F198-L217 HydrophobicContact CE2-CD1 4.22Å; F198-L217 HydrophobicContact CE2-CD2 3.49Å; F198-L217 VanDerWaalsContact CE2-CD2 3.49Å; F198-L217 HydrophobicContact CG-CD1 3.86Å; F198-L217 HydrophobicContact CZ-CD2 4.04Å; Q212-L217 HydrophobicContact CG-CB 4.08Å; Q212-L217 WeakPolarHBondContact CG-O 3.18Å; Q212-L217 PolarHBondContact NE2-O 3.09Å; Q212-L217 VanDerWaalsContact NE2-O 3.15Å; Q212-L217 PolarHBondContact O-N 2.73Å; Q212-L217 VanDerWaalsContact O-N 3.08Å; L215-L217 HydrophobicContact CB-CD1 4.02Å; L215-L217 HydrophobicContact CB-CD2 4.36Å; L215-L217 HydrophobicContact CB-CG 3.72Å; L215-L217 HydrophobicContact CD1-CD1 4.11Å; L215-L217 PolarHBondContact O-N 2.71Å; L217-I222 HydrophobicContact CD1-CB 4.49Å; L217-I222 HydrophobicContact CD1-CD1 4.32Å
218	S	93.9	Very high	92.9	Very high	62 Å²	62	62.1 Å²	62.1	43%	0.434	32%	0.318	S	S	.	.			trans	-71.7	155	168.9	63.4	0	0	0	0	111	Q220 K221	S218-Q220 PolarHBondContact O-N 3.35Å; S218-Q220 VanDerWaalsContact O-N 3.12Å; S218-K221 PolarHBondContact O-N 3.38Å
219	D	92.1	Very high	92.9	Very high	124 Å²	124	64.8 Å²	64.8	66%	0.663	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-57.4	-29.5	-179.4	-61.3	-22.7	0	0	0	112.8	Q212 K221	Q212-D219 PolarHBondContact NE2-OD1 2.86Å; D219-K221 VanDerWaalsContact C-N 3.32Å; D219-K221 PolarHBondContact O-N 3.33Å
220	Q	91.5	Very high	92.6	Very high	161 Å²	161	63.9 Å²	63.9	75%	0.752	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-76.5	-17.2	178.6	-66.1	-178.4	-17	0	0	113.9	S218	S218-Q220 PolarHBondContact O-N 3.35Å; S218-Q220 VanDerWaalsContact O-N 3.12Å
221	K	93.5	Very high	92.4	Very high	57 Å²	57	65.2 Å²	65.2	25%	0.248	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-96.1	-0.1	179.7	-76.4	-158.7	171.7	-162.3	0	112.9	D193 I195 T197 F198 S218 D219	D193-K221 PolarHBondContact O-NZ 2.88Å; I195-K221 PolarHBondContact O-NZ 3.43Å; T197-K221 CarbonylContact C-O 3.43Å; T197-K221 WeakPolarHBondContact CA-O 3.48Å; F198-K221 WeakPolarHBondContact CB-O 3.28Å; F198-K221 WeakPolarHBondContact CD2-O 3.47Å; F198-K221 PolarHBondContact N-O 2.86Å; S218-K221 PolarHBondContact O-N 3.38Å; D219-K221 VanDerWaalsContact C-N 3.32Å; D219-K221 PolarHBondContact O-N 3.33Å
222	I	94.1	Very high	92.1	Very high	13 Å²	13	65.2 Å²	65.2	7%	0.067	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-135	128.1	-177.6	-172.4	173.2	0	0	0	111	F198 I200 Q212 L217 S224	F198-I222 HydrophobicContact CB-CG1 4.49Å; F198-I222 CarbonylContact O-C 3.56Å; F198-I222 VanDerWaalsContact O-CA 3.32Å; F198-I222 WeakPolarHBondContact O-CA 3.4Å; I200-I222 HydrophobicContact CD1-CD1 3.86Å; I200-I222 HydrophobicContact CD1-CG1 4.5Å; I200-I222 HydrophobicContact CG1-CD1 4.27Å; I200-I222 HydrophobicContact CG1-CG1 4.48Å; Q212-I222 HydrophobicContact CB-CD1 4.11Å; Q212-I222 HydrophobicContact CG-CD1 4.31Å; Q212-I222 HydrophobicContact CG-CG2 4.08Å; L217-I222 HydrophobicContact CD1-CB 4.49Å; L217-I222 HydrophobicContact CD1-CD1 4.32Å; I222-S224 PolarHBondContact O-N 3.3Å
223	N	93.2	Very high	91.9	Very high	15 Å²	15	63.8 Å²	63.8	8%	0.08	33%	0.328	C	S	.	.			trans	45.2	41.3	172	-62.8	-20.9	0	0	0	113.7	F198 Q199 I200 E202 Y225 G226	F198-N223 PolarHBondContact O-N 3.28Å; Q199-N223 WeakPolarHBondContact CA-OD1 3.29Å; I200-N223 PolarHBondContact N-OD1 3.13Å; I200-N223 PolarHBondContact O-ND2 3.29Å; I200-N223 PolarHBondContact O-OD1 3.27Å; E202-N223 WeakPolarHBondContact CG-ND2 3.45Å; E202-N223 PolarHBondContact OE1-ND2 3.38Å; N223-Y225 PolarHBondContact O-N 3.15Å; N223-G226 WeakPolarHBondContact O-CA 3.41Å; N223-G226 PolarHBondContact O-N 2.78Å
224	S	91.2	Very high	91.7	Very high	54 Å²	54	55.5 Å²	55.5	38%	0.378	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.1	-170.4	56	0	0	0	0	114.1	I222 E249	I222-S224 PolarHBondContact O-N 3.3Å; S224-E249 PolarHBondContact OG-OE1 3.03Å; S224-E249 PolarHBondContact OG-OE2 2.96Å
225	Y	89.9	Confident	91.4	Very high	99 Å²	99	50.9 Å²	50.9	39%	0.388	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	9.8	177.1	-71.4	-80.2	0	0	0	114	N223 L231 E249 Q252 E253	N223-Y225 PolarHBondContact O-N 3.15Å; Y225-L231 WeakPolarHBondContact O-CD1 3.46Å; Y225-E249 HydrophobicContact CD2-CB 4.29Å; Y225-E249 HydrophobicContact CD2-CG 4.1Å; Y225-E249 HydrophobicContact CE2-CB 4.34Å; Y225-E249 HydrophobicContact CE2-CG 3.96Å; Y225-Q252 PolarHBondContact OH-NE2 3.03Å; Y225-E253 HydrophobicContact CE2-CG 4.38Å; Y225-E253 PolarHBondContact OH-OE1 3.18Å
226	G	90.4	Very high	91.4	Very high	18 Å²	18	50.3 Å²	50.3	19%	0.186	27%	0.268	C	S	.	.			trans	91.3	145.3	-173.9	0	0	0	0	0	113.2	N223 L231	N223-G226 WeakPolarHBondContact O-CA 3.41Å; N223-G226 PolarHBondContact O-N 2.78Å; G226-L231 WeakPolarHBondContact O-CD1 3.39Å
227	G	89.7	Confident	91.3	Very high	2 Å²	2	41.3 Å²	41.3	2%	0.021	23%	0.229	C	C	.	.			trans	-100.9	-152.2	173	0	0	0	0	0	112.7	E202 I229 A230 L231	E202-G227 WeakPolarHBondContact OE2-CA 3.28Å; E202-G227 PolarHBondContact OE2-N 2.92Å; E202-G227 VanDerWaalsContact OE2-N 3.09Å; G227-I229 PolarHBondContact O-N 2.99Å; G227-A230 PolarHBondContact O-N 3.45Å; G227-L231 WeakPolarHBondContact O-CB 3.42Å; G227-L231 PolarHBondContact O-N 3.37Å
228	A	89.8	Confident	91.2	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.033	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-23.8	-175	0	0	0	0	0	113.8	S132 N201 E202 G232 H233	S132-A228 WeakPolarHBondContact CB-O 3.43Å; N201-A228 WeakPolarHBondContact OD1-CB 3.47Å; E202-A228 HydrophobicContact CB-CB 4.42Å; A228-G232 CarbonylContact O-C 3.57Å; A228-G232 WeakPolarHBondContact O-CA 3.45Å; A228-G232 PolarHBondContact O-N 2.96Å; A228-H233 HydrophobicContact CB-CB 4.2Å
229	I	88.9	Confident	91.1	Very high	67 Å²	67	37.6 Å²	37.6	34%	0.344	21%	0.205	S	C	.	.	H	α-helix	trans	-64.4	-46.8	173.9	-68.1	168.6	0	0	0	110.3	E202 A205 G227	E202-I229 HydrophobicContact CB-CD1 3.83Å; E202-I229 HydrophobicContact CB-CG1 3.8Å; E202-I229 WeakPolarHBondContact O-CG1 3.22Å; A205-I229 HydrophobicContact CB-CD1 3.31Å; G227-I229 PolarHBondContact O-N 2.99Å
230	A	88.3	Confident	91.2	Very high	72 Å²	72	31.7 Å²	31.7	60%	0.595	17%	0.173	S	C	*	.	H	α-helix	trans	-80.7	-40.4	-177.7	0	0	0	0	0	112.6	G227	G227-A230 PolarHBondContact O-N 3.45Å
231	L	87.4	Confident	91.3	Very high	68 Å²	68	24.6 Å²	24.6	36%	0.356	14%	0.139	S	C	.	.	H	α-helix	trans	-107.3	-8.3	-166.7	-57	171.9	0	0	0	113.6	Y225 G226 G227	Y225-L231 WeakPolarHBondContact O-CD1 3.46Å; G226-L231 WeakPolarHBondContact O-CD1 3.39Å; G227-L231 WeakPolarHBondContact O-CB 3.42Å; G227-L231 PolarHBondContact O-N 3.37Å
232	G	88.1	Confident	91.3	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.01	13%	0.129	C	C	.	.			trans	93.4	163.2	177.2	0	0	0	0	0	115.6	N135 A228	N135-G232 WeakPolarHBondContact ND2-CA 3.46Å; N135-G232 VanDerWaalsContact OD1-C 3.27Å; N135-G232 WeakPolarHBondContact OD1-CA 3.43Å; A228-G232 CarbonylContact O-C 3.57Å; A228-G232 WeakPolarHBondContact O-CA 3.45Å; A228-G232 PolarHBondContact O-N 2.96Å
233	H	90.2	Very high	91.3	Very high	10 Å²	10	21.6 Å²	21.6	5%	0.046	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-126	72.8	-174.8	-166	38.9	0	0	0	112.6	C86 S132 T133 N135 A228 I235 S238	C86-H233 PolarHBondContact SG-NE2 2.8Å; S132-H233 WeakPolarHBondContact OG-CB 3.44Å; T133-H233 WeakPolarHBondContact O-CB 3.36Å; T133-H233 PolarHBondContact O-N 2.83Å; N135-H233 PolarHBondContact OD1-N 3.27Å; A228-H233 HydrophobicContact CB-CB 4.2Å; H233-I235 PolarHBondContact O-N 3.17Å; H233-S238 PolarHBondContact CE1-OG 3.08Å; H233-S238 VanDerWaalsContact CE1-OG 3.29Å; H233-S238 WeakPolarHBondContact ND1-CB 3.45Å; H233-S238 PolarHBondContact ND1-OG 3.28Å
234	P	91.7	Very high	91.2	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.123	C	C	.	.			trans	-69.2	99	168.7	29.4	-33.4	0	0	0	108	F10 E114 N135 G236 A237 S238	F10-P234 HydrophobicContact CE2-CG 3.79Å; F10-P234 HydrophobicContact CZ-CG 3.74Å; E114-P234 HydrophobicContact CB-CB 4.03Å; N135-P234 HydrophobicContact CB-CB 4.33Å; N135-P234 WeakPolarHBondContact O-CA 3.02Å; P234-G236 PolarHBondContact O-N 2.89Å; P234-A237 HydrophobicContact CB-CB 4.1Å; P234-A237 HydrophobicContact CG-CB 4Å; P234-A237 CarbonylContact O-C 3.53Å; P234-A237 WeakPolarHBondContact O-CA 3.38Å; P234-A237 PolarHBondContact O-N 2.95Å; P234-S238 VanDerWaalsContact C-OG 3.32Å; P234-S238 PolarHBondContact O-N 2.64Å; P234-S238 PolarHBondContact O-OG 3.39Å
235	I	90.9	Very high	91.2	Very high	24 Å²	24	19.6 Å²	19.6	12%	0.123	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-49	-157.8	-56.3	179.5	0	0	0	111.9	V54 V85 C86 M116 H233 A237	V54-I235 HydrophobicContact CB-CG2 4.28Å; V54-I235 HydrophobicContact CG1-CG2 4.41Å; V54-I235 HydrophobicContact CG2-CB 4.32Å; V54-I235 HydrophobicContact CG2-CG2 3.76Å; V85-I235 HydrophobicContact CG1-CG2 3.98Å; C86-I235 HydrophobicContact CB-CG2 4.31Å; M116-I235 HydrophobicContact CE-CD1 3.58Å; M116-I235 HydrophobicContact CE-CG1 4.21Å; M116-I235 HydrophobicContact SD-CD1 3.91Å; M116-I235 HydrophobicContact SD-CG1 3.84Å; H233-I235 PolarHBondContact O-N 3.17Å; I235-A237 VanDerWaalsContact C-N 3.32Å; I235-A237 PolarHBondContact O-N 2.66Å
236	G	93.1	Very high	91.3	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-29.1	177.4	0	0	0	0	0	115.2	G89 G112 P234	G89-G236 WeakPolarHBondContact CA-O 3.43Å; G89-G236 PolarHBondContact N-O 2.94Å; G112-G236 WeakPolarHBondContact CA-O 3.4Å; P234-G236 PolarHBondContact O-N 2.89Å
237	A	94.6	Very high	91.4	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-13.7	-175.9	0	0	0	0	0	114.5	G112 P234 I235 G239 T240 R241	G112-A237 VanDerWaalsContact C-CB 3.46Å; G112-A237 VanDerWaalsContact O-CB 3.25Å; G112-A237 WeakPolarHBondContact O-CB 3.33Å; P234-A237 HydrophobicContact CB-CB 4.1Å; P234-A237 HydrophobicContact CG-CB 4Å; P234-A237 CarbonylContact O-C 3.53Å; P234-A237 WeakPolarHBondContact O-CA 3.38Å; P234-A237 PolarHBondContact O-N 2.95Å; I235-A237 VanDerWaalsContact C-N 3.32Å; I235-A237 PolarHBondContact O-N 2.66Å; A237-G239 VanDerWaalsContact C-N 3.35Å; A237-G239 PolarHBondContact O-N 2.72Å; A237-T240 PolarHBondContact O-N 3.45Å; A237-T240 VanDerWaalsContact O-N 3.13Å; A237-R241 WeakPolarHBondContact O-CB 3.41Å; A237-R241 PolarHBondContact O-N 2.83Å
238	S	93.2	Very high	91.5	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.007	9%	0.092	C	C	.	.	H	α-helix	trans	-60	-42.1	-167.9	-70.3	0	0	0	0	113	H233 P234 T240 R241 I242	H233-S238 PolarHBondContact CE1-OG 3.08Å; H233-S238 VanDerWaalsContact CE1-OG 3.29Å; H233-S238 WeakPolarHBondContact ND1-CB 3.45Å; H233-S238 PolarHBondContact ND1-OG 3.28Å; P234-S238 VanDerWaalsContact C-OG 3.32Å; P234-S238 PolarHBondContact O-N 2.64Å; P234-S238 PolarHBondContact O-OG 3.39Å; S238-T240 PolarHBondContact O-N 3.3Å; S238-R241 PolarHBondContact O-N 3.39Å; S238-I242 VanDerWaalsContact O-CG1 3.29Å; S238-I242 WeakPolarHBondContact O-CG1 3.37Å; S238-I242 PolarHBondContact O-N 2.94Å
239	G	92.3	Very high	91.6	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-58	-44.7	176.5	0	0	0	0	0	113.6	A237 V243	A237-G239 VanDerWaalsContact C-N 3.35Å; A237-G239 PolarHBondContact O-N 2.72Å; G239-V243 WeakPolarHBondContact O-CG2 3.43Å; G239-V243 PolarHBondContact O-N 2.96Å
240	T	93.9	Very high	91.8	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-71	-42.1	177.2	-46	0	0	0	0	110.8	G89 I93 G111 S139 V141 A237 S238 I242 V243 T244	G89-T240 WeakPolarHBondContact CA-OG1 3.48Å; G89-T240 PolarHBondContact O-OG1 2.55Å; G89-T240 VanDerWaalsContact O-OG1 3.11Å; I93-T240 HydrophobicContact CD1-CG2 4.13Å; G111-T240 VanDerWaalsContact C-OG1 3.25Å; G111-T240 WeakPolarHBondContact CA-OG1 3.21Å; S139-T240 WeakPolarHBondContact OG-CG2 3.38Å; V141-T240 HydrophobicContact CG1-CG2 4.34Å; V141-T240 HydrophobicContact CG2-CG2 4.39Å; A237-T240 PolarHBondContact O-N 3.45Å; A237-T240 VanDerWaalsContact O-N 3.13Å; S238-T240 PolarHBondContact O-N 3.3Å; T240-I242 PolarHBondContact O-N 3.29Å; T240-V243 WeakPolarHBondContact O-CB 3.04Å; T240-V243 PolarHBondContact O-N 2.75Å; T240-V243 VanDerWaalsContact O-N 3.13Å; T240-T244 HydrophobicContact CG2-CG2 4.41Å; T240-T244 WeakPolarHBondContact O-CG2 3.4Å; T240-T244 PolarHBondContact O-N 2.99Å; T240-T244 PolarHBondContact O-OG1 2.95Å
241	R	93.8	Very high	91.9	Very high	12 Å²	12	12 Å²	12	5%	0.045	7%	0.065	C	C	.	.	H	α-helix	trans	-54.5	-48.3	176.1	173.5	-97.3	-170	-111.8	-38.1	112.1	F10 A237 S238 V243 T244 T245	F10-R241 HydrophobicContact CB-CG 4.04Å; F10-R241 HydrophobicContact CD1-CG 3.68Å; F10-R241 HydrophobicContact CD2-CB 3.77Å; F10-R241 HydrophobicContact CD2-CG 3.54Å; F10-R241 HydrophobicContact CE1-CG 3.94Å; F10-R241 HydrophobicContact CE2-CB 4.08Å; F10-R241 HydrophobicContact CE2-CG 3.81Å; F10-R241 HydrophobicContact CG-CB 4.12Å; F10-R241 HydrophobicContact CG-CG 3.45Å; F10-R241 VanDerWaalsContact CG-CG 3.45Å; F10-R241 HydrophobicContact CZ-CG 3.99Å; A237-R241 WeakPolarHBondContact O-CB 3.41Å; A237-R241 PolarHBondContact O-N 2.83Å; S238-R241 PolarHBondContact O-N 3.39Å; R241-V243 VanDerWaalsContact C-N 3.33Å; R241-V243 PolarHBondContact O-N 3.19Å; R241-T244 WeakPolarHBondContact CA-OG1 3.38Å; R241-T244 PolarHBondContact O-N 2.69Å; R241-T244 VanDerWaalsContact O-N 3.16Å; R241-T244 PolarHBondContact O-OG1 3.12Å; R241-T245 PolarHBondContact NH1-OG1 3.31Å; R241-T245 PolarHBondContact O-N 3.17Å; R241-T245 PolarHBondContact O-OG1 3.29Å; R241-T245 VanDerWaalsContact O-OG1 3.1Å
242	I	92.9	Very high	92.1	Very high	7 Å²	7	14.8 Å²	14.8	4%	0.036	8%	0.076	C	C	.	.	H	α-helix	trans	-59.9	-43.5	177.3	-70.7	177	0	0	0	111.1	Q199 N201 S238 T240 T244 T245 L246 A260 L262	Q199-I242 HydrophobicContact CB-CG2 3.69Å; Q199-I242 WeakPolarHBondContact O-CG2 3.08Å; N201-I242 HydrophobicContact CB-CD1 3.57Å; S238-I242 VanDerWaalsContact O-CG1 3.29Å; S238-I242 WeakPolarHBondContact O-CG1 3.37Å; S238-I242 PolarHBondContact O-N 2.94Å; T240-I242 PolarHBondContact O-N 3.29Å; I242-T244 PolarHBondContact O-N 3.09Å; I242-T245 PolarHBondContact O-N 2.97Å; I242-L246 WeakPolarHBondContact O-CB 3.47Å; I242-L246 PolarHBondContact O-N 2.95Å; I242-A260 HydrophobicContact CG2-CB 3.67Å; I242-L262 HydrophobicContact CD1-CB 4.18Å; I242-L262 HydrophobicContact CD1-CD1 3.59Å; I242-L262 HydrophobicContact CD1-CG 4.46Å
243	V	92.8	Very high	92.4	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.9	-43.6	175.4	170.4	0	0	0	0	111.2	I2 M90 I93 G239 T240 R241 L246 I247 A260 I277 L279	I2-V243 HydrophobicContact CD1-CG1 3.98Å; M90-V243 HydrophobicContact CE-CG2 4.33Å; I93-V243 HydrophobicContact CD1-CB 3.97Å; I93-V243 HydrophobicContact CD1-CG1 4.07Å; I93-V243 HydrophobicContact CD1-CG2 3.83Å; G239-V243 WeakPolarHBondContact O-CG2 3.43Å; G239-V243 PolarHBondContact O-N 2.96Å; T240-V243 WeakPolarHBondContact O-CB 3.04Å; T240-V243 PolarHBondContact O-N 2.75Å; T240-V243 VanDerWaalsContact O-N 3.13Å; R241-V243 VanDerWaalsContact C-N 3.33Å; R241-V243 PolarHBondContact O-N 3.19Å; V243-L246 WeakPolarHBondContact O-CB 3.15Å; V243-L246 PolarHBondContact O-N 3.04Å; V243-I247 HydrophobicContact CG1-CD1 3.98Å; V243-I247 VanDerWaalsContact O-CG1 3.28Å; V243-I247 WeakPolarHBondContact O-CG1 3.4Å; V243-I247 PolarHBondContact O-N 3.06Å; V243-A260 HydrophobicContact CG2-CB 4.02Å; V243-I277 HydrophobicContact CG2-CD1 4.11Å; V243-L279 HydrophobicContact CG1-CD1 4.35Å
244	T	92.4	Very high	92.5	Very high	2 Å²	2	27 Å²	27	1%	0.012	13%	0.133	C	C	.	.	H	α-helix	trans	-68.1	-36	179.2	56	0	0	0	0	113.3	V8 S139 V141 T240 R241 I242 S248	V8-T244 HydrophobicContact CB-CG2 3.84Å; V8-T244 HydrophobicContact CG1-CG2 3.26Å; S139-T244 WeakPolarHBondContact OG-CG2 3.28Å; S139-T244 PolarHBondContact OG-OG1 3.04Å; V141-T244 HydrophobicContact CG1-CG2 3.56Å; T240-T244 HydrophobicContact CG2-CG2 4.41Å; T240-T244 WeakPolarHBondContact O-CG2 3.4Å; T240-T244 PolarHBondContact O-N 2.99Å; T240-T244 PolarHBondContact O-OG1 2.95Å; R241-T244 WeakPolarHBondContact CA-OG1 3.38Å; R241-T244 PolarHBondContact O-N 2.69Å; R241-T244 VanDerWaalsContact O-N 3.16Å; R241-T244 PolarHBondContact O-OG1 3.12Å; I242-T244 PolarHBondContact O-N 3.09Å; T244-S248 PolarHBondContact O-N 3.28Å; T244-S248 VanDerWaalsContact O-N 3.1Å; T244-S248 PolarHBondContact O-OG 3.48Å
245	T	91.6	Very high	92.6	Very high	24 Å²	24	29.6 Å²	29.6	15%	0.147	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-45.4	172.3	-62.4	0	0	0	0	110.4	R241 I242 I247 S248 E249	R241-T245 PolarHBondContact NH1-OG1 3.31Å; R241-T245 PolarHBondContact O-N 3.17Å; R241-T245 PolarHBondContact O-OG1 3.29Å; R241-T245 VanDerWaalsContact O-OG1 3.1Å; I242-T245 PolarHBondContact O-N 2.97Å; T245-I247 PolarHBondContact O-N 3.15Å; T245-S248 PolarHBondContact O-N 3.41Å; T245-E249 PolarHBondContact O-N 3.36Å
246	L	92.3	Very high	92.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-45.9	177.9	-177.4	62.1	0	0	0	112.1	T197 Q199 I242 V243 S248 E249 L250 A260 L279	T197-L246 HydrophobicContact CG2-CD1 3.52Å; Q199-L246 HydrophobicContact CB-CB 4.36Å; Q199-L246 HydrophobicContact CB-CD1 4.35Å; Q199-L246 HydrophobicContact CG-CB 3.97Å; Q199-L246 HydrophobicContact CG-CD1 3.75Å; Q199-L246 HydrophobicContact CG-CG 4.45Å; I242-L246 WeakPolarHBondContact O-CB 3.47Å; I242-L246 PolarHBondContact O-N 2.95Å; V243-L246 WeakPolarHBondContact O-CB 3.15Å; V243-L246 PolarHBondContact O-N 3.04Å; L246-S248 VanDerWaalsContact C-N 3.31Å; L246-S248 PolarHBondContact O-N 3.48Å; L246-E249 PolarHBondContact O-N 2.9Å; L246-L250 HydrophobicContact CD1-CG 4.38Å; L246-L250 HydrophobicContact CG-CD1 4.25Å; L246-L250 HydrophobicContact CG-CG 4.49Å; L246-L250 VanDerWaalsContact O-CG 3.27Å; L246-L250 WeakPolarHBondContact O-CG 3.45Å; L246-L250 PolarHBondContact O-N 2.97Å; L246-A260 HydrophobicContact CD2-CB 3.88Å; L246-L279 HydrophobicContact CB-CD1 4.36Å; L246-L279 HydrophobicContact CD2-CD1 3.7Å; L246-L279 HydrophobicContact CD2-CG 4.1Å; L246-L279 HydrophobicContact CG-CD1 4Å
247	I	92.3	Very high	92.7	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-59.6	-45.6	176.9	-66.1	163.4	0	0	0	110.7	I2 V8 L157 A158 V243 T245 E249 L250 I251 L279	I2-I247 HydrophobicContact CB-CD1 4.4Å; I2-I247 HydrophobicContact CD1-CD1 3.45Å; I2-I247 VanDerWaalsContact CD1-CD1 3.45Å; I2-I247 HydrophobicContact CG1-CD1 4.49Å; I2-I247 HydrophobicContact CG2-CD1 4.04Å; V8-I247 HydrophobicContact CG2-CD1 4.4Å; V8-I247 HydrophobicContact CG2-CG2 4.41Å; L157-I247 HydrophobicContact CB-CG2 3.77Å; L157-I247 HydrophobicContact CD1-CG2 3.9Å; A158-I247 HydrophobicContact CB-CD1 4.25Å; A158-I247 HydrophobicContact CB-CG1 3.92Å; V243-I247 HydrophobicContact CG1-CD1 3.98Å; V243-I247 VanDerWaalsContact O-CG1 3.28Å; V243-I247 WeakPolarHBondContact O-CG1 3.4Å; V243-I247 PolarHBondContact O-N 3.06Å; T245-I247 PolarHBondContact O-N 3.15Å; I247-E249 PolarHBondContact O-N 3.47Å; I247-L250 PolarHBondContact O-N 3.48Å; I247-I251 HydrophobicContact CG2-CD1 3.76Å; I247-I251 VanDerWaalsContact O-CG1 3.32Å; I247-I251 WeakPolarHBondContact O-CG1 3.43Å; I247-I251 PolarHBondContact O-N 3.04Å; I247-L279 HydrophobicContact CD1-CD1 4.24Å; I247-L279 HydrophobicContact CG1-CD1 3.48Å; I247-L279 VanDerWaalsContact CG1-CD1 3.48Å
248	S	91.7	Very high	92.7	Very high	24 Å²	24	36.3 Å²	36.3	17%	0.168	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-41.8	-179.4	-57.3	0	0	0	0	111.6	V8 T244 T245 L246 I251 Q252	V8-S248 PolarHBondContact O-OG 3.44Å; T244-S248 PolarHBondContact O-N 3.28Å; T244-S248 VanDerWaalsContact O-N 3.1Å; T244-S248 PolarHBondContact O-OG 3.48Å; T245-S248 PolarHBondContact O-N 3.41Å; L246-S248 VanDerWaalsContact C-N 3.31Å; L246-S248 PolarHBondContact O-N 3.48Å; S248-I251 PolarHBondContact O-N 2.96Å; S248-Q252 WeakPolarHBondContact O-CB 3.43Å; S248-Q252 PolarHBondContact O-N 3.45Å
249	E	92	Very high	92.8	Very high	3 Å²	3	36.2 Å²	36.2	1%	0.014	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-46.8	174.6	176.3	178.7	-179.9	0	0	111.6	T197 Q199 S224 Y225 T245 L246 I247 I251 Q252 E253 K255	T197-E249 WeakPolarHBondContact CB-OE1 3.19Å; T197-E249 HydrophobicContact CG2-CG 4.24Å; T197-E249 PolarHBondContact OG1-OE1 3.1Å; T197-E249 PolarHBondContact OG1-OE2 2.96Å; Q199-E249 PolarHBondContact NE2-OE2 3.47Å; S224-E249 PolarHBondContact OG-OE1 3.03Å; S224-E249 PolarHBondContact OG-OE2 2.96Å; Y225-E249 HydrophobicContact CD2-CB 4.29Å; Y225-E249 HydrophobicContact CD2-CG 4.1Å; Y225-E249 HydrophobicContact CE2-CB 4.34Å; Y225-E249 HydrophobicContact CE2-CG 3.96Å; T245-E249 PolarHBondContact O-N 3.36Å; L246-E249 PolarHBondContact O-N 2.9Å; I247-E249 PolarHBondContact O-N 3.47Å; E249-I251 VanDerWaalsContact C-N 3.29Å; E249-I251 PolarHBondContact O-N 3.15Å; E249-Q252 PolarHBondContact O-N 2.91Å; E249-E253 HydrophobicContact CG-CG 4.08Å; E249-E253 VanDerWaalsContact O-CB 3.26Å; E249-E253 WeakPolarHBondContact O-CB 3.49Å; E249-E253 WeakPolarHBondContact O-CG 3.38Å; E249-E253 PolarHBondContact O-N 2.75Å; E249-K255 IonicContact OE1-NZ 3.03Å
250	L	92	Very high	92.8	Very high	11 Å²	11	36.2 Å²	36.2	6%	0.058	17%	0.172	C	C	.	.	H	α-helix	trans	-59	-42.7	179.8	-70.4	175.3	0	0	0	111.7	T197 L246 I247 E254 K255 L279	T197-L250 HydrophobicContact CG2-CD2 3.99Å; L246-L250 HydrophobicContact CD1-CG 4.38Å; L246-L250 HydrophobicContact CG-CD1 4.25Å; L246-L250 HydrophobicContact CG-CG 4.49Å; L246-L250 VanDerWaalsContact O-CG 3.27Å; L246-L250 WeakPolarHBondContact O-CG 3.45Å; L246-L250 PolarHBondContact O-N 2.97Å; I247-L250 PolarHBondContact O-N 3.48Å; L250-E254 CarbonylContact O-C 3.58Å; L250-E254 WeakPolarHBondContact O-CA 3.43Å; L250-E254 PolarHBondContact O-N 3.09Å; L250-E254 VanDerWaalsContact O-N 3.14Å; L250-K255 HydrophobicContact CD2-CB 3.57Å; L250-K255 PolarHBondContact O-N 3.07Å; L250-L279 HydrophobicContact CD1-CB 4.09Å
251	I	90.9	Very high	92.7	Very high	65 Å²	65	36.2 Å²	36.2	33%	0.333	17%	0.172	S	C	.	.	H	α-helix	trans	-68	-48.7	177.5	-65.9	164.4	0	0	0	111.1	L157 I247 S248 E249 E253 E254	L157-I251 HydrophobicContact CB-CD1 4.08Å; L157-I251 HydrophobicContact CD1-CD1 3.89Å; L157-I251 HydrophobicContact CD2-CD1 3.83Å; L157-I251 HydrophobicContact CG-CD1 4.14Å; I247-I251 HydrophobicContact CG2-CD1 3.76Å; I247-I251 VanDerWaalsContact O-CG1 3.32Å; I247-I251 WeakPolarHBondContact O-CG1 3.43Å; I247-I251 PolarHBondContact O-N 3.04Å; S248-I251 PolarHBondContact O-N 2.96Å; E249-I251 VanDerWaalsContact C-N 3.29Å; E249-I251 PolarHBondContact O-N 3.15Å; I251-E253 VanDerWaalsContact C-N 3.32Å; I251-E253 PolarHBondContact O-N 3.04Å; I251-E254 PolarHBondContact O-N 3.15Å
252	Q	91.9	Very high	92.3	Very high	125 Å²	125	35.7 Å²	35.7	58%	0.584	17%	0.17	S	C	*	.	H	α-helix	trans	-66.4	-34.5	-174.7	-178.9	174.1	-8.8	0	0	112.6	Y225 S248 E249	Y225-Q252 PolarHBondContact OH-NE2 3.03Å; S248-Q252 WeakPolarHBondContact O-CB 3.43Å; S248-Q252 PolarHBondContact O-N 3.45Å; E249-Q252 PolarHBondContact O-N 2.91Å
253	E	93.2	Very high	91.8	Very high	87 Å²	87	36 Å²	36	41%	0.407	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	5.7	-179.4	-60.9	-69	153.4	0	0	112.9	Y225 E249 I251 K255	Y225-E253 HydrophobicContact CE2-CG 4.38Å; Y225-E253 PolarHBondContact OH-OE1 3.18Å; E249-E253 HydrophobicContact CG-CG 4.08Å; E249-E253 VanDerWaalsContact O-CB 3.26Å; E249-E253 WeakPolarHBondContact O-CB 3.49Å; E249-E253 WeakPolarHBondContact O-CG 3.38Å; E249-E253 PolarHBondContact O-N 2.75Å; I251-E253 VanDerWaalsContact C-N 3.32Å; I251-E253 PolarHBondContact O-N 3.04Å; E253-K255 HydrophobicContact CB-CD 3.77Å; E253-K255 HydrophobicContact CB-CG 3.86Å; E253-K255 HydrophobicContact CG-CD 4.48Å; E253-K255 PolarHBondContact O-N 3.01Å; E253-K255 VanDerWaalsContact O-N 3.11Å
254	E	93.4	Very high	90.7	Very high	181 Å²	181	36 Å²	36	85%	0.846	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	34.2	-176.3	-58.3	-178.2	-169.7	0	0	113.5	L250 I251	L250-E254 CarbonylContact O-C 3.58Å; L250-E254 WeakPolarHBondContact O-CA 3.43Å; L250-E254 PolarHBondContact O-N 3.09Å; L250-E254 VanDerWaalsContact O-N 3.14Å; I251-E254 PolarHBondContact O-N 3.15Å
255	K	94	Very high	89.2	Confident	55 Å²	55	37 Å²	37	24%	0.239	18%	0.184	C	C	.	.			trans	-89.6	159.2	177.3	-69.3	171.3	-177.8	177.5	0	110.5	D196 E249 L250 E253	D196-K255 HydrophobicContact CB-CB 3.8Å; D196-K255 HydrophobicContact CB-CD 3.83Å; D196-K255 HydrophobicContact CB-CG 3.86Å; E249-K255 IonicContact OE1-NZ 3.03Å; L250-K255 HydrophobicContact CD2-CB 3.57Å; L250-K255 PolarHBondContact O-N 3.07Å; E253-K255 HydrophobicContact CB-CD 3.77Å; E253-K255 HydrophobicContact CB-CG 3.86Å; E253-K255 HydrophobicContact CG-CD 4.48Å; E253-K255 PolarHBondContact O-N 3.01Å; E253-K255 VanDerWaalsContact O-N 3.11Å
256	Q	91.6	Very high	87.3	Confident	108 Å²	108	38.6 Å²	38.6	51%	0.505	20%	0.204	S	C	.	.			trans	-106.8	-35.6	-174.8	-66.7	-174	0.5	0	0	113.5	D196 K280	D196-Q256 PolarHBondContact OD2-N 3.32Å; Q256-K280 WeakPolarHBondContact O-CA 3.34Å
257	R	93.9	Very high	85.1	Confident	56 Å²	56	39.5 Å²	39.5	21%	0.211	21%	0.214	C	C	.	.			trans	-130.2	128.8	-167.4	-69.4	176.9	-168.2	73.5	0.6	112	E194 I195 D196 T197 L279	E194-R257 WeakPolarHBondContact O-CD 3.36Å; I195-R257 HydrophobicContact CD1-CB 4.39Å; D196-R257 WeakPolarHBondContact CB-O 3.26Å; D196-R257 PolarHBondContact N-O 2.86Å; D196-R257 PolarHBondContact OD2-N 3.29Å; T197-R257 PolarHBondContact N-O 2.56Å; R257-L279 WeakPolarHBondContact CA-O 3.29Å
258	G	94.6	Very high	82.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.8	-178.3	0	0	0	0	0	112.4	T197 C278 L279	T197-G258 WeakPolarHBondContact O-CA 3.45Å; G258-C278 WeakPolarHBondContact O-CA 2.99Å; G258-L279 PolarHBondContact N-O 3.02Å; G258-L279 PolarHBondContact O-N 3.17Å
259	V	95	Very high	79.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.7	170.2	173.2	0	0	0	0	109.8	I181 L184 I195 T197 F198 Q199 M276	I181-V259 HydrophobicContact CG1-CG1 4.15Å; L184-V259 HydrophobicContact CD2-CG1 3.93Å; L184-V259 HydrophobicContact CD2-CG2 4.13Å; I195-V259 HydrophobicContact CD1-CG2 4.02Å; I195-V259 HydrophobicContact CG1-CG2 4.09Å; I195-V259 HydrophobicContact CG2-CB 4.31Å; I195-V259 HydrophobicContact CG2-CG2 3.84Å; T197-V259 PolarHBondContact O-N 3.21Å; F198-V259 CarbonylContact C-O 3.58Å; F198-V259 WeakPolarHBondContact CA-O 3.22Å; F198-V259 HydrophobicContact CD1-CB 3.67Å; F198-V259 HydrophobicContact CD1-CG1 4.05Å; F198-V259 HydrophobicContact CD1-CG2 4.35Å; F198-V259 HydrophobicContact CE1-CB 3.89Å; F198-V259 HydrophobicContact CE1-CG1 4.31Å; F198-V259 HydrophobicContact CE1-CG2 4.05Å; Q199-V259 PolarHBondContact N-O 3.09Å; V259-M276 HydrophobicContact CG1-CB 4.1Å; V259-M276 HydrophobicContact CG1-CG 4.09Å
260	A	93.3	Very high	76.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	132.5	167.5	0	0	0	0	0	108.5	M90 Q199 I242 V243 L246 M276 I277	M90-A260 HydrophobicContact CE-CB 4Å; Q199-A260 CarbonylContact O-C 3.48Å; Q199-A260 WeakPolarHBondContact O-CA 3.17Å; I242-A260 HydrophobicContact CG2-CB 3.67Å; V243-A260 HydrophobicContact CG2-CB 4.02Å; L246-A260 HydrophobicContact CD2-CB 3.88Å; A260-M276 CarbonylContact O-C 3.58Å; A260-M276 WeakPolarHBondContact O-CA 3.35Å; A260-M276 WeakPolarHBondContact O-CB 3.4Å; A260-M276 WeakPolarHBondContact O-CG 3.26Å; A260-I277 PolarHBondContact N-O 3.36Å; A260-I277 PolarHBondContact O-N 3.47Å; A260-I277 VanDerWaalsContact O-N 3.09Å
261	S	90.2	Very high	73.4	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.2	179.5	-175.5	0	0	0	0	111.5	Q199 I200 N201 R275	Q199-S261 PolarHBondContact O-N 2.81Å; I200-S261 CarbonylContact C-O 3.6Å; I200-S261 WeakPolarHBondContact CA-O 3.3Å; N201-S261 PolarHBondContact N-O 2.89Å; S261-R275 WeakPolarHBondContact CA-O 3.39Å
262	L	87.5	Confident	70.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	145.6	-177.6	172.2	134.5	0	0	0	112.4	C86 G87 M90 N201 I242 R275	C86-L262 VanDerWaalsContact C-CD2 3.48Å; C86-L262 HydrophobicContact CB-CD2 4.33Å; C86-L262 HydrophobicContact CB-CG 4.49Å; C86-L262 WeakPolarHBondContact O-CD2 3.48Å; G87-L262 VanDerWaalsContact CA-CD2 3.48Å; M90-L262 HydrophobicContact CE-CB 3.92Å; N201-L262 HydrophobicContact CB-CB 3.9Å; N201-L262 HydrophobicContact CB-CD1 3.72Å; N201-L262 HydrophobicContact CB-CG 3.91Å; I242-L262 HydrophobicContact CD1-CB 4.18Å; I242-L262 HydrophobicContact CD1-CD1 3.59Å; I242-L262 HydrophobicContact CD1-CG 4.46Å; L262-R275 PolarHBondContact N-O 3.14Å; L262-R275 PolarHBondContact O-N 3.33Å
263	C	81.5	Confident	68.6	Low	14 Å²	14	52 Å²	52	10%	0.095	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	148.8	176.8	-175.8	0	0	0	0	111.1	C86 G87 W274	C86-C263 WeakPolarHBondContact CB-O 3.33Å; G87-C263 PolarHBondContact N-O 3.15Å; C263-W274 VanDerWaalsContact CA-CE3 3.47Å; C263-W274 HydrophobicContact CB-CD2 4.08Å; C263-W274 HydrophobicContact CB-CE3 4.1Å; C263-W274 HydrophobicContact CB-CH2 3.65Å; C263-W274 HydrophobicContact CB-CZ2 3.6Å; C263-W274 HydrophobicContact CB-CZ3 3.85Å
264	I	68.7	Low	66	Low	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.2	169.9	-55.7	167.1	0	0	0	106.2	E84 G266 L273 R275	E84-I264 HydrophobicContact CB-CG2 4.31Å; E84-I264 VanDerWaalsContact CD-CG2 3.41Å; E84-I264 HydrophobicContact CG-CG2 3.43Å; E84-I264 VanDerWaalsContact CG-CG2 3.43Å; E84-I264 WeakPolarHBondContact OE1-CG2 3.35Å; I264-G266 PolarHBondContact O-N 3.04Å; I264-L273 WeakPolarHBondContact CA-O 3.4Å; I264-L273 HydrophobicContact CB-CB 3.54Å; I264-L273 WeakPolarHBondContact CB-O 3.16Å; I264-L273 HydrophobicContact CD1-CB 3.53Å; I264-L273 HydrophobicContact CG1-CB 4.07Å; I264-L273 HydrophobicContact CG2-CB 3.82Å; I264-L273 HydrophobicContact CG2-CD1 4.47Å; I264-L273 PolarHBondContact N-O 3.03Å; I264-R275 HydrophobicContact CD1-CB 3.81Å; I264-R275 HydrophobicContact CG1-CB 4.31Å
265	G	61.6	Low	64.4	Low	24 Å²	24	39.9 Å²	39.9	25%	0.247	25%	0.249	C	C	.	.	S	Bend	trans	-74.4	116.8	179.4	0	0	0	0	0	110	V85	V85-G265 WeakPolarHBondContact CG2-O 2.95Å
266	G	52.9	Low	63.2	Low	56 Å²	56	37.3 Å²	37.3	58%	0.577	24%	0.238	S	C	*	.	S	Bend	trans	76.2	120.5	-179.6	0	0	0	0	0	112.6	I264	I264-G266 PolarHBondContact O-N 3.04Å
267	G	45.7	Very low	62	Low	19 Å²	19	32.2 Å²	32.2	20%	0.196	21%	0.214	C	C	.	.			trans	-123.2	173.4	177.9	0	0	0	0	0	112.8	G269 G270 Q271	G267-G269 PolarHBondContact O-N 3.01Å; G267-G270 PolarHBondContact O-N 2.92Å; G267-Q271 CarbonylContact C-O 3.52Å; G267-Q271 WeakPolarHBondContact CA-O 2.97Å; G267-Q271 PolarHBondContact N-O 2.86Å
268	L	34.4	Very low	60.4	Low	142 Å²	142	29.7 Å²	29.7	74%	0.743	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-60.1	132.8	-179.9	-68.6	168.1	0	0	0	110.8	G270 Q271	L268-G270 VanDerWaalsContact C-N 3.31Å; L268-G270 PolarHBondContact O-N 3.49Å; L268-Q271 WeakPolarHBondContact O-CB 3.23Å; L268-Q271 PolarHBondContact O-N 2.73Å
269	G	29.3	Very low	58.8	Low	85 Å²	85	29.7 Å²	29.7	88%	0.876	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	67.5	26.4	175.8	0	0	0	0	0	114.8	G267 Q271	G267-G269 PolarHBondContact O-N 3.01Å; G269-Q271 VanDerWaalsContact C-N 3.3Å; G269-Q271 PolarHBondContact O-N 3.48Å
270	G	30.8	Very low	56.8	Low	56 Å²	56	36.8 Å²	36.8	58%	0.577	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	84.2	-2.3	-178.4	0	0	0	0	0	114.1	P170 G267 L268	P170-G270 WeakPolarHBondContact CD-O 2.91Å; P170-G270 WeakPolarHBondContact CG-O 3.35Å; G267-G270 PolarHBondContact O-N 2.92Å; L268-G270 VanDerWaalsContact C-N 3.31Å; L268-G270 PolarHBondContact O-N 3.49Å
271	Q	26.9	Very low	54.9	Low	83 Å²	83	38.6 Å²	38.6	39%	0.388	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-70.2	161.4	177	-65.9	175.2	50.6	0	0	111.6	G167 I168 G267 L268 G269	G167-Q271 VanDerWaalsContact CA-OE1 3.3Å; G167-Q271 PolarHBondContact O-OE1 2.91Å; I168-Q271 CarbonylContact O-C 3.55Å; I168-Q271 WeakPolarHBondContact O-CA 3.26Å; I168-Q271 VanDerWaalsContact O-CB 3.28Å; I168-Q271 WeakPolarHBondContact O-CB 3.31Å; G267-Q271 CarbonylContact C-O 3.52Å; G267-Q271 WeakPolarHBondContact CA-O 2.97Å; G267-Q271 PolarHBondContact N-O 2.86Å; L268-Q271 WeakPolarHBondContact O-CB 3.23Å; L268-Q271 PolarHBondContact O-N 2.73Å; G269-Q271 VanDerWaalsContact C-N 3.3Å; G269-Q271 PolarHBondContact O-N 3.48Å
272	R	38.3	Very low	53.1	Low	92 Å²	92	40.6 Å²	40.6	35%	0.347	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.8	166.6	-61	-150.1	-163.6	-163.5	-3	110.1	G167 I168 M173	G167-R272 WeakPolarHBondContact CA-O 3.21Å; I168-R272 PolarHBondContact N-O 3.21Å; I168-R272 VanDerWaalsContact N-O 3.15Å; I168-R272 PolarHBondContact O-N 2.87Å; M173-R272 HydrophobicContact CB-CB 3.88Å; M173-R272 HydrophobicContact CB-CG 3.77Å; M173-R272 VanDerWaalsContact CE-CZ 3.4Å; M173-R272 VanDerWaalsContact CE-NH1 3.28Å; M173-R272 HydrophobicContact CG-CG 4.47Å; M173-R272 WeakPolarHBondContact SD-CD 3.47Å; M173-R272 PolarHBondContact SD-NE 3.28Å; M173-R272 VanDerWaalsContact SD-NE 3.35Å; M173-R272 PolarHBondContact SD-NH1 2.8Å
273	L	43	Very low	51.2	Low	34 Å²	34	42.9 Å²	42.9	18%	0.178	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	151	-177.3	-79.8	166.9	0	0	0	110.4	V166 I264	V166-L273 CarbonylContact O-C 3.52Å; V166-L273 WeakPolarHBondContact O-CA 3.26Å; I264-L273 WeakPolarHBondContact CA-O 3.4Å; I264-L273 HydrophobicContact CB-CB 3.54Å; I264-L273 WeakPolarHBondContact CB-O 3.16Å; I264-L273 HydrophobicContact CD1-CB 3.53Å; I264-L273 HydrophobicContact CG1-CB 4.07Å; I264-L273 HydrophobicContact CG2-CB 3.82Å; I264-L273 HydrophobicContact CG2-CD1 4.47Å; I264-L273 PolarHBondContact N-O 3.03Å
274	W	39.7	Very low	49.4	Very low	14 Å²	14	44.6 Å²	44.6	5%	0.053	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	145.9	174.4	-78.4	73.1	0	0	0	111.2	E165 V166 M173 A176 P177 A180 C263	E165-W274 CarbonylContact C-O 3.57Å; E165-W274 WeakPolarHBondContact CA-O 3.49Å; V166-W274 PolarHBondContact N-O 3.09Å; V166-W274 VanDerWaalsContact N-O 3.07Å; V166-W274 PolarHBondContact O-N 3.12Å; M173-W274 PolarHBondContact O-NE1 2.92Å; A176-W274 HydrophobicContact CB-CB 4.24Å; A176-W274 HydrophobicContact CB-CD2 3.91Å; A176-W274 HydrophobicContact CB-CG 3.45Å; A176-W274 VanDerWaalsContact CB-CG 3.45Å; P177-W274 HydrophobicContact CB-CE3 4.38Å; P177-W274 HydrophobicContact CB-CZ3 4.4Å; P177-W274 HydrophobicContact CG-CD2 3.96Å; P177-W274 HydrophobicContact CG-CE3 3.52Å; P177-W274 HydrophobicContact CG-CH2 3.43Å; P177-W274 VanDerWaalsContact CG-CH2 3.43Å; P177-W274 HydrophobicContact CG-CZ2 3.88Å; P177-W274 HydrophobicContact CG-CZ3 3.3Å; A180-W274 HydrophobicContact CB-CB 3.86Å; C263-W274 VanDerWaalsContact CA-CE3 3.47Å; C263-W274 HydrophobicContact CB-CD2 4.08Å; C263-W274 HydrophobicContact CB-CE3 4.1Å; C263-W274 HydrophobicContact CB-CH2 3.65Å; C263-W274 HydrophobicContact CB-CZ2 3.6Å; C263-W274 HydrophobicContact CB-CZ3 3.85Å
275	R	60.2	Low	48.2	Very low	0 Å²	0	47.4 Å²	47.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.9	-174.4	-177.9	-179.3	-74	131.8	17.2	112.5	E84 G87 M90 K91 I94 S164 E165 S261 L262 I264	E84-R275 VanDerWaalsContact CD-NH2 3.35Å; E84-R275 IonicContact OE1-CZ 2.73Å; E84-R275 IonicContact OE1-NH1 3.23Å; E84-R275 PolarHBondContact OE1-NH1 2.98Å; E84-R275 IonicContact OE1-NH2 3.2Å; E84-R275 PolarHBondContact OE1-NH2 3.14Å; E84-R275 IonicContact OE2-NH2 3.53Å; E84-R275 PolarHBondContact OE2-NH2 2.58Å; G87-R275 PolarHBondContact O-NH1 3.2Å; G87-R275 VanDerWaalsContact O-NH1 3.09Å; M90-R275 HydrophobicContact CG-CG 3.96Å; M90-R275 HydrophobicContact SD-CB 3.89Å; M90-R275 HydrophobicContact SD-CG 3.53Å; M90-R275 VanDerWaalsContact SD-CG 3.53Å; K91-R275 VanDerWaalsContact CA-NH1 3.26Å; K91-R275 VanDerWaalsContact CD-CZ 3.47Å; K91-R275 VanDerWaalsContact CD-NH2 3.31Å; K91-R275 VanDerWaalsContact N-NH1 3.19Å; I94-R275 HydrophobicContact CD1-CG 3.54Å; I94-R275 VanDerWaalsContact CD1-NE 3.27Å; S164-R275 WeakPolarHBondContact O-CA 3.49Å; E165-R275 HydrophobicContact CG-CB 4.38Å; E165-R275 HydrophobicContact CG-CG 4.32Å; E165-R275 IonicContact OE1-CZ 2.66Å; E165-R275 VanDerWaalsContact OE1-CZ 3.23Å; E165-R275 IonicContact OE1-NE 2.67Å; E165-R275 PolarHBondContact OE1-NE 3.25Å; E165-R275 VanDerWaalsContact OE1-NE 3.15Å; E165-R275 IonicContact OE1-NH2 3.18Å; E165-R275 PolarHBondContact OE1-NH2 3.17Å; S261-R275 WeakPolarHBondContact CA-O 3.39Å; L262-R275 PolarHBondContact N-O 3.14Å; L262-R275 PolarHBondContact O-N 3.33Å; I264-R275 HydrophobicContact CD1-CB 3.81Å; I264-R275 HydrophobicContact CG1-CB 4.31Å
276	M	69.2	Low	47.3	Very low	0 Å²	0	48.9 Å²	48.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	155.4	173.1	-56.5	69.1	46.8	0	0	112.8	Y163 S164 A180 I181 L184 V259 A260	Y163-M276 WeakPolarHBondContact CA-O 3.34Å; Y163-M276 WeakPolarHBondContact CB-O 3.34Å; S164-M276 PolarHBondContact N-O 3.15Å; S164-M276 WeakPolarHBondContact O-CE 2.82Å; S164-M276 PolarHBondContact O-N 2.91Å; S164-M276 WeakPolarHBondContact OG-CE 3.39Å; A180-M276 HydrophobicContact CB-CE 3.39Å; A180-M276 HydrophobicContact CB-SD 3.14Å; A180-M276 WeakPolarHBondContact CB-SD 3.32Å; A180-M276 WeakPolarHBondContact O-CE 3.45Å; I181-M276 HydrophobicContact CG1-CG 3.94Å; I181-M276 HydrophobicContact CG1-SD 4.42Å; L184-M276 HydrophobicContact CB-CE 3.9Å; L184-M276 HydrophobicContact CD2-CB 3.46Å; L184-M276 VanDerWaalsContact CD2-CB 3.46Å; L184-M276 HydrophobicContact CD2-CG 4.32Å; V259-M276 HydrophobicContact CG1-CB 4.1Å; V259-M276 HydrophobicContact CG1-CG 4.09Å; A260-M276 CarbonylContact O-C 3.58Å; A260-M276 WeakPolarHBondContact O-CA 3.35Å; A260-M276 WeakPolarHBondContact O-CB 3.4Å; A260-M276 WeakPolarHBondContact O-CG 3.26Å
277	I	65	Low	46.9	Very low	1 Å²	1	48.4 Å²	48.4	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129	170.1	-72.2	171.6	0	0	0	107.8	M90 I93 I94 I160 V243 A260 L279	M90-I277 HydrophobicContact CG-CD1 3.8Å; M90-I277 HydrophobicContact CG-CG1 4.35Å; M90-I277 HydrophobicContact SD-CD1 4.5Å; M90-I277 HydrophobicContact SD-CG1 4.49Å; I93-I277 HydrophobicContact CB-CD1 4.1Å; I93-I277 HydrophobicContact CG2-CD1 3.56Å; I94-I277 HydrophobicContact CG1-CD1 4.5Å; I160-I277 HydrophobicContact CB-CG2 4.45Å; I160-I277 HydrophobicContact CG1-CG2 4.1Å; I160-I277 HydrophobicContact CG2-CG2 3.87Å; V243-I277 HydrophobicContact CG2-CD1 4.11Å; A260-I277 PolarHBondContact N-O 3.36Å; A260-I277 PolarHBondContact O-N 3.47Å; A260-I277 VanDerWaalsContact O-N 3.09Å; I277-L279 HydrophobicContact CG2-CD2 3.61Å; I277-L279 HydrophobicContact CG2-CG 4.09Å
278	C	60	Low	47	Very low	4 Å²	4	50.7 Å²	50.7	3%	0.027	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.3	168.1	-177.4	0	0	0	0	109.2	N161 N162 L184 G258	N161-C278 HydrophobicContact CB-CB 4.3Å; N161-C278 PolarHBondContact N-O 3.38Å; N162-C278 PolarHBondContact O-N 3.16Å; L184-C278 HydrophobicContact CD1-CB 4.28Å; L184-C278 HydrophobicContact CD2-CB 4.04Å; L184-C278 HydrophobicContact CG-CB 4.42Å; G258-C278 WeakPolarHBondContact O-CA 2.99Å
279	L	60.6	Low	48	Very low	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	146.7	176.1	-61.2	-178.4	0	0	0	111.3	I2 A158 V159 I160 V243 L246 I247 L250 R257 G258 I277	I2-L279 HydrophobicContact CD1-CD2 4.27Å; A158-L279 HydrophobicContact CB-CD1 4.41Å; A158-L279 HydrophobicContact CB-CD2 4.35Å; V159-L279 WeakPolarHBondContact O-CA 3.42Å; I160-L279 HydrophobicContact CB-CD2 4.49Å; I160-L279 HydrophobicContact CG1-CD2 3.77Å; V243-L279 HydrophobicContact CG1-CD1 4.35Å; L246-L279 HydrophobicContact CB-CD1 4.36Å; L246-L279 HydrophobicContact CD2-CD1 3.7Å; L246-L279 HydrophobicContact CD2-CG 4.1Å; L246-L279 HydrophobicContact CG-CD1 4Å; I247-L279 HydrophobicContact CD1-CD1 4.24Å; I247-L279 HydrophobicContact CG1-CD1 3.48Å; I247-L279 VanDerWaalsContact CG1-CD1 3.48Å; L250-L279 HydrophobicContact CD1-CB 4.09Å; R257-L279 WeakPolarHBondContact CA-O 3.29Å; G258-L279 PolarHBondContact N-O 3.02Å; G258-L279 PolarHBondContact O-N 3.17Å; I277-L279 HydrophobicContact CG2-CD2 3.61Å; I277-L279 HydrophobicContact CG2-CG 4.09Å
280	K	53.5	Low	49.7	Very low	148 Å²	148	39.3 Å²	39.3	64%	0.643	20%	0.202	S	C	*	.			trans	-127.7	0	168.4	-179.6	-177.8	175.6	-171	0	110.1	A158 V159 Q256	A158-K280 CarbonylContact C-O 3.57Å; A158-K280 WeakPolarHBondContact CA-O 3.35Å; V159-K280 PolarHBondContact N-O 2.86Å; V159-K280 PolarHBondContact O-N 2.79Å; Q256-K280 WeakPolarHBondContact O-CA 3.34Å

Retrieved 280 of 280 residues in 343.9 ms (Link to these results)

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