A0A077ZNA1_TRITR Loading...

Phage tail N and DUF4376 domain containing protei n

AlphaFold DB , UniProt , Accession A0A077ZNA1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 637 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	73.5	Confident	89.3	Confident	187 Å²	187	59.7 Å²	59.7	92%	0.921	32%	0.32	S	S	*	.				0	127.2	0	-85.5	179.6	72.1	0	0	105.9	P55	M1-P55 WeakPolarHBondContact O-CD 3.41Å; M1-P55 WeakPolarHBondContact O-CG 3.13Å
2	A	86	Confident	88.9	Confident	31 Å²	31	62.8 Å²	62.8	26%	0.256	38%	0.376	S	S	.	.			trans	-57.8	143.2	171.3	0	0	0	0	0	111.6	E52 A53 E54	A2-E52 HydrophobicContact CB-CB 3.86Å; A2-A53 CarbonylContact C-O 3.57Å; A2-A53 VanDerWaalsContact CA-O 3.31Å; A2-A53 WeakPolarHBondContact CA-O 3.31Å; A2-E54 HydrophobicContact CB-CG 4.39Å; A2-E54 WeakPolarHBondContact CB-OE1 3.4Å; A2-E54 PolarHBondContact N-OE1 3.25Å
3	V	90.8	Very high	88.7	Confident	8 Å²	8	64.1 Å²	64.1	5%	0.048	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.5	171.7	-178.4	0	0	0	0	107.7	I5 A53 V77 A78 D81 F89	V3-I5 PolarHBondContact O-N 3.41Å; V3-A53 PolarHBondContact N-O 2.91Å; V3-A53 PolarHBondContact O-N 3.16Å; V3-V77 HydrophobicContact CB-CG1 3.66Å; V3-V77 HydrophobicContact CG1-CG1 4.44Å; V3-V77 HydrophobicContact CG2-CG1 3.71Å; V3-A78 WeakPolarHBondContact CG2-O 3.3Å; V3-D81 HydrophobicContact CG1-CB 4.3Å; V3-D81 HydrophobicContact CG2-CB 4.48Å; V3-F89 HydrophobicContact CG1-CZ 3.8Å
4	K	93.3	Very high	88.4	Confident	86 Å²	86	62.6 Å²	62.6	37%	0.374	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	108.6	-178.3	-176.2	174.7	-176.2	174.9	0	110.9	V50 E52 P83 G84	K4-V50 HydrophobicContact CG-CG1 4.3Å; K4-E52 WeakPolarHBondContact CB-OE2 3.14Å; K4-E52 WeakPolarHBondContact CD-OE1 3.36Å; K4-E52 WeakPolarHBondContact CG-OE1 3.32Å; K4-P83 HydrophobicContact CB-CB 4.18Å; K4-P83 HydrophobicContact CB-CG 4.47Å; K4-P83 VanDerWaalsContact O-CA 3.28Å; K4-P83 WeakPolarHBondContact O-CA 3.13Å; K4-P83 WeakPolarHBondContact O-CB 3.47Å; K4-G84 PolarHBondContact O-N 2.9Å; K4-G84 VanDerWaalsContact O-N 3.16Å
5	I	93.6	Very high	88.3	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	106.4	170.9	-51.6	-176.5	0	0	0	107.9	V3 L24 Y49 I51 A53 I75 V77 G84 L86 F89	V3-I5 PolarHBondContact O-N 3.41Å; I5-L24 HydrophobicContact CD1-CD2 4.45Å; I5-Y49 HydrophobicContact CG2-CE2 4.31Å; I5-I51 HydrophobicContact CB-CB 4.39Å; I5-I51 PolarHBondContact N-O 2.98Å; I5-I51 PolarHBondContact O-N 3.09Å; I5-A53 HydrophobicContact CD1-CB 3.58Å; I5-A53 HydrophobicContact CG1-CB 3.98Å; I5-I75 HydrophobicContact CD1-CD1 3.66Å; I5-V77 HydrophobicContact CD1-CG2 4.02Å; I5-G84 CarbonylContact C-O 3.57Å; I5-G84 VanDerWaalsContact CA-O 3.3Å; I5-G84 WeakPolarHBondContact CA-O 3.31Å; I5-L86 HydrophobicContact CG2-CB 4.02Å; I5-L86 HydrophobicContact CG2-CD1 4.22Å; I5-F89 HydrophobicContact CD1-CD2 4.09Å; I5-F89 HydrophobicContact CD1-CE2 4.27Å; I5-F89 HydrophobicContact CD1-CG 4.25Å; I5-F89 HydrophobicContact CG1-CD2 4.01Å; I5-F89 HydrophobicContact CG1-CE2 3.81Å; I5-F89 HydrophobicContact CG1-CZ 4.26Å; I5-F89 HydrophobicContact CG2-CD2 4.2Å
6	S	93.4	Very high	88.4	Confident	36 Å²	36	67.3 Å²	67.3	25%	0.252	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	148.7	-175.9	58.8	0	0	0	0	112.6	Y49 G84 T85	S6-Y49 VanDerWaalsContact CA-O 3.25Å; S6-Y49 WeakPolarHBondContact CA-O 3.09Å; S6-Y49 WeakPolarHBondContact CB-O 3.25Å; S6-G84 PolarHBondContact N-O 2.58Å; S6-T85 WeakPolarHBondContact O-CA 3.42Å
7	G	92.5	Very high	88.3	Confident	20 Å²	20	64.9 Å²	64.9	21%	0.206	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.2	-168.5	-177.7	0	0	0	0	0	112.5	A48 Y49	G7-A48 CarbonylContact O-C 3.56Å; G7-A48 VanDerWaalsContact O-CA 3.3Å; G7-A48 WeakPolarHBondContact O-CA 3.49Å; G7-Y49 PolarHBondContact N-O 2.79Å; G7-Y49 VanDerWaalsContact N-O 3.09Å; G7-Y49 WeakPolarHBondContact O-CD1 3.25Å; G7-Y49 WeakPolarHBondContact O-CE1 3.1Å; G7-Y49 PolarHBondContact O-N 3.1Å
8	V	92.9	Very high	88.3	Confident	71 Å²	71	64.5 Å²	64.5	43%	0.43	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.6	172.5	177.2	0	0	0	0	108.1	K10 P16 N46 G47 A48	V8-K10 HydrophobicContact CG1-CG 3.98Å; V8-K10 PolarHBondContact O-N 3.32Å; V8-P16 HydrophobicContact CG1-CB 4.47Å; V8-N46 WeakPolarHBondContact CG1-O 3.34Å; V8-G47 CarbonylContact C-O 3.52Å; V8-G47 WeakPolarHBondContact CA-O 3.18Å; V8-A48 HydrophobicContact CG2-CB 4.3Å
9	L	90.1	Very high	88.2	Confident	16 Å²	16	66.9 Å²	66.9	8%	0.084	41%	0.407	C	S	.	.			trans	-75.3	119.7	176	-169.9	66.8	0	0	0	108.1	P16 V17 C20 I22 T43 G47 Y49 L62	L9-P16 WeakPolarHBondContact O-CA 3.29Å; L9-V17 HydrophobicContact CB-CB 4.47Å; L9-V17 HydrophobicContact CD2-CB 4.09Å; L9-V17 HydrophobicContact CD2-CG1 4.29Å; L9-V17 HydrophobicContact CG-CB 4.12Å; L9-V17 HydrophobicContact CG-CG2 4.33Å; L9-V17 PolarHBondContact O-N 2.86Å; L9-C20 HydrophobicContact CD2-CB 4.25Å; L9-I22 HydrophobicContact CD2-CD1 4.46Å; L9-I22 HydrophobicContact CD2-CG1 4.41Å; L9-T43 HydrophobicContact CB-CG2 3.94Å; L9-T43 HydrophobicContact CD2-CG2 4.07Å; L9-G47 PolarHBondContact N-O 3.13Å; L9-Y49 HydrophobicContact CB-CD1 4.04Å; L9-Y49 HydrophobicContact CB-CE1 3.98Å; L9-L62 HydrophobicContact CD1-CD1 4.46Å; L9-L62 HydrophobicContact CD2-CD1 4.32Å; L9-L62 HydrophobicContact CD2-CD2 4.23Å
10	K	88.9	Confident	88.1	Confident	130 Å²	130	63.6 Å²	63.6	57%	0.565	39%	0.387	S	S	*	.	B	Isolated β-bridge	trans	-119.9	145.1	-178.5	-64	178	-178.8	179.4	0	110.1	V8 K15	V8-K10 HydrophobicContact CG1-CG 3.98Å; V8-K10 PolarHBondContact O-N 3.32Å; K10-K15 CarbonylContact C-O 3.54Å; K10-K15 VanDerWaalsContact CA-O 3.25Å; K10-K15 WeakPolarHBondContact CA-O 3.41Å
11	D	87.8	Confident	88.2	Confident	72 Å²	72	61.3 Å²	61.3	39%	0.385	37%	0.374	S	S	.	.			trans	-74.3	177.7	170.1	70.2	11.9	0	0	0	111.1	A13 G14 K15 V17	D11-A13 PolarHBondContact O-N 3.09Å; D11-A13 VanDerWaalsContact O-N 3.09Å; D11-A13 VanDerWaalsContact OD1-C 3.31Å; D11-A13 VanDerWaalsContact OD1-CA 3.3Å; D11-A13 WeakPolarHBondContact OD1-CA 3.41Å; D11-A13 WeakPolarHBondContact OD1-CB 3.19Å; D11-A13 PolarHBondContact OD1-N 3.42Å; D11-G14 PolarHBondContact O-N 2.87Å; D11-G14 PolarHBondContact OD1-N 3.05Å; D11-K15 PolarHBondContact N-O 2.86Å; D11-K15 PolarHBondContact OD1-N 2.94Å; D11-V17 HydrophobicContact CB-CG2 3.96Å
12	G	84.3	Confident	89.1	Confident	96 Å²	96	52.4 Å²	52.4	99%	0.99	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.6	177.4	0	0	0	0	0	114.8
13	A	86.7	Confident	89.4	Confident	80 Å²	80	52.8 Å²	52.8	66%	0.661	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	4.7	174.2	0	0	0	0	0	112.7	D11 K15	D11-A13 PolarHBondContact O-N 3.09Å; D11-A13 VanDerWaalsContact O-N 3.09Å; D11-A13 VanDerWaalsContact OD1-C 3.31Å; D11-A13 VanDerWaalsContact OD1-CA 3.3Å; D11-A13 WeakPolarHBondContact OD1-CA 3.41Å; D11-A13 WeakPolarHBondContact OD1-CB 3.19Å; D11-A13 PolarHBondContact OD1-N 3.42Å; A13-K15 VanDerWaalsContact C-N 3.25Å; A13-K15 PolarHBondContact O-N 2.88Å
14	G	83.8	Confident	89.5	Confident	44 Å²	44	52.5 Å²	52.5	45%	0.454	33%	0.325	S	S	.	.	S	Bend	trans	76.7	6.7	-177.9	0	0	0	0	0	114.4	D11	D11-G14 PolarHBondContact O-N 2.87Å; D11-G14 PolarHBondContact OD1-N 3.05Å
15	K	87.4	Confident	89.4	Confident	137 Å²	137	53.9 Å²	53.9	60%	0.596	33%	0.328	S	S	*	.			trans	-80	141.9	177.4	-64.4	-177.9	178.7	-180	0	110.1	K10 D11 A13 V17	K10-K15 CarbonylContact C-O 3.54Å; K10-K15 VanDerWaalsContact CA-O 3.25Å; K10-K15 WeakPolarHBondContact CA-O 3.41Å; D11-K15 PolarHBondContact N-O 2.86Å; D11-K15 PolarHBondContact OD1-N 2.94Å; A13-K15 VanDerWaalsContact C-N 3.25Å; A13-K15 PolarHBondContact O-N 2.88Å; K15-V17 PolarHBondContact O-N 2.05Å
16	P	88.7	Confident	89.3	Confident	63 Å²	63	54 Å²	54	41%	0.409	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-64.5	130.2	178.9	25.4	-32.1	0	0	0	111	V8 L9 V18 N46	V8-P16 HydrophobicContact CG1-CB 4.47Å; L9-P16 WeakPolarHBondContact O-CA 3.29Å; P16-V18 PolarHBondContact O-N 3.39Å; P16-N46 VanDerWaalsContact CB-C 3.42Å; P16-N46 WeakPolarHBondContact CB-O 3.38Å
17	V	87.4	Confident	89.1	Confident	26 Å²	26	57.9 Å²	57.9	16%	0.158	34%	0.338	C	S	.	.			trans	-85.1	95.2	175.2	-173.9	0	0	0	0	107.7	L9 D11 K15 C20 T43 C64	L9-V17 HydrophobicContact CB-CB 4.47Å; L9-V17 HydrophobicContact CD2-CB 4.09Å; L9-V17 HydrophobicContact CD2-CG1 4.29Å; L9-V17 HydrophobicContact CG-CB 4.12Å; L9-V17 HydrophobicContact CG-CG2 4.33Å; L9-V17 PolarHBondContact O-N 2.86Å; D11-V17 HydrophobicContact CB-CG2 3.96Å; K15-V17 PolarHBondContact O-N 2.05Å; V17-C20 HydrophobicContact CG1-CB 3.69Å; V17-T43 WeakPolarHBondContact O-CB 3.18Å; V17-T43 PolarHBondContact O-OG1 3.23Å; V17-C64 HydrophobicContact CG1-CB 4.29Å
18	V	88.1	Confident	88.8	Confident	58 Å²	58	65.3 Å²	65.3	35%	0.352	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	148	-179	-67.9	0	0	0	0	111.9	P16 C20 D44 N45	P16-V18 PolarHBondContact O-N 3.39Å; V18-C20 VanDerWaalsContact C-N 3.3Å; V18-C20 PolarHBondContact O-N 3.41Å; V18-D44 WeakPolarHBondContact CG1-O 3.44Å; V18-N45 VanDerWaalsContact CG1-C 3.41Å; V18-N45 WeakPolarHBondContact CG1-O 3.47Å
19	N	86	Confident	88.6	Confident	111 Å²	111	66.4 Å²	66.4	59%	0.594	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	41.7	177.3	-164.4	40.4	0	0	0	113.8	T43	N19-T43 PolarHBondContact N-O 3.38Å; N19-T43 PolarHBondContact N-OG1 2.79Å
20	C	87.8	Confident	88.4	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.2	174	-173.5	0	0	0	0	110.7	L9 V17 V18 V42 T43 H63 C64	L9-C20 HydrophobicContact CD2-CB 4.25Å; V17-C20 HydrophobicContact CG1-CB 3.69Å; V18-C20 VanDerWaalsContact C-N 3.3Å; V18-C20 PolarHBondContact O-N 3.41Å; C20-V42 WeakPolarHBondContact O-CA 3.42Å; C20-T43 PolarHBondContact N-OG1 3.42Å; C20-T43 PolarHBondContact O-N 2.83Å; C20-T43 PolarHBondContact O-OG1 3.04Å; C20-H63 CarbonylContact C-O 3.56Å; C20-H63 WeakPolarHBondContact CA-O 3.34Å; C20-H63 PolarHBondContact SG-O 2.94Å; C20-C64 HydrophobicContact CB-CB 3.73Å; C20-C64 WeakPolarHBondContact CB-SG 3.28Å; C20-C64 WeakPolarHBondContact SG-CA 3.37Å; C20-C64 WeakPolarHBondContact SG-CB 3.49Å; C20-C64 PolarHBondContact SG-N 2.81Å; C20-C64 VanDerWaalsContact SG-N 3.41Å; C20-C64 CovalentContact SG-SG 2.05Å; C20-C64 PolarHBondContact SG-SG 3.16Å
21	A	89.9	Confident	88.2	Confident	15 Å²	15	67.2 Å²	67.2	12%	0.124	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117.8	176	0	0	0	0	0	110.4	T40 C41 V42 L62 H63	A21-T40 HydrophobicContact CB-CG2 3.61Å; A21-C41 CarbonylContact C-O 3.55Å; A21-C41 WeakPolarHBondContact CA-O 3.32Å; A21-V42 HydrophobicContact CB-CG2 4.17Å; A21-L62 CarbonylContact O-C 3.56Å; A21-L62 WeakPolarHBondContact O-CA 3.3Å; A21-H63 HydrophobicContact CB-CB 3.7Å; A21-H63 PolarHBondContact N-O 3.11Å; A21-H63 PolarHBondContact O-N 3.44Å
22	I	91.8	Very high	88.2	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	116.4	170	-53.2	174.8	0	0	0	107.4	L9 T40 C41 T43 Y49 I51 V60 L62 L86	L9-I22 HydrophobicContact CD2-CD1 4.46Å; L9-I22 HydrophobicContact CD2-CG1 4.41Å; I22-T40 CarbonylContact O-C 3.48Å; I22-T40 WeakPolarHBondContact O-CA 3.46Å; I22-C41 PolarHBondContact N-O 2.67Å; I22-C41 PolarHBondContact O-N 2.8Å; I22-T43 HydrophobicContact CD1-CG2 4.18Å; I22-T43 HydrophobicContact CG1-CG2 4.49Å; I22-Y49 HydrophobicContact CD1-CD1 3.66Å; I22-Y49 HydrophobicContact CD1-CD2 3.64Å; I22-Y49 HydrophobicContact CD1-CE1 4.19Å; I22-Y49 HydrophobicContact CD1-CE2 4.15Å; I22-Y49 HydrophobicContact CD1-CG 3.36Å; I22-I51 HydrophobicContact CB-CD1 4.06Å; I22-I51 HydrophobicContact CD1-CD1 4.49Å; I22-I51 HydrophobicContact CG2-CD1 3.74Å; I22-V60 HydrophobicContact CG2-CG1 4.24Å; I22-L62 HydrophobicContact CB-CD2 4.14Å; I22-L62 HydrophobicContact CG1-CD2 3.72Å; I22-L62 HydrophobicContact CG2-CD2 4.12Å; I22-L86 HydrophobicContact CD1-CD2 4.29Å; I22-L86 HydrophobicContact CG2-CD2 3.79Å
23	E	92.1	Very high	88.4	Confident	40 Å²	40	64.3 Å²	64.3	19%	0.187	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.2	177.1	-68.5	-167.9	168.3	0	0	110.8	V38 A39 T40 V60 A61 H63	E23-V38 HydrophobicContact CB-CG1 3.84Å; E23-V38 HydrophobicContact CG-CG1 4.03Å; E23-A39 CarbonylContact C-O 3.59Å; E23-A39 VanDerWaalsContact CA-O 3.32Å; E23-A39 WeakPolarHBondContact CA-O 3.06Å; E23-T40 HydrophobicContact CG-CG2 3.92Å; E23-V60 CarbonylContact O-C 3.58Å; E23-V60 VanDerWaalsContact O-CA 3.25Å; E23-V60 WeakPolarHBondContact O-CA 3.06Å; E23-A61 HydrophobicContact CB-CB 4.35Å; E23-A61 PolarHBondContact N-O 3.27Å; E23-A61 PolarHBondContact O-N 2.92Å; E23-H63 IonicContact OE1-CE1 3.04Å; E23-H63 PolarHBondContact OE1-CE1 2.92Å; E23-H63 IonicContact OE1-ND1 2.98Å; E23-H63 PolarHBondContact OE1-ND1 2.7Å; E23-H63 IonicContact OE2-CE1 3.42Å; E23-H63 PolarHBondContact OE2-CE1 2.81Å; E23-H63 IonicContact OE2-ND1 3.62Å
24	L	92.5	Very high	88.5	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	108.1	163.6	-67.1	97.3	0	0	0	108.9	I5 V38 A39 I51 A53 Y58 I75	I5-L24 HydrophobicContact CD1-CD2 4.45Å; L24-V38 CarbonylContact O-C 3.58Å; L24-V38 VanDerWaalsContact O-CA 3.31Å; L24-V38 WeakPolarHBondContact O-CA 3.38Å; L24-A39 PolarHBondContact N-O 2.91Å; L24-A39 PolarHBondContact O-N 3.24Å; L24-I51 HydrophobicContact CD1-CD1 3.49Å; L24-I51 VanDerWaalsContact CD1-CD1 3.49Å; L24-I51 HydrophobicContact CD1-CG2 3.74Å; L24-A53 HydrophobicContact CD2-CB 4.28Å; L24-Y58 HydrophobicContact CB-CD1 3.83Å; L24-Y58 HydrophobicContact CB-CG 4.06Å; L24-Y58 HydrophobicContact CD2-CD1 4.37Å; L24-Y58 HydrophobicContact CD2-CD2 4.14Å; L24-Y58 HydrophobicContact CD2-CG 3.88Å; L24-I75 HydrophobicContact CD2-CD1 3.61Å; L24-I75 HydrophobicContact CD2-CG1 4.4Å
25	R	92.5	Very high	88.7	Confident	115 Å²	115	64 Å²	64	43%	0.434	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	115.2	173.2	176.8	173.7	-93.8	-166.1	-4.6	109.4	R27 V38 Y58 E59	R25-R27 PolarHBondContact O-N 3.37Å; R25-V38 HydrophobicContact CB-CG2 3.91Å; R25-V38 HydrophobicContact CG-CG2 3.94Å; R25-Y58 CarbonylContact O-C 3.58Å; R25-Y58 WeakPolarHBondContact O-CA 3.13Å; R25-E59 HydrophobicContact CB-CB 4.39Å; R25-E59 PolarHBondContact N-O 3.46Å; R25-E59 PolarHBondContact O-N 2.96Å
26	A	90.3	Very high	88.6	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.008	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	123.4	174.9	0	0	0	0	0	109.9	V33 V34 H36 V37 Y58	A26-V33 HydrophobicContact CB-CG1 3.61Å; A26-V34 WeakPolarHBondContact CB-O 3.43Å; A26-H36 WeakPolarHBondContact O-CA 3.38Å; A26-H36 PolarHBondContact O-N 3.45Å; A26-V37 PolarHBondContact N-O 2.91Å; A26-Y58 HydrophobicContact CB-CD1 4.06Å; A26-Y58 HydrophobicContact CB-CE1 3.9Å
27	R	90	Very high	88.7	Confident	119 Å²	119	64.6 Å²	64.6	45%	0.449	34%	0.34	S	S	.	.	S	Bend	trans	-92.8	-19.3	179.9	-73.4	-72.8	-77.2	-151.4	2.6	112.5	R25 Y57 E59	R25-R27 PolarHBondContact O-N 3.37Å; R27-Y57 HydrophobicContact CB-CD1 3.66Å; R27-Y57 HydrophobicContact CB-CE1 4.19Å; R27-Y57 HydrophobicContact CG-CD1 4.28Å; R27-Y57 HydrophobicContact CG-CE1 4.43Å; R27-Y57 PolarHBondContact N-O 2.88Å; R27-E59 WeakPolarHBondContact CD-OE2 3.45Å; R27-E59 HydrophobicContact CG-CB 3.62Å; R27-E59 IonicContact CZ-OE2 2.95Å; R27-E59 IonicContact NE-OE2 2.89Å; R27-E59 IonicContact NH1-OE2 3.64Å; R27-E59 PolarHBondContact NH1-OE2 3.4Å
28	R	86.6	Confident	88.8	Confident	175 Å²	175	65.8 Å²	65.8	66%	0.66	35%	0.347	S	S	*	.	S	Bend	trans	-137.4	150.7	177.4	-62.5	-179.5	-179.4	173	1.3	108.6	S30	R28-S30 PolarHBondContact O-N 3.23Å
29	T	89	Confident	88.8	Confident	95 Å²	95	65.4 Å²	65.4	58%	0.583	35%	0.351	S	S	*	.			trans	-72.2	115.8	170.4	-62.2	0	0	0	0	108	V33 A35	T29-V33 CarbonylContact C-O 3.52Å; T29-V33 WeakPolarHBondContact CA-O 3.49Å; T29-A35 PolarHBondContact OG1-N 3.42Å; T29-A35 VanDerWaalsContact OG1-N 3.07Å
30	S	84.4	Confident	88.9	Confident	22 Å²	22	63.9 Å²	63.9	15%	0.154	35%	0.345	C	S	.	.			trans	-94	172.2	167.3	80.4	0	0	0	0	109.7	R28 T32 V33 P55	R28-S30 PolarHBondContact O-N 3.23Å; S30-T32 PolarHBondContact O-N 2.85Å; S30-T32 VanDerWaalsContact O-N 3.11Å; S30-T32 PolarHBondContact OG-N 2.89Å; S30-V33 PolarHBondContact N-O 3.04Å; S30-V33 PolarHBondContact OG-N 3.25Å; S30-P55 WeakPolarHBondContact CB-O 3.48Å; S30-P55 PolarHBondContact OG-O 2.89Å
31	P	85.9	Confident	89	Confident	141 Å²	141	65.1 Å²	65.1	92%	0.916	35%	0.353	S	S	*	.	S	Bend	trans	-56.6	-23.7	175.9	-26.8	36.2	0	0	0	114.6
32	T	86.9	Confident	89	Confident	82 Å²	82	68.2 Å²	68.2	50%	0.503	37%	0.371	S	S	.	.	S	Bend	trans	-118	-15.8	-176.1	53.1	0	0	0	0	114.6	S30 E54	S30-T32 PolarHBondContact O-N 2.85Å; S30-T32 VanDerWaalsContact O-N 3.11Å; S30-T32 PolarHBondContact OG-N 2.89Å; T32-E54 VanDerWaalsContact CB-OE2 3.31Å; T32-E54 WeakPolarHBondContact CB-OE2 3.33Å; T32-E54 WeakPolarHBondContact CG2-OE2 3.32Å; T32-E54 WeakPolarHBondContact OG1-CB 3.39Å; T32-E54 PolarHBondContact OG1-OE2 2.82Å
33	V	87.5	Confident	88.9	Confident	24 Å²	24	68.5 Å²	68.5	15%	0.145	37%	0.372	C	S	.	.	S	Bend	trans	-132.1	125.4	178.6	-174.3	0	0	0	0	111.2	A26 T29 S30 V37 E54 Y58	A26-V33 HydrophobicContact CB-CG1 3.61Å; T29-V33 CarbonylContact C-O 3.52Å; T29-V33 WeakPolarHBondContact CA-O 3.49Å; S30-V33 PolarHBondContact N-O 3.04Å; S30-V33 PolarHBondContact OG-N 3.25Å; V33-V37 HydrophobicContact CG1-CB 4.23Å; V33-E54 HydrophobicContact CG2-CB 3.44Å; V33-E54 VanDerWaalsContact CG2-CB 3.44Å; V33-E54 HydrophobicContact CG2-CG 4.16Å; V33-Y58 HydrophobicContact CG1-CE1 4.22Å; V33-Y58 VanDerWaalsContact CG2-OH 3.28Å; V33-Y58 WeakPolarHBondContact CG2-OH 3.36Å
34	V	89.2	Confident	88.9	Confident	93 Å²	93	70.3 Å²	70.3	56%	0.564	38%	0.383	S	S	*	.			trans	-75.9	143.5	176.3	-178.9	0	0	0	0	110.5	A26 V37	A26-V34 WeakPolarHBondContact CB-O 3.43Å; V34-V37 HydrophobicContact CB-CG2 4.06Å; V34-V37 WeakPolarHBondContact O-CB 3.43Å; V34-V37 VanDerWaalsContact O-CG2 3.27Å; V34-V37 WeakPolarHBondContact O-CG2 3.3Å; V34-V37 PolarHBondContact O-N 2.89Å
35	A	88.5	Confident	88.7	Confident	24 Å²	24	77.2 Å²	77.2	20%	0.198	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	147.7	176.4	0	0	0	0	0	112.5	T29 V37	T29-A35 PolarHBondContact OG1-N 3.42Å; T29-A35 VanDerWaalsContact OG1-N 3.07Å; A35-V37 PolarHBondContact O-N 2.83Å
36	H	86.2	Confident	88.5	Confident	133 Å²	133	77.2 Å²	77.2	62%	0.616	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	-6.4	-177.8	-52.6	-75.8	0	0	0	116.6	A26	A26-H36 WeakPolarHBondContact O-CA 3.38Å; A26-H36 PolarHBondContact O-N 3.45Å
37	V	90.2	Very high	88.4	Confident	81 Å²	81	77.1 Å²	77.1	49%	0.491	43%	0.428	S	S	.	.			trans	-65.5	136.7	170.7	179.5	0	0	0	0	109.4	A26 V33 V34 A35	A26-V37 PolarHBondContact N-O 2.91Å; V33-V37 HydrophobicContact CG1-CB 4.23Å; V34-V37 HydrophobicContact CB-CG2 4.06Å; V34-V37 WeakPolarHBondContact O-CB 3.43Å; V34-V37 VanDerWaalsContact O-CG2 3.27Å; V34-V37 WeakPolarHBondContact O-CG2 3.3Å; V34-V37 PolarHBondContact O-N 2.89Å; A35-V37 PolarHBondContact O-N 2.83Å
38	V	88.3	Confident	88.5	Confident	50 Å²	50	73 Å²	73	30%	0.303	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.2	-177.7	-173.5	0	0	0	0	109.5	E23 L24 R25	E23-V38 HydrophobicContact CB-CG1 3.84Å; E23-V38 HydrophobicContact CG-CG1 4.03Å; L24-V38 CarbonylContact O-C 3.58Å; L24-V38 VanDerWaalsContact O-CA 3.31Å; L24-V38 WeakPolarHBondContact O-CA 3.38Å; R25-V38 HydrophobicContact CB-CG2 3.91Å; R25-V38 HydrophobicContact CG-CG2 3.94Å
39	A	88.5	Confident	88.8	Confident	51 Å²	51	65 Å²	65	42%	0.421	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.8	165.1	0	0	0	0	0	108.8	E23 L24	E23-A39 CarbonylContact C-O 3.59Å; E23-A39 VanDerWaalsContact CA-O 3.32Å; E23-A39 WeakPolarHBondContact CA-O 3.06Å; L24-A39 PolarHBondContact N-O 2.91Å; L24-A39 PolarHBondContact O-N 3.24Å
40	T	88.7	Confident	89	Confident	79 Å²	79	64.3 Å²	64.3	49%	0.485	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.9	-179.4	-50.2	0	0	0	0	110	A21 I22 E23	A21-T40 HydrophobicContact CB-CG2 3.61Å; I22-T40 CarbonylContact O-C 3.48Å; I22-T40 WeakPolarHBondContact O-CA 3.46Å; E23-T40 HydrophobicContact CG-CG2 3.92Å
41	C	90.4	Very high	89.4	Confident	25 Å²	25	63.9 Å²	63.9	17%	0.169	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	124.6	175.2	176.7	0	0	0	0	109.5	A21 I22 V50 I51	A21-C41 CarbonylContact C-O 3.55Å; A21-C41 WeakPolarHBondContact CA-O 3.32Å; I22-C41 PolarHBondContact N-O 2.67Å; I22-C41 PolarHBondContact O-N 2.8Å; C41-V50 PolarHBondContact SG-O 2.75Å; C41-V50 VanDerWaalsContact SG-O 3.36Å; C41-I51 HydrophobicContact CB-CD1 3.75Å; C41-I51 HydrophobicContact CB-CG1 3.55Å
42	V	89.3	Confident	89.7	Confident	81 Å²	81	62.3 Å²	62.3	49%	0.491	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.8	179.6	-174.1	0	0	0	0	109.8	C20 A21	C20-V42 WeakPolarHBondContact O-CA 3.42Å; A21-V42 HydrophobicContact CB-CG2 4.17Å
43	T	90.7	Very high	89.8	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.031	34%	0.339	C	S	.	.			trans	-70.1	141.2	175.2	57.2	0	0	0	0	112.3	L9 V17 N19 C20 I22 A48 Y49	L9-T43 HydrophobicContact CB-CG2 3.94Å; L9-T43 HydrophobicContact CD2-CG2 4.07Å; V17-T43 WeakPolarHBondContact O-CB 3.18Å; V17-T43 PolarHBondContact O-OG1 3.23Å; N19-T43 PolarHBondContact N-O 3.38Å; N19-T43 PolarHBondContact N-OG1 2.79Å; C20-T43 PolarHBondContact N-OG1 3.42Å; C20-T43 PolarHBondContact O-N 2.83Å; C20-T43 PolarHBondContact O-OG1 3.04Å; I22-T43 HydrophobicContact CD1-CG2 4.18Å; I22-T43 HydrophobicContact CG1-CG2 4.49Å; T43-A48 WeakPolarHBondContact CA-O 3.39Å; T43-Y49 HydrophobicContact CG2-CD1 4.3Å
44	D	91.4	Very high	90	Very high	78 Å²	78	60.3 Å²	60.3	42%	0.417	35%	0.345	S	S	.	.			trans	-76.9	-174	177.7	75.8	4.5	0	0	0	113.3	V18 N46 G47 A48	V18-D44 WeakPolarHBondContact CG1-O 3.44Å; D44-N46 PolarHBondContact O-N 2.98Å; D44-N46 VanDerWaalsContact O-N 3.1Å; D44-N46 VanDerWaalsContact OD1-CA 3.29Å; D44-N46 WeakPolarHBondContact OD1-CA 3.4Å; D44-N46 WeakPolarHBondContact OD1-CB 3.25Å; D44-N46 PolarHBondContact OD1-N 3.36Å; D44-G47 PolarHBondContact O-N 2.88Å; D44-G47 PolarHBondContact OD1-N 3.27Å; D44-G47 VanDerWaalsContact OD1-N 3.11Å; D44-A48 PolarHBondContact N-O 3.48Å; D44-A48 WeakPolarHBondContact OD1-CB 3.31Å; D44-A48 PolarHBondContact OD1-N 3.36Å
45	N	87.2	Confident	90	Very high	147 Å²	147	56.8 Å²	56.8	79%	0.786	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.5	178.4	-71.1	-16.7	0	0	0	114.4	V18	V18-N45 VanDerWaalsContact CG1-C 3.41Å; V18-N45 WeakPolarHBondContact CG1-O 3.47Å
46	N	88.4	Confident	90	Very high	115 Å²	115	56.1 Å²	56.1	62%	0.615	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	7	174.2	-68.6	-14.9	0	0	0	112.1	V8 P16 D44 A48	V8-N46 WeakPolarHBondContact CG1-O 3.34Å; P16-N46 VanDerWaalsContact CB-C 3.42Å; P16-N46 WeakPolarHBondContact CB-O 3.38Å; D44-N46 PolarHBondContact O-N 2.98Å; D44-N46 VanDerWaalsContact O-N 3.1Å; D44-N46 VanDerWaalsContact OD1-CA 3.29Å; D44-N46 WeakPolarHBondContact OD1-CA 3.4Å; D44-N46 WeakPolarHBondContact OD1-CB 3.25Å; D44-N46 PolarHBondContact OD1-N 3.36Å; N46-A48 PolarHBondContact O-N 2.87Å
47	G	88.4	Confident	90.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.3	C	S	.	.			trans	73.1	8.4	-174.5	0	0	0	0	0	113.4	V8 L9 D44	V8-G47 CarbonylContact C-O 3.52Å; V8-G47 WeakPolarHBondContact CA-O 3.18Å; L9-G47 PolarHBondContact N-O 3.13Å; D44-G47 PolarHBondContact O-N 2.88Å; D44-G47 PolarHBondContact OD1-N 3.27Å; D44-G47 VanDerWaalsContact OD1-N 3.11Å
48	A	92.4	Very high	90.3	Very high	32 Å²	32	48.8 Å²	48.8	26%	0.264	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	143.3	-177.2	0	0	0	0	0	111.3	G7 V8 T43 D44 N46	G7-A48 CarbonylContact O-C 3.56Å; G7-A48 VanDerWaalsContact O-CA 3.3Å; G7-A48 WeakPolarHBondContact O-CA 3.49Å; V8-A48 HydrophobicContact CG2-CB 4.3Å; T43-A48 WeakPolarHBondContact CA-O 3.39Å; D44-A48 PolarHBondContact N-O 3.48Å; D44-A48 WeakPolarHBondContact OD1-CB 3.31Å; D44-A48 PolarHBondContact OD1-N 3.36Å; N46-A48 PolarHBondContact O-N 2.87Å
49	Y	93.2	Very high	90.5	Very high	8 Å²	8	47.9 Å²	47.9	3%	0.031	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.7	176.3	61.4	-85.5	0	0	0	110.2	I5 S6 G7 L9 I22 T43 I51 L86	I5-Y49 HydrophobicContact CG2-CE2 4.31Å; S6-Y49 VanDerWaalsContact CA-O 3.25Å; S6-Y49 WeakPolarHBondContact CA-O 3.09Å; S6-Y49 WeakPolarHBondContact CB-O 3.25Å; G7-Y49 PolarHBondContact N-O 2.79Å; G7-Y49 VanDerWaalsContact N-O 3.09Å; G7-Y49 WeakPolarHBondContact O-CD1 3.25Å; G7-Y49 WeakPolarHBondContact O-CE1 3.1Å; G7-Y49 PolarHBondContact O-N 3.1Å; L9-Y49 HydrophobicContact CB-CD1 4.04Å; L9-Y49 HydrophobicContact CB-CE1 3.98Å; I22-Y49 HydrophobicContact CD1-CD1 3.66Å; I22-Y49 HydrophobicContact CD1-CD2 3.64Å; I22-Y49 HydrophobicContact CD1-CE1 4.19Å; I22-Y49 HydrophobicContact CD1-CE2 4.15Å; I22-Y49 HydrophobicContact CD1-CG 3.36Å; T43-Y49 HydrophobicContact CG2-CD1 4.3Å; Y49-I51 HydrophobicContact CD2-CD1 4.38Å; Y49-I51 HydrophobicContact CD2-CG1 4.33Å; Y49-L86 HydrophobicContact CE2-CB 3.8Å; Y49-L86 WeakPolarHBondContact OH-CB 3.48Å; Y49-L86 PolarHBondContact OH-N 2.74Å
50	V	93.5	Very high	90.7	Very high	80 Å²	80	45.5 Å²	45.5	49%	0.485	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	122.7	172.9	177.9	0	0	0	0	107.7	K4 C41	K4-V50 HydrophobicContact CG-CG1 4.3Å; C41-V50 PolarHBondContact SG-O 2.75Å; C41-V50 VanDerWaalsContact SG-O 3.36Å
51	I	92.4	Very high	90.8	Very high	13 Å²	13	42.2 Å²	42.2	7%	0.067	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116	179.4	-47.8	-179.3	0	0	0	107.6	I5 I22 L24 C41 Y49 A53	I5-I51 HydrophobicContact CB-CB 4.39Å; I5-I51 PolarHBondContact N-O 2.98Å; I5-I51 PolarHBondContact O-N 3.09Å; I22-I51 HydrophobicContact CB-CD1 4.06Å; I22-I51 HydrophobicContact CD1-CD1 4.49Å; I22-I51 HydrophobicContact CG2-CD1 3.74Å; L24-I51 HydrophobicContact CD1-CD1 3.49Å; L24-I51 VanDerWaalsContact CD1-CD1 3.49Å; L24-I51 HydrophobicContact CD1-CG2 3.74Å; C41-I51 HydrophobicContact CB-CD1 3.75Å; C41-I51 HydrophobicContact CB-CG1 3.55Å; Y49-I51 HydrophobicContact CD2-CD1 4.38Å; Y49-I51 HydrophobicContact CD2-CG1 4.33Å; I51-A53 HydrophobicContact CG2-CB 4.38Å; I51-A53 PolarHBondContact O-N 2.8Å; I51-A53 VanDerWaalsContact O-N 3.16Å
52	E	91.5	Very high	90.8	Very high	107 Å²	107	42.4 Å²	42.4	50%	0.5	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	88.5	167.8	-61.9	-62	158.5	0	0	107.1	A2 K4	A2-E52 HydrophobicContact CB-CB 3.86Å; K4-E52 WeakPolarHBondContact CB-OE2 3.14Å; K4-E52 WeakPolarHBondContact CD-OE1 3.36Å; K4-E52 WeakPolarHBondContact CG-OE1 3.32Å
53	A	90.4	Very high	90.7	Very high	6 Å²	6	41 Å²	41	5%	0.05	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	116.2	-176.1	0	0	0	0	0	109.8	A2 V3 I5 L24 I51 V77	A2-A53 CarbonylContact C-O 3.57Å; A2-A53 VanDerWaalsContact CA-O 3.31Å; A2-A53 WeakPolarHBondContact CA-O 3.31Å; V3-A53 PolarHBondContact N-O 2.91Å; V3-A53 PolarHBondContact O-N 3.16Å; I5-A53 HydrophobicContact CD1-CB 3.58Å; I5-A53 HydrophobicContact CG1-CB 3.98Å; L24-A53 HydrophobicContact CD2-CB 4.28Å; I51-A53 HydrophobicContact CG2-CB 4.38Å; I51-A53 PolarHBondContact O-N 2.8Å; I51-A53 VanDerWaalsContact O-N 3.16Å; A53-V77 HydrophobicContact CB-CG2 4.44Å
54	E	92.1	Very high	90.4	Very high	58 Å²	58	42.3 Å²	42.3	27%	0.271	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-61.3	150.3	172	-82	-64.2	143.5	0	0	111.2	A2 T32 V33 G56 Y58	A2-E54 HydrophobicContact CB-CG 4.39Å; A2-E54 WeakPolarHBondContact CB-OE1 3.4Å; A2-E54 PolarHBondContact N-OE1 3.25Å; T32-E54 VanDerWaalsContact CB-OE2 3.31Å; T32-E54 WeakPolarHBondContact CB-OE2 3.33Å; T32-E54 WeakPolarHBondContact CG2-OE2 3.32Å; T32-E54 WeakPolarHBondContact OG1-CB 3.39Å; T32-E54 PolarHBondContact OG1-OE2 2.82Å; V33-E54 HydrophobicContact CG2-CB 3.44Å; V33-E54 VanDerWaalsContact CG2-CB 3.44Å; V33-E54 HydrophobicContact CG2-CG 4.16Å; E54-G56 PolarHBondContact O-N 2.79Å; E54-Y58 WeakPolarHBondContact O-CE2 3.47Å; E54-Y58 PolarHBondContact O-OH 3.41Å
55	P	88	Confident	89.4	Confident	19 Å²	19	44.1 Å²	44.1	12%	0.123	24%	0.238	C	C	.	.	S	Bend	trans	-58.5	132.2	-179.6	-25.2	35.3	0	0	0	112.2	M1 S30 V77 P79	M1-P55 WeakPolarHBondContact O-CD 3.41Å; M1-P55 WeakPolarHBondContact O-CG 3.13Å; S30-P55 WeakPolarHBondContact CB-O 3.48Å; S30-P55 PolarHBondContact OG-O 2.89Å; P55-V77 CarbonylContact C-O 3.57Å; P55-V77 WeakPolarHBondContact CA-O 3.32Å; P55-V77 WeakPolarHBondContact CB-O 3.1Å; P55-P79 HydrophobicContact CB-CB 4.32Å; P55-P79 HydrophobicContact CG-CB 3.88Å
56	G	88.8	Confident	88.6	Confident	10 Å²	10	41.2 Å²	41.2	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.9	173.6	-176	0	0	0	0	0	113.9	E54 Y58 V77	E54-G56 PolarHBondContact O-N 2.79Å; G56-Y58 VanDerWaalsContact C-CE2 3.45Å; G56-Y58 WeakPolarHBondContact O-CD2 3.45Å; G56-Y58 VanDerWaalsContact O-CE2 3.26Å; G56-Y58 WeakPolarHBondContact O-CE2 3.12Å; G56-V77 PolarHBondContact N-O 3Å; G56-V77 PolarHBondContact O-N 2.86Å
57	Y	90.2	Very high	87.6	Confident	51 Å²	51	45.2 Å²	45.2	20%	0.2	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	116.5	177.8	-170.1	-109.4	0	0	0	109.8	R27 D74 I75 D76	R27-Y57 HydrophobicContact CB-CD1 3.66Å; R27-Y57 HydrophobicContact CB-CE1 4.19Å; R27-Y57 HydrophobicContact CG-CD1 4.28Å; R27-Y57 HydrophobicContact CG-CE1 4.43Å; R27-Y57 PolarHBondContact N-O 2.88Å; Y57-D74 HydrophobicContact CE1-CB 4.07Å; Y57-D74 HydrophobicContact CE2-CB 4.05Å; Y57-D74 VanDerWaalsContact CZ-CB 3.49Å; Y57-D74 WeakPolarHBondContact OH-CB 3.28Å; Y57-D74 PolarHBondContact OH-OD2 3Å; Y57-I75 WeakPolarHBondContact CD2-O 3.26Å; Y57-D76 HydrophobicContact CD2-CB 4Å
58	Y	92.1	Very high	87	Confident	10 Å²	10	53.1 Å²	53.1	4%	0.039	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	136.6	-172.1	-59.6	-84.4	0	0	0	111.7	L24 R25 A26 V33 E54 G56 D74 I75 V77	L24-Y58 HydrophobicContact CB-CD1 3.83Å; L24-Y58 HydrophobicContact CB-CG 4.06Å; L24-Y58 HydrophobicContact CD2-CD1 4.37Å; L24-Y58 HydrophobicContact CD2-CD2 4.14Å; L24-Y58 HydrophobicContact CD2-CG 3.88Å; R25-Y58 CarbonylContact O-C 3.58Å; R25-Y58 WeakPolarHBondContact O-CA 3.13Å; A26-Y58 HydrophobicContact CB-CD1 4.06Å; A26-Y58 HydrophobicContact CB-CE1 3.9Å; V33-Y58 HydrophobicContact CG1-CE1 4.22Å; V33-Y58 VanDerWaalsContact CG2-OH 3.28Å; V33-Y58 WeakPolarHBondContact CG2-OH 3.36Å; E54-Y58 WeakPolarHBondContact O-CE2 3.47Å; E54-Y58 PolarHBondContact O-OH 3.41Å; G56-Y58 VanDerWaalsContact C-CE2 3.45Å; G56-Y58 WeakPolarHBondContact O-CD2 3.45Å; G56-Y58 VanDerWaalsContact O-CE2 3.26Å; G56-Y58 WeakPolarHBondContact O-CE2 3.12Å; Y58-D74 CarbonylContact O-C 3.49Å; Y58-D74 WeakPolarHBondContact O-CA 3.45Å; Y58-I75 HydrophobicContact CD2-CG1 4.47Å; Y58-I75 PolarHBondContact N-O 2.89Å; Y58-I75 PolarHBondContact O-N 3.4Å; Y58-V77 HydrophobicContact CD2-CG2 4.06Å; Y58-V77 HydrophobicContact CE2-CB 4.38Å; Y58-V77 HydrophobicContact CE2-CG2 4.21Å
59	E	92.5	Very high	86.3	Confident	31 Å²	31	54.5 Å²	54.5	15%	0.145	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124.3	160.8	174.5	179.9	177.8	0	0	108.3	R25 R27 R71	R25-E59 HydrophobicContact CB-CB 4.39Å; R25-E59 PolarHBondContact N-O 3.46Å; R25-E59 PolarHBondContact O-N 2.96Å; R27-E59 WeakPolarHBondContact CD-OE2 3.45Å; R27-E59 HydrophobicContact CG-CB 3.62Å; R27-E59 IonicContact CZ-OE2 2.95Å; R27-E59 IonicContact NE-OE2 2.89Å; R27-E59 IonicContact NH1-OE2 3.64Å; R27-E59 PolarHBondContact NH1-OE2 3.4Å; E59-R71 HydrophobicContact CG-CG 3.92Å; E59-R71 WeakPolarHBondContact OE1-CD 3.48Å; E59-R71 WeakPolarHBondContact OE1-CG 3.17Å; E59-R71 IonicContact OE1-NE 3.44Å; E59-R71 PolarHBondContact OE1-NE 3.2Å
60	V	92.9	Very high	86	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126.1	179.8	-173.5	0	0	0	0	109.5	I22 E23 V72 G73 I75 L86 L90	I22-V60 HydrophobicContact CG2-CG1 4.24Å; E23-V60 CarbonylContact O-C 3.58Å; E23-V60 VanDerWaalsContact O-CA 3.25Å; E23-V60 WeakPolarHBondContact O-CA 3.06Å; V60-V72 HydrophobicContact CB-CG2 3.78Å; V60-V72 HydrophobicContact CG1-CG2 3.49Å; V60-V72 VanDerWaalsContact CG1-CG2 3.49Å; V60-V72 WeakPolarHBondContact O-CG2 3.41Å; V60-V72 PolarHBondContact O-N 2.93Å; V60-G73 PolarHBondContact N-O 3.33Å; V60-G73 PolarHBondContact O-N 3.41Å; V60-I75 HydrophobicContact CG2-CB 4.43Å; V60-I75 HydrophobicContact CG2-CD1 3.99Å; V60-I75 HydrophobicContact CG2-CG1 3.84Å; V60-I75 HydrophobicContact CG2-CG2 3.89Å; V60-L86 HydrophobicContact CG1-CD1 4.05Å; V60-L86 HydrophobicContact CG1-CD2 4.05Å; V60-L86 HydrophobicContact CG1-CG 4.5Å; V60-L86 HydrophobicContact CG2-CD1 4.22Å; V60-L90 HydrophobicContact CB-CD2 4.44Å; V60-L90 HydrophobicContact CG2-CD2 4.35Å
61	A	91.7	Very high	85.8	Confident	10 Å²	10	60.9 Å²	60.9	8%	0.083	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.8	173.5	0	0	0	0	0	111.2	E23 P69 T70	E23-A61 HydrophobicContact CB-CB 4.35Å; E23-A61 PolarHBondContact N-O 3.27Å; E23-A61 PolarHBondContact O-N 2.92Å; A61-P69 HydrophobicContact CB-CB 4.31Å; A61-T70 CarbonylContact C-O 3.58Å; A61-T70 VanDerWaalsContact CA-O 3.31Å; A61-T70 WeakPolarHBondContact CA-O 3.09Å
62	L	90.4	Very high	85.6	Confident	29 Å²	29	63.3 Å²	63.3	15%	0.152	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	130.6	177.8	-62.3	-177.1	0	0	0	110.6	L9 A21 I22 T70 V72	L9-L62 HydrophobicContact CD1-CD1 4.46Å; L9-L62 HydrophobicContact CD2-CD1 4.32Å; L9-L62 HydrophobicContact CD2-CD2 4.23Å; A21-L62 CarbonylContact O-C 3.56Å; A21-L62 WeakPolarHBondContact O-CA 3.3Å; I22-L62 HydrophobicContact CB-CD2 4.14Å; I22-L62 HydrophobicContact CG1-CD2 3.72Å; I22-L62 HydrophobicContact CG2-CD2 4.12Å; L62-T70 PolarHBondContact N-O 3.28Å; L62-T70 PolarHBondContact O-N 2.76Å; L62-V72 HydrophobicContact CB-CG1 4.35Å; L62-V72 HydrophobicContact CD1-CG1 3.62Å; L62-V72 HydrophobicContact CG-CG1 3.71Å; L62-V72 HydrophobicContact CG-CG2 4.18Å
63	H	87.5	Confident	85.5	Confident	52 Å²	52	59.1 Å²	59.1	24%	0.241	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	86.5	174.8	-82.7	128.7	0	0	0	109.6	C20 A21 E23 P69	C20-H63 CarbonylContact C-O 3.56Å; C20-H63 WeakPolarHBondContact CA-O 3.34Å; C20-H63 PolarHBondContact SG-O 2.94Å; A21-H63 HydrophobicContact CB-CB 3.7Å; A21-H63 PolarHBondContact N-O 3.11Å; A21-H63 PolarHBondContact O-N 3.44Å; E23-H63 IonicContact OE1-CE1 3.04Å; E23-H63 PolarHBondContact OE1-CE1 2.92Å; E23-H63 IonicContact OE1-ND1 2.98Å; E23-H63 PolarHBondContact OE1-ND1 2.7Å; E23-H63 IonicContact OE2-CE1 3.42Å; E23-H63 PolarHBondContact OE2-CE1 2.81Å; E23-H63 IonicContact OE2-ND1 3.62Å; H63-P69 WeakPolarHBondContact CD2-CA 3.38Å; H63-P69 VanDerWaalsContact CD2-N 3.34Å; H63-P69 VanDerWaalsContact CE1-CB 3.43Å; H63-P69 WeakPolarHBondContact CE1-CB 3.47Å; H63-P69 WeakPolarHBondContact NE2-CA 3.47Å; H63-P69 WeakPolarHBondContact NE2-CB 3.27Å; H63-P69 WeakPolarHBondContact NE2-CD 3.46Å; H63-P69 WeakPolarHBondContact NE2-CG 3.36Å
64	C	82.6	Confident	85.4	Confident	32 Å²	32	59.6 Å²	59.6	22%	0.216	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	138.4	-179.6	-50.6	0	0	0	0	110.8	V17 C20 G66 W67	V17-C64 HydrophobicContact CG1-CB 4.29Å; C20-C64 HydrophobicContact CB-CB 3.73Å; C20-C64 WeakPolarHBondContact CB-SG 3.28Å; C20-C64 WeakPolarHBondContact SG-CA 3.37Å; C20-C64 WeakPolarHBondContact SG-CB 3.49Å; C20-C64 PolarHBondContact SG-N 2.81Å; C20-C64 VanDerWaalsContact SG-N 3.41Å; C20-C64 CovalentContact SG-SG 2.05Å; C20-C64 PolarHBondContact SG-SG 3.16Å; C64-G66 VanDerWaalsContact C-N 3.31Å; C64-G66 PolarHBondContact O-N 2.76Å; C64-G66 VanDerWaalsContact O-N 3.16Å; C64-W67 VanDerWaalsContact O-CD1 3.26Å; C64-W67 PolarHBondContact O-N 3.21Å
65	N	72.3	Confident	85.4	Confident	116 Å²	116	56.8 Å²	56.8	62%	0.62	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	33.7	167.8	-61.6	-31.9	0	0	0	116.4	W67	N65-W67 VanDerWaalsContact C-N 3.31Å; N65-W67 PolarHBondContact O-N 3.42Å
66	G	68.8	Low	85.4	Confident	87 Å²	87	59.7 Å²	59.7	90%	0.897	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	8.5	176.4	0	0	0	0	0	115.6	C64	C64-G66 VanDerWaalsContact C-N 3.31Å; C64-G66 PolarHBondContact O-N 2.76Å; C64-G66 VanDerWaalsContact O-N 3.16Å
67	W	68.8	Low	85.3	Confident	198 Å²	198	59.2 Å²	59.2	75%	0.75	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-81.2	160.1	173.9	-63.2	84	0	0	0	111.8	C64 N65	C64-W67 VanDerWaalsContact O-CD1 3.26Å; C64-W67 PolarHBondContact O-N 3.21Å; N65-W67 VanDerWaalsContact C-N 3.31Å; N65-W67 PolarHBondContact O-N 3.42Å
68	Q	75.8	Confident	85.1	Confident	166 Å²	166	58.4 Å²	58.4	78%	0.776	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-57	150	173.1	-71.6	-95.6	-28.8	0	0	111.5	T70	Q68-T70 PolarHBondContact O-N 3.16Å
69	P	77.6	Confident	84.6	Confident	62 Å²	62	62.4 Å²	62.4	40%	0.403	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-60	123.7	-177.1	11	-14.7	0	0	0	111	A61 H63	A61-P69 HydrophobicContact CB-CB 4.31Å; H63-P69 WeakPolarHBondContact CD2-CA 3.38Å; H63-P69 VanDerWaalsContact CD2-N 3.34Å; H63-P69 VanDerWaalsContact CE1-CB 3.43Å; H63-P69 WeakPolarHBondContact CE1-CB 3.47Å; H63-P69 WeakPolarHBondContact NE2-CA 3.47Å; H63-P69 WeakPolarHBondContact NE2-CB 3.27Å; H63-P69 WeakPolarHBondContact NE2-CD 3.46Å; H63-P69 WeakPolarHBondContact NE2-CG 3.36Å
70	T	85.6	Confident	84.1	Confident	88 Å²	88	67 Å²	67	54%	0.54	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.4	175.2	-55.3	0	0	0	0	109.4	A61 L62 Q68 V72	A61-T70 CarbonylContact C-O 3.58Å; A61-T70 VanDerWaalsContact CA-O 3.31Å; A61-T70 WeakPolarHBondContact CA-O 3.09Å; L62-T70 PolarHBondContact N-O 3.28Å; L62-T70 PolarHBondContact O-N 2.76Å; Q68-T70 PolarHBondContact O-N 3.16Å; T70-V72 PolarHBondContact O-N 2.88Å
71	R	89.3	Confident	83.6	Confident	134 Å²	134	69.8 Å²	69.8	51%	0.506	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	123	174.2	-174.5	-172.6	177.1	-126	-0.3	110	E59 D74	E59-R71 HydrophobicContact CG-CG 3.92Å; E59-R71 WeakPolarHBondContact OE1-CD 3.48Å; E59-R71 WeakPolarHBondContact OE1-CG 3.17Å; E59-R71 IonicContact OE1-NE 3.44Å; E59-R71 PolarHBondContact OE1-NE 3.2Å; R71-D74 IonicContact CZ-OD1 3.53Å; R71-D74 IonicContact NE-OD1 3.52Å; R71-D74 IonicContact NH2-OD1 3.39Å; R71-D74 PolarHBondContact NH2-OD1 3.2Å; R71-D74 IonicContact NH2-OD2 3.97Å; R71-D74 PolarHBondContact NH2-OD2 3.47Å
72	V	90	Very high	83.4	Confident	64 Å²	64	73 Å²	73	39%	0.388	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-19.8	-179	-67.2	0	0	0	0	113.8	V60 L62 T70 L90	V60-V72 HydrophobicContact CB-CG2 3.78Å; V60-V72 HydrophobicContact CG1-CG2 3.49Å; V60-V72 VanDerWaalsContact CG1-CG2 3.49Å; V60-V72 WeakPolarHBondContact O-CG2 3.41Å; V60-V72 PolarHBondContact O-N 2.93Å; L62-V72 HydrophobicContact CB-CG1 4.35Å; L62-V72 HydrophobicContact CD1-CG1 3.62Å; L62-V72 HydrophobicContact CG-CG1 3.71Å; L62-V72 HydrophobicContact CG-CG2 4.18Å; T70-V72 PolarHBondContact O-N 2.88Å; V72-L90 HydrophobicContact CG2-CD1 4.2Å
73	G	88.7	Confident	83.3	Confident	18 Å²	18	76.1 Å²	76.1	19%	0.186	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.3	-175.3	175.9	0	0	0	0	0	111.9	V60	V60-G73 PolarHBondContact N-O 3.33Å; V60-G73 PolarHBondContact O-N 3.41Å
74	D	88.9	Confident	83.4	Confident	16 Å²	16	74.6 Å²	74.6	9%	0.086	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	143	172.4	-55.9	-21.6	0	0	0	109.2	Y57 Y58 R71 K94	Y57-D74 HydrophobicContact CE1-CB 4.07Å; Y57-D74 HydrophobicContact CE2-CB 4.05Å; Y57-D74 VanDerWaalsContact CZ-CB 3.49Å; Y57-D74 WeakPolarHBondContact OH-CB 3.28Å; Y57-D74 PolarHBondContact OH-OD2 3Å; Y58-D74 CarbonylContact O-C 3.49Å; Y58-D74 WeakPolarHBondContact O-CA 3.45Å; R71-D74 IonicContact CZ-OD1 3.53Å; R71-D74 IonicContact NE-OD1 3.52Å; R71-D74 IonicContact NH2-OD1 3.39Å; R71-D74 PolarHBondContact NH2-OD1 3.2Å; R71-D74 IonicContact NH2-OD2 3.97Å; R71-D74 PolarHBondContact NH2-OD2 3.47Å; D74-K94 WeakPolarHBondContact O-CE 3.37Å; D74-K94 PolarHBondContact O-NZ 3.43Å
75	I	90.4	Very high	83.9	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	146.4	173.6	66	174.5	0	0	0	109.9	I5 L24 Y57 Y58 V60 V77 L86 F89 L90	I5-I75 HydrophobicContact CD1-CD1 3.66Å; L24-I75 HydrophobicContact CD2-CD1 3.61Å; L24-I75 HydrophobicContact CD2-CG1 4.4Å; Y57-I75 WeakPolarHBondContact CD2-O 3.26Å; Y58-I75 HydrophobicContact CD2-CG1 4.47Å; Y58-I75 PolarHBondContact N-O 2.89Å; Y58-I75 PolarHBondContact O-N 3.4Å; V60-I75 HydrophobicContact CG2-CB 4.43Å; V60-I75 HydrophobicContact CG2-CD1 3.99Å; V60-I75 HydrophobicContact CG2-CG1 3.84Å; V60-I75 HydrophobicContact CG2-CG2 3.89Å; I75-V77 HydrophobicContact CD1-CG2 3.86Å; I75-V77 HydrophobicContact CG1-CG2 4.17Å; I75-L86 HydrophobicContact CD1-CD1 4.29Å; I75-F89 HydrophobicContact CB-CB 4.03Å; I75-F89 HydrophobicContact CD1-CB 4.22Å; I75-F89 HydrophobicContact CG2-CB 3.76Å; I75-L90 HydrophobicContact CG2-CB 4.39Å; I75-L90 HydrophobicContact CG2-CD2 3.53Å; I75-L90 HydrophobicContact CG2-CG 3.7Å
76	D	88.1	Confident	84.7	Confident	79 Å²	79	70.7 Å²	70.7	42%	0.422	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.7	164.5	-151.1	-28.7	0	0	0	107.8	Y57	Y57-D76 HydrophobicContact CD2-CB 4Å
77	V	88.2	Confident	85.7	Confident	1 Å²	1	71 Å²	71	1%	0.006	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	100.3	179.4	-176.8	0	0	0	0	106.7	V3 I5 A53 P55 G56 Y58 I75 F89	V3-V77 HydrophobicContact CB-CG1 3.66Å; V3-V77 HydrophobicContact CG1-CG1 4.44Å; V3-V77 HydrophobicContact CG2-CG1 3.71Å; I5-V77 HydrophobicContact CD1-CG2 4.02Å; A53-V77 HydrophobicContact CB-CG2 4.44Å; P55-V77 CarbonylContact C-O 3.57Å; P55-V77 WeakPolarHBondContact CA-O 3.32Å; P55-V77 WeakPolarHBondContact CB-O 3.1Å; G56-V77 PolarHBondContact N-O 3Å; G56-V77 PolarHBondContact O-N 2.86Å; Y58-V77 HydrophobicContact CD2-CG2 4.06Å; Y58-V77 HydrophobicContact CE2-CB 4.38Å; Y58-V77 HydrophobicContact CE2-CG2 4.21Å; I75-V77 HydrophobicContact CD1-CG2 3.86Å; I75-V77 HydrophobicContact CG1-CG2 4.17Å; V77-F89 HydrophobicContact CG1-CE1 4.36Å; V77-F89 HydrophobicContact CG2-CD1 4.19Å; V77-F89 HydrophobicContact CG2-CE1 4.25Å
78	A	84.6	Confident	86.6	Confident	33 Å²	33	64 Å²	64	27%	0.273	38%	0.384	S	S	.	.			trans	-80.6	148.3	174.3	0	0	0	0	0	110.1	V3 T80 D81	V3-A78 WeakPolarHBondContact CG2-O 3.3Å; A78-T80 PolarHBondContact O-N 2.82Å; A78-D81 PolarHBondContact N-OD2 2.95Å; A78-D81 WeakPolarHBondContact O-CB 3.21Å; A78-D81 PolarHBondContact O-N 2.73Å
79	P	81.2	Confident	87.3	Confident	94 Å²	94	56.7 Å²	56.7	61%	0.61	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.5	178.5	24.3	-31.6	0	0	0	113.9	P55	P55-P79 HydrophobicContact CB-CB 4.32Å; P55-P79 HydrophobicContact CG-CB 3.88Å
80	T	81.8	Confident	87.7	Confident	128 Å²	128	55.9 Å²	55.9	79%	0.785	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-3.7	176.6	50.7	0	0	0	0	113.8	A78	A78-T80 PolarHBondContact O-N 2.82Å
81	D	84.2	Confident	87.7	Confident	59 Å²	59	58.2 Å²	58.2	32%	0.316	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-66.5	137.8	-179.3	-72.8	-22.6	0	0	0	110.9	V3 A78 F89	V3-D81 HydrophobicContact CG1-CB 4.3Å; V3-D81 HydrophobicContact CG2-CB 4.48Å; A78-D81 PolarHBondContact N-OD2 2.95Å; A78-D81 WeakPolarHBondContact O-CB 3.21Å; A78-D81 PolarHBondContact O-N 2.73Å; D81-F89 HydrophobicContact CB-CE1 3.94Å; D81-F89 HydrophobicContact CB-CZ 4.13Å
82	A	86	Confident	87.1	Confident	76 Å²	76	53.9 Å²	53.9	63%	0.628	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-71	146	173.5	0	0	0	0	0	110.4	G84	A82-G84 PolarHBondContact O-N 2.83Å
83	P	89.6	Confident	85.9	Confident	96 Å²	96	55.9 Å²	55.9	62%	0.623	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-50.2	136.8	170.1	-28.8	36.2	0	0	0	112.1	K4	K4-P83 HydrophobicContact CB-CB 4.18Å; K4-P83 HydrophobicContact CB-CG 4.47Å; K4-P83 VanDerWaalsContact O-CA 3.28Å; K4-P83 WeakPolarHBondContact O-CA 3.13Å; K4-P83 WeakPolarHBondContact O-CB 3.47Å
84	G	89.7	Confident	84.7	Confident	20 Å²	20	58.5 Å²	58.5	21%	0.206	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-157.9	175	-170.9	0	0	0	0	0	113.7	K4 I5 S6 A82	K4-G84 PolarHBondContact O-N 2.9Å; K4-G84 VanDerWaalsContact O-N 3.16Å; I5-G84 CarbonylContact C-O 3.57Å; I5-G84 VanDerWaalsContact CA-O 3.3Å; I5-G84 WeakPolarHBondContact CA-O 3.31Å; S6-G84 PolarHBondContact N-O 2.58Å; A82-G84 PolarHBondContact O-N 2.83Å
85	T	92.2	Very high	83.3	Confident	63 Å²	63	64.4 Å²	64.4	39%	0.387	40%	0.396	S	S	.	.			trans	-79	151.4	173	65.5	0	0	0	0	110.1	S6 N87 A88 F89	S6-T85 WeakPolarHBondContact O-CA 3.42Å; T85-N87 PolarHBondContact O-N 3.07Å; T85-N87 VanDerWaalsContact O-N 3.13Å; T85-A88 WeakPolarHBondContact O-CA 3.49Å; T85-A88 VanDerWaalsContact O-CB 3.32Å; T85-A88 WeakPolarHBondContact O-CB 3.31Å; T85-A88 PolarHBondContact O-N 2.79Å; T85-A88 PolarHBondContact OG1-N 3.33Å; T85-F89 WeakPolarHBondContact O-CD2 3.4Å; T85-F89 PolarHBondContact O-N 2.81Å
86	L	90.2	Very high	81.9	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.01	43%	0.431	C	S	.	.	H	α-helix	trans	-50.3	-39.1	173.1	-175.7	63.1	0	0	0	112.2	I5 I22 Y49 V60 I75 A88 F89 L90	I5-L86 HydrophobicContact CG2-CB 4.02Å; I5-L86 HydrophobicContact CG2-CD1 4.22Å; I22-L86 HydrophobicContact CD1-CD2 4.29Å; I22-L86 HydrophobicContact CG2-CD2 3.79Å; Y49-L86 HydrophobicContact CE2-CB 3.8Å; Y49-L86 WeakPolarHBondContact OH-CB 3.48Å; Y49-L86 PolarHBondContact OH-N 2.74Å; V60-L86 HydrophobicContact CG1-CD1 4.05Å; V60-L86 HydrophobicContact CG1-CD2 4.05Å; V60-L86 HydrophobicContact CG1-CG 4.5Å; V60-L86 HydrophobicContact CG2-CD1 4.22Å; I75-L86 HydrophobicContact CD1-CD1 4.29Å; L86-A88 VanDerWaalsContact C-N 3.31Å; L86-A88 PolarHBondContact O-N 3.22Å; L86-F89 PolarHBondContact O-N 3.07Å; L86-L90 HydrophobicContact CD2-CD1 4.47Å; L86-L90 HydrophobicContact CG-CD1 3.94Å; L86-L90 HydrophobicContact CG-CG 4.47Å; L86-L90 WeakPolarHBondContact O-CG 3.31Å; L86-L90 PolarHBondContact O-N 2.85Å
87	N	90	Very high	80.6	Confident	93 Å²	93	69.3 Å²	69.3	50%	0.497	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-36.6	176.8	-68.4	17.1	0	0	0	112.6	T85 L90 N91	T85-N87 PolarHBondContact O-N 3.07Å; T85-N87 VanDerWaalsContact O-N 3.13Å; N87-L90 PolarHBondContact O-N 2.77Å; N87-N91 WeakPolarHBondContact O-CB 3.41Å; N87-N91 PolarHBondContact O-N 3.01Å
88	A	87.4	Confident	79.2	Confident	51 Å²	51	74.9 Å²	74.9	42%	0.421	47%	0.468	S	S	.	.	H	α-helix	trans	-64.6	-42.2	177.1	0	0	0	0	0	111.1	T85 L86 N91 A92	T85-A88 WeakPolarHBondContact O-CA 3.49Å; T85-A88 VanDerWaalsContact O-CB 3.32Å; T85-A88 WeakPolarHBondContact O-CB 3.31Å; T85-A88 PolarHBondContact O-N 2.79Å; T85-A88 PolarHBondContact OG1-N 3.33Å; L86-A88 VanDerWaalsContact C-N 3.31Å; L86-A88 PolarHBondContact O-N 3.22Å; A88-N91 PolarHBondContact O-N 3.06Å; A88-A92 PolarHBondContact O-N 2.85Å
89	F	89.1	Confident	78	Confident	14 Å²	14	81.4 Å²	81.4	6%	0.061	49%	0.486	C	S	.	.	H	α-helix	trans	-68	-38.5	175.2	-77.4	-87.2	0	0	0	112.6	V3 I5 I75 V77 D81 T85 L86 N91 A92	V3-F89 HydrophobicContact CG1-CZ 3.8Å; I5-F89 HydrophobicContact CD1-CD2 4.09Å; I5-F89 HydrophobicContact CD1-CE2 4.27Å; I5-F89 HydrophobicContact CD1-CG 4.25Å; I5-F89 HydrophobicContact CG1-CD2 4.01Å; I5-F89 HydrophobicContact CG1-CE2 3.81Å; I5-F89 HydrophobicContact CG1-CZ 4.26Å; I5-F89 HydrophobicContact CG2-CD2 4.2Å; I75-F89 HydrophobicContact CB-CB 4.03Å; I75-F89 HydrophobicContact CD1-CB 4.22Å; I75-F89 HydrophobicContact CG2-CB 3.76Å; V77-F89 HydrophobicContact CG1-CE1 4.36Å; V77-F89 HydrophobicContact CG2-CD1 4.19Å; V77-F89 HydrophobicContact CG2-CE1 4.25Å; D81-F89 HydrophobicContact CB-CE1 3.94Å; D81-F89 HydrophobicContact CB-CZ 4.13Å; T85-F89 WeakPolarHBondContact O-CD2 3.4Å; T85-F89 PolarHBondContact O-N 2.81Å; L86-F89 PolarHBondContact O-N 3.07Å; F89-N91 VanDerWaalsContact C-N 3.3Å; F89-N91 PolarHBondContact O-N 2.97Å; F89-A92 PolarHBondContact O-N 3.3Å
90	L	87.6	Confident	77.2	Confident	44 Å²	44	82.1 Å²	82.1	23%	0.23	49%	0.49	C	S	.	.	H	α-helix	trans	-68	-29	176.2	-75.3	167.9	0	0	0	113	V60 V72 I75 L86 N87	V60-L90 HydrophobicContact CB-CD2 4.44Å; V60-L90 HydrophobicContact CG2-CD2 4.35Å; V72-L90 HydrophobicContact CG2-CD1 4.2Å; I75-L90 HydrophobicContact CG2-CB 4.39Å; I75-L90 HydrophobicContact CG2-CD2 3.53Å; I75-L90 HydrophobicContact CG2-CG 3.7Å; L86-L90 HydrophobicContact CD2-CD1 4.47Å; L86-L90 HydrophobicContact CG-CD1 3.94Å; L86-L90 HydrophobicContact CG-CG 4.47Å; L86-L90 WeakPolarHBondContact O-CG 3.31Å; L86-L90 PolarHBondContact O-N 2.85Å; N87-L90 PolarHBondContact O-N 2.77Å
91	N	84	Confident	76.5	Confident	137 Å²	137	82.8 Å²	82.8	73%	0.733	49%	0.485	S	S	*	.	H	α-helix	trans	-93.2	-5.7	177.5	-77.7	-20.8	0	0	0	114	N87 A88 F89	N87-N91 WeakPolarHBondContact O-CB 3.41Å; N87-N91 PolarHBondContact O-N 3.01Å; A88-N91 PolarHBondContact O-N 3.06Å; F89-N91 VanDerWaalsContact C-N 3.3Å; F89-N91 PolarHBondContact O-N 2.97Å
92	A	77	Confident	75.7	Confident	44 Å²	44	84.9 Å²	84.9	36%	0.364	50%	0.499	S	S	.	.	S	Bend	trans	-65	133.9	-178.6	0	0	0	0	0	110.3	A88 F89 K94	A88-A92 PolarHBondContact O-N 2.85Å; F89-A92 PolarHBondContact O-N 3.3Å; A92-K94 PolarHBondContact O-N 2.76Å
93	P	65.6	Low	74.8	Confident	105 Å²	105	86.2 Å²	86.2	68%	0.682	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-62.9	134.7	173.8	19.1	-22	0	0	0	109.8	D97	P93-D97 HydrophobicContact CB-CB 4.49Å
94	K	63.8	Low	74	Confident	74 Å²	74	87.9 Å²	87.9	32%	0.322	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-91.5	157.2	-175	-62.5	173	-178.7	-174.2	0	109.2	D74 A92 G96 D97	D74-K94 WeakPolarHBondContact O-CE 3.37Å; D74-K94 PolarHBondContact O-NZ 3.43Å; A92-K94 PolarHBondContact O-N 2.76Å; K94-G96 PolarHBondContact O-N 3.41Å; K94-D97 PolarHBondContact N-OD2 2.98Å; K94-D97 WeakPolarHBondContact O-CA 3.16Å; K94-D97 VanDerWaalsContact O-CB 3.31Å; K94-D97 WeakPolarHBondContact O-CB 3.47Å; K94-D97 PolarHBondContact O-N 3.11Å
95	D	59.2	Low	73.4	Confident	140 Å²	140	95.8 Å²	95.8	75%	0.749	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-26.4	174.6	-83.7	-17.9	0	0	0	112.9	D97 L98	D95-D97 VanDerWaalsContact C-N 3.3Å; D95-D97 PolarHBondContact O-N 3.29Å; D95-L98 PolarHBondContact O-N 3.44Å
96	G	61	Low	72.6	Confident	70 Å²	70	99 Å²	99	72%	0.722	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.2	172.3	0	0	0	0	0	115.4	K94	K94-G96 PolarHBondContact O-N 3.41Å
97	D	60.3	Low	72	Confident	111 Å²	111	104.9 Å²	104.9	59%	0.594	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-25.9	177.2	-60.6	-35.5	0	0	0	111.5	P93 K94 D95 R99	P93-D97 HydrophobicContact CB-CB 4.49Å; K94-D97 PolarHBondContact N-OD2 2.98Å; K94-D97 WeakPolarHBondContact O-CA 3.16Å; K94-D97 VanDerWaalsContact O-CB 3.31Å; K94-D97 WeakPolarHBondContact O-CB 3.47Å; K94-D97 PolarHBondContact O-N 3.11Å; D95-D97 VanDerWaalsContact C-N 3.3Å; D95-D97 PolarHBondContact O-N 3.29Å; D97-R99 PolarHBondContact O-N 2.76Å
98	L	58.5	Low	71.6	Confident	118 Å²	118	105.7 Å²	105.7	62%	0.618	55%	0.552	S	S	*	*	S	Bend	trans	-87.9	85.4	176.9	-64.2	171.5	0	0	0	110.3	D95 P100	D95-L98 PolarHBondContact O-N 3.44Å; L98-P100 WeakPolarHBondContact O-CD 3.44Å
99	R	59.6	Low	71.2	Confident	171 Å²	171	109 Å²	109	65%	0.645	56%	0.56	S	S	*	*			trans	-59.8	127.1	175.7	-75.1	-174.4	-159	173.4	7.3	111	D97 E101 V102	D97-R99 PolarHBondContact O-N 2.76Å; R99-E101 PolarHBondContact O-N 3.06Å; R99-V102 HydrophobicContact CB-CG2 4.43Å; R99-V102 PolarHBondContact O-N 3.45Å; R99-V102 VanDerWaalsContact O-N 3.1Å
100	P	63.6	Low	71	Confident	108 Å²	108	111.4 Å²	111.4	70%	0.701	58%	0.576	S	S	*	*	H	α-helix	trans	-54.5	-30.2	177.6	-26	32.7	0	0	0	114.1	L98 V102 M103 K104	L98-P100 WeakPolarHBondContact O-CD 3.44Å; P100-V102 VanDerWaalsContact C-N 3.33Å; P100-V102 PolarHBondContact O-N 3.1Å; P100-M103 PolarHBondContact O-N 3.41Å; P100-K104 PolarHBondContact O-N 3.24Å; P100-K104 VanDerWaalsContact O-N 3.07Å
101	E	67.8	Low	70.8	Confident	143 Å²	143	111.9 Å²	111.9	67%	0.668	59%	0.586	S	S	*	*	H	α-helix	trans	-64.6	-32.6	-178.9	-66	168.6	166.8	0	0	113.2	R99 R105	R99-E101 PolarHBondContact O-N 3.06Å; E101-R105 WeakPolarHBondContact O-CB 3.38Å; E101-R105 PolarHBondContact O-N 3.08Å
102	V	67.9	Low	70.9	Confident	103 Å²	103	111.5 Å²	111.5	62%	0.624	58%	0.58	S	S	*	*	H	α-helix	trans	-73.1	-41.9	179.4	179.1	0	0	0	0	110.4	R99 P100 R105 F106	R99-V102 HydrophobicContact CB-CG2 4.43Å; R99-V102 PolarHBondContact O-N 3.45Å; R99-V102 VanDerWaalsContact O-N 3.1Å; P100-V102 VanDerWaalsContact C-N 3.33Å; P100-V102 PolarHBondContact O-N 3.1Å; V102-R105 PolarHBondContact O-N 3.38Å; V102-F106 PolarHBondContact O-N 3.41Å; V102-F106 VanDerWaalsContact O-N 3.08Å
103	M	66.7	Low	71.3	Confident	104 Å²	104	112.3 Å²	112.3	51%	0.512	59%	0.586	S	S	.	*	H	α-helix	trans	-66.7	-43.8	178.1	-78.5	-56.4	-63.1	0	0	112.3	P100 R105 F106 E107	P100-M103 PolarHBondContact O-N 3.41Å; M103-R105 VanDerWaalsContact C-N 3.27Å; M103-R105 PolarHBondContact O-N 3Å; M103-F106 WeakPolarHBondContact O-CB 3.46Å; M103-F106 PolarHBondContact O-N 3.07Å; M103-F106 VanDerWaalsContact O-N 3.1Å; M103-E107 PolarHBondContact O-N 3.1Å
104	K	72.8	Confident	72.4	Confident	131 Å²	131	113.9 Å²	113.9	57%	0.57	59%	0.585	S	S	*	*	H	α-helix	trans	-57.9	-41.8	175.4	-174	177.6	177.4	-177.4	0	111.9	P100 F106 E107 E108	P100-K104 PolarHBondContact O-N 3.24Å; P100-K104 VanDerWaalsContact O-N 3.07Å; K104-F106 VanDerWaalsContact C-N 3.3Å; K104-F106 PolarHBondContact O-N 3.43Å; K104-E107 PolarHBondContact O-N 2.96Å; K104-E108 VanDerWaalsContact CE-OE1 3.29Å; K104-E108 WeakPolarHBondContact CE-OE1 3.42Å; K104-E108 WeakPolarHBondContact O-CG 3.46Å; K104-E108 PolarHBondContact O-N 3.19Å
105	R	76.5	Confident	73.5	Confident	186 Å²	186	117.3 Å²	117.3	70%	0.702	60%	0.602	S	S	*	*	H	α-helix	trans	-68.4	-30.2	179	-153.2	165.2	-173.5	161.2	-0.1	112.6	E101 V102 M103 M109	E101-R105 WeakPolarHBondContact O-CB 3.38Å; E101-R105 PolarHBondContact O-N 3.08Å; V102-R105 PolarHBondContact O-N 3.38Å; M103-R105 VanDerWaalsContact C-N 3.27Å; M103-R105 PolarHBondContact O-N 3Å; R105-M109 WeakPolarHBondContact O-CB 3.49Å; R105-M109 PolarHBondContact O-N 3.27Å; R105-M109 VanDerWaalsContact O-N 3.16Å
106	F	75.7	Confident	75	Confident	129 Å²	129	114 Å²	114	57%	0.566	59%	0.59	S	S	*	*	H	α-helix	trans	-72	-43.9	174.6	-168.1	-98.7	0	0	0	111.7	V102 M103 K104 M109 V110	V102-F106 PolarHBondContact O-N 3.41Å; V102-F106 VanDerWaalsContact O-N 3.08Å; M103-F106 WeakPolarHBondContact O-CB 3.46Å; M103-F106 PolarHBondContact O-N 3.07Å; M103-F106 VanDerWaalsContact O-N 3.1Å; K104-F106 VanDerWaalsContact C-N 3.3Å; K104-F106 PolarHBondContact O-N 3.43Å; F106-M109 WeakPolarHBondContact O-CB 3.49Å; F106-M109 PolarHBondContact O-N 3Å; F106-V110 HydrophobicContact CD1-CG2 4.33Å; F106-V110 HydrophobicContact CE1-CG2 4.06Å; F106-V110 WeakPolarHBondContact O-CG2 3.42Å; F106-V110 PolarHBondContact O-N 3.5Å
107	E	78.8	Confident	76.2	Confident	126 Å²	126	113.6 Å²	113.6	59%	0.589	58%	0.579	S	S	*	*	H	α-helix	trans	-63	-43.2	175.2	-71.1	179	172	0	0	112.2	M103 K104 M109 V110 A111	M103-E107 PolarHBondContact O-N 3.1Å; K104-E107 PolarHBondContact O-N 2.96Å; E107-M109 VanDerWaalsContact C-N 3.27Å; E107-M109 PolarHBondContact O-N 2.96Å; E107-V110 PolarHBondContact O-N 3.3Å; E107-A111 WeakPolarHBondContact O-CB 3.42Å; E107-A111 PolarHBondContact O-N 3.36Å
108	E	80.9	Confident	77.5	Confident	111 Å²	111	110.5 Å²	110.5	52%	0.519	57%	0.574	S	S	.	*	H	α-helix	trans	-58.3	-39.4	173.1	-77.3	174	-179.5	0	0	111.7	K104 A111 Q112	K104-E108 VanDerWaalsContact CE-OE1 3.29Å; K104-E108 WeakPolarHBondContact CE-OE1 3.42Å; K104-E108 WeakPolarHBondContact O-CG 3.46Å; K104-E108 PolarHBondContact O-N 3.19Å; E108-A111 PolarHBondContact O-N 3.16Å; E108-Q112 VanDerWaalsContact O-CB 3.32Å; E108-Q112 WeakPolarHBondContact O-CB 3.49Å; E108-Q112 PolarHBondContact O-N 3.32Å
109	M	78.8	Confident	79	Confident	120 Å²	120	107.4 Å²	107.4	59%	0.591	57%	0.566	S	S	*	*	H	α-helix	trans	-68.5	-39.8	178.2	-163.7	-177.3	-57.9	0	0	112.5	R105 F106 E107 Q112 A113	R105-M109 WeakPolarHBondContact O-CB 3.49Å; R105-M109 PolarHBondContact O-N 3.27Å; R105-M109 VanDerWaalsContact O-N 3.16Å; F106-M109 WeakPolarHBondContact O-CB 3.49Å; F106-M109 PolarHBondContact O-N 3Å; E107-M109 VanDerWaalsContact C-N 3.27Å; E107-M109 PolarHBondContact O-N 2.96Å; M109-Q112 PolarHBondContact O-N 2.98Å; M109-A113 WeakPolarHBondContact O-CB 3.32Å; M109-A113 PolarHBondContact O-N 3.39Å
110	V	85.6	Confident	80.4	Confident	65 Å²	65	102.1 Å²	102.1	39%	0.394	56%	0.558	S	S	.	*	H	α-helix	trans	-65.8	-43.6	175.3	172.8	0	0	0	0	110.9	F106 E107 Q112 A113 Q114	F106-V110 HydrophobicContact CD1-CG2 4.33Å; F106-V110 HydrophobicContact CE1-CG2 4.06Å; F106-V110 WeakPolarHBondContact O-CG2 3.42Å; F106-V110 PolarHBondContact O-N 3.5Å; E107-V110 PolarHBondContact O-N 3.3Å; V110-Q112 VanDerWaalsContact C-N 3.35Å; V110-Q112 PolarHBondContact O-N 2.93Å; V110-A113 PolarHBondContact O-N 3.35Å; V110-Q114 WeakPolarHBondContact O-CG 3.49Å; V110-Q114 PolarHBondContact O-N 2.93Å
111	A	82.9	Confident	81.7	Confident	54 Å²	54	99.9 Å²	99.9	45%	0.446	55%	0.549	S	S	.	.	H	α-helix	trans	-61.4	-43.3	175.8	0	0	0	0	0	111.6	E107 E108 A113 Q114 Q115	E107-A111 WeakPolarHBondContact O-CB 3.42Å; E107-A111 PolarHBondContact O-N 3.36Å; E108-A111 PolarHBondContact O-N 3.16Å; A111-A113 VanDerWaalsContact C-N 3.34Å; A111-A113 PolarHBondContact O-N 3.28Å; A111-Q114 PolarHBondContact O-N 2.93Å; A111-Q115 WeakPolarHBondContact O-CB 3.31Å; A111-Q115 PolarHBondContact O-N 3.49Å
112	Q	86.4	Confident	82.8	Confident	129 Å²	129	95 Å²	95	60%	0.603	54%	0.537	S	S	*	.	H	α-helix	trans	-65.1	-36.3	177.4	-163.6	174.2	23.2	0	0	112.2	E108 M109 V110 S116	E108-Q112 VanDerWaalsContact O-CB 3.32Å; E108-Q112 WeakPolarHBondContact O-CB 3.49Å; E108-Q112 PolarHBondContact O-N 3.32Å; M109-Q112 PolarHBondContact O-N 2.98Å; V110-Q112 VanDerWaalsContact C-N 3.35Å; V110-Q112 PolarHBondContact O-N 2.93Å; Q112-S116 VanDerWaalsContact O-CB 3.31Å; Q112-S116 WeakPolarHBondContact O-CB 3.32Å; Q112-S116 PolarHBondContact O-N 2.75Å; Q112-S116 PolarHBondContact O-OG 3.37Å
113	A	85.3	Confident	84	Confident	60 Å²	60	95.4 Å²	95.4	50%	0.496	54%	0.536	S	S	.	.	H	α-helix	trans	-67	-44.2	175.5	0	0	0	0	0	112.2	M109 V110 A111 S116 A117	M109-A113 WeakPolarHBondContact O-CB 3.32Å; M109-A113 PolarHBondContact O-N 3.39Å; V110-A113 PolarHBondContact O-N 3.35Å; A111-A113 VanDerWaalsContact C-N 3.34Å; A111-A113 PolarHBondContact O-N 3.28Å; A113-S116 PolarHBondContact O-N 3.45Å; A113-A117 WeakPolarHBondContact O-CB 3.29Å; A113-A117 PolarHBondContact O-N 3.48Å
114	Q	88.5	Confident	85.1	Confident	139 Å²	139	93.4 Å²	93.4	65%	0.65	54%	0.536	S	S	*	.	H	α-helix	trans	-65.1	-41.7	176.2	-72.3	179.3	-10.2	0	0	112	V110 A111 S116 A117 G118	V110-Q114 WeakPolarHBondContact O-CG 3.49Å; V110-Q114 PolarHBondContact O-N 2.93Å; A111-Q114 PolarHBondContact O-N 2.93Å; Q114-S116 VanDerWaalsContact C-N 3.34Å; Q114-S116 PolarHBondContact O-N 3Å; Q114-A117 PolarHBondContact O-N 3.36Å; Q114-G118 PolarHBondContact O-N 2.91Å
115	Q	87.4	Confident	86	Confident	145 Å²	145	93.5 Å²	93.5	68%	0.678	54%	0.538	S	S	*	.	H	α-helix	trans	-62.7	-42.3	175.1	-171.1	176.2	22.2	0	0	111.5	A111 A117 G118 A119	A111-Q115 WeakPolarHBondContact O-CB 3.31Å; A111-Q115 PolarHBondContact O-N 3.49Å; Q115-A117 VanDerWaalsContact C-N 3.35Å; Q115-A117 PolarHBondContact O-N 2.96Å; Q115-G118 PolarHBondContact O-N 2.93Å; Q115-A119 WeakPolarHBondContact O-CB 3.39Å; Q115-A119 PolarHBondContact O-N 3.34Å
116	S	90.3	Very high	86.8	Confident	71 Å²	71	89.1 Å²	89.1	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-63.8	-39.4	176.3	-60.8	0	0	0	0	111.9	Q112 A113 Q114 A119 A120	Q112-S116 VanDerWaalsContact O-CB 3.31Å; Q112-S116 WeakPolarHBondContact O-CB 3.32Å; Q112-S116 PolarHBondContact O-N 2.75Å; Q112-S116 PolarHBondContact O-OG 3.37Å; A113-S116 PolarHBondContact O-N 3.45Å; Q114-S116 VanDerWaalsContact C-N 3.34Å; Q114-S116 PolarHBondContact O-N 3Å; S116-A119 PolarHBondContact O-N 3.5Å; S116-A120 VanDerWaalsContact O-CB 3.32Å; S116-A120 WeakPolarHBondContact O-CB 3.4Å; S116-A120 PolarHBondContact O-N 3.5Å
117	A	86.2	Confident	87.6	Confident	61 Å²	61	86.7 Å²	86.7	50%	0.504	52%	0.522	S	S	.	.	H	α-helix	trans	-66.1	-42.2	175.3	0	0	0	0	0	112.2	A113 Q114 Q115 A120 A121	A113-A117 WeakPolarHBondContact O-CB 3.29Å; A113-A117 PolarHBondContact O-N 3.48Å; Q114-A117 PolarHBondContact O-N 3.36Å; Q115-A117 VanDerWaalsContact C-N 3.35Å; Q115-A117 PolarHBondContact O-N 2.96Å; A117-A120 PolarHBondContact O-N 3.34Å; A117-A121 PolarHBondContact O-N 3.49Å
118	G	87.7	Confident	88.3	Confident	47 Å²	47	83.7 Å²	83.7	49%	0.485	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-43.6	174.8	0	0	0	0	0	112.7	Q114 Q115 A121 G122	Q114-G118 PolarHBondContact O-N 2.91Å; Q115-G118 PolarHBondContact O-N 2.93Å; G118-A121 PolarHBondContact O-N 2.96Å; G118-G122 PolarHBondContact O-N 3.45Å
119	A	90.3	Very high	88.9	Confident	53 Å²	53	83.5 Å²	83.5	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-63.1	-40.7	174.5	0	0	0	0	0	111.9	Q115 S116 G122 N123	Q115-A119 WeakPolarHBondContact O-CB 3.39Å; Q115-A119 PolarHBondContact O-N 3.34Å; S116-A119 PolarHBondContact O-N 3.5Å; A119-G122 PolarHBondContact O-N 2.9Å; A119-N123 WeakPolarHBondContact O-CB 3.39Å; A119-N123 PolarHBondContact O-N 3.02Å; A119-N123 PolarHBondContact O-ND2 3.32Å
120	A	88.6	Confident	89.6	Confident	59 Å²	59	81.8 Å²	81.8	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-41.5	176	0	0	0	0	0	112.3	S116 A117 N123 A124	S116-A120 VanDerWaalsContact O-CB 3.32Å; S116-A120 WeakPolarHBondContact O-CB 3.4Å; S116-A120 PolarHBondContact O-N 3.5Å; A117-A120 PolarHBondContact O-N 3.34Å; A120-N123 PolarHBondContact O-N 2.94Å; A120-A124 WeakPolarHBondContact O-CB 3.35Å; A120-A124 PolarHBondContact O-N 2.85Å
121	A	90	Very high	90.1	Very high	61 Å²	61	83.2 Å²	83.2	50%	0.504	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-43.1	175.8	0	0	0	0	0	112.1	A117 G118 A124 Q125	A117-A121 PolarHBondContact O-N 3.49Å; G118-A121 PolarHBondContact O-N 2.96Å; A121-A124 PolarHBondContact O-N 3.48Å; A121-Q125 PolarHBondContact O-N 3.42Å
122	G	91.3	Very high	90.6	Very high	42 Å²	42	83.2 Å²	83.2	43%	0.433	52%	0.52	S	S	.	.	H	α-helix	trans	-60.3	-45.7	174	0	0	0	0	0	112.3	G118 A119 A124 Q125 Q126	G118-G122 PolarHBondContact O-N 3.45Å; A119-G122 PolarHBondContact O-N 2.9Å; G122-A124 PolarHBondContact O-N 2.95Å; G122-Q125 PolarHBondContact O-N 2.96Å; G122-Q126 PolarHBondContact O-N 3.29Å
123	N	93	Very high	91	Very high	111 Å²	111	80 Å²	80	59%	0.594	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-40.2	176.1	-73.3	-10.2	0	0	0	112.2	A119 A120 Q125 Q126 T127	A119-N123 WeakPolarHBondContact O-CB 3.39Å; A119-N123 PolarHBondContact O-N 3.02Å; A119-N123 PolarHBondContact O-ND2 3.32Å; A120-N123 PolarHBondContact O-N 2.94Å; N123-Q125 VanDerWaalsContact C-N 3.35Å; N123-Q126 PolarHBondContact O-N 3.47Å; N123-T127 VanDerWaalsContact O-CB 3.29Å; N123-T127 WeakPolarHBondContact O-CB 3.29Å; N123-T127 PolarHBondContact O-N 2.91Å; N123-T127 PolarHBondContact O-OG1 3.09Å
124	A	89.3	Confident	91.4	Very high	61 Å²	61	80 Å²	80	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-64	-40.3	176.8	0	0	0	0	0	111.8	A120 A121 G122 T127 A128	A120-A124 WeakPolarHBondContact O-CB 3.35Å; A120-A124 PolarHBondContact O-N 2.85Å; A121-A124 PolarHBondContact O-N 3.48Å; G122-A124 PolarHBondContact O-N 2.95Å; A124-T127 PolarHBondContact O-N 3.45Å; A124-A128 PolarHBondContact O-N 2.89Å
125	Q	92.1	Very high	91.7	Very high	134 Å²	134	75.4 Å²	75.4	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-68.6	-43.4	177.3	-170.3	130.7	-37	0	0	112.3	A121 G122 N123 T127 A128 Q129	A121-Q125 PolarHBondContact O-N 3.42Å; G122-Q125 PolarHBondContact O-N 2.96Å; N123-Q125 VanDerWaalsContact C-N 3.35Å; Q125-T127 VanDerWaalsContact C-N 3.33Å; Q125-A128 PolarHBondContact O-N 3.04Å; Q125-Q129 WeakPolarHBondContact O-CG 3.41Å; Q125-Q129 PolarHBondContact O-N 3.36Å
126	Q	93.2	Very high	92.1	Very high	93 Å²	93	72.4 Å²	72.4	44%	0.435	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-44.1	173.9	-172.9	61.3	55	0	0	110.8	G122 N123 A128 Q129 D130	G122-Q126 PolarHBondContact O-N 3.29Å; N123-Q126 PolarHBondContact O-N 3.47Å; Q126-A128 VanDerWaalsContact C-N 3.3Å; Q126-A128 PolarHBondContact O-N 3.26Å; Q126-Q129 CarbonylContact O-C 3.54Å; Q126-Q129 WeakPolarHBondContact O-CB 3.21Å; Q126-Q129 PolarHBondContact O-N 2.81Å; Q126-Q129 VanDerWaalsContact O-N 3.09Å; Q126-D130 PolarHBondContact NE2-OD1 3.29Å; Q126-D130 PolarHBondContact O-N 2.68Å
127	T	92.8	Very high	92.3	Very high	79 Å²	79	71.8 Å²	71.8	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-59.3	-41.1	176.3	-56.7	0	0	0	0	111.3	N123 A124 Q125 D130 V131	N123-T127 VanDerWaalsContact O-CB 3.29Å; N123-T127 WeakPolarHBondContact O-CB 3.29Å; N123-T127 PolarHBondContact O-N 2.91Å; N123-T127 PolarHBondContact O-OG1 3.09Å; A124-T127 PolarHBondContact O-N 3.45Å; Q125-T127 VanDerWaalsContact C-N 3.33Å; T127-D130 PolarHBondContact O-N 3.04Å; T127-V131 HydrophobicContact CG2-CG2 4.39Å; T127-V131 WeakPolarHBondContact O-CB 3.45Å; T127-V131 WeakPolarHBondContact O-CG2 3.4Å; T127-V131 PolarHBondContact O-N 3.42Å
128	A	92.7	Very high	92.7	Very high	63 Å²	63	76.2 Å²	76.2	52%	0.521	50%	0.495	S	S	.	.	H	α-helix	trans	-64.4	-39.1	176	0	0	0	0	0	112.4	A124 Q125 Q126 A132	A124-A128 PolarHBondContact O-N 2.89Å; Q125-A128 PolarHBondContact O-N 3.04Å; Q126-A128 VanDerWaalsContact C-N 3.3Å; Q126-A128 PolarHBondContact O-N 3.26Å; A128-A132 WeakPolarHBondContact O-CB 3.48Å; A128-A132 PolarHBondContact O-N 3.34Å
129	Q	93.6	Very high	93	Very high	107 Å²	107	77.8 Å²	77.8	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-66.1	-42.8	173.9	-70.1	177.6	1.5	0	0	111.9	Q125 Q126 A132 A133	Q125-Q129 WeakPolarHBondContact O-CG 3.41Å; Q125-Q129 PolarHBondContact O-N 3.36Å; Q126-Q129 CarbonylContact O-C 3.54Å; Q126-Q129 WeakPolarHBondContact O-CB 3.21Å; Q126-Q129 PolarHBondContact O-N 2.81Å; Q126-Q129 VanDerWaalsContact O-N 3.09Å; Q129-A132 PolarHBondContact O-N 3.5Å; Q129-A133 WeakPolarHBondContact O-CB 3.46Å; Q129-A133 PolarHBondContact O-N 2.88Å
130	D	94.4	Very high	93.2	Very high	84 Å²	84	78.8 Å²	78.8	45%	0.449	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-40.3	178.2	-64.2	-18.6	0	0	0	111.1	Q126 T127 A133 A134	Q126-D130 PolarHBondContact NE2-OD1 3.29Å; Q126-D130 PolarHBondContact O-N 2.68Å; T127-D130 PolarHBondContact O-N 3.04Å; D130-A133 PolarHBondContact O-N 2.9Å; D130-A134 VanDerWaalsContact O-CB 3.24Å; D130-A134 WeakPolarHBondContact O-CB 3.24Å; D130-A134 PolarHBondContact O-N 3.4Å
131	V	95.1	Very high	93.4	Very high	94 Å²	94	78.7 Å²	78.7	57%	0.57	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-42.9	174	168.7	0	0	0	0	111	T127 A134 A135	T127-V131 HydrophobicContact CG2-CG2 4.39Å; T127-V131 WeakPolarHBondContact O-CB 3.45Å; T127-V131 WeakPolarHBondContact O-CG2 3.4Å; T127-V131 PolarHBondContact O-N 3.42Å; V131-A134 PolarHBondContact O-N 2.84Å; V131-A135 WeakPolarHBondContact O-CB 3.42Å; V131-A135 PolarHBondContact O-N 3.25Å
132	A	94.4	Very high	93.6	Very high	55 Å²	55	81.1 Å²	81.1	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-65.2	-43.5	176.4	0	0	0	0	0	111.8	A128 Q129 A134 A135 T136	A128-A132 WeakPolarHBondContact O-CB 3.48Å; A128-A132 PolarHBondContact O-N 3.34Å; Q129-A132 PolarHBondContact O-N 3.5Å; A132-A134 PolarHBondContact O-N 3.09Å; A132-A135 PolarHBondContact O-N 2.85Å; A132-T136 PolarHBondContact O-N 3.19Å; A132-T136 PolarHBondContact O-OG1 2.83Å; A132-T136 VanDerWaalsContact O-OG1 3.09Å
133	A	94.5	Very high	93.7	Very high	60 Å²	60	88.2 Å²	88.2	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-41.3	175.8	0	0	0	0	0	111.8	Q129 D130 T136 A137	Q129-A133 WeakPolarHBondContact O-CB 3.46Å; Q129-A133 PolarHBondContact O-N 2.88Å; D130-A133 PolarHBondContact O-N 2.9Å; A133-T136 PolarHBondContact O-N 2.96Å; A133-A137 VanDerWaalsContact O-CB 3.31Å; A133-A137 WeakPolarHBondContact O-CB 3.4Å; A133-A137 PolarHBondContact O-N 3.16Å
134	A	94.2	Very high	93.9	Very high	60 Å²	60	89.4 Å²	89.4	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-38.6	175.5	0	0	0	0	0	112.2	D130 V131 A132 R138	D130-A134 VanDerWaalsContact O-CB 3.24Å; D130-A134 WeakPolarHBondContact O-CB 3.24Å; D130-A134 PolarHBondContact O-N 3.4Å; V131-A134 PolarHBondContact O-N 2.84Å; A132-A134 PolarHBondContact O-N 3.09Å; A134-R138 WeakPolarHBondContact O-CB 3.4Å; A134-R138 PolarHBondContact O-N 3.44Å
135	A	94.8	Very high	94.1	Very high	44 Å²	44	88.3 Å²	88.3	36%	0.364	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-48.5	174.9	0	0	0	0	0	111.4	V131 A132 A137 R138 D139	V131-A135 WeakPolarHBondContact O-CB 3.42Å; V131-A135 PolarHBondContact O-N 3.25Å; A132-A135 PolarHBondContact O-N 2.85Å; A135-A137 PolarHBondContact O-N 2.92Å; A135-R138 WeakPolarHBondContact O-CB 3.46Å; A135-R138 PolarHBondContact O-N 3.34Å; A135-R138 VanDerWaalsContact O-N 3.16Å; A135-D139 PolarHBondContact O-N 3.46Å
136	T	94.8	Very high	94.2	Very high	82 Å²	82	86.7 Å²	86.7	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-58.9	-46	175.3	-57.4	0	0	0	0	111.5	A132 A133 R138 D139 D140	A132-T136 PolarHBondContact O-N 3.19Å; A132-T136 PolarHBondContact O-OG1 2.83Å; A132-T136 VanDerWaalsContact O-OG1 3.09Å; A133-T136 PolarHBondContact O-N 2.96Å; T136-R138 VanDerWaalsContact C-N 3.28Å; T136-R138 PolarHBondContact O-N 2.87Å; T136-D139 PolarHBondContact O-N 2.96Å; T136-D140 WeakPolarHBondContact O-CB 3.43Å; T136-D140 PolarHBondContact O-N 3.34Å
137	A	94.6	Very high	94.2	Very high	57 Å²	57	88.1 Å²	88.1	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-36.1	177.6	0	0	0	0	0	112.3	A133 A135 A141	A133-A137 VanDerWaalsContact O-CB 3.31Å; A133-A137 WeakPolarHBondContact O-CB 3.4Å; A133-A137 PolarHBondContact O-N 3.16Å; A135-A137 PolarHBondContact O-N 2.92Å; A137-A141 VanDerWaalsContact O-CB 3.25Å; A137-A141 WeakPolarHBondContact O-CB 3.25Å; A137-A141 PolarHBondContact O-N 3.28Å
138	R	94.5	Very high	94.3	Very high	155 Å²	155	87.1 Å²	87.1	59%	0.585	49%	0.492	S	S	*	.	H	α-helix	trans	-65.9	-44.9	174.6	-168.7	-165.5	77.7	172.7	3.7	111.4	A134 A135 T136 A141 Q142	A134-R138 WeakPolarHBondContact O-CB 3.4Å; A134-R138 PolarHBondContact O-N 3.44Å; A135-R138 WeakPolarHBondContact O-CB 3.46Å; A135-R138 PolarHBondContact O-N 3.34Å; A135-R138 VanDerWaalsContact O-N 3.16Å; T136-R138 VanDerWaalsContact C-N 3.28Å; T136-R138 PolarHBondContact O-N 2.87Å; R138-A141 PolarHBondContact O-N 2.95Å; R138-Q142 WeakPolarHBondContact O-CG 3.1Å; R138-Q142 PolarHBondContact O-N 2.9Å
139	D	94.9	Very high	94.4	Very high	80 Å²	80	91.7 Å²	91.7	43%	0.428	50%	0.496	S	S	.	.	H	α-helix	trans	-69.3	-38	-178.2	-66.9	-9	0	0	0	111.1	A135 T136 Q142 R143	A135-D139 PolarHBondContact O-N 3.46Å; T136-D139 PolarHBondContact O-N 2.96Å; D139-Q142 PolarHBondContact O-N 3.39Å; D139-R143 WeakPolarHBondContact O-CB 3.33Å; D139-R143 PolarHBondContact O-N 2.94Å
140	D	94.7	Very high	94.4	Very high	74 Å²	74	92 Å²	92	40%	0.396	50%	0.497	S	S	.	.	H	α-helix	trans	-63.5	-44.5	171.1	-77.4	-20.7	0	0	0	111.6	T136 Q142 R143 F144	T136-D140 WeakPolarHBondContact O-CB 3.43Å; T136-D140 PolarHBondContact O-N 3.34Å; D140-Q142 VanDerWaalsContact C-N 3.29Å; D140-Q142 PolarHBondContact O-N 3.31Å; D140-R143 PolarHBondContact O-N 2.85Å; D140-F144 HydrophobicContact CB-CD2 4.43Å; D140-F144 HydrophobicContact CB-CE2 4.07Å; D140-F144 WeakPolarHBondContact O-CB 3.31Å; D140-F144 WeakPolarHBondContact O-CD2 3.46Å; D140-F144 WeakPolarHBondContact O-CG 3.25Å; D140-F144 PolarHBondContact O-N 2.88Å
141	A	92.8	Very high	94.4	Very high	57 Å²	57	92 Å²	92	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-60.4	-39.6	175.2	0	0	0	0	0	111.8	A137 R138 A145	A137-A141 VanDerWaalsContact O-CB 3.25Å; A137-A141 WeakPolarHBondContact O-CB 3.25Å; A137-A141 PolarHBondContact O-N 3.28Å; R138-A141 PolarHBondContact O-N 2.95Å; A141-A145 VanDerWaalsContact O-CB 3.25Å; A141-A145 WeakPolarHBondContact O-CB 3.47Å; A141-A145 PolarHBondContact O-N 3.47Å
142	Q	94.2	Very high	94.3	Very high	112 Å²	112	90.3 Å²	90.3	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-64.8	-45.4	173.7	-76.5	-178.2	-20.1	0	0	111.7	R138 D139 D140 F144 A145 E146	R138-Q142 WeakPolarHBondContact O-CG 3.1Å; R138-Q142 PolarHBondContact O-N 2.9Å; D139-Q142 PolarHBondContact O-N 3.39Å; D140-Q142 VanDerWaalsContact C-N 3.29Å; D140-Q142 PolarHBondContact O-N 3.31Å; Q142-F144 PolarHBondContact O-N 2.94Å; Q142-A145 PolarHBondContact O-N 3.2Å; Q142-E146 WeakPolarHBondContact O-CB 3.46Å; Q142-E146 PolarHBondContact O-N 2.88Å
143	R	94.2	Very high	94.3	Very high	190 Å²	190	91.6 Å²	91.6	72%	0.717	50%	0.495	S	S	*	.	H	α-helix	trans	-60.6	-44.6	177.4	-172.7	-173.8	-173.9	116	3.1	112.1	D139 D140 E146 K147	D139-R143 WeakPolarHBondContact O-CB 3.33Å; D139-R143 PolarHBondContact O-N 2.94Å; D140-R143 PolarHBondContact O-N 2.85Å; R143-E146 PolarHBondContact O-N 3.46Å; R143-K147 WeakPolarHBondContact O-CB 3.34Å; R143-K147 PolarHBondContact O-N 3.14Å
144	F	95.4	Very high	94.3	Very high	136 Å²	136	92.3 Å²	92.3	60%	0.596	49%	0.494	S	S	*	.	H	α-helix	trans	-67.8	-38.3	177.3	-65.9	-43.3	0	0	0	112	D140 Q142 K147 A148	D140-F144 HydrophobicContact CB-CD2 4.43Å; D140-F144 HydrophobicContact CB-CE2 4.07Å; D140-F144 WeakPolarHBondContact O-CB 3.31Å; D140-F144 WeakPolarHBondContact O-CD2 3.46Å; D140-F144 WeakPolarHBondContact O-CG 3.25Å; D140-F144 PolarHBondContact O-N 2.88Å; Q142-F144 PolarHBondContact O-N 2.94Å; F144-K147 PolarHBondContact O-N 2.88Å; F144-A148 VanDerWaalsContact O-CB 3.31Å; F144-A148 WeakPolarHBondContact O-CB 3.5Å; F144-A148 PolarHBondContact O-N 3.02Å
145	A	94.9	Very high	94.1	Very high	38 Å²	38	92.3 Å²	92.3	31%	0.314	49%	0.487	S	S	.	.	H	α-helix	trans	-64.3	-40	174.2	0	0	0	0	0	112.1	A141 Q142 R149	A141-A145 VanDerWaalsContact O-CB 3.25Å; A141-A145 WeakPolarHBondContact O-CB 3.47Å; A141-A145 PolarHBondContact O-N 3.47Å; Q142-A145 PolarHBondContact O-N 3.2Å; A145-R149 WeakPolarHBondContact O-CG 3.31Å; A145-R149 PolarHBondContact O-N 3.17Å; A145-R149 VanDerWaalsContact O-N 3.14Å
146	E	92.8	Very high	94	Very high	101 Å²	101	92.9 Å²	92.9	47%	0.472	49%	0.492	S	S	.	.	H	α-helix	trans	-64.5	-47.1	175.7	-161.1	73.5	-155	0	0	110.8	Q142 R143 A148 R149 Q150	Q142-E146 WeakPolarHBondContact O-CB 3.46Å; Q142-E146 PolarHBondContact O-N 2.88Å; R143-E146 PolarHBondContact O-N 3.46Å; E146-A148 PolarHBondContact O-N 3.43Å; E146-R149 WeakPolarHBondContact O-CB 3.46Å; E146-R149 PolarHBondContact O-N 2.95Å; E146-Q150 WeakPolarHBondContact O-CG 3.43Å; E146-Q150 PolarHBondContact O-N 3.41Å
147	K	95	Very high	93.8	Very high	123 Å²	123	95.1 Å²	95.1	54%	0.535	50%	0.497	S	S	.	.	H	α-helix	trans	-61.6	-43.6	177.6	-177.9	162.7	178.6	130.2	0	112.1	R143 F144 R149 Q150 D151	R143-K147 WeakPolarHBondContact O-CB 3.34Å; R143-K147 PolarHBondContact O-N 3.14Å; F144-K147 PolarHBondContact O-N 2.88Å; K147-R149 VanDerWaalsContact C-N 3.28Å; K147-R149 PolarHBondContact O-N 2.79Å; K147-Q150 PolarHBondContact O-N 2.99Å; K147-Q150 VanDerWaalsContact O-N 3.16Å; K147-D151 PolarHBondContact O-N 3.47Å
148	A	94	Very high	93.7	Very high	57 Å²	57	97.1 Å²	97.1	47%	0.471	50%	0.5	S	S	.	.	H	α-helix	trans	-61.6	-35.3	176.1	0	0	0	0	0	112.6	F144 E146 A152	F144-A148 VanDerWaalsContact O-CB 3.31Å; F144-A148 WeakPolarHBondContact O-CB 3.5Å; F144-A148 PolarHBondContact O-N 3.02Å; E146-A148 PolarHBondContact O-N 3.43Å; A148-A152 VanDerWaalsContact O-CB 3.25Å; A148-A152 WeakPolarHBondContact O-CB 3.25Å; A148-A152 PolarHBondContact O-N 3.33Å
149	R	94.3	Very high	93.6	Very high	160 Å²	160	98.3 Å²	98.3	60%	0.604	50%	0.504	S	S	*	.	H	α-helix	trans	-67.8	-41	173.7	-71.2	177.2	-138.9	-170.3	5.1	112.1	A145 E146 K147 A152 T153	A145-R149 WeakPolarHBondContact O-CG 3.31Å; A145-R149 PolarHBondContact O-N 3.17Å; A145-R149 VanDerWaalsContact O-N 3.14Å; E146-R149 WeakPolarHBondContact O-CB 3.46Å; E146-R149 PolarHBondContact O-N 2.95Å; K147-R149 VanDerWaalsContact C-N 3.28Å; K147-R149 PolarHBondContact O-N 2.79Å; R149-A152 PolarHBondContact O-N 2.99Å; R149-T153 PolarHBondContact O-N 2.95Å; R149-T153 PolarHBondContact O-OG1 3.17Å
150	Q	94.2	Very high	93.5	Very high	113 Å²	113	101.1 Å²	101.1	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-49.5	176.3	-69.6	174.4	2.9	0	0	110.8	E146 K147 A152 T153 V154	E146-Q150 WeakPolarHBondContact O-CG 3.43Å; E146-Q150 PolarHBondContact O-N 3.41Å; K147-Q150 PolarHBondContact O-N 2.99Å; K147-Q150 VanDerWaalsContact O-N 3.16Å; Q150-A152 VanDerWaalsContact C-N 3.29Å; Q150-A152 PolarHBondContact O-N 2.86Å; Q150-T153 WeakPolarHBondContact O-CB 3.47Å; Q150-T153 PolarHBondContact O-N 3.16Å; Q150-V154 WeakPolarHBondContact O-CG2 3.43Å; Q150-V154 PolarHBondContact O-N 3.04Å
151	D	94.2	Very high	93.3	Very high	84 Å²	84	100 Å²	100	45%	0.449	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-39.2	177.8	-68	-15.9	0	0	0	111.4	K147 T155	K147-D151 PolarHBondContact O-N 3.47Å; D151-T155 WeakPolarHBondContact O-CB 3.45Å; D151-T155 PolarHBondContact O-N 3.09Å; D151-T155 PolarHBondContact O-OG1 3.43Å
152	A	92.8	Very high	93.2	Very high	59 Å²	59	101.2 Å²	101.2	49%	0.488	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-35.7	174.7	0	0	0	0	0	113	A148 R149 Q150 A156	A148-A152 VanDerWaalsContact O-CB 3.25Å; A148-A152 WeakPolarHBondContact O-CB 3.25Å; A148-A152 PolarHBondContact O-N 3.33Å; R149-A152 PolarHBondContact O-N 2.99Å; Q150-A152 VanDerWaalsContact C-N 3.29Å; Q150-A152 PolarHBondContact O-N 2.86Å; A152-A156 WeakPolarHBondContact O-CB 3.33Å; A152-A156 PolarHBondContact O-N 3.03Å
153	T	93.7	Very high	93	Very high	81 Å²	81	98.4 Å²	98.4	50%	0.497	51%	0.511	S	S	.	.	H	α-helix	trans	-68.2	-48.1	177	-54.9	0	0	0	0	110.6	R149 Q150 T155 A156 E157	R149-T153 PolarHBondContact O-N 2.95Å; R149-T153 PolarHBondContact O-OG1 3.17Å; Q150-T153 WeakPolarHBondContact O-CB 3.47Å; Q150-T153 PolarHBondContact O-N 3.16Å; T153-T155 VanDerWaalsContact C-N 3.33Å; T153-T155 PolarHBondContact O-N 3.35Å; T153-A156 WeakPolarHBondContact O-CB 3.46Å; T153-A156 PolarHBondContact O-N 3.02Å; T153-A156 VanDerWaalsContact O-N 3.09Å; T153-E157 PolarHBondContact O-N 2.73Å
154	V	94.6	Very high	92.7	Very high	76 Å²	76	94.8 Å²	94.8	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-58.4	-46.3	175	174.5	0	0	0	0	110.6	Q150 A156 E157 D158	Q150-V154 WeakPolarHBondContact O-CG2 3.43Å; Q150-V154 PolarHBondContact O-N 3.04Å; V154-A156 VanDerWaalsContact C-N 3.25Å; V154-A156 PolarHBondContact O-N 3.26Å; V154-E157 PolarHBondContact O-N 2.93Å; V154-E157 VanDerWaalsContact O-N 3.17Å; V154-D158 PolarHBondContact O-N 3.06Å
155	T	91.9	Very high	92.5	Very high	59 Å²	59	93.6 Å²	93.6	36%	0.362	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-34.8	177.2	-57.5	0	0	0	0	112.4	D151 T153 R159	D151-T155 WeakPolarHBondContact O-CB 3.45Å; D151-T155 PolarHBondContact O-N 3.09Å; D151-T155 PolarHBondContact O-OG1 3.43Å; T153-T155 VanDerWaalsContact C-N 3.33Å; T153-T155 PolarHBondContact O-N 3.35Å; T155-R159 WeakPolarHBondContact O-CB 3.4Å; T155-R159 WeakPolarHBondContact O-CG 3.42Å; T155-R159 PolarHBondContact O-N 3.49Å; T155-R159 VanDerWaalsContact O-N 3.09Å
156	A	92	Very high	92.3	Very high	57 Å²	57	96.4 Å²	96.4	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-71.4	-39.9	177.3	0	0	0	0	0	112.1	A152 T153 V154 R159 K160	A152-A156 WeakPolarHBondContact O-CB 3.33Å; A152-A156 PolarHBondContact O-N 3.03Å; T153-A156 WeakPolarHBondContact O-CB 3.46Å; T153-A156 PolarHBondContact O-N 3.02Å; T153-A156 VanDerWaalsContact O-N 3.09Å; V154-A156 VanDerWaalsContact C-N 3.25Å; V154-A156 PolarHBondContact O-N 3.26Å; A156-R159 PolarHBondContact O-N 2.92Å; A156-K160 PolarHBondContact O-N 2.89Å; A156-K160 VanDerWaalsContact O-N 3.07Å
157	E	91.2	Very high	92.3	Very high	129 Å²	129	96.5 Å²	96.5	60%	0.603	52%	0.523	S	S	*	.	H	α-helix	trans	-64.9	-44.9	174.2	-69.7	-175.8	152	0	0	111.5	T153 V154 R159 K160 A161	T153-E157 PolarHBondContact O-N 2.73Å; V154-E157 PolarHBondContact O-N 2.93Å; V154-E157 VanDerWaalsContact O-N 3.17Å; E157-R159 VanDerWaalsContact C-N 3.32Å; E157-R159 PolarHBondContact O-N 3.48Å; E157-K160 WeakPolarHBondContact O-CB 3.47Å; E157-K160 PolarHBondContact O-N 3.37Å; E157-A161 PolarHBondContact O-N 3.25Å
158	D	92.3	Very high	92.1	Very high	98 Å²	98	93.6 Å²	93.6	52%	0.524	52%	0.518	S	S	.	.	H	α-helix	trans	-59.9	-40.9	175.8	-76.6	-15.5	0	0	0	111.9	V154 K160 A161 T162	V154-D158 PolarHBondContact O-N 3.06Å; D158-K160 VanDerWaalsContact C-N 3.33Å; D158-K160 PolarHBondContact O-N 3.46Å; D158-A161 PolarHBondContact O-N 3.04Å; D158-T162 WeakPolarHBondContact O-CB 3.33Å; D158-T162 PolarHBondContact O-N 3.15Å; D158-T162 PolarHBondContact O-OG1 3.07Å
159	R	92.2	Very high	91.9	Very high	181 Å²	181	95.2 Å²	95.2	68%	0.683	52%	0.523	S	S	*	.	H	α-helix	trans	-64.9	-36.8	174.7	-80	-179.9	-176.6	146.6	3.4	112.5	T155 A156 E157 A163	T155-R159 WeakPolarHBondContact O-CB 3.4Å; T155-R159 WeakPolarHBondContact O-CG 3.42Å; T155-R159 PolarHBondContact O-N 3.49Å; T155-R159 VanDerWaalsContact O-N 3.09Å; A156-R159 PolarHBondContact O-N 2.92Å; E157-R159 VanDerWaalsContact C-N 3.32Å; E157-R159 PolarHBondContact O-N 3.48Å; R159-A163 WeakPolarHBondContact O-CB 3.32Å; R159-A163 PolarHBondContact O-N 2.94Å
160	K	91.6	Very high	91.7	Very high	139 Å²	139	89.7 Å²	89.7	60%	0.604	52%	0.515	S	S	*	.	H	α-helix	trans	-67.1	-47.7	177	-170.9	-172.5	178.1	-161.8	0	110.8	A156 E157 D158 T162 A163 E164	A156-K160 PolarHBondContact O-N 2.89Å; A156-K160 VanDerWaalsContact O-N 3.07Å; E157-K160 WeakPolarHBondContact O-CB 3.47Å; E157-K160 PolarHBondContact O-N 3.37Å; D158-K160 VanDerWaalsContact C-N 3.33Å; D158-K160 PolarHBondContact O-N 3.46Å; K160-T162 VanDerWaalsContact C-N 3.31Å; K160-T162 PolarHBondContact O-N 3.09Å; K160-A163 PolarHBondContact O-N 3.39Å; K160-A163 VanDerWaalsContact O-N 3.15Å; K160-E164 WeakPolarHBondContact CE-OE1 3.35Å; K160-E164 PolarHBondContact O-N 2.94Å
161	A	91.4	Very high	91.6	Very high	49 Å²	49	87.1 Å²	87.1	41%	0.405	51%	0.513	S	S	.	.	H	α-helix	trans	-58.5	-44.1	175.1	0	0	0	0	0	111.4	E157 D158 A163 E164 D165	E157-A161 PolarHBondContact O-N 3.25Å; D158-A161 PolarHBondContact O-N 3.04Å; A161-A163 VanDerWaalsContact C-N 3.33Å; A161-A163 PolarHBondContact O-N 3.43Å; A161-E164 PolarHBondContact O-N 2.73Å; A161-D165 PolarHBondContact O-N 3.05Å
162	T	90.8	Very high	91.5	Very high	83 Å²	83	88 Å²	88	51%	0.509	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-41.8	175.7	-56.4	0	0	0	0	111.9	D158 K160 D165 V166	D158-T162 WeakPolarHBondContact O-CB 3.33Å; D158-T162 PolarHBondContact O-N 3.15Å; D158-T162 PolarHBondContact O-OG1 3.07Å; K160-T162 VanDerWaalsContact C-N 3.31Å; K160-T162 PolarHBondContact O-N 3.09Å; T162-D165 PolarHBondContact O-N 3Å; T162-V166 VanDerWaalsContact O-CG2 3.32Å; T162-V166 WeakPolarHBondContact O-CG2 3.48Å; T162-V166 PolarHBondContact O-N 3.38Å
163	A	89.6	Confident	91.3	Very high	54 Å²	54	88.3 Å²	88.3	45%	0.446	52%	0.521	S	S	.	.	H	α-helix	trans	-67	-37.1	178.6	0	0	0	0	0	112.9	R159 K160 A161 T167	R159-A163 WeakPolarHBondContact O-CB 3.32Å; R159-A163 PolarHBondContact O-N 2.94Å; K160-A163 PolarHBondContact O-N 3.39Å; K160-A163 VanDerWaalsContact O-N 3.15Å; A161-A163 VanDerWaalsContact C-N 3.33Å; A161-A163 PolarHBondContact O-N 3.43Å; A163-T167 PolarHBondContact O-N 2.89Å; A163-T167 PolarHBondContact O-OG1 2.73Å
164	E	87.8	Confident	91.3	Very high	113 Å²	113	87.6 Å²	87.6	53%	0.528	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-43.6	173.6	-71.3	173.1	-175.7	0	0	110.9	K160 A161 T167 S168	K160-E164 WeakPolarHBondContact CE-OE1 3.35Å; K160-E164 PolarHBondContact O-N 2.94Å; A161-E164 PolarHBondContact O-N 2.73Å; E164-T167 WeakPolarHBondContact O-CB 3.49Å; E164-T167 PolarHBondContact O-N 3.28Å; E164-S168 WeakPolarHBondContact O-CB 3.27Å; E164-S168 PolarHBondContact O-N 2.92Å
165	D	90.4	Very high	91.1	Very high	111 Å²	111	86.6 Å²	86.6	59%	0.594	52%	0.522	S	S	*	.	H	α-helix	trans	-61.9	-43	174.6	-89.6	4.1	0	0	0	112.7	A161 T162 T167 S168 T169	A161-D165 PolarHBondContact O-N 3.05Å; T162-D165 PolarHBondContact O-N 3Å; D165-T167 VanDerWaalsContact C-N 3.31Å; D165-T167 PolarHBondContact O-N 3.45Å; D165-S168 PolarHBondContact O-N 3.45Å; D165-T169 VanDerWaalsContact O-CB 3.27Å; D165-T169 WeakPolarHBondContact O-CB 3.5Å; D165-T169 PolarHBondContact O-N 2.83Å; D165-T169 PolarHBondContact O-OG1 3.41Å
166	V	91.9	Very high	91	Very high	97 Å²	97	86.6 Å²	86.6	59%	0.588	53%	0.529	S	S	*	.	H	α-helix	trans	-62.2	-40.8	174.9	171.8	0	0	0	0	111	T162 T169 G170	T162-V166 VanDerWaalsContact O-CG2 3.32Å; T162-V166 WeakPolarHBondContact O-CG2 3.48Å; T162-V166 PolarHBondContact O-N 3.38Å; V166-T169 PolarHBondContact O-N 2.9Å; V166-G170 PolarHBondContact O-N 3Å
167	T	91.9	Very high	91	Very high	103 Å²	103	85.6 Å²	85.6	63%	0.632	52%	0.523	S	S	*	.	H	α-helix	trans	-64.9	-46.6	178.3	-56.9	0	0	0	0	111.2	A163 E164 D165 G170 A171	A163-T167 PolarHBondContact O-N 2.89Å; A163-T167 PolarHBondContact O-OG1 2.73Å; E164-T167 WeakPolarHBondContact O-CB 3.49Å; E164-T167 PolarHBondContact O-N 3.28Å; D165-T167 VanDerWaalsContact C-N 3.31Å; D165-T167 PolarHBondContact O-N 3.45Å; T167-G170 PolarHBondContact O-N 3.21Å; T167-A171 PolarHBondContact O-N 2.84Å
168	S	91.1	Very high	91.1	Very high	62 Å²	62	84 Å²	84	43%	0.434	52%	0.516	S	S	.	.	H	α-helix	trans	-61.6	-43.9	176.2	-175.1	0	0	0	0	111.7	E164 D165 G170 A171 N172	E164-S168 WeakPolarHBondContact O-CB 3.27Å; E164-S168 PolarHBondContact O-N 2.92Å; D165-S168 PolarHBondContact O-N 3.45Å; S168-G170 VanDerWaalsContact C-N 3.33Å; S168-G170 PolarHBondContact O-N 3.41Å; S168-A171 PolarHBondContact O-N 3.42Å; S168-N172 WeakPolarHBondContact O-CB 3.42Å; S168-N172 VanDerWaalsContact O-CG 3.28Å; S168-N172 PolarHBondContact O-N 2.93Å; S168-N172 PolarHBondContact O-ND2 3Å
169	T	90.8	Very high	91.1	Very high	92 Å²	92	82.9 Å²	82.9	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-61.1	-41.7	176.1	-58	0	0	0	0	111.6	D165 V166 N172 A173	D165-T169 VanDerWaalsContact O-CB 3.27Å; D165-T169 WeakPolarHBondContact O-CB 3.5Å; D165-T169 PolarHBondContact O-N 2.83Å; D165-T169 PolarHBondContact O-OG1 3.41Å; V166-T169 PolarHBondContact O-N 2.9Å; T169-N172 PolarHBondContact O-N 3.29Å; T169-A173 WeakPolarHBondContact O-CB 3.49Å; T169-A173 PolarHBondContact O-N 3.39Å
170	G	90.1	Very high	91.1	Very high	43 Å²	43	77.2 Å²	77.2	44%	0.443	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-43.3	174.9	0	0	0	0	0	113	V166 T167 S168 A173 A174	V166-G170 PolarHBondContact O-N 3Å; T167-G170 PolarHBondContact O-N 3.21Å; S168-G170 VanDerWaalsContact C-N 3.33Å; S168-G170 PolarHBondContact O-N 3.41Å; G170-A173 PolarHBondContact O-N 2.91Å; G170-A174 PolarHBondContact O-N 3.24Å
171	A	90.7	Very high	91.1	Very high	60 Å²	60	76.9 Å²	76.9	50%	0.496	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-43.1	175.7	0	0	0	0	0	112	T167 S168 A174 A175	T167-A171 PolarHBondContact O-N 2.84Å; S168-A171 PolarHBondContact O-N 3.42Å; A171-A174 PolarHBondContact O-N 2.94Å; A171-A175 WeakPolarHBondContact O-CB 3.33Å; A171-A175 PolarHBondContact O-N 2.94Å
172	N	92.2	Very high	91.1	Very high	103 Å²	103	78 Å²	78	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-64.1	-41	176.5	-70.4	-25.9	0	0	0	112.1	S168 T169 A175 A176	S168-N172 WeakPolarHBondContact O-CB 3.42Å; S168-N172 VanDerWaalsContact O-CG 3.28Å; S168-N172 PolarHBondContact O-N 2.93Å; S168-N172 PolarHBondContact O-ND2 3Å; T169-N172 PolarHBondContact O-N 3.29Å; N172-A175 PolarHBondContact O-N 2.89Å; N172-A176 WeakPolarHBondContact O-CB 3.45Å; N172-A176 PolarHBondContact O-N 2.9Å
173	A	89.8	Confident	91.2	Very high	65 Å²	65	76.8 Å²	76.8	54%	0.537	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-40.7	175.4	0	0	0	0	0	112	T169 G170 G177	T169-A173 WeakPolarHBondContact O-CB 3.49Å; T169-A173 PolarHBondContact O-N 3.39Å; G170-A173 PolarHBondContact O-N 2.91Å; A173-G177 PolarHBondContact O-N 3.4Å
174	A	92.4	Very high	91.2	Very high	66 Å²	66	75.9 Å²	75.9	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-44.6	175.2	0	0	0	0	0	111.9	G170 A171 G177 Q178	G170-A174 PolarHBondContact O-N 3.24Å; A171-A174 PolarHBondContact O-N 2.94Å; A174-G177 PolarHBondContact O-N 3.26Å; A174-Q178 PolarHBondContact O-N 3.31Å
175	A	91.7	Very high	91.5	Very high	54 Å²	54	72.2 Å²	72.2	45%	0.446	49%	0.491	S	S	.	.	H	α-helix	trans	-61.7	-45.2	176.4	0	0	0	0	0	111.8	A171 N172 G177 Q178 S179	A171-A175 WeakPolarHBondContact O-CB 3.33Å; A171-A175 PolarHBondContact O-N 2.94Å; N172-A175 PolarHBondContact O-N 2.89Å; A175-G177 VanDerWaalsContact C-N 3.32Å; A175-G177 PolarHBondContact O-N 2.92Å; A175-Q178 PolarHBondContact O-N 3.13Å; A175-S179 PolarHBondContact O-N 2.97Å; A175-S179 PolarHBondContact O-OG 3.49Å
176	A	89.4	Confident	91.6	Very high	60 Å²	60	75.3 Å²	75.3	50%	0.496	50%	0.496	S	S	.	.	H	α-helix	trans	-61.7	-40.1	175.2	0	0	0	0	0	112	N172 S179 A180	N172-A176 WeakPolarHBondContact O-CB 3.45Å; N172-A176 PolarHBondContact O-N 2.9Å; A176-S179 PolarHBondContact O-N 3.44Å; A176-A180 WeakPolarHBondContact O-CB 3.45Å; A176-A180 PolarHBondContact O-N 3.46Å
177	G	92.1	Very high	91.7	Very high	35 Å²	35	73.6 Å²	73.6	36%	0.361	49%	0.492	S	S	.	.	H	α-helix	trans	-60.8	-43.1	173.8	0	0	0	0	0	112.8	A173 A174 A175 A180 Q181	A173-G177 PolarHBondContact O-N 3.4Å; A174-G177 PolarHBondContact O-N 3.26Å; A175-G177 VanDerWaalsContact C-N 3.32Å; A175-G177 PolarHBondContact O-N 2.92Å; G177-A180 PolarHBondContact O-N 2.9Å; G177-Q181 WeakPolarHBondContact O-CG 3.39Å; G177-Q181 PolarHBondContact O-N 3.22Å; G177-Q181 VanDerWaalsContact O-N 3.13Å
178	Q	92.4	Very high	91.8	Very high	95 Å²	95	77 Å²	77	44%	0.444	49%	0.493	S	S	.	.	H	α-helix	trans	-66	-47.7	176.1	-172.2	61.2	48.1	0	0	111.6	A174 A175 A180 Q181 D182	A174-Q178 PolarHBondContact O-N 3.31Å; A175-Q178 PolarHBondContact O-N 3.13Å; Q178-A180 VanDerWaalsContact C-N 3.26Å; Q178-A180 PolarHBondContact O-N 3.48Å; Q178-Q181 WeakPolarHBondContact O-CB 3.25Å; Q178-Q181 PolarHBondContact O-N 3.2Å; Q178-D182 PolarHBondContact NE2-OD1 3.18Å; Q178-D182 VanDerWaalsContact O-CG 3.32Å; Q178-D182 PolarHBondContact O-N 2.94Å
179	S	92.7	Very high	91.8	Very high	76 Å²	76	76.9 Å²	76.9	53%	0.531	50%	0.497	S	S	.	.	H	α-helix	trans	-59.8	-36.3	177.5	-61.1	0	0	0	0	112.5	A175 A176 D182 A183	A175-S179 PolarHBondContact O-N 2.97Å; A175-S179 PolarHBondContact O-OG 3.49Å; A176-S179 PolarHBondContact O-N 3.44Å; S179-D182 PolarHBondContact O-N 3.27Å; S179-A183 VanDerWaalsContact O-CB 3.29Å; S179-A183 WeakPolarHBondContact O-CB 3.25Å; S179-A183 PolarHBondContact O-N 3.38Å
180	A	91.6	Very high	91.9	Very high	62 Å²	62	75.5 Å²	75.5	51%	0.512	49%	0.494	S	S	.	.	H	α-helix	trans	-66.2	-38.2	174	0	0	0	0	0	112.4	A176 G177 Q178 A184	A176-A180 WeakPolarHBondContact O-CB 3.45Å; A176-A180 PolarHBondContact O-N 3.46Å; G177-A180 PolarHBondContact O-N 2.9Å; Q178-A180 VanDerWaalsContact C-N 3.26Å; Q178-A180 PolarHBondContact O-N 3.48Å; A180-A184 WeakPolarHBondContact O-CB 3.49Å; A180-A184 PolarHBondContact O-N 2.68Å
181	Q	92.7	Very high	91.9	Very high	131 Å²	131	77.8 Å²	77.8	61%	0.612	49%	0.493	S	S	*	.	H	α-helix	trans	-67	-43.6	174.4	-73	-178.4	2	0	0	112	G177 Q178 A184 G185	G177-Q181 WeakPolarHBondContact O-CG 3.39Å; G177-Q181 PolarHBondContact O-N 3.22Å; G177-Q181 VanDerWaalsContact O-N 3.13Å; Q178-Q181 WeakPolarHBondContact O-CB 3.25Å; Q178-Q181 PolarHBondContact O-N 3.2Å; Q181-A184 PolarHBondContact O-N 3.32Å; Q181-G185 PolarHBondContact O-N 3.13Å
182	D	92.1	Very high	92	Very high	72 Å²	72	79.9 Å²	79.9	39%	0.385	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-46.5	178	-64	-15.2	0	0	0	110.6	Q178 S179 A184 G185 Y186	Q178-D182 PolarHBondContact NE2-OD1 3.18Å; Q178-D182 VanDerWaalsContact O-CG 3.32Å; Q178-D182 PolarHBondContact O-N 2.94Å; S179-D182 PolarHBondContact O-N 3.27Å; D182-A184 VanDerWaalsContact C-N 3.31Å; D182-A184 PolarHBondContact O-N 2.74Å; D182-G185 WeakPolarHBondContact O-CA 3.4Å; D182-G185 PolarHBondContact O-N 2.84Å; D182-Y186 HydrophobicContact CB-CE2 4.12Å; D182-Y186 WeakPolarHBondContact O-CD2 3.29Å; D182-Y186 PolarHBondContact O-N 3.02Å
183	A	91.1	Very high	92.1	Very high	58 Å²	58	77.1 Å²	77.1	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-57.8	-42.1	174.7	0	0	0	0	0	112.2	S179 G185 Y186 A187	S179-A183 VanDerWaalsContact O-CB 3.29Å; S179-A183 WeakPolarHBondContact O-CB 3.25Å; S179-A183 PolarHBondContact O-N 3.38Å; A183-G185 VanDerWaalsContact C-N 3.3Å; A183-G185 PolarHBondContact O-N 2.8Å; A183-Y186 PolarHBondContact O-N 3.05Å; A183-A187 WeakPolarHBondContact O-CB 3.44Å; A183-A187 PolarHBondContact O-N 2.93Å
184	A	91.2	Very high	92.2	Very high	36 Å²	36	80 Å²	80	30%	0.298	49%	0.485	S	S	.	.	H	α-helix	trans	-66.8	-31.3	174.4	0	0	0	0	0	112.5	A180 Q181 D182 R188	A180-A184 WeakPolarHBondContact O-CB 3.49Å; A180-A184 PolarHBondContact O-N 2.68Å; Q181-A184 PolarHBondContact O-N 3.32Å; D182-A184 VanDerWaalsContact C-N 3.31Å; D182-A184 PolarHBondContact O-N 2.74Å; A184-R188 VanDerWaalsContact C-NH1 3.27Å; A184-R188 WeakPolarHBondContact O-CG 3.47Å; A184-R188 PolarHBondContact O-N 2.89Å; A184-R188 PolarHBondContact O-NH1 3.43Å
185	G	93.3	Very high	92	Very high	36 Å²	36	80.4 Å²	80.4	37%	0.371	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-50.2	171.9	0	0	0	0	0	112.1	Q181 D182 A183 A187 R188 A189	Q181-G185 PolarHBondContact O-N 3.13Å; D182-G185 WeakPolarHBondContact O-CA 3.4Å; D182-G185 PolarHBondContact O-N 2.84Å; A183-G185 VanDerWaalsContact C-N 3.3Å; A183-G185 PolarHBondContact O-N 2.8Å; G185-A187 PolarHBondContact O-N 3.48Å; G185-R188 PolarHBondContact O-N 2.89Å; G185-A189 PolarHBondContact O-N 3.25Å
186	Y	93.3	Very high	91.8	Very high	175 Å²	175	82.1 Å²	82.1	69%	0.686	48%	0.48	S	S	*	.	H	α-helix	trans	-61.7	-40.5	178	-65.1	-54.5	0	0	0	112.7	D182 A183 R188 A189 A190	D182-Y186 HydrophobicContact CB-CE2 4.12Å; D182-Y186 WeakPolarHBondContact O-CD2 3.29Å; D182-Y186 PolarHBondContact O-N 3.02Å; A183-Y186 PolarHBondContact O-N 3.05Å; Y186-R188 PolarHBondContact O-N 2.89Å; Y186-A189 PolarHBondContact O-N 3.47Å; Y186-A190 WeakPolarHBondContact O-CB 3.38Å; Y186-A190 PolarHBondContact O-N 3.16Å
187	A	93.2	Very high	91.5	Very high	62 Å²	62	84.5 Å²	84.5	51%	0.512	48%	0.483	S	S	.	.	H	α-helix	trans	-61.3	-41.9	176.5	0	0	0	0	0	112.4	A183 G185 A190 E191	A183-A187 WeakPolarHBondContact O-CB 3.44Å; A183-A187 PolarHBondContact O-N 2.93Å; G185-A187 PolarHBondContact O-N 3.48Å; A187-A190 PolarHBondContact O-N 3.19Å; A187-E191 PolarHBondContact O-N 3.28Å
188	R	93.3	Very high	90.8	Very high	173 Å²	173	87.7 Å²	87.7	65%	0.653	49%	0.492	S	S	*	.	H	α-helix	trans	-66.1	-40.5	175.8	-70.4	-179.8	-166.6	98.4	-6.1	112.1	A184 G185 Y186 A190 E191 Q192	A184-R188 VanDerWaalsContact C-NH1 3.27Å; A184-R188 WeakPolarHBondContact O-CG 3.47Å; A184-R188 PolarHBondContact O-N 2.89Å; A184-R188 PolarHBondContact O-NH1 3.43Å; G185-R188 PolarHBondContact O-N 2.89Å; Y186-R188 PolarHBondContact O-N 2.89Å; R188-A190 VanDerWaalsContact C-N 3.33Å; R188-E191 PolarHBondContact O-N 2.86Å; R188-Q192 WeakPolarHBondContact O-CB 3.46Å; R188-Q192 PolarHBondContact O-N 3.33Å
189	A	92.3	Very high	90.2	Very high	61 Å²	61	86.2 Å²	86.2	50%	0.504	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-40.4	176.4	0	0	0	0	0	111.8	G185 Y186 Q192 A193	G185-A189 PolarHBondContact O-N 3.25Å; Y186-A189 PolarHBondContact O-N 3.47Å; A189-Q192 PolarHBondContact O-N 2.95Å; A189-A193 WeakPolarHBondContact O-CB 3.31Å; A189-A193 PolarHBondContact O-N 3.43Å
190	A	92.1	Very high	89.5	Confident	62 Å²	62	85.3 Å²	85.3	51%	0.512	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.1	0	0	0	0	0	112.4	Y186 A187 R188 Q192 A193 K194	Y186-A190 WeakPolarHBondContact O-CB 3.38Å; Y186-A190 PolarHBondContact O-N 3.16Å; A187-A190 PolarHBondContact O-N 3.19Å; R188-A190 VanDerWaalsContact C-N 3.33Å; A190-Q192 VanDerWaalsContact C-N 3.33Å; A190-Q192 PolarHBondContact O-N 3.34Å; A190-A193 PolarHBondContact O-N 2.85Å; A190-K194 PolarHBondContact O-N 2.84Å
191	E	90.7	Very high	88.7	Confident	92 Å²	92	87 Å²	87	43%	0.43	49%	0.493	S	S	.	.	H	α-helix	trans	-64.6	-38.7	176.4	-164	66.4	-145.9	0	0	111.5	A187 R188 K194 N195	A187-E191 PolarHBondContact O-N 3.28Å; R188-E191 PolarHBondContact O-N 2.86Å; E191-K194 PolarHBondContact O-N 2.85Å; E191-K194 IonicContact OE1-NZ 2.63Å; E191-K194 PolarHBondContact OE1-NZ 3.01Å; E191-K194 IonicContact OE2-NZ 3.9Å; E191-N195 VanDerWaalsContact O-CG 3.29Å; E191-N195 PolarHBondContact O-N 3.26Å; E191-N195 PolarHBondContact O-ND2 2.82Å
192	Q	93.3	Very high	87.5	Confident	103 Å²	103	83.4 Å²	83.4	48%	0.481	48%	0.48	S	S	.	.	H	α-helix	trans	-62.8	-47.3	174.1	-174.2	60.8	49.2	0	0	111.4	R188 A189 A190 K194 N195 D196	R188-Q192 WeakPolarHBondContact O-CB 3.46Å; R188-Q192 PolarHBondContact O-N 3.33Å; A189-Q192 PolarHBondContact O-N 2.95Å; A190-Q192 VanDerWaalsContact C-N 3.33Å; A190-Q192 PolarHBondContact O-N 3.34Å; Q192-K194 VanDerWaalsContact C-N 3.29Å; Q192-K194 PolarHBondContact O-N 3.49Å; Q192-N195 PolarHBondContact O-N 3.2Å; Q192-N195 VanDerWaalsContact O-N 3.11Å; Q192-D196 PolarHBondContact NE2-OD1 2.86Å; Q192-D196 VanDerWaalsContact O-CG 3.22Å; Q192-D196 PolarHBondContact O-N 3.25Å
193	A	93.3	Very high	86	Confident	46 Å²	46	81.3 Å²	81.3	38%	0.38	48%	0.475	S	S	.	.	H	α-helix	trans	-59.6	-39.7	178.5	0	0	0	0	0	112.2	A189 A190 D196 I197	A189-A193 WeakPolarHBondContact O-CB 3.31Å; A189-A193 PolarHBondContact O-N 3.43Å; A190-A193 PolarHBondContact O-N 2.85Å; A193-D196 PolarHBondContact O-N 3.31Å; A193-I197 VanDerWaalsContact O-CG1 3.27Å; A193-I197 WeakPolarHBondContact O-CG1 3.04Å; A193-I197 PolarHBondContact O-N 3.37Å
194	K	92.1	Very high	84.7	Confident	124 Å²	124	82.8 Å²	82.8	54%	0.539	48%	0.478	S	S	.	.	H	α-helix	trans	-61.8	-45.8	173.8	176.2	-173.8	153.7	-145.7	0	111.8	A190 E191 Q192 D196 I197 D198	A190-K194 PolarHBondContact O-N 2.84Å; E191-K194 PolarHBondContact O-N 2.85Å; E191-K194 IonicContact OE1-NZ 2.63Å; E191-K194 PolarHBondContact OE1-NZ 3.01Å; E191-K194 IonicContact OE2-NZ 3.9Å; Q192-K194 VanDerWaalsContact C-N 3.29Å; Q192-K194 PolarHBondContact O-N 3.49Å; K194-D196 VanDerWaalsContact C-N 3.34Å; K194-D196 PolarHBondContact O-N 3.32Å; K194-I197 PolarHBondContact O-N 3.2Å; K194-D198 PolarHBondContact O-N 2.9Å
195	N	88.8	Confident	83	Confident	75 Å²	75	87.4 Å²	87.4	40%	0.401	50%	0.497	S	S	.	.	H	α-helix	trans	-64.5	-38.4	177.7	-68.7	-29.5	0	0	0	112.1	E191 Q192 D198 A199	E191-N195 VanDerWaalsContact O-CG 3.29Å; E191-N195 PolarHBondContact O-N 3.26Å; E191-N195 PolarHBondContact O-ND2 2.82Å; Q192-N195 PolarHBondContact O-N 3.2Å; Q192-N195 VanDerWaalsContact O-N 3.11Å; N195-D198 PolarHBondContact O-N 2.81Å; N195-A199 WeakPolarHBondContact O-CB 3.38Å; N195-A199 PolarHBondContact O-N 3.32Å
196	D	87.7	Confident	81.2	Confident	91 Å²	91	93.3 Å²	93.3	49%	0.487	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-40.7	176.5	-65.6	-20.3	0	0	0	111.3	Q192 A193 K194 A200	Q192-D196 PolarHBondContact NE2-OD1 2.86Å; Q192-D196 VanDerWaalsContact O-CG 3.22Å; Q192-D196 PolarHBondContact O-N 3.25Å; A193-D196 PolarHBondContact O-N 3.31Å; K194-D196 VanDerWaalsContact C-N 3.34Å; K194-D196 PolarHBondContact O-N 3.32Å; D196-A200 WeakPolarHBondContact O-CB 3.11Å; D196-A200 PolarHBondContact O-N 3.02Å
197	I	81.5	Confident	79.1	Confident	110 Å²	110	90.1 Å²	90.1	56%	0.564	51%	0.505	S	S	*	.	H	α-helix	trans	-63.7	-46.3	173.9	-70	165	0	0	0	110.7	A193 K194 A199 A200 L201	A193-I197 VanDerWaalsContact O-CG1 3.27Å; A193-I197 WeakPolarHBondContact O-CG1 3.04Å; A193-I197 PolarHBondContact O-N 3.37Å; K194-I197 PolarHBondContact O-N 3.2Å; I197-A199 VanDerWaalsContact C-N 3.34Å; I197-A199 PolarHBondContact O-N 3Å; I197-A200 PolarHBondContact O-N 3.4Å; I197-L201 WeakPolarHBondContact O-CB 3.22Å; I197-L201 PolarHBondContact O-N 3.26Å
198	D	78.5	Confident	77.1	Confident	101 Å²	101	91.6 Å²	91.6	54%	0.54	52%	0.518	S	S	.	.	H	α-helix	trans	-66.4	-37.5	-178.2	-160.3	54.8	0	0	0	112	K194 N195 L201 T202	K194-D198 PolarHBondContact O-N 2.9Å; N195-D198 PolarHBondContact O-N 2.81Å; D198-L201 PolarHBondContact O-N 3.44Å; D198-T202 WeakPolarHBondContact O-CB 3.44Å; D198-T202 PolarHBondContact O-N 2.99Å; D198-T202 PolarHBondContact O-OG1 3.29Å
199	A	78.7	Confident	75.3	Confident	65 Å²	65	88.1 Å²	88.1	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-43.7	171.9	0	0	0	0	0	111.7	N195 I197 G203	N195-A199 WeakPolarHBondContact O-CB 3.38Å; N195-A199 PolarHBondContact O-N 3.32Å; I197-A199 VanDerWaalsContact C-N 3.34Å; I197-A199 PolarHBondContact O-N 3Å; A199-G203 PolarHBondContact O-N 2.96Å
200	A	78.3	Confident	74.1	Confident	56 Å²	56	88.1 Å²	88.1	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-44.2	176	0	0	0	0	0	111.7	D196 I197 T204	D196-A200 WeakPolarHBondContact O-CB 3.11Å; D196-A200 PolarHBondContact O-N 3.02Å; I197-A200 PolarHBondContact O-N 3.4Å; A200-T204 WeakPolarHBondContact O-CB 3.32Å; A200-T204 PolarHBondContact O-N 2.9Å; A200-T204 PolarHBondContact O-OG1 3.04Å
201	L	74.4	Confident	73.1	Confident	98 Å²	98	91.6 Å²	91.6	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-46.3	178.2	-131.4	88.9	0	0	0	111	I197 D198 T204 L205	I197-L201 WeakPolarHBondContact O-CB 3.22Å; I197-L201 PolarHBondContact O-N 3.26Å; D198-L201 PolarHBondContact O-N 3.44Å; L201-T204 PolarHBondContact O-N 3.37Å; L201-L205 HydrophobicContact CD2-CD1 3.81Å; L201-L205 HydrophobicContact CG-CD1 3.76Å; L201-L205 WeakPolarHBondContact O-CB 3.43Å; L201-L205 WeakPolarHBondContact O-CG 3.44Å; L201-L205 PolarHBondContact O-N 2.81Å
202	T	67.7	Low	72.3	Confident	56 Å²	56	89.9 Å²	89.9	34%	0.344	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-45.4	178.6	-65	0	0	0	0	110.9	D198 K206	D198-T202 WeakPolarHBondContact O-CB 3.44Å; D198-T202 PolarHBondContact O-N 2.99Å; D198-T202 PolarHBondContact O-OG1 3.29Å; T202-K206 HydrophobicContact CG2-CD 3.86Å; T202-K206 HydrophobicContact CG2-CG 4.34Å; T202-K206 WeakPolarHBondContact O-CB 3.27Å; T202-K206 PolarHBondContact O-N 3.46Å
203	G	61.4	Low	71.3	Confident	27 Å²	27	89.5 Å²	89.5	28%	0.278	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-49.3	176.2	0	0	0	0	0	112.2	A199 M207	A199-G203 PolarHBondContact O-N 2.96Å; G203-M207 WeakPolarHBondContact O-CB 3.31Å; G203-M207 WeakPolarHBondContact O-CE 3.48Å; G203-M207 WeakPolarHBondContact O-CG 3.37Å; G203-M207 PolarHBondContact O-N 2.99Å
204	T	64	Low	70.6	Confident	89 Å²	89	89.7 Å²	89.7	55%	0.546	50%	0.501	S	S	.	.	H	α-helix	trans	-72	-34	-175.1	-50.6	0	0	0	0	112.7	A200 L201 H210	A200-T204 WeakPolarHBondContact O-CB 3.32Å; A200-T204 PolarHBondContact O-N 2.9Å; A200-T204 PolarHBondContact O-OG1 3.04Å; L201-T204 PolarHBondContact O-N 3.37Å; T204-H210 PolarHBondContact O-CD2 3.3Å
205	L	55.4	Low	70	Confident	133 Å²	133	86.3 Å²	86.3	70%	0.696	50%	0.496	S	S	*	.	H	α-helix	trans	-92.3	-31.4	-177.7	-64.7	172.7	0	0	0	113.3	L201	L201-L205 HydrophobicContact CD2-CD1 3.81Å; L201-L205 HydrophobicContact CG-CD1 3.76Å; L201-L205 WeakPolarHBondContact O-CB 3.43Å; L201-L205 WeakPolarHBondContact O-CG 3.44Å; L201-L205 PolarHBondContact O-N 2.81Å
206	K	56	Low	69.6	Low	161 Å²	161	86.9 Å²	86.9	70%	0.7	51%	0.511	S	S	*	.	H	α-helix	trans	-89.6	-13.8	-178.8	-69.5	-169.5	-178.3	166.8	0	115	T202 A208	T202-K206 HydrophobicContact CG2-CD 3.86Å; T202-K206 HydrophobicContact CG2-CG 4.34Å; T202-K206 WeakPolarHBondContact O-CB 3.27Å; T202-K206 PolarHBondContact O-N 3.46Å; K206-A208 VanDerWaalsContact C-N 3.26Å; K206-A208 PolarHBondContact O-N 2.92Å
207	M	48.7	Very low	69.5	Low	108 Å²	108	85.9 Å²	85.9	53%	0.532	52%	0.515	S	S	.	.			trans	-65.3	94.9	171.1	-83.5	-172.4	-92.5	0	0	108.6	G203 N209 H210	G203-M207 WeakPolarHBondContact O-CB 3.31Å; G203-M207 WeakPolarHBondContact O-CE 3.48Å; G203-M207 WeakPolarHBondContact O-CG 3.37Å; G203-M207 PolarHBondContact O-N 2.99Å; M207-N209 PolarHBondContact O-N 3.35Å; M207-H210 PolarHBondContact O-CD2 2.89Å; M207-H210 PolarHBondContact O-N 3.3Å
208	A	51.4	Low	69.8	Low	93 Å²	93	82 Å²	82	77%	0.769	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-0.1	175.8	0	0	0	0	0	113.8	K206	K206-A208 VanDerWaalsContact C-N 3.26Å; K206-A208 PolarHBondContact O-N 2.92Å
209	N	55.4	Low	70.1	Confident	100 Å²	100	84.9 Å²	84.9	54%	0.535	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-16.2	173.3	-94.3	-10	0	0	0	114.8	M207 L211 S212 E213	M207-N209 PolarHBondContact O-N 3.35Å; N209-L211 VanDerWaalsContact C-N 3.28Å; N209-L211 PolarHBondContact O-N 3.28Å; N209-S212 VanDerWaalsContact CA-OG 3.32Å; N209-S212 WeakPolarHBondContact CA-OG 3.47Å; N209-S212 PolarHBondContact O-N 3.26Å; N209-S212 PolarHBondContact O-OG 3.31Å; N209-S212 PolarHBondContact OD1-OG 2.91Å; N209-E213 HydrophobicContact CB-CG 4.5Å; N209-E213 VanDerWaalsContact O-CB 3.27Å; N209-E213 WeakPolarHBondContact O-CB 3.49Å; N209-E213 WeakPolarHBondContact O-CG 2.92Å; N209-E213 PolarHBondContact O-N 3.49Å
210	H	66.2	Low	70.4	Confident	61 Å²	61	89.7 Å²	89.7	28%	0.282	52%	0.521	S	S	.	.	H	α-helix	trans	-67.3	-31.7	-176.9	-66.1	-50.5	0	0	0	112.8	T204 M207 E213 I214	T204-H210 PolarHBondContact O-CD2 3.3Å; M207-H210 PolarHBondContact O-CD2 2.89Å; M207-H210 PolarHBondContact O-N 3.3Å; H210-E213 IonicContact CE1-OE2 3.75Å; H210-E213 IonicContact CG-OE2 3.57Å; H210-E213 IonicContact ND1-OE2 3.57Å; H210-E213 PolarHBondContact ND1-OE2 2.95Å; H210-E213 PolarHBondContact O-N 3.43Å; H210-I214 WeakPolarHBondContact O-CB 3.32Å; H210-I214 WeakPolarHBondContact O-CD1 3.46Å; H210-I214 WeakPolarHBondContact O-CG1 3.47Å; H210-I214 PolarHBondContact O-N 3.36Å
211	L	71.5	Confident	70.8	Confident	135 Å²	135	88.4 Å²	88.4	71%	0.707	51%	0.511	S	S	*	.	H	α-helix	trans	-68.9	-40.2	173.9	-67.9	176.4	0	0	0	112	N209 I214 A215	N209-L211 VanDerWaalsContact C-N 3.28Å; N209-L211 PolarHBondContact O-N 3.28Å; L211-I214 PolarHBondContact O-N 2.94Å; L211-A215 WeakPolarHBondContact O-CB 3.09Å; L211-A215 PolarHBondContact O-N 3.32Å
212	S	74.1	Confident	71.4	Confident	55 Å²	55	86.7 Å²	86.7	39%	0.385	50%	0.5	S	S	.	.	H	α-helix	trans	-70.7	-33.6	175.3	57.2	0	0	0	0	111.9	N209 A215 A216	N209-S212 VanDerWaalsContact CA-OG 3.32Å; N209-S212 WeakPolarHBondContact CA-OG 3.47Å; N209-S212 PolarHBondContact O-N 3.26Å; N209-S212 PolarHBondContact O-OG 3.31Å; N209-S212 PolarHBondContact OD1-OG 2.91Å; S212-A215 WeakPolarHBondContact O-CB 3.38Å; S212-A215 PolarHBondContact O-N 3.11Å; S212-A216 VanDerWaalsContact O-CB 3.28Å; S212-A216 WeakPolarHBondContact O-CB 3.41Å; S212-A216 PolarHBondContact O-N 3.49Å
213	E	73.1	Confident	72.1	Confident	96 Å²	96	87.7 Å²	87.7	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-66.8	-43.7	171.9	-74.6	167.7	-166.2	0	0	111.5	N209 H210 A215 A216 A217	N209-E213 HydrophobicContact CB-CG 4.5Å; N209-E213 VanDerWaalsContact O-CB 3.27Å; N209-E213 WeakPolarHBondContact O-CB 3.49Å; N209-E213 WeakPolarHBondContact O-CG 2.92Å; N209-E213 PolarHBondContact O-N 3.49Å; H210-E213 IonicContact CE1-OE2 3.75Å; H210-E213 IonicContact CG-OE2 3.57Å; H210-E213 IonicContact ND1-OE2 3.57Å; H210-E213 PolarHBondContact ND1-OE2 2.95Å; H210-E213 PolarHBondContact O-N 3.43Å; E213-A215 VanDerWaalsContact C-N 3.28Å; E213-A215 PolarHBondContact O-N 3.36Å; E213-A216 CarbonylContact O-C 3.55Å; E213-A216 PolarHBondContact O-N 3.42Å; E213-A217 WeakPolarHBondContact O-CB 3.33Å; E213-A217 PolarHBondContact O-N 2.92Å
214	I	78.5	Confident	73.2	Confident	50 Å²	50	92.5 Å²	92.5	26%	0.256	51%	0.514	S	S	.	.	H	α-helix	trans	-61	-41.8	173	-71.8	162.6	0	0	0	109.9	H210 L211 A217 A221 Q222	H210-I214 WeakPolarHBondContact O-CB 3.32Å; H210-I214 WeakPolarHBondContact O-CD1 3.46Å; H210-I214 WeakPolarHBondContact O-CG1 3.47Å; H210-I214 PolarHBondContact O-N 3.36Å; L211-I214 PolarHBondContact O-N 2.94Å; I214-A217 PolarHBondContact O-N 3.31Å; I214-A221 HydrophobicContact CG2-CB 4.46Å; I214-Q222 HydrophobicContact CG2-CB 4.44Å; I214-Q222 HydrophobicContact CG2-CG 4.12Å; I214-Q222 WeakPolarHBondContact O-CG 3.38Å
215	A	78.9	Confident	74.2	Confident	52 Å²	52	89.7 Å²	89.7	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-45.6	175.3	0	0	0	0	0	111.5	L211 S212 E213 G218 Q222	L211-A215 WeakPolarHBondContact O-CB 3.09Å; L211-A215 PolarHBondContact O-N 3.32Å; S212-A215 WeakPolarHBondContact O-CB 3.38Å; S212-A215 PolarHBondContact O-N 3.11Å; E213-A215 VanDerWaalsContact C-N 3.28Å; E213-A215 PolarHBondContact O-N 3.36Å; A215-G218 PolarHBondContact O-N 3.03Å; A215-Q222 PolarHBondContact O-NE2 2.87Å
216	A	81.3	Confident	75.7	Confident	88 Å²	88	85.7 Å²	85.7	73%	0.727	47%	0.474	S	S	*	.	H	α-helix	trans	-71.6	-28	179	0	0	0	0	0	113.7	S212 E213 G218	S212-A216 VanDerWaalsContact O-CB 3.28Å; S212-A216 WeakPolarHBondContact O-CB 3.41Å; S212-A216 PolarHBondContact O-N 3.49Å; E213-A216 CarbonylContact O-C 3.55Å; E213-A216 PolarHBondContact O-N 3.42Å; A216-G218 PolarHBondContact O-N 2.9Å
217	A	84.4	Confident	77	Confident	69 Å²	69	82.4 Å²	82.4	57%	0.57	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-2.6	179	0	0	0	0	0	113.4	E213 I214 A221	E213-A217 WeakPolarHBondContact O-CB 3.33Å; E213-A217 PolarHBondContact O-N 2.92Å; I214-A217 PolarHBondContact O-N 3.31Å; A217-A221 HydrophobicContact CB-CB 3.56Å
218	G	87.7	Confident	78.7	Confident	28 Å²	28	84.1 Å²	84.1	29%	0.289	48%	0.475	S	S	.	.			trans	90.9	174.9	171.6	0	0	0	0	0	114.7	A215 A216 K220 A221 Q222	A215-G218 PolarHBondContact O-N 3.03Å; A216-G218 PolarHBondContact O-N 2.9Å; G218-K220 PolarHBondContact O-N 3.05Å; G218-K220 VanDerWaalsContact O-N 3.11Å; G218-A221 PolarHBondContact O-N 2.98Å; G218-Q222 PolarHBondContact O-N 2.93Å
219	E	84.8	Confident	80.4	Confident	163 Å²	163	85.5 Å²	85.5	76%	0.762	47%	0.469	S	S	*	.	H	α-helix	trans	-55.5	-35.5	-169.4	-65.9	179.9	174.6	0	0	113.9	Q222 Q223	E219-Q222 PolarHBondContact O-N 3.04Å; E219-Q223 WeakPolarHBondContact O-CB 3.34Å; E219-Q223 PolarHBondContact O-N 2.79Å
220	K	86.1	Confident	81.8	Confident	165 Å²	165	83.5 Å²	83.5	72%	0.717	47%	0.472	S	S	*	.	H	α-helix	trans	-66.2	-38.3	179.2	-169.7	176.6	-175	175.7	0	112.5	G218 K224	G218-K220 PolarHBondContact O-N 3.05Å; G218-K220 VanDerWaalsContact O-N 3.11Å; K220-K224 PolarHBondContact O-N 3.38Å; K220-K224 VanDerWaalsContact O-N 3.09Å
221	A	85.2	Confident	82.8	Confident	29 Å²	29	84.2 Å²	84.2	24%	0.24	48%	0.477	C	S	.	.	H	α-helix	trans	-70.1	-42.9	176.7	0	0	0	0	0	110.5	I214 A217 G218 Q223 K224 S225	I214-A221 HydrophobicContact CG2-CB 4.46Å; A217-A221 HydrophobicContact CB-CB 3.56Å; G218-A221 PolarHBondContact O-N 2.98Å; A221-Q223 PolarHBondContact O-N 3.41Å; A221-K224 PolarHBondContact O-N 3.42Å; A221-S225 WeakPolarHBondContact O-CB 3.47Å; A221-S225 PolarHBondContact O-N 3.4Å
222	Q	86.6	Confident	83.5	Confident	63 Å²	63	86.2 Å²	86.2	29%	0.294	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-42	175.3	-58.9	174.2	19.8	0	0	111.9	I214 A215 G218 E219 S225 R226	I214-Q222 HydrophobicContact CG2-CB 4.44Å; I214-Q222 HydrophobicContact CG2-CG 4.12Å; I214-Q222 WeakPolarHBondContact O-CG 3.38Å; A215-Q222 PolarHBondContact O-NE2 2.87Å; G218-Q222 PolarHBondContact O-N 2.93Å; E219-Q222 PolarHBondContact O-N 3.04Å; Q222-S225 WeakPolarHBondContact O-CB 3.32Å; Q222-S225 PolarHBondContact O-N 3.49Å; Q222-R226 WeakPolarHBondContact O-CG 3.19Å; Q222-R226 PolarHBondContact O-N 2.87Å
223	Q	84.2	Confident	83.9	Confident	77 Å²	77	87.5 Å²	87.5	36%	0.36	49%	0.489	S	S	.	.	H	α-helix	trans	-64.4	-47.1	176.7	-173.8	59.9	47.7	0	0	111.7	E219 A221 S225 R226 D227	E219-Q223 WeakPolarHBondContact O-CB 3.34Å; E219-Q223 PolarHBondContact O-N 2.79Å; A221-Q223 PolarHBondContact O-N 3.41Å; Q223-S225 VanDerWaalsContact C-N 3.26Å; Q223-S225 PolarHBondContact O-N 3.28Å; Q223-R226 WeakPolarHBondContact O-CB 3.25Å; Q223-R226 PolarHBondContact O-N 3.45Å; Q223-D227 PolarHBondContact NE2-OD1 3.48Å; Q223-D227 PolarHBondContact O-N 3.04Å
224	K	83.9	Confident	84.4	Confident	128 Å²	128	85.3 Å²	85.3	56%	0.557	49%	0.487	S	S	*	.	H	α-helix	trans	-57.6	-40.5	174.2	-79.7	-175.5	173.1	-169.9	0	112.3	K220 A221 R226 D227 N228	K220-K224 PolarHBondContact O-N 3.38Å; K220-K224 VanDerWaalsContact O-N 3.09Å; A221-K224 PolarHBondContact O-N 3.42Å; K224-R226 VanDerWaalsContact C-N 3.34Å; K224-D227 PolarHBondContact O-N 3.34Å; K224-N228 WeakPolarHBondContact O-CB 3.18Å; K224-N228 VanDerWaalsContact O-CG 3.23Å; K224-N228 PolarHBondContact O-N 3.04Å; K224-N228 PolarHBondContact O-ND2 2.96Å
225	S	84.2	Confident	84.6	Confident	29 Å²	29	85.8 Å²	85.8	20%	0.203	50%	0.499	C	S	.	.	H	α-helix	trans	-63	-40.9	175.9	-171.2	0	0	0	0	111.7	A221 Q222 Q223 L229	A221-S225 WeakPolarHBondContact O-CB 3.47Å; A221-S225 PolarHBondContact O-N 3.4Å; Q222-S225 WeakPolarHBondContact O-CB 3.32Å; Q222-S225 PolarHBondContact O-N 3.49Å; Q223-S225 VanDerWaalsContact C-N 3.26Å; Q223-S225 PolarHBondContact O-N 3.28Å; S225-L229 VanDerWaalsContact O-CG 3.31Å; S225-L229 WeakPolarHBondContact O-CG 3.48Å; S225-L229 PolarHBondContact O-N 3.33Å
226	R	87.3	Confident	84.9	Confident	50 Å²	50	87.1 Å²	87.1	19%	0.189	50%	0.502	C	S	.	.	H	α-helix	trans	-65.1	-44.8	174.6	-73.5	-173.3	-64.1	-93.3	5.4	111.9	Q222 Q223 K224 N228 L229 G230 L231	Q222-R226 WeakPolarHBondContact O-CG 3.19Å; Q222-R226 PolarHBondContact O-N 2.87Å; Q223-R226 WeakPolarHBondContact O-CB 3.25Å; Q223-R226 PolarHBondContact O-N 3.45Å; K224-R226 VanDerWaalsContact C-N 3.34Å; R226-N228 VanDerWaalsContact C-N 3.34Å; R226-N228 PolarHBondContact O-N 3.18Å; R226-L229 CarbonylContact O-C 3.57Å; R226-L229 PolarHBondContact O-N 3.38Å; R226-L229 VanDerWaalsContact O-N 3.09Å; R226-G230 PolarHBondContact O-N 2.97Å; R226-G230 VanDerWaalsContact O-N 3.08Å; R226-L231 HydrophobicContact CB-CB 4.01Å; R226-L231 HydrophobicContact CG-CB 4.29Å; R226-L231 HydrophobicContact CG-CD1 4.36Å; R226-L231 PolarHBondContact O-N 3.02Å
227	D	84.2	Confident	85.2	Confident	92 Å²	92	86.4 Å²	86.4	49%	0.492	48%	0.484	S	S	.	.	H	α-helix	trans	-60.8	-43.3	179.2	-63.5	-23.3	0	0	0	111.2	Q223 K224 L229 G230	Q223-D227 PolarHBondContact NE2-OD1 3.48Å; Q223-D227 PolarHBondContact O-N 3.04Å; K224-D227 PolarHBondContact O-N 3.34Å; D227-L229 PolarHBondContact O-N 3.09Å; D227-G230 PolarHBondContact O-N 3.38Å
228	N	84.6	Confident	85.6	Confident	144 Å²	144	89.3 Å²	89.3	77%	0.77	49%	0.486	S	S	*	.	H	α-helix	trans	-63.9	-28.4	176	-72.7	-14.2	0	0	0	113.2	K224 R226 G230	K224-N228 WeakPolarHBondContact O-CB 3.18Å; K224-N228 VanDerWaalsContact O-CG 3.23Å; K224-N228 PolarHBondContact O-N 3.04Å; K224-N228 PolarHBondContact O-ND2 2.96Å; R226-N228 VanDerWaalsContact C-N 3.34Å; R226-N228 PolarHBondContact O-N 3.18Å; N228-G230 VanDerWaalsContact C-N 3.35Å
229	L	85.3	Confident	85.6	Confident	122 Å²	122	90.1 Å²	90.1	64%	0.639	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.5	175.2	-66.8	174.1	0	0	0	112.9	S225 R226 D227 L231	S225-L229 VanDerWaalsContact O-CG 3.31Å; S225-L229 WeakPolarHBondContact O-CG 3.48Å; S225-L229 PolarHBondContact O-N 3.33Å; R226-L229 CarbonylContact O-C 3.57Å; R226-L229 PolarHBondContact O-N 3.38Å; R226-L229 VanDerWaalsContact O-N 3.09Å; D227-L229 PolarHBondContact O-N 3.09Å; L229-L231 HydrophobicContact CB-CD1 4.02Å; L229-L231 HydrophobicContact CB-CG 3.79Å; L229-L231 HydrophobicContact CD1-CD1 3.9Å; L229-L231 PolarHBondContact O-N 3.23Å
230	G	85.9	Confident	85.8	Confident	57 Å²	57	84.5 Å²	84.5	59%	0.588	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	17.2	-173.4	0	0	0	0	0	114	R226 D227 N228 K232	R226-G230 PolarHBondContact O-N 2.97Å; R226-G230 VanDerWaalsContact O-N 3.08Å; D227-G230 PolarHBondContact O-N 3.38Å; N228-G230 VanDerWaalsContact C-N 3.35Å; G230-K232 PolarHBondContact O-N 2.97Å
231	L	87	Confident	85.7	Confident	77 Å²	77	80.3 Å²	80.3	40%	0.403	46%	0.455	S	S	.	.			trans	-78.6	118.8	179.3	-62.2	177.4	0	0	0	110.2	R226 L229 A235	R226-L231 HydrophobicContact CB-CB 4.01Å; R226-L231 HydrophobicContact CG-CB 4.29Å; R226-L231 HydrophobicContact CG-CD1 4.36Å; R226-L231 PolarHBondContact O-N 3.02Å; L229-L231 HydrophobicContact CB-CD1 4.02Å; L229-L231 HydrophobicContact CB-CG 3.79Å; L229-L231 HydrophobicContact CD1-CD1 3.9Å; L229-L231 PolarHBondContact O-N 3.23Å; L231-A235 HydrophobicContact CB-CB 4.01Å
232	K	86.3	Confident	85.6	Confident	176 Å²	176	81.4 Å²	81.4	77%	0.765	46%	0.457	S	S	*	.			trans	-85.8	-177.7	179.2	-61.5	-176.7	-178.8	178.8	0	111.8	G230 A234 A235	G230-K232 PolarHBondContact O-N 2.97Å; K232-A234 PolarHBondContact O-N 2.72Å; K232-A235 WeakPolarHBondContact O-CB 3.33Å; K232-A235 PolarHBondContact O-N 3.38Å
233	S	83.1	Confident	85.4	Confident	83 Å²	83	80.5 Å²	80.5	58%	0.58	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-54.3	-23.7	-178.3	58	0	0	0	0	115.1	A235 T236	S233-A235 PolarHBondContact O-N 3.42Å; S233-T236 PolarHBondContact O-N 3Å; S233-T236 PolarHBondContact O-OG1 3.22Å
234	A	82.3	Confident	85.3	Confident	49 Å²	49	81.2 Å²	81.2	41%	0.405	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-60.7	-32.5	175.5	0	0	0	0	0	112.6	K232 T236 M237 L251	K232-A234 PolarHBondContact O-N 2.72Å; A234-T236 PolarHBondContact O-N 3.01Å; A234-T236 VanDerWaalsContact O-N 3.13Å; A234-M237 PolarHBondContact O-N 3.37Å; A234-M237 VanDerWaalsContact O-N 3.16Å; A234-L251 HydrophobicContact CB-CD2 3.98Å
235	A	83.1	Confident	85.4	Confident	61 Å²	61	76 Å²	76	50%	0.504	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-68.4	-11	-177.7	0	0	0	0	0	114.1	L231 K232 S233	L231-A235 HydrophobicContact CB-CB 4.01Å; K232-A235 WeakPolarHBondContact O-CB 3.33Å; K232-A235 PolarHBondContact O-N 3.38Å; S233-A235 PolarHBondContact O-N 3.42Å
236	T	84.3	Confident	85.3	Confident	80 Å²	80	86 Å²	86	49%	0.491	47%	0.465	S	S	.	.	G	3₁₀ helix	trans	-109	2.5	177.9	63	0	0	0	0	112.9	S233 A234	S233-T236 PolarHBondContact O-N 3Å; S233-T236 PolarHBondContact O-OG1 3.22Å; A234-T236 PolarHBondContact O-N 3.01Å; A234-T236 VanDerWaalsContact O-N 3.13Å
237	M	89.1	Confident	85.4	Confident	72 Å²	72	87.5 Å²	87.5	36%	0.355	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-95	131.9	-178.3	-69.3	-179.6	-176.7	0	0	109.8	A234 G249 L251	A234-M237 PolarHBondContact O-N 3.37Å; A234-M237 VanDerWaalsContact O-N 3.16Å; M237-G249 WeakPolarHBondContact CB-O 3.49Å; M237-G249 WeakPolarHBondContact CG-O 3.49Å; M237-L251 HydrophobicContact CB-CD1 4.41Å; M237-L251 HydrophobicContact CB-CD2 3.92Å; M237-L251 HydrophobicContact CB-CG 3.73Å; M237-L251 WeakPolarHBondContact O-CD1 3.48Å; M237-L251 HydrophobicContact SD-CD2 4.2Å
238	E	91.4	Very high	85.5	Confident	131 Å²	131	93.2 Å²	93.2	61%	0.612	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-69.1	148.2	171.3	-68.8	-66	147.5	0	0	110.7	R250 L251	E238-R250 VanDerWaalsContact CB-CZ 3.43Å; E238-R250 CarbonylContact O-C 3.47Å; E238-R250 WeakPolarHBondContact O-CA 3.36Å; E238-R250 WeakPolarHBondContact O-CB 3.3Å; E238-R250 WeakPolarHBondContact O-CD 3.42Å; E238-L251 PolarHBondContact O-N 2.89Å
239	A	88.5	Confident	85.7	Confident	44 Å²	44	88.4 Å²	88.4	36%	0.364	49%	0.485	S	S	.	.	B	Isolated β-bridge	trans	-71.3	156	172.7	0	0	0	0	0	111.4	R250 I253	A239-R250 PolarHBondContact O-NH1 3.32Å; A239-I253 HydrophobicContact CB-CD1 3.91Å; A239-I253 HydrophobicContact CB-CG1 3.97Å
240	Q	88.6	Confident	85.9	Confident	46 Å²	46	87.4 Å²	87.4	22%	0.215	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-55.4	144.4	169.4	-77.4	177	-43.4	0	0	110.9	D242 D245 R250 L251 A252 I253	Q240-D242 VanDerWaalsContact C-N 3.34Å; Q240-D245 WeakPolarHBondContact CA-OD2 3.29Å; Q240-D245 HydrophobicContact CB-CB 4.01Å; Q240-D245 HydrophobicContact CG-CB 4.09Å; Q240-D245 PolarHBondContact NE2-O 3.29Å; Q240-R250 HydrophobicContact CG-CB 4.1Å; Q240-L251 WeakPolarHBondContact CG-O 3.4Å; Q240-L251 PolarHBondContact N-O 2.94Å; Q240-A252 VanDerWaalsContact OE1-CA 3.28Å; Q240-I253 HydrophobicContact CB-CD1 4.42Å; Q240-I253 HydrophobicContact CB-CG1 4.29Å; Q240-I253 WeakPolarHBondContact O-CD1 3.35Å
241	S	85.3	Confident	86	Confident	76 Å²	76	87.9 Å²	87.9	53%	0.531	46%	0.461	S	S	.	.	S	Bend	trans	-72.2	-30.5	173.6	57.4	0	0	0	0	113.2	D245 F257	S241-D245 PolarHBondContact N-OD2 2.9Å; S241-F257 VanDerWaalsContact O-CZ 3.29Å; S241-F257 WeakPolarHBondContact O-CZ 3.45Å
242	D	83.2	Confident	85.8	Confident	52 Å²	52	87.9 Å²	87.9	28%	0.278	47%	0.473	S	S	.	.	S	Bend	trans	-163.8	178.6	-176.9	56.7	70.1	0	0	0	109.9	Q240 Y244 D245 F257	Q240-D242 VanDerWaalsContact C-N 3.34Å; D242-Y244 PolarHBondContact O-N 3.35Å; D242-Y244 VanDerWaalsContact OD1-CA 3.25Å; D242-Y244 WeakPolarHBondContact OD1-CA 3.39Å; D242-Y244 VanDerWaalsContact OD1-CB 3.22Å; D242-Y244 WeakPolarHBondContact OD1-CB 3.45Å; D242-Y244 WeakPolarHBondContact OD1-CD2 3.49Å; D242-Y244 PolarHBondContact OD1-N 3.26Å; D242-D245 PolarHBondContact O-N 2.72Å; D242-D245 PolarHBondContact OD1-N 3.02Å; D242-D245 VanDerWaalsContact OD1-N 3.13Å; D242-F257 HydrophobicContact CB-CD1 4.29Å; D242-F257 HydrophobicContact CB-CE1 4.48Å; D242-F257 HydrophobicContact CB-CG 4.48Å
243	I	82.1	Confident	85.3	Confident	44 Å²	44	82 Å²	82	23%	0.226	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.5	179.5	48.8	162.7	0	0	0	115.4	F257	I243-F257 HydrophobicContact CB-CB 4.02Å; I243-F257 WeakPolarHBondContact CD1-O 3.39Å; I243-F257 HydrophobicContact CG1-CB 4.07Å; I243-F257 WeakPolarHBondContact CG1-O 3.47Å; I243-F257 HydrophobicContact CG2-CB 3.33Å
244	Y	82.3	Confident	84.7	Confident	93 Å²	93	83.6 Å²	83.6	37%	0.365	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-9.5	-179.2	-45.2	-70.5	0	0	0	112.6	D242 R246 L285 P286	D242-Y244 PolarHBondContact O-N 3.35Å; D242-Y244 VanDerWaalsContact OD1-CA 3.25Å; D242-Y244 WeakPolarHBondContact OD1-CA 3.39Å; D242-Y244 VanDerWaalsContact OD1-CB 3.22Å; D242-Y244 WeakPolarHBondContact OD1-CB 3.45Å; D242-Y244 WeakPolarHBondContact OD1-CD2 3.49Å; D242-Y244 PolarHBondContact OD1-N 3.26Å; Y244-R246 WeakPolarHBondContact O-CG 3.37Å; Y244-R246 PolarHBondContact O-N 3.09Å; Y244-R246 VanDerWaalsContact O-N 3.09Å; Y244-L285 HydrophobicContact CE1-CB 4Å; Y244-L285 HydrophobicContact CE2-CB 4.49Å; Y244-L285 HydrophobicContact CE2-CD1 3.97Å; Y244-L285 VanDerWaalsContact OH-CB 3.3Å; Y244-L285 WeakPolarHBondContact OH-CB 3.45Å; Y244-P286 HydrophobicContact CE1-CB 4.39Å; Y244-P286 WeakPolarHBondContact CE1-O 3.5Å; Y244-P286 PolarHBondContact OH-O 3.22Å
245	D	84.6	Confident	83.8	Confident	19 Å²	19	82.6 Å²	82.6	10%	0.102	45%	0.452	C	S	.	.			trans	-65.4	109.8	177.4	-176.8	4.6	0	0	0	110.6	Q240 S241 D242 T247	Q240-D245 WeakPolarHBondContact CA-OD2 3.29Å; Q240-D245 HydrophobicContact CB-CB 4.01Å; Q240-D245 HydrophobicContact CG-CB 4.09Å; Q240-D245 PolarHBondContact NE2-O 3.29Å; S241-D245 PolarHBondContact N-OD2 2.9Å; D242-D245 PolarHBondContact O-N 2.72Å; D242-D245 PolarHBondContact OD1-N 3.02Å; D242-D245 VanDerWaalsContact OD1-N 3.13Å; D245-T247 WeakPolarHBondContact OD1-CB 3.4Å; D245-T247 PolarHBondContact OD1-N 2.95Å; D245-T247 PolarHBondContact OD1-OG1 3.3Å
246	R	83.6	Confident	82.7	Confident	237 Å²	237	81.8 Å²	81.8	89%	0.894	45%	0.446	S	S	*	.			trans	-105.9	17.6	178.1	-54.1	-162.2	69.2	-166.5	-0.7	112.8	Y244 K248	Y244-R246 WeakPolarHBondContact O-CG 3.37Å; Y244-R246 PolarHBondContact O-N 3.09Å; Y244-R246 VanDerWaalsContact O-N 3.09Å; R246-K248 PolarHBondContact O-N 3.3Å
247	T	87.8	Confident	81.5	Confident	83 Å²	83	82.2 Å²	82.2	51%	0.509	44%	0.441	S	S	.	.			trans	-61.5	121	179.3	-54.2	0	0	0	0	109.8	D245 G249 R250	D245-T247 WeakPolarHBondContact OD1-CB 3.4Å; D245-T247 PolarHBondContact OD1-N 2.95Å; D245-T247 PolarHBondContact OD1-OG1 3.3Å; T247-G249 PolarHBondContact O-N 3.37Å; T247-R250 HydrophobicContact CG2-CG 4.22Å; T247-R250 PolarHBondContact O-N 3.4Å
248	K	87.6	Confident	80	Confident	211 Å²	211	79 Å²	79	92%	0.917	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	131.3	180	-174.8	179	178.6	-178.6	0	109.8	R246	R246-K248 PolarHBondContact O-N 3.3Å
249	G	87.8	Confident	78.8	Confident	43 Å²	43	79 Å²	79	44%	0.443	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	12	178.2	0	0	0	0	0	115.2	M237 T247	M237-G249 WeakPolarHBondContact CB-O 3.49Å; M237-G249 WeakPolarHBondContact CG-O 3.49Å; T247-G249 PolarHBondContact O-N 3.37Å
250	R	89.3	Confident	77.8	Confident	102 Å²	102	80 Å²	80	39%	0.385	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-92.1	149.3	171	-65.7	-70.3	-175.5	139	-10.9	112	E238 A239 Q240 T247	E238-R250 VanDerWaalsContact CB-CZ 3.43Å; E238-R250 CarbonylContact O-C 3.47Å; E238-R250 WeakPolarHBondContact O-CA 3.36Å; E238-R250 WeakPolarHBondContact O-CB 3.3Å; E238-R250 WeakPolarHBondContact O-CD 3.42Å; A239-R250 PolarHBondContact O-NH1 3.32Å; Q240-R250 HydrophobicContact CG-CB 4.1Å; T247-R250 HydrophobicContact CG2-CG 4.22Å; T247-R250 PolarHBondContact O-N 3.4Å
251	L	88.1	Confident	77.2	Confident	66 Å²	66	83.2 Å²	83.2	35%	0.346	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-76.5	132.8	171.5	-60.5	175.1	0	0	0	110.5	A234 M237 E238 Q240	A234-L251 HydrophobicContact CB-CD2 3.98Å; M237-L251 HydrophobicContact CB-CD1 4.41Å; M237-L251 HydrophobicContact CB-CD2 3.92Å; M237-L251 HydrophobicContact CB-CG 3.73Å; M237-L251 WeakPolarHBondContact O-CD1 3.48Å; M237-L251 HydrophobicContact SD-CD2 4.2Å; E238-L251 PolarHBondContact O-N 2.89Å; Q240-L251 WeakPolarHBondContact CG-O 3.4Å; Q240-L251 PolarHBondContact N-O 2.94Å
252	A	83.3	Confident	77.1	Confident	78 Å²	78	83.5 Å²	83.5	65%	0.645	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-65.9	136.6	173.6	0	0	0	0	0	110.6	Q240 P254	Q240-A252 VanDerWaalsContact OE1-CA 3.28Å; A252-P254 WeakPolarHBondContact O-CD 3.45Å
253	I	76.7	Confident	77.3	Confident	52 Å²	52	84 Å²	84	27%	0.267	46%	0.456	S	S	.	.			trans	-96.6	106.5	173	-59	179.3	0	0	0	108.9	A239 Q240 A256 F257	A239-I253 HydrophobicContact CB-CD1 3.91Å; A239-I253 HydrophobicContact CB-CG1 3.97Å; Q240-I253 HydrophobicContact CB-CD1 4.42Å; Q240-I253 HydrophobicContact CB-CG1 4.29Å; Q240-I253 WeakPolarHBondContact O-CD1 3.35Å; I253-A256 HydrophobicContact CG2-CB 3.47Å; I253-A256 VanDerWaalsContact CG2-CB 3.47Å; I253-F257 HydrophobicContact CB-CD2 4.39Å; I253-F257 HydrophobicContact CD1-CD2 4.26Å; I253-F257 HydrophobicContact CD1-CE2 3.72Å; I253-F257 HydrophobicContact CG2-CD2 4.26Å; I253-F257 HydrophobicContact CG2-CE2 4.4Å
254	P	70	Confident	77.7	Confident	116 Å²	116	86 Å²	86	75%	0.753	47%	0.466	S	S	*	.			trans	-69.1	141.9	176.1	-10.4	27	0	0	0	109.9	A252 A256	A252-P254 WeakPolarHBondContact O-CD 3.45Å; P254-A256 PolarHBondContact O-N 2.88Å
255	G	63.7	Low	78.1	Confident	28 Å²	28	86.6 Å²	86.6	29%	0.289	48%	0.482	S	S	.	.	S	Bend	trans	78.2	-46.5	168	0	0	0	0	0	116	F257 F259 R261	G255-F257 VanDerWaalsContact C-N 3.35Å; G255-F257 PolarHBondContact O-N 3.11Å; G255-F259 WeakPolarHBondContact CA-O 3.42Å; G255-F259 PolarHBondContact N-O 2.79Å; G255-R261 WeakPolarHBondContact O-CA 3.37Å; G255-R261 WeakPolarHBondContact O-CB 3.5Å; G255-R261 PolarHBondContact O-N 3.33Å
256	A	60.3	Low	78.5	Confident	45 Å²	45	93.3 Å²	93.3	37%	0.372	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-27.4	-158.2	0	0	0	0	0	115.6	I253 P254	I253-A256 HydrophobicContact CG2-CB 3.47Å; I253-A256 VanDerWaalsContact CG2-CB 3.47Å; P254-A256 PolarHBondContact O-N 2.88Å
257	F	58.6	Low	78.8	Confident	89 Å²	89	84.1 Å²	84.1	39%	0.39	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	14.4	-168.8	-71.2	-73.8	0	0	0	115	S241 D242 I243 I253 G255	S241-F257 VanDerWaalsContact O-CZ 3.29Å; S241-F257 WeakPolarHBondContact O-CZ 3.45Å; D242-F257 HydrophobicContact CB-CD1 4.29Å; D242-F257 HydrophobicContact CB-CE1 4.48Å; D242-F257 HydrophobicContact CB-CG 4.48Å; I243-F257 HydrophobicContact CB-CB 4.02Å; I243-F257 WeakPolarHBondContact CD1-O 3.39Å; I243-F257 HydrophobicContact CG1-CB 4.07Å; I243-F257 WeakPolarHBondContact CG1-O 3.47Å; I243-F257 HydrophobicContact CG2-CB 3.33Å; I253-F257 HydrophobicContact CB-CD2 4.39Å; I253-F257 HydrophobicContact CD1-CD2 4.26Å; I253-F257 HydrophobicContact CD1-CE2 3.72Å; I253-F257 HydrophobicContact CG2-CD2 4.26Å; I253-F257 HydrophobicContact CG2-CE2 4.4Å; G255-F257 VanDerWaalsContact C-N 3.35Å; G255-F257 PolarHBondContact O-N 3.11Å
258	G	57.3	Low	79.2	Confident	5 Å²	5	81.7 Å²	81.7	5%	0.052	47%	0.466	C	S	.	.	S	Bend	trans	149.9	-34.8	169	0	0	0	0	0	115.2	G260 E288	G258-G260 PolarHBondContact O-N 3Å; G258-E288 WeakPolarHBondContact O-CB 3.44Å
259	F	66.7	Low	79.6	Confident	130 Å²	130	74 Å²	74	57%	0.57	43%	0.434	S	S	*	.	S	Bend	trans	-92.6	83.2	177.1	-69.9	-79.5	0	0	0	110	G255	G255-F259 WeakPolarHBondContact CA-O 3.42Å; G255-F259 PolarHBondContact N-O 2.79Å
260	G	67	Low	80	Confident	65 Å²	65	79.8 Å²	79.8	67%	0.67	44%	0.443	S	S	*	.	S	Bend	trans	109	7.4	176.6	0	0	0	0	0	116.1	G258	G258-G260 PolarHBondContact O-N 3Å
261	R	75.3	Confident	80.4	Confident	114 Å²	114	75.3 Å²	75.3	43%	0.43	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-67.7	134.4	171	-176.6	176.8	-179.6	174.1	-5.8	109.5	G255 F263 D267	G255-R261 WeakPolarHBondContact O-CA 3.37Å; G255-R261 WeakPolarHBondContact O-CB 3.5Å; G255-R261 PolarHBondContact O-N 3.33Å; R261-F263 PolarHBondContact O-N 3.42Å; R261-D267 IonicContact NH2-OD1 3.2Å
262	A	84.2	Confident	80.7	Confident	82 Å²	82	78.1 Å²	78.1	68%	0.678	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-71.6	116	166.7	0	0	0	0	0	109.4
263	F	87.9	Confident	81.2	Confident	63 Å²	63	77.2 Å²	77.2	28%	0.276	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-71.2	133.5	175.9	-65.1	-69.6	0	0	0	111	R261 D267 E288 V307	R261-F263 PolarHBondContact O-N 3.42Å; F263-D267 HydrophobicContact CB-CB 4.38Å; F263-D267 HydrophobicContact CD1-CB 3.96Å; F263-E288 HydrophobicContact CZ-CB 4.12Å; F263-V307 HydrophobicContact CD2-CG2 4.08Å; F263-V307 HydrophobicContact CE2-CG1 4.03Å; F263-V307 HydrophobicContact CE2-CG2 3.8Å
264	L	90	Very high	81.9	Confident	84 Å²	84	80.6 Å²	80.6	44%	0.44	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-96.1	163.5	172.8	-62.5	179.4	0	0	0	110.5	E266 D267	L264-E266 HydrophobicContact CB-CG 3.83Å; L264-E266 PolarHBondContact O-N 3.48Å; L264-E266 VanDerWaalsContact O-N 3.09Å; L264-D267 PolarHBondContact N-OD2 3.31Å; L264-D267 WeakPolarHBondContact O-CB 3.42Å; L264-D267 PolarHBondContact O-N 3.05Å
265	P	91.4	Very high	83	Confident	107 Å²	107	79.2 Å²	79.2	70%	0.695	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-55.3	-28.5	177.4	-27.9	36.4	0	0	0	114.5	V268	P265-V268 WeakPolarHBondContact O-CG2 3.46Å
266	E	91.9	Very high	84.5	Confident	160 Å²	160	81.5 Å²	81.5	75%	0.748	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-74.1	-21.6	175.4	59.6	-161.7	-128.6	0	0	114.2	L264 V268	L264-E266 HydrophobicContact CB-CG 3.83Å; L264-E266 PolarHBondContact O-N 3.48Å; L264-E266 VanDerWaalsContact O-N 3.09Å; E266-V268 VanDerWaalsContact C-N 3.29Å
267	D	90.7	Very high	86.2	Confident	43 Å²	43	79.4 Å²	79.4	23%	0.23	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-80.4	-11.4	176.7	-61.8	-47.2	0	0	0	112.4	R261 F263 L264 I269	R261-D267 IonicContact NH2-OD1 3.2Å; F263-D267 HydrophobicContact CB-CB 4.38Å; F263-D267 HydrophobicContact CD1-CB 3.96Å; L264-D267 PolarHBondContact N-OD2 3.31Å; L264-D267 WeakPolarHBondContact O-CB 3.42Å; L264-D267 PolarHBondContact O-N 3.05Å; D267-I269 PolarHBondContact O-N 3.01Å
268	V	94.8	Very high	87.9	Confident	33 Å²	33	77.2 Å²	77.2	20%	0.2	41%	0.414	C	S	.	.			trans	-74.8	114.5	-173.7	-175.7	0	0	0	0	111.2	P265 E266 R270 A292	P265-V268 WeakPolarHBondContact O-CG2 3.46Å; E266-V268 VanDerWaalsContact C-N 3.29Å; V268-R270 HydrophobicContact CG1-CG 4.32Å; V268-A292 HydrophobicContact CG1-CB 3.6Å
269	I	96.4	Very high	89.6	Confident	48 Å²	48	79.3 Å²	79.3	25%	0.246	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	118.1	174.9	-49.8	175.4	0	0	0	109.2	D267 F271 W280 Y289 S290 V291 A292	D267-I269 PolarHBondContact O-N 3.01Å; I269-F271 HydrophobicContact CB-CE2 4.35Å; I269-F271 HydrophobicContact CB-CZ 4.13Å; I269-F271 HydrophobicContact CG2-CE1 3.73Å; I269-F271 HydrophobicContact CG2-CE2 3.99Å; I269-F271 HydrophobicContact CG2-CZ 3.39Å; I269-W280 HydrophobicContact CD1-CH2 4.42Å; I269-W280 HydrophobicContact CD1-CZ2 3.48Å; I269-W280 VanDerWaalsContact CD1-CZ2 3.48Å; I269-Y289 HydrophobicContact CD1-CD1 4.04Å; I269-S290 PolarHBondContact N-O 2.95Å; I269-V291 CarbonylContact O-C 3.57Å; I269-V291 WeakPolarHBondContact O-CA 3.39Å; I269-A292 PolarHBondContact O-N 3.41Å
270	R	96.9	Very high	91.1	Very high	165 Å²	165	76 Å²	76	62%	0.623	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.8	-178.5	-74.6	177.8	174.3	79.7	0.8	111.8	V268 A292	V268-R270 HydrophobicContact CG1-CG 4.32Å; R270-A292 CarbonylContact C-O 3.54Å; R270-A292 VanDerWaalsContact CA-O 3.3Å; R270-A292 WeakPolarHBondContact CA-O 3.34Å; R270-A292 HydrophobicContact CG-CB 4.02Å
271	F	96.8	Very high	92.4	Very high	9 Å²	9	72.9 Å²	72.9	4%	0.039	38%	0.383	C	S	.	.			trans	-122.8	127.5	176.3	-51.9	-75.6	0	0	0	110.2	I269 F277 W280 V291 A292 G293 P294 I298 F304	I269-F271 HydrophobicContact CB-CE2 4.35Å; I269-F271 HydrophobicContact CB-CZ 4.13Å; I269-F271 HydrophobicContact CG2-CE1 3.73Å; I269-F271 HydrophobicContact CG2-CE2 3.99Å; I269-F271 HydrophobicContact CG2-CZ 3.39Å; F271-F277 HydrophobicContact CB-CB 4.22Å; F271-F277 HydrophobicContact CD1-CB 4.17Å; F271-F277 HydrophobicContact CD1-CD2 4.24Å; F271-F277 AromaticContact CD2-CD2 3.66Å; F271-F277 HydrophobicContact CD2-CD2 3.66Å; F271-F277 HydrophobicContact CD2-CE2 4.4Å; F271-F277 HydrophobicContact CE1-CD2 4.21Å; F271-F277 AromaticContact CE2-CD2 3.6Å; F271-F277 HydrophobicContact CE2-CD2 3.6Å; F271-F277 HydrophobicContact CE2-CE2 4.03Å; F271-F277 HydrophobicContact CG-CB 4.05Å; F271-F277 AromaticContact CG-CD2 3.96Å; F271-F277 HydrophobicContact CG-CD2 3.96Å; F271-F277 AromaticContact CZ-CD2 3.89Å; F271-F277 HydrophobicContact CZ-CD2 3.89Å; F271-F277 HydrophobicContact CZ-CE2 4.39Å; F271-W280 HydrophobicContact CD1-CB 4.46Å; F271-W280 HydrophobicContact CE1-CB 3.52Å; F271-W280 AromaticContact CE1-CD2 3.88Å; F271-W280 HydrophobicContact CE1-CD2 3.88Å; F271-W280 HydrophobicContact CE1-CE3 4.13Å; F271-W280 AromaticContact CE1-CG 3.6Å; F271-W280 HydrophobicContact CE1-CG 3.6Å; F271-W280 HydrophobicContact CZ-CB 4.16Å; F271-W280 AromaticContact CZ-CD2 3.58Å; F271-W280 HydrophobicContact CZ-CD2 3.58Å; F271-W280 AromaticContact CZ-CE3 3.57Å; F271-W280 HydrophobicContact CZ-CE3 3.57Å; F271-W280 AromaticContact CZ-CG 3.83Å; F271-W280 HydrophobicContact CZ-CG 3.83Å; F271-W280 HydrophobicContact CZ-CZ3 4.21Å; F271-V291 HydrophobicContact CE2-CB 3.96Å; F271-V291 HydrophobicContact CE2-CG1 3.81Å; F271-V291 HydrophobicContact CZ-CG1 4.48Å; F271-A292 PolarHBondContact N-O 2.9Å; F271-G293 WeakPolarHBondContact O-CA 3.32Å; F271-P294 WeakPolarHBondContact O-CD 3.13Å; F271-I298 HydrophobicContact CB-CD1 4.48Å; F271-F304 AromaticContact CD2-CE1 3.96Å; F271-F304 HydrophobicContact CD2-CE1 3.96Å; F271-F304 HydrophobicContact CE2-CE1 4.4Å
272	D	93.8	Very high	93.2	Very high	125 Å²	125	72.1 Å²	72.1	67%	0.668	38%	0.38	S	S	*	.	S	Bend	trans	-87.8	-31	178.6	-62.5	-44.8	0	0	0	112	P294	D272-P294 WeakPolarHBondContact O-CG 3.42Å
273	T	94.9	Very high	93.7	Very high	59 Å²	59	72.5 Å²	72.5	36%	0.362	37%	0.371	S	S	.	.	S	Bend	trans	-133.1	160.6	-177.5	76.9	0	0	0	0	113.5	S275 D276 F277 I298	T273-S275 PolarHBondContact O-N 2.94Å; T273-S275 PolarHBondContact OG1-N 3.39Å; T273-D276 WeakPolarHBondContact CB-OD2 3.36Å; T273-D276 PolarHBondContact N-OD2 3.38Å; T273-D276 PolarHBondContact O-N 3.4Å; T273-D276 PolarHBondContact OG1-N 3.44Å; T273-D276 VanDerWaalsContact OG1-N 3.15Å; T273-D276 PolarHBondContact OG1-OD2 2.94Å; T273-F277 PolarHBondContact O-N 3.46Å; T273-F277 VanDerWaalsContact O-N 3.17Å; T273-I298 WeakPolarHBondContact O-CD1 3.3Å
274	K	92	Very high	93.9	Very high	123 Å²	123	69.7 Å²	69.7	54%	0.535	36%	0.36	S	S	.	.	H	α-helix	trans	-56.6	-33.9	170.4	-71.2	-175.4	-176.8	179.1	0	112.3	L278 I297 I298	K274-L278 WeakPolarHBondContact O-CB 3.34Å; K274-L278 PolarHBondContact O-N 3.18Å; K274-I297 WeakPolarHBondContact CE-O 3.18Å; K274-I297 HydrophobicContact CG-CG2 4.47Å; K274-I297 WeakPolarHBondContact CG-O 3.38Å; K274-I298 HydrophobicContact CG-CD1 4.35Å
275	S	93.1	Very high	94	Very high	87 Å²	87	68.9 Å²	68.9	61%	0.608	36%	0.355	S	S	*	.	H	α-helix	trans	-69.4	-42	-179.3	-62.8	0	0	0	0	111.7	T273 L278 A279	T273-S275 PolarHBondContact O-N 2.94Å; T273-S275 PolarHBondContact OG1-N 3.39Å; S275-L278 PolarHBondContact O-N 3.07Å; S275-A279 WeakPolarHBondContact O-CB 3.32Å; S275-A279 PolarHBondContact O-N 2.97Å
276	D	95.1	Very high	93.9	Very high	75 Å²	75	65.6 Å²	65.6	40%	0.401	33%	0.334	S	S	.	.	H	α-helix	trans	-65.2	-43.8	177.6	-54.8	-39.4	0	0	0	110.8	T273 L278 A279 W280	T273-D276 WeakPolarHBondContact CB-OD2 3.36Å; T273-D276 PolarHBondContact N-OD2 3.38Å; T273-D276 PolarHBondContact O-N 3.4Å; T273-D276 PolarHBondContact OG1-N 3.44Å; T273-D276 VanDerWaalsContact OG1-N 3.15Å; T273-D276 PolarHBondContact OG1-OD2 2.94Å; D276-L278 PolarHBondContact O-N 2.86Å; D276-A279 PolarHBondContact O-N 3.13Å; D276-W280 PolarHBondContact O-N 2.87Å
277	F	95.8	Very high	93.8	Very high	2 Å²	2	58 Å²	58	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-58.7	-47.9	174.3	-179.5	-111.1	0	0	0	111.8	F271 T273 A279 W280 V281 I298 F304 L308 L329 L351 W354	F271-F277 HydrophobicContact CB-CB 4.22Å; F271-F277 HydrophobicContact CD1-CB 4.17Å; F271-F277 HydrophobicContact CD1-CD2 4.24Å; F271-F277 AromaticContact CD2-CD2 3.66Å; F271-F277 HydrophobicContact CD2-CD2 3.66Å; F271-F277 HydrophobicContact CD2-CE2 4.4Å; F271-F277 HydrophobicContact CE1-CD2 4.21Å; F271-F277 AromaticContact CE2-CD2 3.6Å; F271-F277 HydrophobicContact CE2-CD2 3.6Å; F271-F277 HydrophobicContact CE2-CE2 4.03Å; F271-F277 HydrophobicContact CG-CB 4.05Å; F271-F277 AromaticContact CG-CD2 3.96Å; F271-F277 HydrophobicContact CG-CD2 3.96Å; F271-F277 AromaticContact CZ-CD2 3.89Å; F271-F277 HydrophobicContact CZ-CD2 3.89Å; F271-F277 HydrophobicContact CZ-CE2 4.39Å; T273-F277 PolarHBondContact O-N 3.46Å; T273-F277 VanDerWaalsContact O-N 3.17Å; F277-A279 VanDerWaalsContact C-N 3.33Å; F277-A279 PolarHBondContact O-N 3.41Å; F277-W280 HydrophobicContact CE2-CE3 4.41Å; F277-W280 HydrophobicContact CE2-CZ3 4.46Å; F277-W280 PolarHBondContact O-N 3.39Å; F277-V281 HydrophobicContact CD1-CG2 4.22Å; F277-V281 HydrophobicContact CD2-CG2 4.22Å; F277-V281 HydrophobicContact CE1-CG2 3.8Å; F277-V281 HydrophobicContact CE2-CG2 3.79Å; F277-V281 HydrophobicContact CG-CG2 4.42Å; F277-V281 HydrophobicContact CZ-CG2 3.57Å; F277-V281 WeakPolarHBondContact O-CG2 3.27Å; F277-V281 PolarHBondContact O-N 2.87Å; F277-I298 HydrophobicContact CB-CD1 3.76Å; F277-I298 HydrophobicContact CD1-CG2 3.8Å; F277-I298 HydrophobicContact CE1-CG2 4.03Å; F277-I298 HydrophobicContact CG-CD1 4.3Å; F277-I298 HydrophobicContact CG-CG2 4.09Å; F277-F304 HydrophobicContact CD2-CE1 4.23Å; F277-F304 HydrophobicContact CD2-CZ 4.14Å; F277-F304 HydrophobicContact CE2-CE1 4.13Å; F277-F304 AromaticContact CE2-CZ 3.64Å; F277-F304 HydrophobicContact CE2-CZ 3.64Å; F277-F304 AromaticContact CZ-CZ 3.93Å; F277-F304 HydrophobicContact CZ-CZ 3.93Å; F277-L308 HydrophobicContact CE2-CD2 3.8Å; F277-L308 HydrophobicContact CZ-CD2 3.88Å; F277-L329 HydrophobicContact CZ-CD2 4.18Å; F277-L351 HydrophobicContact CD1-CD1 3.73Å; F277-L351 HydrophobicContact CE1-CD1 3.49Å; F277-L351 VanDerWaalsContact CE1-CD1 3.49Å; F277-W354 HydrophobicContact CE1-CH2 4.36Å; F277-W354 AromaticContact CE1-CZ2 3.72Å; F277-W354 HydrophobicContact CE1-CZ2 3.72Å; F277-W354 HydrophobicContact CZ-CH2 4.27Å; F277-W354 HydrophobicContact CZ-CZ2 4.04Å
278	L	93.8	Very high	93.8	Very high	42 Å²	42	58.6 Å²	58.6	22%	0.22	30%	0.3	C	S	.	.	H	α-helix	trans	-62.8	-39	178.1	178.6	63.5	0	0	0	112.3	K274 S275 D276 W280 R282 Y343 L351	K274-L278 WeakPolarHBondContact O-CB 3.34Å; K274-L278 PolarHBondContact O-N 3.18Å; S275-L278 PolarHBondContact O-N 3.07Å; D276-L278 PolarHBondContact O-N 2.86Å; L278-W280 VanDerWaalsContact C-N 3.33Å; L278-R282 PolarHBondContact O-N 3.49Å; L278-R282 VanDerWaalsContact O-N 3.07Å; L278-Y343 HydrophobicContact CD1-CD2 4.09Å; L278-Y343 HydrophobicContact CD1-CE2 4.09Å; L278-L351 HydrophobicContact CD1-CD1 4.46Å; L278-L351 HydrophobicContact CD1-CG 3.95Å
279	A	94.1	Very high	93.7	Very high	50 Å²	50	59.2 Å²	59.2	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-64.7	-38.2	177.5	0	0	0	0	0	111.9	S275 D276 F277 R282 N283	S275-A279 WeakPolarHBondContact O-CB 3.32Å; S275-A279 PolarHBondContact O-N 2.97Å; D276-A279 PolarHBondContact O-N 3.13Å; F277-A279 VanDerWaalsContact C-N 3.33Å; F277-A279 PolarHBondContact O-N 3.41Å; A279-R282 WeakPolarHBondContact O-CB 3.27Å; A279-N283 PolarHBondContact O-ND2 3.33Å
280	W	96.4	Very high	93.6	Very high	59 Å²	59	57.8 Å²	57.8	22%	0.223	29%	0.294	C	S	.	.	H	α-helix	trans	-70.6	-48.7	174.6	178.1	86.6	0	0	0	112.2	I269 F271 D276 F277 L278 R282 N283 A284 Y289 L308 I310	I269-W280 HydrophobicContact CD1-CH2 4.42Å; I269-W280 HydrophobicContact CD1-CZ2 3.48Å; I269-W280 VanDerWaalsContact CD1-CZ2 3.48Å; F271-W280 HydrophobicContact CD1-CB 4.46Å; F271-W280 HydrophobicContact CE1-CB 3.52Å; F271-W280 AromaticContact CE1-CD2 3.88Å; F271-W280 HydrophobicContact CE1-CD2 3.88Å; F271-W280 HydrophobicContact CE1-CE3 4.13Å; F271-W280 AromaticContact CE1-CG 3.6Å; F271-W280 HydrophobicContact CE1-CG 3.6Å; F271-W280 HydrophobicContact CZ-CB 4.16Å; F271-W280 AromaticContact CZ-CD2 3.58Å; F271-W280 HydrophobicContact CZ-CD2 3.58Å; F271-W280 AromaticContact CZ-CE3 3.57Å; F271-W280 HydrophobicContact CZ-CE3 3.57Å; F271-W280 AromaticContact CZ-CG 3.83Å; F271-W280 HydrophobicContact CZ-CG 3.83Å; F271-W280 HydrophobicContact CZ-CZ3 4.21Å; D276-W280 PolarHBondContact O-N 2.87Å; F277-W280 HydrophobicContact CE2-CE3 4.41Å; F277-W280 HydrophobicContact CE2-CZ3 4.46Å; F277-W280 PolarHBondContact O-N 3.39Å; L278-W280 VanDerWaalsContact C-N 3.33Å; W280-R282 PolarHBondContact O-N 2.88Å; W280-R282 VanDerWaalsContact O-N 3.14Å; W280-N283 CarbonylContact O-C 3.55Å; W280-N283 PolarHBondContact O-N 2.93Å; W280-A284 HydrophobicContact CE3-CB 4.4Å; W280-A284 HydrophobicContact CH2-CB 4.09Å; W280-A284 HydrophobicContact CZ2-CB 4.22Å; W280-A284 HydrophobicContact CZ3-CB 4.18Å; W280-A284 PolarHBondContact O-N 3.01Å; W280-Y289 HydrophobicContact CH2-CD1 4.07Å; W280-Y289 AromaticContact CH2-CD2 3.75Å; W280-Y289 HydrophobicContact CH2-CD2 3.75Å; W280-Y289 HydrophobicContact CH2-CE2 4.22Å; W280-Y289 AromaticContact CH2-CG 3.65Å; W280-Y289 HydrophobicContact CH2-CG 3.65Å; W280-Y289 AromaticContact CZ2-CD1 3.74Å; W280-Y289 HydrophobicContact CZ2-CD1 3.74Å; W280-Y289 HydrophobicContact CZ2-CD2 4.23Å; W280-Y289 HydrophobicContact CZ2-CE1 4.05Å; W280-Y289 AromaticContact CZ2-CG 3.83Å; W280-Y289 HydrophobicContact CZ2-CG 3.83Å; W280-L308 HydrophobicContact CH2-CD2 4.28Å; W280-L308 HydrophobicContact CZ3-CD2 3.74Å; W280-I310 HydrophobicContact CH2-CD1 3.67Å; W280-I310 HydrophobicContact CZ3-CD1 3.65Å
281	V	95.5	Very high	93.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56.3	-34.6	178.1	168.2	0	0	0	0	112	F277 N283 A284 K327 L329 Y343 L351	F277-V281 HydrophobicContact CD1-CG2 4.22Å; F277-V281 HydrophobicContact CD2-CG2 4.22Å; F277-V281 HydrophobicContact CE1-CG2 3.8Å; F277-V281 HydrophobicContact CE2-CG2 3.79Å; F277-V281 HydrophobicContact CG-CG2 4.42Å; F277-V281 HydrophobicContact CZ-CG2 3.57Å; F277-V281 WeakPolarHBondContact O-CG2 3.27Å; F277-V281 PolarHBondContact O-N 2.87Å; V281-N283 PolarHBondContact O-N 2.84Å; V281-A284 PolarHBondContact O-N 2.81Å; V281-K327 HydrophobicContact CG1-CD 4.47Å; V281-K327 WeakPolarHBondContact O-CD 3.41Å; V281-K327 WeakPolarHBondContact O-CE 3.34Å; V281-K327 PolarHBondContact O-NZ 2.87Å; V281-L329 HydrophobicContact CB-CD2 4.34Å; V281-L329 HydrophobicContact CG1-CD1 4.11Å; V281-L329 HydrophobicContact CG1-CD2 3.7Å; V281-L329 HydrophobicContact CG1-CG 4.48Å; V281-L329 HydrophobicContact CG2-CD2 3.6Å; V281-Y343 HydrophobicContact CG1-CD2 4.14Å; V281-Y343 HydrophobicContact CG1-CG 3.98Å; V281-L351 HydrophobicContact CG1-CD2 4.15Å
282	R	92.7	Very high	93.6	Very high	98 Å²	98	49.9 Å²	49.9	37%	0.37	27%	0.265	S	S	.	.	H	α-helix	trans	-53.6	-42.1	174.8	-178.4	177.2	-59.4	178.3	3	111.3	L278 A279 W280 P322 R323 K327 Y343	L278-R282 PolarHBondContact O-N 3.49Å; L278-R282 VanDerWaalsContact O-N 3.07Å; A279-R282 WeakPolarHBondContact O-CB 3.27Å; W280-R282 PolarHBondContact O-N 2.88Å; W280-R282 VanDerWaalsContact O-N 3.14Å; R282-P322 CarbonylContact O-C 3.28Å; R282-P322 VanDerWaalsContact O-C 3.28Å; R282-R323 HydrophobicContact CG-CB 3.87Å; R282-R323 VanDerWaalsContact O-CA 3.23Å; R282-R323 WeakPolarHBondContact O-CA 3.21Å; R282-R323 PolarHBondContact O-N 3.18Å; R282-K327 PolarHBondContact O-NZ 3.05Å; R282-Y343 WeakPolarHBondContact CG-OH 3.44Å
283	N	93.6	Very high	93.6	Very high	91 Å²	91	45 Å²	45	49%	0.487	24%	0.244	S	C	.	.	H	α-helix	trans	-100.3	-1.1	-174.9	-63.2	-57.1	0	0	0	114.4	A279 W280 V281 P322	A279-N283 PolarHBondContact O-ND2 3.33Å; W280-N283 CarbonylContact O-C 3.55Å; W280-N283 PolarHBondContact O-N 2.93Å; V281-N283 PolarHBondContact O-N 2.84Å; N283-P322 VanDerWaalsContact O-CB 3.3Å; N283-P322 WeakPolarHBondContact O-CB 3.18Å; N283-P322 WeakPolarHBondContact O-CG 3.18Å
284	A	92.9	Very high	93.4	Very high	4 Å²	4	44.5 Å²	44.5	3%	0.033	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-69	134.9	-176.7	0	0	0	0	0	113.2	W280 V281 I310 W312 K327	W280-A284 HydrophobicContact CE3-CB 4.4Å; W280-A284 HydrophobicContact CH2-CB 4.09Å; W280-A284 HydrophobicContact CZ2-CB 4.22Å; W280-A284 HydrophobicContact CZ3-CB 4.18Å; W280-A284 PolarHBondContact O-N 3.01Å; V281-A284 PolarHBondContact O-N 2.81Å; A284-I310 HydrophobicContact CB-CD1 3.59Å; A284-W312 PolarHBondContact O-NE1 3.31Å; A284-K327 WeakPolarHBondContact O-CE 3.46Å
285	L	90.9	Very high	93.4	Very high	67 Å²	67	45.4 Å²	45.4	35%	0.351	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-78.8	166.6	171.3	-69.5	170.2	0	0	0	110.5	Y244 Y289 W312 P322	Y244-L285 HydrophobicContact CE1-CB 4Å; Y244-L285 HydrophobicContact CE2-CB 4.49Å; Y244-L285 HydrophobicContact CE2-CD1 3.97Å; Y244-L285 VanDerWaalsContact OH-CB 3.3Å; Y244-L285 WeakPolarHBondContact OH-CB 3.45Å; L285-Y289 PolarHBondContact O-OH 3Å; L285-W312 HydrophobicContact CD2-CH2 4.01Å; L285-W312 HydrophobicContact CD2-CZ2 3.81Å; L285-P322 HydrophobicContact CD2-CG 3.79Å; L285-P322 HydrophobicContact CG-CG 4.4Å
286	P	89.3	Confident	93.2	Very high	37 Å²	37	44.7 Å²	44.7	24%	0.24	23%	0.233	C	C	.	.	S	Bend	trans	-64	138.4	172.7	-20.1	32.5	0	0	0	111.8	Y244 I310 W312	Y244-P286 HydrophobicContact CE1-CB 4.39Å; Y244-P286 WeakPolarHBondContact CE1-O 3.5Å; Y244-P286 PolarHBondContact OH-O 3.22Å; P286-I310 CarbonylContact C-O 3.6Å; P286-I310 VanDerWaalsContact CA-O 3.24Å; P286-I310 WeakPolarHBondContact CA-O 3.4Å; P286-W312 HydrophobicContact CG-CB 4.3Å; P286-W312 HydrophobicContact CG-CD2 3.74Å; P286-W312 HydrophobicContact CG-CE3 4.36Å; P286-W312 HydrophobicContact CG-CG 3.68Å
287	G	89.9	Confident	93	Very high	2 Å²	2	44.3 Å²	44.3	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152	-172.7	178.3	0	0	0	0	0	112.7	S309 I310	G287-S309 WeakPolarHBondContact O-CA 3.2Å; G287-I310 PolarHBondContact N-O 3.49Å; G287-I310 PolarHBondContact O-N 3.21Å
288	E	91.9	Very high	92.8	Very high	55 Å²	55	44.5 Å²	44.5	26%	0.257	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137.2	176.6	-57.4	-167.2	159.6	0	0	110.5	G258 F263 V307 L308	G258-E288 WeakPolarHBondContact O-CB 3.44Å; F263-E288 HydrophobicContact CZ-CB 4.12Å; E288-V307 HydrophobicContact CB-CG1 3.99Å; E288-L308 WeakPolarHBondContact CA-O 3.34Å
289	Y	92.9	Very high	92.7	Very high	45 Å²	45	42.6 Å²	42.6	18%	0.176	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.5	-175	-58.6	-86.5	0	0	0	109.8	I269 W280 L285 V307 L308 I310	I269-Y289 HydrophobicContact CD1-CD1 4.04Å; W280-Y289 HydrophobicContact CH2-CD1 4.07Å; W280-Y289 AromaticContact CH2-CD2 3.75Å; W280-Y289 HydrophobicContact CH2-CD2 3.75Å; W280-Y289 HydrophobicContact CH2-CE2 4.22Å; W280-Y289 AromaticContact CH2-CG 3.65Å; W280-Y289 HydrophobicContact CH2-CG 3.65Å; W280-Y289 AromaticContact CZ2-CD1 3.74Å; W280-Y289 HydrophobicContact CZ2-CD1 3.74Å; W280-Y289 HydrophobicContact CZ2-CD2 4.23Å; W280-Y289 HydrophobicContact CZ2-CE1 4.05Å; W280-Y289 AromaticContact CZ2-CG 3.83Å; W280-Y289 HydrophobicContact CZ2-CG 3.83Å; L285-Y289 PolarHBondContact O-OH 3Å; Y289-V307 CarbonylContact O-C 3.28Å; Y289-V307 WeakPolarHBondContact O-CA 3.44Å; Y289-L308 PolarHBondContact N-O 3.34Å; Y289-L308 PolarHBondContact O-N 3.35Å; Y289-I310 HydrophobicContact CD2-CD1 3.98Å; Y289-I310 HydrophobicContact CD2-CG1 4.16Å; Y289-I310 HydrophobicContact CE2-CB 4.25Å; Y289-I310 HydrophobicContact CE2-CD1 3.94Å; Y289-I310 HydrophobicContact CE2-CG1 4.2Å
290	S	93.6	Very high	92.3	Very high	19 Å²	19	43.6 Å²	43.6	13%	0.133	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	122.5	166.1	-173.9	0	0	0	0	109.5	I269	I269-S290 PolarHBondContact N-O 2.95Å
291	V	96.5	Very high	91.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.1	-175.8	-61.4	0	0	0	0	111.2	I269 F271 F304 E305 G306 L308 F331	I269-V291 CarbonylContact O-C 3.57Å; I269-V291 WeakPolarHBondContact O-CA 3.39Å; F271-V291 HydrophobicContact CE2-CB 3.96Å; F271-V291 HydrophobicContact CE2-CG1 3.81Å; F271-V291 HydrophobicContact CZ-CG1 4.48Å; V291-F304 HydrophobicContact CB-CE1 4.09Å; V291-F304 HydrophobicContact CB-CZ 4.45Å; V291-F304 HydrophobicContact CG2-CE1 3.84Å; V291-F304 HydrophobicContact CG2-CZ 3.83Å; V291-E305 WeakPolarHBondContact O-CA 3.44Å; V291-G306 PolarHBondContact N-O 2.88Å; V291-G306 PolarHBondContact O-N 3.5Å; V291-L308 HydrophobicContact CG1-CB 3.99Å; V291-L308 HydrophobicContact CG1-CD2 4.22Å; V291-L308 HydrophobicContact CG2-CB 3.91Å; V291-F331 HydrophobicContact CG2-CD2 4.11Å; V291-F331 HydrophobicContact CG2-CE2 3.95Å
292	A	97	Very high	91.5	Very high	7 Å²	7	47.3 Å²	47.3	6%	0.058	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	153.3	174.3	0	0	0	0	0	111.6	V268 I269 R270 F271 F304 E305	V268-A292 HydrophobicContact CG1-CB 3.6Å; I269-A292 PolarHBondContact O-N 3.41Å; R270-A292 CarbonylContact C-O 3.54Å; R270-A292 VanDerWaalsContact CA-O 3.3Å; R270-A292 WeakPolarHBondContact CA-O 3.34Å; R270-A292 HydrophobicContact CG-CB 4.02Å; F271-A292 PolarHBondContact N-O 2.9Å; A292-F304 CarbonylContact C-O 3.58Å; A292-F304 VanDerWaalsContact C-O 3.28Å; A292-F304 WeakPolarHBondContact CA-O 3.4Å; A292-E305 HydrophobicContact CB-CG 4.3Å
293	G	94.1	Very high	91.4	Very high	22 Å²	22	48 Å²	48	23%	0.227	25%	0.25	C	S	.	.			trans	-170.2	170.6	177.1	0	0	0	0	0	112.3	F271 F304	F271-G293 WeakPolarHBondContact O-CA 3.32Å; G293-F304 PolarHBondContact N-O 3.34Å
294	P	91.6	Very high	91.4	Very high	50 Å²	50	43.7 Å²	43.7	33%	0.325	23%	0.227	S	C	.	.			trans	-63.6	146.5	-179.9	19.9	-24.5	0	0	0	112	F271 D272 I297	F271-P294 WeakPolarHBondContact O-CD 3.13Å; D272-P294 WeakPolarHBondContact O-CG 3.42Å; P294-I297 HydrophobicContact CB-CB 4.32Å; P294-I297 HydrophobicContact CB-CG1 3.74Å; P294-I297 HydrophobicContact CG-CB 3.83Å; P294-I297 HydrophobicContact CG-CG1 3.61Å; P294-I297 HydrophobicContact CG-CG2 4.24Å; P294-I297 PolarHBondContact O-N 3.2Å
295	Y	90.9	Very high	91.6	Very high	141 Å²	141	46.7 Å²	46.7	55%	0.553	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	140.4	177.4	179.1	-92.2	0	0	0	111.2	I297 R303	Y295-I297 PolarHBondContact O-N 2.96Å; Y295-R303 HydrophobicContact CD2-CB 4.17Å
296	D	88.1	Confident	91.8	Very high	73 Å²	73	43.8 Å²	43.8	39%	0.39	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	-2.6	176.7	-168.3	46.5	0	0	0	115.4	P300 D301 T302	D296-P300 WeakPolarHBondContact OD1-CA 3.45Å; D296-D301 PolarHBondContact OD1-N 3.49Å; D296-T302 PolarHBondContact N-O 3.28Å
297	I	91.1	Very high	92	Very high	67 Å²	67	43.9 Å²	43.9	34%	0.344	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-55.2	-178.7	-58.3	-53.9	0	0	0	111.9	K274 P294 Y295	K274-I297 WeakPolarHBondContact CE-O 3.18Å; K274-I297 HydrophobicContact CG-CG2 4.47Å; K274-I297 WeakPolarHBondContact CG-O 3.38Å; P294-I297 HydrophobicContact CB-CB 4.32Å; P294-I297 HydrophobicContact CB-CG1 3.74Å; P294-I297 HydrophobicContact CG-CB 3.83Å; P294-I297 HydrophobicContact CG-CG1 3.61Å; P294-I297 HydrophobicContact CG-CG2 4.24Å; P294-I297 PolarHBondContact O-N 3.2Å; Y295-I297 PolarHBondContact O-N 2.96Å
298	I	93.2	Very high	92.2	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.031	23%	0.226	C	C	.	.	S	Bend	trans	-81.8	-45.2	-175.8	-55.5	-58.1	0	0	0	111.8	F271 T273 K274 F277 F304 W354	F271-I298 HydrophobicContact CB-CD1 4.48Å; T273-I298 WeakPolarHBondContact O-CD1 3.3Å; K274-I298 HydrophobicContact CG-CD1 4.35Å; F277-I298 HydrophobicContact CB-CD1 3.76Å; F277-I298 HydrophobicContact CD1-CG2 3.8Å; F277-I298 HydrophobicContact CE1-CG2 4.03Å; F277-I298 HydrophobicContact CG-CD1 4.3Å; F277-I298 HydrophobicContact CG-CG2 4.09Å; I298-F304 HydrophobicContact CB-CB 4.11Å; I298-F304 HydrophobicContact CB-CD1 3.88Å; I298-F304 HydrophobicContact CB-CD2 3.76Å; I298-F304 HydrophobicContact CB-CE1 4.23Å; I298-F304 HydrophobicContact CB-CE2 4.11Å; I298-F304 HydrophobicContact CB-CG 3.63Å; I298-F304 HydrophobicContact CB-CZ 4.33Å; I298-F304 HydrophobicContact CG1-CB 4.37Å; I298-F304 HydrophobicContact CG1-CD1 3.67Å; I298-F304 HydrophobicContact CG1-CD2 4.48Å; I298-F304 HydrophobicContact CG1-CE1 4.04Å; I298-F304 HydrophobicContact CG1-CG 3.91Å; I298-F304 HydrophobicContact CG2-CD1 4.17Å; I298-F304 HydrophobicContact CG2-CD2 3.74Å; I298-F304 HydrophobicContact CG2-CE1 4.01Å; I298-F304 HydrophobicContact CG2-CE2 3.56Å; I298-F304 HydrophobicContact CG2-CG 4.04Å; I298-F304 HydrophobicContact CG2-CZ 3.71Å; I298-W354 HydrophobicContact CG2-CZ2 4.17Å; I298-W354 PolarHBondContact O-NE1 2.58Å
299	I	91.1	Very high	92.3	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.01	22%	0.218	C	C	.	.	S	Bend	trans	-122.6	124.5	175.5	-56.2	179.2	0	0	0	106.8	T302 F304 F331 Y339 W354	I299-T302 HydrophobicContact CB-CG2 4.2Å; I299-T302 HydrophobicContact CG2-CG2 4.17Å; I299-T302 PolarHBondContact O-N 2.84Å; I299-F304 HydrophobicContact CD1-CD2 3.78Å; I299-F304 HydrophobicContact CD1-CE2 3.94Å; I299-F304 HydrophobicContact CG1-CD2 3.87Å; I299-F304 HydrophobicContact CG1-CE2 4.18Å; I299-F331 HydrophobicContact CD1-CB 4.42Å; I299-F331 HydrophobicContact CD1-CD1 3.52Å; I299-F331 HydrophobicContact CD1-CE1 4.02Å; I299-F331 HydrophobicContact CD1-CG 4.12Å; I299-Y339 HydrophobicContact CD1-CD2 3.95Å; I299-Y339 HydrophobicContact CD1-CG 4.03Å; I299-Y339 HydrophobicContact CG2-CD1 4.06Å; I299-Y339 HydrophobicContact CG2-CD2 4.21Å; I299-Y339 HydrophobicContact CG2-CE1 3.91Å; I299-Y339 HydrophobicContact CG2-CE2 4.02Å; I299-Y339 HydrophobicContact CG2-CG 4.21Å; I299-W354 HydrophobicContact CD1-CD2 3.9Å; I299-W354 HydrophobicContact CD1-CE3 3.97Å; I299-W354 HydrophobicContact CD1-CG 4.44Å; I299-W354 HydrophobicContact CD1-CH2 4.14Å; I299-W354 HydrophobicContact CD1-CZ2 4.1Å; I299-W354 HydrophobicContact CD1-CZ3 4.07Å; I299-W354 HydrophobicContact CG1-CD2 3.78Å; I299-W354 HydrophobicContact CG1-CE3 4.37Å; I299-W354 HydrophobicContact CG1-CG 3.97Å; I299-W354 HydrophobicContact CG1-CZ2 3.98Å; I299-W354 HydrophobicContact CG2-CB 4.43Å; I299-W354 HydrophobicContact CG2-CG 4.45Å
300	P	86.1	Confident	92.3	Very high	71 Å²	71	39.8 Å²	39.8	46%	0.461	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	144.3	178.7	-25.8	34.8	0	0	0	112.9	D296 T302	D296-P300 WeakPolarHBondContact OD1-CA 3.45Å; P300-T302 PolarHBondContact O-N 3.02Å; P300-T302 PolarHBondContact O-OG1 3.45Å
301	D	84.6	Confident	92.2	Very high	128 Å²	128	47.1 Å²	47.1	68%	0.684	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	29.5	179.6	-66.6	-43.4	0	0	0	113.9	D296	D296-D301 PolarHBondContact OD1-N 3.49Å
302	T	89	Confident	92	Very high	8 Å²	8	49.8 Å²	49.8	5%	0.049	25%	0.245	C	C	.	.	S	Bend	trans	-136.4	134.9	-173.9	-60.1	0	0	0	0	110.8	D296 I299 P300 F304 F331 Y339	D296-T302 PolarHBondContact N-O 3.28Å; I299-T302 HydrophobicContact CB-CG2 4.2Å; I299-T302 HydrophobicContact CG2-CG2 4.17Å; I299-T302 PolarHBondContact O-N 2.84Å; P300-T302 PolarHBondContact O-N 3.02Å; P300-T302 PolarHBondContact O-OG1 3.45Å; T302-F304 PolarHBondContact O-N 2.92Å; T302-F331 HydrophobicContact CG2-CE1 4.35Å; T302-Y339 HydrophobicContact CG2-CD2 4.41Å; T302-Y339 HydrophobicContact CG2-CE2 3.72Å; T302-Y339 WeakPolarHBondContact OG1-CE2 3.37Å; T302-Y339 PolarHBondContact OG1-OH 3.35Å
303	R	90.7	Very high	91.5	Very high	113 Å²	113	53.2 Å²	53.2	43%	0.426	27%	0.266	S	S	.	.			trans	-71.2	109.9	165.6	-177.9	177.7	178.2	-174.2	1.1	108.4	Y295 E305 I334	Y295-R303 HydrophobicContact CD2-CB 4.17Å; R303-E305 HydrophobicContact CG-CB 4.17Å; R303-E305 IonicContact CZ-OE2 3.09Å; R303-E305 IonicContact NE-OE2 2.87Å; R303-E305 PolarHBondContact NE-OE2 3.13Å; R303-E305 IonicContact NH2-OE1 3.53Å; R303-E305 IonicContact NH2-OE2 2.65Å; R303-E305 PolarHBondContact NH2-OE2 3.13Å; R303-E305 PolarHBondContact O-N 2.85Å; R303-I334 VanDerWaalsContact CZ-CD1 3.47Å
304	F	95	Very high	91	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.263	C	S	.	.			trans	-80.8	73.1	180	-168.4	-106.6	0	0	0	110.6	F271 F277 V291 A292 G293 I298 I299 T302 F331 W354	F271-F304 AromaticContact CD2-CE1 3.96Å; F271-F304 HydrophobicContact CD2-CE1 3.96Å; F271-F304 HydrophobicContact CE2-CE1 4.4Å; F277-F304 HydrophobicContact CD2-CE1 4.23Å; F277-F304 HydrophobicContact CD2-CZ 4.14Å; F277-F304 HydrophobicContact CE2-CE1 4.13Å; F277-F304 AromaticContact CE2-CZ 3.64Å; F277-F304 HydrophobicContact CE2-CZ 3.64Å; F277-F304 AromaticContact CZ-CZ 3.93Å; F277-F304 HydrophobicContact CZ-CZ 3.93Å; V291-F304 HydrophobicContact CB-CE1 4.09Å; V291-F304 HydrophobicContact CB-CZ 4.45Å; V291-F304 HydrophobicContact CG2-CE1 3.84Å; V291-F304 HydrophobicContact CG2-CZ 3.83Å; A292-F304 CarbonylContact C-O 3.58Å; A292-F304 VanDerWaalsContact C-O 3.28Å; A292-F304 WeakPolarHBondContact CA-O 3.4Å; G293-F304 PolarHBondContact N-O 3.34Å; I298-F304 HydrophobicContact CB-CB 4.11Å; I298-F304 HydrophobicContact CB-CD1 3.88Å; I298-F304 HydrophobicContact CB-CD2 3.76Å; I298-F304 HydrophobicContact CB-CE1 4.23Å; I298-F304 HydrophobicContact CB-CE2 4.11Å; I298-F304 HydrophobicContact CB-CG 3.63Å; I298-F304 HydrophobicContact CB-CZ 4.33Å; I298-F304 HydrophobicContact CG1-CB 4.37Å; I298-F304 HydrophobicContact CG1-CD1 3.67Å; I298-F304 HydrophobicContact CG1-CD2 4.48Å; I298-F304 HydrophobicContact CG1-CE1 4.04Å; I298-F304 HydrophobicContact CG1-CG 3.91Å; I298-F304 HydrophobicContact CG2-CD1 4.17Å; I298-F304 HydrophobicContact CG2-CD2 3.74Å; I298-F304 HydrophobicContact CG2-CE1 4.01Å; I298-F304 HydrophobicContact CG2-CE2 3.56Å; I298-F304 HydrophobicContact CG2-CG 4.04Å; I298-F304 HydrophobicContact CG2-CZ 3.71Å; I299-F304 HydrophobicContact CD1-CD2 3.78Å; I299-F304 HydrophobicContact CD1-CE2 3.94Å; I299-F304 HydrophobicContact CG1-CD2 3.87Å; I299-F304 HydrophobicContact CG1-CE2 4.18Å; T302-F304 PolarHBondContact O-N 2.92Å; F304-F331 HydrophobicContact CD2-CD2 4.38Å; F304-F331 HydrophobicContact CD2-CE1 4.26Å; F304-F331 HydrophobicContact CD2-CE2 4.11Å; F304-F331 HydrophobicContact CD2-CZ 4.04Å; F304-F331 AromaticContact CE2-CD2 3.92Å; F304-F331 HydrophobicContact CE2-CD2 3.92Å; F304-F331 HydrophobicContact CE2-CE2 4.05Å; F304-F331 HydrophobicContact CE2-CG 4.17Å; F304-F331 HydrophobicContact CE2-CZ 4.39Å; F304-F331 HydrophobicContact CZ-CD2 4.49Å; F304-W354 HydrophobicContact CE2-CH2 4.43Å; F304-W354 HydrophobicContact CE2-CZ2 4.35Å
305	E	95.8	Very high	90.2	Very high	67 Å²	67	56.2 Å²	56.2	31%	0.313	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	129.2	175.2	-171.6	172.7	164.4	0	0	109.1	V291 A292 R303 F331 G333 I334	V291-E305 WeakPolarHBondContact O-CA 3.44Å; A292-E305 HydrophobicContact CB-CG 4.3Å; R303-E305 HydrophobicContact CG-CB 4.17Å; R303-E305 IonicContact CZ-OE2 3.09Å; R303-E305 IonicContact NE-OE2 2.87Å; R303-E305 PolarHBondContact NE-OE2 3.13Å; R303-E305 IonicContact NH2-OE1 3.53Å; R303-E305 IonicContact NH2-OE2 2.65Å; R303-E305 PolarHBondContact NH2-OE2 3.13Å; R303-E305 PolarHBondContact O-N 2.85Å; E305-F331 WeakPolarHBondContact O-CZ 3.27Å; E305-G333 WeakPolarHBondContact O-CA 3.42Å; E305-I334 HydrophobicContact CB-CD1 3.97Å; E305-I334 HydrophobicContact CB-CG1 4.24Å; E305-I334 HydrophobicContact CG-CD1 3.89Å; E305-I334 HydrophobicContact CG-CG1 4.48Å; E305-I334 HydrophobicContact CG-CG2 4.33Å; E305-I334 PolarHBondContact O-N 3.08Å
306	G	94.5	Very high	89.4	Confident	7 Å²	7	54.6 Å²	54.6	7%	0.072	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	152.3	-156.6	-176.7	0	0	0	0	0	113.5	V291 Y332	V291-G306 PolarHBondContact N-O 2.88Å; V291-G306 PolarHBondContact O-N 3.5Å; G306-Y332 CarbonylContact C-O 3.51Å; G306-Y332 VanDerWaalsContact CA-O 3.32Å; G306-Y332 WeakPolarHBondContact CA-O 3.18Å
307	V	94	Very high	88.1	Confident	39 Å²	39	57.1 Å²	57.1	24%	0.236	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	131.5	-178	-179.7	0	0	0	0	110.2	F263 E288 Y289 Y332	F263-V307 HydrophobicContact CD2-CG2 4.08Å; F263-V307 HydrophobicContact CE2-CG1 4.03Å; F263-V307 HydrophobicContact CE2-CG2 3.8Å; E288-V307 HydrophobicContact CB-CG1 3.99Å; Y289-V307 CarbonylContact O-C 3.28Å; Y289-V307 WeakPolarHBondContact O-CA 3.44Å; V307-Y332 PolarHBondContact N-O 2.84Å; V307-Y332 PolarHBondContact O-N 2.6Å
308	L	94.9	Very high	86.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	113.7	174.6	-173.5	71.4	0	0	0	109.5	F277 W280 E288 Y289 V291 I310 L329 F331 W354	F277-L308 HydrophobicContact CE2-CD2 3.8Å; F277-L308 HydrophobicContact CZ-CD2 3.88Å; W280-L308 HydrophobicContact CH2-CD2 4.28Å; W280-L308 HydrophobicContact CZ3-CD2 3.74Å; E288-L308 WeakPolarHBondContact CA-O 3.34Å; Y289-L308 PolarHBondContact N-O 3.34Å; Y289-L308 PolarHBondContact O-N 3.35Å; V291-L308 HydrophobicContact CG1-CB 3.99Å; V291-L308 HydrophobicContact CG1-CD2 4.22Å; V291-L308 HydrophobicContact CG2-CB 3.91Å; L308-I310 HydrophobicContact CD2-CD1 4.03Å; L308-I310 HydrophobicContact CD2-CG1 4.23Å; L308-I310 HydrophobicContact CG-CD1 4.46Å; L308-I310 HydrophobicContact CG-CG1 4.13Å; L308-L329 HydrophobicContact CD1-CB 4.23Å; L308-L329 HydrophobicContact CD1-CD2 4.42Å; L308-L329 HydrophobicContact CD2-CD2 4.2Å; L308-F331 HydrophobicContact CD1-CB 3.83Å; L308-F331 HydrophobicContact CD1-CD2 4.47Å; L308-W354 HydrophobicContact CD1-CH2 4.27Å
309	S	93.5	Very high	85.8	Confident	14 Å²	14	63.1 Å²	63.1	10%	0.098	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	121.7	173.7	-171.4	0	0	0	0	110	G287 L329 T330	G287-S309 WeakPolarHBondContact O-CA 3.2Å; S309-L329 WeakPolarHBondContact O-CA 3.07Å; S309-T330 PolarHBondContact N-O 3.21Å; S309-T330 PolarHBondContact O-N 3.05Å
310	I	93.6	Very high	85.1	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	127.2	-178.3	-59.6	-174.2	0	0	0	109.2	W280 A284 P286 G287 Y289 L308 K327 S328 L329	W280-I310 HydrophobicContact CH2-CD1 3.67Å; W280-I310 HydrophobicContact CZ3-CD1 3.65Å; A284-I310 HydrophobicContact CB-CD1 3.59Å; P286-I310 CarbonylContact C-O 3.6Å; P286-I310 VanDerWaalsContact CA-O 3.24Å; P286-I310 WeakPolarHBondContact CA-O 3.4Å; G287-I310 PolarHBondContact N-O 3.49Å; G287-I310 PolarHBondContact O-N 3.21Å; Y289-I310 HydrophobicContact CD2-CD1 3.98Å; Y289-I310 HydrophobicContact CD2-CG1 4.16Å; Y289-I310 HydrophobicContact CE2-CB 4.25Å; Y289-I310 HydrophobicContact CE2-CD1 3.94Å; Y289-I310 HydrophobicContact CE2-CG1 4.2Å; L308-I310 HydrophobicContact CD2-CD1 4.03Å; L308-I310 HydrophobicContact CD2-CG1 4.23Å; L308-I310 HydrophobicContact CG-CD1 4.46Å; L308-I310 HydrophobicContact CG-CG1 4.13Å; I310-K327 HydrophobicContact CG2-CB 4.13Å; I310-K327 HydrophobicContact CG2-CD 3.92Å; I310-K327 HydrophobicContact CG2-CG 4.39Å; I310-S328 WeakPolarHBondContact CA-O 3.33Å; I310-L329 HydrophobicContact CD1-CD2 4.47Å; I310-L329 HydrophobicContact CG1-CG 4.26Å
311	R	91.8	Very high	85.1	Confident	174 Å²	174	69.1 Å²	69.1	66%	0.657	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.1	174.5	-62.3	-179.4	68.9	176.1	2.1	109.8	K327 S328	R311-K327 CarbonylContact O-C 3.57Å; R311-K327 VanDerWaalsContact O-CA 3.27Å; R311-K327 WeakPolarHBondContact O-CA 3.48Å; R311-S328 PolarHBondContact N-O 2.98Å; R311-S328 PolarHBondContact O-N 2.73Å
312	W	90.6	Very high	85.3	Confident	56 Å²	56	64.4 Å²	64.4	21%	0.212	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.5	167.4	-67.5	5.6	0	0	0	108.8	A284 L285 P286 T320 P322 R325 A326	A284-W312 PolarHBondContact O-NE1 3.31Å; L285-W312 HydrophobicContact CD2-CH2 4.01Å; L285-W312 HydrophobicContact CD2-CZ2 3.81Å; P286-W312 HydrophobicContact CG-CB 4.3Å; P286-W312 HydrophobicContact CG-CD2 3.74Å; P286-W312 HydrophobicContact CG-CE3 4.36Å; P286-W312 HydrophobicContact CG-CG 3.68Å; W312-T320 WeakPolarHBondContact CH2-O 3.12Å; W312-P322 HydrophobicContact CH2-CB 4.39Å; W312-P322 HydrophobicContact CH2-CG 4.19Å; W312-P322 HydrophobicContact CZ2-CB 3.71Å; W312-P322 HydrophobicContact CZ2-CG 3.84Å; W312-R325 HydrophobicContact CD2-CB 3.87Å; W312-R325 HydrophobicContact CD2-CG 3.88Å; W312-R325 HydrophobicContact CE3-CB 4.19Å; W312-R325 HydrophobicContact CE3-CG 3.71Å; W312-R325 HydrophobicContact CG-CB 4.11Å; W312-R325 HydrophobicContact CH2-CG 4.03Å; W312-R325 HydrophobicContact CZ2-CG 4.18Å; W312-R325 HydrophobicContact CZ3-CG 3.8Å; W312-A326 WeakPolarHBondContact CA-O 3.48Å
313	T	88.2	Confident	85.3	Confident	79 Å²	79	69.5 Å²	69.5	49%	0.485	35%	0.354	S	S	.	.			trans	-104.7	-6.1	-171.8	51.1	0	0	0	0	113.9	A326 S328	T313-A326 PolarHBondContact N-O 3.21Å; T313-A326 PolarHBondContact OG1-O 3.23Å; T313-S328 VanDerWaalsContact CG2-CB 3.44Å
314	D	82.7	Confident	85.1	Confident	34 Å²	34	69.5 Å²	69.5	18%	0.182	36%	0.355	C	S	.	.			trans	-107.6	149.4	172.3	53.6	11.6	0	0	0	110.7	R316 R325 A326	D314-R316 HydrophobicContact CB-CG 4.37Å; D314-R316 IonicContact OD2-NE 2.69Å; D314-R325 PolarHBondContact O-NH2 2.89Å; D314-R325 IonicContact OD1-CZ 3.25Å; D314-R325 IonicContact OD1-NE 2.7Å; D314-R325 PolarHBondContact OD1-NE 2.64Å; D314-R325 IonicContact OD1-NH2 3.42Å; D314-A326 PolarHBondContact OD2-N 3.1Å
315	A	75.6	Confident	84.9	Confident	101 Å²	101	70.5 Å²	70.5	84%	0.835	36%	0.359	S	S	*	.			trans	-107.1	80.3	170.6	0	0	0	0	0	108.7	P317	A315-P317 WeakPolarHBondContact O-CD 3.28Å
316	R	72.6	Confident	84.6	Confident	107 Å²	107	67.6 Å²	67.6	40%	0.404	35%	0.346	S	S	.	.			trans	-93.9	118	176.8	-71.4	-178.6	166.7	-125.4	-17.1	110.4	D314 R325 Y345	D314-R316 HydrophobicContact CB-CG 4.37Å; D314-R316 IonicContact OD2-NE 2.69Å; R316-R325 VanDerWaalsContact N-NH2 3.2Å; R316-R325 PolarHBondContact O-NH1 3.36Å; R316-Y345 PolarHBondContact NE-OH 3.22Å; R316-Y345 PolarHBondContact NH1-OH 3.4Å; R316-Y345 VanDerWaalsContact NH1-OH 3.13Å; R316-Y345 PolarHBondContact NH2-OH 3.14Å
317	P	62	Low	84.5	Confident	125 Å²	125	67.2 Å²	67.2	81%	0.812	34%	0.343	S	S	*	.	S	Bend	trans	-73.8	-19.8	175.4	27	-30.7	0	0	0	112.6	A315 T319	A315-P317 WeakPolarHBondContact O-CD 3.28Å; P317-T319 PolarHBondContact O-N 3.46Å
318	E	66	Low	84.5	Confident	173 Å²	173	66.4 Å²	66.4	81%	0.808	34%	0.338	S	S	*	.	S	Bend	trans	-80.9	-17.7	-164.5	-39.1	-165.6	-126.5	0	0	113.4
319	T	69.3	Low	84.6	Confident	27 Å²	27	66.4 Å²	66.4	17%	0.166	34%	0.338	C	S	.	.			trans	-156.9	133.5	178.1	-178	0	0	0	0	112.2	P317 E321 R325	P317-T319 PolarHBondContact O-N 3.46Å; T319-E321 VanDerWaalsContact C-N 3.32Å; T319-E321 VanDerWaalsContact OG1-CB 3.28Å; T319-E321 WeakPolarHBondContact OG1-CB 3.34Å; T319-E321 WeakPolarHBondContact OG1-CG 3.37Å; T319-E321 PolarHBondContact OG1-N 3.13Å; T319-R325 PolarHBondContact O-NH1 3.33Å
320	T	75.8	Confident	84.7	Confident	123 Å²	123	66.8 Å²	66.8	76%	0.755	34%	0.34	S	S	*	.			trans	-90.7	2.5	168.1	51.7	0	0	0	0	112	W312 P322	W312-T320 WeakPolarHBondContact CH2-O 3.12Å; T320-P322 WeakPolarHBondContact O-CD 3.37Å
321	E	86.8	Confident	84.9	Confident	76 Å²	76	66.7 Å²	66.7	36%	0.355	34%	0.34	S	S	.	.			trans	-75.4	124.8	-177.8	-65.2	-174.9	-125.7	0	0	111.6	T319 R323 Y324 R325	T319-E321 VanDerWaalsContact C-N 3.32Å; T319-E321 VanDerWaalsContact OG1-CB 3.28Å; T319-E321 WeakPolarHBondContact OG1-CB 3.34Å; T319-E321 WeakPolarHBondContact OG1-CG 3.37Å; T319-E321 PolarHBondContact OG1-N 3.13Å; E321-R323 HydrophobicContact CB-CG 4.44Å; E321-R323 PolarHBondContact O-N 3.25Å; E321-R323 VanDerWaalsContact O-N 3.12Å; E321-R323 IonicContact OE2-CZ 3.15Å; E321-R323 IonicContact OE2-NE 2.77Å; E321-R323 PolarHBondContact OE2-NE 3.43Å; E321-R323 IonicContact OE2-NH2 2.75Å; E321-R323 PolarHBondContact OE2-NH2 3.26Å; E321-Y324 HydrophobicContact CB-CD2 4.21Å; E321-Y324 PolarHBondContact O-N 3.36Å; E321-R325 WeakPolarHBondContact O-CG 3.28Å
322	P	89.7	Confident	85	Confident	28 Å²	28	63.5 Å²	63.5	18%	0.182	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-57.9	-33.5	-175.4	-26.7	33.8	0	0	0	114.6	R282 N283 L285 W312 T320 Y324 R325 K327	R282-P322 CarbonylContact O-C 3.28Å; R282-P322 VanDerWaalsContact O-C 3.28Å; N283-P322 VanDerWaalsContact O-CB 3.3Å; N283-P322 WeakPolarHBondContact O-CB 3.18Å; N283-P322 WeakPolarHBondContact O-CG 3.18Å; L285-P322 HydrophobicContact CD2-CG 3.79Å; L285-P322 HydrophobicContact CG-CG 4.4Å; W312-P322 HydrophobicContact CH2-CB 4.39Å; W312-P322 HydrophobicContact CH2-CG 4.19Å; W312-P322 HydrophobicContact CZ2-CB 3.71Å; W312-P322 HydrophobicContact CZ2-CG 3.84Å; T320-P322 WeakPolarHBondContact O-CD 3.37Å; P322-Y324 PolarHBondContact O-N 2.97Å; P322-Y324 VanDerWaalsContact O-N 3.14Å; P322-R325 PolarHBondContact O-N 3.49Å; P322-K327 PolarHBondContact O-NZ 2.85Å
323	R	88.1	Confident	85.2	Confident	115 Å²	115	61.4 Å²	61.4	43%	0.434	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20	-175.3	70.7	-177.9	120.4	-161.1	-1.5	114.8	R282 E321 Y345	R282-R323 HydrophobicContact CG-CB 3.87Å; R282-R323 VanDerWaalsContact O-CA 3.23Å; R282-R323 WeakPolarHBondContact O-CA 3.21Å; R282-R323 PolarHBondContact O-N 3.18Å; E321-R323 HydrophobicContact CB-CG 4.44Å; E321-R323 PolarHBondContact O-N 3.25Å; E321-R323 VanDerWaalsContact O-N 3.12Å; E321-R323 IonicContact OE2-CZ 3.15Å; E321-R323 IonicContact OE2-NE 2.77Å; E321-R323 PolarHBondContact OE2-NE 3.43Å; E321-R323 IonicContact OE2-NH2 2.75Å; E321-R323 PolarHBondContact OE2-NH2 3.26Å; R323-Y345 WeakPolarHBondContact O-CB 3.4Å
324	Y	87.6	Confident	85.4	Confident	113 Å²	113	61.7 Å²	61.7	44%	0.443	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-109.6	21.9	-178.4	-57.9	-55.5	0	0	0	113	E321 P322 Y345	E321-Y324 HydrophobicContact CB-CD2 4.21Å; E321-Y324 PolarHBondContact O-N 3.36Å; P322-Y324 PolarHBondContact O-N 2.97Å; P322-Y324 VanDerWaalsContact O-N 3.14Å; Y324-Y345 HydrophobicContact CD1-CD2 4.42Å; Y324-Y345 WeakPolarHBondContact O-CE1 3.4Å
325	R	88.9	Confident	85.6	Confident	21 Å²	21	65.7 Å²	65.7	8%	0.079	34%	0.344	C	S	.	.	S	Bend	trans	-115.6	131.4	-179.1	-55.4	-58.3	-67.5	-120.4	-5.5	111.3	W312 D314 R316 T319 E321 P322 K327 Y343	W312-R325 HydrophobicContact CD2-CB 3.87Å; W312-R325 HydrophobicContact CD2-CG 3.88Å; W312-R325 HydrophobicContact CE3-CB 4.19Å; W312-R325 HydrophobicContact CE3-CG 3.71Å; W312-R325 HydrophobicContact CG-CB 4.11Å; W312-R325 HydrophobicContact CH2-CG 4.03Å; W312-R325 HydrophobicContact CZ2-CG 4.18Å; W312-R325 HydrophobicContact CZ3-CG 3.8Å; D314-R325 PolarHBondContact O-NH2 2.89Å; D314-R325 IonicContact OD1-CZ 3.25Å; D314-R325 IonicContact OD1-NE 2.7Å; D314-R325 PolarHBondContact OD1-NE 2.64Å; D314-R325 IonicContact OD1-NH2 3.42Å; R316-R325 VanDerWaalsContact N-NH2 3.2Å; R316-R325 PolarHBondContact O-NH1 3.36Å; T319-R325 PolarHBondContact O-NH1 3.33Å; E321-R325 WeakPolarHBondContact O-CG 3.28Å; P322-R325 PolarHBondContact O-N 3.49Å; R325-K327 PolarHBondContact O-NZ 2.82Å; R325-Y343 WeakPolarHBondContact O-CD1 3.45Å
326	A	90	Very high	86.1	Confident	6 Å²	6	62.9 Å²	62.9	5%	0.05	32%	0.324	C	S	.	.			trans	-66.1	135.7	168.3	0	0	0	0	0	109.5	W312 T313 D314 Y345	W312-A326 WeakPolarHBondContact CA-O 3.48Å; T313-A326 PolarHBondContact N-O 3.21Å; T313-A326 PolarHBondContact OG1-O 3.23Å; D314-A326 PolarHBondContact OD2-N 3.1Å; A326-Y345 HydrophobicContact CB-CE1 4.43Å
327	K	92.7	Very high	86.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138.2	-178.9	-47.1	178.5	-177.7	66.5	0	110.7	V281 R282 A284 I310 R311 P322 R325 L329 R342 Y343	V281-K327 HydrophobicContact CG1-CD 4.47Å; V281-K327 WeakPolarHBondContact O-CD 3.41Å; V281-K327 WeakPolarHBondContact O-CE 3.34Å; V281-K327 PolarHBondContact O-NZ 2.87Å; R282-K327 PolarHBondContact O-NZ 3.05Å; A284-K327 WeakPolarHBondContact O-CE 3.46Å; I310-K327 HydrophobicContact CG2-CB 4.13Å; I310-K327 HydrophobicContact CG2-CD 3.92Å; I310-K327 HydrophobicContact CG2-CG 4.39Å; R311-K327 CarbonylContact O-C 3.57Å; R311-K327 VanDerWaalsContact O-CA 3.27Å; R311-K327 WeakPolarHBondContact O-CA 3.48Å; P322-K327 PolarHBondContact O-NZ 2.85Å; R325-K327 PolarHBondContact O-NZ 2.82Å; K327-L329 HydrophobicContact CB-CD1 3.86Å; K327-R342 CarbonylContact O-C 3.58Å; K327-R342 WeakPolarHBondContact O-CA 3.34Å; K327-R342 WeakPolarHBondContact O-CG 3.45Å; K327-Y343 HydrophobicContact CB-CD1 4.46Å; K327-Y343 HydrophobicContact CD-CD1 4.2Å; K327-Y343 HydrophobicContact CG-CD1 4.03Å; K327-Y343 PolarHBondContact N-O 2.87Å; K327-Y343 VanDerWaalsContact N-O 3.13Å; K327-Y343 PolarHBondContact O-N 3.48Å
328	S	94.7	Very high	88.3	Confident	21 Å²	21	55.2 Å²	55.2	15%	0.147	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	128.1	163.5	162	0	0	0	0	107.7	I310 R311 T313 H340	I310-S328 WeakPolarHBondContact CA-O 3.33Å; R311-S328 PolarHBondContact N-O 2.98Å; R311-S328 PolarHBondContact O-N 2.73Å; T313-S328 VanDerWaalsContact CG2-CB 3.44Å; S328-H340 PolarHBondContact OG-CE1 2.65Å
329	L	96.6	Very high	89.7	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.7	179.1	-67.7	84.7	0	0	0	108.6	F277 V281 L308 S309 I310 K327 H340 T341 L351	F277-L329 HydrophobicContact CZ-CD2 4.18Å; V281-L329 HydrophobicContact CB-CD2 4.34Å; V281-L329 HydrophobicContact CG1-CD1 4.11Å; V281-L329 HydrophobicContact CG1-CD2 3.7Å; V281-L329 HydrophobicContact CG1-CG 4.48Å; V281-L329 HydrophobicContact CG2-CD2 3.6Å; L308-L329 HydrophobicContact CD1-CB 4.23Å; L308-L329 HydrophobicContact CD1-CD2 4.42Å; L308-L329 HydrophobicContact CD2-CD2 4.2Å; S309-L329 WeakPolarHBondContact O-CA 3.07Å; I310-L329 HydrophobicContact CD1-CD2 4.47Å; I310-L329 HydrophobicContact CG1-CG 4.26Å; K327-L329 HydrophobicContact CB-CD1 3.86Å; L329-H340 WeakPolarHBondContact O-CA 3.41Å; L329-H340 PolarHBondContact O-ND1 2.93Å; L329-T341 HydrophobicContact CB-CG2 3.78Å; L329-T341 HydrophobicContact CD1-CG2 4.44Å; L329-T341 HydrophobicContact CD2-CG2 4.37Å; L329-T341 HydrophobicContact CG-CG2 4.43Å; L329-T341 PolarHBondContact N-O 2.84Å; L329-T341 PolarHBondContact O-N 2.98Å; L329-L351 HydrophobicContact CD1-CD2 4.15Å; L329-L351 HydrophobicContact CD2-CD2 4.3Å
330	T	96.2	Very high	91	Very high	22 Å²	22	50.2 Å²	50.2	14%	0.135	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.3	171.8	-56.8	0	0	0	0	108.5	S309 Y332 I338 Y339 I357	S309-T330 PolarHBondContact N-O 3.21Å; S309-T330 PolarHBondContact O-N 3.05Å; T330-Y332 HydrophobicContact CG2-CD2 4.25Å; T330-Y332 HydrophobicContact CG2-CE1 4.21Å; T330-Y332 HydrophobicContact CG2-CE2 3.57Å; T330-I338 HydrophobicContact CG2-CG2 3.68Å; T330-Y339 CarbonylContact C-O 3.5Å; T330-Y339 WeakPolarHBondContact CA-O 3.12Å; T330-I357 HydrophobicContact CG2-CD1 4.14Å
331	F	96.3	Very high	91.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.2	177.3	172.9	-111	0	0	0	109.6	V291 I299 T302 F304 E305 L308 G333 I338 Y339 W354	V291-F331 HydrophobicContact CG2-CD2 4.11Å; V291-F331 HydrophobicContact CG2-CE2 3.95Å; I299-F331 HydrophobicContact CD1-CB 4.42Å; I299-F331 HydrophobicContact CD1-CD1 3.52Å; I299-F331 HydrophobicContact CD1-CE1 4.02Å; I299-F331 HydrophobicContact CD1-CG 4.12Å; T302-F331 HydrophobicContact CG2-CE1 4.35Å; F304-F331 HydrophobicContact CD2-CD2 4.38Å; F304-F331 HydrophobicContact CD2-CE1 4.26Å; F304-F331 HydrophobicContact CD2-CE2 4.11Å; F304-F331 HydrophobicContact CD2-CZ 4.04Å; F304-F331 AromaticContact CE2-CD2 3.92Å; F304-F331 HydrophobicContact CE2-CD2 3.92Å; F304-F331 HydrophobicContact CE2-CE2 4.05Å; F304-F331 HydrophobicContact CE2-CG 4.17Å; F304-F331 HydrophobicContact CE2-CZ 4.39Å; F304-F331 HydrophobicContact CZ-CD2 4.49Å; E305-F331 WeakPolarHBondContact O-CZ 3.27Å; L308-F331 HydrophobicContact CD1-CB 3.83Å; L308-F331 HydrophobicContact CD1-CD2 4.47Å; F331-G333 VanDerWaalsContact CZ-CA 3.47Å; F331-I338 CarbonylContact O-C 3.52Å; F331-I338 VanDerWaalsContact O-CA 3.23Å; F331-I338 WeakPolarHBondContact O-CA 3.48Å; F331-Y339 HydrophobicContact CD1-CD2 4.12Å; F331-Y339 PolarHBondContact N-O 3.36Å; F331-Y339 PolarHBondContact O-N 3.05Å; F331-W354 HydrophobicContact CB-CH2 4.18Å; F331-W354 HydrophobicContact CB-CZ3 3.91Å
332	Y	94.5	Very high	92.2	Very high	106 Å²	106	46.6 Å²	46.6	42%	0.416	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	97.7	174.1	-59.5	-91.8	0	0	0	107.9	G306 V307 T330 I338	G306-Y332 CarbonylContact C-O 3.51Å; G306-Y332 VanDerWaalsContact CA-O 3.32Å; G306-Y332 WeakPolarHBondContact CA-O 3.18Å; V307-Y332 PolarHBondContact N-O 2.84Å; V307-Y332 PolarHBondContact O-N 2.6Å; T330-Y332 HydrophobicContact CG2-CD2 4.25Å; T330-Y332 HydrophobicContact CG2-CE1 4.21Å; T330-Y332 HydrophobicContact CG2-CE2 3.57Å; Y332-I338 HydrophobicContact CD1-CD1 3.89Å; Y332-I338 HydrophobicContact CD1-CG1 3.87Å; Y332-I338 HydrophobicContact CD1-CG2 4.12Å; Y332-I338 HydrophobicContact CE1-CD1 3.97Å; Y332-I338 HydrophobicContact CE1-CG1 4.33Å; Y332-I338 HydrophobicContact CE1-CG2 4.06Å
333	G	94	Very high	92.4	Very high	12 Å²	12	45.2 Å²	45.2	12%	0.124	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	145.9	-178.3	0	0	0	0	0	112.3	E305 F331 N335 G336 P337	E305-G333 WeakPolarHBondContact O-CA 3.42Å; F331-G333 VanDerWaalsContact CZ-CA 3.47Å; G333-N335 PolarHBondContact O-N 2.71Å; G333-N335 VanDerWaalsContact O-N 3.11Å; G333-G336 PolarHBondContact O-N 3.07Å; G333-P337 PolarHBondContact N-O 2.6Å
334	I	92.5	Very high	92.4	Very high	86 Å²	86	41 Å²	41	44%	0.441	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26	179	59.4	171.8	0	0	0	113.6	R303 E305 G336	R303-I334 VanDerWaalsContact CZ-CD1 3.47Å; E305-I334 HydrophobicContact CB-CD1 3.97Å; E305-I334 HydrophobicContact CB-CG1 4.24Å; E305-I334 HydrophobicContact CG-CD1 3.89Å; E305-I334 HydrophobicContact CG-CG1 4.48Å; E305-I334 HydrophobicContact CG-CG2 4.33Å; E305-I334 PolarHBondContact O-N 3.08Å; I334-G336 VanDerWaalsContact C-N 3.26Å; I334-G336 PolarHBondContact O-N 2.72Å
335	N	88.6	Confident	92.2	Very high	118 Å²	118	37.8 Å²	37.8	63%	0.631	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	1.6	177.7	-69.7	-12.1	0	0	0	112.6	G333 P337	G333-N335 PolarHBondContact O-N 2.71Å; G333-N335 VanDerWaalsContact O-N 3.11Å; N335-P337 VanDerWaalsContact O-CD 3.29Å; N335-P337 WeakPolarHBondContact O-CD 3.41Å
336	G	85.3	Confident	91.6	Very high	41 Å²	41	46.2 Å²	46.2	42%	0.423	23%	0.226	S	C	.	.	S	Bend	trans	104.9	-28.2	179.6	0	0	0	0	0	117.2	G333 I334 I338 N358	G333-G336 PolarHBondContact O-N 3.07Å; I334-G336 VanDerWaalsContact C-N 3.26Å; I334-G336 PolarHBondContact O-N 2.72Å; G336-I338 PolarHBondContact O-N 3.45Å; G336-N358 PolarHBondContact O-ND2 3.08Å
337	P	87.4	Confident	91	Very high	28 Å²	28	50.5 Å²	50.5	18%	0.182	25%	0.254	C	S	.	.			trans	-59.5	136.2	-179.9	-27.2	34.4	0	0	0	113.2	G333 N335 Y339	G333-P337 PolarHBondContact N-O 2.6Å; N335-P337 VanDerWaalsContact O-CD 3.29Å; N335-P337 WeakPolarHBondContact O-CD 3.41Å; P337-Y339 HydrophobicContact CB-CD2 3.97Å; P337-Y339 HydrophobicContact CB-CE2 3.42Å; P337-Y339 VanDerWaalsContact CB-CE2 3.42Å; P337-Y339 HydrophobicContact CG-CE2 4.48Å
338	I	93.7	Very high	90.4	Very high	44 Å²	44	55.8 Å²	55.8	23%	0.226	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.4	174.4	-54.9	175.3	0	0	0	107.7	T330 F331 Y332 G336 K356 I357 N358	T330-I338 HydrophobicContact CG2-CG2 3.68Å; F331-I338 CarbonylContact O-C 3.52Å; F331-I338 VanDerWaalsContact O-CA 3.23Å; F331-I338 WeakPolarHBondContact O-CA 3.48Å; Y332-I338 HydrophobicContact CD1-CD1 3.89Å; Y332-I338 HydrophobicContact CD1-CG1 3.87Å; Y332-I338 HydrophobicContact CD1-CG2 4.12Å; Y332-I338 HydrophobicContact CE1-CD1 3.97Å; Y332-I338 HydrophobicContact CE1-CG1 4.33Å; Y332-I338 HydrophobicContact CE1-CG2 4.06Å; G336-I338 PolarHBondContact O-N 3.45Å; I338-K356 WeakPolarHBondContact O-CA 3.5Å; I338-I357 HydrophobicContact CG2-CB 4.42Å; I338-I357 HydrophobicContact CG2-CD1 3.73Å; I338-I357 HydrophobicContact CG2-CG1 4.23Å; I338-I357 PolarHBondContact O-N 3.28Å; I338-N358 HydrophobicContact CB-CB 4.35Å; I338-N358 HydrophobicContact CD1-CB 4.28Å; I338-N358 HydrophobicContact CG1-CB 4.39Å; I338-N358 PolarHBondContact N-OD1 2.98Å; I338-N358 PolarHBondContact O-OD1 3.24Å
339	Y	94.7	Very high	89.9	Confident	30 Å²	30	56.5 Å²	56.5	12%	0.118	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	142.6	178.8	-70.4	-89.3	0	0	0	111	I299 T302 T330 F331 P337 W354 V355 K356	I299-Y339 HydrophobicContact CD1-CD2 3.95Å; I299-Y339 HydrophobicContact CD1-CG 4.03Å; I299-Y339 HydrophobicContact CG2-CD1 4.06Å; I299-Y339 HydrophobicContact CG2-CD2 4.21Å; I299-Y339 HydrophobicContact CG2-CE1 3.91Å; I299-Y339 HydrophobicContact CG2-CE2 4.02Å; I299-Y339 HydrophobicContact CG2-CG 4.21Å; T302-Y339 HydrophobicContact CG2-CD2 4.41Å; T302-Y339 HydrophobicContact CG2-CE2 3.72Å; T302-Y339 WeakPolarHBondContact OG1-CE2 3.37Å; T302-Y339 PolarHBondContact OG1-OH 3.35Å; T330-Y339 CarbonylContact C-O 3.5Å; T330-Y339 WeakPolarHBondContact CA-O 3.12Å; F331-Y339 HydrophobicContact CD1-CD2 4.12Å; F331-Y339 PolarHBondContact N-O 3.36Å; F331-Y339 PolarHBondContact O-N 3.05Å; P337-Y339 HydrophobicContact CB-CD2 3.97Å; P337-Y339 HydrophobicContact CB-CE2 3.42Å; P337-Y339 VanDerWaalsContact CB-CE2 3.42Å; P337-Y339 HydrophobicContact CG-CE2 4.48Å; Y339-W354 HydrophobicContact CD1-CB 4.3Å; Y339-V355 CarbonylContact C-O 3.58Å; Y339-V355 WeakPolarHBondContact CA-O 3.48Å; Y339-K356 HydrophobicContact CD1-CB 3.88Å; Y339-K356 HydrophobicContact CD1-CG 4.33Å; Y339-K356 HydrophobicContact CE1-CB 3.58Å; Y339-K356 HydrophobicContact CE1-CD 4.33Å; Y339-K356 HydrophobicContact CE1-CG 3.93Å
340	H	95.8	Very high	89.5	Confident	64 Å²	64	64 Å²	64	30%	0.296	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142	172.7	-175.4	75.3	0	0	0	110.9	S328 L329 W354 V355 I357	S328-H340 PolarHBondContact OG-CE1 2.65Å; L329-H340 WeakPolarHBondContact O-CA 3.41Å; L329-H340 PolarHBondContact O-ND1 2.93Å; H340-W354 WeakPolarHBondContact O-CA 3.12Å; H340-V355 PolarHBondContact N-O 2.77Å; H340-V355 PolarHBondContact O-N 3.18Å; H340-I357 HydrophobicContact CB-CD1 3.6Å; H340-I357 HydrophobicContact CB-CG1 3.84Å
341	T	95.4	Very high	89.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	164.1	164	-172.3	0	0	0	0	110	L329 L351 T352 W354	L329-T341 HydrophobicContact CB-CG2 3.78Å; L329-T341 HydrophobicContact CD1-CG2 4.44Å; L329-T341 HydrophobicContact CD2-CG2 4.37Å; L329-T341 HydrophobicContact CG-CG2 4.43Å; L329-T341 PolarHBondContact N-O 2.84Å; L329-T341 PolarHBondContact O-N 2.98Å; T341-L351 HydrophobicContact CG2-CD2 3.92Å; T341-T352 PolarHBondContact OG1-O 3.39Å; T341-T352 PolarHBondContact OG1-OG1 3.39Å; T341-T352 VanDerWaalsContact OG1-OG1 3.08Å; T341-W354 HydrophobicContact CG2-CD2 3.85Å; T341-W354 HydrophobicContact CG2-CE3 3.56Å; T341-W354 HydrophobicContact CG2-CH2 3.55Å; T341-W354 HydrophobicContact CG2-CZ2 3.8Å; T341-W354 HydrophobicContact CG2-CZ3 3.43Å; T341-W354 VanDerWaalsContact CG2-CZ3 3.43Å
342	R	93.9	Very high	88.8	Confident	123 Å²	123	67.5 Å²	67.5	46%	0.464	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.7	176.3	-175.6	-177.6	174.3	-168.2	0.1	109.8	K327 L351 T352	K327-R342 CarbonylContact O-C 3.58Å; K327-R342 WeakPolarHBondContact O-CA 3.34Å; K327-R342 WeakPolarHBondContact O-CG 3.45Å; R342-L351 CarbonylContact O-C 3.5Å; R342-L351 WeakPolarHBondContact O-CA 3.34Å; R342-T352 HydrophobicContact CB-CG2 3.98Å; R342-T352 PolarHBondContact N-OG1 3.47Å; R342-T352 PolarHBondContact O-N 3.27Å; R342-T352 PolarHBondContact O-OG1 3.06Å
343	Y	93.2	Very high	88.4	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.3	165.5	174.1	-106.9	0	0	0	110.1	L278 V281 R282 R325 K327 S349 L351	L278-Y343 HydrophobicContact CD1-CD2 4.09Å; L278-Y343 HydrophobicContact CD1-CE2 4.09Å; V281-Y343 HydrophobicContact CG1-CD2 4.14Å; V281-Y343 HydrophobicContact CG1-CG 3.98Å; R282-Y343 WeakPolarHBondContact CG-OH 3.44Å; R325-Y343 WeakPolarHBondContact O-CD1 3.45Å; K327-Y343 HydrophobicContact CB-CD1 4.46Å; K327-Y343 HydrophobicContact CD-CD1 4.2Å; K327-Y343 HydrophobicContact CG-CD1 4.03Å; K327-Y343 PolarHBondContact N-O 2.87Å; K327-Y343 VanDerWaalsContact N-O 3.13Å; K327-Y343 PolarHBondContact O-N 3.48Å; Y343-S349 PolarHBondContact OH-OG 2.94Å; Y343-L351 HydrophobicContact CD2-CD2 4.42Å
344	C	87.9	Confident	88.3	Confident	25 Å²	25	67.2 Å²	67.2	17%	0.169	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.9	171	-63	0	0	0	0	108.4	S349 R350	C344-S349 CarbonylContact O-C 3.56Å; C344-S349 VanDerWaalsContact O-CA 3.23Å; C344-S349 WeakPolarHBondContact O-CA 3.31Å; C344-R350 PolarHBondContact N-O 3.17Å; C344-R350 PolarHBondContact O-N 2.78Å
345	Y	83.1	Confident	88.1	Confident	47 Å²	47	67.4 Å²	67.4	18%	0.184	35%	0.352	C	S	.	.			trans	-89.4	-23.6	177.4	66.7	-85.6	0	0	0	112.8	R316 R323 Y324 A326 S349	R316-Y345 PolarHBondContact NE-OH 3.22Å; R316-Y345 PolarHBondContact NH1-OH 3.4Å; R316-Y345 VanDerWaalsContact NH1-OH 3.13Å; R316-Y345 PolarHBondContact NH2-OH 3.14Å; R323-Y345 WeakPolarHBondContact O-CB 3.4Å; Y324-Y345 HydrophobicContact CD1-CD2 4.42Å; Y324-Y345 WeakPolarHBondContact O-CE1 3.4Å; A326-Y345 HydrophobicContact CB-CE1 4.43Å; Y345-S349 PolarHBondContact O-N 3.39Å; Y345-S349 PolarHBondContact O-OG 3.3Å
346	W	76.2	Confident	88.1	Confident	197 Å²	197	64.4 Å²	64.4	75%	0.746	33%	0.333	S	S	*	.	S	Bend	trans	-127.3	146.4	-178.5	-171.5	88.1	0	0	0	111.8	I348	W346-I348 VanDerWaalsContact C-N 3.31Å
347	P	78	Confident	88.1	Confident	96 Å²	96	67 Å²	67	62%	0.623	34%	0.336	S	S	*	.	S	Bend	cis	-73.1	-20.9	-8.2	30.1	-34.6	0	0	0	112.9
348	I	80	Confident	87.8	Confident	112 Å²	112	68.1 Å²	68.1	57%	0.574	34%	0.341	S	S	*	.	S	Bend	trans	-124.6	127.2	178.8	-58.5	173.4	0	0	0	107.8	W346 R350	W346-I348 VanDerWaalsContact C-N 3.31Å; I348-R350 PolarHBondContact O-N 2.83Å; I348-R350 VanDerWaalsContact O-N 3.07Å
349	S	84.2	Confident	86.8	Confident	36 Å²	36	70.2 Å²	70.2	25%	0.252	35%	0.352	S	S	.	.			trans	-63	106.1	174.2	-83	0	0	0	0	111.1	Y343 C344 Y345	Y343-S349 PolarHBondContact OH-OG 2.94Å; C344-S349 CarbonylContact O-C 3.56Å; C344-S349 VanDerWaalsContact O-CA 3.23Å; C344-S349 WeakPolarHBondContact O-CA 3.31Å; Y345-S349 PolarHBondContact O-N 3.39Å; Y345-S349 PolarHBondContact O-OG 3.3Å
350	R	89.3	Confident	85.7	Confident	156 Å²	156	71.6 Å²	71.6	59%	0.589	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.7	157.3	-179.1	67.3	-175.5	178.3	174.5	0.2	112.1	C344 I348	C344-R350 PolarHBondContact N-O 3.17Å; C344-R350 PolarHBondContact O-N 2.78Å; I348-R350 PolarHBondContact O-N 2.83Å; I348-R350 VanDerWaalsContact O-N 3.07Å
351	L	90.7	Very high	84.1	Confident	39 Å²	39	73.5 Å²	73.5	20%	0.204	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	145.2	161.2	-70	171.6	0	0	0	109.4	F277 L278 V281 L329 T341 R342 Y343	F277-L351 HydrophobicContact CD1-CD1 3.73Å; F277-L351 HydrophobicContact CE1-CD1 3.49Å; F277-L351 VanDerWaalsContact CE1-CD1 3.49Å; L278-L351 HydrophobicContact CD1-CD1 4.46Å; L278-L351 HydrophobicContact CD1-CG 3.95Å; V281-L351 HydrophobicContact CG1-CD2 4.15Å; L329-L351 HydrophobicContact CD1-CD2 4.15Å; L329-L351 HydrophobicContact CD2-CD2 4.3Å; T341-L351 HydrophobicContact CG2-CD2 3.92Å; R342-L351 CarbonylContact O-C 3.5Å; R342-L351 WeakPolarHBondContact O-CA 3.34Å; Y343-L351 HydrophobicContact CD2-CD2 4.42Å
352	T	86.6	Confident	82.8	Confident	58 Å²	58	81 Å²	81	36%	0.356	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-69.5	167.8	163.2	61.1	0	0	0	0	109.8	T341 R342	T341-T352 PolarHBondContact OG1-O 3.39Å; T341-T352 PolarHBondContact OG1-OG1 3.39Å; T341-T352 VanDerWaalsContact OG1-OG1 3.08Å; R342-T352 HydrophobicContact CB-CG2 3.98Å; R342-T352 PolarHBondContact N-OG1 3.47Å; R342-T352 PolarHBondContact O-N 3.27Å; R342-T352 PolarHBondContact O-OG1 3.06Å
353	G	86.4	Confident	81.4	Confident	59 Å²	59	77 Å²	77	61%	0.608	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-56.2	144.9	169.5	0	0	0	0	0	111
354	W	91.8	Very high	80.1	Confident	52 Å²	52	81 Å²	81	20%	0.197	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-71.5	134.7	173.2	-70.4	103.6	0	0	0	110.3	F277 I298 I299 F304 L308 F331 Y339 H340 T341	F277-W354 HydrophobicContact CE1-CH2 4.36Å; F277-W354 AromaticContact CE1-CZ2 3.72Å; F277-W354 HydrophobicContact CE1-CZ2 3.72Å; F277-W354 HydrophobicContact CZ-CH2 4.27Å; F277-W354 HydrophobicContact CZ-CZ2 4.04Å; I298-W354 HydrophobicContact CG2-CZ2 4.17Å; I298-W354 PolarHBondContact O-NE1 2.58Å; I299-W354 HydrophobicContact CD1-CD2 3.9Å; I299-W354 HydrophobicContact CD1-CE3 3.97Å; I299-W354 HydrophobicContact CD1-CG 4.44Å; I299-W354 HydrophobicContact CD1-CH2 4.14Å; I299-W354 HydrophobicContact CD1-CZ2 4.1Å; I299-W354 HydrophobicContact CD1-CZ3 4.07Å; I299-W354 HydrophobicContact CG1-CD2 3.78Å; I299-W354 HydrophobicContact CG1-CE3 4.37Å; I299-W354 HydrophobicContact CG1-CG 3.97Å; I299-W354 HydrophobicContact CG1-CZ2 3.98Å; I299-W354 HydrophobicContact CG2-CB 4.43Å; I299-W354 HydrophobicContact CG2-CG 4.45Å; F304-W354 HydrophobicContact CE2-CH2 4.43Å; F304-W354 HydrophobicContact CE2-CZ2 4.35Å; L308-W354 HydrophobicContact CD1-CH2 4.27Å; F331-W354 HydrophobicContact CB-CH2 4.18Å; F331-W354 HydrophobicContact CB-CZ3 3.91Å; Y339-W354 HydrophobicContact CD1-CB 4.3Å; H340-W354 WeakPolarHBondContact O-CA 3.12Å; T341-W354 HydrophobicContact CG2-CD2 3.85Å; T341-W354 HydrophobicContact CG2-CE3 3.56Å; T341-W354 HydrophobicContact CG2-CH2 3.55Å; T341-W354 HydrophobicContact CG2-CZ2 3.8Å; T341-W354 HydrophobicContact CG2-CZ3 3.43Å; T341-W354 VanDerWaalsContact CG2-CZ3 3.43Å
355	V	88.2	Confident	78.7	Confident	91 Å²	91	84.2 Å²	84.2	55%	0.552	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	123.3	178.1	-179.4	0	0	0	0	108.7	Y339 H340	Y339-V355 CarbonylContact C-O 3.58Å; Y339-V355 WeakPolarHBondContact CA-O 3.48Å; H340-V355 PolarHBondContact N-O 2.77Å; H340-V355 PolarHBondContact O-N 3.18Å
356	K	87.7	Confident	77.5	Confident	54 Å²	54	88.4 Å²	88.4	24%	0.235	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	127	174.6	-164.6	177	-178	-177.2	0	109.5	I338 Y339 D363	I338-K356 WeakPolarHBondContact O-CA 3.5Å; Y339-K356 HydrophobicContact CD1-CB 3.88Å; Y339-K356 HydrophobicContact CD1-CG 4.33Å; Y339-K356 HydrophobicContact CE1-CB 3.58Å; Y339-K356 HydrophobicContact CE1-CD 4.33Å; Y339-K356 HydrophobicContact CE1-CG 3.93Å; K356-D363 VanDerWaalsContact CE-OD2 3.25Å; K356-D363 WeakPolarHBondContact CE-OD2 3.43Å; K356-D363 IonicContact NZ-OD1 2.82Å; K356-D363 PolarHBondContact NZ-OD1 2.7Å; K356-D363 IonicContact NZ-OD2 2.71Å; K356-D363 PolarHBondContact NZ-OD2 2.95Å
357	I	85.6	Confident	76.6	Confident	95 Å²	95	88 Å²	88	49%	0.487	45%	0.452	S	S	.	.	S	Bend	trans	-97.6	-39.4	-174.6	-35.9	174.9	0	0	0	111.3	T330 I338 H340 I359	T330-I357 HydrophobicContact CG2-CD1 4.14Å; I338-I357 HydrophobicContact CG2-CB 4.42Å; I338-I357 HydrophobicContact CG2-CD1 3.73Å; I338-I357 HydrophobicContact CG2-CG1 4.23Å; I338-I357 PolarHBondContact O-N 3.28Å; H340-I357 HydrophobicContact CB-CD1 3.6Å; H340-I357 HydrophobicContact CB-CG1 3.84Å; I357-I359 VanDerWaalsContact C-N 3.35Å; I357-I359 PolarHBondContact O-N 2.81Å
358	N	82	Confident	75.3	Confident	53 Å²	53	86 Å²	86	28%	0.283	44%	0.436	S	S	.	.	S	Bend	trans	-91.6	70.9	178.1	67.1	-25.8	0	0	0	111.1	G336 I338 T360	G336-N358 PolarHBondContact O-ND2 3.08Å; I338-N358 HydrophobicContact CB-CB 4.35Å; I338-N358 HydrophobicContact CD1-CB 4.28Å; I338-N358 HydrophobicContact CG1-CB 4.39Å; I338-N358 PolarHBondContact N-OD1 2.98Å; I338-N358 PolarHBondContact O-OD1 3.24Å; N358-T360 PolarHBondContact O-N 2.66Å
359	I	73.1	Confident	73.9	Confident	87 Å²	87	84 Å²	84	45%	0.446	43%	0.429	S	S	.	.			trans	-63.9	124.4	176.3	-56	177.6	0	0	0	108.9	I357 D363 I364	I357-I359 VanDerWaalsContact C-N 3.35Å; I357-I359 PolarHBondContact O-N 2.81Å; I359-D363 HydrophobicContact CG2-CB 3.65Å; I359-I364 HydrophobicContact CG2-CD1 4.3Å; I359-I364 HydrophobicContact CG2-CG1 3.67Å
360	T	70	Confident	72.1	Confident	59 Å²	59	83.3 Å²	83.3	36%	0.362	43%	0.425	S	S	.	.			trans	-91.6	166.6	177.2	69.9	0	0	0	0	111.8	N358 E362 D363 I364	N358-T360 PolarHBondContact O-N 2.66Å; T360-E362 PolarHBondContact O-N 3.43Å; T360-E362 PolarHBondContact OG1-N 2.84Å; T360-D363 PolarHBondContact N-OD2 2.83Å; T360-D363 WeakPolarHBondContact O-CB 3.28Å; T360-D363 PolarHBondContact O-N 3.32Å; T360-D363 PolarHBondContact OG1-N 3.46Å; T360-D363 PolarHBondContact OG1-OD2 3.13Å; T360-I364 WeakPolarHBondContact O-CG1 3.41Å; T360-I364 PolarHBondContact O-N 2.95Å
361	T	63.7	Low	70.1	Confident	105 Å²	105	76.6 Å²	76.6	64%	0.644	40%	0.402	S	S	*	.	H	α-helix	trans	-55.5	-37.4	169.8	-52.1	0	0	0	0	111.5	I364 I365	T361-I364 PolarHBondContact O-N 3.35Å; T361-I365 HydrophobicContact CG2-CD1 3.78Å; T361-I365 HydrophobicContact CG2-CG1 4.24Å; T361-I365 WeakPolarHBondContact O-CB 3.48Å; T361-I365 VanDerWaalsContact O-CG1 3.23Å; T361-I365 WeakPolarHBondContact O-CG1 3.47Å; T361-I365 PolarHBondContact O-N 3.29Å
362	E	66.8	Low	67.9	Low	156 Å²	156	76.5 Å²	76.5	73%	0.729	41%	0.405	S	S	*	.	H	α-helix	trans	-65.5	-39.9	173.8	-77.4	-179.3	167.7	0	0	112.3	T360 I364 I365 Y366	T360-E362 PolarHBondContact O-N 3.43Å; T360-E362 PolarHBondContact OG1-N 2.84Å; E362-I364 VanDerWaalsContact C-N 3.29Å; E362-I364 PolarHBondContact O-N 2.93Å; E362-I365 PolarHBondContact O-N 3.22Å; E362-Y366 WeakPolarHBondContact O-CA 3.28Å; E362-Y366 WeakPolarHBondContact O-CB 3.37Å; E362-Y366 PolarHBondContact O-N 3.2Å
363	D	65.8	Low	65.8	Low	41 Å²	41	78.8 Å²	78.8	22%	0.219	42%	0.418	C	S	.	.	H	α-helix	trans	-63.2	-38.5	174.9	-65.3	-49	0	0	0	111.4	K356 I359 T360 R367	K356-D363 VanDerWaalsContact CE-OD2 3.25Å; K356-D363 WeakPolarHBondContact CE-OD2 3.43Å; K356-D363 IonicContact NZ-OD1 2.82Å; K356-D363 PolarHBondContact NZ-OD1 2.7Å; K356-D363 IonicContact NZ-OD2 2.71Å; K356-D363 PolarHBondContact NZ-OD2 2.95Å; I359-D363 HydrophobicContact CG2-CB 3.65Å; T360-D363 PolarHBondContact N-OD2 2.83Å; T360-D363 WeakPolarHBondContact O-CB 3.28Å; T360-D363 PolarHBondContact O-N 3.32Å; T360-D363 PolarHBondContact OG1-N 3.46Å; T360-D363 PolarHBondContact OG1-OD2 3.13Å; D363-R367 VanDerWaalsContact O-CB 3.29Å; D363-R367 WeakPolarHBondContact O-CB 3.46Å; D363-R367 WeakPolarHBondContact O-CG 3.32Å; D363-R367 PolarHBondContact O-N 2.69Å
364	I	64.3	Low	63.8	Low	83 Å²	83	85.5 Å²	85.5	43%	0.426	43%	0.425	S	S	.	.	H	α-helix	trans	-67.8	-52.4	176.6	-66.2	170.5	0	0	0	109.9	I359 T360 T361 E362 Y366 R367 I368	I359-I364 HydrophobicContact CG2-CD1 4.3Å; I359-I364 HydrophobicContact CG2-CG1 3.67Å; T360-I364 WeakPolarHBondContact O-CG1 3.41Å; T360-I364 PolarHBondContact O-N 2.95Å; T361-I364 PolarHBondContact O-N 3.35Å; E362-I364 VanDerWaalsContact C-N 3.29Å; E362-I364 PolarHBondContact O-N 2.93Å; I364-Y366 VanDerWaalsContact C-N 3.3Å; I364-Y366 PolarHBondContact O-N 3.29Å; I364-R367 PolarHBondContact O-N 3.18Å; I364-R367 VanDerWaalsContact O-N 3.16Å; I364-I368 HydrophobicContact CG2-CD1 3.46Å; I364-I368 VanDerWaalsContact CG2-CD1 3.46Å; I364-I368 HydrophobicContact CG2-CG1 4.22Å; I364-I368 VanDerWaalsContact O-CB 3.3Å; I364-I368 WeakPolarHBondContact O-CB 3.42Å; I364-I368 WeakPolarHBondContact O-CG1 3.39Å; I364-I368 PolarHBondContact O-N 3.45Å
365	I	58.7	Low	61.5	Low	92 Å²	92	85.4 Å²	85.4	47%	0.472	43%	0.428	S	S	.	.	H	α-helix	trans	-58.7	-45.3	177.1	-69.9	171.6	0	0	0	109.4	T361 E362 R367 I368 V369	T361-I365 HydrophobicContact CG2-CD1 3.78Å; T361-I365 HydrophobicContact CG2-CG1 4.24Å; T361-I365 WeakPolarHBondContact O-CB 3.48Å; T361-I365 VanDerWaalsContact O-CG1 3.23Å; T361-I365 WeakPolarHBondContact O-CG1 3.47Å; T361-I365 PolarHBondContact O-N 3.29Å; E362-I365 PolarHBondContact O-N 3.22Å; I365-R367 PolarHBondContact O-N 3.33Å; I365-I368 CarbonylContact O-C 3.55Å; I365-I368 PolarHBondContact O-N 3.06Å; I365-V369 HydrophobicContact CG2-CB 4.49Å; I365-V369 HydrophobicContact CG2-CG2 3.72Å; I365-V369 WeakPolarHBondContact O-CA 3.39Å; I365-V369 WeakPolarHBondContact O-CB 3.42Å; I365-V369 WeakPolarHBondContact O-CG2 3.3Å; I365-V369 PolarHBondContact O-N 3.47Å
366	Y	58.4	Low	59.4	Low	136 Å²	136	92.4 Å²	92.4	53%	0.533	45%	0.445	S	S	.	.	H	α-helix	trans	-62.1	-43.4	177.5	-168.1	-89	0	0	0	110.8	E362 I364 I368 V369 A370 R374	E362-Y366 WeakPolarHBondContact O-CA 3.28Å; E362-Y366 WeakPolarHBondContact O-CB 3.37Å; E362-Y366 PolarHBondContact O-N 3.2Å; I364-Y366 VanDerWaalsContact C-N 3.3Å; I364-Y366 PolarHBondContact O-N 3.29Å; Y366-I368 VanDerWaalsContact C-N 3.33Å; Y366-I368 PolarHBondContact O-N 2.83Å; Y366-V369 PolarHBondContact O-N 3.4Å; Y366-A370 HydrophobicContact CD1-CB 3.84Å; Y366-A370 HydrophobicContact CE1-CB 3.67Å; Y366-A370 HydrophobicContact CE2-CB 4.46Å; Y366-A370 HydrophobicContact CG-CB 4.31Å; Y366-A370 WeakPolarHBondContact O-CA 3.44Å; Y366-A370 WeakPolarHBondContact O-CB 3.38Å; Y366-A370 PolarHBondContact O-N 3.21Å; Y366-R374 PolarHBondContact OH-NH2 3.37Å
367	R	58.1	Low	57.4	Low	188 Å²	188	99.1 Å²	99.1	71%	0.709	47%	0.469	S	S	*	.	H	α-helix	trans	-64	-37.4	174.3	-81.7	179.6	163.7	-151.9	-3.4	112.8	D363 I364 I365 S371	D363-R367 VanDerWaalsContact O-CB 3.29Å; D363-R367 WeakPolarHBondContact O-CB 3.46Å; D363-R367 WeakPolarHBondContact O-CG 3.32Å; D363-R367 PolarHBondContact O-N 2.69Å; I364-R367 PolarHBondContact O-N 3.18Å; I364-R367 VanDerWaalsContact O-N 3.16Å; I365-R367 PolarHBondContact O-N 3.33Å; R367-S371 PolarHBondContact O-OG 3.48Å
368	I	51	Low	55.4	Low	55 Å²	55	97 Å²	97	28%	0.282	47%	0.471	S	S	.	.	H	α-helix	trans	-73.9	-35.5	179.1	-72.4	173.4	0	0	0	112.4	I364 I365 Y366 S371 S372 L385	I364-I368 HydrophobicContact CG2-CD1 3.46Å; I364-I368 VanDerWaalsContact CG2-CD1 3.46Å; I364-I368 HydrophobicContact CG2-CG1 4.22Å; I364-I368 VanDerWaalsContact O-CB 3.3Å; I364-I368 WeakPolarHBondContact O-CB 3.42Å; I364-I368 WeakPolarHBondContact O-CG1 3.39Å; I364-I368 PolarHBondContact O-N 3.45Å; I365-I368 CarbonylContact O-C 3.55Å; I365-I368 PolarHBondContact O-N 3.06Å; Y366-I368 VanDerWaalsContact C-N 3.33Å; Y366-I368 PolarHBondContact O-N 2.83Å; I368-S371 PolarHBondContact O-OG 2.89Å; I368-S372 PolarHBondContact O-OG 3.05Å; I368-L385 HydrophobicContact CG2-CB 3.59Å
369	V	48.7	Very low	53.6	Low	70 Å²	70	98.7 Å²	98.7	42%	0.424	48%	0.48	S	S	.	.	H	α-helix	trans	-98.3	-38.3	-172.1	177.3	0	0	0	0	111.1	I365 Y366 S371 S372 V373	I365-V369 HydrophobicContact CG2-CB 4.49Å; I365-V369 HydrophobicContact CG2-CG2 3.72Å; I365-V369 WeakPolarHBondContact O-CA 3.39Å; I365-V369 WeakPolarHBondContact O-CB 3.42Å; I365-V369 WeakPolarHBondContact O-CG2 3.3Å; I365-V369 PolarHBondContact O-N 3.47Å; Y366-V369 PolarHBondContact O-N 3.4Å; V369-S371 PolarHBondContact O-N 3.05Å; V369-S372 WeakPolarHBondContact O-CA 3.44Å; V369-S372 WeakPolarHBondContact O-CB 3.49Å; V369-S372 PolarHBondContact O-N 3.02Å; V369-S372 PolarHBondContact O-OG 2.85Å; V369-V373 WeakPolarHBondContact O-CG2 3.45Å; V369-V373 PolarHBondContact O-N 2.93Å
370	A	47.4	Very low	52.3	Low	20 Å²	20	97.7 Å²	97.7	17%	0.165	48%	0.479	C	S	.	.	H	α-helix	trans	-65.8	-25.8	176.5	0	0	0	0	0	111.9	Y366 S372 V373	Y366-A370 HydrophobicContact CD1-CB 3.84Å; Y366-A370 HydrophobicContact CE1-CB 3.67Å; Y366-A370 HydrophobicContact CE2-CB 4.46Å; Y366-A370 HydrophobicContact CG-CB 4.31Å; Y366-A370 WeakPolarHBondContact O-CA 3.44Å; Y366-A370 WeakPolarHBondContact O-CB 3.38Å; Y366-A370 PolarHBondContact O-N 3.21Å; A370-S372 PolarHBondContact O-N 3.09Å; A370-V373 PolarHBondContact O-N 3.46Å
371	S	46.6	Very low	51	Low	15 Å²	15	99.5 Å²	99.5	11%	0.105	49%	0.487	C	S	.	.	H	α-helix	trans	-61.3	-20	166	54.1	0	0	0	0	112.6	R367 I368 V369 P380 D381 G384	R367-S371 PolarHBondContact O-OG 3.48Å; I368-S371 PolarHBondContact O-OG 2.89Å; V369-S371 PolarHBondContact O-N 3.05Å; S371-P380 CarbonylContact O-C 3.55Å; S371-P380 WeakPolarHBondContact O-CA 3.34Å; S371-D381 WeakPolarHBondContact O-CB 3.39Å; S371-D381 PolarHBondContact O-N 3.26Å; S371-G384 WeakPolarHBondContact OG-CA 3.3Å
372	S	44.4	Very low	50.1	Low	38 Å²	38	100.6 Å²	100.6	27%	0.266	49%	0.487	S	S	.	.	H	α-helix	trans	-94.7	-21.6	-178.5	-35	0	0	0	0	114	I368 V369 A370	I368-S372 PolarHBondContact O-OG 3.05Å; V369-S372 WeakPolarHBondContact O-CA 3.44Å; V369-S372 WeakPolarHBondContact O-CB 3.49Å; V369-S372 PolarHBondContact O-N 3.02Å; V369-S372 PolarHBondContact O-OG 2.85Å; A370-S372 PolarHBondContact O-N 3.09Å
373	V	43.6	Very low	48.9	Very low	105 Å²	105	96.5 Å²	96.5	64%	0.636	49%	0.487	S	S	*	.	H	α-helix	trans	-113.9	-13.7	-167.7	-76.2	0	0	0	0	116.3	V369 A370	V369-V373 WeakPolarHBondContact O-CG2 3.45Å; V369-V373 PolarHBondContact O-N 2.93Å; A370-V373 PolarHBondContact O-N 3.46Å
374	R	44	Very low	48	Very low	201 Å²	201	95.2 Å²	95.2	76%	0.758	48%	0.484	S	S	*	.	S	Bend	trans	-90.2	-5.2	-175.2	-79.9	-158.4	-164	-148.6	10.5	116.6	Y366	Y366-R374 PolarHBondContact OH-NH2 3.37Å
375	N	44.2	Very low	47.2	Very low	49 Å²	49	97.1 Å²	97.1	26%	0.262	49%	0.494	S	S	.	.	S	Bend	trans	-100	146.7	168.9	72.4	45.8	0	0	0	110.7	W377 G378 D379	N375-W377 HydrophobicContact CB-CE3 4.24Å; N375-W377 PolarHBondContact O-N 3.44Å; N375-W377 PolarHBondContact OD1-N 2.76Å; N375-G378 PolarHBondContact O-N 2.84Å; N375-G378 VanDerWaalsContact O-N 3.16Å; N375-G378 PolarHBondContact OD1-N 3.06Å; N375-D379 PolarHBondContact ND2-O 3.05Å; N375-D379 PolarHBondContact OD1-N 3.31Å
376	R	44.2	Very low	46.7	Very low	238 Å²	238	97.6 Å²	97.6	90%	0.898	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-8.7	-178	-90	-174.8	-80.4	-156.2	-5.4	114.1
377	W	44.4	Very low	46.1	Very low	195 Å²	195	98.6 Å²	98.6	74%	0.739	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-10	-177.8	-64.9	-90.1	0	0	0	112.6	N375 D379	N375-W377 HydrophobicContact CB-CE3 4.24Å; N375-W377 PolarHBondContact O-N 3.44Å; N375-W377 PolarHBondContact OD1-N 2.76Å; W377-D379 HydrophobicContact CB-CB 4.48Å; W377-D379 WeakPolarHBondContact CB-OD2 3.35Å; W377-D379 PolarHBondContact O-N 2.96Å
378	G	43.4	Very low	45.6	Very low	51 Å²	51	93 Å²	93	53%	0.526	50%	0.503	S	S	.	.			trans	67.2	18.6	-173.7	0	0	0	0	0	112.7	N375	N375-G378 PolarHBondContact O-N 2.84Å; N375-G378 VanDerWaalsContact O-N 3.16Å; N375-G378 PolarHBondContact OD1-N 3.06Å
379	D	44.5	Very low	45.5	Very low	88 Å²	88	94.2 Å²	94.2	47%	0.471	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-77.6	138.6	-178.4	-64.9	-33.3	0	0	0	109.8	N375 W377 D381	N375-D379 PolarHBondContact ND2-O 3.05Å; N375-D379 PolarHBondContact OD1-N 3.31Å; W377-D379 HydrophobicContact CB-CB 4.48Å; W377-D379 WeakPolarHBondContact CB-OD2 3.35Å; W377-D379 PolarHBondContact O-N 2.96Å; D379-D381 PolarHBondContact O-N 3.32Å
380	P	46.3	Very low	45.7	Very low	67 Å²	67	93.3 Å²	93.3	44%	0.435	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-67.7	131	170.7	26.7	-31.5	0	0	0	111.2	S371	S371-P380 CarbonylContact O-C 3.55Å; S371-P380 WeakPolarHBondContact O-CA 3.34Å
381	D	42.8	Very low	46.1	Very low	97 Å²	97	98.8 Å²	98.8	52%	0.519	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-76.7	170.2	172.6	-142.7	-23	0	0	0	111.8	S371 D379 G383 G384	S371-D381 WeakPolarHBondContact O-CB 3.39Å; S371-D381 PolarHBondContact O-N 3.26Å; D379-D381 PolarHBondContact O-N 3.32Å; D381-G383 PolarHBondContact O-N 2.96Å; D381-G383 VanDerWaalsContact O-N 3.14Å; D381-G384 PolarHBondContact O-N 3.38Å
382	I	44.8	Very low	46.8	Very low	127 Å²	127	98.6 Å²	98.6	65%	0.651	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	120.4	177.6	-62.9	174.3	0	0	0	109.8
383	G	42.4	Very low	47.6	Very low	71 Å²	71	104.9 Å²	104.9	73%	0.732	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.9	-1.2	-178.9	0	0	0	0	0	115.3	D381	D381-G383 PolarHBondContact O-N 2.96Å; D381-G383 VanDerWaalsContact O-N 3.14Å
384	G	46.2	Very low	48.3	Very low	14 Å²	14	102.7 Å²	102.7	14%	0.144	55%	0.552	C	S	.	*			trans	-70.7	150.8	171.9	0	0	0	0	0	113.2	S371 D381 I386	S371-G384 WeakPolarHBondContact OG-CA 3.3Å; D381-G384 PolarHBondContact O-N 3.38Å; G384-I386 PolarHBondContact O-N 3.08Å
385	L	46.4	Very low	49	Very low	122 Å²	122	100.4 Å²	100.4	64%	0.639	56%	0.555	S	S	*	*			trans	-69.6	113.8	175.6	-161.6	91.2	0	0	0	109.3	I368 I387	I368-L385 HydrophobicContact CG2-CB 3.59Å; L385-I387 PolarHBondContact O-N 3.03Å
386	I	49	Very low	49.6	Very low	102 Å²	102	101.2 Å²	101.2	52%	0.523	57%	0.574	S	S	.	*			trans	-72.2	116.6	172.2	-59.2	-175.8	0	0	0	108.3	G384 A388	G384-I386 PolarHBondContact O-N 3.08Å; I386-A388 PolarHBondContact O-N 3.32Å
387	I	45.4	Very low	50.2	Low	157 Å²	157	93.8 Å²	93.8	81%	0.805	55%	0.552	S	S	*	*			trans	-78.1	104.4	170.4	-54.5	-178.8	0	0	0	107.5	L385	L385-I387 PolarHBondContact O-N 3.03Å
388	A	48	Very low	50.9	Low	70 Å²	70	94 Å²	94	58%	0.579	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-83.1	131.4	173.4	0	0	0	0	0	110.5	I386 L413	I386-A388 PolarHBondContact O-N 3.32Å; A388-L413 HydrophobicContact CB-CD2 4.27Å
389	A	49.9	Very low	51.5	Low	81 Å²	81	97.5 Å²	97.5	67%	0.669	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-102.6	124	170.7	0	0	0	0	0	109.7
390	Y	52	Low	52.1	Low	52 Å²	52	96.8 Å²	96.8	20%	0.204	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-70.6	126.1	169.6	176.4	-104.2	0	0	0	109.4	G392 I400 L402 Y408 S411	Y390-G392 VanDerWaalsContact CE1-CA 3.5Å; Y390-I400 HydrophobicContact CD1-CG2 3.55Å; Y390-I400 HydrophobicContact CE1-CG2 3.88Å; Y390-L402 HydrophobicContact CD1-CD1 4.3Å; Y390-L402 HydrophobicContact CD1-CD2 3.6Å; Y390-L402 HydrophobicContact CD1-CG 4.19Å; Y390-L402 HydrophobicContact CE1-CD2 3.89Å; Y390-L402 HydrophobicContact CG-CD1 4.41Å; Y390-L402 HydrophobicContact CG-CD2 3.93Å; Y390-Y408 HydrophobicContact CE2-CG 4.21Å; Y390-S411 WeakPolarHBondContact CD2-OG 3.45Å; Y390-S411 WeakPolarHBondContact CE2-OG 3.29Å
391	Q	56	Low	52.5	Low	134 Å²	134	104.6 Å²	104.6	63%	0.626	59%	0.586	S	S	*	*			trans	-93.5	5.8	-172.5	-68.1	-168.6	-13.9	0	0	114.8
392	G	60.9	Low	53.1	Low	12 Å²	12	104.6 Å²	104.6	12%	0.124	59%	0.585	C	S	.	*			trans	87.7	-176.7	-173.7	0	0	0	0	0	112.8	Y390	Y390-G392 VanDerWaalsContact CE1-CA 3.5Å
393	E	62.2	Low	53.3	Low	170 Å²	170	103.1 Å²	103.1	79%	0.794	58%	0.582	S	S	*	*	S	Bend	trans	-84.2	-20.4	176.8	-69.9	-169	173	0	0	112.3	D397	E393-D397 PolarHBondContact N-OD2 3.09Å
394	A	57.7	Low	53.3	Low	59 Å²	59	111.7 Å²	111.7	49%	0.488	59%	0.592	S	S	.	*	S	Bend	trans	-137.1	151.6	176.3	0	0	0	0	0	111.9	G396 D397	A394-G396 PolarHBondContact O-N 3.45Å; A394-D397 PolarHBondContact O-N 2.87Å
395	D	58.7	Low	52.9	Low	153 Å²	153	115.2 Å²	115.2	82%	0.818	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	123.9	175	-80.3	-11.4	0	0	0	110.6
396	G	56.9	Low	52.8	Low	66 Å²	66	115.5 Å²	115.5	68%	0.68	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.2	9.7	175	0	0	0	0	0	115.8	A394 K398	A394-G396 PolarHBondContact O-N 3.45Å; G396-K398 WeakPolarHBondContact O-CG 3.2Å; G396-K398 PolarHBondContact O-N 2.94Å; G396-K398 VanDerWaalsContact O-N 3.12Å
397	D	55.4	Low	52.8	Low	81 Å²	81	115.9 Å²	115.9	43%	0.433	64%	0.638	S	S	.	*			trans	-57.5	114.5	172.5	-102.4	-18	0	0	0	111.5	E393 A394 I400	E393-D397 PolarHBondContact N-OD2 3.09Å; A394-D397 PolarHBondContact O-N 2.87Å; D397-I400 HydrophobicContact CB-CG1 4.31Å
398	K	61	Low	53.1	Low	200 Å²	200	111.6 Å²	111.6	87%	0.87	61%	0.612	S	S	*	*	S	Bend	trans	-89.2	-15.8	-176.8	-62.4	-170.4	-179.3	-179.4	0	113.7	G396	G396-K398 WeakPolarHBondContact O-CG 3.2Å; G396-K398 PolarHBondContact O-N 2.94Å; G396-K398 VanDerWaalsContact O-N 3.12Å
399	V	54.4	Low	53	Low	125 Å²	125	119.6 Å²	119.6	76%	0.758	63%	0.627	S	S	*	*			trans	-126.5	96	-177	-174.8	0	0	0	0	108.9
400	I	58	Low	52.8	Low	73 Å²	73	118.8 Å²	118.8	37%	0.374	63%	0.627	S	S	.	*			trans	-108.4	121.2	-178.1	-59.5	177	0	0	0	108.4	Y390 D397 L402	Y390-I400 HydrophobicContact CD1-CG2 3.55Å; Y390-I400 HydrophobicContact CE1-CG2 3.88Å; D397-I400 HydrophobicContact CB-CG1 4.31Å; I400-L402 HydrophobicContact CG2-CG 4.15Å
401	R	55.1	Low	52.3	Low	230 Å²	230	118.6 Å²	118.6	87%	0.868	63%	0.633	S	S	*	*			trans	-112.7	116.7	169.6	-86.9	-176	176.1	173.6	-0.4	109.9
402	L	56	Low	51.5	Low	98 Å²	98	122.8 Å²	122.8	51%	0.513	64%	0.643	S	S	.	*			trans	-105.2	134.6	173.3	-67.1	168.9	0	0	0	110	Y390 I400 Y408	Y390-L402 HydrophobicContact CD1-CD1 4.3Å; Y390-L402 HydrophobicContact CD1-CD2 3.6Å; Y390-L402 HydrophobicContact CD1-CG 4.19Å; Y390-L402 HydrophobicContact CE1-CD2 3.89Å; Y390-L402 HydrophobicContact CG-CD1 4.41Å; Y390-L402 HydrophobicContact CG-CD2 3.93Å; I400-L402 HydrophobicContact CG2-CG 4.15Å; L402-Y408 WeakPolarHBondContact CA-OH 3.34Å; L402-Y408 HydrophobicContact CD2-CD1 4.36Å; L402-Y408 HydrophobicContact CD2-CD2 3.73Å; L402-Y408 HydrophobicContact CD2-CE1 4.12Å; L402-Y408 HydrophobicContact CD2-CE2 3.45Å; L402-Y408 VanDerWaalsContact CD2-CE2 3.45Å; L402-Y408 HydrophobicContact CD2-CG 4.18Å
403	V	47.2	Very low	50.5	Low	95 Å²	95	127.9 Å²	127.9	58%	0.576	67%	0.667	S	S	*	*			trans	-105.1	129.9	172.5	-177.5	0	0	0	0	107.8	G405 Q406 Y408	V403-G405 PolarHBondContact O-N 3.48Å; V403-Q406 HydrophobicContact CB-CG 4.17Å; V403-Q406 HydrophobicContact CG1-CG 4.41Å; V403-Q406 PolarHBondContact O-N 3.38Å; V403-Y408 PolarHBondContact N-OH 3.07Å
404	R	43.2	Very low	49.3	Very low	252 Å²	252	123 Å²	123	95%	0.951	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	128.4	179.9	-145.7	-172.7	-76.7	-131.6	3.8	109.2
405	G	36.9	Very low	48.2	Very low	87 Å²	87	124.7 Å²	124.7	90%	0.897	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.2	-4.5	178.8	0	0	0	0	0	116.1	V403	V403-G405 PolarHBondContact O-N 3.48Å
406	Q	45.9	Very low	47	Very low	129 Å²	129	121.5 Å²	121.5	60%	0.603	66%	0.658	S	S	*	*			trans	-87.1	141.7	173.6	-81.5	-79.5	-16.5	0	0	111.8	V403 Y408	V403-Q406 HydrophobicContact CB-CG 4.17Å; V403-Q406 HydrophobicContact CG1-CG 4.41Å; V403-Q406 PolarHBondContact O-N 3.38Å; Q406-Y408 HydrophobicContact CB-CE2 3.77Å
407	S	47.7	Very low	45.9	Very low	109 Å²	109	123.7 Å²	123.7	76%	0.762	65%	0.653	S	S	*	*			trans	-90.5	123.9	170.9	69.6	0	0	0	0	110.3
408	Y	52.1	Low	44.8	Very low	68 Å²	68	127.2 Å²	127.2	27%	0.267	67%	0.666	S	S	.	*			trans	-100.6	115.4	179.3	-67	-87.2	0	0	0	110.8	Y390 L402 V403 Q406 S411	Y390-Y408 HydrophobicContact CE2-CG 4.21Å; L402-Y408 WeakPolarHBondContact CA-OH 3.34Å; L402-Y408 HydrophobicContact CD2-CD1 4.36Å; L402-Y408 HydrophobicContact CD2-CD2 3.73Å; L402-Y408 HydrophobicContact CD2-CE1 4.12Å; L402-Y408 HydrophobicContact CD2-CE2 3.45Å; L402-Y408 VanDerWaalsContact CD2-CE2 3.45Å; L402-Y408 HydrophobicContact CD2-CG 4.18Å; V403-Y408 PolarHBondContact N-OH 3.07Å; Q406-Y408 HydrophobicContact CB-CE2 3.77Å; Y408-S411 WeakPolarHBondContact CB-OG 3.5Å; Y408-S411 PolarHBondContact O-OG 3.03Å
409	R	46.6	Very low	43.3	Very low	237 Å²	237	124.5 Å²	124.5	89%	0.894	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	138.7	173.8	-96	-169.8	176.5	-169.6	0.4	109.5	S411	R409-S411 VanDerWaalsContact C-N 3.3Å; R409-S411 PolarHBondContact O-N 3.18Å
410	G	45.5	Very low	42.3	Very low	65 Å²	65	126.4 Å²	126.4	67%	0.67	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	83.4	2	178.9	0	0	0	0	0	114.8	R412	G410-R412 VanDerWaalsContact C-N 3.27Å; G410-R412 PolarHBondContact O-N 3.05Å
411	S	40.6	Very low	41	Very low	47 Å²	47	125.8 Å²	125.8	33%	0.329	66%	0.657	S	S	.	*			trans	-57.6	92.6	166.7	-53.5	0	0	0	0	109.3	Y390 Y408 R409 L413	Y390-S411 WeakPolarHBondContact CD2-OG 3.45Å; Y390-S411 WeakPolarHBondContact CE2-OG 3.29Å; Y408-S411 WeakPolarHBondContact CB-OG 3.5Å; Y408-S411 PolarHBondContact O-OG 3.03Å; R409-S411 VanDerWaalsContact C-N 3.3Å; R409-S411 PolarHBondContact O-N 3.18Å; S411-L413 PolarHBondContact O-N 3.43Å
412	R	38.7	Very low	39.9	Very low	222 Å²	222	123.3 Å²	123.3	84%	0.838	66%	0.655	S	S	*	*			trans	-71.2	86.5	166.3	-62	-178.6	-179.5	-174.4	0.4	105.2	G410 G414	G410-R412 VanDerWaalsContact C-N 3.27Å; G410-R412 PolarHBondContact O-N 3.05Å; R412-G414 PolarHBondContact O-N 2.92Å
413	L	40.1	Very low	38.7	Very low	120 Å²	120	126.4 Å²	126.4	63%	0.628	67%	0.67	S	S	*	*			trans	-57.2	95.2	158.4	-67.2	169.3	0	0	0	104.4	A388 S411 P415	A388-L413 HydrophobicContact CB-CD2 4.27Å; S411-L413 PolarHBondContact O-N 3.43Å; L413-P415 WeakPolarHBondContact O-CD 3.44Å
414	G	36.7	Very low	37.9	Very low	66 Å²	66	125.8 Å²	125.8	68%	0.68	68%	0.675	S	S	*	*			trans	-73.8	106.5	175.4	0	0	0	0	0	107.6	R412 S416	R412-G414 PolarHBondContact O-N 2.92Å; G414-S416 PolarHBondContact O-N 2.94Å
415	P	35.5	Very low	37.3	Very low	95 Å²	95	119.2 Å²	119.2	62%	0.617	67%	0.665	S	S	*	*			trans	-64.8	124.4	166.6	28.6	-33.8	0	0	0	107.7	L413 I417	L413-P415 WeakPolarHBondContact O-CD 3.44Å; P415-I417 HydrophobicContact CB-CG1 3.83Å; P415-I417 HydrophobicContact CG-CD1 4.08Å; P415-I417 HydrophobicContact CG-CG1 3.87Å; P415-I417 PolarHBondContact O-N 3.37Å
416	S	34.3	Very low	37.1	Very low	86 Å²	86	119.5 Å²	119.5	60%	0.601	65%	0.652	S	S	*	*			trans	-72.3	89.3	156.8	52.7	0	0	0	0	106.8	G414 H418	G414-S416 PolarHBondContact O-N 2.94Å; S416-H418 PolarHBondContact O-N 2.91Å
417	I	32.7	Very low	36.5	Very low	112 Å²	112	119.6 Å²	119.6	57%	0.574	66%	0.664	S	S	*	*			trans	-71.1	101.7	177	-58.7	174	0	0	0	107.1	P415 Y419	P415-I417 HydrophobicContact CB-CG1 3.83Å; P415-I417 HydrophobicContact CG-CD1 4.08Å; P415-I417 HydrophobicContact CG-CG1 3.87Å; P415-I417 PolarHBondContact O-N 3.37Å; I417-Y419 HydrophobicContact CB-CE2 4.4Å; I417-Y419 HydrophobicContact CG2-CD2 3.84Å; I417-Y419 HydrophobicContact CG2-CE2 3.68Å; I417-Y419 PolarHBondContact O-N 2.63Å
418	H	32.2	Very low	35.9	Very low	155 Å²	155	118 Å²	118	72%	0.718	66%	0.664	S	S	*	*			trans	-74.3	95.2	169.7	-160.4	80.1	0	0	0	108.4	S416 R420	S416-H418 PolarHBondContact O-N 2.91Å; H418-R420 PolarHBondContact O-N 3.2Å
419	Y	29.1	Very low	34.9	Very low	143 Å²	143	119.3 Å²	119.3	56%	0.561	68%	0.683	S	S	*	*			trans	-66.8	88.7	162.7	-80.1	-88.7	0	0	0	107.9	I417 G421 F441	I417-Y419 HydrophobicContact CB-CE2 4.4Å; I417-Y419 HydrophobicContact CG2-CD2 3.84Å; I417-Y419 HydrophobicContact CG2-CE2 3.68Å; I417-Y419 PolarHBondContact O-N 2.63Å; Y419-G421 PolarHBondContact O-N 3.45Å; Y419-F441 AromaticContact CE1-CD1 3.96Å; Y419-F441 HydrophobicContact CE1-CD1 3.96Å; Y419-F441 HydrophobicContact CE1-CE1 4.16Å; Y419-F441 WeakPolarHBondContact OH-CD1 3.48Å
420	R	33.8	Very low	34.3	Very low	166 Å²	166	120.2 Å²	120.2	63%	0.626	69%	0.686	S	S	*	*			trans	-65.5	93	158.4	-117.8	-173.3	-172.5	-171.5	5.2	105.8	H418 H422	H418-R420 PolarHBondContact O-N 3.2Å; R420-H422 VanDerWaalsContact C-N 3.31Å; R420-H422 PolarHBondContact O-N 3.49Å
421	G	31.3	Very low	33.7	Very low	60 Å²	60	124.5 Å²	124.5	62%	0.619	69%	0.691	S	S	*	*			trans	-49.5	100.6	170.7	0	0	0	0	0	108.4	Y419 I423	Y419-G421 PolarHBondContact O-N 3.45Å; G421-I423 PolarHBondContact O-N 2.73Å
422	H	31.7	Very low	33.4	Very low	178 Å²	178	132 Å²	132	82%	0.824	72%	0.72	S	S	*	*			trans	-62.1	106.2	151.1	-80.5	33.1	0	0	0	103.3	R420 A424	R420-H422 VanDerWaalsContact C-N 3.31Å; R420-H422 PolarHBondContact O-N 3.49Å; H422-A424 PolarHBondContact O-N 3Å
423	I	30.9	Very low	33	Very low	162 Å²	162	128.9 Å²	128.9	83%	0.831	72%	0.717	S	S	*	*			trans	-60.9	84.5	174.8	-60.8	168.2	0	0	0	105.3	G421 P425	G421-I423 PolarHBondContact O-N 2.73Å; I423-P425 WeakPolarHBondContact O-CD 3.41Å
424	A	30.4	Very low	32.9	Very low	82 Å²	82	127.7 Å²	127.7	68%	0.678	72%	0.718	S	S	*	*			trans	-75.9	117.2	162.8	0	0	0	0	0	105.3	H422 C426	H422-A424 PolarHBondContact O-N 3Å; A424-C426 PolarHBondContact O-N 3.24Å
425	P	30.4	Very low	32.8	Very low	115 Å²	115	131.2 Å²	131.2	75%	0.747	72%	0.721	S	S	*	*			trans	-64.9	106.2	179.5	24.5	-30.3	0	0	0	108.4	I423 P427	I423-P425 WeakPolarHBondContact O-CD 3.41Å; P425-P427 VanDerWaalsContact O-CD 3.26Å; P425-P427 WeakPolarHBondContact O-CD 3.33Å
426	C	32.4	Very low	33	Very low	93 Å²	93	131.1 Å²	131.1	63%	0.628	73%	0.728	S	S	*	*			trans	-67	115.7	176.5	-174.8	0	0	0	0	108.8	A424 G428	A424-C426 PolarHBondContact O-N 3.24Å; C426-G428 PolarHBondContact O-N 2.82Å
427	P	33	Very low	33.1	Very low	131 Å²	131	134.6 Å²	134.6	85%	0.851	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	99.2	178	18.1	-10	0	0	0	108.9	P425	P425-P427 VanDerWaalsContact O-CD 3.26Å; P425-P427 WeakPolarHBondContact O-CD 3.33Å
428	G	35.5	Very low	33.1	Very low	75 Å²	75	133.2 Å²	133.2	77%	0.773	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	140.8	-19.5	166.8	0	0	0	0	0	116.3	C426	C426-G428 PolarHBondContact O-N 2.82Å
429	C	32.7	Very low	33.2	Very low	96 Å²	96	132.4 Å²	132.4	65%	0.649	74%	0.742	S	S	*	*			trans	-111.4	100	-173.2	-68.3	0	0	0	0	111.7	M431	C429-M431 PolarHBondContact O-N 3.48Å; C429-M431 VanDerWaalsContact O-N 3.07Å
430	R	34	Very low	33.4	Very low	256 Å²	256	129 Å²	129	97%	0.966	75%	0.751	S	S	*	*			trans	-73.4	23.1	170.2	-76	-168	-169.9	-139.9	3.5	114
431	M	32	Very low	33.4	Very low	155 Å²	155	128.2 Å²	128.2	76%	0.764	75%	0.752	S	S	*	*	S	Bend	trans	-128.3	122.9	177.6	-82.5	-172.8	177.3	0	0	111	C429 M433	C429-M431 PolarHBondContact O-N 3.48Å; C429-M431 VanDerWaalsContact O-N 3.07Å; M431-M433 PolarHBondContact O-N 2.81Å
432	H	34.5	Very low	33.3	Very low	204 Å²	204	132.8 Å²	132.8	94%	0.944	76%	0.762	S	S	*	*			trans	-61.2	95.3	170.3	-75.4	-90.8	0	0	0	109.6
433	M	29.6	Very low	33.2	Very low	157 Å²	157	134.1 Å²	134.1	77%	0.773	77%	0.765	S	S	*	*			trans	-121.4	134.7	166.7	-83.8	-171	157.8	0	0	110.7	M431	M431-M433 PolarHBondContact O-N 2.81Å
434	S	37.6	Very low	33.4	Very low	94 Å²	94	130.9 Å²	130.9	66%	0.657	76%	0.763	S	S	*	*			trans	-67.5	129.3	-176.5	149.3	0	0	0	0	111.1	A436	S434-A436 PolarHBondContact O-N 3.45Å; S434-A436 PolarHBondContact OG-N 3.48Å
435	L	36.4	Very low	33.5	Very low	140 Å²	140	135.6 Å²	135.6	73%	0.733	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-60.1	-6.4	-179.5	-101.1	125.6	0	0	0	115.2	Q437 C438	L435-Q437 PolarHBondContact O-N 2.75Å; L435-C438 PolarHBondContact O-N 3.36Å; L435-C438 VanDerWaalsContact O-N 3.16Å
436	A	38.4	Very low	33.8	Very low	93 Å²	93	141.1 Å²	141.1	77%	0.769	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-62.3	-6.2	176.2	0	0	0	0	0	114.4	S434	S434-A436 PolarHBondContact O-N 3.45Å; S434-A436 PolarHBondContact OG-N 3.48Å
437	Q	37	Very low	33.9	Very low	159 Å²	159	144.8 Å²	144.8	74%	0.743	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-98.1	8.4	175.8	-69	-177.2	-25.2	0	0	114.6	L435 P439	L435-Q437 PolarHBondContact O-N 2.75Å; Q437-P439 WeakPolarHBondContact O-CD 3.42Å
438	C	32.4	Very low	34.3	Very low	84 Å²	84	146.7 Å²	146.7	57%	0.568	78%	0.782	S	S	*	*			trans	-96.1	108.6	176.1	-79.8	0	0	0	0	111.8	L435 G440	L435-C438 PolarHBondContact O-N 3.36Å; L435-C438 VanDerWaalsContact O-N 3.16Å; C438-G440 PolarHBondContact O-N 3.21Å
439	P	34.1	Very low	34.6	Very low	137 Å²	137	149.1 Å²	149.1	89%	0.89	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	13.4	-171.4	-15.2	31.3	0	0	0	116.4	Q437	Q437-P439 WeakPolarHBondContact O-CD 3.42Å
440	G	32.6	Very low	35.5	Very low	71 Å²	71	149.1 Å²	149.1	73%	0.732	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-3.9	-166.3	0	0	0	0	0	117.9	C438	C438-G440 PolarHBondContact O-N 3.21Å
441	F	33.6	Very low	37	Very low	150 Å²	150	139.6 Å²	139.6	66%	0.658	75%	0.753	S	S	*	*			trans	-102.4	12	-159.9	-112.6	-86.4	0	0	0	117.1	Y419 F443	Y419-F441 AromaticContact CE1-CD1 3.96Å; Y419-F441 HydrophobicContact CE1-CD1 3.96Å; Y419-F441 HydrophobicContact CE1-CE1 4.16Å; Y419-F441 WeakPolarHBondContact OH-CD1 3.48Å; F441-F443 PolarHBondContact O-N 2.87Å
442	L	30.9	Very low	39.4	Very low	157 Å²	157	138.2 Å²	138.2	82%	0.822	75%	0.745	S	S	*	*	S	Bend	trans	-89.4	7.5	-167.8	-102.8	155	0	0	0	117.2
443	F	29.9	Very low	41.7	Very low	205 Å²	205	129.2 Å²	129.2	90%	0.899	70%	0.703	S	S	*	*			trans	-136.6	83.6	178.2	-70.8	-84.6	0	0	0	111.9	F441	F441-F443 PolarHBondContact O-N 2.87Å
444	A	34	Very low	44.5	Very low	95 Å²	95	128.1 Å²	128.1	79%	0.785	69%	0.694	S	S	*	*			trans	-113.1	119.1	162.3	0	0	0	0	0	108.3
445	H	32.8	Very low	47.1	Very low	180 Å²	180	128.9 Å²	128.9	83%	0.833	69%	0.686	S	S	*	*			trans	-52.1	132.9	-175.8	-84	-82.6	0	0	0	113	E447	H445-E447 PolarHBondContact O-N 3.18Å; H445-E447 VanDerWaalsContact O-N 3.11Å
446	R	36.3	Very low	49.7	Very low	231 Å²	231	122.3 Å²	122.3	87%	0.872	65%	0.651	S	S	*	*			trans	-69.8	93.4	158.3	-91.5	-179.1	171.2	174.4	-3.5	107.3	E448	R446-E448 PolarHBondContact O-N 3.28Å
447	E	35.6	Very low	52.3	Low	171 Å²	171	120.1 Å²	120.1	80%	0.799	63%	0.627	S	S	*	*			trans	-75.8	108.2	159.9	-74.4	174.2	167	0	0	106.5	H445 C449	H445-E447 PolarHBondContact O-N 3.18Å; H445-E447 VanDerWaalsContact O-N 3.11Å; E447-C449 PolarHBondContact O-N 2.8Å; E447-C449 VanDerWaalsContact O-N 3.08Å
448	E	40.8	Very low	54.9	Low	170 Å²	170	117.2 Å²	117.2	79%	0.794	62%	0.616	S	S	*	*			trans	-60	109.8	162.2	-74.5	174.9	172.5	0	0	106.2	R446 T450	R446-E448 PolarHBondContact O-N 3.28Å; E448-T450 PolarHBondContact O-N 3.11Å; E448-T450 PolarHBondContact O-OG1 2.84Å
449	C	42.3	Very low	57.9	Low	127 Å²	127	113.9 Å²	113.9	86%	0.858	59%	0.593	S	S	*	*			trans	-61.8	87.7	172.7	-71.6	0	0	0	0	108.2	E447 V451	E447-C449 PolarHBondContact O-N 2.8Å; E447-C449 VanDerWaalsContact O-N 3.08Å; C449-V451 PolarHBondContact O-N 3.39Å
450	T	51.6	Low	60.6	Low	96 Å²	96	113.9 Å²	113.9	59%	0.589	58%	0.576	S	S	*	*			trans	-80.1	110.1	172.3	33.8	0	0	0	0	105.7	E448 E452	E448-T450 PolarHBondContact O-N 3.11Å; E448-T450 PolarHBondContact O-OG1 2.84Å; T450-E452 PolarHBondContact O-N 3.19Å
451	V	65.5	Low	63.3	Low	55 Å²	55	114.2 Å²	114.2	33%	0.333	56%	0.555	S	S	.	*			trans	-67.2	115	174.2	174	0	0	0	0	107.3	C449 F473 D474 D475	C449-V451 PolarHBondContact O-N 3.39Å; V451-F473 HydrophobicContact CG1-CB 3.44Å; V451-F473 VanDerWaalsContact CG1-CB 3.44Å; V451-F473 HydrophobicContact CG1-CD1 4.21Å; V451-F473 HydrophobicContact CG1-CD2 3.84Å; V451-F473 HydrophobicContact CG1-CG 3.61Å; V451-D474 WeakPolarHBondContact CA-OD1 3.47Å; V451-D474 WeakPolarHBondContact CG1-OD1 3.47Å; V451-D475 HydrophobicContact CG1-CB 4.49Å; V451-D475 HydrophobicContact CG2-CB 4.4Å
452	E	81.3	Confident	65.8	Low	127 Å²	127	108.5 Å²	108.5	59%	0.593	53%	0.533	S	S	*	.			trans	-91.7	143.3	-175.4	-71.2	-169.4	164.4	0	0	111.9	T450 K454 F473 D474	T450-E452 PolarHBondContact O-N 3.19Å; E452-K454 PolarHBondContact O-N 2.94Å; E452-F473 CarbonylContact O-C 3.55Å; E452-F473 WeakPolarHBondContact O-CA 3.41Å; E452-D474 HydrophobicContact CB-CB 4.43Å; E452-D474 PolarHBondContact N-OD1 2.86Å; E452-D474 PolarHBondContact O-N 2.89Å
453	I	83.2	Confident	68.2	Low	14 Å²	14	105.8 Å²	105.8	7%	0.072	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	105.7	172.4	-55.7	169.7	0	0	0	108.7	I456 V471 F473 Q495 I496 W505	I453-I456 HydrophobicContact CG2-CD1 4.09Å; I453-I456 HydrophobicContact CG2-CG1 3.8Å; I453-V471 HydrophobicContact CG2-CG1 4.15Å; I453-F473 HydrophobicContact CG1-CD1 4.18Å; I453-F473 HydrophobicContact CG1-CE1 3.96Å; I453-Q495 HydrophobicContact CD1-CB 3.99Å; I453-Q495 HydrophobicContact CD1-CG 3.66Å; I453-I496 HydrophobicContact CD1-CG1 3.57Å; I453-I496 HydrophobicContact CG1-CG1 4.35Å; I453-W505 HydrophobicContact CG2-CZ2 4.45Å
454	K	88.8	Confident	70.7	Confident	134 Å²	134	101 Å²	101	58%	0.583	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	-44.4	175.7	-95	-176	177.6	157.5	0	112.6	E452 F472 D474 W505	E452-K454 PolarHBondContact O-N 2.94Å; K454-F472 HydrophobicContact CB-CB 4.24Å; K454-F472 PolarHBondContact N-O 2.75Å; K454-D474 HydrophobicContact CD-CB 4.33Å; K454-D474 HydrophobicContact CG-CB 4.21Å; K454-D474 PolarHBondContact NZ-O 3.36Å; K454-W505 WeakPolarHBondContact O-CH2 3.18Å
455	K	90.8	Very high	73.1	Confident	110 Å²	110	98.2 Å²	98.2	48%	0.478	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	143.1	-174.6	-165	177.4	-176.2	-176.4	0	111.1	I457 F472 W505	K455-I457 HydrophobicContact CD-CG2 3.79Å; K455-I457 VanDerWaalsContact CE-CG2 3.49Å; K455-I457 HydrophobicContact CG-CG2 3.92Å; K455-F472 HydrophobicContact CB-CB 4.26Å; K455-F472 HydrophobicContact CB-CD2 4.22Å; K455-F472 PolarHBondContact N-O 3.46Å; K455-F472 PolarHBondContact O-N 3.2Å; K455-W505 HydrophobicContact CB-CZ3 4.27Å; K455-W505 HydrophobicContact CG-CE3 4.06Å; K455-W505 HydrophobicContact CG-CZ3 3.98Å
456	I	92.3	Very high	75.8	Confident	2 Å²	2	90 Å²	90	1%	0.01	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135	166.8	-55.1	173.3	0	0	0	107.9	I453 C469 D470 V471 I496 L500 W505	I453-I456 HydrophobicContact CG2-CD1 4.09Å; I453-I456 HydrophobicContact CG2-CG1 3.8Å; I456-C469 HydrophobicContact CG2-CB 3.59Å; I456-D470 WeakPolarHBondContact CA-O 3.3Å; I456-V471 HydrophobicContact CG1-CG1 4.21Å; I456-V471 HydrophobicContact CG1-CG2 4.23Å; I456-V471 HydrophobicContact CG2-CG2 4.36Å; I456-I496 HydrophobicContact CD1-CB 4.33Å; I456-I496 HydrophobicContact CD1-CG1 4.3Å; I456-I496 HydrophobicContact CD1-CG2 3.9Å; I456-L500 HydrophobicContact CD1-CG 4.21Å; I456-L500 HydrophobicContact CG2-CD2 3.87Å; I456-L500 HydrophobicContact CG2-CG 4.46Å; I456-W505 HydrophobicContact CB-CB 4.18Å; I456-W505 HydrophobicContact CB-CD2 4.42Å; I456-W505 HydrophobicContact CB-CG 3.85Å; I456-W505 HydrophobicContact CG1-CG 4.33Å
457	I	93.1	Very high	78.2	Confident	48 Å²	48	79 Å²	79	25%	0.246	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	165.8	177.3	67.5	170.1	0	0	0	111.5	K455 P459 D470 F472	K455-I457 HydrophobicContact CD-CG2 3.79Å; K455-I457 VanDerWaalsContact CE-CG2 3.49Å; K455-I457 HydrophobicContact CG-CG2 3.92Å; I457-P459 VanDerWaalsContact C-N 3.34Å; I457-D470 HydrophobicContact CD1-CB 4.49Å; I457-D470 HydrophobicContact CG1-CB 3.79Å; I457-D470 PolarHBondContact N-O 3.35Å; I457-D470 PolarHBondContact O-N 3Å; I457-F472 HydrophobicContact CD1-CE2 3.66Å; I457-F472 HydrophobicContact CD1-CZ 4.28Å; I457-F472 HydrophobicContact CG1-CE2 3.94Å; I457-F472 HydrophobicContact CG2-CE2 4.46Å
458	N	91.9	Very high	80.8	Confident	97 Å²	97	72.8 Å²	72.8	52%	0.519	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.8	37.7	179.4	-52.8	-36.3	0	0	0	115.4	R460 D470	N458-R460 PolarHBondContact O-N 3.36Å; N458-D470 PolarHBondContact ND2-OD2 3.13Å
459	P	94	Very high	83.1	Confident	14 Å²	14	65 Å²	65	9%	0.091	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	127.3	179.8	31.7	-35.4	0	0	0	110.3	I457 V467 D468 C469 L500 I508 A509	I457-P459 VanDerWaalsContact C-N 3.34Å; P459-V467 HydrophobicContact CB-CG1 3.89Å; P459-D468 CarbonylContact C-O 3.53Å; P459-D468 VanDerWaalsContact CA-O 3.29Å; P459-D468 WeakPolarHBondContact CA-O 3.48Å; P459-C469 HydrophobicContact CB-CB 4.24Å; P459-L500 HydrophobicContact CB-CD2 3.54Å; P459-L500 HydrophobicContact CG-CD2 4.22Å; P459-I508 HydrophobicContact CB-CB 4.45Å; P459-I508 HydrophobicContact CB-CG1 4.17Å; P459-I508 HydrophobicContact CB-CG2 4.23Å; P459-A509 PolarHBondContact O-N 2.89Å
460	R	90.3	Very high	85.4	Confident	138 Å²	138	61.1 Å²	61.1	52%	0.521	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.2	174.7	65.2	-179.1	-179.9	-117.1	-6.7	111.1	N458 V467 D468 A509	N458-R460 PolarHBondContact O-N 3.36Å; R460-V467 CarbonylContact O-C 3.49Å; R460-V467 WeakPolarHBondContact O-CA 3.47Å; R460-D468 HydrophobicContact CG-CB 3.97Å; R460-D468 PolarHBondContact N-O 3.32Å; R460-D468 IonicContact NE-OD2 2.58Å; R460-D468 IonicContact NH2-OD2 2.77Å; R460-D468 PolarHBondContact O-N 3.28Å; R460-A509 CarbonylContact C-O 3.56Å; R460-A509 VanDerWaalsContact CA-O 3.3Å; R460-A509 WeakPolarHBondContact CA-O 3.47Å; R460-A509 HydrophobicContact CB-CB 4.05Å
461	Y	91	Very high	87.1	Confident	77 Å²	77	56.6 Å²	56.6	30%	0.302	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	139.6	173	-75.3	-72.7	0	0	0	111	A466 V467 I508 A509 F511	Y461-A466 CarbonylContact C-O 3.59Å; Y461-A466 WeakPolarHBondContact CA-O 3.32Å; Y461-V467 HydrophobicContact CD1-CG2 3.74Å; Y461-V467 HydrophobicContact CE1-CG2 3.63Å; Y461-I508 HydrophobicContact CD1-CG2 4.35Å; Y461-I508 HydrophobicContact CD2-CB 4.03Å; Y461-I508 HydrophobicContact CD2-CG2 3.38Å; Y461-I508 HydrophobicContact CE1-CD1 4.45Å; Y461-I508 HydrophobicContact CE1-CG2 4.38Å; Y461-I508 HydrophobicContact CE2-CB 3.59Å; Y461-I508 HydrophobicContact CE2-CD1 4.16Å; Y461-I508 HydrophobicContact CE2-CG1 4.49Å; Y461-I508 HydrophobicContact CE2-CG2 3.4Å; Y461-I508 VanDerWaalsContact CE2-CG2 3.4Å; Y461-I508 HydrophobicContact CG-CG2 3.89Å; Y461-I508 WeakPolarHBondContact OH-CD1 3.34Å; Y461-A509 PolarHBondContact N-O 3.37Å; Y461-F511 WeakPolarHBondContact O-CA 3.45Å; Y461-F511 WeakPolarHBondContact O-CB 3.32Å
462	T	85.8	Confident	88.1	Confident	30 Å²	30	56.8 Å²	56.8	18%	0.184	29%	0.286	C	S	.	.			trans	-88.2	169.4	164.2	69.6	0	0	0	0	109.8	S464 G465 A466 D468	T462-S464 PolarHBondContact O-N 3.26Å; T462-S464 PolarHBondContact OG1-N 3.44Å; T462-S464 PolarHBondContact OG1-OG 3.09Å; T462-G465 PolarHBondContact O-N 2.97Å; T462-G465 VanDerWaalsContact O-N 3.09Å; T462-A466 HydrophobicContact CG2-CB 4.45Å; T462-A466 PolarHBondContact N-O 3.33Å; T462-A466 WeakPolarHBondContact OG1-CB 3.05Å; T462-A466 PolarHBondContact OG1-N 3.23Å; T462-A466 PolarHBondContact OG1-O 3Å; T462-D468 HydrophobicContact CG2-CB 4.46Å
463	E	81.5	Confident	88.2	Confident	100 Å²	100	51.9 Å²	51.9	47%	0.467	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-29.1	175.8	-173.6	171.9	-165.2	0	0	112.9	G465 F511 R632	E463-G465 VanDerWaalsContact C-N 3.25Å; E463-G465 PolarHBondContact O-N 3.32Å; E463-F511 HydrophobicContact CB-CD1 4.5Å; E463-F511 HydrophobicContact CB-CE1 4.21Å; E463-F511 HydrophobicContact CB-CE2 4.27Å; E463-F511 HydrophobicContact CB-CZ 4.1Å; E463-F511 HydrophobicContact CG-CE1 4.34Å; E463-R632 IonicContact OE1-CZ 2.73Å; E463-R632 IonicContact OE1-NH1 3.62Å; E463-R632 PolarHBondContact OE1-NH1 3.16Å; E463-R632 IonicContact OE1-NH2 2.72Å; E463-R632 IonicContact OE2-CZ 2.98Å; E463-R632 IonicContact OE2-NH1 3.68Å; E463-R632 PolarHBondContact OE2-NH1 2.99Å; E463-R632 IonicContact OE2-NH2 3.94Å; E463-R632 PolarHBondContact OE2-NH2 3.47Å
464	S	82.3	Confident	88.1	Confident	105 Å²	105	54.2 Å²	54.2	73%	0.734	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-3.6	178.4	63.5	0	0	0	0	114.3	T462 A466	T462-S464 PolarHBondContact O-N 3.26Å; T462-S464 PolarHBondContact OG1-N 3.44Å; T462-S464 PolarHBondContact OG1-OG 3.09Å; S464-A466 VanDerWaalsContact C-N 3.31Å
465	G	83.5	Confident	87.5	Confident	37 Å²	37	53.1 Å²	53.1	38%	0.381	28%	0.276	S	S	.	.	S	Bend	trans	82.9	3.3	-173.3	0	0	0	0	0	114.5	T462 E463	T462-G465 PolarHBondContact O-N 2.97Å; T462-G465 VanDerWaalsContact O-N 3.09Å; E463-G465 VanDerWaalsContact C-N 3.25Å; E463-G465 PolarHBondContact O-N 3.32Å
466	A	89.4	Confident	86.6	Confident	7 Å²	7	50.7 Å²	50.7	6%	0.058	26%	0.264	C	S	.	.			trans	-71.9	167.2	167.6	0	0	0	0	0	110.8	Y461 T462 S464 T483 T485	Y461-A466 CarbonylContact C-O 3.59Å; Y461-A466 WeakPolarHBondContact CA-O 3.32Å; T462-A466 HydrophobicContact CG2-CB 4.45Å; T462-A466 PolarHBondContact N-O 3.33Å; T462-A466 WeakPolarHBondContact OG1-CB 3.05Å; T462-A466 PolarHBondContact OG1-N 3.23Å; T462-A466 PolarHBondContact OG1-O 3Å; S464-A466 VanDerWaalsContact C-N 3.31Å; A466-T483 HydrophobicContact CB-CG2 3.82Å; A466-T485 HydrophobicContact CB-CG2 3.85Å
467	V	87.8	Confident	86	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	112.1	179.7	-177.5	0	0	0	0	110.1	P459 R460 Y461 T483 A484 W497 L500 I508	P459-V467 HydrophobicContact CB-CG1 3.89Å; R460-V467 CarbonylContact O-C 3.49Å; R460-V467 WeakPolarHBondContact O-CA 3.47Å; Y461-V467 HydrophobicContact CD1-CG2 3.74Å; Y461-V467 HydrophobicContact CE1-CG2 3.63Å; V467-T483 CarbonylContact O-C 3.54Å; V467-T483 WeakPolarHBondContact O-CA 3.5Å; V467-A484 HydrophobicContact CB-CB 4.48Å; V467-A484 PolarHBondContact N-O 3.31Å; V467-A484 PolarHBondContact O-N 3.46Å; V467-W497 HydrophobicContact CB-CZ3 4.48Å; V467-W497 HydrophobicContact CG2-CZ3 3.86Å; V467-L500 HydrophobicContact CB-CD1 4.16Å; V467-L500 HydrophobicContact CG1-CD1 3.86Å; V467-L500 HydrophobicContact CG1-CD2 4.36Å; V467-I508 HydrophobicContact CG1-CG2 3.83Å; V467-I508 HydrophobicContact CG2-CD1 4.07Å; V467-I508 HydrophobicContact CG2-CG2 4.12Å
468	D	89.2	Confident	85.4	Confident	41 Å²	41	63.6 Å²	63.6	22%	0.219	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.1	167.6	-79.9	-9.7	0	0	0	109.4	P459 R460 T462 T483	P459-D468 CarbonylContact C-O 3.53Å; P459-D468 VanDerWaalsContact CA-O 3.29Å; P459-D468 WeakPolarHBondContact CA-O 3.48Å; R460-D468 HydrophobicContact CG-CB 3.97Å; R460-D468 PolarHBondContact N-O 3.32Å; R460-D468 IonicContact NE-OD2 2.58Å; R460-D468 IonicContact NH2-OD2 2.77Å; R460-D468 PolarHBondContact O-N 3.28Å; T462-D468 HydrophobicContact CG2-CB 4.46Å; D468-T483 WeakPolarHBondContact OD1-CB 3.11Å; D468-T483 WeakPolarHBondContact OD1-CG2 3.46Å; D468-T483 PolarHBondContact OD1-OG1 3.33Å
469	C	88.8	Confident	85.1	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.041	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	165.5	179.4	63.5	0	0	0	0	111.8	I456 P459 P481 Y482	I456-C469 HydrophobicContact CG2-CB 3.59Å; P459-C469 HydrophobicContact CB-CB 4.24Å; C469-P481 CarbonylContact O-C 3.53Å; C469-P481 WeakPolarHBondContact O-CA 3.36Å; C469-Y482 PolarHBondContact N-O 3.35Å; C469-Y482 PolarHBondContact O-N 2.84Å; C469-Y482 PolarHBondContact SG-O 3Å; C469-Y482 VanDerWaalsContact SG-O 3.35Å
470	D	91.5	Very high	84.5	Confident	46 Å²	46	62.5 Å²	62.5	25%	0.246	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.7	173.6	-59	-51.3	0	0	0	109.6	I456 I457 N458 A479	I456-D470 WeakPolarHBondContact CA-O 3.3Å; I457-D470 HydrophobicContact CD1-CB 4.49Å; I457-D470 HydrophobicContact CG1-CB 3.79Å; I457-D470 PolarHBondContact N-O 3.35Å; I457-D470 PolarHBondContact O-N 3Å; N458-D470 PolarHBondContact ND2-OD2 3.13Å; D470-A479 HydrophobicContact CB-CB 3.74Å
471	V	86.5	Confident	84.2	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.1	-172.7	-173.8	0	0	0	0	110.8	I453 I456 F473 R476 A479 V480 Y482 I496	I453-V471 HydrophobicContact CG2-CG1 4.15Å; I456-V471 HydrophobicContact CG1-CG1 4.21Å; I456-V471 HydrophobicContact CG1-CG2 4.23Å; I456-V471 HydrophobicContact CG2-CG2 4.36Å; V471-F473 HydrophobicContact CB-CE1 4.45Å; V471-F473 HydrophobicContact CG1-CD1 3.78Å; V471-F473 HydrophobicContact CG1-CE1 3.35Å; V471-F473 HydrophobicContact CG1-CZ 3.92Å; V471-R476 PolarHBondContact O-NE 3.5Å; V471-R476 PolarHBondContact O-NH2 2.87Å; V471-A479 CarbonylContact O-C 3.55Å; V471-A479 WeakPolarHBondContact O-CA 3.16Å; V471-V480 PolarHBondContact N-O 3.16Å; V471-V480 PolarHBondContact O-N 2.86Å; V471-Y482 HydrophobicContact CG2-CG 4.37Å; V471-I496 HydrophobicContact CG1-CD1 4.19Å; V471-I496 HydrophobicContact CG1-CG1 4.43Å; V471-I496 HydrophobicContact CG2-CD1 4.08Å; V471-I496 HydrophobicContact CG2-CG1 4.47Å; V471-I496 HydrophobicContact CG2-CG2 4.4Å
472	F	87.8	Confident	83.8	Confident	59 Å²	59	60 Å²	60	26%	0.259	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	120.2	168.5	-68	-94.4	0	0	0	109.3	K454 K455 I457 A479	K454-F472 HydrophobicContact CB-CB 4.24Å; K454-F472 PolarHBondContact N-O 2.75Å; K455-F472 HydrophobicContact CB-CB 4.26Å; K455-F472 HydrophobicContact CB-CD2 4.22Å; K455-F472 PolarHBondContact N-O 3.46Å; K455-F472 PolarHBondContact O-N 3.2Å; I457-F472 HydrophobicContact CD1-CE2 3.66Å; I457-F472 HydrophobicContact CD1-CZ 4.28Å; I457-F472 HydrophobicContact CG1-CE2 3.94Å; I457-F472 HydrophobicContact CG2-CE2 4.46Å; F472-A479 HydrophobicContact CD1-CB 4.13Å; F472-A479 HydrophobicContact CD2-CB 3.84Å; F472-A479 HydrophobicContact CE1-CB 3.84Å; F472-A479 HydrophobicContact CE2-CB 3.53Å; F472-A479 HydrophobicContact CG-CB 4.15Å; F472-A479 HydrophobicContact CZ-CB 3.55Å
473	F	82.8	Confident	83.9	Confident	24 Å²	24	62.1 Å²	62.1	11%	0.105	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	162	167.6	-62.7	-38.1	0	0	0	109.7	V451 E452 I453 V471 D475 R476 T492 I496	V451-F473 HydrophobicContact CG1-CB 3.44Å; V451-F473 VanDerWaalsContact CG1-CB 3.44Å; V451-F473 HydrophobicContact CG1-CD1 4.21Å; V451-F473 HydrophobicContact CG1-CD2 3.84Å; V451-F473 HydrophobicContact CG1-CG 3.61Å; E452-F473 CarbonylContact O-C 3.55Å; E452-F473 WeakPolarHBondContact O-CA 3.41Å; I453-F473 HydrophobicContact CG1-CD1 4.18Å; I453-F473 HydrophobicContact CG1-CE1 3.96Å; V471-F473 HydrophobicContact CB-CE1 4.45Å; V471-F473 HydrophobicContact CG1-CD1 3.78Å; V471-F473 HydrophobicContact CG1-CE1 3.35Å; V471-F473 HydrophobicContact CG1-CZ 3.92Å; F473-D475 VanDerWaalsContact C-N 3.32Å; F473-D475 VanDerWaalsContact CB-OD1 3.32Å; F473-D475 WeakPolarHBondContact CB-OD1 3.33Å; F473-R476 HydrophobicContact CB-CG 3.93Å; F473-R476 VanDerWaalsContact CD2-NE 3.33Å; F473-R476 VanDerWaalsContact CG-CZ 3.47Å; F473-R476 VanDerWaalsContact O-O 3.11Å; F473-T492 HydrophobicContact CE1-CG2 3.72Å; F473-T492 HydrophobicContact CZ-CG2 3.68Å; F473-I496 HydrophobicContact CE1-CD1 4.26Å; F473-I496 HydrophobicContact CZ-CD1 4.2Å
474	D	81.1	Confident	84.1	Confident	64 Å²	64	57.4 Å²	57.4	34%	0.342	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-30.8	-179	66.4	-28.8	0	0	0	114.2	V451 E452 K454	V451-D474 WeakPolarHBondContact CA-OD1 3.47Å; V451-D474 WeakPolarHBondContact CG1-OD1 3.47Å; E452-D474 HydrophobicContact CB-CB 4.43Å; E452-D474 PolarHBondContact N-OD1 2.86Å; E452-D474 PolarHBondContact O-N 2.89Å; K454-D474 HydrophobicContact CD-CB 4.33Å; K454-D474 HydrophobicContact CG-CB 4.21Å; K454-D474 PolarHBondContact NZ-O 3.36Å
475	D	76.6	Confident	84.2	Confident	110 Å²	110	54.8 Å²	54.8	59%	0.588	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-5.8	-177.8	75.1	-22.9	0	0	0	114.8	V451 F473	V451-D475 HydrophobicContact CG1-CB 4.49Å; V451-D475 HydrophobicContact CG2-CB 4.4Å; F473-D475 VanDerWaalsContact C-N 3.32Å; F473-D475 VanDerWaalsContact CB-OD1 3.32Å; F473-D475 WeakPolarHBondContact CB-OD1 3.33Å
476	R	70.5	Confident	84.4	Confident	59 Å²	59	56 Å²	56	22%	0.223	31%	0.309	C	S	.	.			trans	-134.8	140.7	-175.6	66.4	-170.1	-171.6	-163.1	-6.2	113	V471 F473 Q478 V480	V471-R476 PolarHBondContact O-NE 3.5Å; V471-R476 PolarHBondContact O-NH2 2.87Å; F473-R476 HydrophobicContact CB-CG 3.93Å; F473-R476 VanDerWaalsContact CD2-NE 3.33Å; F473-R476 VanDerWaalsContact CG-CZ 3.47Å; F473-R476 VanDerWaalsContact O-O 3.11Å; R476-Q478 WeakPolarHBondContact CG-O 3.46Å; R476-V480 VanDerWaalsContact NH1-CB 3.34Å
477	D	79.5	Confident	84.2	Confident	166 Å²	166	62.6 Å²	62.6	89%	0.888	34%	0.343	S	S	*	.	S	Bend	trans	-80.7	-16.3	-178.9	-64.7	-33.7	0	0	0	113.6
478	Q	82.2	Confident	83.9	Confident	155 Å²	155	63.9 Å²	63.9	72%	0.724	35%	0.35	S	S	*	.	S	Bend	trans	-114	145.6	-177.3	-65.3	-174.9	7	0	0	111.7	R476	R476-Q478 WeakPolarHBondContact CG-O 3.46Å
479	A	85.8	Confident	83.3	Confident	30 Å²	30	68.1 Å²	68.1	25%	0.248	38%	0.377	C	S	.	.			trans	-66.7	143.9	170	0	0	0	0	0	110	D470 V471 F472	D470-A479 HydrophobicContact CB-CB 3.74Å; V471-A479 CarbonylContact O-C 3.55Å; V471-A479 WeakPolarHBondContact O-CA 3.16Å; F472-A479 HydrophobicContact CD1-CB 4.13Å; F472-A479 HydrophobicContact CD2-CB 3.84Å; F472-A479 HydrophobicContact CE1-CB 3.84Å; F472-A479 HydrophobicContact CE2-CB 3.53Å; F472-A479 HydrophobicContact CG-CB 4.15Å; F472-A479 HydrophobicContact CZ-CB 3.55Å
480	V	79.8	Confident	82.6	Confident	58 Å²	58	69.8 Å²	69.8	35%	0.352	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.3	171	174	0	0	0	0	108.7	V471 R476 Y482	V471-V480 PolarHBondContact N-O 3.16Å; V471-V480 PolarHBondContact O-N 2.86Å; R476-V480 VanDerWaalsContact NH1-CB 3.34Å; V480-Y482 PolarHBondContact O-N 2.91Å
481	P	85.4	Confident	82	Confident	101 Å²	101	72.6 Å²	72.6	66%	0.656	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58	129.5	171.7	-21.9	32.5	0	0	0	109.9	C469	C469-P481 CarbonylContact O-C 3.53Å; C469-P481 WeakPolarHBondContact O-CA 3.36Å
482	Y	82.6	Confident	81.6	Confident	62 Å²	62	75.1 Å²	75.1	24%	0.243	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	133.3	-178.4	-162	-88.8	0	0	0	109.8	C469 V471 V480 A484 D488 G493 I496	C469-Y482 PolarHBondContact N-O 3.35Å; C469-Y482 PolarHBondContact O-N 2.84Å; C469-Y482 PolarHBondContact SG-O 3Å; C469-Y482 VanDerWaalsContact SG-O 3.35Å; V471-Y482 HydrophobicContact CG2-CG 4.37Å; V480-Y482 PolarHBondContact O-N 2.91Å; Y482-A484 HydrophobicContact CD1-CB 4.12Å; Y482-A484 HydrophobicContact CE1-CB 4.27Å; Y482-D488 PolarHBondContact OH-OD2 3.4Å; Y482-G493 WeakPolarHBondContact OH-CA 3.48Å; Y482-I496 HydrophobicContact CD1-CD1 4.02Å; Y482-I496 HydrophobicContact CD1-CG2 4.07Å; Y482-I496 HydrophobicContact CD2-CD1 4.3Å; Y482-I496 HydrophobicContact CE1-CD1 4.05Å; Y482-I496 HydrophobicContact CE1-CG2 4.39Å; Y482-I496 HydrophobicContact CE2-CD1 4.32Å; Y482-I496 HydrophobicContact CG-CD1 4.16Å
483	T	86.5	Confident	81.2	Confident	75 Å²	75	72.3 Å²	72.3	46%	0.46	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	102.5	171.9	-56.9	0	0	0	0	107.9	A466 V467 D468	A466-T483 HydrophobicContact CB-CG2 3.82Å; V467-T483 CarbonylContact O-C 3.54Å; V467-T483 WeakPolarHBondContact O-CA 3.5Å; D468-T483 WeakPolarHBondContact OD1-CB 3.11Å; D468-T483 WeakPolarHBondContact OD1-CG2 3.46Å; D468-T483 PolarHBondContact OD1-OG1 3.33Å
484	A	85.9	Confident	81.4	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	139.1	-179.7	0	0	0	0	0	110.9	V467 Y482 I496 W497 L500	V467-A484 HydrophobicContact CB-CB 4.48Å; V467-A484 PolarHBondContact N-O 3.31Å; V467-A484 PolarHBondContact O-N 3.46Å; Y482-A484 HydrophobicContact CD1-CB 4.12Å; Y482-A484 HydrophobicContact CE1-CB 4.27Å; A484-I496 HydrophobicContact CB-CG2 3.81Å; A484-W497 HydrophobicContact CB-CE3 3.93Å; A484-W497 WeakPolarHBondContact O-CZ3 3.33Å; A484-L500 HydrophobicContact CB-CD1 3.74Å
485	T	85.8	Confident	81.7	Confident	51 Å²	51	76.2 Å²	76.2	31%	0.313	43%	0.432	S	S	.	.			trans	-135.6	156.5	179.1	65.4	0	0	0	0	110.3	A466 D487 W497	A466-T485 HydrophobicContact CB-CG2 3.85Å; T485-D487 PolarHBondContact O-N 3.11Å; T485-W497 VanDerWaalsContact C-CE3 3.44Å
486	A	86.5	Confident	82.3	Confident	63 Å²	63	71 Å²	71	52%	0.521	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-26.2	177.8	0	0	0	0	0	113.2	W497	A486-W497 VanDerWaalsContact CA-CE2 3.48Å; A486-W497 HydrophobicContact CB-CD2 4.48Å; A486-W497 HydrophobicContact CB-CH2 4.41Å; A486-W497 HydrophobicContact CB-CZ2 3.65Å
487	D	84.8	Confident	83.2	Confident	145 Å²	145	70.6 Å²	70.6	78%	0.775	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	15.5	-173.3	-56.7	-44.5	0	0	0	113.4	T485 V489	T485-D487 PolarHBondContact O-N 3.11Å; D487-V489 PolarHBondContact O-N 3.35Å
488	D	82.1	Confident	83.8	Confident	26 Å²	26	69 Å²	69	14%	0.139	39%	0.389	C	S	.	.			trans	-63.7	133.6	179.7	-157.5	-44.4	0	0	0	111.3	Y482 A490 G493 Q494	Y482-D488 PolarHBondContact OH-OD2 3.4Å; D488-A490 WeakPolarHBondContact OD1-CB 3.39Å; D488-A490 PolarHBondContact OD1-N 2.71Å; D488-G493 VanDerWaalsContact OD2-CA 3.32Å; D488-G493 WeakPolarHBondContact OD2-CA 3.24Å; D488-Q494 WeakPolarHBondContact O-CG 3.49Å; D488-Q494 PolarHBondContact O-NE2 2.9Å
489	V	76.1	Confident	84.3	Confident	131 Å²	131	62.7 Å²	62.7	79%	0.794	36%	0.36	S	S	*	.			trans	-97.2	-16.2	-178.9	-64.6	0	0	0	0	113.1	D487	D487-V489 PolarHBondContact O-N 3.35Å
490	A	75.7	Confident	84.6	Confident	41 Å²	41	61.4 Å²	61.4	34%	0.339	35%	0.349	S	S	.	.	S	Bend	trans	-80.8	135.3	179.3	0	0	0	0	0	110	D488 T492 G493 Q494	D488-A490 WeakPolarHBondContact OD1-CB 3.39Å; D488-A490 PolarHBondContact OD1-N 2.71Å; A490-T492 VanDerWaalsContact C-N 3.27Å; A490-T492 PolarHBondContact O-N 3.35Å; A490-G493 WeakPolarHBondContact O-CA 3.34Å; A490-G493 PolarHBondContact O-N 3.1Å; A490-Q494 PolarHBondContact O-N 3.09Å
491	P	77	Confident	85.2	Confident	104 Å²	104	62.8 Å²	62.8	68%	0.675	35%	0.351	S	S	*	.	H	α-helix	trans	-54.1	-42	-179.5	-27.8	34.4	0	0	0	113.4	Q494 Q495	P491-Q494 PolarHBondContact O-N 3.41Å; P491-Q495 WeakPolarHBondContact O-CB 3.15Å; P491-Q495 PolarHBondContact O-N 2.92Å
492	T	79	Confident	85.5	Confident	54 Å²	54	61.9 Å²	61.9	33%	0.331	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-39.9	175.8	-46.9	0	0	0	0	112.2	F473 A490 Q495 I496	F473-T492 HydrophobicContact CE1-CG2 3.72Å; F473-T492 HydrophobicContact CZ-CG2 3.68Å; A490-T492 VanDerWaalsContact C-N 3.27Å; A490-T492 PolarHBondContact O-N 3.35Å; T492-Q495 PolarHBondContact O-N 3.44Å; T492-I496 HydrophobicContact CG2-CD1 4.12Å; T492-I496 WeakPolarHBondContact O-CD1 3.35Å; T492-I496 VanDerWaalsContact O-CG1 3.24Å; T492-I496 WeakPolarHBondContact O-CG1 3.38Å; T492-I496 PolarHBondContact O-N 3.31Å
493	G	80.4	Confident	85.8	Confident	0 Å²	0	61 Å²	61	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-67.2	-40.7	178.3	0	0	0	0	0	112.8	Y482 D488 A490 I496 W497	Y482-G493 WeakPolarHBondContact OH-CA 3.48Å; D488-G493 VanDerWaalsContact OD2-CA 3.32Å; D488-G493 WeakPolarHBondContact OD2-CA 3.24Å; A490-G493 WeakPolarHBondContact O-CA 3.34Å; A490-G493 PolarHBondContact O-N 3.1Å; G493-I496 PolarHBondContact O-N 3.37Å; G493-W497 PolarHBondContact O-N 3.31Å
494	Q	85.6	Confident	86.1	Confident	90 Å²	90	62.8 Å²	62.8	42%	0.421	36%	0.358	S	S	.	.	H	α-helix	trans	-61.3	-42.9	171.4	-68.5	178.9	-3.9	0	0	111.9	D488 A490 P491 W497 Q498	D488-Q494 WeakPolarHBondContact O-CG 3.49Å; D488-Q494 PolarHBondContact O-NE2 2.9Å; A490-Q494 PolarHBondContact O-N 3.09Å; P491-Q494 PolarHBondContact O-N 3.41Å; Q494-W497 PolarHBondContact O-N 2.95Å; Q494-Q498 WeakPolarHBondContact O-CB 2.92Å; Q494-Q498 WeakPolarHBondContact O-CG 3.18Å; Q494-Q498 PolarHBondContact O-N 2.8Å
495	Q	87.9	Confident	86.3	Confident	80 Å²	80	65.9 Å²	65.9	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-64.4	-44.8	177.3	-171.1	-176.2	-10.2	0	0	111.5	I453 P491 T492 W497 Q498 E499	I453-Q495 HydrophobicContact CD1-CB 3.99Å; I453-Q495 HydrophobicContact CD1-CG 3.66Å; P491-Q495 WeakPolarHBondContact O-CB 3.15Å; P491-Q495 PolarHBondContact O-N 2.92Å; T492-Q495 PolarHBondContact O-N 3.44Å; Q495-W497 VanDerWaalsContact C-N 3.34Å; Q495-W497 PolarHBondContact O-N 2.71Å; Q495-Q498 PolarHBondContact O-N 3.46Å; Q495-E499 HydrophobicContact CG-CG 4.31Å; Q495-E499 PolarHBondContact NE2-OE1 3.34Å; Q495-E499 WeakPolarHBondContact O-CB 3.34Å; Q495-E499 WeakPolarHBondContact O-CG 3.4Å; Q495-E499 PolarHBondContact O-N 2.88Å
496	I	88.6	Confident	86.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-57.1	-48.7	175.7	-71.3	163.4	0	0	0	110.3	I453 I456 V471 F473 Y482 A484 T492 G493 E499 L500	I453-I496 HydrophobicContact CD1-CG1 3.57Å; I453-I496 HydrophobicContact CG1-CG1 4.35Å; I456-I496 HydrophobicContact CD1-CB 4.33Å; I456-I496 HydrophobicContact CD1-CG1 4.3Å; I456-I496 HydrophobicContact CD1-CG2 3.9Å; V471-I496 HydrophobicContact CG1-CD1 4.19Å; V471-I496 HydrophobicContact CG1-CG1 4.43Å; V471-I496 HydrophobicContact CG2-CD1 4.08Å; V471-I496 HydrophobicContact CG2-CG1 4.47Å; V471-I496 HydrophobicContact CG2-CG2 4.4Å; F473-I496 HydrophobicContact CE1-CD1 4.26Å; F473-I496 HydrophobicContact CZ-CD1 4.2Å; Y482-I496 HydrophobicContact CD1-CD1 4.02Å; Y482-I496 HydrophobicContact CD1-CG2 4.07Å; Y482-I496 HydrophobicContact CD2-CD1 4.3Å; Y482-I496 HydrophobicContact CE1-CD1 4.05Å; Y482-I496 HydrophobicContact CE1-CG2 4.39Å; Y482-I496 HydrophobicContact CE2-CD1 4.32Å; Y482-I496 HydrophobicContact CG-CD1 4.16Å; A484-I496 HydrophobicContact CB-CG2 3.81Å; T492-I496 HydrophobicContact CG2-CD1 4.12Å; T492-I496 WeakPolarHBondContact O-CD1 3.35Å; T492-I496 VanDerWaalsContact O-CG1 3.24Å; T492-I496 WeakPolarHBondContact O-CG1 3.38Å; T492-I496 PolarHBondContact O-N 3.31Å; G493-I496 PolarHBondContact O-N 3.37Å; I496-E499 PolarHBondContact O-N 3.42Å; I496-L500 HydrophobicContact CG2-CD1 3.85Å; I496-L500 WeakPolarHBondContact O-CB 3.35Å; I496-L500 WeakPolarHBondContact O-CG 3.14Å; I496-L500 PolarHBondContact O-N 3.42Å
497	W	91	Very high	86.6	Confident	50 Å²	50	71.3 Å²	71.3	19%	0.189	39%	0.392	C	S	.	.	H	α-helix	trans	-59.7	-49.8	178	180	-102.7	0	0	0	111.8	V467 A484 T485 A486 G493 Q494 Q495 E499 L500 Q501	V467-W497 HydrophobicContact CB-CZ3 4.48Å; V467-W497 HydrophobicContact CG2-CZ3 3.86Å; A484-W497 HydrophobicContact CB-CE3 3.93Å; A484-W497 WeakPolarHBondContact O-CZ3 3.33Å; T485-W497 VanDerWaalsContact C-CE3 3.44Å; A486-W497 VanDerWaalsContact CA-CE2 3.48Å; A486-W497 HydrophobicContact CB-CD2 4.48Å; A486-W497 HydrophobicContact CB-CH2 4.41Å; A486-W497 HydrophobicContact CB-CZ2 3.65Å; G493-W497 PolarHBondContact O-N 3.31Å; Q494-W497 PolarHBondContact O-N 2.95Å; Q495-W497 VanDerWaalsContact C-N 3.34Å; Q495-W497 PolarHBondContact O-N 2.71Å; W497-E499 PolarHBondContact O-N 2.86Å; W497-L500 PolarHBondContact O-N 3.45Å; W497-Q501 HydrophobicContact CD2-CG 4.12Å; W497-Q501 HydrophobicContact CG-CG 4.39Å; W497-Q501 HydrophobicContact CZ2-CG 4.04Å; W497-Q501 VanDerWaalsContact O-CG 3.3Å; W497-Q501 WeakPolarHBondContact O-CG 3.42Å; W497-Q501 PolarHBondContact O-N 2.63Å
498	Q	90.8	Very high	86.9	Confident	133 Å²	133	65.7 Å²	65.7	62%	0.621	36%	0.362	S	S	*	.	H	α-helix	trans	-60.6	-42.5	178.5	-74.2	178.7	3.3	0	0	112.3	Q494 Q495 Q501 S502	Q494-Q498 WeakPolarHBondContact O-CB 2.92Å; Q494-Q498 WeakPolarHBondContact O-CG 3.18Å; Q494-Q498 PolarHBondContact O-N 2.8Å; Q495-Q498 PolarHBondContact O-N 3.46Å; Q498-Q501 PolarHBondContact O-N 2.89Å; Q498-S502 VanDerWaalsContact O-CB 3.3Å; Q498-S502 WeakPolarHBondContact O-CB 3.22Å; Q498-S502 PolarHBondContact O-N 2.88Å; Q498-S502 PolarHBondContact O-OG 3.37Å
499	E	92.8	Very high	87.3	Confident	22 Å²	22	66.8 Å²	66.8	10%	0.103	37%	0.374	C	S	.	.	H	α-helix	trans	-67.8	-37.1	179.3	-72	-167.7	-167.9	0	0	112.3	Q495 I496 W497 S502 K504 W505	Q495-E499 HydrophobicContact CG-CG 4.31Å; Q495-E499 PolarHBondContact NE2-OE1 3.34Å; Q495-E499 WeakPolarHBondContact O-CB 3.34Å; Q495-E499 WeakPolarHBondContact O-CG 3.4Å; Q495-E499 PolarHBondContact O-N 2.88Å; I496-E499 PolarHBondContact O-N 3.42Å; W497-E499 PolarHBondContact O-N 2.86Å; E499-S502 WeakPolarHBondContact CA-OG 3.25Å; E499-S502 PolarHBondContact O-OG 3.39Å; E499-K504 HydrophobicContact CB-CD 4.34Å; E499-K504 HydrophobicContact CG-CD 4.08Å; E499-K504 PolarHBondContact O-N 2.86Å; E499-K504 IonicContact OE1-NZ 2.82Å; E499-K504 PolarHBondContact OE1-NZ 2.94Å; E499-K504 VanDerWaalsContact OE1-NZ 3.08Å; E499-K504 WeakPolarHBondContact OE2-CD 3.29Å; E499-K504 IonicContact OE2-NZ 3.74Å; E499-K504 PolarHBondContact OE2-NZ 3Å; E499-W505 WeakPolarHBondContact OE2-CZ2 3.36Å; E499-W505 PolarHBondContact OE2-NE1 2.85Å
500	L	93.1	Very high	88	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-63.3	-50.6	171.6	-77.2	167.6	0	0	0	111.6	I456 P459 V467 A484 I496 W497 S502 G503 I508	I456-L500 HydrophobicContact CD1-CG 4.21Å; I456-L500 HydrophobicContact CG2-CD2 3.87Å; I456-L500 HydrophobicContact CG2-CG 4.46Å; P459-L500 HydrophobicContact CB-CD2 3.54Å; P459-L500 HydrophobicContact CG-CD2 4.22Å; V467-L500 HydrophobicContact CB-CD1 4.16Å; V467-L500 HydrophobicContact CG1-CD1 3.86Å; V467-L500 HydrophobicContact CG1-CD2 4.36Å; A484-L500 HydrophobicContact CB-CD1 3.74Å; I496-L500 HydrophobicContact CG2-CD1 3.85Å; I496-L500 WeakPolarHBondContact O-CB 3.35Å; I496-L500 WeakPolarHBondContact O-CG 3.14Å; I496-L500 PolarHBondContact O-N 3.42Å; W497-L500 PolarHBondContact O-N 3.45Å; L500-S502 PolarHBondContact O-N 3.38Å; L500-G503 PolarHBondContact O-N 3.35Å; L500-G503 VanDerWaalsContact O-N 3.09Å; L500-I508 HydrophobicContact CB-CD1 4.28Å
501	Q	91.8	Very high	88.6	Confident	86 Å²	86	66.6 Å²	66.6	40%	0.402	37%	0.365	S	S	.	.	H	α-helix	trans	-66.1	-26	179.8	-63.4	-51	-46.9	0	0	112.9	W497 Q498 G503	W497-Q501 HydrophobicContact CD2-CG 4.12Å; W497-Q501 HydrophobicContact CG-CG 4.39Å; W497-Q501 HydrophobicContact CZ2-CG 4.04Å; W497-Q501 VanDerWaalsContact O-CG 3.3Å; W497-Q501 WeakPolarHBondContact O-CG 3.42Å; W497-Q501 PolarHBondContact O-N 2.63Å; Q498-Q501 PolarHBondContact O-N 2.89Å; Q501-G503 PolarHBondContact O-N 3.22Å
502	S	92.6	Very high	89.1	Confident	83 Å²	83	66.4 Å²	66.4	58%	0.58	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-12.8	175.2	74.9	0	0	0	0	113.9	Q498 E499 L500 K504	Q498-S502 VanDerWaalsContact O-CB 3.3Å; Q498-S502 WeakPolarHBondContact O-CB 3.22Å; Q498-S502 PolarHBondContact O-N 2.88Å; Q498-S502 PolarHBondContact O-OG 3.37Å; E499-S502 WeakPolarHBondContact CA-OG 3.25Å; E499-S502 PolarHBondContact O-OG 3.39Å; L500-S502 PolarHBondContact O-N 3.38Å; S502-K504 PolarHBondContact O-N 2.93Å; S502-K504 WeakPolarHBondContact OG-CB 3.37Å; S502-K504 PolarHBondContact OG-N 2.84Å
503	G	88.6	Confident	89.5	Confident	42 Å²	42	66.5 Å²	66.5	43%	0.433	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	7.5	-174.5	0	0	0	0	0	114.5	L500 Q501 W505 G506	L500-G503 PolarHBondContact O-N 3.35Å; L500-G503 VanDerWaalsContact O-N 3.09Å; Q501-G503 PolarHBondContact O-N 3.22Å; G503-W505 PolarHBondContact O-N 2.95Å; G503-W505 VanDerWaalsContact O-N 3.1Å; G503-G506 PolarHBondContact O-N 2.9Å; G503-G506 VanDerWaalsContact O-N 3.11Å
504	K	91.8	Very high	89.8	Confident	114 Å²	114	68.9 Å²	68.9	50%	0.496	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.6	-178.7	-178.5	-177.3	174.4	-165.3	0	113.2	E499 S502	E499-K504 HydrophobicContact CB-CD 4.34Å; E499-K504 HydrophobicContact CG-CD 4.08Å; E499-K504 PolarHBondContact O-N 2.86Å; E499-K504 IonicContact OE1-NZ 2.82Å; E499-K504 PolarHBondContact OE1-NZ 2.94Å; E499-K504 VanDerWaalsContact OE1-NZ 3.08Å; E499-K504 WeakPolarHBondContact OE2-CD 3.29Å; E499-K504 IonicContact OE2-NZ 3.74Å; E499-K504 PolarHBondContact OE2-NZ 3Å; S502-K504 PolarHBondContact O-N 2.93Å; S502-K504 WeakPolarHBondContact OG-CB 3.37Å; S502-K504 PolarHBondContact OG-N 2.84Å
505	W	90.2	Very high	90	Very high	65 Å²	65	69.6 Å²	69.6	25%	0.246	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	15.7	-175.6	-56.5	112.8	0	0	0	114.1	I453 K454 K455 I456 E499 G503	I453-W505 HydrophobicContact CG2-CZ2 4.45Å; K454-W505 WeakPolarHBondContact O-CH2 3.18Å; K455-W505 HydrophobicContact CB-CZ3 4.27Å; K455-W505 HydrophobicContact CG-CE3 4.06Å; K455-W505 HydrophobicContact CG-CZ3 3.98Å; I456-W505 HydrophobicContact CB-CB 4.18Å; I456-W505 HydrophobicContact CB-CD2 4.42Å; I456-W505 HydrophobicContact CB-CG 3.85Å; I456-W505 HydrophobicContact CG1-CG 4.33Å; E499-W505 WeakPolarHBondContact OE2-CZ2 3.36Å; E499-W505 PolarHBondContact OE2-NE1 2.85Å; G503-W505 PolarHBondContact O-N 2.95Å; G503-W505 VanDerWaalsContact O-N 3.1Å
506	G	88.7	Confident	90	Very high	40 Å²	40	73.2 Å²	73.2	41%	0.412	41%	0.406	S	S	.	.			trans	100.6	178.7	-176.8	0	0	0	0	0	113.1	G503	G503-G506 PolarHBondContact O-N 2.9Å; G503-G506 VanDerWaalsContact O-N 3.11Å
507	E	89.4	Confident	89.8	Confident	188 Å²	188	75.9 Å²	75.9	88%	0.879	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-71.3	139.3	176.8	-72.1	-176.8	164	0	0	111.1	A509	E507-A509 PolarHBondContact O-N 2.87Å
508	I	91.8	Very high	89.7	Confident	27 Å²	27	75.1 Å²	75.1	14%	0.138	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-78	121.8	174.1	-55.4	166.2	0	0	0	107.5	P459 Y461 V467 L500	P459-I508 HydrophobicContact CB-CB 4.45Å; P459-I508 HydrophobicContact CB-CG1 4.17Å; P459-I508 HydrophobicContact CB-CG2 4.23Å; Y461-I508 HydrophobicContact CD1-CG2 4.35Å; Y461-I508 HydrophobicContact CD2-CB 4.03Å; Y461-I508 HydrophobicContact CD2-CG2 3.38Å; Y461-I508 HydrophobicContact CE1-CD1 4.45Å; Y461-I508 HydrophobicContact CE1-CG2 4.38Å; Y461-I508 HydrophobicContact CE2-CB 3.59Å; Y461-I508 HydrophobicContact CE2-CD1 4.16Å; Y461-I508 HydrophobicContact CE2-CG1 4.49Å; Y461-I508 HydrophobicContact CE2-CG2 3.4Å; Y461-I508 VanDerWaalsContact CE2-CG2 3.4Å; Y461-I508 HydrophobicContact CG-CG2 3.89Å; Y461-I508 WeakPolarHBondContact OH-CD1 3.34Å; V467-I508 HydrophobicContact CG1-CG2 3.83Å; V467-I508 HydrophobicContact CG2-CD1 4.07Å; V467-I508 HydrophobicContact CG2-CG2 4.12Å; L500-I508 HydrophobicContact CB-CD1 4.28Å
509	A	91.1	Very high	89.7	Confident	49 Å²	49	73.2 Å²	73.2	41%	0.405	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-61.8	135.4	178.3	0	0	0	0	0	110.3	P459 R460 Y461 E507	P459-A509 PolarHBondContact O-N 2.89Å; R460-A509 CarbonylContact C-O 3.56Å; R460-A509 VanDerWaalsContact CA-O 3.3Å; R460-A509 WeakPolarHBondContact CA-O 3.47Å; R460-A509 HydrophobicContact CB-CB 4.05Å; Y461-A509 PolarHBondContact N-O 3.37Å; E507-A509 PolarHBondContact O-N 2.87Å
510	P	90	Very high	89.5	Confident	97 Å²	97	75.2 Å²	75.2	63%	0.63	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-66	151.4	178.3	27.9	-34.4	0	0	0	111.1	T512	P510-T512 PolarHBondContact O-N 2.78Å; P510-T512 PolarHBondContact O-OG1 2.75Å
511	F	87.7	Confident	89.3	Confident	70 Å²	70	75.6 Å²	75.6	31%	0.307	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-58.1	127.3	170.3	169.1	-112	0	0	0	109.4	Y461 E463 V513 M517	Y461-F511 WeakPolarHBondContact O-CA 3.45Å; Y461-F511 WeakPolarHBondContact O-CB 3.32Å; E463-F511 HydrophobicContact CB-CD1 4.5Å; E463-F511 HydrophobicContact CB-CE1 4.21Å; E463-F511 HydrophobicContact CB-CE2 4.27Å; E463-F511 HydrophobicContact CB-CZ 4.1Å; E463-F511 HydrophobicContact CG-CE1 4.34Å; F511-V513 HydrophobicContact CE1-CG2 3.59Å; F511-V513 HydrophobicContact CZ-CG2 3.91Å; F511-M517 HydrophobicContact CE2-CE 3.82Å; F511-M517 HydrophobicContact CE2-SD 3.93Å; F511-M517 HydrophobicContact CZ-CE 3.48Å; F511-M517 VanDerWaalsContact CZ-CE 3.48Å; F511-M517 HydrophobicContact CZ-SD 3.94Å
512	T	88	Confident	89.3	Confident	101 Å²	101	73.3 Å²	73.3	62%	0.62	42%	0.422	S	S	*	.			trans	-118.5	122.4	178.9	-54.1	0	0	0	0	108.7	P510 T514	P510-T512 PolarHBondContact O-N 2.78Å; P510-T512 PolarHBondContact O-OG1 2.75Å; T512-T514 PolarHBondContact O-N 2.79Å
513	V	87.1	Confident	89.3	Confident	56 Å²	56	72.8 Å²	72.8	34%	0.339	41%	0.41	S	S	.	.			trans	-68.3	122.4	173.9	177.6	0	0	0	0	108.8	F511 M517 L518 L628	F511-V513 HydrophobicContact CE1-CG2 3.59Å; F511-V513 HydrophobicContact CZ-CG2 3.91Å; V513-M517 HydrophobicContact CG1-CB 4.44Å; V513-L518 HydrophobicContact CG1-CD1 4.35Å; V513-L518 HydrophobicContact CG1-CD2 3.7Å; V513-L518 HydrophobicContact CG1-CG 3.72Å; V513-L628 HydrophobicContact CG1-CB 4.02Å; V513-L628 HydrophobicContact CG1-CD2 4.28Å; V513-L628 HydrophobicContact CG2-CB 4.17Å; V513-L628 HydrophobicContact CG2-CD2 4.06Å
514	T	88.4	Confident	89.4	Confident	49 Å²	49	73 Å²	73	30%	0.301	41%	0.408	S	S	.	.			trans	-90.2	156.1	176.9	69.6	0	0	0	0	111.2	T512 E516 M517 L518	T512-T514 PolarHBondContact O-N 2.79Å; T514-E516 PolarHBondContact O-N 2.92Å; T514-M517 WeakPolarHBondContact O-CB 3.43Å; T514-M517 PolarHBondContact O-N 2.92Å; T514-M517 WeakPolarHBondContact OG1-CG 3.39Å; T514-M517 PolarHBondContact OG1-N 3.33Å; T514-L518 PolarHBondContact O-N 2.99Å
515	P	88.6	Confident	89.5	Confident	105 Å²	105	70.2 Å²	70.2	68%	0.682	39%	0.394	S	S	*	.	H	α-helix	trans	-55.8	-32.2	172.9	-26.4	35.3	0	0	0	113.3	L518 E519	P515-L518 PolarHBondContact O-N 3.08Å; P515-E519 WeakPolarHBondContact O-CB 3.33Å; P515-E519 PolarHBondContact O-N 2.93Å
516	E	87.1	Confident	89.7	Confident	156 Å²	156	70.2 Å²	70.2	73%	0.729	39%	0.394	S	S	*	.	H	α-helix	trans	-65.6	-39.2	176.8	-64.1	154.2	-177.7	0	0	111.7	T514 E519 A520	T514-E516 PolarHBondContact O-N 2.92Å; E516-E519 PolarHBondContact O-N 3.21Å; E516-A520 VanDerWaalsContact O-CB 3.28Å; E516-A520 WeakPolarHBondContact O-CB 3.49Å; E516-A520 PolarHBondContact O-N 2.66Å
517	M	86	Confident	90	Very high	56 Å²	56	73.5 Å²	73.5	28%	0.276	40%	0.399	S	S	.	.	H	α-helix	trans	-67.1	-40.7	175.3	-68.2	178.2	71.4	0	0	111.8	F511 V513 T514 A521 L628	F511-M517 HydrophobicContact CE2-CE 3.82Å; F511-M517 HydrophobicContact CE2-SD 3.93Å; F511-M517 HydrophobicContact CZ-CE 3.48Å; F511-M517 VanDerWaalsContact CZ-CE 3.48Å; F511-M517 HydrophobicContact CZ-SD 3.94Å; V513-M517 HydrophobicContact CG1-CB 4.44Å; T514-M517 WeakPolarHBondContact O-CB 3.43Å; T514-M517 PolarHBondContact O-N 2.92Å; T514-M517 WeakPolarHBondContact OG1-CG 3.39Å; T514-M517 PolarHBondContact OG1-N 3.33Å; M517-A521 WeakPolarHBondContact O-CB 3.3Å; M517-A521 PolarHBondContact O-N 2.96Å; M517-L628 HydrophobicContact CE-CD2 3.91Å
518	L	89.3	Confident	90.3	Very high	34 Å²	34	68.3 Å²	68.3	18%	0.178	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-47	175.2	-66.2	173.3	0	0	0	110.8	V513 T514 P515 A521 R522 L628 I631	V513-L518 HydrophobicContact CG1-CD1 4.35Å; V513-L518 HydrophobicContact CG1-CD2 3.7Å; V513-L518 HydrophobicContact CG1-CG 3.72Å; T514-L518 PolarHBondContact O-N 2.99Å; P515-L518 PolarHBondContact O-N 3.08Å; L518-A521 PolarHBondContact O-N 3.49Å; L518-R522 WeakPolarHBondContact O-CG 3.04Å; L518-R522 PolarHBondContact O-N 2.76Å; L518-L628 HydrophobicContact CD2-CB 4.01Å; L518-L628 HydrophobicContact CD2-CD1 4.49Å; L518-I631 HydrophobicContact CB-CD1 4.31Å; L518-I631 HydrophobicContact CD2-CD1 3.67Å
519	E	89.7	Confident	90.4	Very high	93 Å²	93	67 Å²	67	44%	0.435	37%	0.368	S	S	.	.	H	α-helix	trans	-67.8	-40.4	-178.6	-169	57	-151.8	0	0	112.1	P515 E516 A521 R522 E523 R526	P515-E519 WeakPolarHBondContact O-CB 3.33Å; P515-E519 PolarHBondContact O-N 2.93Å; E516-E519 PolarHBondContact O-N 3.21Å; E519-A521 VanDerWaalsContact C-N 3.3Å; E519-A521 PolarHBondContact O-N 3.19Å; E519-R522 PolarHBondContact O-N 3.29Å; E519-E523 WeakPolarHBondContact O-CB 3.45Å; E519-E523 PolarHBondContact O-N 3.27Å; E519-R526 IonicContact OE1-CZ 3.98Å; E519-R526 IonicContact OE1-NH1 3.96Å; E519-R526 PolarHBondContact OE1-NH1 3.42Å; E519-R526 IonicContact OE1-NH2 2.84Å; E519-R526 PolarHBondContact OE1-NH2 3.42Å
520	A	87.8	Confident	90.5	Very high	64 Å²	64	68.9 Å²	68.9	53%	0.529	37%	0.368	S	S	.	.	H	α-helix	trans	-61.5	-39.4	174.1	0	0	0	0	0	111.9	E516 E523 A524	E516-A520 VanDerWaalsContact O-CB 3.28Å; E516-A520 WeakPolarHBondContact O-CB 3.49Å; E516-A520 PolarHBondContact O-N 2.66Å; A520-E523 PolarHBondContact O-N 3.38Å; A520-A524 PolarHBondContact O-N 2.72Å
521	A	89.9	Confident	90.8	Very high	12 Å²	12	66.6 Å²	66.6	10%	0.099	36%	0.357	C	S	.	.	H	α-helix	trans	-67.9	-40.9	176.1	0	0	0	0	0	112.2	M517 L518 E519 A524 R525 L628 I631 R632	M517-A521 WeakPolarHBondContact O-CB 3.3Å; M517-A521 PolarHBondContact O-N 2.96Å; L518-A521 PolarHBondContact O-N 3.49Å; E519-A521 VanDerWaalsContact C-N 3.3Å; E519-A521 PolarHBondContact O-N 3.19Å; A521-A524 PolarHBondContact O-N 2.88Å; A521-R525 PolarHBondContact O-N 3.09Å; A521-L628 HydrophobicContact CB-CD1 3.67Å; A521-I631 HydrophobicContact CB-CB 4.44Å; A521-I631 HydrophobicContact CB-CG2 3.59Å; A521-R632 HydrophobicContact CB-CG 4.35Å
522	R	91	Very high	91.2	Very high	38 Å²	38	64.4 Å²	64.4	14%	0.143	35%	0.347	C	S	.	.	H	α-helix	trans	-63.9	-42.3	173.8	-70	-179.2	-156.6	-103.8	12.6	111.6	L518 E519 A524 R525 R526 L622 S623 L625 I631	L518-R522 WeakPolarHBondContact O-CG 3.04Å; L518-R522 PolarHBondContact O-N 2.76Å; E519-R522 PolarHBondContact O-N 3.29Å; R522-A524 VanDerWaalsContact C-N 3.33Å; R522-A524 PolarHBondContact O-N 3.48Å; R522-R525 PolarHBondContact O-N 3.34Å; R522-R526 WeakPolarHBondContact O-CG 3.24Å; R522-R526 PolarHBondContact O-N 2.99Å; R522-L622 PolarHBondContact NH1-O 3.18Å; R522-S623 VanDerWaalsContact NH1-CA 3.34Å; R522-S623 PolarHBondContact NH1-O 2.64Å; R522-L625 PolarHBondContact NH1-O 2.77Å; R522-L625 PolarHBondContact NH2-O 2.89Å; R522-I631 HydrophobicContact CG-CD1 4.02Å; R522-I631 HydrophobicContact CG-CG1 4.35Å; R522-I631 HydrophobicContact CG-CG2 3.99Å
523	E	92.5	Very high	91.5	Very high	73 Å²	73	63.1 Å²	63.1	34%	0.341	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-43.3	179	-178.5	55.2	-157.1	0	0	111.5	E519 A520 R525 R526 Q527	E519-E523 WeakPolarHBondContact O-CB 3.45Å; E519-E523 PolarHBondContact O-N 3.27Å; A520-E523 PolarHBondContact O-N 3.38Å; E523-R525 VanDerWaalsContact C-N 3.33Å; E523-R525 PolarHBondContact O-N 3.19Å; E523-R526 PolarHBondContact O-N 2.97Å; E523-R526 IonicContact OE2-CZ 3.99Å; E523-R526 VanDerWaalsContact OE2-CZ 3.25Å; E523-R526 IonicContact OE2-NE 3.31Å; E523-R526 PolarHBondContact OE2-NE 3.22Å; E523-R526 IonicContact OE2-NH2 4Å; E523-R526 PolarHBondContact OE2-NH2 3.35Å; E523-Q527 WeakPolarHBondContact O-CG 3.41Å; E523-Q527 PolarHBondContact O-N 3.01Å; E523-Q527 PolarHBondContact OE1-NE2 2.78Å
524	A	92	Very high	91.8	Very high	46 Å²	46	65 Å²	65	38%	0.38	34%	0.342	S	S	.	.	H	α-helix	trans	-57.2	-45.6	173.8	0	0	0	0	0	111.9	A520 A521 R522 Q527 E528	A520-A524 PolarHBondContact O-N 2.72Å; A521-A524 PolarHBondContact O-N 2.88Å; R522-A524 VanDerWaalsContact C-N 3.33Å; R522-A524 PolarHBondContact O-N 3.48Å; A524-Q527 PolarHBondContact O-N 2.9Å; A524-E528 PolarHBondContact O-N 2.82Å
525	R	93.7	Very high	92.1	Very high	56 Å²	56	68.4 Å²	68.4	21%	0.211	36%	0.355	C	S	.	.	H	α-helix	trans	-68.8	-34.3	177.3	-68	-67.5	173.5	-141.3	-12.8	113.3	A521 R522 E523 Q527 E528 I529 L622 I631 R632	A521-R525 PolarHBondContact O-N 3.09Å; R522-R525 PolarHBondContact O-N 3.34Å; E523-R525 VanDerWaalsContact C-N 3.33Å; E523-R525 PolarHBondContact O-N 3.19Å; R525-Q527 VanDerWaalsContact C-N 3.3Å; R525-Q527 PolarHBondContact O-N 2.86Å; R525-E528 IonicContact CZ-OE1 2.73Å; R525-E528 IonicContact CZ-OE2 3.91Å; R525-E528 IonicContact NH1-OE1 2.8Å; R525-E528 PolarHBondContact NH1-OE1 3.32Å; R525-E528 IonicContact NH1-OE2 3.08Å; R525-E528 PolarHBondContact NH1-OE2 3.45Å; R525-E528 PolarHBondContact O-N 3.13Å; R525-I529 WeakPolarHBondContact O-CG1 3.49Å; R525-I529 PolarHBondContact O-N 2.74Å; R525-L622 HydrophobicContact CB-CD1 3.77Å; R525-L622 HydrophobicContact CB-CD2 3.56Å; R525-L622 HydrophobicContact CB-CG 4.33Å; R525-L622 HydrophobicContact CG-CD1 4.17Å; R525-I631 WeakPolarHBondContact CG-O 3.49Å; R525-I631 PolarHBondContact NE-O 3Å; R525-R632 PolarHBondContact NE-O 3.18Å; R525-R632 PolarHBondContact NH2-O 2.86Å
526	R	94.4	Very high	92.4	Very high	65 Å²	65	65.1 Å²	65.1	25%	0.245	33%	0.331	C	S	.	.	H	α-helix	trans	-61.9	-39.4	173.4	-76.1	-171.9	-64.9	-111.7	4.1	111.9	E519 R522 E523 I529 E530 L622	E519-R526 IonicContact OE1-CZ 3.98Å; E519-R526 IonicContact OE1-NH1 3.96Å; E519-R526 PolarHBondContact OE1-NH1 3.42Å; E519-R526 IonicContact OE1-NH2 2.84Å; E519-R526 PolarHBondContact OE1-NH2 3.42Å; R522-R526 WeakPolarHBondContact O-CG 3.24Å; R522-R526 PolarHBondContact O-N 2.99Å; E523-R526 PolarHBondContact O-N 2.97Å; E523-R526 IonicContact OE2-CZ 3.99Å; E523-R526 VanDerWaalsContact OE2-CZ 3.25Å; E523-R526 IonicContact OE2-NE 3.31Å; E523-R526 PolarHBondContact OE2-NE 3.22Å; E523-R526 IonicContact OE2-NH2 4Å; E523-R526 PolarHBondContact OE2-NH2 3.35Å; R526-I529 PolarHBondContact O-N 2.81Å; R526-E530 WeakPolarHBondContact O-CG 3.45Å; R526-E530 PolarHBondContact O-N 2.63Å; R526-L622 HydrophobicContact CG-CD2 3.74Å
527	Q	94.4	Very high	92.7	Very high	109 Å²	109	60 Å²	60	51%	0.509	31%	0.307	S	S	.	.	H	α-helix	trans	-65.5	-40.1	176.1	-70	174.1	11.4	0	0	111.7	E523 A524 R525 E530 A531	E523-Q527 WeakPolarHBondContact O-CG 3.41Å; E523-Q527 PolarHBondContact O-N 3.01Å; E523-Q527 PolarHBondContact OE1-NE2 2.78Å; A524-Q527 PolarHBondContact O-N 2.9Å; R525-Q527 VanDerWaalsContact C-N 3.3Å; R525-Q527 PolarHBondContact O-N 2.86Å; Q527-E530 PolarHBondContact O-N 2.94Å; Q527-A531 PolarHBondContact O-N 3.34Å
528	E	95	Very high	93	Very high	79 Å²	79	60.5 Å²	60.5	37%	0.369	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-41.2	173.8	-68.8	176	-165.5	0	0	112.4	A524 R525 E530 A531 W532 V636	A524-E528 PolarHBondContact O-N 2.82Å; R525-E528 IonicContact CZ-OE1 2.73Å; R525-E528 IonicContact CZ-OE2 3.91Å; R525-E528 IonicContact NH1-OE1 2.8Å; R525-E528 PolarHBondContact NH1-OE1 3.32Å; R525-E528 IonicContact NH1-OE2 3.08Å; R525-E528 PolarHBondContact NH1-OE2 3.45Å; R525-E528 PolarHBondContact O-N 3.13Å; E528-E530 VanDerWaalsContact C-N 3.26Å; E528-E530 PolarHBondContact O-N 2.85Å; E528-A531 PolarHBondContact O-N 3.03Å; E528-W532 WeakPolarHBondContact O-CB 3.41Å; E528-W532 PolarHBondContact O-N 2.87Å; E528-V636 HydrophobicContact CB-CG2 4.25Å
529	I	95.1	Very high	93.2	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.4	-35.2	174.3	-69.8	163.7	0	0	0	111.7	R525 R526 R533 Q615 M618 K619 L622 F634 V636	R525-I529 WeakPolarHBondContact O-CG1 3.49Å; R525-I529 PolarHBondContact O-N 2.74Å; R526-I529 PolarHBondContact O-N 2.81Å; I529-R533 PolarHBondContact O-N 2.8Å; I529-R533 VanDerWaalsContact O-N 3.13Å; I529-Q615 HydrophobicContact CG2-CG 3.5Å; I529-M618 HydrophobicContact CD1-CB 3.92Å; I529-M618 HydrophobicContact CG1-CB 4.23Å; I529-M618 HydrophobicContact CG1-CE 4.4Å; I529-M618 HydrophobicContact CG1-SD 4.43Å; I529-M618 HydrophobicContact CG2-CE 4Å; I529-K619 HydrophobicContact CD1-CG 4.14Å; I529-K619 HydrophobicContact CG2-CG 4.06Å; I529-L622 HydrophobicContact CD1-CD2 3.92Å; I529-F634 HydrophobicContact CD1-CE1 3.96Å; I529-F634 HydrophobicContact CG1-CE1 4.47Å; I529-V636 HydrophobicContact CG1-CG1 3.98Å; I529-V636 HydrophobicContact CG1-CG2 4.15Å
530	E	93.6	Very high	93.3	Very high	87 Å²	87	63.6 Å²	63.6	41%	0.407	34%	0.341	S	S	.	.	H	α-helix	trans	-72.4	-40.4	176.3	-76.4	164.6	-170.4	0	0	112.5	R526 Q527 E528 R533 T534 K619	R526-E530 WeakPolarHBondContact O-CG 3.45Å; R526-E530 PolarHBondContact O-N 2.63Å; Q527-E530 PolarHBondContact O-N 2.94Å; E528-E530 VanDerWaalsContact C-N 3.26Å; E528-E530 PolarHBondContact O-N 2.85Å; E530-R533 PolarHBondContact O-N 2.94Å; E530-T534 PolarHBondContact O-N 2.8Å; E530-T534 PolarHBondContact O-OG1 2.82Å; E530-K619 IonicContact OE1-NZ 3Å; E530-K619 PolarHBondContact OE1-NZ 3.4Å
531	A	95.2	Very high	93.7	Very high	49 Å²	49	61.8 Å²	61.8	41%	0.405	32%	0.321	S	S	.	.	H	α-helix	trans	-62.3	-47.2	171.4	0	0	0	0	0	111.4	Q527 E528 R533 T534 E535	Q527-A531 PolarHBondContact O-N 3.34Å; E528-A531 PolarHBondContact O-N 3.03Å; A531-R533 VanDerWaalsContact C-N 3.32Å; A531-R533 PolarHBondContact O-N 2.79Å; A531-T534 WeakPolarHBondContact O-CB 3.46Å; A531-T534 PolarHBondContact O-N 2.91Å; A531-T534 VanDerWaalsContact O-N 3.1Å; A531-E535 PolarHBondContact O-N 2.79Å
532	W	96.4	Very high	94	Very high	25 Å²	25	64.9 Å²	64.9	10%	0.095	34%	0.339	C	S	.	.	H	α-helix	trans	-53	-48.4	175.7	169.9	98.4	0	0	0	111.3	E528 T534 E535 Q536 I611 R614 Q615 M618 V636 E637	E528-W532 WeakPolarHBondContact O-CB 3.41Å; E528-W532 PolarHBondContact O-N 2.87Å; W532-T534 VanDerWaalsContact C-N 3.32Å; W532-T534 PolarHBondContact O-N 2.91Å; W532-E535 PolarHBondContact O-N 3.19Å; W532-Q536 HydrophobicContact CD2-CG 3.8Å; W532-Q536 VanDerWaalsContact CE2-CG 3.48Å; W532-Q536 HydrophobicContact CE3-CG 4.35Å; W532-Q536 HydrophobicContact CG-CG 4.23Å; W532-Q536 HydrophobicContact CH2-CG 4.25Å; W532-Q536 HydrophobicContact CZ2-CG 3.74Å; W532-Q536 VanDerWaalsContact O-CG 3.3Å; W532-Q536 WeakPolarHBondContact O-CG 3.37Å; W532-Q536 PolarHBondContact O-N 2.77Å; W532-I611 HydrophobicContact CH2-CG2 4.01Å; W532-I611 HydrophobicContact CZ3-CG2 3.74Å; W532-R614 HydrophobicContact CH2-CB 3.85Å; W532-R614 HydrophobicContact CH2-CG 3.55Å; W532-R614 HydrophobicContact CZ2-CG 3.98Å; W532-R614 HydrophobicContact CZ3-CG 4.42Å; W532-Q615 HydrophobicContact CZ3-CB 4.3Å; W532-M618 HydrophobicContact CD2-CE 3.72Å; W532-M618 HydrophobicContact CE3-CE 3.39Å; W532-M618 HydrophobicContact CG-CE 4.49Å; W532-M618 HydrophobicContact CH2-CE 3.86Å; W532-M618 HydrophobicContact CZ2-CE 4.08Å; W532-M618 HydrophobicContact CZ3-CE 3.49Å; W532-M618 VanDerWaalsContact CZ3-CE 3.49Å; W532-V636 HydrophobicContact CB-CG1 3.71Å; W532-V636 HydrophobicContact CG-CG1 3.97Å; W532-E637 VanDerWaalsContact CE2-OXT 3.3Å; W532-E637 VanDerWaalsContact CZ2-OXT 3.32Å; W532-E637 WeakPolarHBondContact CZ2-OXT 3.27Å; W532-E637 PolarHBondContact NE1-OXT 3.02Å
533	R	95.1	Very high	94.3	Very high	74 Å²	74	64.4 Å²	64.4	28%	0.279	34%	0.338	S	S	.	.	H	α-helix	trans	-57.9	-47	178.6	169.9	173.2	176.9	-167	-3.7	111.5	I529 E530 A531 E535 Q536 E537 I611 Q615	I529-R533 PolarHBondContact O-N 2.8Å; I529-R533 VanDerWaalsContact O-N 3.13Å; E530-R533 PolarHBondContact O-N 2.94Å; A531-R533 VanDerWaalsContact C-N 3.32Å; A531-R533 PolarHBondContact O-N 2.79Å; R533-E535 VanDerWaalsContact C-N 3.28Å; R533-E535 PolarHBondContact O-N 2.91Å; R533-Q536 PolarHBondContact O-N 3.09Å; R533-E537 HydrophobicContact CG-CG 4.27Å; R533-E537 IonicContact CZ-OE1 3.95Å; R533-E537 VanDerWaalsContact CZ-OE1 3.31Å; R533-E537 IonicContact NE-OE1 2.79Å; R533-E537 PolarHBondContact NE-OE1 2.74Å; R533-E537 IonicContact NE-OE2 3.83Å; R533-E537 IonicContact NH2-OE1 3.61Å; R533-E537 PolarHBondContact NH2-OE1 3.41Å; R533-E537 WeakPolarHBondContact O-CG 3.47Å; R533-E537 PolarHBondContact O-N 2.93Å; R533-I611 HydrophobicContact CB-CG2 4.35Å; R533-I611 HydrophobicContact CG-CG2 3.93Å; R533-Q615 VanDerWaalsContact CD-NE2 3.3Å; R533-Q615 VanDerWaalsContact NH1-OE1 3.16Å
534	T	93.8	Very high	94.4	Very high	94 Å²	94	68 Å²	68	58%	0.577	36%	0.355	S	S	*	.	H	α-helix	trans	-59.5	-42.4	-180	-54.5	0	0	0	0	110.9	E530 A531 W532 A538	E530-T534 PolarHBondContact O-N 2.8Å; E530-T534 PolarHBondContact O-OG1 2.82Å; A531-T534 WeakPolarHBondContact O-CB 3.46Å; A531-T534 PolarHBondContact O-N 2.91Å; A531-T534 VanDerWaalsContact O-N 3.1Å; W532-T534 VanDerWaalsContact C-N 3.32Å; W532-T534 PolarHBondContact O-N 2.91Å; T534-A538 WeakPolarHBondContact O-CB 3.41Å; T534-A538 PolarHBondContact O-N 2.88Å
535	E	93.9	Very high	94.7	Very high	122 Å²	122	67.8 Å²	67.8	57%	0.57	34%	0.344	S	S	*	.	H	α-helix	trans	-67.3	-42.2	175.8	-70.5	-177.1	-174.7	0	0	112.7	A531 W532 R533 A538 K539	A531-E535 PolarHBondContact O-N 2.79Å; W532-E535 PolarHBondContact O-N 3.19Å; R533-E535 VanDerWaalsContact C-N 3.28Å; R533-E535 PolarHBondContact O-N 2.91Å; E535-A538 PolarHBondContact O-N 3.5Å; E535-K539 WeakPolarHBondContact O-CG 3.32Å; E535-K539 PolarHBondContact O-N 3.4Å
536	Q	94.6	Very high	94.7	Very high	35 Å²	35	70.5 Å²	70.5	16%	0.164	36%	0.363	C	S	.	.	H	α-helix	trans	-67.3	-40.1	179.9	-63.9	-58.3	-19.4	0	0	112.6	W532 R533 A538 K539 I611	W532-Q536 HydrophobicContact CD2-CG 3.8Å; W532-Q536 VanDerWaalsContact CE2-CG 3.48Å; W532-Q536 HydrophobicContact CE3-CG 4.35Å; W532-Q536 HydrophobicContact CG-CG 4.23Å; W532-Q536 HydrophobicContact CH2-CG 4.25Å; W532-Q536 HydrophobicContact CZ2-CG 3.74Å; W532-Q536 VanDerWaalsContact O-CG 3.3Å; W532-Q536 WeakPolarHBondContact O-CG 3.37Å; W532-Q536 PolarHBondContact O-N 2.77Å; R533-Q536 PolarHBondContact O-N 3.09Å; Q536-A538 VanDerWaalsContact C-N 3.26Å; Q536-A538 PolarHBondContact O-N 3.11Å; Q536-K539 PolarHBondContact O-N 3.19Å; Q536-I611 HydrophobicContact CB-CD1 3.74Å; Q536-I611 HydrophobicContact CB-CG1 4.05Å; Q536-I611 HydrophobicContact CB-CG2 4.08Å
537	E	93.2	Very high	94.6	Very high	49 Å²	49	70.4 Å²	70.4	23%	0.229	38%	0.383	C	S	.	.	H	α-helix	trans	-67.7	-27.3	177.1	-71.8	-178.8	174.3	0	0	112	R533 I611	R533-E537 HydrophobicContact CG-CG 4.27Å; R533-E537 IonicContact CZ-OE1 3.95Å; R533-E537 VanDerWaalsContact CZ-OE1 3.31Å; R533-E537 IonicContact NE-OE1 2.79Å; R533-E537 PolarHBondContact NE-OE1 2.74Å; R533-E537 IonicContact NE-OE2 3.83Å; R533-E537 IonicContact NH2-OE1 3.61Å; R533-E537 PolarHBondContact NH2-OE1 3.41Å; R533-E537 WeakPolarHBondContact O-CG 3.47Å; R533-E537 PolarHBondContact O-N 2.93Å; E537-I611 HydrophobicContact CG-CD1 4.08Å; E537-I611 HydrophobicContact CG-CG2 4.23Å
538	A	92.5	Very high	94.6	Very high	67 Å²	67	69.8 Å²	69.8	55%	0.554	38%	0.376	S	S	*	.	H	α-helix	trans	-81.8	-19.1	176.5	0	0	0	0	0	113.9	T534 E535 Q536	T534-A538 WeakPolarHBondContact O-CB 3.41Å; T534-A538 PolarHBondContact O-N 2.88Å; E535-A538 PolarHBondContact O-N 3.5Å; Q536-A538 VanDerWaalsContact C-N 3.26Å; Q536-A538 PolarHBondContact O-N 3.11Å
539	K	92.9	Very high	94.7	Very high	86 Å²	86	70.1 Å²	70.1	37%	0.374	38%	0.379	S	S	.	.	S	Bend	trans	-68	135.2	-176.7	-81.3	169.7	-166.4	173.2	0	111.5	E535 Q536	E535-K539 WeakPolarHBondContact O-CG 3.32Å; E535-K539 PolarHBondContact O-N 3.4Å; Q536-K539 PolarHBondContact O-N 3.19Å
540	P	93.1	Very high	94.7	Very high	105 Å²	105	70.2 Å²	70.2	68%	0.682	38%	0.38	S	S	*	.			trans	-67	151.8	170.3	30.7	-34.6	0	0	0	110
541	F	95.3	Very high	94.7	Very high	26 Å²	26	68.9 Å²	68.9	11%	0.114	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	175.9	175.8	71	-76.9	0	0	0	109.9	A552 A603 R607	F541-A552 HydrophobicContact CD1-CB 4.02Å; F541-A552 HydrophobicContact CD2-CB 4.1Å; F541-A552 HydrophobicContact CE1-CB 3.56Å; F541-A552 HydrophobicContact CE2-CB 3.65Å; F541-A552 HydrophobicContact CG-CB 4.27Å; F541-A552 HydrophobicContact CZ-CB 3.35Å; F541-A552 PolarHBondContact N-O 2.76Å; F541-A552 PolarHBondContact O-N 3.25Å; F541-A603 HydrophobicContact CE2-CB 4.09Å; F541-A603 HydrophobicContact CZ-CB 4.22Å; F541-R607 VanDerWaalsContact CD1-CD 3.47Å; F541-R607 HydrophobicContact CE2-CB 4.48Å; F541-R607 VanDerWaalsContact CG-CD 3.49Å; F541-R607 HydrophobicContact CZ-CB 4.3Å
542	T	96.3	Very high	94.7	Very high	78 Å²	78	66.6 Å²	66.6	48%	0.479	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	153.4	176.8	57	0	0	0	0	111.4	I549 W550 A581	T542-I549 HydrophobicContact CG2-CG2 4Å; T542-W550 WeakPolarHBondContact CA-O 3.23Å; T542-W550 WeakPolarHBondContact CB-O 3.29Å; T542-A581 HydrophobicContact CG2-CB 3.87Å
543	F	96.5	Very high	94.4	Very high	27 Å²	27	65.4 Å²	65.4	12%	0.118	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.2	174.4	77.2	-70.1	0	0	0	110.2	W545 I549 W550 A552 L596 A599 M600 A603	F543-W545 HydrophobicContact CD2-CB 4.29Å; F543-W545 HydrophobicContact CE2-CB 3.71Å; F543-W545 HydrophobicContact CZ-CB 4.39Å; F543-I549 WeakPolarHBondContact O-CA 3.33Å; F543-W550 HydrophobicContact CD1-CB 4.11Å; F543-W550 HydrophobicContact CE1-CB 3.64Å; F543-W550 HydrophobicContact CZ-CB 4.14Å; F543-W550 PolarHBondContact N-O 2.74Å; F543-W550 PolarHBondContact O-N 3.38Å; F543-A552 HydrophobicContact CD1-CB 3.6Å; F543-A552 HydrophobicContact CE1-CB 3.94Å; F543-L596 HydrophobicContact CZ-CD1 3.87Å; F543-A599 HydrophobicContact CE2-CB 3.81Å; F543-A599 HydrophobicContact CZ-CB 4.43Å; F543-M600 HydrophobicContact CE1-CB 3.88Å; F543-M600 HydrophobicContact CE1-CE 4.2Å; F543-M600 HydrophobicContact CE1-CG 3.91Å; F543-M600 HydrophobicContact CZ-CB 3.69Å; F543-M600 HydrophobicContact CZ-CG 4.26Å; F543-A603 HydrophobicContact CB-CB 3.96Å; F543-A603 HydrophobicContact CD1-CB 4.39Å; F543-A603 HydrophobicContact CD2-CB 3.95Å; F543-A603 HydrophobicContact CG-CB 3.84Å
544	E	96.6	Very high	94.3	Very high	150 Å²	150	64.9 Å²	64.9	70%	0.701	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.3	178.3	-168.7	-179.3	158	0	0	110.7	R548	E544-R548 CarbonylContact C-O 3.56Å; E544-R548 WeakPolarHBondContact CA-O 3.45Å
545	W	96.6	Very high	94.1	Very high	40 Å²	40	66.8 Å²	66.8	15%	0.152	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	131.9	170.3	176.5	85.5	0	0	0	109.8	F543 G547 R548 W550 L588 E592 E595 L596 A599	F543-W545 HydrophobicContact CD2-CB 4.29Å; F543-W545 HydrophobicContact CE2-CB 3.71Å; F543-W545 HydrophobicContact CZ-CB 4.39Å; W545-G547 VanDerWaalsContact C-N 3.29Å; W545-G547 PolarHBondContact O-N 3.29Å; W545-R548 PolarHBondContact N-O 3.35Å; W545-R548 PolarHBondContact O-N 2.85Å; W545-R548 VanDerWaalsContact O-N 3.13Å; W545-R548 VanDerWaalsContact O-O 3.13Å; W545-W550 AromaticContact CE3-CE2 3.88Å; W545-W550 AromaticContact CE3-CZ2 3.94Å; W545-W550 HydrophobicContact CE3-CZ2 3.94Å; W545-W550 AromaticContact CE3-NE1 3.6Å; W545-W550 HydrophobicContact CZ3-CZ2 4.03Å; W545-W550 PolarHBondContact O-NE1 2.98Å; W545-L588 HydrophobicContact CH2-CD2 4.4Å; W545-L588 HydrophobicContact CZ3-CD2 4.07Å; W545-E592 HydrophobicContact CH2-CB 4.1Å; W545-E592 WeakPolarHBondContact CH2-O 3.3Å; W545-E595 HydrophobicContact CZ2-CB 3.75Å; W545-L596 HydrophobicContact CB-CD1 4.43Å; W545-L596 HydrophobicContact CD2-CB 4.42Å; W545-L596 HydrophobicContact CD2-CD1 4.04Å; W545-L596 HydrophobicContact CE3-CB 4.17Å; W545-L596 HydrophobicContact CE3-CD1 3.7Å; W545-L596 HydrophobicContact CE3-CG 4.45Å; W545-L596 HydrophobicContact CG-CD1 4.36Å; W545-L596 HydrophobicContact CH2-CB 4.2Å; W545-L596 HydrophobicContact CZ2-CB 4.46Å; W545-L596 HydrophobicContact CZ3-CB 4.05Å; W545-L596 HydrophobicContact CZ3-CD1 4.31Å; W545-A599 HydrophobicContact CG-CB 4.13Å
546	N	93.7	Very high	94	Very high	113 Å²	113	61.6 Å²	61.6	60%	0.604	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	43.2	-179.8	-159.5	16	0	0	0	113.4	R548	N546-R548 PolarHBondContact O-N 3.04Å
547	G	92.4	Very high	93.8	Very high	64 Å²	64	61.2 Å²	61.2	66%	0.66	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	13.2	178.9	0	0	0	0	0	115.1	W545	W545-G547 VanDerWaalsContact C-N 3.29Å; W545-G547 PolarHBondContact O-N 3.29Å
548	R	94.6	Very high	93.8	Very high	96 Å²	96	61.2 Å²	61.2	36%	0.362	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	155	175.8	-71.4	-172.2	174.6	-95.5	-6.7	111.3	E544 W545 N546 W550 D580 Q584	E544-R548 CarbonylContact C-O 3.56Å; E544-R548 WeakPolarHBondContact CA-O 3.45Å; W545-R548 PolarHBondContact N-O 3.35Å; W545-R548 PolarHBondContact O-N 2.85Å; W545-R548 VanDerWaalsContact O-N 3.13Å; W545-R548 VanDerWaalsContact O-O 3.13Å; N546-R548 PolarHBondContact O-N 3.04Å; R548-W550 HydrophobicContact CB-CZ2 4.21Å; R548-W550 VanDerWaalsContact O-CD1 3.27Å; R548-W550 PolarHBondContact O-NE1 3.01Å; R548-D580 IonicContact CZ-OD2 3.59Å; R548-D580 IonicContact NH1-OD2 2.7Å; R548-D580 PolarHBondContact NH1-OD2 2.73Å; R548-Q584 VanDerWaalsContact NH1-OE1 3.15Å
549	I	96.9	Very high	93.7	Very high	86 Å²	86	66 Å²	66	44%	0.441	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.2	177.7	-58.3	178.4	0	0	0	108.6	T542 F543 D580 A581	T542-I549 HydrophobicContact CG2-CG2 4Å; F543-I549 WeakPolarHBondContact O-CA 3.33Å; I549-D580 WeakPolarHBondContact O-CB 3.47Å; I549-A581 HydrophobicContact CB-CB 4.28Å; I549-A581 HydrophobicContact CG2-CB 3.78Å; I549-A581 VanDerWaalsContact O-CB 3.27Å; I549-A581 WeakPolarHBondContact O-CB 3.37Å; I549-A581 PolarHBondContact O-N 3.08Å
550	W	95.7	Very high	93.6	Very high	2 Å²	2	62 Å²	62	1%	0.008	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	147.3	-177.1	-57.2	88	0	0	0	111	T542 F543 W545 R548 W578 D580 V586 L588 L596	T542-W550 WeakPolarHBondContact CA-O 3.23Å; T542-W550 WeakPolarHBondContact CB-O 3.29Å; F543-W550 HydrophobicContact CD1-CB 4.11Å; F543-W550 HydrophobicContact CE1-CB 3.64Å; F543-W550 HydrophobicContact CZ-CB 4.14Å; F543-W550 PolarHBondContact N-O 2.74Å; F543-W550 PolarHBondContact O-N 3.38Å; W545-W550 AromaticContact CE3-CE2 3.88Å; W545-W550 AromaticContact CE3-CZ2 3.94Å; W545-W550 HydrophobicContact CE3-CZ2 3.94Å; W545-W550 AromaticContact CE3-NE1 3.6Å; W545-W550 HydrophobicContact CZ3-CZ2 4.03Å; W545-W550 PolarHBondContact O-NE1 2.98Å; R548-W550 HydrophobicContact CB-CZ2 4.21Å; R548-W550 VanDerWaalsContact O-CD1 3.27Å; R548-W550 PolarHBondContact O-NE1 3.01Å; W550-W578 AromaticContact CE3-CD1 3.82Å; W550-W578 HydrophobicContact CZ3-CB 4.28Å; W550-W578 AromaticContact CZ3-CD1 3.7Å; W550-W578 HydrophobicContact CZ3-CG 4.39Å; W550-D580 HydrophobicContact CD2-CB 4.33Å; W550-D580 HydrophobicContact CE3-CB 3.97Å; W550-D580 HydrophobicContact CZ3-CB 4.07Å; W550-V586 HydrophobicContact CH2-CB 3.71Å; W550-V586 HydrophobicContact CH2-CG1 3.96Å; W550-V586 HydrophobicContact CH2-CG2 3.84Å; W550-V586 HydrophobicContact CZ2-CG1 4.47Å; W550-V586 HydrophobicContact CZ3-CB 4.38Å; W550-V586 HydrophobicContact CZ3-CG2 4.38Å; W550-L588 HydrophobicContact CH2-CD1 3.91Å; W550-L588 HydrophobicContact CH2-CD2 4.34Å; W550-L588 HydrophobicContact CH2-CG 4.45Å; W550-L588 HydrophobicContact CZ3-CD1 4.44Å; W550-L596 HydrophobicContact CB-CD1 4.31Å; W550-L596 HydrophobicContact CD2-CD1 3.73Å; W550-L596 HydrophobicContact CD2-CD2 4.16Å; W550-L596 HydrophobicContact CE3-CD1 4.27Å; W550-L596 HydrophobicContact CE3-CD2 3.87Å; W550-L596 HydrophobicContact CG-CD1 3.74Å; W550-L596 HydrophobicContact CH2-CD2 4.19Å; W550-L596 HydrophobicContact CZ2-CD2 4.49Å; W550-L596 HydrophobicContact CZ3-CD2 3.91Å
551	N	94.5	Very high	93.3	Very high	59 Å²	59	59.7 Å²	59.7	32%	0.316	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	130.9	169.3	-68.4	-48.1	0	0	0	109.8	S556 M600	N551-S556 WeakPolarHBondContact O-CB 3.47Å; N551-S556 PolarHBondContact O-OG 2.86Å; N551-M600 WeakPolarHBondContact O-CE 3.3Å
552	A	93.3	Very high	92.9	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	178.4	171.2	0	0	0	0	0	109.9	F541 F543 S556 M600	F541-A552 HydrophobicContact CD1-CB 4.02Å; F541-A552 HydrophobicContact CD2-CB 4.1Å; F541-A552 HydrophobicContact CE1-CB 3.56Å; F541-A552 HydrophobicContact CE2-CB 3.65Å; F541-A552 HydrophobicContact CG-CB 4.27Å; F541-A552 HydrophobicContact CZ-CB 3.35Å; F541-A552 PolarHBondContact N-O 2.76Å; F541-A552 PolarHBondContact O-N 3.25Å; F543-A552 HydrophobicContact CD1-CB 3.6Å; F543-A552 HydrophobicContact CE1-CB 3.94Å; A552-S556 PolarHBondContact O-OG 2.82Å; A552-M600 HydrophobicContact CB-CG 3.9Å
553	G	92.1	Very high	92.4	Very high	1 Å²	1	60 Å²	60	1%	0.01	33%	0.332	C	S	.	.	S	Bend	trans	118.9	170	-172	0	0	0	0	0	112.2	D555 S556 L557	G553-D555 VanDerWaalsContact C-N 3.27Å; G553-D555 PolarHBondContact O-N 3.27Å; G553-S556 PolarHBondContact O-N 3.12Å; G553-L557 PolarHBondContact O-N 3.24Å
554	P	91	Very high	91.8	Very high	62 Å²	62	59.3 Å²	59.3	40%	0.403	33%	0.33	S	S	.	.	H	α-helix	trans	-54.4	-41.3	178.3	-25.3	33.7	0	0	0	113	G558	P554-G558 PolarHBondContact O-N 2.9Å
555	D	91.1	Very high	91.2	Very high	134 Å²	134	58.4 Å²	58.4	72%	0.717	33%	0.327	S	S	*	.	H	α-helix	trans	-68.7	-42.8	-179.6	-73.7	-7.6	0	0	0	112.5	G553 G558 R559	G553-D555 VanDerWaalsContact C-N 3.27Å; G553-D555 PolarHBondContact O-N 3.27Å; D555-G558 PolarHBondContact O-N 3.3Å; D555-R559 VanDerWaalsContact O-CG 3.27Å; D555-R559 WeakPolarHBondContact O-CG 3.28Å; D555-R559 PolarHBondContact O-N 2.85Å
556	S	91.7	Very high	90.3	Very high	14 Å²	14	61.7 Å²	61.7	10%	0.098	35%	0.348	C	S	.	.	H	α-helix	trans	-64.7	-44.1	178.8	-61.4	0	0	0	0	110.9	N551 A552 G553 R559 L560	N551-S556 WeakPolarHBondContact O-CB 3.47Å; N551-S556 PolarHBondContact O-OG 2.86Å; A552-S556 PolarHBondContact O-OG 2.82Å; G553-S556 PolarHBondContact O-N 3.12Å; S556-R559 PolarHBondContact O-N 3.05Å; S556-L560 WeakPolarHBondContact O-CB 3.49Å; S556-L560 PolarHBondContact O-N 3.13Å
557	L	90.5	Very high	89.4	Confident	26 Å²	26	57.1 Å²	57.1	14%	0.136	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-42.3	173.9	-78.7	169.8	0	0	0	112	G553 R559 L560 S561 M600 V601 Q604	G553-L557 PolarHBondContact O-N 3.24Å; L557-R559 PolarHBondContact O-N 3.47Å; L557-L560 PolarHBondContact O-N 2.82Å; L557-S561 VanDerWaalsContact O-CB 3.3Å; L557-S561 WeakPolarHBondContact O-CB 3.3Å; L557-S561 PolarHBondContact O-N 3.06Å; L557-S561 PolarHBondContact O-OG 3.3Å; L557-M600 HydrophobicContact CB-SD 4.43Å; L557-M600 HydrophobicContact CD2-CB 4.02Å; L557-M600 HydrophobicContact CD2-CG 3.69Å; L557-M600 HydrophobicContact CD2-SD 3.67Å; L557-M600 HydrophobicContact CG-CG 3.88Å; L557-M600 HydrophobicContact CG-SD 3.71Å; L557-V601 HydrophobicContact CD2-CB 4.49Å; L557-V601 HydrophobicContact CD2-CG2 3.51Å; L557-Q604 HydrophobicContact CD1-CB 3.87Å; L557-Q604 HydrophobicContact CD1-CG 3.93Å
558	G	91.9	Very high	88.4	Confident	49 Å²	49	60.2 Å²	60.2	51%	0.505	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-29.4	176.8	0	0	0	0	0	113.2	P554 D555 P562	P554-G558 PolarHBondContact O-N 2.9Å; D555-G558 PolarHBondContact O-N 3.3Å; G558-P562 WeakPolarHBondContact O-CD 3.2Å; G558-P562 WeakPolarHBondContact O-CG 3.43Å
559	R	90.9	Very high	87.2	Confident	169 Å²	169	59.6 Å²	59.6	64%	0.638	33%	0.331	S	S	*	.	H	α-helix	trans	-83.8	-38.9	175.1	-68.2	170.7	63.9	-167.3	-1.4	112.9	D555 S556 L557 V563 W578	D555-R559 VanDerWaalsContact O-CG 3.27Å; D555-R559 WeakPolarHBondContact O-CG 3.28Å; D555-R559 PolarHBondContact O-N 2.85Å; S556-R559 PolarHBondContact O-N 3.05Å; L557-R559 PolarHBondContact O-N 3.47Å; R559-V563 WeakPolarHBondContact O-CG2 3.47Å; R559-W578 HydrophobicContact CB-CH2 3.83Å; R559-W578 HydrophobicContact CB-CZ2 4.27Å
560	L	90.5	Very high	85.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-77.8	-37.5	-176.1	-175.9	59	0	0	0	112.4	S556 L557 V563 V564 W578 L593 L596 A597 M600	S556-L560 WeakPolarHBondContact O-CB 3.49Å; S556-L560 PolarHBondContact O-N 3.13Å; L557-L560 PolarHBondContact O-N 2.82Å; L560-V563 WeakPolarHBondContact O-CB 3.49Å; L560-V563 PolarHBondContact O-N 2.9Å; L560-V563 VanDerWaalsContact O-N 3.09Å; L560-V564 HydrophobicContact CD1-CG2 4.1Å; L560-V564 HydrophobicContact CG-CG2 4.11Å; L560-V564 PolarHBondContact O-N 2.86Å; L560-W578 HydrophobicContact CB-CH2 4.06Å; L560-W578 HydrophobicContact CB-CZ2 3.82Å; L560-W578 HydrophobicContact CD1-CD2 4.05Å; L560-W578 HydrophobicContact CD1-CE3 4.2Å; L560-W578 HydrophobicContact CD1-CH2 4.18Å; L560-W578 HydrophobicContact CD1-CZ2 4.05Å; L560-W578 HydrophobicContact CD1-CZ3 4.27Å; L560-W578 HydrophobicContact CG-CZ2 4.47Å; L560-L593 HydrophobicContact CD1-CD1 3.72Å; L560-L593 HydrophobicContact CD1-CD2 4.49Å; L560-L593 HydrophobicContact CD1-CG 4.03Å; L560-L596 HydrophobicContact CD2-CD2 4.4Å; L560-L596 HydrophobicContact CD2-CG 4.19Å; L560-A597 HydrophobicContact CD2-CB 3.71Å; L560-A597 HydrophobicContact CG-CB 4.08Å; L560-M600 HydrophobicContact CD2-CE 3.67Å; L560-M600 HydrophobicContact CD2-SD 4.22Å
561	S	88.1	Confident	84	Confident	57 Å²	57	65.1 Å²	65.1	40%	0.399	37%	0.369	S	S	.	.	H	α-helix	trans	-58.9	-46.3	-174.6	-56.9	0	0	0	0	113.7	L557 V563 V564 M565	L557-S561 VanDerWaalsContact O-CB 3.3Å; L557-S561 WeakPolarHBondContact O-CB 3.3Å; L557-S561 PolarHBondContact O-N 3.06Å; L557-S561 PolarHBondContact O-OG 3.3Å; S561-V563 VanDerWaalsContact C-N 3.26Å; S561-V563 PolarHBondContact O-N 2.92Å; S561-V564 PolarHBondContact O-N 2.79Å; S561-M565 WeakPolarHBondContact O-CG 3.38Å; S561-M565 PolarHBondContact O-N 2.91Å
562	P	86.3	Confident	82.5	Confident	80 Å²	80	66.6 Å²	66.6	52%	0.519	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-33	176.5	-22.5	34.8	0	0	0	112.9	G558 M565 L566	G558-P562 WeakPolarHBondContact O-CD 3.2Å; G558-P562 WeakPolarHBondContact O-CG 3.43Å; P562-M565 PolarHBondContact O-N 2.84Å; P562-L566 WeakPolarHBondContact O-CB 3.01Å; P562-L566 PolarHBondContact O-N 2.79Å
563	V	84.7	Confident	81.3	Confident	30 Å²	30	71.9 Å²	71.9	18%	0.182	41%	0.414	C	S	.	.	H	α-helix	trans	-66.8	-48.4	178.1	176.7	0	0	0	0	110.6	R559 L560 S561 M565 L566 A567 M576 W578 L593	R559-V563 WeakPolarHBondContact O-CG2 3.47Å; L560-V563 WeakPolarHBondContact O-CB 3.49Å; L560-V563 PolarHBondContact O-N 2.9Å; L560-V563 VanDerWaalsContact O-N 3.09Å; S561-V563 VanDerWaalsContact C-N 3.26Å; S561-V563 PolarHBondContact O-N 2.92Å; V563-M565 VanDerWaalsContact C-N 3.25Å; V563-M565 PolarHBondContact O-N 3.44Å; V563-L566 PolarHBondContact O-N 2.91Å; V563-A567 VanDerWaalsContact O-CB 3.25Å; V563-A567 WeakPolarHBondContact O-CB 3.49Å; V563-A567 PolarHBondContact O-N 3.2Å; V563-M576 HydrophobicContact CB-CE 4.17Å; V563-M576 HydrophobicContact CG1-CE 3.12Å; V563-M576 HydrophobicContact CG1-SD 3.32Å; V563-M576 WeakPolarHBondContact CG1-SD 3.35Å; V563-M576 HydrophobicContact CG2-CE 3.95Å; V563-W578 HydrophobicContact CG2-CZ3 4.02Å; V563-L593 HydrophobicContact CG1-CD2 3.63Å
564	V	85.9	Confident	80.7	Confident	14 Å²	14	76.4 Å²	76.4	9%	0.085	44%	0.441	C	S	.	.	H	α-helix	trans	-61.9	-35.8	176.6	174.2	0	0	0	0	111.3	L560 S561 A567 K568 L593 E594 A597	L560-V564 HydrophobicContact CD1-CG2 4.1Å; L560-V564 HydrophobicContact CG-CG2 4.11Å; L560-V564 PolarHBondContact O-N 2.86Å; S561-V564 PolarHBondContact O-N 2.79Å; V564-A567 WeakPolarHBondContact O-CB 3.44Å; V564-K568 WeakPolarHBondContact O-CG 3.35Å; V564-K568 PolarHBondContact O-N 2.71Å; V564-L593 HydrophobicContact CG2-CD2 3.98Å; V564-L593 HydrophobicContact CG2-CG 3.97Å; V564-E594 HydrophobicContact CG1-CG 3.81Å; V564-A597 HydrophobicContact CG2-CB 3.83Å
565	M	83	Confident	80.4	Confident	130 Å²	130	77.2 Å²	77.2	64%	0.64	44%	0.44	S	S	*	.	H	α-helix	trans	-68	-43.7	174.3	-74.6	-68.8	167.9	0	0	112.5	S561 P562 V563 A567 K568	S561-M565 WeakPolarHBondContact O-CG 3.38Å; S561-M565 PolarHBondContact O-N 2.91Å; P562-M565 PolarHBondContact O-N 2.84Å; V563-M565 VanDerWaalsContact C-N 3.25Å; V563-M565 PolarHBondContact O-N 3.44Å; M565-A567 VanDerWaalsContact C-N 3.33Å; M565-A567 PolarHBondContact O-N 2.87Å; M565-K568 PolarHBondContact O-N 2.82Å
566	L	77.7	Confident	80.2	Confident	110 Å²	110	73.3 Å²	73.3	58%	0.576	42%	0.418	S	S	*	.	H	α-helix	trans	-62.4	-44	177.3	-174.7	69.8	0	0	0	110.9	P562 V563 K568 S569 V570	P562-L566 WeakPolarHBondContact O-CB 3.01Å; P562-L566 PolarHBondContact O-N 2.79Å; V563-L566 PolarHBondContact O-N 2.91Å; L566-K568 PolarHBondContact O-N 3.07Å; L566-S569 PolarHBondContact O-N 3.36Å; L566-S569 PolarHBondContact O-OG 2.78Å; L566-V570 HydrophobicContact CD1-CG2 4.02Å; L566-V570 HydrophobicContact CG-CG2 4.16Å; L566-V570 PolarHBondContact O-N 3.16Å
567	A	73.9	Confident	80.1	Confident	16 Å²	16	74.9 Å²	74.9	13%	0.132	43%	0.431	C	S	.	.	H	α-helix	trans	-51.3	-40	174.8	0	0	0	0	0	113.9	V563 V564 M565 S569 M590	V563-A567 VanDerWaalsContact O-CB 3.25Å; V563-A567 WeakPolarHBondContact O-CB 3.49Å; V563-A567 PolarHBondContact O-N 3.2Å; V564-A567 WeakPolarHBondContact O-CB 3.44Å; M565-A567 VanDerWaalsContact C-N 3.33Å; M565-A567 PolarHBondContact O-N 2.87Å; A567-S569 PolarHBondContact O-N 3.45Å; A567-M590 HydrophobicContact CB-CE 3.71Å; A567-M590 HydrophobicContact CB-CG 3.55Å; A567-M590 HydrophobicContact CB-SD 3.11Å; A567-M590 WeakPolarHBondContact CB-SD 3.5Å
568	K	71.9	Confident	80.1	Confident	130 Å²	130	75.2 Å²	75.2	57%	0.565	43%	0.431	S	S	*	.	H	α-helix	trans	-67.8	-21.9	176.3	-72.6	179.1	177	-174.3	0	113.9	V564 M565 L566 E594	V564-K568 WeakPolarHBondContact O-CG 3.35Å; V564-K568 PolarHBondContact O-N 2.71Å; M565-K568 PolarHBondContact O-N 2.82Å; L566-K568 PolarHBondContact O-N 3.07Å; K568-E594 WeakPolarHBondContact CE-OE1 3.45Å; K568-E594 WeakPolarHBondContact CG-OE1 3.07Å; K568-E594 IonicContact NZ-OE1 2.94Å; K568-E594 IonicContact NZ-OE2 3.62Å
569	S	70.7	Confident	80.1	Confident	83 Å²	83	75 Å²	75	58%	0.58	42%	0.422	S	S	*	.	H	α-helix	trans	-99	-27.5	-177.9	63	0	0	0	0	114.2	L566 A567	L566-S569 PolarHBondContact O-N 3.36Å; L566-S569 PolarHBondContact O-OG 2.78Å; A567-S569 PolarHBondContact O-N 3.45Å
570	V	60.1	Low	80.2	Confident	58 Å²	58	67.1 Å²	67.1	35%	0.352	39%	0.392	S	S	.	.			trans	-101.2	101.1	-176.3	-177.5	0	0	0	0	110.5	L566 A572	L566-V570 HydrophobicContact CD1-CG2 4.02Å; L566-V570 HydrophobicContact CG-CG2 4.16Å; L566-V570 PolarHBondContact O-N 3.16Å; V570-A572 HydrophobicContact CG1-CB 4.25Å; V570-A572 PolarHBondContact O-N 2.8Å
571	T	63.7	Low	80.3	Confident	146 Å²	146	68.2 Å²	68.2	90%	0.896	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-13.8	179.1	43.9	0	0	0	0	114.7
572	A	62.8	Low	80.5	Confident	90 Å²	90	71.1 Å²	71.1	74%	0.744	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-24.8	-174.2	0	0	0	0	0	114.3	V570	V570-A572 HydrophobicContact CG1-CB 4.25Å; V570-A572 PolarHBondContact O-N 2.8Å
573	Q	68.9	Low	80.7	Confident	111 Å²	111	73.3 Å²	73.3	52%	0.519	42%	0.419	S	S	.	.			trans	-105.2	108.7	-172.5	-165.7	155.4	-1.4	0	0	110.2	H575 M590	Q573-H575 WeakPolarHBondContact CG-O 3.4Å; Q573-M590 WeakPolarHBondContact O-CE 3.25Å
574	T	79.2	Confident	81.1	Confident	95 Å²	95	76.8 Å²	76.8	58%	0.583	43%	0.434	S	S	*	.			trans	-89	-19.4	-175.6	55.7	0	0	0	0	113.9	M590	T574-M590 PolarHBondContact O-N 3.41Å
575	H	85.5	Confident	81.3	Confident	79 Å²	79	83.6 Å²	83.6	37%	0.366	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	149.7	-177.8	-62.1	74	0	0	0	111.1	Q573 K587 L588	Q573-H575 WeakPolarHBondContact CG-O 3.4Å; H575-K587 HydrophobicContact CB-CD 4.43Å; H575-K587 HydrophobicContact CB-CG 4.04Å; H575-L588 CarbonylContact C-O 3.56Å; H575-L588 WeakPolarHBondContact CA-O 3.35Å
576	M	86.9	Confident	81.8	Confident	52 Å²	52	78.5 Å²	78.5	26%	0.256	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	147.1	173	-154.7	171.5	116.3	0	0	111.4	V563 W578 L588	V563-M576 HydrophobicContact CB-CE 4.17Å; V563-M576 HydrophobicContact CG1-CE 3.12Å; V563-M576 HydrophobicContact CG1-SD 3.32Å; V563-M576 WeakPolarHBondContact CG1-SD 3.35Å; V563-M576 HydrophobicContact CG2-CE 3.95Å; M576-W578 HydrophobicContact CE-CE3 4.19Å; M576-W578 HydrophobicContact CE-CZ3 4.4Å; M576-L588 PolarHBondContact N-O 3.2Å; M576-L588 PolarHBondContact O-N 2.77Å
577	A	88.4	Confident	82.5	Confident	47 Å²	47	80.5 Å²	80.5	39%	0.388	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.3	172.9	0	0	0	0	0	109.9	Q585 V586	A577-Q585 HydrophobicContact CB-CB 4.39Å; A577-V586 CarbonylContact C-O 3.53Å; A577-V586 VanDerWaalsContact CA-O 3.31Å; A577-V586 WeakPolarHBondContact CA-O 3.46Å
578	W	90.7	Very high	83.3	Confident	34 Å²	34	80 Å²	80	13%	0.129	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.8	169.7	-163.8	-106.2	0	0	0	109.9	W550 R559 L560 V563 M576 V586 L588 L593 L596	W550-W578 AromaticContact CE3-CD1 3.82Å; W550-W578 HydrophobicContact CZ3-CB 4.28Å; W550-W578 AromaticContact CZ3-CD1 3.7Å; W550-W578 HydrophobicContact CZ3-CG 4.39Å; R559-W578 HydrophobicContact CB-CH2 3.83Å; R559-W578 HydrophobicContact CB-CZ2 4.27Å; L560-W578 HydrophobicContact CB-CH2 4.06Å; L560-W578 HydrophobicContact CB-CZ2 3.82Å; L560-W578 HydrophobicContact CD1-CD2 4.05Å; L560-W578 HydrophobicContact CD1-CE3 4.2Å; L560-W578 HydrophobicContact CD1-CH2 4.18Å; L560-W578 HydrophobicContact CD1-CZ2 4.05Å; L560-W578 HydrophobicContact CD1-CZ3 4.27Å; L560-W578 HydrophobicContact CG-CZ2 4.47Å; V563-W578 HydrophobicContact CG2-CZ3 4.02Å; M576-W578 HydrophobicContact CE-CE3 4.19Å; M576-W578 HydrophobicContact CE-CZ3 4.4Å; W578-V586 PolarHBondContact N-O 2.75Å; W578-V586 PolarHBondContact O-N 3.49Å; W578-L588 HydrophobicContact CB-CD1 4.13Å; W578-L593 HydrophobicContact CB-CD1 4.33Å; W578-L596 HydrophobicContact CG-CD2 4.42Å
579	S	91.6	Very high	84.2	Confident	44 Å²	44	75 Å²	75	31%	0.308	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	131	-179.7	-69.3	0	0	0	0	111	Q584	S579-Q584 VanDerWaalsContact CA-O 3.32Å; S579-Q584 WeakPolarHBondContact CA-O 3.41Å
580	D	93.2	Very high	84.9	Confident	4 Å²	4	72.3 Å²	72.3	2%	0.021	40%	0.4	C	S	.	.			trans	-75.2	-179	167.7	69.1	13.8	0	0	0	111.5	R548 I549 W550 D582 N583 Q584 V586	R548-D580 IonicContact CZ-OD2 3.59Å; R548-D580 IonicContact NH1-OD2 2.7Å; R548-D580 PolarHBondContact NH1-OD2 2.73Å; I549-D580 WeakPolarHBondContact O-CB 3.47Å; W550-D580 HydrophobicContact CD2-CB 4.33Å; W550-D580 HydrophobicContact CE3-CB 3.97Å; W550-D580 HydrophobicContact CZ3-CB 4.07Å; D580-D582 PolarHBondContact O-N 3.34Å; D580-D582 PolarHBondContact OD1-N 2.86Å; D580-N583 PolarHBondContact O-N 2.71Å; D580-N583 PolarHBondContact OD1-N 3.11Å; D580-Q584 PolarHBondContact N-O 3.43Å; D580-Q584 WeakPolarHBondContact OD1-CA 3.36Å; D580-Q584 WeakPolarHBondContact OD1-CB 3.45Å; D580-Q584 PolarHBondContact OD1-N 2.85Å; D580-V586 HydrophobicContact CB-CG2 4.28Å
581	A	92.9	Very high	86.3	Confident	22 Å²	22	73.4 Å²	73.4	18%	0.182	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-28	-176.8	0	0	0	0	0	113.2	T542 I549 N583	T542-A581 HydrophobicContact CG2-CB 3.87Å; I549-A581 HydrophobicContact CB-CB 4.28Å; I549-A581 HydrophobicContact CG2-CB 3.78Å; I549-A581 VanDerWaalsContact O-CB 3.27Å; I549-A581 WeakPolarHBondContact O-CB 3.37Å; I549-A581 PolarHBondContact O-N 3.08Å; A581-N583 PolarHBondContact O-N 3.24Å
582	D	92.6	Very high	87.6	Confident	119 Å²	119	69.6 Å²	69.6	64%	0.636	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	10.6	176.1	-65.4	-41.9	0	0	0	112.6	D580 Q584	D580-D582 PolarHBondContact O-N 3.34Å; D580-D582 PolarHBondContact OD1-N 2.86Å; D582-Q584 HydrophobicContact CB-CG 4.32Å; D582-Q584 PolarHBondContact O-N 2.74Å
583	N	90.6	Very high	88.9	Confident	125 Å²	125	65.3 Å²	65.3	67%	0.668	35%	0.345	S	S	*	.			trans	62.1	20.8	-176.4	-58	-69.9	0	0	0	114.5	D580 A581	D580-N583 PolarHBondContact O-N 2.71Å; D580-N583 PolarHBondContact OD1-N 3.11Å; A581-N583 PolarHBondContact O-N 3.24Å
584	Q	92.2	Very high	89.9	Confident	103 Å²	103	63.6 Å²	63.6	48%	0.481	34%	0.337	S	S	.	.			trans	-79	132.3	172.7	-54	-175.6	5.4	0	0	109.9	R548 S579 D580 D582 V586	R548-Q584 VanDerWaalsContact NH1-OE1 3.15Å; S579-Q584 VanDerWaalsContact CA-O 3.32Å; S579-Q584 WeakPolarHBondContact CA-O 3.41Å; D580-Q584 PolarHBondContact N-O 3.43Å; D580-Q584 WeakPolarHBondContact OD1-CA 3.36Å; D580-Q584 WeakPolarHBondContact OD1-CB 3.45Å; D580-Q584 PolarHBondContact OD1-N 2.85Å; D582-Q584 HydrophobicContact CB-CG 4.32Å; D582-Q584 PolarHBondContact O-N 2.74Å; Q584-V586 PolarHBondContact O-N 3.4Å
585	Q	91.5	Very high	90.6	Very high	158 Å²	158	64.3 Å²	64.3	74%	0.738	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.5	176.4	-68.8	-171	7.6	0	0	110.4	A577	A577-Q585 HydrophobicContact CB-CB 4.39Å
586	V	92.4	Very high	91	Very high	23 Å²	23	60.6 Å²	60.6	14%	0.139	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.5	177.1	-175.7	0	0	0	0	108.5	W550 A577 W578 D580 Q584 L588	W550-V586 HydrophobicContact CH2-CB 3.71Å; W550-V586 HydrophobicContact CH2-CG1 3.96Å; W550-V586 HydrophobicContact CH2-CG2 3.84Å; W550-V586 HydrophobicContact CZ2-CG1 4.47Å; W550-V586 HydrophobicContact CZ3-CB 4.38Å; W550-V586 HydrophobicContact CZ3-CG2 4.38Å; A577-V586 CarbonylContact C-O 3.53Å; A577-V586 VanDerWaalsContact CA-O 3.31Å; A577-V586 WeakPolarHBondContact CA-O 3.46Å; W578-V586 PolarHBondContact N-O 2.75Å; W578-V586 PolarHBondContact O-N 3.49Å; D580-V586 HydrophobicContact CB-CG2 4.28Å; Q584-V586 PolarHBondContact O-N 3.4Å; V586-L588 HydrophobicContact CG1-CD2 3.81Å; V586-L588 HydrophobicContact CG1-CG 4.23Å; V586-L588 PolarHBondContact O-N 3.13Å
587	K	92.5	Very high	91.3	Very high	152 Å²	152	58.7 Å²	58.7	66%	0.661	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	109.7	176.5	-171.4	178.8	-178.4	-176.8	0	109.1	H575	H575-K587 HydrophobicContact CB-CD 4.43Å; H575-K587 HydrophobicContact CB-CG 4.04Å
588	L	91.7	Very high	91.5	Very high	5 Å²	5	59.5 Å²	59.5	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140	178.6	-59.7	172.7	0	0	0	109.5	W545 W550 H575 M576 W578 V586 E592 L593 L596	W545-L588 HydrophobicContact CH2-CD2 4.4Å; W545-L588 HydrophobicContact CZ3-CD2 4.07Å; W550-L588 HydrophobicContact CH2-CD1 3.91Å; W550-L588 HydrophobicContact CH2-CD2 4.34Å; W550-L588 HydrophobicContact CH2-CG 4.45Å; W550-L588 HydrophobicContact CZ3-CD1 4.44Å; H575-L588 CarbonylContact C-O 3.56Å; H575-L588 WeakPolarHBondContact CA-O 3.35Å; M576-L588 PolarHBondContact N-O 3.2Å; M576-L588 PolarHBondContact O-N 2.77Å; W578-L588 HydrophobicContact CB-CD1 4.13Å; V586-L588 HydrophobicContact CG1-CD2 3.81Å; V586-L588 HydrophobicContact CG1-CG 4.23Å; V586-L588 PolarHBondContact O-N 3.13Å; L588-E592 HydrophobicContact CB-CB 4.11Å; L588-E592 HydrophobicContact CD2-CB 4.23Å; L588-L593 HydrophobicContact CD1-CD1 3.94Å; L588-L596 HydrophobicContact CD1-CD2 3.7Å
589	S	90.7	Very high	91.7	Very high	26 Å²	26	59.1 Å²	59.1	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	163.5	163.4	67.6	0	0	0	0	110.3	E592 L593	S589-E592 VanDerWaalsContact CB-OE2 3.25Å; S589-E592 WeakPolarHBondContact CB-OE2 3.49Å; S589-E592 PolarHBondContact N-OE2 3.34Å; S589-E592 WeakPolarHBondContact O-CB 3.43Å; S589-E592 PolarHBondContact O-N 2.7Å; S589-E592 VanDerWaalsContact OG-CD 3.27Å; S589-E592 VanDerWaalsContact OG-CG 3.25Å; S589-E592 WeakPolarHBondContact OG-CG 3.32Å; S589-E592 PolarHBondContact OG-N 3.14Å; S589-E592 PolarHBondContact OG-OE2 3.31Å; S589-L593 PolarHBondContact O-N 3.04Å
590	M	85.5	Confident	91.9	Very high	26 Å²	26	57 Å²	57	13%	0.128	31%	0.305	C	S	.	.	H	α-helix	trans	-62.8	-41.3	-177.8	-144.1	57.9	83.4	0	0	114.8	A567 Q573 T574 E592 L593 E594	A567-M590 HydrophobicContact CB-CE 3.71Å; A567-M590 HydrophobicContact CB-CG 3.55Å; A567-M590 HydrophobicContact CB-SD 3.11Å; A567-M590 WeakPolarHBondContact CB-SD 3.5Å; Q573-M590 WeakPolarHBondContact O-CE 3.25Å; T574-M590 PolarHBondContact O-N 3.41Å; M590-E592 PolarHBondContact O-N 3.02Å; M590-L593 PolarHBondContact O-N 3.27Å; M590-L593 HydrophobicContact SD-CD2 4.05Å; M590-E594 PolarHBondContact O-N 2.87Å
591	P	87.9	Confident	92	Very high	81 Å²	81	60.2 Å²	60.2	53%	0.526	33%	0.325	S	S	.	.	H	α-helix	trans	-59.5	-42.1	170.6	-25.2	36	0	0	0	113.1	L593 E594 E595	P591-L593 VanDerWaalsContact C-N 3.27Å; P591-L593 PolarHBondContact O-N 2.89Å; P591-E594 WeakPolarHBondContact O-CB 3.29Å; P591-E594 PolarHBondContact O-N 3.21Å; P591-E594 VanDerWaalsContact O-N 3.16Å; P591-E595 WeakPolarHBondContact O-CG 3.23Å; P591-E595 PolarHBondContact O-N 3.35Å
592	E	91.8	Very high	92.1	Very high	65 Å²	65	64.1 Å²	64.1	30%	0.304	34%	0.339	S	S	.	.	H	α-helix	trans	-63.1	-33.4	177.5	-75.1	169.8	133.2	0	0	112.4	W545 L588 S589 M590 E595 L596	W545-E592 HydrophobicContact CH2-CB 4.1Å; W545-E592 WeakPolarHBondContact CH2-O 3.3Å; L588-E592 HydrophobicContact CB-CB 4.11Å; L588-E592 HydrophobicContact CD2-CB 4.23Å; S589-E592 VanDerWaalsContact CB-OE2 3.25Å; S589-E592 WeakPolarHBondContact CB-OE2 3.49Å; S589-E592 PolarHBondContact N-OE2 3.34Å; S589-E592 WeakPolarHBondContact O-CB 3.43Å; S589-E592 PolarHBondContact O-N 2.7Å; S589-E592 VanDerWaalsContact OG-CD 3.27Å; S589-E592 VanDerWaalsContact OG-CG 3.25Å; S589-E592 WeakPolarHBondContact OG-CG 3.32Å; S589-E592 PolarHBondContact OG-N 3.14Å; S589-E592 PolarHBondContact OG-OE2 3.31Å; M590-E592 PolarHBondContact O-N 3.02Å; E592-E595 PolarHBondContact O-N 3.14Å; E592-L596 WeakPolarHBondContact O-CB 3.18Å; E592-L596 PolarHBondContact O-N 3.45Å
593	L	90.3	Very high	92.2	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-69.2	-37.4	175.5	-164.5	76.2	0	0	0	112	L560 V563 V564 W578 L588 S589 M590 P591 A597	L560-L593 HydrophobicContact CD1-CD1 3.72Å; L560-L593 HydrophobicContact CD1-CD2 4.49Å; L560-L593 HydrophobicContact CD1-CG 4.03Å; V563-L593 HydrophobicContact CG1-CD2 3.63Å; V564-L593 HydrophobicContact CG2-CD2 3.98Å; V564-L593 HydrophobicContact CG2-CG 3.97Å; W578-L593 HydrophobicContact CB-CD1 4.33Å; L588-L593 HydrophobicContact CD1-CD1 3.94Å; S589-L593 PolarHBondContact O-N 3.04Å; M590-L593 PolarHBondContact O-N 3.27Å; M590-L593 HydrophobicContact SD-CD2 4.05Å; P591-L593 VanDerWaalsContact C-N 3.27Å; P591-L593 PolarHBondContact O-N 2.89Å; L593-A597 WeakPolarHBondContact O-CB 3.45Å; L593-A597 PolarHBondContact O-N 2.82Å
594	E	89.6	Confident	92.4	Very high	75 Å²	75	54.1 Å²	54.1	35%	0.35	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-42.5	173.1	-72.5	-173.3	-168.7	0	0	111.6	V564 K568 M590 P591 A597 A598	V564-E594 HydrophobicContact CG1-CG 3.81Å; K568-E594 WeakPolarHBondContact CE-OE1 3.45Å; K568-E594 WeakPolarHBondContact CG-OE1 3.07Å; K568-E594 IonicContact NZ-OE1 2.94Å; K568-E594 IonicContact NZ-OE2 3.62Å; M590-E594 PolarHBondContact O-N 2.87Å; P591-E594 WeakPolarHBondContact O-CB 3.29Å; P591-E594 PolarHBondContact O-N 3.21Å; P591-E594 VanDerWaalsContact O-N 3.16Å; E594-A597 PolarHBondContact O-N 2.78Å; E594-A598 WeakPolarHBondContact O-CB 3.23Å; E594-A598 PolarHBondContact O-N 2.93Å
595	E	93.7	Very high	92.5	Very high	110 Å²	110	52.2 Å²	52.2	51%	0.514	28%	0.283	S	S	.	.	H	α-helix	trans	-63.3	-43.5	175	-72.4	179.9	-175.6	0	0	111.9	W545 P591 E592 A597 A598 A599	W545-E595 HydrophobicContact CZ2-CB 3.75Å; P591-E595 WeakPolarHBondContact O-CG 3.23Å; P591-E595 PolarHBondContact O-N 3.35Å; E592-E595 PolarHBondContact O-N 3.14Å; E595-A597 VanDerWaalsContact C-N 3.31Å; E595-A597 PolarHBondContact O-N 3.07Å; E595-A598 PolarHBondContact O-N 2.9Å; E595-A599 VanDerWaalsContact O-CB 3.31Å; E595-A599 WeakPolarHBondContact O-CB 3.42Å; E595-A599 PolarHBondContact O-N 2.92Å
596	L	94.2	Very high	92.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-42.7	174.6	175.4	63.1	0	0	0	111.3	F543 W545 W550 L560 W578 L588 E592 A599 M600	F543-L596 HydrophobicContact CZ-CD1 3.87Å; W545-L596 HydrophobicContact CB-CD1 4.43Å; W545-L596 HydrophobicContact CD2-CB 4.42Å; W545-L596 HydrophobicContact CD2-CD1 4.04Å; W545-L596 HydrophobicContact CE3-CB 4.17Å; W545-L596 HydrophobicContact CE3-CD1 3.7Å; W545-L596 HydrophobicContact CE3-CG 4.45Å; W545-L596 HydrophobicContact CG-CD1 4.36Å; W545-L596 HydrophobicContact CH2-CB 4.2Å; W545-L596 HydrophobicContact CZ2-CB 4.46Å; W545-L596 HydrophobicContact CZ3-CB 4.05Å; W545-L596 HydrophobicContact CZ3-CD1 4.31Å; W550-L596 HydrophobicContact CB-CD1 4.31Å; W550-L596 HydrophobicContact CD2-CD1 3.73Å; W550-L596 HydrophobicContact CD2-CD2 4.16Å; W550-L596 HydrophobicContact CE3-CD1 4.27Å; W550-L596 HydrophobicContact CE3-CD2 3.87Å; W550-L596 HydrophobicContact CG-CD1 3.74Å; W550-L596 HydrophobicContact CH2-CD2 4.19Å; W550-L596 HydrophobicContact CZ2-CD2 4.49Å; W550-L596 HydrophobicContact CZ3-CD2 3.91Å; L560-L596 HydrophobicContact CD2-CD2 4.4Å; L560-L596 HydrophobicContact CD2-CG 4.19Å; W578-L596 HydrophobicContact CG-CD2 4.42Å; L588-L596 HydrophobicContact CD1-CD2 3.7Å; E592-L596 WeakPolarHBondContact O-CB 3.18Å; E592-L596 PolarHBondContact O-N 3.45Å; L596-A599 PolarHBondContact O-N 2.9Å; L596-M600 WeakPolarHBondContact O-CB 3.37Å; L596-M600 PolarHBondContact O-N 3.08Å
597	A	92.6	Very high	92.7	Very high	13 Å²	13	50.9 Å²	50.9	11%	0.107	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-43.8	178.1	0	0	0	0	0	112.1	L560 V564 L593 E594 E595 A599 M600 V601	L560-A597 HydrophobicContact CD2-CB 3.71Å; L560-A597 HydrophobicContact CG-CB 4.08Å; V564-A597 HydrophobicContact CG2-CB 3.83Å; L593-A597 WeakPolarHBondContact O-CB 3.45Å; L593-A597 PolarHBondContact O-N 2.82Å; E594-A597 PolarHBondContact O-N 2.78Å; E595-A597 VanDerWaalsContact C-N 3.31Å; E595-A597 PolarHBondContact O-N 3.07Å; A597-A599 VanDerWaalsContact C-N 3.34Å; A597-A599 PolarHBondContact O-N 2.9Å; A597-M600 PolarHBondContact O-N 2.74Å; A597-V601 WeakPolarHBondContact O-CG2 3.39Å; A597-V601 PolarHBondContact O-N 3.18Å
598	A	93.3	Very high	92.7	Very high	63 Å²	63	45.6 Å²	45.6	52%	0.521	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-43.5	174.8	0	0	0	0	0	111.5	E594 E595 V601 Q602	E594-A598 WeakPolarHBondContact O-CB 3.23Å; E594-A598 PolarHBondContact O-N 2.93Å; E595-A598 PolarHBondContact O-N 2.9Å; A598-V601 PolarHBondContact O-N 2.95Å; A598-Q602 PolarHBondContact O-N 2.87Å
599	A	95.9	Very high	92.8	Very high	26 Å²	26	49.5 Å²	49.5	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-39.5	177.1	0	0	0	0	0	112.2	F543 W545 E595 L596 A597 Q602 A603	F543-A599 HydrophobicContact CE2-CB 3.81Å; F543-A599 HydrophobicContact CZ-CB 4.43Å; W545-A599 HydrophobicContact CG-CB 4.13Å; E595-A599 VanDerWaalsContact O-CB 3.31Å; E595-A599 WeakPolarHBondContact O-CB 3.42Å; E595-A599 PolarHBondContact O-N 2.92Å; L596-A599 PolarHBondContact O-N 2.9Å; A597-A599 VanDerWaalsContact C-N 3.34Å; A597-A599 PolarHBondContact O-N 2.9Å; A599-Q602 PolarHBondContact O-N 2.65Å; A599-A603 WeakPolarHBondContact O-CB 3.37Å; A599-A603 PolarHBondContact O-N 2.99Å
600	M	95.5	Very high	92.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-40.9	175.6	-171.8	-176.9	-61.8	0	0	112.1	F543 N551 A552 L557 L560 L596 A597 A603 Q604	F543-M600 HydrophobicContact CE1-CB 3.88Å; F543-M600 HydrophobicContact CE1-CE 4.2Å; F543-M600 HydrophobicContact CE1-CG 3.91Å; F543-M600 HydrophobicContact CZ-CB 3.69Å; F543-M600 HydrophobicContact CZ-CG 4.26Å; N551-M600 WeakPolarHBondContact O-CE 3.3Å; A552-M600 HydrophobicContact CB-CG 3.9Å; L557-M600 HydrophobicContact CB-SD 4.43Å; L557-M600 HydrophobicContact CD2-CB 4.02Å; L557-M600 HydrophobicContact CD2-CG 3.69Å; L557-M600 HydrophobicContact CD2-SD 3.67Å; L557-M600 HydrophobicContact CG-CG 3.88Å; L557-M600 HydrophobicContact CG-SD 3.71Å; L560-M600 HydrophobicContact CD2-CE 3.67Å; L560-M600 HydrophobicContact CD2-SD 4.22Å; L596-M600 WeakPolarHBondContact O-CB 3.37Å; L596-M600 PolarHBondContact O-N 3.08Å; A597-M600 PolarHBondContact O-N 2.74Å; M600-A603 PolarHBondContact O-N 3.02Å; M600-Q604 WeakPolarHBondContact O-CB 2.91Å; M600-Q604 PolarHBondContact O-N 3.46Å
601	V	94.7	Very high	93.3	Very high	72 Å²	72	53.7 Å²	53.7	44%	0.436	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-45.8	174.5	170.2	0	0	0	0	110.1	L557 A597 A598 A603 Q604 V605	L557-V601 HydrophobicContact CD2-CB 4.49Å; L557-V601 HydrophobicContact CD2-CG2 3.51Å; A597-V601 WeakPolarHBondContact O-CG2 3.39Å; A597-V601 PolarHBondContact O-N 3.18Å; A598-V601 PolarHBondContact O-N 2.95Å; V601-A603 PolarHBondContact O-N 3.26Å; V601-Q604 WeakPolarHBondContact O-CB 3.34Å; V601-Q604 PolarHBondContact O-N 2.72Å; V601-V605 WeakPolarHBondContact O-CG2 3.16Å; V601-V605 PolarHBondContact O-N 3.45Å
602	Q	94.3	Very high	93.5	Very high	103 Å²	103	54.1 Å²	54.1	48%	0.481	28%	0.283	S	S	.	.	H	α-helix	trans	-60.1	-47.2	177.3	-172	60.5	54.1	0	0	111.2	A598 A599 Q604 V605 D606	A598-Q602 PolarHBondContact O-N 2.87Å; A599-Q602 PolarHBondContact O-N 2.65Å; Q602-Q604 VanDerWaalsContact C-N 3.28Å; Q602-Q604 PolarHBondContact O-N 3.25Å; Q602-V605 PolarHBondContact O-N 3.18Å; Q602-V605 VanDerWaalsContact O-N 3.11Å; Q602-D606 PolarHBondContact NE2-OD1 3.14Å; Q602-D606 VanDerWaalsContact O-CG 3.22Å; Q602-D606 PolarHBondContact O-N 2.89Å
603	A	95.7	Very high	93.6	Very high	17 Å²	17	57.4 Å²	57.4	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-36.7	177.5	0	0	0	0	0	112.7	F541 F543 A599 M600 V601 R607	F541-A603 HydrophobicContact CE2-CB 4.09Å; F541-A603 HydrophobicContact CZ-CB 4.22Å; F543-A603 HydrophobicContact CB-CB 3.96Å; F543-A603 HydrophobicContact CD1-CB 4.39Å; F543-A603 HydrophobicContact CD2-CB 3.95Å; F543-A603 HydrophobicContact CG-CB 3.84Å; A599-A603 WeakPolarHBondContact O-CB 3.37Å; A599-A603 PolarHBondContact O-N 2.99Å; M600-A603 PolarHBondContact O-N 3.02Å; V601-A603 PolarHBondContact O-N 3.26Å; A603-R607 WeakPolarHBondContact O-CB 3.18Å; A603-R607 PolarHBondContact O-N 2.97Å; A603-R607 VanDerWaalsContact O-N 3.09Å
604	Q	94.1	Very high	93.9	Very high	18 Å²	18	61.2 Å²	61.2	8%	0.084	31%	0.306	C	S	.	.	H	α-helix	trans	-66.3	-43	174.4	-179.5	73.1	61.9	0	0	111.8	L557 M600 V601 Q602 N608	L557-Q604 HydrophobicContact CD1-CB 3.87Å; L557-Q604 HydrophobicContact CD1-CG 3.93Å; M600-Q604 WeakPolarHBondContact O-CB 2.91Å; M600-Q604 PolarHBondContact O-N 3.46Å; V601-Q604 WeakPolarHBondContact O-CB 3.34Å; V601-Q604 PolarHBondContact O-N 2.72Å; Q602-Q604 VanDerWaalsContact C-N 3.28Å; Q602-Q604 PolarHBondContact O-N 3.25Å; Q604-N608 PolarHBondContact NE2-ND2 3.2Å; Q604-N608 PolarHBondContact NE2-OD1 3.32Å; Q604-N608 WeakPolarHBondContact O-CB 3.11Å; Q604-N608 PolarHBondContact O-N 3.38Å; Q604-N608 PolarHBondContact O-OD1 3.47Å
605	V	94	Very high	94.2	Very high	62 Å²	62	58.2 Å²	58.2	38%	0.376	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-48.8	177.4	170	0	0	0	0	110.1	V601 Q602 R607 N608 D609	V601-V605 WeakPolarHBondContact O-CG2 3.16Å; V601-V605 PolarHBondContact O-N 3.45Å; Q602-V605 PolarHBondContact O-N 3.18Å; Q602-V605 VanDerWaalsContact O-N 3.11Å; V605-R607 VanDerWaalsContact C-N 3.33Å; V605-R607 PolarHBondContact O-N 2.8Å; V605-N608 PolarHBondContact O-N 3.18Å; V605-D609 WeakPolarHBondContact O-CB 2.94Å; V605-D609 PolarHBondContact O-N 3.3Å
606	D	93.5	Very high	94.2	Very high	78 Å²	78	59 Å²	59	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-59	-45.3	-179.5	-64.2	-19.5	0	0	0	111.1	Q602 D609 E610	Q602-D606 PolarHBondContact NE2-OD1 3.14Å; Q602-D606 VanDerWaalsContact O-CG 3.22Å; Q602-D606 PolarHBondContact O-N 2.89Å; D606-D609 PolarHBondContact O-N 2.84Å; D606-E610 WeakPolarHBondContact O-CG 3.46Å; D606-E610 PolarHBondContact O-N 3.23Å
607	R	94.1	Very high	94.2	Very high	75 Å²	75	62.9 Å²	62.9	28%	0.283	31%	0.309	S	S	.	.	H	α-helix	trans	-64.5	-42.2	176.7	-177.1	168.6	175.9	103.7	-0.2	112.6	F541 A603 V605 D609 E610 I611	F541-R607 VanDerWaalsContact CD1-CD 3.47Å; F541-R607 HydrophobicContact CE2-CB 4.48Å; F541-R607 VanDerWaalsContact CG-CD 3.49Å; F541-R607 HydrophobicContact CZ-CB 4.3Å; A603-R607 WeakPolarHBondContact O-CB 3.18Å; A603-R607 PolarHBondContact O-N 2.97Å; A603-R607 VanDerWaalsContact O-N 3.09Å; V605-R607 VanDerWaalsContact C-N 3.33Å; V605-R607 PolarHBondContact O-N 2.8Å; R607-D609 VanDerWaalsContact C-N 3.31Å; R607-D609 PolarHBondContact O-N 3.35Å; R607-E610 PolarHBondContact O-N 3.12Å; R607-I611 HydrophobicContact CG-CD1 4.04Å; R607-I611 WeakPolarHBondContact O-CD1 3.46Å; R607-I611 VanDerWaalsContact O-CG1 3.29Å; R607-I611 WeakPolarHBondContact O-CG1 3.15Å; R607-I611 PolarHBondContact O-N 2.7Å
608	N	94	Very high	94.4	Very high	42 Å²	42	62.2 Å²	62.2	23%	0.225	30%	0.304	C	S	.	.	H	α-helix	trans	-66	-36.2	177.8	-73.3	1.4	0	0	0	111.6	Q604 V605 I611 Y612	Q604-N608 PolarHBondContact NE2-ND2 3.2Å; Q604-N608 PolarHBondContact NE2-OD1 3.32Å; Q604-N608 WeakPolarHBondContact O-CB 3.11Å; Q604-N608 PolarHBondContact O-N 3.38Å; Q604-N608 PolarHBondContact O-OD1 3.47Å; V605-N608 PolarHBondContact O-N 3.18Å; N608-I611 PolarHBondContact O-N 3.29Å; N608-Y612 WeakPolarHBondContact O-CB 3.46Å; N608-Y612 PolarHBondContact O-N 2.99Å
609	D	93.4	Very high	94.4	Very high	86 Å²	86	62.3 Å²	62.3	46%	0.46	29%	0.292	S	S	.	.	H	α-helix	trans	-66.6	-37.2	175.5	-81.1	-9.8	0	0	0	112.2	V605 D606 R607 R613	V605-D609 WeakPolarHBondContact O-CB 2.94Å; V605-D609 PolarHBondContact O-N 3.3Å; D606-D609 PolarHBondContact O-N 2.84Å; R607-D609 VanDerWaalsContact C-N 3.31Å; R607-D609 PolarHBondContact O-N 3.35Å; D609-R613 WeakPolarHBondContact O-CB 3.4Å; D609-R613 PolarHBondContact O-N 3.26Å
610	E	93.5	Very high	94.3	Very high	126 Å²	126	67.8 Å²	67.8	59%	0.589	31%	0.313	S	S	*	.	H	α-helix	trans	-63	-48.4	171.4	-73.3	177.5	174.2	0	0	111.7	D606 R607 Y612 R613 R614	D606-E610 WeakPolarHBondContact O-CG 3.46Å; D606-E610 PolarHBondContact O-N 3.23Å; R607-E610 PolarHBondContact O-N 3.12Å; E610-Y612 VanDerWaalsContact C-N 3.31Å; E610-Y612 PolarHBondContact O-N 3.34Å; E610-R613 PolarHBondContact O-N 2.99Å; E610-R614 PolarHBondContact O-N 3.47Å
611	I	94.3	Very high	94.2	Very high	14 Å²	14	72.6 Å²	72.6	7%	0.072	34%	0.336	C	S	.	.	H	α-helix	trans	-59	-44.6	176.8	-67.3	162.5	0	0	0	110.5	W532 R533 Q536 E537 R607 N608 R613 R614 Q615	W532-I611 HydrophobicContact CH2-CG2 4.01Å; W532-I611 HydrophobicContact CZ3-CG2 3.74Å; R533-I611 HydrophobicContact CB-CG2 4.35Å; R533-I611 HydrophobicContact CG-CG2 3.93Å; Q536-I611 HydrophobicContact CB-CD1 3.74Å; Q536-I611 HydrophobicContact CB-CG1 4.05Å; Q536-I611 HydrophobicContact CB-CG2 4.08Å; E537-I611 HydrophobicContact CG-CD1 4.08Å; E537-I611 HydrophobicContact CG-CG2 4.23Å; R607-I611 HydrophobicContact CG-CD1 4.04Å; R607-I611 WeakPolarHBondContact O-CD1 3.46Å; R607-I611 VanDerWaalsContact O-CG1 3.29Å; R607-I611 WeakPolarHBondContact O-CG1 3.15Å; R607-I611 PolarHBondContact O-N 2.7Å; N608-I611 PolarHBondContact O-N 3.29Å; I611-R613 VanDerWaalsContact C-N 3.34Å; I611-R613 PolarHBondContact O-N 3.42Å; I611-R614 PolarHBondContact O-N 3.07Å; I611-Q615 WeakPolarHBondContact O-CB 3.49Å; I611-Q615 PolarHBondContact O-N 3.41Å
612	Y	92	Very high	94.2	Very high	90 Å²	90	69.3 Å²	69.3	35%	0.353	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-38.9	177.9	175.4	-110	0	0	0	112.4	N608 E610 Q615 R616	N608-Y612 WeakPolarHBondContact O-CB 3.46Å; N608-Y612 PolarHBondContact O-N 2.99Å; E610-Y612 VanDerWaalsContact C-N 3.31Å; E610-Y612 PolarHBondContact O-N 3.34Å; Y612-Q615 WeakPolarHBondContact O-CB 3.23Å; Y612-Q615 PolarHBondContact O-N 3.39Å; Y612-R616 HydrophobicContact CE1-CG 4.48Å; Y612-R616 VanDerWaalsContact CE1-CZ 3.41Å; Y612-R616 HydrophobicContact CE2-CG 4.34Å; Y612-R616 PolarHBondContact O-N 3.48Å; Y612-R616 VanDerWaalsContact O-N 3.13Å
613	R	93.5	Very high	94.1	Very high	134 Å²	134	68 Å²	68	51%	0.506	32%	0.318	S	S	.	.	H	α-helix	trans	-64.5	-47.9	175.9	-165.7	-178.6	-49.8	162.5	10.2	111.3	D609 E610 I611 Q615 R616 E617	D609-R613 WeakPolarHBondContact O-CB 3.4Å; D609-R613 PolarHBondContact O-N 3.26Å; E610-R613 PolarHBondContact O-N 2.99Å; I611-R613 VanDerWaalsContact C-N 3.34Å; I611-R613 PolarHBondContact O-N 3.42Å; R613-Q615 VanDerWaalsContact C-N 3.3Å; R613-Q615 PolarHBondContact O-N 2.92Å; R613-R616 WeakPolarHBondContact O-CB 3.47Å; R613-R616 PolarHBondContact O-N 3.27Å; R613-E617 WeakPolarHBondContact O-CG 2.99Å; R613-E617 PolarHBondContact O-N 2.98Å
614	R	95.7	Very high	93.9	Very high	81 Å²	81	70.1 Å²	70.1	31%	0.306	34%	0.342	S	S	.	.	H	α-helix	trans	-60.5	-39.4	176.1	-178.5	61.1	-179.2	151.6	4.7	112	W532 E610 I611 R616 E617 M618 E637	W532-R614 HydrophobicContact CH2-CB 3.85Å; W532-R614 HydrophobicContact CH2-CG 3.55Å; W532-R614 HydrophobicContact CZ2-CG 3.98Å; W532-R614 HydrophobicContact CZ3-CG 4.42Å; E610-R614 PolarHBondContact O-N 3.47Å; I611-R614 PolarHBondContact O-N 3.07Å; R614-R616 VanDerWaalsContact C-N 3.31Å; R614-R616 PolarHBondContact O-N 2.93Å; R614-E617 IonicContact NH1-OE2 2.91Å; R614-E617 PolarHBondContact O-N 2.76Å; R614-M618 HydrophobicContact CG-CE 4.32Å; R614-M618 WeakPolarHBondContact O-CG 3.34Å; R614-M618 PolarHBondContact O-N 3.01Å; R614-E637 PolarHBondContact NE-O 3.17Å; R614-E637 PolarHBondContact NH2-O 3.27Å
615	Q	95.4	Very high	93.8	Very high	13 Å²	13	71.4 Å²	71.4	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-57	-44.3	173.1	-170.9	-174.4	47.5	0	0	111.9	I529 W532 R533 I611 Y612 R613 K619	I529-Q615 HydrophobicContact CG2-CG 3.5Å; W532-Q615 HydrophobicContact CZ3-CB 4.3Å; R533-Q615 VanDerWaalsContact CD-NE2 3.3Å; R533-Q615 VanDerWaalsContact NH1-OE1 3.16Å; I611-Q615 WeakPolarHBondContact O-CB 3.49Å; I611-Q615 PolarHBondContact O-N 3.41Å; Y612-Q615 WeakPolarHBondContact O-CB 3.23Å; Y612-Q615 PolarHBondContact O-N 3.39Å; R613-Q615 VanDerWaalsContact C-N 3.3Å; R613-Q615 PolarHBondContact O-N 2.92Å; Q615-K619 WeakPolarHBondContact O-CG 3.41Å; Q615-K619 PolarHBondContact O-N 3.49Å
616	R	94.8	Very high	93.6	Very high	127 Å²	127	74.7 Å²	74.7	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-67	-43.9	178.7	-71.8	-171.6	-61.4	-166.2	1.8	111.9	Y612 R613 R614 M618 K619 E620	Y612-R616 HydrophobicContact CE1-CG 4.48Å; Y612-R616 VanDerWaalsContact CE1-CZ 3.41Å; Y612-R616 HydrophobicContact CE2-CG 4.34Å; Y612-R616 PolarHBondContact O-N 3.48Å; Y612-R616 VanDerWaalsContact O-N 3.13Å; R613-R616 WeakPolarHBondContact O-CB 3.47Å; R613-R616 PolarHBondContact O-N 3.27Å; R614-R616 VanDerWaalsContact C-N 3.31Å; R614-R616 PolarHBondContact O-N 2.93Å; R616-M618 PolarHBondContact O-N 2.8Å; R616-K619 PolarHBondContact O-N 3.44Å; R616-E620 WeakPolarHBondContact O-CB 3.19Å; R616-E620 PolarHBondContact O-N 3.24Å
617	E	93.8	Very high	93.5	Very high	80 Å²	80	74 Å²	74	37%	0.374	36%	0.36	S	S	.	.	H	α-helix	trans	-56.5	-50	175.6	-70.4	166.7	-172.6	0	0	110.7	R613 R614 K619 E620 E621	R613-E617 WeakPolarHBondContact O-CG 2.99Å; R613-E617 PolarHBondContact O-N 2.98Å; R614-E617 IonicContact NH1-OE2 2.91Å; R614-E617 PolarHBondContact O-N 2.76Å; E617-K619 VanDerWaalsContact C-N 3.33Å; E617-K619 PolarHBondContact O-N 2.98Å; E617-E620 PolarHBondContact O-N 2.8Å; E617-E620 VanDerWaalsContact O-N 3.13Å; E617-E621 WeakPolarHBondContact O-CG 3.46Å; E617-E621 PolarHBondContact O-N 3.01Å
618	M	96.3	Very high	93.2	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-60.2	-40.9	176.9	-71.3	-168.8	-70.1	0	0	112.8	I529 W532 R614 R616 E620 L622 F634 V636	I529-M618 HydrophobicContact CD1-CB 3.92Å; I529-M618 HydrophobicContact CG1-CB 4.23Å; I529-M618 HydrophobicContact CG1-CE 4.4Å; I529-M618 HydrophobicContact CG1-SD 4.43Å; I529-M618 HydrophobicContact CG2-CE 4Å; W532-M618 HydrophobicContact CD2-CE 3.72Å; W532-M618 HydrophobicContact CE3-CE 3.39Å; W532-M618 HydrophobicContact CG-CE 4.49Å; W532-M618 HydrophobicContact CH2-CE 3.86Å; W532-M618 HydrophobicContact CZ2-CE 4.08Å; W532-M618 HydrophobicContact CZ3-CE 3.49Å; W532-M618 VanDerWaalsContact CZ3-CE 3.49Å; R614-M618 HydrophobicContact CG-CE 4.32Å; R614-M618 WeakPolarHBondContact O-CG 3.34Å; R614-M618 PolarHBondContact O-N 3.01Å; R616-M618 PolarHBondContact O-N 2.8Å; M618-E620 VanDerWaalsContact C-N 3.33Å; M618-L622 WeakPolarHBondContact O-CB 3.35Å; M618-L622 PolarHBondContact O-N 3.15Å; M618-F634 HydrophobicContact CB-CE1 4.12Å; M618-F634 HydrophobicContact CB-CZ 3.94Å; M618-F634 HydrophobicContact CG-CE1 4.49Å; M618-F634 HydrophobicContact CG-CZ 4.26Å; M618-F634 WeakPolarHBondContact O-CZ 2.66Å; M618-V636 HydrophobicContact CE-CG1 4.48Å; M618-V636 HydrophobicContact SD-CG1 4.18Å
619	K	94.1	Very high	93	Very high	64 Å²	64	72.2 Å²	72.2	28%	0.278	37%	0.366	S	S	.	.	H	α-helix	trans	-66.4	-35.6	176.9	-76.8	-176.3	171.9	-171	0	112.2	I529 E530 Q615 R616 E617 S623	I529-K619 HydrophobicContact CD1-CG 4.14Å; I529-K619 HydrophobicContact CG2-CG 4.06Å; E530-K619 IonicContact OE1-NZ 3Å; E530-K619 PolarHBondContact OE1-NZ 3.4Å; Q615-K619 WeakPolarHBondContact O-CG 3.41Å; Q615-K619 PolarHBondContact O-N 3.49Å; R616-K619 PolarHBondContact O-N 3.44Å; E617-K619 VanDerWaalsContact C-N 3.33Å; E617-K619 PolarHBondContact O-N 2.98Å; K619-S623 WeakPolarHBondContact O-CB 3.46Å; K619-S623 PolarHBondContact O-N 3.2Å; K619-S623 VanDerWaalsContact O-N 3.07Å
620	E	93.4	Very high	93	Very high	142 Å²	142	70.3 Å²	70.3	66%	0.664	36%	0.36	S	S	*	.	H	α-helix	trans	-70.7	-46.9	176.5	-173	169.1	-170.3	0	0	111.2	R616 E617 M618 L622 S623 G624	R616-E620 WeakPolarHBondContact O-CB 3.19Å; R616-E620 PolarHBondContact O-N 3.24Å; E617-E620 PolarHBondContact O-N 2.8Å; E617-E620 VanDerWaalsContact O-N 3.13Å; M618-E620 VanDerWaalsContact C-N 3.33Å; E620-L622 PolarHBondContact O-N 3.28Å; E620-S623 WeakPolarHBondContact O-CB 3.19Å; E620-S623 PolarHBondContact O-N 3.32Å; E620-S623 VanDerWaalsContact O-N 3.08Å; E620-S623 PolarHBondContact O-OG 3.34Å; E620-G624 PolarHBondContact O-N 3.22Å; E620-G624 VanDerWaalsContact O-N 3.13Å
621	E	93.8	Very high	92.9	Very high	101 Å²	101	64.3 Å²	64.3	47%	0.472	33%	0.332	S	S	.	.	H	α-helix	trans	-56.3	-49	173.5	-71.6	173.8	-171	0	0	111.2	E617 S623 G624 L625 F634	E617-E621 WeakPolarHBondContact O-CG 3.46Å; E617-E621 PolarHBondContact O-N 3.01Å; E621-S623 PolarHBondContact O-N 3.49Å; E621-G624 PolarHBondContact O-N 2.98Å; E621-L625 PolarHBondContact O-N 3.34Å; E621-F634 HydrophobicContact CB-CE2 3.77Å; E621-F634 HydrophobicContact CB-CZ 4.16Å
622	L	94.5	Very high	92.7	Very high	2 Å²	2	68.8 Å²	68.8	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-33.8	176.4	179.4	65.1	0	0	0	112.5	R522 R525 R526 I529 M618 E620 G624 L625 I631 F634	R522-L622 PolarHBondContact NH1-O 3.18Å; R525-L622 HydrophobicContact CB-CD1 3.77Å; R525-L622 HydrophobicContact CB-CD2 3.56Å; R525-L622 HydrophobicContact CB-CG 4.33Å; R525-L622 HydrophobicContact CG-CD1 4.17Å; R526-L622 HydrophobicContact CG-CD2 3.74Å; I529-L622 HydrophobicContact CD1-CD2 3.92Å; M618-L622 WeakPolarHBondContact O-CB 3.35Å; M618-L622 PolarHBondContact O-N 3.15Å; E620-L622 PolarHBondContact O-N 3.28Å; L622-G624 VanDerWaalsContact C-N 3.3Å; L622-L625 HydrophobicContact CD1-CD1 4.45Å; L622-I631 HydrophobicContact CD1-CG2 4.07Å; L622-F634 HydrophobicContact CB-CD1 4.49Å; L622-F634 HydrophobicContact CB-CE1 4.35Å; L622-F634 HydrophobicContact CB-CE2 4.47Å; L622-F634 HydrophobicContact CB-CZ 4.33Å; L622-F634 HydrophobicContact CD1-CB 4.21Å; L622-F634 HydrophobicContact CD1-CD1 4.23Å; L622-F634 HydrophobicContact CD1-CG 4.06Å
623	S	91.3	Very high	92.7	Very high	77 Å²	77	68.2 Å²	68.2	54%	0.538	36%	0.362	S	S	.	.	H	α-helix	trans	-71.5	-24.9	176.6	79.7	0	0	0	0	113	R522 K619 E620 E621	R522-S623 VanDerWaalsContact NH1-CA 3.34Å; R522-S623 PolarHBondContact NH1-O 2.64Å; K619-S623 WeakPolarHBondContact O-CB 3.46Å; K619-S623 PolarHBondContact O-N 3.2Å; K619-S623 VanDerWaalsContact O-N 3.07Å; E620-S623 WeakPolarHBondContact O-CB 3.19Å; E620-S623 PolarHBondContact O-N 3.32Å; E620-S623 VanDerWaalsContact O-N 3.08Å; E620-S623 PolarHBondContact O-OG 3.34Å; E621-S623 PolarHBondContact O-N 3.49Å
624	G	91.6	Very high	92.8	Very high	61 Å²	61	63 Å²	63	63%	0.629	34%	0.343	S	S	*	.	H	α-helix	trans	-79.1	-21.3	179	0	0	0	0	0	115.1	E620 E621 L622	E620-G624 PolarHBondContact O-N 3.22Å; E620-G624 VanDerWaalsContact O-N 3.13Å; E621-G624 PolarHBondContact O-N 2.98Å; L622-G624 VanDerWaalsContact C-N 3.3Å
625	L	93	Very high	92.5	Very high	45 Å²	45	64 Å²	64	24%	0.236	35%	0.354	C	S	.	.			trans	-71.9	134.4	-178.7	-61.6	177.2	0	0	0	111.6	R522 E621 L622 I631 F634	R522-L625 PolarHBondContact NH1-O 2.77Å; R522-L625 PolarHBondContact NH2-O 2.89Å; E621-L625 PolarHBondContact O-N 3.34Å; L622-L625 HydrophobicContact CD1-CD1 4.45Å; L625-I631 HydrophobicContact CB-CG1 3.69Å; L625-I631 HydrophobicContact CD1-CG1 4.3Å; L625-F634 HydrophobicContact CD1-CB 4.22Å; L625-F634 HydrophobicContact CD1-CD2 3.89Å; L625-F634 HydrophobicContact CD1-CG 4.41Å
626	D	90.4	Very high	92.2	Very high	130 Å²	130	64.7 Å²	64.7	70%	0.695	36%	0.359	S	S	*	.			trans	-113.9	-11.1	-177.4	59.1	-13.3	0	0	0	114.2
627	D	90.8	Very high	91.5	Very high	63 Å²	63	65.8 Å²	65.8	34%	0.337	37%	0.37	S	S	.	.	S	Bend	trans	-107.4	145.5	177.8	80.2	92	0	0	0	113.2	A629 S630 I631	D627-A629 VanDerWaalsContact C-N 3.3Å; D627-A629 PolarHBondContact O-N 2.78Å; D627-A629 WeakPolarHBondContact OD1-CB 3.19Å; D627-A629 PolarHBondContact OD1-N 3.38Å; D627-S630 WeakPolarHBondContact OD1-CB 3.36Å; D627-S630 PolarHBondContact OD1-N 2.93Å; D627-S630 PolarHBondContact OD1-OG 2.99Å; D627-S630 VanDerWaalsContact OD1-OG 3.06Å; D627-S630 WeakPolarHBondContact OD2-CB 3.47Å; D627-S630 PolarHBondContact OD2-OG 2.97Å; D627-I631 WeakPolarHBondContact O-CD1 3.21Å; D627-I631 VanDerWaalsContact O-CG1 3.28Å; D627-I631 WeakPolarHBondContact O-CG1 3.17Å; D627-I631 PolarHBondContact O-N 3.06Å; D627-I631 VanDerWaalsContact O-N 3.13Å
628	L	88.2	Confident	91.4	Very high	10 Å²	10	65.1 Å²	65.1	5%	0.052	37%	0.37	C	S	.	.	H	α-helix	trans	-64.6	-33	-175.3	-176.7	63.2	0	0	0	113	V513 M517 L518 A521 R632	V513-L628 HydrophobicContact CG1-CB 4.02Å; V513-L628 HydrophobicContact CG1-CD2 4.28Å; V513-L628 HydrophobicContact CG2-CB 4.17Å; V513-L628 HydrophobicContact CG2-CD2 4.06Å; M517-L628 HydrophobicContact CE-CD2 3.91Å; L518-L628 HydrophobicContact CD2-CB 4.01Å; L518-L628 HydrophobicContact CD2-CD1 4.49Å; A521-L628 HydrophobicContact CB-CD1 3.67Å; L628-R632 HydrophobicContact CD1-CG 4.38Å; L628-R632 WeakPolarHBondContact O-CB 3.36Å; L628-R632 WeakPolarHBondContact O-CG 3.26Å; L628-R632 PolarHBondContact O-N 2.72Å
629	A	89.6	Confident	91.1	Very high	70 Å²	70	68.5 Å²	68.5	58%	0.579	39%	0.389	S	S	*	.	H	α-helix	trans	-70.5	-46.2	-177.3	0	0	0	0	0	110.6	D627 R632 A633	D627-A629 VanDerWaalsContact C-N 3.3Å; D627-A629 PolarHBondContact O-N 2.78Å; D627-A629 WeakPolarHBondContact OD1-CB 3.19Å; D627-A629 PolarHBondContact OD1-N 3.38Å; A629-R632 CarbonylContact O-C 3.55Å; A629-R632 PolarHBondContact O-N 3.16Å; A629-A633 VanDerWaalsContact O-CB 3.28Å; A629-A633 WeakPolarHBondContact O-CB 3.4Å; A629-A633 PolarHBondContact O-N 2.98Å
630	S	92.2	Very high	91	Very high	46 Å²	46	68.8 Å²	68.8	32%	0.322	40%	0.395	S	S	.	.	H	α-helix	trans	-65	-41.6	175.9	-57.7	0	0	0	0	111.9	D627 R632 A633 F634	D627-S630 WeakPolarHBondContact OD1-CB 3.36Å; D627-S630 PolarHBondContact OD1-N 2.93Å; D627-S630 PolarHBondContact OD1-OG 2.99Å; D627-S630 VanDerWaalsContact OD1-OG 3.06Å; D627-S630 WeakPolarHBondContact OD2-CB 3.47Å; D627-S630 PolarHBondContact OD2-OG 2.97Å; S630-R632 VanDerWaalsContact C-N 3.29Å; S630-R632 PolarHBondContact O-N 3.19Å; S630-A633 CarbonylContact O-C 3.58Å; S630-A633 PolarHBondContact O-N 2.96Å; S630-A633 VanDerWaalsContact O-N 3.14Å; S630-F634 PolarHBondContact O-N 3Å
631	I	93.2	Very high	90.8	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-59.3	-44.4	175.6	-66.4	163.2	0	0	0	110.2	L518 A521 R522 R525 L622 L625 D627 A633 F634	L518-I631 HydrophobicContact CB-CD1 4.31Å; L518-I631 HydrophobicContact CD2-CD1 3.67Å; A521-I631 HydrophobicContact CB-CB 4.44Å; A521-I631 HydrophobicContact CB-CG2 3.59Å; R522-I631 HydrophobicContact CG-CD1 4.02Å; R522-I631 HydrophobicContact CG-CG1 4.35Å; R522-I631 HydrophobicContact CG-CG2 3.99Å; R525-I631 WeakPolarHBondContact CG-O 3.49Å; R525-I631 PolarHBondContact NE-O 3Å; L622-I631 HydrophobicContact CD1-CG2 4.07Å; L625-I631 HydrophobicContact CB-CG1 3.69Å; L625-I631 HydrophobicContact CD1-CG1 4.3Å; D627-I631 WeakPolarHBondContact O-CD1 3.21Å; D627-I631 VanDerWaalsContact O-CG1 3.28Å; D627-I631 WeakPolarHBondContact O-CG1 3.17Å; D627-I631 PolarHBondContact O-N 3.06Å; D627-I631 VanDerWaalsContact O-N 3.13Å; I631-A633 VanDerWaalsContact C-N 3.33Å; I631-F634 WeakPolarHBondContact O-CB 3.42Å; I631-F634 PolarHBondContact O-N 3.03Å
632	R	89.9	Confident	90.6	Very high	108 Å²	108	62.2 Å²	62.2	41%	0.408	37%	0.374	S	S	.	.	H	α-helix	trans	-73.9	-22.6	178	-72.5	178.9	178.1	172.2	4.8	113.3	E463 A521 R525 L628 A629 S630	E463-R632 IonicContact OE1-CZ 2.73Å; E463-R632 IonicContact OE1-NH1 3.62Å; E463-R632 PolarHBondContact OE1-NH1 3.16Å; E463-R632 IonicContact OE1-NH2 2.72Å; E463-R632 IonicContact OE2-CZ 2.98Å; E463-R632 IonicContact OE2-NH1 3.68Å; E463-R632 PolarHBondContact OE2-NH1 2.99Å; E463-R632 IonicContact OE2-NH2 3.94Å; E463-R632 PolarHBondContact OE2-NH2 3.47Å; A521-R632 HydrophobicContact CB-CG 4.35Å; R525-R632 PolarHBondContact NE-O 3.18Å; R525-R632 PolarHBondContact NH2-O 2.86Å; L628-R632 HydrophobicContact CD1-CG 4.38Å; L628-R632 WeakPolarHBondContact O-CB 3.36Å; L628-R632 WeakPolarHBondContact O-CG 3.26Å; L628-R632 PolarHBondContact O-N 2.72Å; A629-R632 CarbonylContact O-C 3.55Å; A629-R632 PolarHBondContact O-N 3.16Å; S630-R632 VanDerWaalsContact C-N 3.29Å; S630-R632 PolarHBondContact O-N 3.19Å
633	A	92.4	Very high	90.4	Very high	79 Å²	79	66.2 Å²	66.2	65%	0.653	40%	0.398	S	S	*	.	H	α-helix	trans	-91.9	0.7	175.3	0	0	0	0	0	113.1	A629 S630 I631 D635	A629-A633 VanDerWaalsContact O-CB 3.28Å; A629-A633 WeakPolarHBondContact O-CB 3.4Å; A629-A633 PolarHBondContact O-N 2.98Å; S630-A633 CarbonylContact O-C 3.58Å; S630-A633 PolarHBondContact O-N 2.96Å; S630-A633 VanDerWaalsContact O-N 3.14Å; I631-A633 VanDerWaalsContact C-N 3.33Å; A633-D635 PolarHBondContact O-N 3.07Å
634	F	94	Very high	90.3	Very high	24 Å²	24	65.4 Å²	65.4	11%	0.105	39%	0.388	C	S	.	.			trans	-59.5	123.5	-179.6	-175.2	-99.1	0	0	0	110.7	I529 M618 E621 L622 L625 S630 I631 V636	I529-F634 HydrophobicContact CD1-CE1 3.96Å; I529-F634 HydrophobicContact CG1-CE1 4.47Å; M618-F634 HydrophobicContact CB-CE1 4.12Å; M618-F634 HydrophobicContact CB-CZ 3.94Å; M618-F634 HydrophobicContact CG-CE1 4.49Å; M618-F634 HydrophobicContact CG-CZ 4.26Å; M618-F634 WeakPolarHBondContact O-CZ 2.66Å; E621-F634 HydrophobicContact CB-CE2 3.77Å; E621-F634 HydrophobicContact CB-CZ 4.16Å; L622-F634 HydrophobicContact CB-CD1 4.49Å; L622-F634 HydrophobicContact CB-CE1 4.35Å; L622-F634 HydrophobicContact CB-CE2 4.47Å; L622-F634 HydrophobicContact CB-CZ 4.33Å; L622-F634 HydrophobicContact CD1-CB 4.21Å; L622-F634 HydrophobicContact CD1-CD1 4.23Å; L622-F634 HydrophobicContact CD1-CG 4.06Å; L625-F634 HydrophobicContact CD1-CB 4.22Å; L625-F634 HydrophobicContact CD1-CD2 3.89Å; L625-F634 HydrophobicContact CD1-CG 4.41Å; S630-F634 PolarHBondContact O-N 3Å; I631-F634 WeakPolarHBondContact O-CB 3.42Å; I631-F634 PolarHBondContact O-N 3.03Å; F634-V636 HydrophobicContact CD1-CG2 4.16Å; F634-V636 HydrophobicContact CE1-CG2 4.37Å
635	D	90.9	Very high	90.2	Very high	102 Å²	102	65.8 Å²	65.8	55%	0.545	37%	0.369	S	S	.	.			trans	-87.4	133.6	-175.7	-160.1	7.7	0	0	0	110.9	A633	A633-D635 PolarHBondContact O-N 3.07Å
636	V	88.4	Confident	90	Very high	27 Å²	27	67.5 Å²	67.5	16%	0.164	38%	0.38	C	S	.	.			trans	-111.3	78.5	-176.4	-174.1	0	0	0	0	108.3	E528 I529 W532 M618 F634	E528-V636 HydrophobicContact CB-CG2 4.25Å; I529-V636 HydrophobicContact CG1-CG1 3.98Å; I529-V636 HydrophobicContact CG1-CG2 4.15Å; W532-V636 HydrophobicContact CB-CG1 3.71Å; W532-V636 HydrophobicContact CG-CG1 3.97Å; M618-V636 HydrophobicContact CE-CG1 4.48Å; M618-V636 HydrophobicContact SD-CG1 4.18Å; F634-V636 HydrophobicContact CD1-CG2 4.16Å; F634-V636 HydrophobicContact CE1-CG2 4.37Å
637	E	79.8	Confident	89.9	Confident	151 Å²	151	61.8 Å²	61.8	71%	0.706	35%	0.352	S	S	*	.			trans	-122.4	0	179.7	-69.1	-166.4	162.7	0	0	114.2	W532 R614	W532-E637 VanDerWaalsContact CE2-OXT 3.3Å; W532-E637 VanDerWaalsContact CZ2-OXT 3.32Å; W532-E637 WeakPolarHBondContact CZ2-OXT 3.27Å; W532-E637 PolarHBondContact NE1-OXT 3.02Å; R614-E637 PolarHBondContact NE-O 3.17Å; R614-E637 PolarHBondContact NH2-O 3.27Å

Retrieved 637 of 637 residues in 995.2 ms (Link to these results)

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