A0A060WKB3_ONCMY Loading...

T-complex protein 1 subunit zeta

AlphaFold DB , UniProt , Accession A0A060WKB3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 531 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	48.9	Very low	74	Confident	220 Å²	220	94.7 Å²	94.7	100%	1.084	53%	0.526	S	S	*	.				0	134.8	0	-76.2	-163.1	-88.5	0	0	108.5
2	T	59.8	Low	74.7	Confident	21 Å²	21	96.8 Å²	96.8	13%	0.129	53%	0.529	C	S	.	.			trans	-58.9	139.5	171.9	34.7	0	0	0	0	109.5	I4 K5 A6	T2-I4 PolarHBondContact O-N 3.17Å; T2-I4 VanDerWaalsContact O-N 3.1Å; T2-K5 PolarHBondContact O-N 2.99Å; T2-K5 WeakPolarHBondContact OG1-CB 3.33Å; T2-K5 VanDerWaalsContact OG1-CD 3.29Å; T2-K5 WeakPolarHBondContact OG1-CD 3.48Å; T2-K5 WeakPolarHBondContact OG1-CG 3.4Å; T2-K5 PolarHBondContact OG1-N 3.49Å; T2-A6 PolarHBondContact O-N 2.89Å
3	A	71.5	Confident	75.5	Confident	79 Å²	79	92.2 Å²	92.2	65%	0.653	51%	0.506	S	S	*	.	H	α-helix	trans	-52.8	-32.9	174.5	0	0	0	0	0	111.7	A6 L7	A3-A6 WeakPolarHBondContact O-CB 3.27Å; A3-A6 PolarHBondContact O-N 3.14Å; A3-L7 PolarHBondContact O-N 2.68Å
4	I	72.9	Confident	76	Confident	22 Å²	22	87.6 Å²	87.6	11%	0.113	49%	0.486	C	S	.	.	H	α-helix	trans	-69.3	-37.3	174.8	-66.3	159.5	0	0	0	113.1	T2 A6 L7 N8 A11 V13 E520 M522	T2-I4 PolarHBondContact O-N 3.17Å; T2-I4 VanDerWaalsContact O-N 3.1Å; I4-A6 PolarHBondContact O-N 2.88Å; I4-L7 PolarHBondContact O-N 3.34Å; I4-N8 PolarHBondContact O-N 3.33Å; I4-A11 HydrophobicContact CG2-CB 3.93Å; I4-V13 HydrophobicContact CB-CG2 4.15Å; I4-V13 HydrophobicContact CD1-CG1 4.08Å; I4-V13 HydrophobicContact CD1-CG2 4.14Å; I4-V13 HydrophobicContact CG2-CG2 3.64Å; I4-E520 WeakPolarHBondContact CD1-OE2 3.39Å; I4-M522 HydrophobicContact CB-CE 4.45Å; I4-M522 HydrophobicContact CD1-CE 3.57Å; I4-M522 HydrophobicContact CD1-CG 4.22Å; I4-M522 HydrophobicContact CD1-SD 3.65Å; I4-M522 HydrophobicContact CG1-CE 3.85Å; I4-M522 HydrophobicContact CG1-SD 4.5Å; I4-M522 HydrophobicContact CG2-CE 3.72Å
5	K	76.1	Confident	76.6	Confident	106 Å²	106	90.2 Å²	90.2	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-66.9	-20	175.1	-82	179.4	-178.4	-171.8	0	112.2	T2 P9	T2-K5 PolarHBondContact O-N 2.99Å; T2-K5 WeakPolarHBondContact OG1-CB 3.33Å; T2-K5 VanDerWaalsContact OG1-CD 3.29Å; T2-K5 WeakPolarHBondContact OG1-CD 3.48Å; T2-K5 WeakPolarHBondContact OG1-CG 3.4Å; T2-K5 PolarHBondContact OG1-N 3.49Å; K5-P9 WeakPolarHBondContact O-CA 3.4Å
6	A	79.1	Confident	76.9	Confident	84 Å²	84	88.5 Å²	88.5	69%	0.694	49%	0.487	S	S	*	.	H	α-helix	trans	-74.4	-30.6	169.5	0	0	0	0	0	112.4	T2 A3 I4	T2-A6 PolarHBondContact O-N 2.89Å; A3-A6 WeakPolarHBondContact O-CB 3.27Å; A3-A6 PolarHBondContact O-N 3.14Å; I4-A6 PolarHBondContact O-N 2.88Å
7	L	80.9	Confident	77.3	Confident	152 Å²	152	91.5 Å²	91.5	80%	0.796	50%	0.497	S	S	*	.	H	α-helix	trans	-82.5	-41.7	176.6	-67	170.1	0	0	0	112.7	A3 I4	A3-L7 PolarHBondContact O-N 2.68Å; I4-L7 PolarHBondContact O-N 3.34Å
8	N	80.8	Confident	77.8	Confident	59 Å²	59	89.4 Å²	89.4	32%	0.316	49%	0.494	S	S	.	.			trans	-141.3	106.3	176.3	-177	-7.1	0	0	0	109.8	I4 K10 A11	I4-N8 PolarHBondContact O-N 3.33Å; N8-K10 PolarHBondContact O-N 2.88Å; N8-K10 VanDerWaalsContact O-N 3.17Å; N8-K10 PolarHBondContact OD1-N 3.43Å; N8-A11 HydrophobicContact CB-CB 4Å; N8-A11 WeakPolarHBondContact O-CB 3.37Å; N8-A11 PolarHBondContact O-N 3.44Å; N8-A11 VanDerWaalsContact O-N 3.12Å
9	P	80.1	Confident	78.4	Confident	106 Å²	106	84.7 Å²	84.7	69%	0.688	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-19	-177.1	24.8	-32.4	0	0	0	113.4	K5	K5-P9 WeakPolarHBondContact O-CA 3.4Å
10	K	83.1	Confident	79	Confident	189 Å²	189	81 Å²	81	82%	0.822	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-0.8	177.7	-64.9	-175.9	178.8	-179.7	0	113.8	N8 E12	N8-K10 PolarHBondContact O-N 2.88Å; N8-K10 VanDerWaalsContact O-N 3.17Å; N8-K10 PolarHBondContact OD1-N 3.43Å; K10-E12 PolarHBondContact O-N 3.47Å
11	A	80.9	Confident	79.5	Confident	4 Å²	4	79.7 Å²	79.7	3%	0.033	45%	0.447	C	S	.	.			trans	-73.2	128.6	-179.4	0	0	0	0	0	111.6	I4 N8 V13 A524	I4-A11 HydrophobicContact CG2-CB 3.93Å; N8-A11 HydrophobicContact CB-CB 4Å; N8-A11 WeakPolarHBondContact O-CB 3.37Å; N8-A11 PolarHBondContact O-N 3.44Å; N8-A11 VanDerWaalsContact O-N 3.12Å; A11-V13 HydrophobicContact CB-CG2 4.43Å; A11-A524 HydrophobicContact CB-CB 4.47Å
12	E	82.7	Confident	81.6	Confident	119 Å²	119	72.1 Å²	72.1	56%	0.556	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.5	167.6	-62.6	175	160.4	0	0	108.7	K10 R523	K10-E12 PolarHBondContact O-N 3.47Å; E12-R523 HydrophobicContact CB-CB 4.19Å; E12-R523 PolarHBondContact O-N 3.32Å; E12-R523 WeakPolarHBondContact OE2-CD 3.47Å; E12-R523 IonicContact OE2-NH1 3.69Å; E12-R523 PolarHBondContact OE2-NH1 3.38Å
13	V	84.1	Confident	83.2	Confident	38 Å²	38	71.3 Å²	71.3	23%	0.23	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	128.1	-176.6	-172.4	0	0	0	0	110	I4 A11 R15 I521 M522	I4-V13 HydrophobicContact CB-CG2 4.15Å; I4-V13 HydrophobicContact CD1-CG1 4.08Å; I4-V13 HydrophobicContact CD1-CG2 4.14Å; I4-V13 HydrophobicContact CG2-CG2 3.64Å; A11-V13 HydrophobicContact CB-CG2 4.43Å; V13-R15 HydrophobicContact CG1-CG 3.8Å; V13-I521 WeakPolarHBondContact CA-O 3.23Å; V13-M522 HydrophobicContact CG1-CG 4.33Å; V13-M522 HydrophobicContact CG2-CG 4.48Å
14	A	83.6	Confident	84.2	Confident	27 Å²	27	67.7 Å²	67.7	22%	0.223	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	136.3	162.1	0	0	0	0	0	108.8	A19 E520 I521	A14-A19 HydrophobicContact CB-CB 4.28Å; A14-E520 WeakPolarHBondContact O-CA 3.36Å; A14-I521 HydrophobicContact CB-CB 4.42Å; A14-I521 PolarHBondContact N-O 3.24Å; A14-I521 VanDerWaalsContact N-O 3.08Å; A14-I521 PolarHBondContact O-N 3.39Å
15	R	84.6	Confident	85.2	Confident	127 Å²	127	70.5 Å²	70.5	48%	0.479	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	145.3	-173.5	-65.1	-159	-81.6	179.3	-4.7	113.3	V13 Q17 A18 A19 D519 E520	V13-R15 HydrophobicContact CG1-CG 3.8Å; R15-Q17 PolarHBondContact O-N 2.67Å; R15-Q17 VanDerWaalsContact O-N 3.09Å; R15-A18 WeakPolarHBondContact O-CB 3.33Å; R15-A18 PolarHBondContact O-N 3.12Å; R15-A19 PolarHBondContact O-N 3.4Å; R15-D519 CarbonylContact C-O 3.55Å; R15-E520 HydrophobicContact CB-CG 4.5Å; R15-E520 WeakPolarHBondContact CD-OE1 3.39Å; R15-E520 HydrophobicContact CG-CG 4.13Å; R15-E520 VanDerWaalsContact CG-OE1 3.29Å; R15-E520 WeakPolarHBondContact CG-OE1 3.37Å
16	A	80.8	Confident	86	Confident	63 Å²	63	66.2 Å²	66.2	52%	0.521	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	34.3	-106.3	178.6	0	0	0	0	0	112.6	A18 A19 L20 D519	A16-A18 VanDerWaalsContact C-N 3.3Å; A16-A18 PolarHBondContact O-N 3.46Å; A16-A19 WeakPolarHBondContact O-CB 3.39Å; A16-A19 PolarHBondContact O-N 3.01Å; A16-A19 VanDerWaalsContact O-N 3.12Å; A16-L20 PolarHBondContact O-N 3.16Å; A16-D519 WeakPolarHBondContact CA-O 3.46Å; A16-D519 PolarHBondContact N-O 3.13Å
17	Q	83.6	Confident	86.8	Confident	139 Å²	139	62.2 Å²	62.2	65%	0.65	35%	0.351	S	S	*	.	H	α-helix	trans	-63.4	-32.1	-176.3	-159.9	174.9	3.2	0	0	113.3	R15 A21	R15-Q17 PolarHBondContact O-N 2.67Å; R15-Q17 VanDerWaalsContact O-N 3.09Å; Q17-A21 WeakPolarHBondContact O-CB 3.22Å; Q17-A21 PolarHBondContact O-N 2.97Å
18	A	87.5	Confident	87.4	Confident	54 Å²	54	58.6 Å²	58.6	45%	0.446	33%	0.327	S	S	.	.	H	α-helix	trans	-71.4	-37.1	175.2	0	0	0	0	0	111.8	R15 A16 V22	R15-A18 WeakPolarHBondContact O-CB 3.33Å; R15-A18 PolarHBondContact O-N 3.12Å; A16-A18 VanDerWaalsContact C-N 3.3Å; A16-A18 PolarHBondContact O-N 3.46Å; A18-V22 WeakPolarHBondContact O-CB 3.48Å; A18-V22 VanDerWaalsContact O-CG2 3.23Å; A18-V22 WeakPolarHBondContact O-CG2 3.21Å; A18-V22 PolarHBondContact O-N 2.98Å; A18-V22 VanDerWaalsContact O-N 3.09Å
19	A	89.1	Confident	88	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.2	-45.1	173.9	0	0	0	0	0	110.7	A14 R15 A16 V22 N23 D519 I521	A14-A19 HydrophobicContact CB-CB 4.28Å; R15-A19 PolarHBondContact O-N 3.4Å; A16-A19 WeakPolarHBondContact O-CB 3.39Å; A16-A19 PolarHBondContact O-N 3.01Å; A16-A19 VanDerWaalsContact O-N 3.12Å; A19-V22 PolarHBondContact O-N 3.44Å; A19-N23 VanDerWaalsContact O-CG 3.31Å; A19-N23 PolarHBondContact O-N 3.18Å; A19-N23 PolarHBondContact O-ND2 3.44Å; A19-D519 WeakPolarHBondContact CB-O 3.15Å; A19-I521 HydrophobicContact CB-CD1 4.1Å; A19-I521 HydrophobicContact CB-CG1 4Å
20	L	89.2	Confident	88.7	Confident	10 Å²	10	53.1 Å²	53.1	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-60.7	-47.8	176.5	-174.5	67.6	0	0	0	111.9	A16 V22 N23 I24 V110 L516	A16-L20 PolarHBondContact O-N 3.16Å; L20-V22 VanDerWaalsContact C-N 3.31Å; L20-V22 PolarHBondContact O-N 2.9Å; L20-N23 WeakPolarHBondContact O-CB 3.22Å; L20-N23 PolarHBondContact O-N 3.48Å; L20-I24 HydrophobicContact CD1-CD1 3.89Å; L20-I24 HydrophobicContact CD1-CG1 4.26Å; L20-I24 HydrophobicContact CD2-CD1 4.25Å; L20-I24 HydrophobicContact CG-CD1 3.66Å; L20-I24 HydrophobicContact CG-CG1 4.35Å; L20-I24 VanDerWaalsContact O-CG1 3.27Å; L20-I24 WeakPolarHBondContact O-CG1 3.38Å; L20-I24 PolarHBondContact O-N 2.92Å; L20-V110 HydrophobicContact CD2-CB 4.15Å; L20-V110 HydrophobicContact CD2-CG1 3.58Å; L20-V110 HydrophobicContact CD2-CG2 4.2Å; L20-L516 HydrophobicContact CD1-CD2 3.82Å
21	A	90.1	Very high	89.2	Confident	54 Å²	54	44.4 Å²	44.4	45%	0.446	26%	0.262	S	S	.	.	H	α-helix	trans	-60	-40.3	178.6	0	0	0	0	0	112.4	Q17 S25	Q17-A21 WeakPolarHBondContact O-CB 3.22Å; Q17-A21 PolarHBondContact O-N 2.97Å; A21-S25 WeakPolarHBondContact O-CB 3.44Å; A21-S25 PolarHBondContact O-N 3.39Å
22	V	92.4	Very high	89.8	Confident	62 Å²	62	49.2 Å²	49.2	38%	0.376	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-44.5	175.6	169.2	0	0	0	0	111	A18 A19 L20 S25 A26 H71 I521	A18-V22 WeakPolarHBondContact O-CB 3.48Å; A18-V22 VanDerWaalsContact O-CG2 3.23Å; A18-V22 WeakPolarHBondContact O-CG2 3.21Å; A18-V22 PolarHBondContact O-N 2.98Å; A18-V22 VanDerWaalsContact O-N 3.09Å; A19-V22 PolarHBondContact O-N 3.44Å; L20-V22 VanDerWaalsContact C-N 3.31Å; L20-V22 PolarHBondContact O-N 2.9Å; V22-S25 PolarHBondContact O-N 3.48Å; V22-A26 WeakPolarHBondContact O-CB 3.5Å; V22-A26 PolarHBondContact O-N 2.82Å; V22-H71 WeakPolarHBondContact CG1-NE2 3.09Å; V22-I521 HydrophobicContact CG1-CD1 4.3Å
23	N	93.3	Very high	90.3	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-48.1	176.9	-75	-22.2	0	0	0	112.5	A19 L20 A26 A27 T73 I515 I521	A19-N23 VanDerWaalsContact O-CG 3.31Å; A19-N23 PolarHBondContact O-N 3.18Å; A19-N23 PolarHBondContact O-ND2 3.44Å; L20-N23 WeakPolarHBondContact O-CB 3.22Å; L20-N23 PolarHBondContact O-N 3.48Å; N23-A26 PolarHBondContact O-N 3.37Å; N23-A27 WeakPolarHBondContact O-CB 3.44Å; N23-A27 PolarHBondContact O-N 3Å; N23-T73 HydrophobicContact CB-CG2 4.04Å; N23-T73 PolarHBondContact OD1-OG1 3.08Å; N23-I515 HydrophobicContact CB-CG2 3.7Å; N23-I521 WeakPolarHBondContact OD1-CD1 3.39Å
24	I	92.9	Very high	90.7	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.015	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-42.4	-178.9	-64.4	172.5	0	0	0	110.4	L20 A26 A27 R28 L103 D107	L20-I24 HydrophobicContact CD1-CD1 3.89Å; L20-I24 HydrophobicContact CD1-CG1 4.26Å; L20-I24 HydrophobicContact CD2-CD1 4.25Å; L20-I24 HydrophobicContact CG-CD1 3.66Å; L20-I24 HydrophobicContact CG-CG1 4.35Å; L20-I24 VanDerWaalsContact O-CG1 3.27Å; L20-I24 WeakPolarHBondContact O-CG1 3.38Å; L20-I24 PolarHBondContact O-N 2.92Å; I24-A26 VanDerWaalsContact C-N 3.34Å; I24-A26 PolarHBondContact O-N 3.23Å; I24-A27 PolarHBondContact O-N 3.27Å; I24-R28 HydrophobicContact CG2-CG 4.32Å; I24-R28 WeakPolarHBondContact O-CB 3.36Å; I24-R28 WeakPolarHBondContact O-CG 3.19Å; I24-R28 PolarHBondContact O-N 2.7Å; I24-L103 HydrophobicContact CG1-CB 4.24Å; I24-D107 HydrophobicContact CD1-CB 3.77Å; I24-D107 WeakPolarHBondContact CD1-OD1 3.44Å; I24-D107 HydrophobicContact CG2-CB 4.45Å
25	S	94.1	Very high	91.2	Very high	80 Å²	80	45.1 Å²	45.1	56%	0.559	26%	0.264	S	S	*	.	H	α-helix	trans	-59.3	-44.4	176.2	-177.1	0	0	0	0	111.8	A21 V22 R28 G29	A21-S25 WeakPolarHBondContact O-CB 3.44Å; A21-S25 PolarHBondContact O-N 3.39Å; V22-S25 PolarHBondContact O-N 3.48Å; S25-R28 PolarHBondContact O-N 2.72Å; S25-G29 PolarHBondContact O-N 3.39Å
26	A	93.9	Very high	91.6	Very high	16 Å²	16	40.1 Å²	40.1	13%	0.132	25%	0.249	C	C	.	.	H	α-helix	trans	-65.6	-40.7	177	0	0	0	0	0	113	V22 N23 I24 G29 L30 H71	V22-A26 WeakPolarHBondContact O-CB 3.5Å; V22-A26 PolarHBondContact O-N 2.82Å; N23-A26 PolarHBondContact O-N 3.37Å; I24-A26 VanDerWaalsContact C-N 3.34Å; I24-A26 PolarHBondContact O-N 3.23Å; A26-G29 PolarHBondContact O-N 3.36Å; A26-L30 PolarHBondContact O-N 3.47Å; A26-H71 HydrophobicContact CB-CB 4.45Å; A26-H71 WeakPolarHBondContact CB-CE1 3.09Å; A26-H71 VanDerWaalsContact CB-ND1 3.27Å; A26-H71 WeakPolarHBondContact CB-ND1 3.18Å
27	A	94.8	Very high	92.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-43.7	176.4	0	0	0	0	0	111.8	N23 I24 L30 Q31 I77 L103	N23-A27 WeakPolarHBondContact O-CB 3.44Å; N23-A27 PolarHBondContact O-N 3Å; I24-A27 PolarHBondContact O-N 3.27Å; A27-L30 PolarHBondContact O-N 3.09Å; A27-Q31 WeakPolarHBondContact O-CB 3.12Å; A27-Q31 PolarHBondContact O-N 3.25Å; A27-I77 HydrophobicContact CB-CD1 3.74Å; A27-L103 HydrophobicContact CB-CD1 3.51Å
28	R	94.2	Very high	92.6	Very high	77 Å²	77	31.4 Å²	31.4	29%	0.291	20%	0.198	S	C	.	.	H	α-helix	trans	-61.5	-44.3	174.3	-72.8	179.9	-174	167.7	8.7	111.6	I24 S25 L30 Q31 D32 K104 D107	I24-R28 HydrophobicContact CG2-CG 4.32Å; I24-R28 WeakPolarHBondContact O-CB 3.36Å; I24-R28 WeakPolarHBondContact O-CG 3.19Å; I24-R28 PolarHBondContact O-N 2.7Å; S25-R28 PolarHBondContact O-N 2.72Å; R28-L30 VanDerWaalsContact C-N 3.32Å; R28-L30 PolarHBondContact O-N 3.09Å; R28-Q31 WeakPolarHBondContact O-CB 3.46Å; R28-Q31 PolarHBondContact O-N 2.87Å; R28-D32 PolarHBondContact O-N 3.37Å; R28-K104 HydrophobicContact CG-CB 4.49Å; R28-D107 IonicContact CZ-OD2 3.28Å; R28-D107 IonicContact NH1-OD2 3.98Å; R28-D107 IonicContact NH2-OD2 3.34Å; R28-D107 PolarHBondContact NH2-OD2 3.22Å
29	G	93.7	Very high	92.8	Very high	37 Å²	37	29.3 Å²	29.3	38%	0.381	18%	0.181	S	C	.	.	H	α-helix	trans	-59.3	-41.8	176.4	0	0	0	0	0	112.6	S25 A26 V33	S25-G29 PolarHBondContact O-N 3.39Å; A26-G29 PolarHBondContact O-N 3.36Å; G29-V33 WeakPolarHBondContact O-CG2 3.27Å; G29-V33 PolarHBondContact O-N 3.33Å
30	L	93.2	Very high	92.9	Very high	13 Å²	13	32 Å²	32	7%	0.068	20%	0.199	C	C	.	.	H	α-helix	trans	-70	-40	176.4	-166.3	66.5	0	0	0	112.3	A26 A27 R28 V33 L34 L64 A74 I77 V96	A26-L30 PolarHBondContact O-N 3.47Å; A27-L30 PolarHBondContact O-N 3.09Å; R28-L30 VanDerWaalsContact C-N 3.32Å; R28-L30 PolarHBondContact O-N 3.09Å; L30-V33 PolarHBondContact O-N 3.46Å; L30-L34 HydrophobicContact CG-CD1 4.41Å; L30-L34 PolarHBondContact O-N 2.92Å; L30-L64 HydrophobicContact CD1-CD2 3.85Å; L30-L64 HydrophobicContact CD2-CD2 4.13Å; L30-L64 HydrophobicContact CG-CD2 4.35Å; L30-A74 HydrophobicContact CD2-CB 4.27Å; L30-I77 HydrophobicContact CD2-CB 4.15Å; L30-I77 HydrophobicContact CD2-CG2 3.86Å; L30-V96 HydrophobicContact CB-CG1 4.35Å; L30-V96 HydrophobicContact CD2-CG1 3.8Å; L30-V96 HydrophobicContact CG-CG1 3.85Å
31	Q	95	Very high	93	Very high	6 Å²	6	37.2 Å²	37.2	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-56.7	-48.7	173.4	173.7	-174.5	4.4	0	0	110.9	A27 R28 V33 L34 K35 L97 E101	A27-Q31 WeakPolarHBondContact O-CB 3.12Å; A27-Q31 PolarHBondContact O-N 3.25Å; R28-Q31 WeakPolarHBondContact O-CB 3.46Å; R28-Q31 PolarHBondContact O-N 2.87Å; Q31-V33 VanDerWaalsContact C-N 3.33Å; Q31-V33 PolarHBondContact O-N 2.92Å; Q31-L34 PolarHBondContact O-N 2.92Å; Q31-K35 WeakPolarHBondContact O-CB 3.4Å; Q31-K35 PolarHBondContact O-N 3.15Å; Q31-L97 HydrophobicContact CB-CD2 4.36Å; Q31-L97 HydrophobicContact CG-CD2 3.61Å; Q31-L97 WeakPolarHBondContact O-CD2 3.42Å; Q31-E101 PolarHBondContact NE2-OE2 2.74Å
32	D	93.3	Very high	93	Very high	105 Å²	105	35.1 Å²	35.1	56%	0.561	21%	0.205	S	C	*	.	H	α-helix	trans	-64.6	-35.3	-178.1	-74.8	-26.2	0	0	0	112.8	R28	R28-D32 PolarHBondContact O-N 3.37Å
33	V	92.6	Very high	92.9	Very high	54 Å²	54	36 Å²	36	33%	0.327	21%	0.211	S	C	.	.	H	α-helix	trans	-64.6	-42.4	175.6	171	0	0	0	0	111.4	G29 L30 Q31 S36 K45 L63 M67	G29-V33 WeakPolarHBondContact O-CG2 3.27Å; G29-V33 PolarHBondContact O-N 3.33Å; L30-V33 PolarHBondContact O-N 3.46Å; Q31-V33 VanDerWaalsContact C-N 3.33Å; Q31-V33 PolarHBondContact O-N 2.92Å; V33-S36 PolarHBondContact O-OG 2.82Å; V33-K45 WeakPolarHBondContact O-CE 3.29Å; V33-K45 PolarHBondContact O-NZ 3.22Å; V33-L63 HydrophobicContact CG1-CD2 4.31Å; V33-M67 HydrophobicContact CG1-SD 4.49Å
34	L	93.6	Very high	92.7	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-86.3	-21.9	-176.2	-79.6	172.6	0	0	0	113.8	L30 Q31 S36 N37 L63 L64 T93 V96	L30-L34 HydrophobicContact CG-CD1 4.41Å; L30-L34 PolarHBondContact O-N 2.92Å; Q31-L34 PolarHBondContact O-N 2.92Å; L34-S36 PolarHBondContact O-N 3.27Å; L34-N37 WeakPolarHBondContact O-CB 3.3Å; L34-N37 PolarHBondContact O-N 3.44Å; L34-L63 HydrophobicContact CD2-CD1 4.42Å; L34-L63 HydrophobicContact CD2-CD2 3.86Å; L34-L63 HydrophobicContact CG-CD2 4.4Å; L34-L64 HydrophobicContact CD1-CD1 4.29Å; L34-L64 HydrophobicContact CD1-CD2 4.15Å; L34-L64 HydrophobicContact CD1-CG 4.36Å; L34-T93 HydrophobicContact CB-CG2 4.26Å; L34-T93 WeakPolarHBondContact O-CG2 3.29Å; L34-V96 HydrophobicContact CD1-CB 3.68Å; L34-V96 HydrophobicContact CD1-CG1 3.68Å; L34-V96 HydrophobicContact CD1-CG2 3.72Å
35	K	94	Very high	92.6	Very high	43 Å²	43	42.6 Å²	42.6	19%	0.187	24%	0.241	C	C	.	.	H	α-helix	trans	-53.1	-41.9	-178.6	174.7	170.2	168.5	165.9	0	112.7	Q31 N37 L38 L97 V450 N454	Q31-K35 WeakPolarHBondContact O-CB 3.4Å; Q31-K35 PolarHBondContact O-N 3.15Å; K35-N37 PolarHBondContact O-N 3.4Å; K35-L38 PolarHBondContact O-N 3.03Å; K35-L97 HydrophobicContact CB-CD2 3.89Å; K35-V450 HydrophobicContact CD-CG2 3.91Å; K35-V450 HydrophobicContact CG-CB 4.33Å; K35-V450 HydrophobicContact CG-CG1 3.59Å; K35-V450 HydrophobicContact CG-CG2 3.76Å; K35-V450 VanDerWaalsContact O-CG1 3.27Å; K35-V450 WeakPolarHBondContact O-CG1 3.31Å; K35-N454 PolarHBondContact O-ND2 3.49Å
36	S	93	Very high	92.5	Very high	23 Å²	23	44.8 Å²	44.8	16%	0.161	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.5	180	64	0	0	0	0	113.7	V33 L34 G42 T43 K45	V33-S36 PolarHBondContact O-OG 2.82Å; L34-S36 PolarHBondContact O-N 3.27Å; S36-G42 CarbonylContact O-C 3.58Å; S36-G42 WeakPolarHBondContact O-CA 3.42Å; S36-T43 WeakPolarHBondContact CB-OG1 3.42Å; S36-T43 PolarHBondContact O-N 3.33Å; S36-T43 PolarHBondContact O-OG1 2.93Å; S36-K45 WeakPolarHBondContact OG-CE 3.4Å; S36-K45 PolarHBondContact OG-NZ 3.48Å
37	N	91.3	Very high	92.3	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.021	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-20.2	-177.7	-64.7	9.7	0	0	0	112.8	L34 K35 T43 K45 K58 T93	L34-N37 WeakPolarHBondContact O-CB 3.3Å; L34-N37 PolarHBondContact O-N 3.44Å; K35-N37 PolarHBondContact O-N 3.4Å; N37-T43 PolarHBondContact OD1-O 3.16Å; N37-K45 WeakPolarHBondContact OD1-CE 3.3Å; N37-K45 WeakPolarHBondContact OD1-CG 3.44Å; N37-K58 HydrophobicContact CB-CG 4.29Å; N37-K58 WeakPolarHBondContact CB-O 3.48Å; N37-K58 PolarHBondContact ND2-O 3.1Å; N37-K58 WeakPolarHBondContact O-CE 3.39Å; N37-T93 HydrophobicContact CB-CG2 4.41Å
38	L	93.7	Very high	92.1	Very high	15 Å²	15	50.3 Å²	50.3	8%	0.079	28%	0.275	C	S	.	.	S	Bend	trans	-67.8	135.6	-172.3	-172.3	74.7	0	0	0	112.4	K35 T93 S94 L97 I447 V450 L451 N454	K35-L38 PolarHBondContact O-N 3.03Å; L38-T93 HydrophobicContact CB-CG2 4.17Å; L38-T93 HydrophobicContact CD1-CG2 4.16Å; L38-S94 WeakPolarHBondContact CD1-OG 3.27Å; L38-L97 HydrophobicContact CB-CD1 4.01Å; L38-L97 HydrophobicContact CD1-CD1 4.21Å; L38-L97 HydrophobicContact CD2-CD1 3.7Å; L38-L97 HydrophobicContact CG-CD1 4.18Å; L38-I447 HydrophobicContact CD2-CG2 4.4Å; L38-V450 HydrophobicContact CB-CG1 3.9Å; L38-V450 HydrophobicContact CD2-CB 3.89Å; L38-V450 HydrophobicContact CD2-CG1 3.67Å; L38-V450 HydrophobicContact CG-CG1 4.4Å; L38-L451 HydrophobicContact CD2-CD2 4.15Å; L38-L451 HydrophobicContact CD2-CG 4.11Å; L38-L451 HydrophobicContact CG-CD2 4.07Å; L38-N454 PolarHBondContact O-ND2 2.95Å
39	G	91.3	Very high	91.8	Very high	9 Å²	9	49 Å²	49	9%	0.093	28%	0.278	C	S	.	.	S	Bend	trans	79.6	167	173.6	0	0	0	0	0	114.1	K41 G42 K58	G39-K41 VanDerWaalsContact C-N 3.29Å; G39-K41 PolarHBondContact O-N 3.38Å; G39-G42 PolarHBondContact O-N 2.98Å; G39-K58 WeakPolarHBondContact O-CE 3.2Å; G39-K58 PolarHBondContact O-NZ 2.78Å
40	P	90.6	Very high	91.6	Very high	58 Å²	58	51.8 Å²	51.8	38%	0.377	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-30.9	-176.8	27.3	-36.3	0	0	0	113.3	G42 K58 R157 L481	P40-G42 VanDerWaalsContact C-N 3.29Å; P40-G42 PolarHBondContact O-N 3.4Å; P40-K58 PolarHBondContact O-NZ 2.87Å; P40-R157 WeakPolarHBondContact CA-O 3.49Å; P40-R157 HydrophobicContact CB-CB 4.28Å; P40-R157 WeakPolarHBondContact CB-O 3.36Å; P40-L481 HydrophobicContact CG-CD1 3.14Å
41	K	91.4	Very high	91.4	Very high	118 Å²	118	55.9 Å²	55.9	51%	0.513	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-1.1	173.9	-61.9	-67.4	-173.2	172.2	0	114.3	G39 L481	G39-K41 VanDerWaalsContact C-N 3.29Å; G39-K41 PolarHBondContact O-N 3.38Å; K41-L481 HydrophobicContact CG-CB 4.19Å
42	G	89.7	Confident	91.1	Very high	11 Å²	11	57.8 Å²	57.8	11%	0.113	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-63.3	153.8	174.5	0	0	0	0	0	113.4	S36 G39 P40 K58	S36-G42 CarbonylContact O-C 3.58Å; S36-G42 WeakPolarHBondContact O-CA 3.42Å; G39-G42 PolarHBondContact O-N 2.98Å; P40-G42 VanDerWaalsContact C-N 3.29Å; P40-G42 PolarHBondContact O-N 3.4Å; G42-K58 VanDerWaalsContact O-CE 3.29Å; G42-K58 WeakPolarHBondContact O-CE 3.38Å; G42-K58 PolarHBondContact O-NZ 2.98Å
43	T	90.9	Very high	90.8	Very high	81 Å²	81	56.5 Å²	56.5	50%	0.497	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-87	151.6	-178.8	59.4	0	0	0	0	112.2	S36 N37	S36-T43 WeakPolarHBondContact CB-OG1 3.42Å; S36-T43 PolarHBondContact O-N 3.33Å; S36-T43 PolarHBondContact O-OG1 2.93Å; N37-T43 PolarHBondContact OD1-O 3.16Å
44	M	89.9	Confident	90.7	Very high	86 Å²	86	57 Å²	57	42%	0.424	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-84.5	150.1	175.1	-65.7	-171.5	-73.6	0	0	111.2	K58 Q386	M44-K58 HydrophobicContact CG-CB 4.39Å; M44-Q386 PolarHBondContact SD-NE2 3.24Å
45	K	91.2	Very high	90.4	Very high	58 Å²	58	59.4 Å²	59.4	25%	0.252	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.8	173	-58.7	-69.6	-178.6	173.2	0	109.4	V33 S36 N37 T57 L63	V33-K45 WeakPolarHBondContact O-CE 3.29Å; V33-K45 PolarHBondContact O-NZ 3.22Å; S36-K45 WeakPolarHBondContact OG-CE 3.4Å; S36-K45 PolarHBondContact OG-NZ 3.48Å; N37-K45 WeakPolarHBondContact OD1-CE 3.3Å; N37-K45 WeakPolarHBondContact OD1-CG 3.44Å; K45-T57 PolarHBondContact N-O 3.17Å; K45-T57 PolarHBondContact O-N 3.31Å; K45-L63 HydrophobicContact CB-CD1 3.88Å; K45-L63 HydrophobicContact CG-CD1 3.65Å
46	M	91.2	Very high	90.2	Very high	126 Å²	126	59.4 Å²	59.4	62%	0.621	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.6	172.2	-170.4	-174.6	-57.4	0	0	108.5	I54 L56	M46-I54 HydrophobicContact CG-CG2 3.71Å; M46-I54 HydrophobicContact SD-CG2 4.09Å; M46-L56 HydrophobicContact CB-CD2 3.67Å; M46-L56 HydrophobicContact CE-CD2 3.91Å; M46-L56 HydrophobicContact CG-CD2 3.69Å
47	L	90.4	Very high	90	Very high	36 Å²	36	58.6 Å²	58.6	19%	0.188	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	134	176.1	-58.3	176.4	0	0	0	108.3	I54 K55 T57 E66	L47-I54 CarbonylContact O-C 3.2Å; L47-I54 WeakPolarHBondContact O-CA 3.32Å; L47-K55 HydrophobicContact CB-CB 4.47Å; L47-K55 PolarHBondContact N-O 3.32Å; L47-K55 PolarHBondContact O-N 3.42Å; L47-T57 HydrophobicContact CD1-CG2 4.13Å; L47-E66 HydrophobicContact CD1-CB 3.64Å; L47-E66 HydrophobicContact CD1-CG 4.18Å
48	V	90.5	Very high	89.9	Confident	97 Å²	97	59.2 Å²	59.2	59%	0.588	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	114.6	173.8	-174.6	0	0	0	0	107	I54	V48-I54 HydrophobicContact CG2-CG1 4.43Å
49	S	87.6	Confident	89.7	Confident	50 Å²	50	58.8 Å²	58.8	35%	0.35	36%	0.363	S	S	.	.			trans	-71.6	162.7	176.9	65.8	0	0	0	0	111	A51 G52 D53	S49-A51 PolarHBondContact O-N 3.24Å; S49-A51 VanDerWaalsContact O-N 3.12Å; S49-G52 PolarHBondContact O-N 3.26Å; S49-D53 PolarHBondContact N-O 3.44Å; S49-D53 WeakPolarHBondContact OG-CA 3.25Å; S49-D53 WeakPolarHBondContact OG-CB 3.4Å; S49-D53 PolarHBondContact OG-N 3.07Å; S49-D53 PolarHBondContact OG-O 3.44Å; S49-D53 VanDerWaalsContact OG-O 3.07Å
50	G	88.3	Confident	89.6	Confident	94 Å²	94	58.3 Å²	58.3	97%	0.969	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.1	175.9	0	0	0	0	0	114.1	G52	G50-G52 VanDerWaalsContact C-N 3.28Å
51	A	90.8	Very high	89.6	Confident	100 Å²	100	56.3 Å²	56.3	83%	0.826	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.7	173.6	0	0	0	0	0	113.5	S49 D53	S49-A51 PolarHBondContact O-N 3.24Å; S49-A51 VanDerWaalsContact O-N 3.12Å; A51-D53 VanDerWaalsContact C-N 3.33Å
52	G	87.8	Confident	89.5	Confident	46 Å²	46	51.5 Å²	51.5	47%	0.474	33%	0.325	S	S	.	.			trans	81.2	5	-175.5	0	0	0	0	0	114.6	S49 G50 I54	S49-G52 PolarHBondContact O-N 3.26Å; G50-G52 VanDerWaalsContact C-N 3.28Å; G52-I54 PolarHBondContact O-N 3.24Å
53	D	87.8	Confident	89.6	Confident	78 Å²	78	51 Å²	51	42%	0.417	32%	0.319	S	S	.	.			trans	-69.1	130.2	171.7	-161.5	13.6	0	0	0	109.1	S49 A51 K381 H382	S49-D53 PolarHBondContact N-O 3.44Å; S49-D53 WeakPolarHBondContact OG-CA 3.25Å; S49-D53 WeakPolarHBondContact OG-CB 3.4Å; S49-D53 PolarHBondContact OG-N 3.07Å; S49-D53 PolarHBondContact OG-O 3.44Å; S49-D53 VanDerWaalsContact OG-O 3.07Å; A51-D53 VanDerWaalsContact C-N 3.33Å; D53-K381 IonicContact OD2-NZ 2.68Å; D53-H382 IonicContact OD1-CE1 2.74Å
54	I	89.3	Confident	89.6	Confident	65 Å²	65	47.6 Å²	47.6	33%	0.333	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	141.1	-179.5	-57.7	175.4	0	0	0	107.4	M46 L47 V48 G52 H382	M46-I54 HydrophobicContact CG-CG2 3.71Å; M46-I54 HydrophobicContact SD-CG2 4.09Å; L47-I54 CarbonylContact O-C 3.2Å; L47-I54 WeakPolarHBondContact O-CA 3.32Å; V48-I54 HydrophobicContact CG2-CG1 4.43Å; G52-I54 PolarHBondContact O-N 3.24Å; I54-H382 PolarHBondContact O-CE1 2.94Å; I54-H382 PolarHBondContact O-ND1 3.43Å
55	K	88	Confident	89.6	Confident	50 Å²	50	49.1 Å²	49.1	22%	0.217	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	126.7	172.6	-164.5	170.5	-179	179.2	0	108.9	L47 V62 E66	L47-K55 HydrophobicContact CB-CB 4.47Å; L47-K55 PolarHBondContact N-O 3.32Å; L47-K55 PolarHBondContact O-N 3.42Å; K55-V62 HydrophobicContact CD-CG1 4.1Å; K55-V62 VanDerWaalsContact CE-CG1 3.41Å; K55-E66 HydrophobicContact CD-CG 4.26Å; K55-E66 IonicContact NZ-OE1 3.59Å; K55-E66 PolarHBondContact NZ-OE1 3.38Å
56	L	90.2	Very high	89.4	Confident	43 Å²	43	50.9 Å²	50.9	23%	0.225	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.5	173.7	-67	172.6	0	0	0	107.5	M46 H382	M46-L56 HydrophobicContact CB-CD2 3.67Å; M46-L56 HydrophobicContact CE-CD2 3.91Å; M46-L56 HydrophobicContact CG-CD2 3.69Å; L56-H382 HydrophobicContact CD1-CB 4.47Å
57	T	88.8	Confident	89.3	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.031	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	145.7	177.1	-171.7	0	0	0	0	111.4	K45 L47 D59 V62 L63	K45-T57 PolarHBondContact N-O 3.17Å; K45-T57 PolarHBondContact O-N 3.31Å; L47-T57 HydrophobicContact CD1-CG2 4.13Å; T57-D59 PolarHBondContact OG1-N 3.29Å; T57-V62 HydrophobicContact CG2-CB 4.25Å; T57-V62 HydrophobicContact CG2-CG1 3.85Å; T57-L63 HydrophobicContact CG2-CB 4.29Å
58	K	89.4	Confident	89.1	Confident	17 Å²	17	55.4 Å²	55.4	7%	0.074	33%	0.332	C	S	.	.			trans	-108.2	-12.8	164.4	-171.2	161.3	168.4	-171.7	0	111.6	N37 G39 P40 G42 M44 T158	N37-K58 HydrophobicContact CB-CG 4.29Å; N37-K58 WeakPolarHBondContact CB-O 3.48Å; N37-K58 PolarHBondContact ND2-O 3.1Å; N37-K58 WeakPolarHBondContact O-CE 3.39Å; G39-K58 WeakPolarHBondContact O-CE 3.2Å; G39-K58 PolarHBondContact O-NZ 2.78Å; P40-K58 PolarHBondContact O-NZ 2.87Å; G42-K58 VanDerWaalsContact O-CE 3.29Å; G42-K58 WeakPolarHBondContact O-CE 3.38Å; G42-K58 PolarHBondContact O-NZ 2.98Å; M44-K58 HydrophobicContact CG-CB 4.39Å; K58-T158 WeakPolarHBondContact CD-O 3.48Å; K58-T158 WeakPolarHBondContact CE-O 3.36Å; K58-T158 PolarHBondContact NZ-O 3.44Å
59	D	89.1	Confident	89.1	Confident	6 Å²	6	52.9 Å²	52.9	3%	0.032	32%	0.315	C	S	.	.			trans	-74.3	132.9	-179.4	-180	41.6	0	0	0	111.8	T57 N61 V62 L63 T92 K159	T57-D59 PolarHBondContact OG1-N 3.29Å; D59-N61 VanDerWaalsContact OD2-CB 3.27Å; D59-N61 WeakPolarHBondContact OD2-CB 3.34Å; D59-N61 PolarHBondContact OD2-N 3.45Å; D59-V62 HydrophobicContact CB-CB 4.34Å; D59-V62 HydrophobicContact CB-CG2 4.17Å; D59-V62 WeakPolarHBondContact OD2-CG2 3.25Å; D59-V62 PolarHBondContact OD2-N 3.35Å; D59-V62 VanDerWaalsContact OD2-N 3.09Å; D59-L63 WeakPolarHBondContact O-CB 3.5Å; D59-L63 PolarHBondContact O-N 3.08Å; D59-T92 PolarHBondContact OD1-OG1 3.47Å; D59-K159 HydrophobicContact CB-CD 4.22Å; D59-K159 VanDerWaalsContact CG-NZ 3.31Å; D59-K159 IonicContact OD1-NZ 3.89Å; D59-K159 PolarHBondContact OD1-NZ 2.95Å
60	G	89.1	Confident	89.1	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-67.5	-37.9	179.5	0	0	0	0	0	112	L63 L64	G60-L63 PolarHBondContact O-N 3.4Å; G60-L64 WeakPolarHBondContact O-CB 3.37Å; G60-L64 WeakPolarHBondContact O-CD1 3.37Å; G60-L64 WeakPolarHBondContact O-CG 3.3Å; G60-L64 PolarHBondContact O-N 3.19Å
61	N	90.5	Very high	89.2	Confident	16 Å²	16	57.8 Å²	57.8	9%	0.086	31%	0.307	C	S	.	.	H	α-helix	trans	-65.5	-48.8	-179.2	-171.2	36	0	0	0	111.1	D59 L63 L64 H65 T82 D85 T92	D59-N61 VanDerWaalsContact OD2-CB 3.27Å; D59-N61 WeakPolarHBondContact OD2-CB 3.34Å; D59-N61 PolarHBondContact OD2-N 3.45Å; N61-L63 VanDerWaalsContact C-N 3.3Å; N61-L63 PolarHBondContact O-N 2.63Å; N61-L64 PolarHBondContact O-N 3.46Å; N61-H65 PolarHBondContact O-CD2 3.07Å; N61-H65 PolarHBondContact O-N 2.6Å; N61-H65 PolarHBondContact OD1-CD2 3.32Å; N61-H65 PolarHBondContact OD1-NE2 3.07Å; N61-T82 PolarHBondContact OD1-OG1 2.9Å; N61-D85 HydrophobicContact CB-CB 4.05Å; N61-D85 WeakPolarHBondContact ND2-CB 3.37Å; N61-D85 PolarHBondContact ND2-OD2 3.37Å; N61-T92 HydrophobicContact CB-CG2 3.84Å; N61-T92 PolarHBondContact N-OG1 3.49Å
62	V	89.4	Confident	89.2	Confident	16 Å²	16	57.1 Å²	57.1	10%	0.097	30%	0.295	C	S	.	.	H	α-helix	trans	-56.4	-45.3	175.1	175.8	0	0	0	0	111.2	K55 T57 D59 L64 H65 E66	K55-V62 HydrophobicContact CD-CG1 4.1Å; K55-V62 VanDerWaalsContact CE-CG1 3.41Å; T57-V62 HydrophobicContact CG2-CB 4.25Å; T57-V62 HydrophobicContact CG2-CG1 3.85Å; D59-V62 HydrophobicContact CB-CB 4.34Å; D59-V62 HydrophobicContact CB-CG2 4.17Å; D59-V62 WeakPolarHBondContact OD2-CG2 3.25Å; D59-V62 PolarHBondContact OD2-N 3.35Å; D59-V62 VanDerWaalsContact OD2-N 3.09Å; V62-L64 PolarHBondContact O-N 2.62Å; V62-H65 PolarHBondContact O-N 3.43Å; V62-E66 HydrophobicContact CG1-CG 4.2Å; V62-E66 WeakPolarHBondContact O-CB 3.33Å; V62-E66 WeakPolarHBondContact O-CG 3.41Å; V62-E66 PolarHBondContact O-N 2.87Å; V62-E66 VanDerWaalsContact O-N 3.09Å
63	L	91.4	Very high	89.4	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-42.9	-179.9	-176.2	147.4	0	0	0	112.2	V33 L34 K45 T57 D59 G60 N61 H65 E66 M67	V33-L63 HydrophobicContact CG1-CD2 4.31Å; L34-L63 HydrophobicContact CD2-CD1 4.42Å; L34-L63 HydrophobicContact CD2-CD2 3.86Å; L34-L63 HydrophobicContact CG-CD2 4.4Å; K45-L63 HydrophobicContact CB-CD1 3.88Å; K45-L63 HydrophobicContact CG-CD1 3.65Å; T57-L63 HydrophobicContact CG2-CB 4.29Å; D59-L63 WeakPolarHBondContact O-CB 3.5Å; D59-L63 PolarHBondContact O-N 3.08Å; G60-L63 PolarHBondContact O-N 3.4Å; N61-L63 VanDerWaalsContact C-N 3.3Å; N61-L63 PolarHBondContact O-N 2.63Å; L63-H65 VanDerWaalsContact C-N 3.35Å; L63-H65 PolarHBondContact O-N 3.1Å; L63-E66 PolarHBondContact O-N 3.16Å; L63-M67 HydrophobicContact CD2-CG 4.25Å; L63-M67 HydrophobicContact CD2-SD 3.27Å; L63-M67 WeakPolarHBondContact CD2-SD 3.19Å; L63-M67 HydrophobicContact CG-CG 4.4Å; L63-M67 HydrophobicContact CG-SD 3.83Å; L63-M67 VanDerWaalsContact O-CB 3.32Å; L63-M67 WeakPolarHBondContact O-CB 3.43Å; L63-M67 VanDerWaalsContact O-CG 3.24Å; L63-M67 WeakPolarHBondContact O-CG 3.32Å; L63-M67 PolarHBondContact O-N 3.29Å
64	L	91.3	Very high	89.7	Confident	9 Å²	9	52.1 Å²	52.1	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-69.4	-30.3	-179.2	-69.7	169.3	0	0	0	113.2	L30 L34 G60 N61 V62 I69 A78 A81 V96	L30-L64 HydrophobicContact CD1-CD2 3.85Å; L30-L64 HydrophobicContact CD2-CD2 4.13Å; L30-L64 HydrophobicContact CG-CD2 4.35Å; L34-L64 HydrophobicContact CD1-CD1 4.29Å; L34-L64 HydrophobicContact CD1-CD2 4.15Å; L34-L64 HydrophobicContact CD1-CG 4.36Å; G60-L64 WeakPolarHBondContact O-CB 3.37Å; G60-L64 WeakPolarHBondContact O-CD1 3.37Å; G60-L64 WeakPolarHBondContact O-CG 3.3Å; G60-L64 PolarHBondContact O-N 3.19Å; N61-L64 PolarHBondContact O-N 3.46Å; V62-L64 PolarHBondContact O-N 2.62Å; L64-I69 HydrophobicContact CD2-CD1 4.03Å; L64-A78 HydrophobicContact CB-CB 4.25Å; L64-A78 HydrophobicContact CD2-CB 3.96Å; L64-A78 HydrophobicContact CG-CB 4.47Å; L64-A81 HydrophobicContact CD1-CB 3.48Å; L64-A81 VanDerWaalsContact CD1-CB 3.48Å; L64-V96 HydrophobicContact CD1-CG2 4.1Å
65	H	89.5	Confident	89.8	Confident	118 Å²	118	50.9 Å²	50.9	55%	0.546	26%	0.256	S	S	.	.	H	α-helix	trans	-75.9	-38.2	174.8	-89.6	-65.6	0	0	0	113.7	N61 V62 L63 T82	N61-H65 PolarHBondContact O-CD2 3.07Å; N61-H65 PolarHBondContact O-N 2.6Å; N61-H65 PolarHBondContact OD1-CD2 3.32Å; N61-H65 PolarHBondContact OD1-NE2 3.07Å; V62-H65 PolarHBondContact O-N 3.43Å; L63-H65 VanDerWaalsContact C-N 3.35Å; L63-H65 PolarHBondContact O-N 3.1Å; H65-T82 WeakPolarHBondContact NE2-CG2 3.38Å; H65-T82 PolarHBondContact NE2-OG1 3.49Å
66	E	87.9	Confident	90.1	Very high	95 Å²	95	52.2 Å²	52.2	44%	0.444	27%	0.265	S	S	.	.	H	α-helix	trans	-80.9	-26.6	-176.9	-64.1	-73.6	179.5	0	0	112	L47 K55 V62 L63	L47-E66 HydrophobicContact CD1-CB 3.64Å; L47-E66 HydrophobicContact CD1-CG 4.18Å; K55-E66 HydrophobicContact CD-CG 4.26Å; K55-E66 IonicContact NZ-OE1 3.59Å; K55-E66 PolarHBondContact NZ-OE1 3.38Å; V62-E66 HydrophobicContact CG1-CG 4.2Å; V62-E66 WeakPolarHBondContact O-CB 3.33Å; V62-E66 WeakPolarHBondContact O-CG 3.41Å; V62-E66 PolarHBondContact O-N 2.87Å; V62-E66 VanDerWaalsContact O-N 3.09Å; L63-E66 PolarHBondContact O-N 3.16Å
67	M	87.4	Confident	90.2	Very high	71 Å²	71	50.2 Å²	50.2	35%	0.35	25%	0.254	S	S	.	.	S	Bend	trans	-75.9	130	177.1	-76.3	-175	65.8	0	0	112.1	V33 L63 I69	V33-M67 HydrophobicContact CG1-SD 4.49Å; L63-M67 HydrophobicContact CD2-CG 4.25Å; L63-M67 HydrophobicContact CD2-SD 3.27Å; L63-M67 WeakPolarHBondContact CD2-SD 3.19Å; L63-M67 HydrophobicContact CG-CG 4.4Å; L63-M67 HydrophobicContact CG-SD 3.83Å; L63-M67 VanDerWaalsContact O-CB 3.32Å; L63-M67 WeakPolarHBondContact O-CB 3.43Å; L63-M67 VanDerWaalsContact O-CG 3.24Å; L63-M67 WeakPolarHBondContact O-CG 3.32Å; L63-M67 PolarHBondContact O-N 3.29Å; M67-I69 HydrophobicContact CB-CG1 4.25Å; M67-I69 PolarHBondContact O-N 3.09Å
68	Q	88	Confident	90.5	Very high	186 Å²	186	50.4 Å²	50.4	87%	0.869	26%	0.256	S	S	*	.			trans	-78	87.2	171.7	-66.3	-178.5	1.6	0	0	110.6	Q70	Q68-Q70 PolarHBondContact O-N 3.43Å
69	I	89.6	Confident	90.6	Very high	45 Å²	45	56.6 Å²	56.6	23%	0.231	28%	0.283	C	S	.	.			trans	-79.2	113.2	-178.2	-57.8	171.7	0	0	0	110.4	L64 M67 A74 A78	L64-I69 HydrophobicContact CD2-CD1 4.03Å; M67-I69 HydrophobicContact CB-CG1 4.25Å; M67-I69 PolarHBondContact O-N 3.09Å; I69-A74 HydrophobicContact CG2-CB 3.5Å; I69-A74 VanDerWaalsContact CG2-CB 3.5Å; I69-A78 HydrophobicContact CD1-CB 3.53Å
70	Q	88.3	Confident	90.7	Very high	185 Å²	185	57.4 Å²	57.4	86%	0.864	29%	0.288	S	S	*	.			trans	-87.1	-31.2	178.9	-62.9	-176.8	-2.1	0	0	113.3	Q68	Q68-Q70 PolarHBondContact O-N 3.43Å
71	H	89.7	Confident	90.9	Very high	61 Å²	61	57.5 Å²	57.5	28%	0.282	29%	0.289	S	S	.	.	S	Bend	trans	-74.5	125.6	-175.5	-165.2	-73.6	0	0	0	110.8	V22 A26 T73 A74 S75	V22-H71 WeakPolarHBondContact CG1-NE2 3.09Å; A26-H71 HydrophobicContact CB-CB 4.45Å; A26-H71 WeakPolarHBondContact CB-CE1 3.09Å; A26-H71 VanDerWaalsContact CB-ND1 3.27Å; A26-H71 WeakPolarHBondContact CB-ND1 3.18Å; H71-T73 PolarHBondContact CE1-OG1 3.46Å; H71-T73 WeakPolarHBondContact ND1-CB 3.22Å; H71-T73 PolarHBondContact ND1-N 3.47Å; H71-T73 PolarHBondContact ND1-OG1 3.39Å; H71-T73 PolarHBondContact O-N 3.19Å; H71-A74 HydrophobicContact CB-CB 4.06Å; H71-A74 PolarHBondContact O-N 3.04Å; H71-S75 PolarHBondContact O-N 2.86Å
72	P	90.9	Very high	90.9	Very high	87 Å²	87	57.8 Å²	57.8	57%	0.565	29%	0.291	S	S	*	.	H	α-helix	trans	-56.8	-44.5	-175.3	-26.6	34.2	0	0	0	113.6	S75 L76	P72-S75 WeakPolarHBondContact O-CB 3.34Å; P72-S75 PolarHBondContact O-N 3.39Å; P72-L76 PolarHBondContact O-N 3.2Å
73	T	92.1	Very high	91.1	Very high	10 Å²	10	59.2 Å²	59.2	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-42.8	179.4	-39.5	0	0	0	0	112.1	N23 H71 S75 L76 I77 I515	N23-T73 HydrophobicContact CB-CG2 4.04Å; N23-T73 PolarHBondContact OD1-OG1 3.08Å; H71-T73 PolarHBondContact CE1-OG1 3.46Å; H71-T73 WeakPolarHBondContact ND1-CB 3.22Å; H71-T73 PolarHBondContact ND1-N 3.47Å; H71-T73 PolarHBondContact ND1-OG1 3.39Å; H71-T73 PolarHBondContact O-N 3.19Å; T73-S75 VanDerWaalsContact C-N 3.32Å; T73-S75 PolarHBondContact O-N 3.27Å; T73-L76 PolarHBondContact O-N 3.41Å; T73-I77 HydrophobicContact CG2-CD1 4.4Å; T73-I77 VanDerWaalsContact O-CG1 3.32Å; T73-I77 WeakPolarHBondContact O-CG1 3.28Å; T73-I77 PolarHBondContact O-N 3.03Å; T73-I515 HydrophobicContact CG2-CD1 3.87Å; T73-I515 HydrophobicContact CG2-CG1 4.23Å; T73-I515 HydrophobicContact CG2-CG2 3.95Å
74	A	93.1	Very high	91.1	Very high	8 Å²	8	59.3 Å²	59.3	7%	0.066	31%	0.305	C	S	.	.	H	α-helix	trans	-66.5	-36.3	175.8	0	0	0	0	0	111.1	L30 I69 H71 I77 A78	L30-A74 HydrophobicContact CD2-CB 4.27Å; I69-A74 HydrophobicContact CG2-CB 3.5Å; I69-A74 VanDerWaalsContact CG2-CB 3.5Å; H71-A74 HydrophobicContact CB-CB 4.06Å; H71-A74 PolarHBondContact O-N 3.04Å; A74-I77 PolarHBondContact O-N 2.92Å; A74-A78 VanDerWaalsContact O-CB 3.26Å; A74-A78 WeakPolarHBondContact O-CB 3.34Å; A74-A78 PolarHBondContact O-N 3.47Å
75	S	93.2	Very high	91.1	Very high	40 Å²	40	59.3 Å²	59.3	28%	0.28	31%	0.305	S	S	.	.	H	α-helix	trans	-64.9	-39.2	174.3	-176.8	0	0	0	0	111.9	H71 P72 T73 A78 K79	H71-S75 PolarHBondContact O-N 2.86Å; P72-S75 WeakPolarHBondContact O-CB 3.34Å; P72-S75 PolarHBondContact O-N 3.39Å; T73-S75 VanDerWaalsContact C-N 3.32Å; T73-S75 PolarHBondContact O-N 3.27Å; S75-A78 PolarHBondContact O-N 3.41Å; S75-K79 WeakPolarHBondContact O-CG 3.35Å; S75-K79 PolarHBondContact O-N 3.19Å
76	L	92.6	Very high	91.1	Very high	78 Å²	78	58.8 Å²	58.8	41%	0.408	31%	0.307	S	S	.	.	H	α-helix	trans	-64.8	-46.2	175.6	-171.8	151.7	0	0	0	111.3	P72 T73 A78 K79 V80 I511 I515	P72-L76 PolarHBondContact O-N 3.2Å; T73-L76 PolarHBondContact O-N 3.41Å; L76-A78 VanDerWaalsContact C-N 3.33Å; L76-A78 PolarHBondContact O-N 2.92Å; L76-K79 PolarHBondContact O-N 3.45Å; L76-V80 VanDerWaalsContact O-CG2 3.31Å; L76-V80 WeakPolarHBondContact O-CG2 3.4Å; L76-V80 PolarHBondContact O-N 2.96Å; L76-I511 HydrophobicContact CD2-CD1 3.94Å; L76-I511 HydrophobicContact CD2-CG2 3.64Å; L76-I515 HydrophobicContact CD2-CD1 4.25Å; L76-I515 HydrophobicContact CD2-CG1 4.42Å
77	I	93.9	Very high	91.1	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-42.2	175.4	-65.2	168.8	0	0	0	110.8	A27 L30 T73 A74 K79 V80 A81 V96 I99 I511 I515	A27-I77 HydrophobicContact CB-CD1 3.74Å; L30-I77 HydrophobicContact CD2-CB 4.15Å; L30-I77 HydrophobicContact CD2-CG2 3.86Å; T73-I77 HydrophobicContact CG2-CD1 4.4Å; T73-I77 VanDerWaalsContact O-CG1 3.32Å; T73-I77 WeakPolarHBondContact O-CG1 3.28Å; T73-I77 PolarHBondContact O-N 3.03Å; A74-I77 PolarHBondContact O-N 2.92Å; I77-K79 PolarHBondContact O-N 3.36Å; I77-V80 WeakPolarHBondContact O-CB 3.4Å; I77-V80 PolarHBondContact O-N 3.49Å; I77-A81 PolarHBondContact O-N 2.99Å; I77-V96 HydrophobicContact CG2-CB 4.34Å; I77-V96 HydrophobicContact CG2-CG1 3.94Å; I77-V96 HydrophobicContact CG2-CG2 3.93Å; I77-I99 HydrophobicContact CD1-CG2 3.92Å; I77-I99 HydrophobicContact CG1-CG2 4.08Å; I77-I99 HydrophobicContact CG2-CD1 4.23Å; I77-I511 HydrophobicContact CG1-CG2 4.48Å; I77-I515 HydrophobicContact CD1-CD1 4.11Å; I77-I515 HydrophobicContact CG1-CD1 3.9Å
78	A	94.2	Very high	91.1	Very high	8 Å²	8	56.2 Å²	56.2	7%	0.066	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-44.6	178.1	0	0	0	0	0	112.4	L64 I69 A74 S75 L76 V80 A81 T82	L64-A78 HydrophobicContact CB-CB 4.25Å; L64-A78 HydrophobicContact CD2-CB 3.96Å; L64-A78 HydrophobicContact CG-CB 4.47Å; I69-A78 HydrophobicContact CD1-CB 3.53Å; A74-A78 VanDerWaalsContact O-CB 3.26Å; A74-A78 WeakPolarHBondContact O-CB 3.34Å; A74-A78 PolarHBondContact O-N 3.47Å; S75-A78 PolarHBondContact O-N 3.41Å; L76-A78 VanDerWaalsContact C-N 3.33Å; L76-A78 PolarHBondContact O-N 2.92Å; A78-V80 VanDerWaalsContact C-N 3.25Å; A78-V80 PolarHBondContact O-N 3.18Å; A78-A81 PolarHBondContact O-N 3.05Å; A78-T82 PolarHBondContact O-N 3.1Å; A78-T82 PolarHBondContact O-OG1 2.82Å
79	K	92	Very high	91	Very high	148 Å²	148	47.4 Å²	47.4	64%	0.643	26%	0.255	S	S	*	.	H	α-helix	trans	-61.2	-34.1	177.2	-73.8	175.3	-177.4	-177.8	0	112.9	S75 L76 I77 T82 A83	S75-K79 WeakPolarHBondContact O-CG 3.35Å; S75-K79 PolarHBondContact O-N 3.19Å; L76-K79 PolarHBondContact O-N 3.45Å; I77-K79 PolarHBondContact O-N 3.36Å; K79-T82 PolarHBondContact O-N 3.17Å; K79-A83 PolarHBondContact O-N 3.29Å
80	V	91.5	Very high	91	Very high	23 Å²	23	47 Å²	47	14%	0.139	25%	0.253	C	S	.	.	H	α-helix	trans	-71.2	-41.6	177.4	175.1	0	0	0	0	110.4	L76 I77 A78 T82 A83 Q84 I511	L76-V80 VanDerWaalsContact O-CG2 3.31Å; L76-V80 WeakPolarHBondContact O-CG2 3.4Å; L76-V80 PolarHBondContact O-N 2.96Å; I77-V80 WeakPolarHBondContact O-CB 3.4Å; I77-V80 PolarHBondContact O-N 3.49Å; A78-V80 VanDerWaalsContact C-N 3.25Å; A78-V80 PolarHBondContact O-N 3.18Å; V80-T82 VanDerWaalsContact C-N 3.31Å; V80-T82 PolarHBondContact O-N 3.18Å; V80-A83 PolarHBondContact O-N 2.99Å; V80-Q84 PolarHBondContact O-N 3.15Å; V80-I511 HydrophobicContact CB-CG1 4.25Å; V80-I511 HydrophobicContact CG1-CG1 3.9Å; V80-I511 HydrophobicContact CG2-CB 4.5Å; V80-I511 HydrophobicContact CG2-CD1 3.36Å; V80-I511 HydrophobicContact CG2-CG1 3.47Å; V80-I511 VanDerWaalsContact CG2-CG1 3.47Å; V80-I511 HydrophobicContact CG2-CG2 4.38Å
81	A	91.8	Very high	91	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-38.6	173.9	0	0	0	0	0	111.8	L64 I77 A78 Q84 D85 T92 V96	L64-A81 HydrophobicContact CD1-CB 3.48Å; L64-A81 VanDerWaalsContact CD1-CB 3.48Å; I77-A81 PolarHBondContact O-N 2.99Å; A78-A81 PolarHBondContact O-N 3.05Å; A81-Q84 WeakPolarHBondContact O-CB 3.3Å; A81-Q84 PolarHBondContact O-N 3.35Å; A81-D85 PolarHBondContact O-N 2.94Å; A81-D85 VanDerWaalsContact O-N 3.1Å; A81-T92 WeakPolarHBondContact O-CG2 3.39Å; A81-V96 HydrophobicContact CB-CG2 3.89Å
82	T	91.6	Very high	91.2	Very high	22 Å²	22	35.6 Å²	35.6	14%	0.135	20%	0.202	C	C	.	.	H	α-helix	trans	-61.2	-45.1	171	-58.7	0	0	0	0	111.7	N61 H65 A78 K79 V80 Q84 D85 D86	N61-T82 PolarHBondContact OD1-OG1 2.9Å; H65-T82 WeakPolarHBondContact NE2-CG2 3.38Å; H65-T82 PolarHBondContact NE2-OG1 3.49Å; A78-T82 PolarHBondContact O-N 3.1Å; A78-T82 PolarHBondContact O-OG1 2.82Å; K79-T82 PolarHBondContact O-N 3.17Å; V80-T82 VanDerWaalsContact C-N 3.31Å; V80-T82 PolarHBondContact O-N 3.18Å; T82-Q84 VanDerWaalsContact C-N 3.25Å; T82-Q84 PolarHBondContact O-N 2.83Å; T82-D85 WeakPolarHBondContact O-CB 3.49Å; T82-D85 PolarHBondContact O-N 3.25Å; T82-D86 PolarHBondContact O-N 2.98Å
83	A	92.6	Very high	91.3	Very high	46 Å²	46	32 Å²	32	38%	0.38	18%	0.178	S	C	.	.	H	α-helix	trans	-62.4	-33.1	177.4	0	0	0	0	0	112.7	K79 V80 I87	K79-A83 PolarHBondContact O-N 3.29Å; V80-A83 PolarHBondContact O-N 2.99Å; A83-I87 WeakPolarHBondContact O-CG1 3.49Å; A83-I87 PolarHBondContact O-N 2.96Å
84	Q	91.8	Very high	91.4	Very high	3 Å²	3	32.5 Å²	32.5	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-43.4	172	-178.7	69.5	28.2	0	0	111.4	V80 A81 T82 T88 V500	V80-Q84 PolarHBondContact O-N 3.15Å; A81-Q84 WeakPolarHBondContact O-CB 3.3Å; A81-Q84 PolarHBondContact O-N 3.35Å; T82-Q84 VanDerWaalsContact C-N 3.25Å; T82-Q84 PolarHBondContact O-N 2.83Å; Q84-T88 PolarHBondContact NE2-OG1 3.17Å; Q84-T88 PolarHBondContact O-N 3.34Å; Q84-T88 PolarHBondContact O-OG1 2.98Å; Q84-V500 PolarHBondContact NE2-O 3.41Å
85	D	91.6	Very high	91.5	Very high	9 Å²	9	32.1 Å²	32.1	5%	0.048	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-42.1	177	-164.7	77.4	0	0	0	112.5	N61 A81 T82 I87 G89 T92 R396	N61-D85 HydrophobicContact CB-CB 4.05Å; N61-D85 WeakPolarHBondContact ND2-CB 3.37Å; N61-D85 PolarHBondContact ND2-OD2 3.37Å; A81-D85 PolarHBondContact O-N 2.94Å; A81-D85 VanDerWaalsContact O-N 3.1Å; T82-D85 WeakPolarHBondContact O-CB 3.49Å; T82-D85 PolarHBondContact O-N 3.25Å; D85-I87 VanDerWaalsContact C-N 3.28Å; D85-I87 PolarHBondContact O-N 2.81Å; D85-G89 WeakPolarHBondContact O-CA 3.39Å; D85-G89 PolarHBondContact O-N 3.25Å; D85-T92 HydrophobicContact CB-CG2 3.61Å; D85-R396 PolarHBondContact O-NH1 2.95Å; D85-R396 VanDerWaalsContact O-NH1 3.1Å; D85-R396 IonicContact OD1-NH1 3.05Å; D85-R396 IonicContact OD2-NH1 3.57Å; D85-R396 PolarHBondContact OD2-NH1 3.33Å
86	D	89.6	Confident	91.6	Very high	108 Å²	108	30.2 Å²	30.2	58%	0.578	17%	0.166	S	C	*	.	H	α-helix	trans	-62.5	-37.3	-178.4	-74.3	-26	0	0	0	111.9	T82	T82-D86 PolarHBondContact O-N 2.98Å
87	I	88.3	Confident	91.8	Very high	109 Å²	109	26.5 Å²	26.5	56%	0.559	15%	0.146	S	C	*	.	H	α-helix	trans	-83.9	-50.7	-179.7	-62.9	172.6	0	0	0	111.3	A83 D85	A83-I87 WeakPolarHBondContact O-CG1 3.49Å; A83-I87 PolarHBondContact O-N 2.96Å; D85-I87 VanDerWaalsContact C-N 3.28Å; D85-I87 PolarHBondContact O-N 2.81Å
88	T	87.8	Confident	91.9	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-110.5	-24.3	-167.3	68	0	0	0	0	113.6	Q84 D90 N400 V500 Q503	Q84-T88 PolarHBondContact NE2-OG1 3.17Å; Q84-T88 PolarHBondContact O-N 3.34Å; Q84-T88 PolarHBondContact O-OG1 2.98Å; T88-D90 PolarHBondContact O-N 3.06Å; T88-D90 PolarHBondContact OG1-O 3.32Å; T88-D90 VanDerWaalsContact OG1-O 3.07Å; T88-N400 PolarHBondContact O-ND2 3.05Å; T88-V500 HydrophobicContact CG2-CG2 4.43Å; T88-Q503 HydrophobicContact CG2-CB 4.21Å
89	G	85.6	Confident	92	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	73.9	3	-179.5	0	0	0	0	0	116.5	D85 R396	D85-G89 WeakPolarHBondContact O-CA 3.39Å; D85-G89 PolarHBondContact O-N 3.25Å; G89-R396 VanDerWaalsContact CA-CD 3.4Å
90	D	88.2	Confident	92.2	Very high	36 Å²	36	19.2 Å²	19.2	19%	0.193	11%	0.113	C	C	.	.	S	Bend	trans	-149.8	171.7	176.3	-153.8	-10.4	0	0	0	110.4	T88 T92 S155 V500	T88-D90 PolarHBondContact O-N 3.06Å; T88-D90 PolarHBondContact OG1-O 3.32Å; T88-D90 VanDerWaalsContact OG1-O 3.07Å; D90-T92 VanDerWaalsContact C-N 3.33Å; D90-T92 PolarHBondContact O-N 3.33Å; D90-S155 PolarHBondContact OD2-OG 3.38Å; D90-V500 HydrophobicContact CB-CG2 4.38Å
91	G	89.7	Confident	92.4	Very high	6 Å²	6	18.4 Å²	18.4	6%	0.062	11%	0.108	C	C	.	.			trans	79.9	10.4	176.9	0	0	0	0	0	114.8	S94 N95	G91-S94 PolarHBondContact O-N 3.01Å; G91-N95 WeakPolarHBondContact O-CB 3.32Å; G91-N95 PolarHBondContact O-N 3.19Å
92	T	92.6	Very high	92.6	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-59.3	-48.6	178	55.1	0	0	0	0	112.5	D59 N61 A81 D85 D90 N95 V96	D59-T92 PolarHBondContact OD1-OG1 3.47Å; N61-T92 HydrophobicContact CB-CG2 3.84Å; N61-T92 PolarHBondContact N-OG1 3.49Å; A81-T92 WeakPolarHBondContact O-CG2 3.39Å; D85-T92 HydrophobicContact CB-CG2 3.61Å; D90-T92 VanDerWaalsContact C-N 3.33Å; D90-T92 PolarHBondContact O-N 3.33Å; T92-N95 WeakPolarHBondContact O-CB 3.41Å; T92-N95 PolarHBondContact O-N 3.47Å; T92-V96 PolarHBondContact O-N 3.27Å
93	T	93.8	Very high	92.8	Very high	12 Å²	12	17.3 Å²	17.3	7%	0.074	10%	0.101	C	C	.	.	H	α-helix	trans	-61.4	-48.6	176.3	-53.7	0	0	0	0	110.9	L34 N37 L38 N95 V96 L97	L34-T93 HydrophobicContact CB-CG2 4.26Å; L34-T93 WeakPolarHBondContact O-CG2 3.29Å; N37-T93 HydrophobicContact CB-CG2 4.41Å; L38-T93 HydrophobicContact CB-CG2 4.17Å; L38-T93 HydrophobicContact CD1-CG2 4.16Å; T93-N95 VanDerWaalsContact C-N 3.27Å; T93-N95 PolarHBondContact O-N 3.35Å; T93-V96 PolarHBondContact O-N 3.38Å; T93-L97 HydrophobicContact CG2-CD1 4.14Å; T93-L97 HydrophobicContact CG2-CG 4.45Å; T93-L97 VanDerWaalsContact O-CG 3.32Å; T93-L97 WeakPolarHBondContact O-CG 3.31Å; T93-L97 PolarHBondContact O-N 3.27Å; T93-L97 VanDerWaalsContact O-N 3.07Å
94	S	94.6	Very high	92.9	Very high	20 Å²	20	18.8 Å²	18.8	14%	0.14	10%	0.099	C	C	.	.	H	α-helix	trans	-59.1	-38.6	-179.7	-54.9	0	0	0	0	112.3	L38 G91 L97 I98	L38-S94 WeakPolarHBondContact CD1-OG 3.27Å; G91-S94 PolarHBondContact O-N 3.01Å; S94-L97 PolarHBondContact O-N 2.92Å; S94-I98 WeakPolarHBondContact O-CG1 3.32Å; S94-I98 PolarHBondContact O-N 3.46Å
95	N	94.6	Very high	93.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-48.5	177.4	-163.9	-11.3	0	0	0	111.5	G91 T92 T93 L97 I98 I99 S507 C508	G91-N95 WeakPolarHBondContact O-CB 3.32Å; G91-N95 PolarHBondContact O-N 3.19Å; T92-N95 WeakPolarHBondContact O-CB 3.41Å; T92-N95 PolarHBondContact O-N 3.47Å; T93-N95 VanDerWaalsContact C-N 3.27Å; T93-N95 PolarHBondContact O-N 3.35Å; N95-L97 VanDerWaalsContact C-N 3.34Å; N95-L97 PolarHBondContact O-N 2.79Å; N95-I98 PolarHBondContact O-N 2.99Å; N95-I99 VanDerWaalsContact O-CG1 3.29Å; N95-I99 WeakPolarHBondContact O-CG1 3.29Å; N95-I99 PolarHBondContact O-N 3.37Å; N95-I99 VanDerWaalsContact OD1-CD1 3.28Å; N95-I99 WeakPolarHBondContact OD1-CD1 3.44Å; N95-S507 PolarHBondContact ND2-OG 3.07Å; N95-C508 PolarHBondContact OD1-SG 2.68Å
96	V	95.7	Very high	93.2	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-65.9	-38.1	178.7	-177.6	0	0	0	0	112.1	L30 L34 L64 I77 A81 T92 T93 I99 G100	L30-V96 HydrophobicContact CB-CG1 4.35Å; L30-V96 HydrophobicContact CD2-CG1 3.8Å; L30-V96 HydrophobicContact CG-CG1 3.85Å; L34-V96 HydrophobicContact CD1-CB 3.68Å; L34-V96 HydrophobicContact CD1-CG1 3.68Å; L34-V96 HydrophobicContact CD1-CG2 3.72Å; L64-V96 HydrophobicContact CD1-CG2 4.1Å; I77-V96 HydrophobicContact CG2-CB 4.34Å; I77-V96 HydrophobicContact CG2-CG1 3.94Å; I77-V96 HydrophobicContact CG2-CG2 3.93Å; A81-V96 HydrophobicContact CB-CG2 3.89Å; T92-V96 PolarHBondContact O-N 3.27Å; T93-V96 PolarHBondContact O-N 3.38Å; V96-I99 PolarHBondContact O-N 3.03Å; V96-G100 PolarHBondContact O-N 3Å
97	L	96.1	Very high	93.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.5	-43.9	179	-65	178.5	0	0	0	112.4	Q31 K35 L38 T93 S94 N95 G100 E101 I446 V450	Q31-L97 HydrophobicContact CB-CD2 4.36Å; Q31-L97 HydrophobicContact CG-CD2 3.61Å; Q31-L97 WeakPolarHBondContact O-CD2 3.42Å; K35-L97 HydrophobicContact CB-CD2 3.89Å; L38-L97 HydrophobicContact CB-CD1 4.01Å; L38-L97 HydrophobicContact CD1-CD1 4.21Å; L38-L97 HydrophobicContact CD2-CD1 3.7Å; L38-L97 HydrophobicContact CG-CD1 4.18Å; T93-L97 HydrophobicContact CG2-CD1 4.14Å; T93-L97 HydrophobicContact CG2-CG 4.45Å; T93-L97 VanDerWaalsContact O-CG 3.32Å; T93-L97 WeakPolarHBondContact O-CG 3.31Å; T93-L97 PolarHBondContact O-N 3.27Å; T93-L97 VanDerWaalsContact O-N 3.07Å; S94-L97 PolarHBondContact O-N 2.92Å; N95-L97 VanDerWaalsContact C-N 3.34Å; N95-L97 PolarHBondContact O-N 2.79Å; L97-G100 PolarHBondContact O-N 3.43Å; L97-E101 WeakPolarHBondContact O-CB 3.14Å; L97-E101 PolarHBondContact O-N 3.09Å; L97-I446 HydrophobicContact CB-CG2 4.4Å; L97-V450 HydrophobicContact CD1-CG1 4.36Å
98	I	96.2	Very high	93.7	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-68.2	-42.2	178.3	-70	168.3	0	0	0	110.7	S94 N95 G100 E101 L102 L444 I446 I447 L504 C508	S94-I98 WeakPolarHBondContact O-CG1 3.32Å; S94-I98 PolarHBondContact O-N 3.46Å; N95-I98 PolarHBondContact O-N 2.99Å; I98-G100 VanDerWaalsContact C-N 3.35Å; I98-G100 PolarHBondContact O-N 3.2Å; I98-E101 PolarHBondContact O-N 3.47Å; I98-L102 HydrophobicContact CG2-CD1 3.71Å; I98-L102 HydrophobicContact CG2-CG 4.01Å; I98-L102 VanDerWaalsContact O-CB 3.3Å; I98-L102 WeakPolarHBondContact O-CB 3.43Å; I98-L102 VanDerWaalsContact O-CG 3.25Å; I98-L102 WeakPolarHBondContact O-CG 3.39Å; I98-L102 PolarHBondContact O-N 3.06Å; I98-L444 HydrophobicContact CD1-CD2 4.32Å; I98-I446 HydrophobicContact CG1-CG2 3.92Å; I98-I447 HydrophobicContact CD1-CD1 3.67Å; I98-I447 HydrophobicContact CD1-CG1 4.36Å; I98-I447 HydrophobicContact CG1-CD1 4.25Å; I98-I447 HydrophobicContact CG1-CG1 4.42Å; I98-L504 HydrophobicContact CD1-CD1 4.22Å; I98-L504 HydrophobicContact CD1-CD2 3.36Å; I98-L504 HydrophobicContact CD1-CG 4.19Å; I98-C508 HydrophobicContact CB-CB 4.49Å; I98-C508 HydrophobicContact CG2-CB 3.81Å
99	I	96.1	Very high	93.9	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-60	-46.4	176.5	-68	165.6	0	0	0	110.9	I77 N95 V96 E101 L102 L103 C508 I511	I77-I99 HydrophobicContact CD1-CG2 3.92Å; I77-I99 HydrophobicContact CG1-CG2 4.08Å; I77-I99 HydrophobicContact CG2-CD1 4.23Å; N95-I99 VanDerWaalsContact O-CG1 3.29Å; N95-I99 WeakPolarHBondContact O-CG1 3.29Å; N95-I99 PolarHBondContact O-N 3.37Å; N95-I99 VanDerWaalsContact OD1-CD1 3.28Å; N95-I99 WeakPolarHBondContact OD1-CD1 3.44Å; V96-I99 PolarHBondContact O-N 3.03Å; I99-E101 PolarHBondContact O-N 3.11Å; I99-L102 PolarHBondContact O-N 3.17Å; I99-L103 HydrophobicContact CG2-CD1 4.08Å; I99-L103 WeakPolarHBondContact O-CB 3.5Å; I99-L103 WeakPolarHBondContact O-CG 3.39Å; I99-L103 PolarHBondContact O-N 3.25Å; I99-C508 HydrophobicContact CG1-CB 3.98Å; I99-I511 HydrophobicContact CD1-CB 4.32Å; I99-I511 HydrophobicContact CD1-CG2 4.16Å
100	G	95.8	Very high	94.2	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-60.4	-44.3	177.7	0	0	0	0	0	112.4	V96 L97 I98 K104	V96-G100 PolarHBondContact O-N 3Å; L97-G100 PolarHBondContact O-N 3.43Å; I98-G100 VanDerWaalsContact C-N 3.35Å; I98-G100 PolarHBondContact O-N 3.2Å; G100-K104 WeakPolarHBondContact O-CB 3.36Å; G100-K104 PolarHBondContact O-N 3.1Å
101	E	96.5	Very high	94.4	Very high	6 Å²	6	19.6 Å²	19.6	3%	0.028	11%	0.108	C	C	.	.	H	α-helix	trans	-71.7	-38.9	179.2	-162.5	66.3	-154.1	0	0	112.4	Q31 L97 I98 I99 L103 K104 Q105 A443 I446	Q31-E101 PolarHBondContact NE2-OE2 2.74Å; L97-E101 WeakPolarHBondContact O-CB 3.14Å; L97-E101 PolarHBondContact O-N 3.09Å; I98-E101 PolarHBondContact O-N 3.47Å; I99-E101 PolarHBondContact O-N 3.11Å; E101-L103 VanDerWaalsContact C-N 3.33Å; E101-L103 PolarHBondContact O-N 3.08Å; E101-K104 CarbonylContact O-C 3.5Å; E101-K104 WeakPolarHBondContact O-CA 3.42Å; E101-K104 WeakPolarHBondContact O-CB 3.37Å; E101-K104 PolarHBondContact O-N 3.03Å; E101-K104 VanDerWaalsContact O-N 3.1Å; E101-K104 IonicContact OE1-NZ 2.77Å; E101-K104 PolarHBondContact OE1-NZ 2.98Å; E101-K104 IonicContact OE2-NZ 3.99Å; E101-K104 PolarHBondContact OE2-NZ 3.24Å; E101-K104 VanDerWaalsContact OE2-NZ 3.11Å; E101-Q105 HydrophobicContact CG-CG 4.35Å; E101-Q105 WeakPolarHBondContact O-CG 3.41Å; E101-Q105 PolarHBondContact O-N 3.41Å; E101-Q105 PolarHBondContact OE1-NE2 3.05Å; E101-A443 HydrophobicContact CB-CB 4.22Å; E101-A443 HydrophobicContact CG-CB 4.09Å; E101-I446 HydrophobicContact CB-CB 3.99Å; E101-I446 HydrophobicContact CB-CG1 4.09Å; E101-I446 HydrophobicContact CB-CG2 4.21Å; E101-I446 HydrophobicContact CG-CB 4Å; E101-I446 HydrophobicContact CG-CD1 4.29Å; E101-I446 HydrophobicContact CG-CG1 4.27Å
102	L	96.3	Very high	94.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57.3	-47.4	174.6	-80.3	171.7	0	0	0	111.4	I98 I99 K104 Q105 A106 F123 F440 A443 C508 A512	I98-L102 HydrophobicContact CG2-CD1 3.71Å; I98-L102 HydrophobicContact CG2-CG 4.01Å; I98-L102 VanDerWaalsContact O-CB 3.3Å; I98-L102 WeakPolarHBondContact O-CB 3.43Å; I98-L102 VanDerWaalsContact O-CG 3.25Å; I98-L102 WeakPolarHBondContact O-CG 3.39Å; I98-L102 PolarHBondContact O-N 3.06Å; I99-L102 PolarHBondContact O-N 3.17Å; L102-K104 VanDerWaalsContact C-N 3.29Å; L102-K104 PolarHBondContact O-N 3.27Å; L102-Q105 PolarHBondContact O-N 3.42Å; L102-A106 WeakPolarHBondContact O-CB 3.47Å; L102-A106 PolarHBondContact O-N 3.14Å; L102-F123 HydrophobicContact CB-CE2 4.39Å; L102-F123 HydrophobicContact CB-CZ 4.36Å; L102-F123 HydrophobicContact CD2-CE1 4.09Å; L102-F123 HydrophobicContact CD2-CE2 4.33Å; L102-F123 HydrophobicContact CD2-CZ 3.93Å; L102-F440 HydrophobicContact CD1-CD2 4.38Å; L102-F440 HydrophobicContact CD1-CE2 4.12Å; L102-F440 HydrophobicContact CD2-CB 4.23Å; L102-F440 HydrophobicContact CD2-CD2 3.4Å; L102-F440 HydrophobicContact CD2-CE2 3.94Å; L102-F440 HydrophobicContact CD2-CG 3.99Å; L102-A443 HydrophobicContact CB-CB 4.39Å; L102-A443 HydrophobicContact CD2-CB 3.55Å; L102-A443 HydrophobicContact CG-CB 3.82Å; L102-C508 HydrophobicContact CD1-CB 4.13Å; L102-A512 HydrophobicContact CB-CB 4.08Å; L102-A512 HydrophobicContact CD1-CB 3.99Å
103	L	95.6	Very high	94.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-36.3	176.6	-72	177.5	0	0	0	111.6	I24 A27 I99 E101 D107 A512 I515 L516	I24-L103 HydrophobicContact CG1-CB 4.24Å; A27-L103 HydrophobicContact CB-CD1 3.51Å; I99-L103 HydrophobicContact CG2-CD1 4.08Å; I99-L103 WeakPolarHBondContact O-CB 3.5Å; I99-L103 WeakPolarHBondContact O-CG 3.39Å; I99-L103 PolarHBondContact O-N 3.25Å; E101-L103 VanDerWaalsContact C-N 3.33Å; E101-L103 PolarHBondContact O-N 3.08Å; L103-D107 PolarHBondContact O-N 3.37Å; L103-A512 HydrophobicContact CD2-CB 4.42Å; L103-I515 HydrophobicContact CD1-CB 4.47Å; L103-I515 HydrophobicContact CD1-CD1 4.22Å; L103-I515 HydrophobicContact CD1-CG2 3.97Å; L103-I515 HydrophobicContact CD2-CB 4.28Å; L103-I515 HydrophobicContact CD2-CG2 4.05Å; L103-L516 HydrophobicContact CD2-CD1 4.49Å; L103-L516 HydrophobicContact CD2-CD2 3.62Å; L103-L516 HydrophobicContact CD2-CG 3.64Å
104	K	95.6	Very high	94.3	Very high	77 Å²	77	29.3 Å²	29.3	34%	0.335	17%	0.169	S	C	.	.	H	α-helix	trans	-68.1	-40.9	175.7	172.4	171.3	160.8	-129.1	0	112.9	R28 G100 E101 L102 D107	R28-K104 HydrophobicContact CG-CB 4.49Å; G100-K104 WeakPolarHBondContact O-CB 3.36Å; G100-K104 PolarHBondContact O-N 3.1Å; E101-K104 CarbonylContact O-C 3.5Å; E101-K104 WeakPolarHBondContact O-CA 3.42Å; E101-K104 WeakPolarHBondContact O-CB 3.37Å; E101-K104 PolarHBondContact O-N 3.03Å; E101-K104 VanDerWaalsContact O-N 3.1Å; E101-K104 IonicContact OE1-NZ 2.77Å; E101-K104 PolarHBondContact OE1-NZ 2.98Å; E101-K104 IonicContact OE2-NZ 3.99Å; E101-K104 PolarHBondContact OE2-NZ 3.24Å; E101-K104 VanDerWaalsContact OE2-NZ 3.11Å; L102-K104 VanDerWaalsContact C-N 3.29Å; L102-K104 PolarHBondContact O-N 3.27Å; K104-D107 WeakPolarHBondContact O-CB 3.16Å; K104-D107 PolarHBondContact O-N 3.41Å
105	Q	95.5	Very high	94.1	Very high	26 Å²	26	34.2 Å²	34.2	12%	0.121	19%	0.189	C	C	.	.	H	α-helix	trans	-70	-37.5	176	-65.4	-55.5	-35.3	0	0	111.4	E101 L102 D107 L108 A439 D442 A443	E101-Q105 HydrophobicContact CG-CG 4.35Å; E101-Q105 WeakPolarHBondContact O-CG 3.41Å; E101-Q105 PolarHBondContact O-N 3.41Å; E101-Q105 PolarHBondContact OE1-NE2 3.05Å; L102-Q105 PolarHBondContact O-N 3.42Å; Q105-D107 VanDerWaalsContact C-N 3.33Å; Q105-D107 PolarHBondContact O-N 2.98Å; Q105-L108 PolarHBondContact O-N 3.32Å; Q105-A439 HydrophobicContact CB-CB 3.76Å; Q105-D442 HydrophobicContact CG-CB 4.39Å; Q105-A443 HydrophobicContact CG-CB 4.1Å
106	A	94.1	Very high	94.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-39.4	173.5	0	0	0	0	0	112.5	L102 L108 Y109 V110 I119 F123 L516	L102-A106 WeakPolarHBondContact O-CB 3.47Å; L102-A106 PolarHBondContact O-N 3.14Å; A106-L108 PolarHBondContact O-N 3.42Å; A106-Y109 PolarHBondContact O-N 2.86Å; A106-V110 WeakPolarHBondContact O-CG2 3.3Å; A106-V110 PolarHBondContact O-N 2.91Å; A106-I119 HydrophobicContact CB-CD1 4.35Å; A106-I119 HydrophobicContact CB-CG2 3.94Å; A106-F123 HydrophobicContact CB-CZ 4.1Å; A106-L516 HydrophobicContact CB-CD1 3.79Å; A106-L516 HydrophobicContact CB-CD2 3.76Å; A106-L516 HydrophobicContact CB-CG 4.42Å
107	D	93.6	Very high	93.9	Very high	44 Å²	44	44.3 Å²	44.3	24%	0.235	23%	0.231	C	C	.	.	H	α-helix	trans	-52.6	-41.8	178.4	-161.6	31.6	0	0	0	112.5	I24 R28 L103 K104 Q105 Y109 V110 S111	I24-D107 HydrophobicContact CD1-CB 3.77Å; I24-D107 WeakPolarHBondContact CD1-OD1 3.44Å; I24-D107 HydrophobicContact CG2-CB 4.45Å; R28-D107 IonicContact CZ-OD2 3.28Å; R28-D107 IonicContact NH1-OD2 3.98Å; R28-D107 IonicContact NH2-OD2 3.34Å; R28-D107 PolarHBondContact NH2-OD2 3.22Å; L103-D107 PolarHBondContact O-N 3.37Å; K104-D107 WeakPolarHBondContact O-CB 3.16Å; K104-D107 PolarHBondContact O-N 3.41Å; Q105-D107 VanDerWaalsContact C-N 3.33Å; Q105-D107 PolarHBondContact O-N 2.98Å; D107-Y109 PolarHBondContact O-N 2.96Å; D107-V110 PolarHBondContact O-N 3.43Å; D107-S111 VanDerWaalsContact O-CB 3.28Å; D107-S111 WeakPolarHBondContact O-CB 3.47Å; D107-S111 PolarHBondContact O-N 2.83Å; D107-S111 PolarHBondContact O-OG 2.68Å
108	L	93.6	Very high	93.8	Very high	89 Å²	89	46.4 Å²	46.4	47%	0.466	24%	0.241	S	C	.	.	H	α-helix	trans	-57.7	-50.3	-179.6	-62.6	174.6	0	0	0	110.5	Q105 A106 S111 E112	Q105-L108 PolarHBondContact O-N 3.32Å; A106-L108 PolarHBondContact O-N 3.42Å; L108-S111 PolarHBondContact O-N 3.16Å; L108-S111 PolarHBondContact O-OG 3.31Å; L108-E112 WeakPolarHBondContact O-CG 3.27Å; L108-E112 PolarHBondContact O-N 3.45Å
109	Y	93.3	Very high	93.7	Very high	26 Å²	26	46.4 Å²	46.4	10%	0.102	24%	0.241	C	C	.	.	H	α-helix	trans	-71.3	-36	179.7	-66	-54.7	0	0	0	113.2	A106 D107 S111 E112 G113 L114 L435 Q438 A439	A106-Y109 PolarHBondContact O-N 2.86Å; D107-Y109 PolarHBondContact O-N 2.96Å; Y109-S111 VanDerWaalsContact C-N 3.29Å; Y109-S111 PolarHBondContact O-N 3.19Å; Y109-E112 PolarHBondContact O-N 3.26Å; Y109-G113 PolarHBondContact O-N 3.32Å; Y109-L114 HydrophobicContact CD1-CD1 4.1Å; Y109-L114 HydrophobicContact CG-CD1 4.25Å; Y109-L114 WeakPolarHBondContact O-CB 3.47Å; Y109-L114 PolarHBondContact O-N 2.91Å; Y109-L435 HydrophobicContact CD1-CB 4.3Å; Y109-L435 HydrophobicContact CD1-CD1 4.43Å; Y109-L435 HydrophobicContact CE1-CB 4.26Å; Y109-L435 HydrophobicContact CE1-CD2 4Å; Y109-L435 HydrophobicContact CE2-CB 4.47Å; Y109-L435 VanDerWaalsContact CE2-O 3.32Å; Y109-L435 WeakPolarHBondContact CE2-O 3.43Å; Y109-L435 HydrophobicContact CG-CB 4.44Å; Y109-Q438 VanDerWaalsContact OH-CD 3.25Å; Y109-Q438 PolarHBondContact OH-OE1 3.35Å; Y109-A439 HydrophobicContact CD2-CB 3.97Å; Y109-A439 HydrophobicContact CE2-CB 3.71Å
110	V	91.9	Very high	93.6	Very high	21 Å²	21	46.9 Å²	46.9	13%	0.127	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-37.5	174.5	178.9	0	0	0	0	110.7	L20 A106 D107 E112 G113 P116 I119	L20-V110 HydrophobicContact CD2-CB 4.15Å; L20-V110 HydrophobicContact CD2-CG1 3.58Å; L20-V110 HydrophobicContact CD2-CG2 4.2Å; A106-V110 WeakPolarHBondContact O-CG2 3.3Å; A106-V110 PolarHBondContact O-N 2.91Å; D107-V110 PolarHBondContact O-N 3.43Å; V110-E112 PolarHBondContact O-N 3.3Å; V110-G113 WeakPolarHBondContact O-CA 3.36Å; V110-G113 PolarHBondContact O-N 3.48Å; V110-P116 HydrophobicContact CG1-CG 4.34Å; V110-P116 HydrophobicContact CG2-CG 4.02Å; V110-I119 HydrophobicContact CG2-CD1 3.47Å; V110-I119 VanDerWaalsContact CG2-CD1 3.47Å
111	S	90.6	Very high	93.5	Very high	79 Å²	79	53 Å²	53	55%	0.552	27%	0.274	S	S	*	.	H	α-helix	trans	-64.5	-30	176.5	80.1	0	0	0	0	112.8	D107 L108 Y109 G113	D107-S111 VanDerWaalsContact O-CB 3.28Å; D107-S111 WeakPolarHBondContact O-CB 3.47Å; D107-S111 PolarHBondContact O-N 2.83Å; D107-S111 PolarHBondContact O-OG 2.68Å; L108-S111 PolarHBondContact O-N 3.16Å; L108-S111 PolarHBondContact O-OG 3.31Å; Y109-S111 VanDerWaalsContact C-N 3.29Å; Y109-S111 PolarHBondContact O-N 3.19Å; S111-G113 PolarHBondContact O-N 3.05Å
112	E	92.3	Very high	93.4	Very high	144 Å²	144	52.7 Å²	52.7	67%	0.673	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-4.3	171.5	-67.3	176.6	175.5	0	0	113.5	L108 Y109 V110	L108-E112 WeakPolarHBondContact O-CG 3.27Å; L108-E112 PolarHBondContact O-N 3.45Å; Y109-E112 PolarHBondContact O-N 3.26Å; V110-E112 PolarHBondContact O-N 3.3Å
113	G	89.6	Confident	93.4	Very high	63 Å²	63	52.7 Å²	52.7	65%	0.649	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.4	13.7	176	0	0	0	0	0	115.4	Y109 V110 S111	Y109-G113 PolarHBondContact O-N 3.32Å; V110-G113 WeakPolarHBondContact O-CA 3.36Å; V110-G113 PolarHBondContact O-N 3.48Å; S111-G113 PolarHBondContact O-N 3.05Å
114	L	92.3	Very high	93.3	Very high	17 Å²	17	56.5 Å²	56.5	9%	0.089	29%	0.29	C	S	.	.			trans	-72.7	136.2	170	-82.4	136.3	0	0	0	111.6	Y109 I118 R432 L435	Y109-L114 HydrophobicContact CD1-CD1 4.1Å; Y109-L114 HydrophobicContact CG-CD1 4.25Å; Y109-L114 WeakPolarHBondContact O-CB 3.47Å; Y109-L114 PolarHBondContact O-N 2.91Å; L114-I118 HydrophobicContact CD2-CD1 4.45Å; L114-I118 HydrophobicContact CD2-CG2 4.35Å; L114-R432 HydrophobicContact CD2-CB 4.07Å; L114-L435 HydrophobicContact CD1-CD1 3.34Å; L114-L435 HydrophobicContact CD2-CD1 4.11Å; L114-L435 HydrophobicContact CG-CD1 4.34Å
115	H	91.8	Very high	93.2	Very high	123 Å²	123	54.6 Å²	54.6	57%	0.569	29%	0.289	S	S	*	.			trans	-68.9	129.8	174.7	-166.8	-46.4	0	0	0	109.8	R117 I118	H115-R117 PolarHBondContact ND1-N 3.18Å; H115-R117 PolarHBondContact O-N 3.43Å; H115-I118 HydrophobicContact CB-CD1 4.34Å; H115-I118 HydrophobicContact CB-CG1 4.48Å; H115-I118 PolarHBondContact O-N 2.95Å
116	P	92.8	Very high	93.1	Very high	28 Å²	28	53.3 Å²	53.3	18%	0.182	28%	0.283	C	S	.	.	H	α-helix	trans	-52.3	-29.6	-178.1	-31.1	34.2	0	0	0	115.7	V110 I118 I119 A120 L516	V110-P116 HydrophobicContact CG1-CG 4.34Å; V110-P116 HydrophobicContact CG2-CG 4.02Å; P116-I118 VanDerWaalsContact C-N 3.32Å; P116-I118 PolarHBondContact O-N 3.06Å; P116-I119 WeakPolarHBondContact O-CB 3.18Å; P116-I119 PolarHBondContact O-N 3.26Å; P116-I119 VanDerWaalsContact O-N 3.16Å; P116-A120 PolarHBondContact O-N 3.37Å; P116-L516 HydrophobicContact CB-CB 4.45Å; P116-L516 WeakPolarHBondContact CB-O 3.31Å
117	R	93.4	Very high	93.2	Very high	184 Å²	184	53.8 Å²	53.8	69%	0.694	29%	0.285	S	S	*	.	H	α-helix	trans	-63	-34.8	177.9	-168.9	171	-176.2	170.2	1.6	113.4	H115 I119 A120 E121 L517	H115-R117 PolarHBondContact ND1-N 3.18Å; H115-R117 PolarHBondContact O-N 3.43Å; R117-I119 VanDerWaalsContact C-N 3.31Å; R117-A120 PolarHBondContact O-N 3.25Å; R117-E121 WeakPolarHBondContact O-CB 3.36Å; R117-E121 PolarHBondContact O-N 3.48Å; R117-L517 HydrophobicContact CB-CD2 4.09Å; R117-L517 HydrophobicContact CG-CD2 4.41Å
118	I	93.7	Very high	93.3	Very high	44 Å²	44	55.4 Å²	55.4	23%	0.226	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-35.4	176.6	-60.6	174.8	0	0	0	110.2	L114 H115 P116 G122 R432	L114-I118 HydrophobicContact CD2-CD1 4.45Å; L114-I118 HydrophobicContact CD2-CG2 4.35Å; H115-I118 HydrophobicContact CB-CD1 4.34Å; H115-I118 HydrophobicContact CB-CG1 4.48Å; H115-I118 PolarHBondContact O-N 2.95Å; P116-I118 VanDerWaalsContact C-N 3.32Å; P116-I118 PolarHBondContact O-N 3.06Å; I118-G122 PolarHBondContact O-N 3.33Å; I118-R432 HydrophobicContact CD1-CB 4.39Å; I118-R432 HydrophobicContact CG2-CB 3.7Å
119	I	94	Very high	93.3	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-69.7	-45.1	177	-57	174.9	0	0	0	109.7	A106 V110 P116 R117 E121 G122 F123 L516	A106-I119 HydrophobicContact CB-CD1 4.35Å; A106-I119 HydrophobicContact CB-CG2 3.94Å; V110-I119 HydrophobicContact CG2-CD1 3.47Å; V110-I119 VanDerWaalsContact CG2-CD1 3.47Å; P116-I119 WeakPolarHBondContact O-CB 3.18Å; P116-I119 PolarHBondContact O-N 3.26Å; P116-I119 VanDerWaalsContact O-N 3.16Å; R117-I119 VanDerWaalsContact C-N 3.31Å; I119-E121 VanDerWaalsContact C-N 3.32Å; I119-E121 PolarHBondContact O-N 2.82Å; I119-G122 CarbonylContact O-C 3.54Å; I119-G122 WeakPolarHBondContact O-CA 3.32Å; I119-G122 PolarHBondContact O-N 3.3Å; I119-G122 VanDerWaalsContact O-N 3.1Å; I119-F123 HydrophobicContact CG2-CD1 4.19Å; I119-F123 HydrophobicContact CG2-CD2 4.44Å; I119-F123 HydrophobicContact CG2-CE1 3.75Å; I119-F123 HydrophobicContact CG2-CE2 4.02Å; I119-F123 HydrophobicContact CG2-CZ 3.66Å; I119-F123 WeakPolarHBondContact O-CG 3.3Å; I119-F123 PolarHBondContact O-N 3.36Å; I119-L516 HydrophobicContact CG2-CD1 4.15Å
120	A	93.9	Very high	93.4	Very high	11 Å²	11	52 Å²	52	9%	0.091	28%	0.275	C	S	.	.	H	α-helix	trans	-59.6	-40.2	175.5	0	0	0	0	0	112.4	P116 R117 F123 E124 L517	P116-A120 PolarHBondContact O-N 3.37Å; R117-A120 PolarHBondContact O-N 3.25Å; A120-F123 PolarHBondContact O-N 3.21Å; A120-E124 PolarHBondContact O-N 3.41Å; A120-E124 VanDerWaalsContact O-N 3.08Å; A120-L517 HydrophobicContact CB-CD1 4.45Å
121	E	93.2	Very high	93.5	Very high	129 Å²	129	53 Å²	53	60%	0.603	28%	0.28	S	S	*	.	H	α-helix	trans	-63	-41.8	173	-173.5	179.1	179.6	0	0	111.8	R117 I119 E124 A125	R117-E121 WeakPolarHBondContact O-CB 3.36Å; R117-E121 PolarHBondContact O-N 3.48Å; I119-E121 VanDerWaalsContact C-N 3.32Å; I119-E121 PolarHBondContact O-N 2.82Å; E121-E124 PolarHBondContact O-N 2.94Å; E121-A125 PolarHBondContact O-N 3.39Å; E121-A125 VanDerWaalsContact O-N 3.17Å
122	G	93.9	Very high	93.7	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-35.5	174	0	0	0	0	0	113.6	I118 I119 A126 V437	I118-G122 PolarHBondContact O-N 3.33Å; I119-G122 CarbonylContact O-C 3.54Å; I119-G122 WeakPolarHBondContact O-CA 3.32Å; I119-G122 PolarHBondContact O-N 3.3Å; I119-G122 VanDerWaalsContact O-N 3.1Å; G122-A126 VanDerWaalsContact O-CB 3.32Å; G122-A126 WeakPolarHBondContact O-CB 3.31Å; G122-A126 PolarHBondContact O-N 3.46Å; G122-V437 WeakPolarHBondContact O-CG2 3.46Å
123	F	95.6	Very high	93.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.2	-40.6	174.7	-73.8	-6.1	0	0	0	112	L102 A106 I119 A120 A126 K127 G436 A439 F440 T509 A512 L516	L102-F123 HydrophobicContact CB-CE2 4.39Å; L102-F123 HydrophobicContact CB-CZ 4.36Å; L102-F123 HydrophobicContact CD2-CE1 4.09Å; L102-F123 HydrophobicContact CD2-CE2 4.33Å; L102-F123 HydrophobicContact CD2-CZ 3.93Å; A106-F123 HydrophobicContact CB-CZ 4.1Å; I119-F123 HydrophobicContact CG2-CD1 4.19Å; I119-F123 HydrophobicContact CG2-CD2 4.44Å; I119-F123 HydrophobicContact CG2-CE1 3.75Å; I119-F123 HydrophobicContact CG2-CE2 4.02Å; I119-F123 HydrophobicContact CG2-CZ 3.66Å; I119-F123 WeakPolarHBondContact O-CG 3.3Å; I119-F123 PolarHBondContact O-N 3.36Å; A120-F123 PolarHBondContact O-N 3.21Å; F123-A126 PolarHBondContact O-N 3.19Å; F123-K127 VanDerWaalsContact O-CB 3.32Å; F123-K127 WeakPolarHBondContact O-CB 3.35Å; F123-K127 PolarHBondContact O-N 3.43Å; F123-G436 VanDerWaalsContact CD1-O 3.31Å; F123-G436 WeakPolarHBondContact CD1-O 3.48Å; F123-G436 WeakPolarHBondContact CE1-O 3.3Å; F123-A439 HydrophobicContact CE1-CB 3.79Å; F123-A439 HydrophobicContact CZ-CB 4.32Å; F123-F440 HydrophobicContact CB-CD2 4.31Å; F123-F440 HydrophobicContact CD1-CB 3.89Å; F123-F440 AromaticContact CD1-CD2 3.96Å; F123-F440 HydrophobicContact CD1-CD2 3.96Å; F123-F440 HydrophobicContact CD1-CG 4.43Å; F123-F440 HydrophobicContact CE1-CB 4.1Å; F123-F440 HydrophobicContact CE1-CD2 4.48Å; F123-F440 HydrophobicContact CG-CD2 4.2Å; F123-T509 HydrophobicContact CB-CG2 3.92Å; F123-A512 HydrophobicContact CE2-CB 4.38Å; F123-L516 HydrophobicContact CD2-CD1 4.13Å; F123-L516 HydrophobicContact CE2-CD1 3.54Å; F123-L516 HydrophobicContact CZ-CD1 4.35Å
124	E	94.3	Very high	93.9	Very high	81 Å²	81	44.4 Å²	44.4	38%	0.379	21%	0.214	S	C	.	.	H	α-helix	trans	-64.9	-45.8	177.8	-170.2	66.8	177.8	0	0	111.4	A120 E121 A126 K127 D128	A120-E124 PolarHBondContact O-N 3.41Å; A120-E124 VanDerWaalsContact O-N 3.08Å; E121-E124 PolarHBondContact O-N 2.94Å; E124-A126 VanDerWaalsContact C-N 3.33Å; E124-A126 PolarHBondContact O-N 3.08Å; E124-K127 PolarHBondContact O-N 2.95Å; E124-K127 IonicContact OE1-NZ 2.82Å; E124-K127 PolarHBondContact OE1-NZ 3.07Å; E124-K127 IonicContact OE2-NZ 3.11Å; E124-K127 PolarHBondContact OE2-NZ 3.13Å; E124-D128 PolarHBondContact O-N 2.97Å
125	A	93.1	Very high	93.9	Very high	36 Å²	36	47.6 Å²	47.6	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-40.2	174.9	0	0	0	0	0	112.5	E121 K129	E121-A125 PolarHBondContact O-N 3.39Å; E121-A125 VanDerWaalsContact O-N 3.17Å; A125-K129 PolarHBondContact O-N 3.36Å
126	A	94.9	Very high	93.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67	-40.1	176.7	0	0	0	0	0	112.2	G122 F123 E124 K129 A130 L422 V437 F440	G122-A126 VanDerWaalsContact O-CB 3.32Å; G122-A126 WeakPolarHBondContact O-CB 3.31Å; G122-A126 PolarHBondContact O-N 3.46Å; F123-A126 PolarHBondContact O-N 3.19Å; E124-A126 VanDerWaalsContact C-N 3.33Å; E124-A126 PolarHBondContact O-N 3.08Å; A126-K129 PolarHBondContact O-N 3.37Å; A126-A130 VanDerWaalsContact O-CB 3.27Å; A126-A130 WeakPolarHBondContact O-CB 3.43Å; A126-A130 PolarHBondContact O-N 2.68Å; A126-L422 HydrophobicContact CB-CD2 4.08Å; A126-L422 WeakPolarHBondContact O-CD2 3.43Å; A126-V437 HydrophobicContact CB-CB 4.4Å; A126-V437 HydrophobicContact CB-CG1 4.18Å; A126-V437 HydrophobicContact CB-CG2 4.27Å; A126-F440 HydrophobicContact CB-CB 3.71Å; A126-F440 HydrophobicContact CB-CD1 3.69Å; A126-F440 HydrophobicContact CB-CD2 4.32Å; A126-F440 HydrophobicContact CB-CE1 4.39Å; A126-F440 HydrophobicContact CB-CG 3.64Å
127	K	95.3	Very high	93.6	Very high	10 Å²	10	48.9 Å²	48.9	4%	0.043	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-47.8	177.1	178.5	-147.9	70.1	-171.6	0	111	F123 E124 K129 A130 L131 T509	F123-K127 VanDerWaalsContact O-CB 3.32Å; F123-K127 WeakPolarHBondContact O-CB 3.35Å; F123-K127 PolarHBondContact O-N 3.43Å; E124-K127 PolarHBondContact O-N 2.95Å; E124-K127 IonicContact OE1-NZ 2.82Å; E124-K127 PolarHBondContact OE1-NZ 3.07Å; E124-K127 IonicContact OE2-NZ 3.11Å; E124-K127 PolarHBondContact OE2-NZ 3.13Å; K127-K129 VanDerWaalsContact C-N 3.31Å; K127-K129 PolarHBondContact O-N 2.77Å; K127-A130 PolarHBondContact O-N 3.45Å; K127-L131 HydrophobicContact CG-CD1 4.32Å; K127-L131 WeakPolarHBondContact O-CG 3.48Å; K127-L131 PolarHBondContact O-N 3.02Å; K127-T509 HydrophobicContact CB-CG2 3.77Å; K127-T509 HydrophobicContact CD-CG2 4.07Å; K127-T509 HydrophobicContact CG-CG2 4.18Å
128	D	94.8	Very high	93.4	Very high	77 Å²	77	43 Å²	43	41%	0.412	21%	0.212	S	C	.	.	H	α-helix	trans	-60.8	-44.1	179.3	-68.4	-16.7	0	0	0	110.7	E124 A130 L131 E132	E124-D128 PolarHBondContact O-N 2.97Å; D128-A130 PolarHBondContact O-N 3Å; D128-L131 PolarHBondContact O-N 3Å; D128-E132 PolarHBondContact O-N 3.41Å
129	K	94.6	Very high	93.1	Very high	44 Å²	44	42.8 Å²	42.8	19%	0.191	21%	0.213	C	C	.	.	H	α-helix	trans	-66.1	-37.8	175.7	-171.5	52.3	175	164	0	113	A125 A126 K127 L131 E132 V133 L422 H425	A125-K129 PolarHBondContact O-N 3.36Å; A126-K129 PolarHBondContact O-N 3.37Å; K127-K129 VanDerWaalsContact C-N 3.31Å; K127-K129 PolarHBondContact O-N 2.77Å; K129-L131 VanDerWaalsContact C-N 3.3Å; K129-L131 PolarHBondContact O-N 3.09Å; K129-E132 HydrophobicContact CD-CB 4.38Å; K129-E132 WeakPolarHBondContact CD-OE2 3.37Å; K129-E132 IonicContact NZ-OE2 3.83Å; K129-E132 PolarHBondContact NZ-OE2 2.86Å; K129-E132 WeakPolarHBondContact O-CB 3.47Å; K129-E132 PolarHBondContact O-N 3.46Å; K129-V133 VanDerWaalsContact O-CG2 3.27Å; K129-V133 WeakPolarHBondContact O-CG2 3.39Å; K129-V133 PolarHBondContact O-N 2.99Å; K129-L422 HydrophobicContact CB-CD2 4Å; K129-L422 HydrophobicContact CG-CD2 4.16Å; K129-H425 HydrophobicContact CG-CB 4.09Å
130	A	94.8	Very high	92.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.1	-34.7	176.3	0	0	0	0	0	112.1	A126 K127 D128 V133 L134 V418 F440 L505	A126-A130 VanDerWaalsContact O-CB 3.27Å; A126-A130 WeakPolarHBondContact O-CB 3.43Å; A126-A130 PolarHBondContact O-N 2.68Å; K127-A130 PolarHBondContact O-N 3.45Å; D128-A130 PolarHBondContact O-N 3Å; A130-V133 PolarHBondContact O-N 3.43Å; A130-L134 WeakPolarHBondContact O-CB 3.46Å; A130-L134 PolarHBondContact O-N 3.16Å; A130-V418 HydrophobicContact CB-CG1 3.72Å; A130-F440 HydrophobicContact CB-CE1 4.4Å; A130-L505 HydrophobicContact CB-CD1 3.95Å
131	L	94.9	Very high	91.9	Very high	43 Å²	43	53.5 Å²	53.5	23%	0.225	26%	0.263	C	S	.	.	H	α-helix	trans	-69.6	-37.8	174.2	-70.9	173.7	0	0	0	112.3	K127 D128 K129 L134 E135 K502 L505	K127-L131 HydrophobicContact CG-CD1 4.32Å; K127-L131 WeakPolarHBondContact O-CG 3.48Å; K127-L131 PolarHBondContact O-N 3.02Å; D128-L131 PolarHBondContact O-N 3Å; K129-L131 VanDerWaalsContact C-N 3.3Å; K129-L131 PolarHBondContact O-N 3.09Å; L131-L134 HydrophobicContact CD2-CD2 4.31Å; L131-L134 PolarHBondContact O-N 2.93Å; L131-E135 PolarHBondContact O-N 2.81Å; L131-E135 VanDerWaalsContact O-N 3.09Å; L131-K502 HydrophobicContact CD2-CG 4.03Å; L131-L505 HydrophobicContact CD2-CB 4.4Å; L131-L505 HydrophobicContact CD2-CD1 4.27Å
132	E	94.6	Very high	91.2	Very high	102 Å²	102	55.1 Å²	55.1	48%	0.477	27%	0.27	S	S	.	.	H	α-helix	trans	-60.1	-46.7	171.1	-69	174.5	-173.5	0	0	111.2	D128 K129 L134 E135 E136	D128-E132 PolarHBondContact O-N 3.41Å; K129-E132 HydrophobicContact CD-CB 4.38Å; K129-E132 WeakPolarHBondContact CD-OE2 3.37Å; K129-E132 IonicContact NZ-OE2 3.83Å; K129-E132 PolarHBondContact NZ-OE2 2.86Å; K129-E132 WeakPolarHBondContact O-CB 3.47Å; K129-E132 PolarHBondContact O-N 3.46Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.45Å; E132-E135 WeakPolarHBondContact O-CB 3.27Å; E132-E135 PolarHBondContact O-N 2.64Å; E132-E135 VanDerWaalsContact O-N 3.1Å; E132-E136 PolarHBondContact O-N 3.45Å
133	V	92.9	Very high	90.6	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-38.3	178.8	174.3	0	0	0	0	111.3	K129 A130 E135 E136 M137 V418 A421	K129-V133 VanDerWaalsContact O-CG2 3.27Å; K129-V133 WeakPolarHBondContact O-CG2 3.39Å; K129-V133 PolarHBondContact O-N 2.99Å; A130-V133 PolarHBondContact O-N 3.43Å; V133-E135 VanDerWaalsContact C-N 3.27Å; V133-E135 PolarHBondContact O-N 2.8Å; V133-E136 PolarHBondContact O-N 3.22Å; V133-M137 HydrophobicContact CG1-CE 3.32Å; V133-M137 HydrophobicContact CG1-CG 4.18Å; V133-M137 HydrophobicContact CG1-SD 3.57Å; V133-M137 VanDerWaalsContact CG1-SD 3.57Å; V133-M137 WeakPolarHBondContact O-CB 3.43Å; V133-M137 VanDerWaalsContact O-CG 3.3Å; V133-M137 WeakPolarHBondContact O-CG 3.27Å; V133-M137 PolarHBondContact O-N 2.87Å; V133-V418 HydrophobicContact CB-CG2 4.44Å; V133-V418 HydrophobicContact CG1-CG2 3.87Å; V133-A421 HydrophobicContact CG1-CB 4.31Å; V133-A421 HydrophobicContact CG2-CB 3.66Å
134	L	93.5	Very high	90.3	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-37.7	173.7	178.2	65.4	0	0	0	111.9	A130 L131 E132 K138 V408 F414 Y498 K501 K502	A130-L134 WeakPolarHBondContact O-CB 3.46Å; A130-L134 PolarHBondContact O-N 3.16Å; L131-L134 HydrophobicContact CD2-CD2 4.31Å; L131-L134 PolarHBondContact O-N 2.93Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.45Å; L134-K138 PolarHBondContact O-N 3.01Å; L134-V408 HydrophobicContact CD1-CG1 4.47Å; L134-V408 HydrophobicContact CD1-CG2 3.91Å; L134-F414 HydrophobicContact CB-CE2 3.82Å; L134-F414 HydrophobicContact CB-CZ 3.94Å; L134-F414 HydrophobicContact CD1-CD2 4.07Å; L134-F414 HydrophobicContact CD1-CE1 4.5Å; L134-F414 HydrophobicContact CD1-CE2 3.39Å; L134-F414 HydrophobicContact CD1-CZ 3.63Å; L134-F414 HydrophobicContact CG-CE2 4.17Å; L134-F414 HydrophobicContact CG-CZ 4.24Å; L134-Y498 HydrophobicContact CD1-CD2 4.06Å; L134-Y498 HydrophobicContact CD1-CE2 4.39Å; L134-Y498 HydrophobicContact CD2-CD2 4.14Å; L134-Y498 HydrophobicContact CD2-CE2 3.9Å; L134-Y498 HydrophobicContact CG-CD2 3.86Å; L134-Y498 HydrophobicContact CG-CE2 3.68Å; L134-K501 HydrophobicContact CD1-CB 4.05Å; L134-K501 HydrophobicContact CD2-CB 4.33Å; L134-K502 HydrophobicContact CD2-CB 3.78Å; L134-K502 HydrophobicContact CD2-CG 4.47Å
135	E	92.8	Very high	90.1	Very high	83 Å²	83	62.7 Å²	62.7	39%	0.388	31%	0.305	S	S	.	.	H	α-helix	trans	-70.2	-34.3	177.3	-162	66.6	-170.4	0	0	112.5	L131 E132 V133 K138 Y498	L131-E135 PolarHBondContact O-N 2.81Å; L131-E135 VanDerWaalsContact O-N 3.09Å; E132-E135 WeakPolarHBondContact O-CB 3.27Å; E132-E135 PolarHBondContact O-N 2.64Å; E132-E135 VanDerWaalsContact O-N 3.1Å; V133-E135 VanDerWaalsContact C-N 3.27Å; V133-E135 PolarHBondContact O-N 2.8Å; E135-K138 WeakPolarHBondContact O-CG 3.45Å; E135-K138 WeakPolarHBondContact OE1-CE 3.38Å; E135-K138 IonicContact OE1-NZ 3.81Å; E135-K138 PolarHBondContact OE1-NZ 2.82Å; E135-K138 IonicContact OE2-NZ 2.62Å; E135-Y498 WeakPolarHBondContact OE2-CE2 3.42Å; E135-Y498 VanDerWaalsContact OE2-CZ 3.3Å; E135-Y498 PolarHBondContact OE2-OH 2.94Å
136	E	90.9	Very high	90	Very high	145 Å²	145	68 Å²	68	68%	0.678	32%	0.323	S	S	*	.	H	α-helix	trans	-73.2	-34.9	175.4	-69	173.3	-173.2	0	0	112.5	E132 V133	E132-E136 PolarHBondContact O-N 3.45Å; V133-E136 PolarHBondContact O-N 3.22Å
137	M	86.8	Confident	89.8	Confident	33 Å²	33	68.6 Å²	68.6	16%	0.163	33%	0.327	C	S	.	.	H	α-helix	trans	-88.9	-9.3	-175.1	-70.4	-178.6	-178.4	0	0	114.5	V133 V139 F414 A417 L476	V133-M137 HydrophobicContact CG1-CE 3.32Å; V133-M137 HydrophobicContact CG1-CG 4.18Å; V133-M137 HydrophobicContact CG1-SD 3.57Å; V133-M137 VanDerWaalsContact CG1-SD 3.57Å; V133-M137 WeakPolarHBondContact O-CB 3.43Å; V133-M137 VanDerWaalsContact O-CG 3.3Å; V133-M137 WeakPolarHBondContact O-CG 3.27Å; V133-M137 PolarHBondContact O-N 2.87Å; M137-V139 PolarHBondContact O-N 2.91Å; M137-F414 HydrophobicContact SD-CD2 4.45Å; M137-A417 HydrophobicContact CE-CB 3.39Å; M137-A417 HydrophobicContact SD-CB 3.53Å; M137-A417 VanDerWaalsContact SD-CB 3.53Å; M137-L476 HydrophobicContact SD-CD2 4.1Å
138	K	89.2	Confident	89.7	Confident	61 Å²	61	68.1 Å²	68.1	27%	0.265	33%	0.325	S	S	.	.			trans	-65.7	132.5	179.8	76.7	-171.5	-176.5	169.3	0	110.3	L134 E135 T140 C406 Y498	L134-K138 PolarHBondContact O-N 3.01Å; E135-K138 WeakPolarHBondContact O-CG 3.45Å; E135-K138 WeakPolarHBondContact OE1-CE 3.38Å; E135-K138 IonicContact OE1-NZ 3.81Å; E135-K138 PolarHBondContact OE1-NZ 2.82Å; E135-K138 IonicContact OE2-NZ 2.62Å; K138-T140 PolarHBondContact O-N 3.11Å; K138-C406 HydrophobicContact CB-CB 4.29Å; K138-C406 HydrophobicContact CD-CB 4.39Å; K138-C406 HydrophobicContact CG-CB 4.38Å; K138-Y498 HydrophobicContact CB-CD2 4.15Å; K138-Y498 HydrophobicContact CD-CD2 4.34Å; K138-Y498 HydrophobicContact CD-CE2 4.15Å
139	V	87.6	Confident	89.7	Confident	40 Å²	40	65.4 Å²	65.4	24%	0.242	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	104.7	174.8	-178.5	0	0	0	0	107.3	M137 R141 C406 V407 W495	M137-V139 PolarHBondContact O-N 2.91Å; V139-R141 HydrophobicContact CG1-CG 3.91Å; V139-R141 PolarHBondContact O-N 2.81Å; V139-C406 WeakPolarHBondContact O-CA 3.41Å; V139-V407 HydrophobicContact CB-CG2 4.46Å; V139-V407 PolarHBondContact N-O 3.02Å; V139-V407 PolarHBondContact O-N 3.05Å; V139-W495 HydrophobicContact CB-CZ3 4.28Å; V139-W495 HydrophobicContact CG2-CH2 4.43Å; V139-W495 HydrophobicContact CG2-CZ3 4.1Å
140	T	86.1	Confident	89.6	Confident	103 Å²	103	66.1 Å²	66.1	63%	0.632	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	118.5	173	-51	0	0	0	0	107.9	K138	K138-T140 PolarHBondContact O-N 3.11Å
141	R	75.6	Confident	89.6	Confident	133 Å²	133	66.2 Å²	66.2	50%	0.502	32%	0.315	S	S	.	.			trans	-139.5	147.9	-178.3	-93.2	-179.1	161.2	-165.8	-7.9	109.3	V139 M143	V139-R141 HydrophobicContact CG1-CG 3.91Å; V139-R141 PolarHBondContact O-N 2.81Å; R141-M143 PolarHBondContact O-N 3.19Å
142	E	78.9	Confident	89.5	Confident	164 Å²	164	64.2 Å²	64.2	77%	0.766	30%	0.304	S	S	*	.			trans	-62.2	130.8	163.2	-67	-170.2	164.1	0	0	107.9	D144	E142-D144 PolarHBondContact O-N 2.85Å
143	M	81.5	Confident	89.5	Confident	41 Å²	41	62.5 Å²	62.5	20%	0.202	29%	0.293	C	S	.	.			trans	-77.9	74.4	-174.6	-68.4	-63.8	159.8	0	0	109.8	R141 L148 A401 V407	R141-M143 PolarHBondContact O-N 3.19Å; M143-L148 HydrophobicContact CB-CD2 4.15Å; M143-L148 HydrophobicContact CB-CG 4.45Å; M143-L148 HydrophobicContact SD-CD2 4.24Å; M143-A401 VanDerWaalsContact CE-O 3.31Å; M143-A401 WeakPolarHBondContact CE-O 3.33Å; M143-A401 HydrophobicContact SD-CB 4.22Å; M143-V407 HydrophobicContact CE-CG1 4.06Å; M143-V407 HydrophobicContact SD-CG1 4.45Å
144	D	88.6	Confident	89.5	Confident	93 Å²	93	63.5 Å²	63.5	50%	0.497	30%	0.3	S	S	.	.			trans	-65.3	150.8	174.6	-67.6	-33.6	0	0	0	110.4	E142 E146 T147 L148	E142-D144 PolarHBondContact O-N 2.85Å; D144-E146 PolarHBondContact O-N 3.08Å; D144-E146 VanDerWaalsContact O-N 3.08Å; D144-T147 HydrophobicContact CB-CG2 4.35Å; D144-T147 PolarHBondContact N-OG1 3.46Å; D144-T147 PolarHBondContact O-N 2.92Å; D144-T147 PolarHBondContact O-OG1 3.29Å; D144-L148 PolarHBondContact O-N 2.86Å; D144-L148 VanDerWaalsContact O-N 3.07Å
145	R	91.8	Very high	89.5	Confident	106 Å²	106	63.8 Å²	63.8	40%	0.4	30%	0.301	S	S	.	.	H	α-helix	trans	-51.7	-38.1	177.4	-175	176	-177.6	-89.3	1.1	112.4	L148 I149 V173 D174 L177	R145-L148 PolarHBondContact O-N 3.35Å; R145-I149 HydrophobicContact CG-CD1 4.14Å; R145-I149 VanDerWaalsContact O-CG1 3.27Å; R145-I149 WeakPolarHBondContact O-CG1 2.94Å; R145-I149 PolarHBondContact O-N 3Å; R145-V173 HydrophobicContact CG-CG1 4.03Å; R145-D174 IonicContact CZ-OD1 2.8Å; R145-D174 VanDerWaalsContact CZ-OD1 3.31Å; R145-D174 IonicContact NE-OD1 3.07Å; R145-D174 PolarHBondContact NE-OD1 2.94Å; R145-D174 IonicContact NH2-OD1 2.65Å; R145-D174 PolarHBondContact NH2-OD1 3.31Å; R145-D174 IonicContact NH2-OD2 2.74Å; R145-D174 PolarHBondContact NH2-OD2 3.36Å; R145-L177 HydrophobicContact CB-CD1 4.45Å; R145-L177 HydrophobicContact CG-CD1 4.08Å
146	E	91	Very high	89.5	Confident	146 Å²	146	59.8 Å²	59.8	68%	0.682	28%	0.283	S	S	*	.	H	α-helix	trans	-64.3	-44.4	177.9	-65.5	-176.5	177.4	0	0	112.2	D144 L148 I149 H150	D144-E146 PolarHBondContact O-N 3.08Å; D144-E146 VanDerWaalsContact O-N 3.08Å; E146-L148 VanDerWaalsContact C-N 3.32Å; E146-L148 PolarHBondContact O-N 3.42Å; E146-I149 WeakPolarHBondContact O-CB 3.24Å; E146-I149 PolarHBondContact O-N 3.48Å; E146-H150 PolarHBondContact O-CD2 3.24Å; E146-H150 PolarHBondContact O-N 3.31Å
147	T	90.6	Very high	89.5	Confident	13 Å²	13	57.5 Å²	57.5	8%	0.08	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-41	176.3	64.7	0	0	0	0	111.6	D144 I149 H150 V151	D144-T147 HydrophobicContact CB-CG2 4.35Å; D144-T147 PolarHBondContact N-OG1 3.46Å; D144-T147 PolarHBondContact O-N 2.92Å; D144-T147 PolarHBondContact O-OG1 3.29Å; T147-I149 VanDerWaalsContact C-N 3.33Å; T147-I149 PolarHBondContact O-N 2.65Å; T147-H150 WeakPolarHBondContact O-CB 3.14Å; T147-H150 PolarHBondContact O-N 2.62Å; T147-H150 VanDerWaalsContact O-N 3.13Å; T147-V151 WeakPolarHBondContact O-CG2 3.33Å; T147-V151 PolarHBondContact O-N 3.31Å
148	L	92.9	Very high	89.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-36.3	176	-62.7	178.1	0	0	0	112.2	M143 D144 R145 E146 H150 V151 A152 V173 L177 V398 A401 I402	M143-L148 HydrophobicContact CB-CD2 4.15Å; M143-L148 HydrophobicContact CB-CG 4.45Å; M143-L148 HydrophobicContact SD-CD2 4.24Å; D144-L148 PolarHBondContact O-N 2.86Å; D144-L148 VanDerWaalsContact O-N 3.07Å; R145-L148 PolarHBondContact O-N 3.35Å; E146-L148 VanDerWaalsContact C-N 3.32Å; E146-L148 PolarHBondContact O-N 3.42Å; L148-H150 VanDerWaalsContact C-N 3.32Å; L148-V151 PolarHBondContact O-N 2.89Å; L148-A152 WeakPolarHBondContact O-CB 3.36Å; L148-A152 PolarHBondContact O-N 2.96Å; L148-V173 HydrophobicContact CB-CG1 3.85Å; L148-V173 HydrophobicContact CB-CG2 4.06Å; L148-V173 HydrophobicContact CD1-CG1 4.39Å; L148-V173 WeakPolarHBondContact O-CG2 3.45Å; L148-L177 HydrophobicContact CD1-CD2 3.97Å; L148-L177 HydrophobicContact CD1-CG 4.48Å; L148-V398 HydrophobicContact CB-CG1 4.43Å; L148-V398 HydrophobicContact CD2-CG1 4.18Å; L148-A401 HydrophobicContact CD2-CB 4.05Å; L148-I402 HydrophobicContact CD1-CD1 4.1Å; L148-I402 HydrophobicContact CD1-CG1 4.15Å; L148-I402 HydrophobicContact CD2-CD1 4.47Å; L148-I402 HydrophobicContact CD2-CG1 3.85Å
149	I	94.6	Very high	89.7	Confident	19 Å²	19	55.5 Å²	55.5	10%	0.097	26%	0.261	C	S	.	.	H	α-helix	trans	-60.8	-43.7	171.7	-74.8	168.5	0	0	0	110.2	R145 E146 T147 R153 T169 V173	R145-I149 HydrophobicContact CG-CD1 4.14Å; R145-I149 VanDerWaalsContact O-CG1 3.27Å; R145-I149 WeakPolarHBondContact O-CG1 2.94Å; R145-I149 PolarHBondContact O-N 3Å; E146-I149 WeakPolarHBondContact O-CB 3.24Å; E146-I149 PolarHBondContact O-N 3.48Å; T147-I149 VanDerWaalsContact C-N 3.33Å; T147-I149 PolarHBondContact O-N 2.65Å; I149-R153 WeakPolarHBondContact O-CB 3.32Å; I149-R153 PolarHBondContact O-N 2.94Å; I149-T169 HydrophobicContact CB-CG2 4.09Å; I149-T169 HydrophobicContact CG1-CG2 4.35Å; I149-T169 HydrophobicContact CG2-CG2 3.65Å; I149-T169 WeakPolarHBondContact O-CG2 3.28Å; I149-V173 HydrophobicContact CG1-CB 4.38Å; I149-V173 HydrophobicContact CG1-CG1 4.4Å; I149-V173 HydrophobicContact CG1-CG2 4.03Å
150	H	92.9	Very high	89.8	Confident	60 Å²	60	54.2 Å²	54.2	28%	0.278	25%	0.253	S	S	.	.	H	α-helix	trans	-65.1	-40.2	177.3	-72.8	-68.2	0	0	0	112.9	E146 T147 L148 R153 T154 G493	E146-H150 PolarHBondContact O-CD2 3.24Å; E146-H150 PolarHBondContact O-N 3.31Å; T147-H150 WeakPolarHBondContact O-CB 3.14Å; T147-H150 PolarHBondContact O-N 2.62Å; T147-H150 VanDerWaalsContact O-N 3.13Å; L148-H150 VanDerWaalsContact C-N 3.32Å; H150-R153 PolarHBondContact ND1-NH1 2.98Å; H150-T154 WeakPolarHBondContact O-CB 3.11Å; H150-T154 PolarHBondContact O-N 3.17Å; H150-T154 PolarHBondContact O-OG1 3.5Å; H150-G493 WeakPolarHBondContact CB-O 3.33Å
151	V	93.3	Very high	89.9	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-51.3	174.5	175.6	0	0	0	0	111	T147 L148 R153 T154 S155 A397 A401 V407 W495	T147-V151 WeakPolarHBondContact O-CG2 3.33Å; T147-V151 PolarHBondContact O-N 3.31Å; L148-V151 PolarHBondContact O-N 2.89Å; V151-R153 VanDerWaalsContact C-N 3.33Å; V151-R153 PolarHBondContact O-N 3.48Å; V151-T154 PolarHBondContact O-N 2.65Å; V151-T154 VanDerWaalsContact O-N 3.16Å; V151-S155 PolarHBondContact O-N 2.83Å; V151-S155 VanDerWaalsContact O-N 3.11Å; V151-A397 HydrophobicContact CG1-CB 4.3Å; V151-A401 HydrophobicContact CG1-CB 4.26Å; V151-A401 HydrophobicContact CG2-CB 4.32Å; V151-V407 HydrophobicContact CG2-CG1 3.95Å; V151-W495 HydrophobicContact CG2-CB 3.97Å
152	A	94.3	Very high	90.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-44.2	178.2	0	0	0	0	0	111.7	L148 T154 S155 L156 T169 V172 V173 V398	L148-A152 WeakPolarHBondContact O-CB 3.36Å; L148-A152 PolarHBondContact O-N 2.96Å; A152-T154 VanDerWaalsContact C-N 3.32Å; A152-T154 PolarHBondContact O-N 3.4Å; A152-S155 PolarHBondContact O-N 3.38Å; A152-L156 VanDerWaalsContact O-CB 3.3Å; A152-L156 WeakPolarHBondContact O-CB 3.12Å; A152-L156 VanDerWaalsContact O-CG 3.25Å; A152-L156 WeakPolarHBondContact O-CG 3.47Å; A152-L156 PolarHBondContact O-N 3.36Å; A152-T169 HydrophobicContact CB-CG2 3.82Å; A152-V172 HydrophobicContact CB-CG1 4.37Å; A152-V173 HydrophobicContact CB-CG2 3.81Å; A152-V398 HydrophobicContact CB-CG2 3.62Å
153	R	94.3	Very high	91	Very high	66 Å²	66	52.2 Å²	52.2	25%	0.249	25%	0.251	C	S	.	.	H	α-helix	trans	-60.1	-42.6	176.8	-178.9	-178.7	-74.1	133.6	4.6	111.5	I149 H150 V151 R157 D166 T169	I149-R153 WeakPolarHBondContact O-CB 3.32Å; I149-R153 PolarHBondContact O-N 2.94Å; H150-R153 PolarHBondContact ND1-NH1 2.98Å; V151-R153 VanDerWaalsContact C-N 3.33Å; V151-R153 PolarHBondContact O-N 3.48Å; R153-R157 HydrophobicContact CG-CG 4.2Å; R153-R157 VanDerWaalsContact CG-NE 3.35Å; R153-R157 VanDerWaalsContact O-CB 3.25Å; R153-R157 WeakPolarHBondContact O-CB 3.31Å; R153-R157 WeakPolarHBondContact O-CG 3.5Å; R153-R157 PolarHBondContact O-N 3.5Å; R153-D166 WeakPolarHBondContact CD-OD1 3.22Å; R153-D166 IonicContact CZ-OD1 3.97Å; R153-D166 IonicContact NE-OD1 2.76Å; R153-D166 PolarHBondContact NE-OD1 2.82Å; R153-T169 HydrophobicContact CB-CG2 4.02Å
154	T	92.4	Very high	91.4	Very high	25 Å²	25	51 Å²	51	15%	0.153	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-49.9	179.3	-58.8	0	0	0	0	110.6	H150 V151 A152 T158 V494 W495	H150-T154 WeakPolarHBondContact O-CB 3.11Å; H150-T154 PolarHBondContact O-N 3.17Å; H150-T154 PolarHBondContact O-OG1 3.5Å; V151-T154 PolarHBondContact O-N 2.65Å; V151-T154 VanDerWaalsContact O-N 3.16Å; A152-T154 VanDerWaalsContact C-N 3.32Å; A152-T154 PolarHBondContact O-N 3.4Å; T154-T158 WeakPolarHBondContact O-CG2 3.1Å; T154-V494 HydrophobicContact CG2-CG1 3.81Å; T154-W495 WeakPolarHBondContact CG2-O 3.47Å; T154-W495 PolarHBondContact OG1-N 2.98Å
155	S	92.7	Very high	91.6	Very high	5 Å²	5	46.5 Å²	46.5	4%	0.035	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-48.6	179.2	-173.4	0	0	0	0	112.1	D90 V151 A152 R157 T158	D90-S155 PolarHBondContact OD2-OG 3.38Å; V151-S155 PolarHBondContact O-N 2.83Å; V151-S155 VanDerWaalsContact O-N 3.11Å; A152-S155 PolarHBondContact O-N 3.38Å; S155-R157 PolarHBondContact O-N 3.35Å; S155-T158 WeakPolarHBondContact O-CB 3.3Å; S155-T158 PolarHBondContact O-N 3.44Å; S155-T158 VanDerWaalsContact O-N 3.14Å; S155-T158 PolarHBondContact O-OG1 3.36Å
156	L	93.1	Very high	91.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-40.8	-177.3	-72.4	168	0	0	0	113.1	A152 T158 K159 V160 A165 L168 V172 A390	A152-L156 VanDerWaalsContact O-CB 3.3Å; A152-L156 WeakPolarHBondContact O-CB 3.12Å; A152-L156 VanDerWaalsContact O-CG 3.25Å; A152-L156 WeakPolarHBondContact O-CG 3.47Å; A152-L156 PolarHBondContact O-N 3.36Å; L156-T158 PolarHBondContact O-N 3.32Å; L156-T158 VanDerWaalsContact O-N 3.12Å; L156-K159 PolarHBondContact O-N 2.95Å; L156-V160 VanDerWaalsContact O-CG2 3.31Å; L156-V160 WeakPolarHBondContact O-CG2 3.33Å; L156-V160 PolarHBondContact O-N 3.14Å; L156-A165 HydrophobicContact CB-CB 3.9Å; L156-L168 HydrophobicContact CD1-CB 3.86Å; L156-L168 HydrophobicContact CD2-CB 4.47Å; L156-L168 HydrophobicContact CD2-CD1 4.5Å; L156-V172 HydrophobicContact CD1-CG2 4.3Å; L156-A390 HydrophobicContact CD2-CB 4.22Å; L156-A390 VanDerWaalsContact CD2-O 3.31Å; L156-A390 WeakPolarHBondContact CD2-O 3.26Å
157	R	92	Very high	91.6	Very high	97 Å²	97	40.6 Å²	40.6	37%	0.366	20%	0.202	S	C	.	.	H	α-helix	trans	-61	-22.1	178.4	-78.2	-179.1	177	-167.6	-2.8	112.7	P40 R153 S155 K159 A165 D166	P40-R157 WeakPolarHBondContact CA-O 3.49Å; P40-R157 HydrophobicContact CB-CB 4.28Å; P40-R157 WeakPolarHBondContact CB-O 3.36Å; R153-R157 HydrophobicContact CG-CG 4.2Å; R153-R157 VanDerWaalsContact CG-NE 3.35Å; R153-R157 VanDerWaalsContact O-CB 3.25Å; R153-R157 WeakPolarHBondContact O-CB 3.31Å; R153-R157 WeakPolarHBondContact O-CG 3.5Å; R153-R157 PolarHBondContact O-N 3.5Å; S155-R157 PolarHBondContact O-N 3.35Å; R157-K159 VanDerWaalsContact C-N 3.32Å; R157-A165 HydrophobicContact CB-CB 4.49Å; R157-A165 HydrophobicContact CG-CB 3.7Å; R157-D166 IonicContact CZ-OD1 3.39Å; R157-D166 IonicContact NE-OD1 3.66Å; R157-D166 IonicContact NH2-OD1 3.21Å; R157-D166 PolarHBondContact NH2-OD1 3.42Å; R157-D166 IonicContact NH2-OD2 2.68Å; R157-D166 PolarHBondContact NH2-OD2 3.12Å
158	T	90.1	Very high	91.7	Very high	31 Å²	31	40.1 Å²	40.1	19%	0.19	20%	0.199	C	C	.	.	H	α-helix	trans	-71.2	-27.2	174.3	71.9	0	0	0	0	112.8	K58 T154 S155 L156	K58-T158 WeakPolarHBondContact CD-O 3.48Å; K58-T158 WeakPolarHBondContact CE-O 3.36Å; K58-T158 PolarHBondContact NZ-O 3.44Å; T154-T158 WeakPolarHBondContact O-CG2 3.1Å; S155-T158 WeakPolarHBondContact O-CB 3.3Å; S155-T158 PolarHBondContact O-N 3.44Å; S155-T158 VanDerWaalsContact O-N 3.14Å; S155-T158 PolarHBondContact O-OG1 3.36Å; L156-T158 PolarHBondContact O-N 3.32Å; L156-T158 VanDerWaalsContact O-N 3.12Å
159	K	88.8	Confident	91.7	Very high	20 Å²	20	40 Å²	40	9%	0.087	20%	0.199	C	C	.	.	H	α-helix	trans	-107.9	-33.7	-169.5	-53.7	-67	168	119	0	113.8	D59 L156 R157 Q386 A390 D393	D59-K159 HydrophobicContact CB-CD 4.22Å; D59-K159 VanDerWaalsContact CG-NZ 3.31Å; D59-K159 IonicContact OD1-NZ 3.89Å; D59-K159 PolarHBondContact OD1-NZ 2.95Å; L156-K159 PolarHBondContact O-N 2.95Å; R157-K159 VanDerWaalsContact C-N 3.32Å; K159-Q386 PolarHBondContact O-NE2 3.05Å; K159-A390 HydrophobicContact CB-CB 3.59Å; K159-A390 HydrophobicContact CG-CB 4.24Å; K159-D393 IonicContact NZ-OD2 2.91Å; K159-D393 PolarHBondContact NZ-OD2 2.99Å
160	V	90.3	Very high	91.7	Very high	13 Å²	13	44.5 Å²	44.5	8%	0.079	22%	0.219	C	C	.	.	S	Bend	trans	-124.6	168.1	-177.2	-66.1	0	0	0	0	111.9	L156 L164 A165 L168 I387 A390	L156-V160 VanDerWaalsContact O-CG2 3.31Å; L156-V160 WeakPolarHBondContact O-CG2 3.33Å; L156-V160 PolarHBondContact O-N 3.14Å; V160-L164 HydrophobicContact CB-CD2 4.3Å; V160-L164 HydrophobicContact CG1-CD2 4.43Å; V160-A165 HydrophobicContact CG2-CB 3.89Å; V160-L168 HydrophobicContact CG2-CD1 4.28Å; V160-I387 HydrophobicContact CG1-CG1 4.41Å; V160-A390 HydrophobicContact CG1-CB 3.71Å
161	H	88.1	Confident	91.7	Very high	128 Å²	128	42.1 Å²	42.1	59%	0.593	21%	0.21	S	C	*	.			trans	-60.3	148.4	175.6	-60.5	-64.6	0	0	0	111.5	E163 L164 A165	H161-E163 PolarHBondContact O-N 3.12Å; H161-L164 PolarHBondContact O-N 3.36Å; H161-A165 WeakPolarHBondContact O-CB 3.11Å; H161-A165 PolarHBondContact O-N 3.09Å
162	A	88.8	Confident	91.8	Very high	54 Å²	54	42 Å²	42	45%	0.446	21%	0.21	S	C	.	.	H	α-helix	trans	-57.8	-44.1	-171.8	0	0	0	0	0	113.5	L164 A165 D166	A162-L164 PolarHBondContact O-N 3.23Å; A162-A165 WeakPolarHBondContact O-CB 3.33Å; A162-A165 PolarHBondContact O-N 3.13Å; A162-D166 PolarHBondContact O-N 3.45Å
163	E	89.8	Confident	91.8	Very high	176 Å²	176	42 Å²	42	82%	0.822	21%	0.21	S	C	*	.	H	α-helix	trans	-62	-43.7	178.9	-64.9	175.8	-175.9	0	0	112	H161 D166 L167	H161-E163 PolarHBondContact O-N 3.12Å; E163-D166 PolarHBondContact O-N 2.87Å; E163-L167 PolarHBondContact O-N 2.91Å
164	L	90.1	Very high	91.7	Very high	15 Å²	15	40.8 Å²	40.8	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-68.8	-37.6	176.9	-174.3	62.6	0	0	0	111.3	V160 H161 A162 D166 L167 L168 I387	V160-L164 HydrophobicContact CB-CD2 4.3Å; V160-L164 HydrophobicContact CG1-CD2 4.43Å; H161-L164 PolarHBondContact O-N 3.36Å; A162-L164 PolarHBondContact O-N 3.23Å; L164-D166 VanDerWaalsContact C-N 3.33Å; L164-D166 PolarHBondContact O-N 3.5Å; L164-L167 PolarHBondContact O-N 2.96Å; L164-L168 HydrophobicContact CD1-CD1 4.42Å; L164-L168 HydrophobicContact CD1-CG 4.38Å; L164-L168 HydrophobicContact CG-CD1 3.93Å; L164-L168 HydrophobicContact CG-CG 4.34Å; L164-L168 WeakPolarHBondContact O-CB 3.44Å; L164-L168 VanDerWaalsContact O-CG 3.24Å; L164-L168 WeakPolarHBondContact O-CG 3.25Å; L164-L168 PolarHBondContact O-N 3.11Å; L164-I387 HydrophobicContact CD2-CD1 3.78Å; L164-I387 HydrophobicContact CD2-CG1 3.84Å
165	A	91.1	Very high	91.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-46.1	174.9	0	0	0	0	0	110.9	L156 R157 V160 H161 A162 L167 L168 T169	L156-A165 HydrophobicContact CB-CB 3.9Å; R157-A165 HydrophobicContact CB-CB 4.49Å; R157-A165 HydrophobicContact CG-CB 3.7Å; V160-A165 HydrophobicContact CG2-CB 3.89Å; H161-A165 WeakPolarHBondContact O-CB 3.11Å; H161-A165 PolarHBondContact O-N 3.09Å; A162-A165 WeakPolarHBondContact O-CB 3.33Å; A162-A165 PolarHBondContact O-N 3.13Å; A165-L167 VanDerWaalsContact C-N 3.33Å; A165-L167 PolarHBondContact O-N 3.39Å; A165-L168 PolarHBondContact O-N 3.44Å; A165-T169 WeakPolarHBondContact O-CB 3.42Å; A165-T169 PolarHBondContact O-N 2.96Å; A165-T169 PolarHBondContact O-OG1 3.37Å
166	D	91.4	Very high	91.8	Very high	55 Å²	55	39.3 Å²	39.3	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-64	-38	-178.5	-70.4	-33.1	0	0	0	111.6	R153 R157 A162 E163 L164 T169	R153-D166 WeakPolarHBondContact CD-OD1 3.22Å; R153-D166 IonicContact CZ-OD1 3.97Å; R153-D166 IonicContact NE-OD1 2.76Å; R153-D166 PolarHBondContact NE-OD1 2.82Å; R157-D166 IonicContact CZ-OD1 3.39Å; R157-D166 IonicContact NE-OD1 3.66Å; R157-D166 IonicContact NH2-OD1 3.21Å; R157-D166 PolarHBondContact NH2-OD1 3.42Å; R157-D166 IonicContact NH2-OD2 2.68Å; R157-D166 PolarHBondContact NH2-OD2 3.12Å; A162-D166 PolarHBondContact O-N 3.45Å; E163-D166 PolarHBondContact O-N 2.87Å; L164-D166 VanDerWaalsContact C-N 3.33Å; L164-D166 PolarHBondContact O-N 3.5Å; D166-T169 PolarHBondContact O-N 2.93Å
167	L	91.3	Very high	91.7	Very high	73 Å²	73	42.5 Å²	42.5	38%	0.382	22%	0.215	S	C	.	.	H	α-helix	trans	-67	-43.2	173.5	-176.6	138.2	0	0	0	112.8	E163 L164 A165 T169 S202	E163-L167 PolarHBondContact O-N 2.91Å; L164-L167 PolarHBondContact O-N 2.96Å; A165-L167 VanDerWaalsContact C-N 3.33Å; A165-L167 PolarHBondContact O-N 3.39Å; L167-T169 VanDerWaalsContact C-N 3.29Å; L167-T169 PolarHBondContact O-N 3.16Å; L167-S202 VanDerWaalsContact CD1-O 3.27Å; L167-S202 WeakPolarHBondContact CD1-O 3.46Å
168	L	93.3	Very high	91.6	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-28.7	178.9	-69.8	173	0	0	0	112.5	L156 V160 L164 A165 E170 A171 V172 T204 I387 V391	L156-L168 HydrophobicContact CD1-CB 3.86Å; L156-L168 HydrophobicContact CD2-CB 4.47Å; L156-L168 HydrophobicContact CD2-CD1 4.5Å; V160-L168 HydrophobicContact CG2-CD1 4.28Å; L164-L168 HydrophobicContact CD1-CD1 4.42Å; L164-L168 HydrophobicContact CD1-CG 4.38Å; L164-L168 HydrophobicContact CG-CD1 3.93Å; L164-L168 HydrophobicContact CG-CG 4.34Å; L164-L168 WeakPolarHBondContact O-CB 3.44Å; L164-L168 VanDerWaalsContact O-CG 3.24Å; L164-L168 WeakPolarHBondContact O-CG 3.25Å; L164-L168 PolarHBondContact O-N 3.11Å; A165-L168 PolarHBondContact O-N 3.44Å; L168-E170 PolarHBondContact O-N 2.94Å; L168-A171 PolarHBondContact O-N 2.94Å; L168-V172 WeakPolarHBondContact O-CB 3.31Å; L168-V172 VanDerWaalsContact O-CG2 3.28Å; L168-V172 WeakPolarHBondContact O-CG2 3.45Å; L168-V172 PolarHBondContact O-N 3.23Å; L168-T204 HydrophobicContact CD2-CG2 3.41Å; L168-T204 VanDerWaalsContact CD2-CG2 3.41Å; L168-I387 HydrophobicContact CD1-CG2 3.88Å; L168-I387 HydrophobicContact CD2-CG2 4.29Å; L168-V391 HydrophobicContact CD1-CG2 4.23Å; L168-V391 HydrophobicContact CD2-CG2 4.04Å
169	T	94.2	Very high	91.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-57.8	-48.4	-175.7	-64.5	0	0	0	0	111.4	I149 A152 R153 A165 D166 L167 A171 V172 V173	I149-T169 HydrophobicContact CB-CG2 4.09Å; I149-T169 HydrophobicContact CG1-CG2 4.35Å; I149-T169 HydrophobicContact CG2-CG2 3.65Å; I149-T169 WeakPolarHBondContact O-CG2 3.28Å; A152-T169 HydrophobicContact CB-CG2 3.82Å; R153-T169 HydrophobicContact CB-CG2 4.02Å; A165-T169 WeakPolarHBondContact O-CB 3.42Å; A165-T169 PolarHBondContact O-N 2.96Å; A165-T169 PolarHBondContact O-OG1 3.37Å; D166-T169 PolarHBondContact O-N 2.93Å; L167-T169 VanDerWaalsContact C-N 3.29Å; L167-T169 PolarHBondContact O-N 3.16Å; T169-A171 PolarHBondContact O-N 2.92Å; T169-V172 PolarHBondContact O-N 3.46Å; T169-V173 WeakPolarHBondContact O-CG2 3.48Å; T169-V173 PolarHBondContact O-N 3.32Å; T169-V173 VanDerWaalsContact O-N 3.1Å
170	E	92.7	Very high	91.5	Very high	112 Å²	112	41.9 Å²	41.9	52%	0.523	22%	0.221	S	C	.	.	H	α-helix	trans	-63.7	-44.1	179.3	-63.1	-170.9	170.5	0	0	111.5	L168 V172 V173 D174	L168-E170 PolarHBondContact O-N 2.94Å; E170-V172 PolarHBondContact O-N 2.81Å; E170-V173 PolarHBondContact O-N 2.87Å; E170-D174 WeakPolarHBondContact O-CB 3.11Å; E170-D174 VanDerWaalsContact O-CG 3.3Å; E170-D174 PolarHBondContact O-N 3.4Å
171	A	93.7	Very high	91.2	Very high	11 Å²	11	44.8 Å²	44.8	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-41.2	180	0	0	0	0	0	112.3	L168 T169 A175 L206 L374	L168-A171 PolarHBondContact O-N 2.94Å; T169-A171 PolarHBondContact O-N 2.92Å; A171-A175 VanDerWaalsContact O-CB 3.22Å; A171-A175 WeakPolarHBondContact O-CB 3.34Å; A171-A175 PolarHBondContact O-N 3Å; A171-L206 HydrophobicContact CB-CB 4.07Å; A171-L374 HydrophobicContact CB-CD2 3.7Å
172	V	95.3	Very high	90.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-47.1	178.2	167.6	0	0	0	0	110.9	A152 L156 L168 T169 E170 A175 V176 L374 V391 L395 V398	A152-V172 HydrophobicContact CB-CG1 4.37Å; L156-V172 HydrophobicContact CD1-CG2 4.3Å; L168-V172 WeakPolarHBondContact O-CB 3.31Å; L168-V172 VanDerWaalsContact O-CG2 3.28Å; L168-V172 WeakPolarHBondContact O-CG2 3.45Å; L168-V172 PolarHBondContact O-N 3.23Å; T169-V172 PolarHBondContact O-N 3.46Å; E170-V172 PolarHBondContact O-N 2.81Å; V172-A175 PolarHBondContact O-N 3.44Å; V172-V176 WeakPolarHBondContact O-CG2 3.21Å; V172-V176 PolarHBondContact O-N 3.32Å; V172-V176 VanDerWaalsContact O-N 3.13Å; V172-L374 HydrophobicContact CG2-CD1 4.45Å; V172-V391 HydrophobicContact CG2-CG1 4.26Å; V172-L395 HydrophobicContact CG1-CD2 3.97Å; V172-L395 HydrophobicContact CG1-CG 4.22Å; V172-V398 HydrophobicContact CG1-CG2 4.07Å
173	V	94.8	Very high	90.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.1	-47.3	-179.9	173.5	0	0	0	0	110.9	R145 L148 I149 A152 T169 E170 A175 V176 L177 V398	R145-V173 HydrophobicContact CG-CG1 4.03Å; L148-V173 HydrophobicContact CB-CG1 3.85Å; L148-V173 HydrophobicContact CB-CG2 4.06Å; L148-V173 HydrophobicContact CD1-CG1 4.39Å; L148-V173 WeakPolarHBondContact O-CG2 3.45Å; I149-V173 HydrophobicContact CG1-CB 4.38Å; I149-V173 HydrophobicContact CG1-CG1 4.4Å; I149-V173 HydrophobicContact CG1-CG2 4.03Å; A152-V173 HydrophobicContact CB-CG2 3.81Å; T169-V173 WeakPolarHBondContact O-CG2 3.48Å; T169-V173 PolarHBondContact O-N 3.32Å; T169-V173 VanDerWaalsContact O-N 3.1Å; E170-V173 PolarHBondContact O-N 2.87Å; V173-A175 PolarHBondContact O-N 3.01Å; V173-V176 PolarHBondContact O-N 3.28Å; V173-L177 HydrophobicContact CG1-CD1 3.75Å; V173-L177 HydrophobicContact CG1-CG 4.22Å; V173-L177 WeakPolarHBondContact O-CB 3.25Å; V173-L177 VanDerWaalsContact O-CG 3.31Å; V173-L177 WeakPolarHBondContact O-CG 3.3Å; V173-L177 PolarHBondContact O-N 3.45Å; V173-V398 HydrophobicContact CG2-CG2 4.24Å
174	D	93.1	Very high	90.1	Very high	39 Å²	39	46 Å²	46	21%	0.209	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-31.7	179	-72.3	-8.6	0	0	0	111.9	R145 E170 A178 L206	R145-D174 IonicContact CZ-OD1 2.8Å; R145-D174 VanDerWaalsContact CZ-OD1 3.31Å; R145-D174 IonicContact NE-OD1 3.07Å; R145-D174 PolarHBondContact NE-OD1 2.94Å; R145-D174 IonicContact NH2-OD1 2.65Å; R145-D174 PolarHBondContact NH2-OD1 3.31Å; R145-D174 IonicContact NH2-OD2 2.74Å; R145-D174 PolarHBondContact NH2-OD2 3.36Å; E170-D174 WeakPolarHBondContact O-CB 3.11Å; E170-D174 VanDerWaalsContact O-CG 3.3Å; E170-D174 PolarHBondContact O-N 3.4Å; D174-A178 WeakPolarHBondContact O-CB 3.34Å; D174-A178 PolarHBondContact O-N 2.79Å; D174-L206 HydrophobicContact CB-CD2 3.4Å
175	A	93.6	Very high	89.9	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-45.4	174.9	0	0	0	0	0	112.2	A171 V172 V173 A178 V191 L206 V372 L374 L395	A171-A175 VanDerWaalsContact O-CB 3.22Å; A171-A175 WeakPolarHBondContact O-CB 3.34Å; A171-A175 PolarHBondContact O-N 3Å; V172-A175 PolarHBondContact O-N 3.44Å; V173-A175 PolarHBondContact O-N 3.01Å; A175-A178 PolarHBondContact O-N 3.49Å; A175-V191 HydrophobicContact CB-CG1 4.36Å; A175-V191 HydrophobicContact CB-CG2 4.35Å; A175-L206 HydrophobicContact CB-CD1 3.84Å; A175-V372 HydrophobicContact CB-CG2 3.87Å; A175-L374 HydrophobicContact CB-CD1 4.12Å; A175-L374 HydrophobicContact CB-CD2 4.43Å; A175-L374 HydrophobicContact CB-CG 4.25Å; A175-L395 HydrophobicContact CB-CD2 4.25Å
176	V	92.9	Very high	89.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.8	-42	178.9	179.3	0	0	0	0	110.8	V172 V173 A178 I179 H180 I186 L395 V398 I402	V172-V176 WeakPolarHBondContact O-CG2 3.21Å; V172-V176 PolarHBondContact O-N 3.32Å; V172-V176 VanDerWaalsContact O-N 3.13Å; V173-V176 PolarHBondContact O-N 3.28Å; V176-A178 VanDerWaalsContact C-N 3.27Å; V176-A178 PolarHBondContact O-N 3.31Å; V176-I179 PolarHBondContact O-N 2.98Å; V176-I179 VanDerWaalsContact O-N 3.13Å; V176-H180 WeakPolarHBondContact O-CB 3.36Å; V176-H180 PolarHBondContact O-N 3.49Å; V176-I186 HydrophobicContact CG1-CD1 4.07Å; V176-I186 HydrophobicContact CG1-CG2 4.31Å; V176-L395 HydrophobicContact CG2-CD2 3.57Å; V176-V398 HydrophobicContact CB-CG1 3.89Å; V176-V398 HydrophobicContact CG1-CG1 3.93Å; V176-V398 HydrophobicContact CG2-CB 4.21Å; V176-V398 HydrophobicContact CG2-CG1 3.97Å; V176-I402 HydrophobicContact CG1-CD1 3.57Å
177	L	91.6	Very high	89.5	Confident	66 Å²	66	50.9 Å²	50.9	35%	0.346	27%	0.274	S	S	.	.	H	α-helix	trans	-62.3	-33.2	176.9	-71.4	176.2	0	0	0	112.7	R145 L148 V173 I179	R145-L177 HydrophobicContact CB-CD1 4.45Å; R145-L177 HydrophobicContact CG-CD1 4.08Å; L148-L177 HydrophobicContact CD1-CD2 3.97Å; L148-L177 HydrophobicContact CD1-CG 4.48Å; V173-L177 HydrophobicContact CG1-CD1 3.75Å; V173-L177 HydrophobicContact CG1-CG 4.22Å; V173-L177 WeakPolarHBondContact O-CB 3.25Å; V173-L177 VanDerWaalsContact O-CG 3.31Å; V173-L177 WeakPolarHBondContact O-CG 3.3Å; V173-L177 PolarHBondContact O-N 3.45Å; L177-I179 VanDerWaalsContact C-N 3.27Å; L177-I179 PolarHBondContact O-N 3.45Å
178	A	89.5	Confident	89.4	Confident	39 Å²	39	49.1 Å²	49.1	32%	0.322	27%	0.265	S	S	.	.	H	α-helix	trans	-67.4	-27.4	176.4	0	0	0	0	0	113.4	D174 A175 V176 V372	D174-A178 WeakPolarHBondContact O-CB 3.34Å; D174-A178 PolarHBondContact O-N 2.79Å; A175-A178 PolarHBondContact O-N 3.49Å; V176-A178 VanDerWaalsContact C-N 3.27Å; V176-A178 PolarHBondContact O-N 3.31Å; A178-V372 HydrophobicContact CB-CG1 3.68Å
179	I	88.4	Confident	89.2	Confident	18 Å²	18	56.7 Å²	56.7	9%	0.092	30%	0.298	C	S	.	.	H	α-helix	trans	-93.5	-28.1	-179.4	-65	160.9	0	0	0	111.3	V176 L177 R181 I186 M190 V191 V372	V176-I179 PolarHBondContact O-N 2.98Å; V176-I179 VanDerWaalsContact O-N 3.13Å; L177-I179 VanDerWaalsContact C-N 3.27Å; L177-I179 PolarHBondContact O-N 3.45Å; I179-R181 PolarHBondContact O-N 2.98Å; I179-I186 HydrophobicContact CG2-CG2 4.49Å; I179-M190 HydrophobicContact CD1-CB 3.77Å; I179-M190 HydrophobicContact CG1-CB 3.98Å; I179-M190 HydrophobicContact CG2-CB 4.05Å; I179-M190 HydrophobicContact CG2-CG 4.49Å; I179-V191 HydrophobicContact CD1-CB 4.16Å; I179-V191 HydrophobicContact CD1-CG2 3.08Å; I179-V372 HydrophobicContact CD1-CG2 4.05Å; I179-V372 HydrophobicContact CG1-CG2 4.43Å
180	H	88.4	Confident	89	Confident	78 Å²	78	58.4 Å²	58.4	36%	0.361	31%	0.307	S	S	.	.			trans	-57.6	130.4	-176.1	-179.8	62.4	0	0	0	112	V176	V176-H180 WeakPolarHBondContact O-CB 3.36Å; V176-H180 PolarHBondContact O-N 3.49Å
181	R	84.3	Confident	88.9	Confident	74 Å²	74	53.4 Å²	53.4	28%	0.279	28%	0.284	S	S	.	.			trans	-124.9	142.3	172.2	-67.7	176.9	-170.4	161.8	11.5	109.4	I179 N183 E184	I179-R181 PolarHBondContact O-N 2.98Å; R181-N183 PolarHBondContact O-N 3.48Å; R181-E184 HydrophobicContact CB-CB 4.17Å; R181-E184 WeakPolarHBondContact CD-OE2 3.47Å; R181-E184 IonicContact CZ-OE2 3.49Å; R181-E184 IonicContact NE-OE2 2.67Å; R181-E184 IonicContact NH1-OE1 3.02Å; R181-E184 IonicContact NH1-OE2 3.71Å; R181-E184 PolarHBondContact NH1-OE2 3.07Å; R181-E184 PolarHBondContact O-N 3.04Å
182	P	78.8	Confident	88.9	Confident	108 Å²	108	53.4 Å²	53.4	70%	0.701	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	126.9	171.3	26.4	-32.1	0	0	0	109
183	N	78.6	Confident	88.9	Confident	174 Å²	174	54.7 Å²	54.7	93%	0.93	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	8	176	-45.9	-48.2	0	0	0	117.9	R181	R181-N183 PolarHBondContact O-N 3.48Å
184	E	85.3	Confident	88.8	Confident	101 Å²	101	55.3 Å²	55.3	47%	0.472	29%	0.292	S	S	.	.	S	Bend	trans	-116.6	137.8	172.9	-164.1	176.5	171.3	0	0	110.1	R181	R181-E184 HydrophobicContact CB-CB 4.17Å; R181-E184 WeakPolarHBondContact CD-OE2 3.47Å; R181-E184 IonicContact CZ-OE2 3.49Å; R181-E184 IonicContact NE-OE2 2.67Å; R181-E184 IonicContact NH1-OE1 3.02Å; R181-E184 IonicContact NH1-OE2 3.71Å; R181-E184 PolarHBondContact NH1-OE2 3.07Å; R181-E184 PolarHBondContact O-N 3.04Å
185	P	85.1	Confident	88.8	Confident	100 Å²	100	56.1 Å²	56.1	65%	0.649	29%	0.294	S	S	*	.			trans	-62	144.5	175.7	26.5	-35	0	0	0	110.9	D187	P185-D187 PolarHBondContact O-N 3.03Å
186	I	87.5	Confident	88.8	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.041	29%	0.294	C	S	.	.			trans	-76	118.2	-175.7	-61.3	173.4	0	0	0	109.2	V176 I179 L188 K399 I402 E403	V176-I186 HydrophobicContact CG1-CD1 4.07Å; V176-I186 HydrophobicContact CG1-CG2 4.31Å; I179-I186 HydrophobicContact CG2-CG2 4.49Å; I186-L188 HydrophobicContact CG2-CD2 4.22Å; I186-K399 HydrophobicContact CB-CD 4.21Å; I186-K399 HydrophobicContact CB-CG 4.15Å; I186-K399 HydrophobicContact CG2-CD 4.37Å; I186-K399 HydrophobicContact CG2-CG 4.4Å; I186-K399 WeakPolarHBondContact O-CE 3.44Å; I186-K399 PolarHBondContact O-NZ 3Å; I186-I402 HydrophobicContact CD1-CB 3.87Å; I186-I402 HydrophobicContact CD1-CD1 3.82Å; I186-I402 HydrophobicContact CD1-CG1 4.46Å; I186-I402 HydrophobicContact CD1-CG2 3.77Å; I186-E403 PolarHBondContact N-OE1 3.1Å
187	D	87.7	Confident	88.7	Confident	65 Å²	65	61.5 Å²	61.5	35%	0.348	32%	0.318	S	S	.	.			trans	-92.2	106.1	172.5	-172.5	5.6	0	0	0	111.8	P185 F189 M190	P185-D187 PolarHBondContact O-N 3.03Å; D187-F189 PolarHBondContact O-N 3.42Å; D187-F189 WeakPolarHBondContact OD1-CB 3.33Å; D187-F189 WeakPolarHBondContact OD1-CD2 3.46Å; D187-F189 PolarHBondContact OD1-N 3.23Å; D187-M190 HydrophobicContact CB-CG 4.27Å; D187-M190 WeakPolarHBondContact O-CB 3.37Å; D187-M190 PolarHBondContact O-N 2.78Å; D187-M190 WeakPolarHBondContact OD2-CE 3.47Å
188	L	88.3	Confident	88.5	Confident	37 Å²	37	61.3 Å²	61.3	19%	0.194	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-69.8	-16	177.2	-64.9	179.1	0	0	0	113.2	I186 M190 V191 L395 R396 K399	I186-L188 HydrophobicContact CG2-CD2 4.22Å; L188-M190 PolarHBondContact O-N 3.44Å; L188-V191 PolarHBondContact O-N 2.89Å; L188-L395 HydrophobicContact CD2-CB 4.17Å; L188-R396 HydrophobicContact CD1-CB 4.36Å; L188-R396 HydrophobicContact CD1-CG 3.53Å; L188-K399 HydrophobicContact CD1-CB 4.42Å; L188-K399 HydrophobicContact CD1-CD 3.8Å; L188-K399 HydrophobicContact CD2-CB 4.2Å; L188-K399 HydrophobicContact CD2-CD 4.23Å; L188-K399 HydrophobicContact CG-CD 3.76Å
189	F	89.1	Confident	88.4	Confident	161 Å²	161	68.2 Å²	68.2	71%	0.706	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-63.3	-20.6	174.1	-70.4	-68	0	0	0	112.3	D187 V191 R323	D187-F189 PolarHBondContact O-N 3.42Å; D187-F189 WeakPolarHBondContact OD1-CB 3.33Å; D187-F189 WeakPolarHBondContact OD1-CD2 3.46Å; D187-F189 PolarHBondContact OD1-N 3.23Å; F189-V191 VanDerWaalsContact C-N 3.28Å; F189-V191 PolarHBondContact O-N 2.99Å; F189-R323 VanDerWaalsContact O-CZ 3.25Å; F189-R323 PolarHBondContact O-NE 3.46Å; F189-R323 PolarHBondContact O-NH2 3.42Å
190	M	89.6	Confident	88.4	Confident	35 Å²	35	70 Å²	70	17%	0.172	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-74.6	-16.3	176	-58.9	-54.9	159.7	0	0	113.5	I179 D187 L188 L326 S371 V372	I179-M190 HydrophobicContact CD1-CB 3.77Å; I179-M190 HydrophobicContact CG1-CB 3.98Å; I179-M190 HydrophobicContact CG2-CB 4.05Å; I179-M190 HydrophobicContact CG2-CG 4.49Å; D187-M190 HydrophobicContact CB-CG 4.27Å; D187-M190 WeakPolarHBondContact O-CB 3.37Å; D187-M190 PolarHBondContact O-N 2.78Å; D187-M190 WeakPolarHBondContact OD2-CE 3.47Å; L188-M190 PolarHBondContact O-N 3.44Å; M190-L326 HydrophobicContact CE-CD1 3.52Å; M190-L326 HydrophobicContact CG-CD1 4.46Å; M190-L326 HydrophobicContact SD-CD1 3.27Å; M190-L326 WeakPolarHBondContact SD-CD1 3.5Å; M190-S371 VanDerWaalsContact O-CA 3.31Å; M190-S371 WeakPolarHBondContact O-CA 3.13Å; M190-S371 WeakPolarHBondContact O-CB 3.37Å; M190-S371 PolarHBondContact O-OG 2.95Å; M190-V372 PolarHBondContact O-N 3.5Å
191	V	92.5	Very high	88.2	Confident	8 Å²	8	68.6 Å²	68.6	5%	0.048	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	110.9	164.6	-170.6	0	0	0	0	108.3	A175 I179 L188 F189 V372 L374 L395	A175-V191 HydrophobicContact CB-CG1 4.36Å; A175-V191 HydrophobicContact CB-CG2 4.35Å; I179-V191 HydrophobicContact CD1-CB 4.16Å; I179-V191 HydrophobicContact CD1-CG2 3.08Å; L188-V191 PolarHBondContact O-N 2.89Å; F189-V191 VanDerWaalsContact C-N 3.28Å; F189-V191 PolarHBondContact O-N 2.99Å; V191-V372 WeakPolarHBondContact CA-O 3.16Å; V191-V372 HydrophobicContact CG1-CG2 4.41Å; V191-V372 HydrophobicContact CG2-CG2 4.26Å; V191-L374 HydrophobicContact CG1-CD1 3.82Å; V191-L374 HydrophobicContact CG1-CG 4.07Å; V191-L395 HydrophobicContact CB-CD1 4.2Å; V191-L395 HydrophobicContact CG1-CD1 3.86Å; V191-L395 HydrophobicContact CG1-CD2 4.35Å; V191-L395 HydrophobicContact CG2-CD1 4.42Å; V191-L395 HydrophobicContact CG2-CD2 4.11Å
192	E	93.2	Very high	88.3	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.047	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	133.1	166.4	-179.6	67.2	149.2	0	0	109.7	L210 R319 R323 V372 T373 L374	E192-L210 HydrophobicContact CB-CD1 4.17Å; E192-R319 IonicContact OE1-CZ 3.69Å; E192-R319 IonicContact OE1-NE 3.23Å; E192-R319 PolarHBondContact OE1-NE 2.97Å; E192-R319 IonicContact OE1-NH2 3.86Å; E192-R319 PolarHBondContact OE1-NH2 3.34Å; E192-R319 IonicContact OE2-NH2 2.78Å; E192-R323 IonicContact OE1-NH1 2.81Å; E192-R323 PolarHBondContact OE1-NH1 3.2Å; E192-R323 IonicContact OE2-CZ 2.62Å; E192-R323 IonicContact OE2-NH1 3.31Å; E192-R323 PolarHBondContact OE2-NH1 2.85Å; E192-R323 IonicContact OE2-NH2 2.94Å; E192-R323 PolarHBondContact OE2-NH2 3.18Å; E192-V372 PolarHBondContact N-O 3.27Å; E192-T373 HydrophobicContact CB-CG2 4.16Å; E192-T373 HydrophobicContact CG-CG2 4.25Å; E192-T373 CarbonylContact O-C 3.58Å; E192-T373 VanDerWaalsContact O-CA 3.27Å; E192-T373 WeakPolarHBondContact O-CA 3.14Å; E192-L374 PolarHBondContact O-N 3.02Å
193	I	94.8	Very high	88.7	Confident	27 Å²	27	66.2 Å²	66.2	14%	0.138	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	111.6	168.8	-55.6	172.2	0	0	0	106.7	L374 V376 K388 V391 R392 L395	I193-L374 WeakPolarHBondContact CA-O 3.38Å; I193-V376 HydrophobicContact CG2-CG2 3.81Å; I193-K388 HydrophobicContact CG2-CB 4.31Å; I193-K388 HydrophobicContact CG2-CD 4.32Å; I193-K388 HydrophobicContact CG2-CG 4.03Å; I193-V391 HydrophobicContact CD1-CG1 3.93Å; I193-V391 HydrophobicContact CG1-CG1 4.29Å; I193-R392 HydrophobicContact CD1-CB 4.47Å; I193-L395 HydrophobicContact CD1-CD1 4.21Å
194	M	93.5	Very high	89.1	Confident	14 Å²	14	58.4 Å²	58.4	7%	0.069	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.5	177.6	-175.5	46	50.9	0	0	110.5	V211 D213 Y360 T373 L374 L375 V376	M194-V211 HydrophobicContact CB-CB 4.48Å; M194-V211 HydrophobicContact CG-CB 4.38Å; M194-V211 HydrophobicContact CG-CG1 4.17Å; M194-D213 HydrophobicContact CE-CB 4.5Å; M194-D213 HydrophobicContact SD-CB 4.41Å; M194-Y360 HydrophobicContact CG-CE1 4.42Å; M194-Y360 HydrophobicContact SD-CE1 4.32Å; M194-T373 HydrophobicContact CB-CG2 3.81Å; M194-L374 PolarHBondContact N-O 2.91Å; M194-L375 HydrophobicContact CB-CD1 3.98Å; M194-L375 HydrophobicContact CG-CD1 3.86Å; M194-L375 CarbonylContact O-C 3.57Å; M194-V376 PolarHBondContact O-N 2.98Å
195	E	93.1	Very high	89.4	Confident	55 Å²	55	58.6 Å²	58.6	26%	0.257	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.1	178.9	-65	167	-140.9	0	0	109.3	Y360 V376 L384 K388	E195-Y360 PolarHBondContact O-OH 3.18Å; E195-V376 WeakPolarHBondContact CA-O 3.31Å; E195-L384 HydrophobicContact CB-CD2 4.47Å; E195-K388 HydrophobicContact CG-CD 4.27Å; E195-K388 WeakPolarHBondContact OE1-CD 3.44Å; E195-K388 WeakPolarHBondContact OE1-CE 3.31Å; E195-K388 IonicContact OE1-NZ 3.66Å; E195-K388 PolarHBondContact OE1-NZ 3.21Å
196	M	91.9	Very high	89.8	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	117.7	175.8	-179.6	174.2	-167.4	0	0	109.8	H198 H353 L355 Y360 L375 V376 K377 G378	M196-H198 PolarHBondContact O-N 3.39Å; M196-H198 VanDerWaalsContact O-N 3.13Å; M196-H353 WeakPolarHBondContact CE-ND1 3.42Å; M196-L355 HydrophobicContact CE-CB 3.54Å; M196-L355 HydrophobicContact CE-CD1 3.96Å; M196-L355 HydrophobicContact CE-CD2 3.82Å; M196-L355 HydrophobicContact CE-CG 3.96Å; M196-Y360 HydrophobicContact CB-CE1 4.5Å; M196-Y360 HydrophobicContact CE-CD2 3.78Å; M196-Y360 HydrophobicContact CE-CE2 3.9Å; M196-Y360 HydrophobicContact CG-CD2 4.47Å; M196-Y360 HydrophobicContact CG-CE2 3.91Å; M196-Y360 HydrophobicContact SD-CD2 4.25Å; M196-Y360 HydrophobicContact SD-CE2 4.28Å; M196-L375 HydrophobicContact CB-CD1 3.81Å; M196-L375 HydrophobicContact SD-CD2 4.33Å; M196-V376 PolarHBondContact N-O 2.89Å; M196-K377 HydrophobicContact CB-CG 4.16Å; M196-K377 HydrophobicContact CG-CG 4.5Å; M196-K377 VanDerWaalsContact O-CA 3.3Å; M196-K377 WeakPolarHBondContact O-CA 3.07Å; M196-G378 PolarHBondContact O-N 3.25Å
197	K	90.9	Very high	90.1	Very high	113 Å²	113	55.6 Å²	55.6	49%	0.491	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	113.6	177.1	-72.1	178.1	-177.8	170.1	0	109.2	L355 G378 L384	K197-L355 WeakPolarHBondContact O-CD2 3.46Å; K197-G378 WeakPolarHBondContact CA-O 3.42Å; K197-L384 HydrophobicContact CG-CD1 3.75Å
198	H	89	Confident	90.2	Very high	61 Å²	61	60 Å²	60	28%	0.282	29%	0.286	S	S	.	.			trans	-142.6	159.2	179.8	-161.3	58.7	0	0	0	110	M196 T200 D203 K377 G378 P379	M196-H198 PolarHBondContact O-N 3.39Å; M196-H198 VanDerWaalsContact O-N 3.13Å; H198-T200 PolarHBondContact CD2-OG1 3.11Å; H198-T200 PolarHBondContact O-N 3.37Å; H198-T200 VanDerWaalsContact O-N 3.11Å; H198-D203 IonicContact CD2-OD2 2.71Å; H198-K377 HydrophobicContact CB-CB 4.09Å; H198-K377 HydrophobicContact CB-CD 4.18Å; H198-K377 HydrophobicContact CB-CG 4.27Å; H198-G378 PolarHBondContact N-O 3.46Å; H198-G378 CarbonylContact O-C 3.59Å; H198-P379 WeakPolarHBondContact O-CA 3.31Å
199	K	86.2	Confident	90.3	Very high	185 Å²	185	58.3 Å²	58.3	80%	0.804	28%	0.277	S	S	*	.	S	Bend	trans	-61.8	-26.7	-172.4	-64.6	-178.8	-179.6	178.8	0	113.8
200	T	88.1	Confident	90.5	Very high	55 Å²	55	50.6 Å²	50.6	34%	0.337	24%	0.243	S	C	.	.			trans	-120.7	143.9	-173.8	36.1	0	0	0	0	110.4	H198 D203	H198-T200 PolarHBondContact CD2-OG1 3.11Å; H198-T200 PolarHBondContact O-N 3.37Å; H198-T200 VanDerWaalsContact O-N 3.11Å; T200-D203 PolarHBondContact OG1-OD2 2.6Å
201	D	85.3	Confident	90.7	Very high	49 Å²	49	49 Å²	49	26%	0.262	24%	0.235	S	C	.	.	S	Bend	trans	-94.1	-24.2	175.4	55.9	-25.2	0	0	0	113.4	D203 T204 K377 I387	D201-D203 PolarHBondContact O-N 3.14Å; D201-T204 PolarHBondContact O-OG1 3.5Å; D201-T204 VanDerWaalsContact O-OG1 3.08Å; D201-K377 WeakPolarHBondContact CA-O 3.48Å; D201-I387 HydrophobicContact CB-CD1 3.87Å
202	S	85.4	Confident	90.8	Very high	67 Å²	67	48.7 Å²	48.7	47%	0.469	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.8	176.7	-46	0	0	0	0	114.5	L167 T204	L167-S202 VanDerWaalsContact CD1-O 3.27Å; L167-S202 WeakPolarHBondContact CD1-O 3.46Å; S202-T204 PolarHBondContact O-N 2.68Å
203	D	86.8	Confident	90.6	Very high	65 Å²	65	49.9 Å²	49.9	35%	0.348	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	22.3	-175.5	-65.3	-34.9	0	0	0	113.8	H198 T200 D201 K377	H198-D203 IonicContact CD2-OD2 2.71Å; T200-D203 PolarHBondContact OG1-OD2 2.6Å; D201-D203 PolarHBondContact O-N 3.14Å; D203-K377 HydrophobicContact CB-CD 3.83Å; D203-K377 WeakPolarHBondContact O-CD 3.43Å; D203-K377 PolarHBondContact O-NZ 3.41Å; D203-K377 VanDerWaalsContact O-NZ 3.15Å
204	T	89	Confident	90.4	Very high	9 Å²	9	52.1 Å²	52.1	6%	0.055	25%	0.25	C	C	.	.			trans	-70	131	176.4	-65.8	0	0	0	0	109.8	L168 D201 S202 L375 V376 K377	L168-T204 HydrophobicContact CD2-CG2 3.41Å; L168-T204 VanDerWaalsContact CD2-CG2 3.41Å; D201-T204 PolarHBondContact O-OG1 3.5Å; D201-T204 VanDerWaalsContact O-OG1 3.08Å; S202-T204 PolarHBondContact O-N 2.68Å; T204-L375 WeakPolarHBondContact CA-O 2.97Å; T204-L375 WeakPolarHBondContact CG2-O 3.29Å; T204-V376 HydrophobicContact CG2-CG2 4.27Å; T204-K377 PolarHBondContact OG1-N 2.86Å
205	Q	90.8	Very high	90.2	Very high	105 Å²	105	51.7 Å²	51.7	49%	0.491	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	144.2	-171	-70.4	173.9	-2	0	0	111.5	L375	Q205-L375 PolarHBondContact N-O 3.25Å; Q205-L375 VanDerWaalsContact N-O 3.13Å; Q205-L375 PolarHBondContact O-N 2.86Å
206	L	93.6	Very high	90	Very high	40 Å²	40	49.1 Å²	49.1	21%	0.209	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	122.8	166.4	176	63	0	0	0	109.6	A171 D174 A175 V372 L374	A171-L206 HydrophobicContact CB-CB 4.07Å; D174-L206 HydrophobicContact CB-CD2 3.4Å; A175-L206 HydrophobicContact CB-CD1 3.84Å; L206-V372 HydrophobicContact CD1-CB 4.02Å; L206-V372 HydrophobicContact CD1-CG2 4.18Å; L206-L374 HydrophobicContact CB-CD2 4.03Å; L206-L374 HydrophobicContact CD1-CD2 3.74Å; L206-L374 HydrophobicContact CD1-CG 4.18Å; L206-L374 HydrophobicContact CG-CD2 4.47Å
207	I	92.9	Very high	89.8	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.1	175.4	-64.3	160.4	0	0	0	107.7	G209 V211 F362 E364 T373 L375	I207-G209 PolarHBondContact O-N 3.43Å; I207-V211 HydrophobicContact CB-CG2 4.41Å; I207-V211 HydrophobicContact CD1-CG2 3.24Å; I207-V211 HydrophobicContact CG1-CG2 4.41Å; I207-V211 HydrophobicContact CG2-CG2 4.34Å; I207-F362 HydrophobicContact CD1-CD1 3.66Å; I207-F362 HydrophobicContact CD1-CE1 3.45Å; I207-F362 VanDerWaalsContact CD1-CE1 3.45Å; I207-E364 HydrophobicContact CG2-CG 3.92Å; I207-T373 PolarHBondContact N-O 3.46Å; I207-T373 PolarHBondContact O-N 3.04Å; I207-L375 HydrophobicContact CD1-CB 3.68Å; I207-L375 HydrophobicContact CD1-CD2 3.9Å; I207-L375 HydrophobicContact CD1-CG 4.41Å
208	R	90.5	Very high	89.8	Confident	159 Å²	159	52.2 Å²	52.2	60%	0.6	25%	0.247	S	C	*	.	S	Bend	trans	-76.3	72	174.5	-65.9	-173.8	-179.5	-171.4	0.4	110	P369	R208-P369 HydrophobicContact CB-CB 4.35Å; R208-P369 HydrophobicContact CB-CG 4.24Å
209	G	90.5	Very high	89.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.9	-151.2	-176.3	0	0	0	0	0	110.8	I207 I363 V372 T373	I207-G209 PolarHBondContact O-N 3.43Å; G209-I363 CarbonylContact C-O 3.55Å; G209-I363 VanDerWaalsContact CA-O 3.29Å; G209-I363 WeakPolarHBondContact CA-O 3.36Å; G209-V372 CarbonylContact O-C 3.57Å; G209-V372 WeakPolarHBondContact O-CA 3.32Å; G209-T373 PolarHBondContact O-N 3.36Å; G209-T373 VanDerWaalsContact O-N 3.08Å; G209-T373 PolarHBondContact O-OG1 3.26Å
210	L	92.9	Very high	90	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.6	-174.3	-164.8	69.1	0	0	0	112.7	E192 L212 N320 R323 L324 I363 T373	E192-L210 HydrophobicContact CB-CD1 4.17Å; L210-L212 HydrophobicContact CD2-CD2 3.66Å; L210-L212 HydrophobicContact CD2-CG 4.46Å; L210-L212 HydrophobicContact CG-CD2 4.18Å; L210-N320 HydrophobicContact CD2-CB 3.87Å; L210-R323 HydrophobicContact CD1-CB 4.27Å; L210-R323 HydrophobicContact CD2-CB 4.41Å; L210-L324 HydrophobicContact CB-CD2 4.21Å; L210-L324 HydrophobicContact CD2-CD1 4.15Å; L210-L324 HydrophobicContact CD2-CD2 3.63Å; L210-L324 HydrophobicContact CD2-CG 3.5Å; L210-I363 PolarHBondContact N-O 3.48Å; L210-I363 WeakPolarHBondContact O-CB 3.28Å; L210-I363 PolarHBondContact O-N 3.03Å; L210-T373 VanDerWaalsContact CA-OG1 3.31Å; L210-T373 WeakPolarHBondContact CA-OG1 3.5Å
211	V	94.1	Very high	90.2	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.8	165.7	-172.3	0	0	0	0	109.9	M194 I207 Y360 T361 F362 T373	M194-V211 HydrophobicContact CB-CB 4.48Å; M194-V211 HydrophobicContact CG-CB 4.38Å; M194-V211 HydrophobicContact CG-CG1 4.17Å; I207-V211 HydrophobicContact CB-CG2 4.41Å; I207-V211 HydrophobicContact CD1-CG2 3.24Å; I207-V211 HydrophobicContact CG1-CG2 4.41Å; I207-V211 HydrophobicContact CG2-CG2 4.34Å; V211-Y360 HydrophobicContact CG1-CD1 4.23Å; V211-T361 WeakPolarHBondContact CA-O 3.38Å; V211-F362 HydrophobicContact CG1-CE1 4.39Å; V211-F362 HydrophobicContact CG1-CE2 4.31Å; V211-F362 HydrophobicContact CG1-CZ 4.22Å; V211-F362 HydrophobicContact CG2-CD1 3.89Å; V211-F362 HydrophobicContact CG2-CE1 3.94Å; V211-F362 HydrophobicContact CG2-CG 4.5Å; V211-T373 HydrophobicContact CB-CG2 3.94Å; V211-T373 HydrophobicContact CG2-CG2 3.87Å; V211-T373 PolarHBondContact N-OG1 3.39Å
212	L	93.5	Very high	90.3	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141.7	174.7	-58.7	174.9	0	0	0	109.6	L210 H214 L292 L313 T316 N320 Y360 T361 I363	L210-L212 HydrophobicContact CD2-CD2 3.66Å; L210-L212 HydrophobicContact CD2-CG 4.46Å; L210-L212 HydrophobicContact CG-CD2 4.18Å; L212-H214 PolarHBondContact O-N 3.41Å; L212-L292 HydrophobicContact CD1-CD1 4.29Å; L212-L292 HydrophobicContact CD1-CD2 3.81Å; L212-L313 HydrophobicContact CB-CD2 4.3Å; L212-L313 HydrophobicContact CD1-CD2 3.54Å; L212-T316 HydrophobicContact CD1-CG2 4.42Å; L212-N320 HydrophobicContact CD2-CB 3.99Å; L212-N320 VanDerWaalsContact CD2-ND2 3.28Å; L212-N320 WeakPolarHBondContact CD2-ND2 3.38Å; L212-Y360 VanDerWaalsContact O-CA 3.29Å; L212-Y360 WeakPolarHBondContact O-CA 3.44Å; L212-T361 PolarHBondContact N-O 3.07Å; L212-T361 PolarHBondContact O-N 2.97Å; L212-I363 HydrophobicContact CD1-CD1 3.99Å
213	D	90.7	Very high	90.6	Very high	36 Å²	36	55.6 Å²	55.6	19%	0.193	26%	0.262	C	S	.	.	S	Bend	trans	-78.5	0.3	-177.9	56.1	-32.6	0	0	0	114	M194 K317 K359	M194-D213 HydrophobicContact CE-CB 4.5Å; M194-D213 HydrophobicContact SD-CB 4.41Å; D213-K317 IonicContact OD1-NZ 2.86Å; D213-K317 WeakPolarHBondContact OD2-CE 3.2Å; D213-K317 IonicContact OD2-NZ 2.73Å; D213-K317 PolarHBondContact OD2-NZ 3.26Å; D213-K359 CarbonylContact C-O 3.41Å; D213-K359 VanDerWaalsContact C-O 3.28Å; D213-K359 VanDerWaalsContact O-O 3.1Å
214	H	89.4	Confident	90.9	Very high	73 Å²	73	60 Å²	60	34%	0.338	27%	0.274	S	S	.	.			trans	-133.6	151	179.6	-54.4	-36.4	0	0	0	110.2	L212 L313 K359 T361	L212-H214 PolarHBondContact O-N 3.41Å; H214-L313 WeakPolarHBondContact O-CD2 3.39Å; H214-K359 CarbonylContact C-O 3.53Å; H214-K359 WeakPolarHBondContact CA-O 3.34Å; H214-K359 PolarHBondContact N-O 3.12Å; H214-T361 PolarHBondContact O-OG1 3.18Å
215	G	88.9	Confident	90.9	Very high	5 Å²	5	60 Å²	60	5%	0.052	27%	0.274	C	S	.	.			trans	-117.7	-172.7	176.3	0	0	0	0	0	114.1	R217 K359 T361	G215-R217 PolarHBondContact O-N 2.95Å; G215-K359 PolarHBondContact N-O 3.48Å; G215-T361 VanDerWaalsContact CA-OG1 3.31Å; G215-T361 WeakPolarHBondContact CA-OG1 3.35Å
216	A	89.1	Confident	91	Very high	2 Å²	2	60.4 Å²	60.4	2%	0.017	28%	0.276	C	S	.	.			trans	-63.7	133	175.7	0	0	0	0	0	109.7	M221 V311 E352 K359	A216-M221 HydrophobicContact CB-CB 3.86Å; A216-M221 HydrophobicContact CB-CG 4.48Å; A216-M221 HydrophobicContact CB-SD 3.84Å; A216-V311 HydrophobicContact CB-CG1 4.24Å; A216-E352 WeakPolarHBondContact CB-OE2 3.39Å; A216-E352 PolarHBondContact N-OE2 2.89Å; A216-K359 PolarHBondContact O-NZ 2.71Å
217	R	88.4	Confident	90.8	Very high	147 Å²	147	61.1 Å²	61.1	56%	0.555	28%	0.28	S	S	*	.			trans	-89	-29.6	-178.5	-72.1	-69.7	-176.6	170.5	-1.3	112.7	G215 L302	G215-R217 PolarHBondContact O-N 2.95Å; R217-L302 HydrophobicContact CB-CD1 4.29Å
218	H	91	Very high	90.6	Very high	31 Å²	31	60.9 Å²	60.9	14%	0.144	28%	0.279	C	S	.	.	S	Bend	trans	-80.6	133	179	-166.9	-80.3	0	0	0	110.2	D220 M221 L302 D303 A306	H218-D220 VanDerWaalsContact C-N 3.33Å; H218-D220 IonicContact CE1-OD2 3.67Å; H218-D220 PolarHBondContact CE1-OD2 3Å; H218-D220 PolarHBondContact ND1-N 2.91Å; H218-D220 VanDerWaalsContact ND1-N 3.11Å; H218-D220 PolarHBondContact O-N 2.96Å; H218-M221 HydrophobicContact CB-CE 3.82Å; H218-M221 HydrophobicContact CB-CG 3.91Å; H218-M221 HydrophobicContact CB-SD 3.87Å; H218-M221 PolarHBondContact O-N 3.3Å; H218-L302 HydrophobicContact CB-CB 4.43Å; H218-D303 IonicContact CD2-OD1 3.88Å; H218-D303 PolarHBondContact CD2-OD1 2.94Å; H218-D303 IonicContact NE2-OD1 2.99Å; H218-D303 PolarHBondContact NE2-OD1 3.1Å; H218-D303 VanDerWaalsContact NE2-OD1 3.07Å; H218-A306 HydrophobicContact CB-CB 4.35Å; H218-A306 WeakPolarHBondContact ND1-CB 3.11Å
219	P	89.1	Confident	90.7	Very high	103 Å²	103	54.9 Å²	54.9	67%	0.669	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-34.3	-176.3	25	-34	0	0	0	113.3	M221	P219-M221 VanDerWaalsContact C-N 3.27Å; P219-M221 PolarHBondContact O-N 2.86Å
220	D	90.2	Very high	90.8	Very high	124 Å²	124	55 Å²	55	66%	0.663	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-2.5	-178	-55.9	-25.5	0	0	0	113.7	H218	H218-D220 VanDerWaalsContact C-N 3.33Å; H218-D220 IonicContact CE1-OD2 3.67Å; H218-D220 PolarHBondContact CE1-OD2 3Å; H218-D220 PolarHBondContact ND1-N 2.91Å; H218-D220 VanDerWaalsContact ND1-N 3.11Å; H218-D220 PolarHBondContact O-N 2.96Å
221	M	91.3	Very high	90.8	Very high	7 Å²	7	55 Å²	55	3%	0.034	26%	0.258	C	S	.	.	S	Bend	trans	-68.1	142.5	173.6	-79	175.7	-175.6	0	0	110.6	A216 H218 P219 K223 L302 L305 A306 A312	A216-M221 HydrophobicContact CB-CB 3.86Å; A216-M221 HydrophobicContact CB-CG 4.48Å; A216-M221 HydrophobicContact CB-SD 3.84Å; H218-M221 HydrophobicContact CB-CE 3.82Å; H218-M221 HydrophobicContact CB-CG 3.91Å; H218-M221 HydrophobicContact CB-SD 3.87Å; H218-M221 PolarHBondContact O-N 3.3Å; P219-M221 VanDerWaalsContact C-N 3.27Å; P219-M221 PolarHBondContact O-N 2.86Å; M221-K223 PolarHBondContact O-N 2.89Å; M221-L302 HydrophobicContact CE-CB 4.04Å; M221-L302 HydrophobicContact CE-CD2 3.72Å; M221-L302 VanDerWaalsContact CE-O 3.25Å; M221-L302 WeakPolarHBondContact CE-O 3.1Å; M221-L305 HydrophobicContact CE-CB 4.3Å; M221-A306 HydrophobicContact CE-CB 4.06Å; M221-A306 HydrophobicContact CG-CB 3.79Å; M221-A312 HydrophobicContact CE-CB 3.86Å; M221-A312 HydrophobicContact SD-CB 4.36Å
222	K	88.5	Confident	90.7	Very high	118 Å²	118	55.1 Å²	55.1	51%	0.513	26%	0.259	S	S	.	.			trans	-60.3	127.5	178.7	-66.9	-178.7	179.6	176.6	0	110.1	V225 V311	K222-V225 HydrophobicContact CB-CG2 4.03Å; K222-V311 HydrophobicContact CB-CG2 4.08Å; K222-V311 WeakPolarHBondContact O-CG2 3.27Å
223	K	90.9	Very high	90.6	Very high	137 Å²	137	55.1 Å²	55.1	60%	0.596	26%	0.259	S	S	*	.	S	Bend	trans	-77.7	-22.5	176.6	-64.2	-176.9	-179.5	-180	0	113.3	M221 Y351 E352	M221-K223 PolarHBondContact O-N 2.89Å; K223-Y351 CarbonylContact O-C 3.55Å; K223-Y351 VanDerWaalsContact O-CA 3.3Å; K223-Y351 WeakPolarHBondContact O-CA 3.41Å; K223-E352 PolarHBondContact O-N 2.6Å
224	R	92.7	Very high	90.7	Very high	156 Å²	156	55.7 Å²	55.7	59%	0.589	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.2	133.5	-179.8	179.2	172.3	170.2	161.8	-3.9	109.2	E226 L349	R224-E226 IonicContact CZ-OE1 2.66Å; R224-E226 IonicContact NE-OE1 3.79Å; R224-E226 PolarHBondContact NE-OE1 3.39Å; R224-E226 IonicContact NH2-OE1 3.69Å; R224-E226 PolarHBondContact NH2-OE1 3.22Å; R224-L349 HydrophobicContact CG-CD1 4.13Å
225	V	90.8	Very high	90.6	Very high	10 Å²	10	52.9 Å²	52.9	6%	0.061	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	119.3	-176.3	-174.2	0	0	0	0	107.7	K222 A228 V290 V311 V350	K222-V225 HydrophobicContact CB-CG2 4.03Å; V225-A228 HydrophobicContact CG1-CB 3.78Å; V225-V290 HydrophobicContact CG1-CG2 4.46Å; V225-V311 HydrophobicContact CG2-CG2 3.51Å; V225-V350 HydrophobicContact CB-CB 4.44Å; V225-V350 PolarHBondContact N-O 2.98Å; V225-V350 PolarHBondContact O-N 3.33Å
226	E	91	Very high	90.6	Very high	114 Å²	114	53.1 Å²	53.1	53%	0.533	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	144.8	176.8	-58.9	-172	163.8	0	0	109.4	R224 G288 L349	R224-E226 IonicContact CZ-OE1 2.66Å; R224-E226 IonicContact NE-OE1 3.79Å; R224-E226 PolarHBondContact NE-OE1 3.39Å; R224-E226 IonicContact NH2-OE1 3.69Å; R224-E226 PolarHBondContact NH2-OE1 3.22Å; E226-G288 PolarHBondContact O-N 3.4Å; E226-L349 HydrophobicContact CG-CD1 3.99Å
227	D	90.2	Very high	90.6	Very high	55 Å²	55	53 Å²	53	29%	0.294	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	41.5	71.2	-175.2	-164.8	20.2	0	0	0	112.6	K287 G288 Q346 G348	D227-K287 HydrophobicContact CB-CG 4.31Å; D227-K287 CarbonylContact O-C 3.45Å; D227-K287 WeakPolarHBondContact O-CA 3.33Å; D227-K287 WeakPolarHBondContact O-CB 3.28Å; D227-K287 WeakPolarHBondContact OD2-CE 3.44Å; D227-K287 WeakPolarHBondContact OD2-CG 3.25Å; D227-K287 IonicContact OD2-NZ 2.92Å; D227-G288 PolarHBondContact O-N 2.91Å; D227-Q346 PolarHBondContact OD1-NE2 2.94Å; D227-G348 PolarHBondContact N-O 3.15Å
228	A	89.6	Confident	90.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.9	-173.9	0	0	0	0	0	112.1	V225 G288 V290 A347 V350	V225-A228 HydrophobicContact CG1-CB 3.78Å; A228-G288 WeakPolarHBondContact CA-O 3.25Å; A228-V290 HydrophobicContact CB-CG2 3.87Å; A228-A347 PolarHBondContact N-O 3.24Å; A228-A347 PolarHBondContact O-N 2.99Å; A228-V350 HydrophobicContact CB-CG2 3.9Å
229	F	91.8	Very high	90	Very high	33 Å²	33	51.8 Å²	51.8	15%	0.145	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	134	157.7	-69.6	-70.7	0	0	0	110.1	V281 K287 G288 F289 V290 L344 G345	F229-V281 HydrophobicContact CD1-CG1 4.46Å; F229-V281 HydrophobicContact CD2-CG1 3.54Å; F229-V281 HydrophobicContact CE1-CG1 4.25Å; F229-V281 HydrophobicContact CE2-CG1 3.25Å; F229-V281 HydrophobicContact CG-CG1 4.13Å; F229-V281 HydrophobicContact CZ-CG1 3.65Å; F229-K287 HydrophobicContact CD2-CB 4.26Å; F229-K287 HydrophobicContact CD2-CD 4.25Å; F229-K287 HydrophobicContact CE2-CB 4.07Å; F229-K287 HydrophobicContact CE2-CD 3.36Å; F229-K287 HydrophobicContact CE2-CG 4.32Å; F229-K287 HydrophobicContact CZ-CD 3.8Å; F229-G288 PolarHBondContact N-O 2.85Å; F229-F289 HydrophobicContact CB-CD2 3.9Å; F229-F289 HydrophobicContact CB-CE2 4.19Å; F229-V290 PolarHBondContact O-N 2.77Å; F229-L344 HydrophobicContact CB-CB 4.45Å; F229-L344 HydrophobicContact CB-CD1 4.21Å; F229-L344 HydrophobicContact CD1-CB 4.13Å; F229-L344 HydrophobicContact CD1-CD1 4.36Å; F229-L344 HydrophobicContact CG-CD1 4.31Å; F229-G345 CarbonylContact C-O 3.36Å; F229-G345 WeakPolarHBondContact CA-O 3.23Å
230	V	91.8	Very high	89.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	111.9	-177.7	-176.3	0	0	0	0	108.6	T232 V290 L292 G345 A347	V230-T232 HydrophobicContact CG1-CG2 4.34Å; V230-V290 WeakPolarHBondContact CA-O 3.3Å; V230-L292 HydrophobicContact CG1-CD1 3.44Å; V230-L292 VanDerWaalsContact CG1-CD1 3.44Å; V230-L292 HydrophobicContact CG1-CG 3.98Å; V230-G345 PolarHBondContact N-O 3.42Å; V230-G345 PolarHBondContact O-N 3.5Å; V230-A347 HydrophobicContact CG2-CB 3.82Å
231	L	93.1	Very high	88.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.8	171.7	178.3	63.3	0	0	0	109.3	C233 I274 L277 F289 V290 V291 L292 M333 L339 L344	L231-C233 VanDerWaalsContact CG-SG 3.52Å; L231-I274 HydrophobicContact CD2-CG1 4.39Å; L231-I274 HydrophobicContact CD2-CG2 4.32Å; L231-L277 HydrophobicContact CD2-CD2 4.45Å; L231-F289 HydrophobicContact CB-CE1 4.17Å; L231-F289 HydrophobicContact CB-CZ 3.96Å; L231-F289 HydrophobicContact CD2-CE1 4.32Å; L231-F289 HydrophobicContact CD2-CZ 4.23Å; L231-V290 PolarHBondContact N-O 3.47Å; L231-V291 HydrophobicContact CB-CG2 4.37Å; L231-V291 HydrophobicContact CD2-CG2 4.25Å; L231-L292 PolarHBondContact O-N 3.18Å; L231-M333 HydrophobicContact CD1-CG 4.48Å; L231-L339 HydrophobicContact CD1-CD2 4.01Å; L231-L339 HydrophobicContact CD2-CD2 4.49Å; L231-L344 HydrophobicContact CB-CD2 3.7Å; L231-L344 HydrophobicContact CD1-CD2 3.85Å; L231-L344 HydrophobicContact CG-CD2 4.31Å
232	T	92.8	Very high	88.1	Confident	4 Å²	4	58.6 Å²	58.6	3%	0.025	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120	174.2	46.9	0	0	0	0	109.7	V230 L292 M321 L324 I331 M333	V230-T232 HydrophobicContact CG1-CG2 4.34Å; T232-L292 HydrophobicContact CG2-CB 4.33Å; T232-L292 HydrophobicContact CG2-CD1 4.43Å; T232-M321 HydrophobicContact CG2-CE 4.18Å; T232-L324 HydrophobicContact CG2-CB 3.85Å; T232-L324 HydrophobicContact CG2-CD1 4.09Å; T232-I331 PolarHBondContact OG1-O 3.4Å; T232-M333 PolarHBondContact O-N 3.43Å
233	C	92.1	Very high	87.8	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.007	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	151.9	179.5	-63.4	0	0	0	0	112	L231 L292 N293 Q294 M321 M333 F336	L231-C233 VanDerWaalsContact CG-SG 3.52Å; C233-L292 PolarHBondContact N-O 3.48Å; C233-N293 WeakPolarHBondContact O-CA 3.49Å; C233-N293 PolarHBondContact O-OD1 3.32Å; C233-N293 VanDerWaalsContact O-OD1 3.11Å; C233-Q294 PolarHBondContact O-N 2.8Å; C233-M321 VanDerWaalsContact O-CE 3.25Å; C233-M321 WeakPolarHBondContact O-CE 3.2Å; C233-M333 WeakPolarHBondContact CA-O 3.47Å; C233-F336 HydrophobicContact CB-CE1 3.95Å; C233-F336 HydrophobicContact CB-CZ 4.3Å
234	N	91.4	Very high	87.5	Confident	48 Å²	48	61.5 Å²	61.5	26%	0.257	30%	0.295	S	S	.	.			trans	-118.7	8.7	169.8	72.9	13	0	0	0	114.5	Q294 K295 M333 N334	N234-Q294 HydrophobicContact CB-CB 4.02Å; N234-Q294 VanDerWaalsContact CB-OE1 3.28Å; N234-K295 WeakPolarHBondContact O-CG 3.49Å; N234-M333 PolarHBondContact N-O 2.95Å; N234-M333 PolarHBondContact OD1-O 3.31Å; N234-N334 VanDerWaalsContact CG-OD1 3.29Å; N234-N334 PolarHBondContact ND2-OD1 2.92Å; N234-N334 WeakPolarHBondContact OD1-CA 3.32Å; N234-N334 PolarHBondContact OD1-OD1 3.39Å
235	A	88.3	Confident	86.9	Confident	15 Å²	15	62.1 Å²	62.1	12%	0.124	31%	0.31	C	S	.	.	S	Bend	trans	-84.4	143.9	175.6	0	0	0	0	0	112	N293 F336	A235-N293 VanDerWaalsContact O-CG 3.31Å; A235-N293 PolarHBondContact O-ND2 3.18Å; A235-N293 PolarHBondContact O-OD1 2.76Å; A235-F336 HydrophobicContact CB-CD2 3.84Å; A235-F336 HydrophobicContact CB-CE2 3.27Å; A235-F336 HydrophobicContact CB-CZ 3.69Å
236	S	89.3	Confident	86.2	Confident	9 Å²	9	64.6 Å²	64.6	6%	0.063	33%	0.328	C	S	.	.			trans	-73.2	134.6	179.8	-166.3	0	0	0	0	112.6	E238 E240 R270	S236-E238 PolarHBondContact OG-N 3.46Å; S236-E238 PolarHBondContact OG-O 3.46Å; S236-E240 VanDerWaalsContact CB-CD 3.48Å; S236-E240 WeakPolarHBondContact CB-OE1 3.35Å; S236-E240 PolarHBondContact OG-OE1 3.37Å; S236-R270 PolarHBondContact O-NH1 2.86Å
237	L	87.9	Confident	85.7	Confident	1 Å²	1	62 Å²	62	1%	0.005	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-106.2	17.3	167.9	-67.5	171.8	0	0	0	110.8	R270 V271 I274 G296 I297 D298 F336	L237-R270 HydrophobicContact CD2-CB 3.92Å; L237-V271 HydrophobicContact CD2-CG2 4.29Å; L237-I274 HydrophobicContact CD1-CD1 4.02Å; L237-I274 HydrophobicContact CD2-CD1 4.21Å; L237-G296 PolarHBondContact N-O 3.39Å; L237-G296 VanDerWaalsContact N-O 3.15Å; L237-I297 HydrophobicContact CB-CB 4.36Å; L237-I297 HydrophobicContact CB-CG1 4.28Å; L237-I297 HydrophobicContact CB-CG2 4.11Å; L237-I297 HydrophobicContact CD1-CD1 4.33Å; L237-I297 HydrophobicContact CD1-CG1 4.1Å; L237-I297 HydrophobicContact CD1-CG2 4.26Å; L237-D298 WeakPolarHBondContact O-CB 3.45Å; L237-D298 PolarHBondContact O-N 3.29Å; L237-D298 VanDerWaalsContact O-N 3.12Å; L237-F336 HydrophobicContact CD1-CZ 4.19Å; L237-F336 HydrophobicContact CD2-CD2 4.39Å; L237-F336 HydrophobicContact CD2-CE1 4.36Å; L237-F336 HydrophobicContact CD2-CE2 3.59Å; L237-F336 HydrophobicContact CD2-CZ 3.59Å; L237-F336 HydrophobicContact CG-CE2 4.07Å; L237-F336 HydrophobicContact CG-CZ 3.73Å
238	E	87	Confident	85.1	Confident	54 Å²	54	65.4 Å²	65.4	25%	0.252	34%	0.343	S	S	.	.	S	Bend	trans	-106.5	154.6	170.9	-74.8	173.4	-168.6	0	0	109.7	S236 E240 G296 I297 D298	S236-E238 PolarHBondContact OG-N 3.46Å; S236-E238 PolarHBondContact OG-O 3.46Å; E238-E240 PolarHBondContact O-N 2.92Å; E238-E240 VanDerWaalsContact O-N 3.12Å; E238-G296 WeakPolarHBondContact OE1-CA 3.33Å; E238-I297 PolarHBondContact OE1-N 3.38Å; E238-D298 HydrophobicContact CG-CB 4.34Å
239	Y	80.8	Confident	84.8	Confident	97 Å²	97	75.1 Å²	75.1	38%	0.38	39%	0.386	S	S	.	.			trans	-69	110.2	171.8	-176.8	-116.7	0	0	0	109.4	E263	Y239-E263 HydrophobicContact CD2-CB 3.99Å; Y239-E263 HydrophobicContact CD2-CG 4.16Å; Y239-E263 VanDerWaalsContact CE1-CD 3.5Å; Y239-E263 HydrophobicContact CE1-CG 4.18Å; Y239-E263 VanDerWaalsContact CE1-OE1 3.25Å; Y239-E263 WeakPolarHBondContact CE1-OE1 3.32Å; Y239-E263 HydrophobicContact CE2-CB 3.83Å; Y239-E263 HydrophobicContact CE2-CG 3.51Å; Y239-E263 VanDerWaalsContact OH-CD 3.27Å; Y239-E263 WeakPolarHBondContact OH-CG 3.25Å; Y239-E263 PolarHBondContact OH-OE1 3.16Å
240	E	74.4	Confident	84.6	Confident	113 Å²	113	79.1 Å²	79.1	53%	0.528	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-88.2	131.1	176.5	-69	-176	159.5	0	0	110	S236 E238	S236-E240 VanDerWaalsContact CB-CD 3.48Å; S236-E240 WeakPolarHBondContact CB-OE1 3.35Å; S236-E240 PolarHBondContact OG-OE1 3.37Å; E238-E240 PolarHBondContact O-N 2.92Å; E238-E240 VanDerWaalsContact O-N 3.12Å
241	K	78.4	Confident	84.4	Confident	189 Å²	189	89 Å²	89	82%	0.822	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-66.6	142.1	166.4	-67	-176	179.3	-179.1	0	108.4
242	T	78.1	Confident	84.3	Confident	76 Å²	76	91.4 Å²	91.4	47%	0.466	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-61.5	139.9	175.4	48	0	0	0	0	110.8	V244 S246	T242-V244 VanDerWaalsContact C-N 3.28Å; T242-V244 PolarHBondContact O-N 3.3Å; T242-V244 PolarHBondContact OG1-O 3.23Å; T242-S246 WeakPolarHBondContact OG1-CB 3.39Å; T242-S246 PolarHBondContact OG1-OG 3.47Å
243	E	80.5	Confident	84.2	Confident	201 Å²	201	94.9 Å²	94.9	94%	0.939	49%	0.49	S	S	*	.	S	Bend	trans	-65	-34.7	179.3	-64.1	-174.4	162.3	0	0	111.9
244	V	85.1	Confident	84.1	Confident	114 Å²	114	96.6 Å²	96.6	69%	0.691	51%	0.507	S	S	*	.	S	Bend	trans	-80.5	125.6	168.6	-176.6	0	0	0	0	107.8	T242 S246	T242-V244 VanDerWaalsContact C-N 3.28Å; T242-V244 PolarHBondContact O-N 3.3Å; T242-V244 PolarHBondContact OG1-O 3.23Å; V244-S246 VanDerWaalsContact C-N 3.3Å; V244-S246 PolarHBondContact O-N 3Å; V244-S246 PolarHBondContact O-OG 3.39Å
245	N	80.6	Confident	83.9	Confident	170 Å²	170	98.6 Å²	98.6	91%	0.909	52%	0.515	S	S	*	.			trans	-50.7	91.8	176.2	-78.9	-26.7	0	0	0	111.2
246	S	76.4	Confident	83.8	Confident	62 Å²	62	104.8 Å²	104.8	43%	0.434	54%	0.535	S	S	.	.			trans	-106.2	105	-179.6	-49.4	0	0	0	0	106.8	T242 V244	T242-S246 WeakPolarHBondContact OG1-CB 3.39Å; T242-S246 PolarHBondContact OG1-OG 3.47Å; V244-S246 VanDerWaalsContact C-N 3.3Å; V244-S246 PolarHBondContact O-N 3Å; V244-S246 PolarHBondContact O-OG 3.39Å
247	G	78.9	Confident	83.7	Confident	58 Å²	58	111.3 Å²	111.3	60%	0.598	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-92.4	123.9	172.2	0	0	0	0	0	109.7
248	F	78.4	Confident	83.7	Confident	127 Å²	127	118.8 Å²	118.8	56%	0.557	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-87.5	122	168.4	-67	-80.7	0	0	0	109.4	L259	F248-L259 HydrophobicContact CB-CD1 3.53Å; F248-L259 HydrophobicContact CD1-CD1 3.88Å; F248-L259 HydrophobicContact CD2-CD1 4.06Å; F248-L259 HydrophobicContact CG-CD1 3.57Å
249	F	84.4	Confident	83.6	Confident	205 Å²	205	118.2 Å²	118.2	90%	0.899	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-99.4	119.4	170.9	-61.7	-81.9	0	0	0	108.7
250	Y	85.7	Confident	83.8	Confident	116 Å²	116	116.1 Å²	116.1	46%	0.455	59%	0.593	S	S	.	*			trans	-116.1	143.2	173.6	50.7	-94.4	0	0	0	109.5	R256	Y250-R256 HydrophobicContact CD2-CB 3.93Å; Y250-R256 HydrophobicContact CD2-CG 4.46Å; Y250-R256 HydrophobicContact CE1-CG 4.3Å; Y250-R256 HydrophobicContact CE2-CB 4.05Å; Y250-R256 HydrophobicContact CE2-CG 4.12Å; Y250-R256 HydrophobicContact CG-CB 4.19Å
251	K	88.1	Confident	84.4	Confident	210 Å²	210	112.7 Å²	112.7	91%	0.913	58%	0.584	S	S	*	*	S	Bend	trans	-102.3	-25.4	179.1	-68.4	-177.3	-179	178.3	0	112.3	E255	K251-E255 PolarHBondContact N-OE2 3.36Å
252	S	92.4	Very high	84.7	Confident	49 Å²	49	106.5 Å²	106.5	34%	0.343	57%	0.568	S	S	.	*	S	Bend	trans	-118.4	153.3	-176.9	68.9	0	0	0	0	112.5	G254 E255 R256	S252-G254 VanDerWaalsContact C-N 3.28Å; S252-G254 PolarHBondContact O-N 2.94Å; S252-E255 PolarHBondContact N-OE2 2.93Å; S252-E255 PolarHBondContact O-N 3.49Å; S252-E255 VanDerWaalsContact OG-CG 3.23Å; S252-E255 WeakPolarHBondContact OG-CG 3.49Å; S252-E255 PolarHBondContact OG-N 3.3Å; S252-E255 PolarHBondContact OG-OE1 3.38Å; S252-R256 PolarHBondContact O-N 3.42Å
253	A	89.3	Confident	84.9	Confident	78 Å²	78	105.2 Å²	105.2	65%	0.645	56%	0.557	S	S	*	*	H	α-helix	trans	-63.1	-35	175.2	0	0	0	0	0	112.2	R256 E257	A253-R256 WeakPolarHBondContact O-CB 3.17Å; A253-R256 PolarHBondContact O-N 3.13Å; A253-E257 PolarHBondContact O-N 3.35Å; A253-E257 VanDerWaalsContact O-N 3.13Å
254	G	91.3	Very high	85	Confident	36 Å²	36	102.7 Å²	102.7	37%	0.371	54%	0.538	S	S	.	.	H	α-helix	trans	-68	-33.3	178.1	0	0	0	0	0	113.9	S252 R256 E257 K258	S252-G254 VanDerWaalsContact C-N 3.28Å; S252-G254 PolarHBondContact O-N 2.94Å; G254-R256 VanDerWaalsContact C-N 3.35Å; G254-E257 PolarHBondContact O-N 3.44Å; G254-K258 WeakPolarHBondContact O-CG 3.33Å; G254-K258 PolarHBondContact O-N 2.93Å; G254-K258 VanDerWaalsContact O-N 3.15Å
255	E	87.4	Confident	85.2	Confident	91 Å²	91	103.1 Å²	103.1	43%	0.425	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-40.9	171.2	-79	156.1	-144.8	0	0	111.6	K251 S252 E257 K258 L259	K251-E255 PolarHBondContact N-OE2 3.36Å; S252-E255 PolarHBondContact N-OE2 2.93Å; S252-E255 PolarHBondContact O-N 3.49Å; S252-E255 VanDerWaalsContact OG-CG 3.23Å; S252-E255 WeakPolarHBondContact OG-CG 3.49Å; S252-E255 PolarHBondContact OG-N 3.3Å; S252-E255 PolarHBondContact OG-OE1 3.38Å; E255-E257 PolarHBondContact O-N 3.46Å; E255-K258 PolarHBondContact O-N 3.19Å; E255-L259 PolarHBondContact O-N 2.98Å
256	R	84.9	Confident	85.5	Confident	145 Å²	145	99.9 Å²	99.9	55%	0.547	51%	0.509	S	S	.	.	H	α-helix	trans	-60.7	-45.4	176.7	-176	-175.8	175.9	-177.1	-1.2	111.4	Y250 S252 A253 G254 L259 V260	Y250-R256 HydrophobicContact CD2-CB 3.93Å; Y250-R256 HydrophobicContact CD2-CG 4.46Å; Y250-R256 HydrophobicContact CE1-CG 4.3Å; Y250-R256 HydrophobicContact CE2-CB 4.05Å; Y250-R256 HydrophobicContact CE2-CG 4.12Å; Y250-R256 HydrophobicContact CG-CB 4.19Å; S252-R256 PolarHBondContact O-N 3.42Å; A253-R256 WeakPolarHBondContact O-CB 3.17Å; A253-R256 PolarHBondContact O-N 3.13Å; G254-R256 VanDerWaalsContact C-N 3.35Å; R256-L259 PolarHBondContact O-N 3.45Å; R256-V260 WeakPolarHBondContact O-CG2 3.27Å; R256-V260 PolarHBondContact O-N 2.79Å
257	E	88.5	Confident	86.1	Confident	145 Å²	145	97.5 Å²	97.5	68%	0.678	49%	0.491	S	S	*	.	H	α-helix	trans	-63.5	-42	178.2	-73.4	-179.3	175.6	0	0	112.6	A253 G254 E255 L259 V260 A261	A253-E257 PolarHBondContact O-N 3.35Å; A253-E257 VanDerWaalsContact O-N 3.13Å; G254-E257 PolarHBondContact O-N 3.44Å; E255-E257 PolarHBondContact O-N 3.46Å; E257-L259 VanDerWaalsContact C-N 3.29Å; E257-L259 PolarHBondContact O-N 3.26Å; E257-V260 PolarHBondContact O-N 3.05Å; E257-A261 WeakPolarHBondContact O-CB 3.21Å; E257-A261 PolarHBondContact O-N 2.82Å
258	K	87.6	Confident	86.5	Confident	158 Å²	158	97.1 Å²	97.1	69%	0.687	47%	0.474	S	S	*	.	H	α-helix	trans	-61.9	-37.8	176.2	-73.6	177.2	-177.2	179.7	0	112.2	G254 E255 A261 A262	G254-K258 WeakPolarHBondContact O-CG 3.33Å; G254-K258 PolarHBondContact O-N 2.93Å; G254-K258 VanDerWaalsContact O-N 3.15Å; E255-K258 PolarHBondContact O-N 3.19Å; K258-A261 PolarHBondContact O-N 3.27Å; K258-A262 WeakPolarHBondContact O-CB 3.11Å; K258-A262 PolarHBondContact O-N 3.33Å
259	L	83.8	Confident	87.1	Confident	43 Å²	43	96.3 Å²	96.3	23%	0.225	47%	0.472	C	S	.	.	H	α-helix	trans	-66.2	-50.8	177.3	-169	161.4	0	0	0	110.7	F248 E255 R256 E257 A261 A262 E263	F248-L259 HydrophobicContact CB-CD1 3.53Å; F248-L259 HydrophobicContact CD1-CD1 3.88Å; F248-L259 HydrophobicContact CD2-CD1 4.06Å; F248-L259 HydrophobicContact CG-CD1 3.57Å; E255-L259 PolarHBondContact O-N 2.98Å; R256-L259 PolarHBondContact O-N 3.45Å; E257-L259 VanDerWaalsContact C-N 3.29Å; E257-L259 PolarHBondContact O-N 3.26Å; L259-A261 PolarHBondContact O-N 3.36Å; L259-A262 WeakPolarHBondContact O-CB 3.31Å; L259-A262 PolarHBondContact O-N 2.9Å; L259-E263 VanDerWaalsContact CD2-CD 3.47Å; L259-E263 HydrophobicContact CD2-CG 3.89Å; L259-E263 WeakPolarHBondContact CD2-OE1 3.04Å; L259-E263 WeakPolarHBondContact O-CG 3.46Å; L259-E263 PolarHBondContact O-N 2.73Å
260	V	85.1	Confident	87.3	Confident	52 Å²	52	89.7 Å²	89.7	32%	0.315	44%	0.441	S	S	.	.	H	α-helix	trans	-57.2	-38.9	175.9	175.8	0	0	0	0	111	R256 E257 R264	R256-V260 WeakPolarHBondContact O-CG2 3.27Å; R256-V260 PolarHBondContact O-N 2.79Å; E257-V260 PolarHBondContact O-N 3.05Å; V260-R264 WeakPolarHBondContact O-CG 3.03Å; V260-R264 PolarHBondContact O-N 3.07Å; V260-R264 VanDerWaalsContact O-N 3.11Å
261	A	87	Confident	87.6	Confident	42 Å²	42	84.5 Å²	84.5	35%	0.347	42%	0.421	S	S	.	.	H	α-helix	trans	-67.3	-37.3	175.4	0	0	0	0	0	112.7	E257 K258 L259 R264 K265	E257-A261 WeakPolarHBondContact O-CB 3.21Å; E257-A261 PolarHBondContact O-N 2.82Å; K258-A261 PolarHBondContact O-N 3.27Å; L259-A261 PolarHBondContact O-N 3.36Å; A261-R264 PolarHBondContact O-N 2.88Å; A261-K265 WeakPolarHBondContact O-CB 3.35Å; A261-K265 VanDerWaalsContact O-CG 3.25Å; A261-K265 WeakPolarHBondContact O-CG 3.46Å; A261-K265 PolarHBondContact O-N 3.09Å
262	A	85.7	Confident	87.7	Confident	58 Å²	58	79.5 Å²	79.5	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-67.9	-42	176.3	0	0	0	0	0	112.1	K258 L259 R264 K265 F266	K258-A262 WeakPolarHBondContact O-CB 3.11Å; K258-A262 PolarHBondContact O-N 3.33Å; L259-A262 WeakPolarHBondContact O-CB 3.31Å; L259-A262 PolarHBondContact O-N 2.9Å; A262-R264 VanDerWaalsContact C-N 3.3Å; A262-R264 PolarHBondContact O-N 3.03Å; A262-K265 PolarHBondContact O-N 3.13Å; A262-F266 PolarHBondContact O-N 2.98Å; A262-F266 VanDerWaalsContact O-N 3.17Å
263	E	82	Confident	87.6	Confident	50 Å²	50	80.5 Å²	80.5	23%	0.234	40%	0.398	C	S	.	.	H	α-helix	trans	-58.1	-43.9	173.6	-67	179.4	162.2	0	0	111.1	Y239 L259	Y239-E263 HydrophobicContact CD2-CB 3.99Å; Y239-E263 HydrophobicContact CD2-CG 4.16Å; Y239-E263 VanDerWaalsContact CE1-CD 3.5Å; Y239-E263 HydrophobicContact CE1-CG 4.18Å; Y239-E263 VanDerWaalsContact CE1-OE1 3.25Å; Y239-E263 WeakPolarHBondContact CE1-OE1 3.32Å; Y239-E263 HydrophobicContact CE2-CB 3.83Å; Y239-E263 HydrophobicContact CE2-CG 3.51Å; Y239-E263 VanDerWaalsContact OH-CD 3.27Å; Y239-E263 WeakPolarHBondContact OH-CG 3.25Å; Y239-E263 PolarHBondContact OH-OE1 3.16Å; L259-E263 VanDerWaalsContact CD2-CD 3.47Å; L259-E263 HydrophobicContact CD2-CG 3.89Å; L259-E263 WeakPolarHBondContact CD2-OE1 3.04Å; L259-E263 WeakPolarHBondContact O-CG 3.46Å; L259-E263 PolarHBondContact O-N 2.73Å
264	R	83.1	Confident	87.7	Confident	147 Å²	147	76.8 Å²	76.8	56%	0.555	37%	0.367	S	S	*	.	H	α-helix	trans	-65.7	-44.9	176.1	-72.7	177.8	-177.2	-170.4	0.2	112.5	V260 A261 A262 F266 I267 E268	V260-R264 WeakPolarHBondContact O-CG 3.03Å; V260-R264 PolarHBondContact O-N 3.07Å; V260-R264 VanDerWaalsContact O-N 3.11Å; A261-R264 PolarHBondContact O-N 2.88Å; A262-R264 VanDerWaalsContact C-N 3.3Å; A262-R264 PolarHBondContact O-N 3.03Å; R264-F266 VanDerWaalsContact C-N 3.25Å; R264-F266 PolarHBondContact O-N 3.33Å; R264-I267 PolarHBondContact O-N 3.1Å; R264-I267 VanDerWaalsContact O-N 3.08Å; R264-E268 WeakPolarHBondContact O-CB 3.27Å; R264-E268 WeakPolarHBondContact O-CG 3.15Å; R264-E268 PolarHBondContact O-N 2.85Å
265	K	89	Confident	87.7	Confident	123 Å²	123	76.4 Å²	76.4	54%	0.535	36%	0.356	S	S	.	.	H	α-helix	trans	-54.9	-41.6	178.9	-81.3	175.4	-178.7	-173.3	0	112.2	A261 A262 I267 E268 E269	A261-K265 WeakPolarHBondContact O-CB 3.35Å; A261-K265 VanDerWaalsContact O-CG 3.25Å; A261-K265 WeakPolarHBondContact O-CG 3.46Å; A261-K265 PolarHBondContact O-N 3.09Å; A262-K265 PolarHBondContact O-N 3.13Å; K265-I267 VanDerWaalsContact C-N 3.32Å; K265-I267 PolarHBondContact O-N 3.42Å; K265-E268 PolarHBondContact O-N 3.49Å; K265-E269 WeakPolarHBondContact O-CB 3.48Å; K265-E269 VanDerWaalsContact O-CG 3.31Å; K265-E269 WeakPolarHBondContact O-CG 3.35Å; K265-E269 PolarHBondContact O-N 3.45Å
266	F	86.3	Confident	87.9	Confident	102 Å²	102	78 Å²	78	45%	0.447	36%	0.364	S	S	.	.	H	α-helix	trans	-59.6	-41.2	178.1	-179.7	-106.4	0	0	0	113	A262 R264 R270	A262-F266 PolarHBondContact O-N 2.98Å; A262-F266 VanDerWaalsContact O-N 3.17Å; R264-F266 VanDerWaalsContact C-N 3.25Å; R264-F266 PolarHBondContact O-N 3.33Å; F266-R270 VanDerWaalsContact CZ-CZ 3.49Å
267	I	88.3	Confident	88	Confident	13 Å²	13	71.6 Å²	71.6	7%	0.067	34%	0.34	C	S	.	.	H	α-helix	trans	-75	-42.1	177.6	-59.8	174	0	0	0	110.3	R264 K265 E269 R270 V271 S301	R264-I267 PolarHBondContact O-N 3.1Å; R264-I267 VanDerWaalsContact O-N 3.08Å; K265-I267 VanDerWaalsContact C-N 3.32Å; K265-I267 PolarHBondContact O-N 3.42Å; I267-E269 VanDerWaalsContact C-N 3.28Å; I267-E269 PolarHBondContact O-N 3.35Å; I267-R270 WeakPolarHBondContact O-CB 3.28Å; I267-R270 PolarHBondContact O-N 3.38Å; I267-R270 VanDerWaalsContact O-N 3.11Å; I267-V271 HydrophobicContact CG2-CG2 4.38Å; I267-V271 WeakPolarHBondContact O-CG2 3.29Å; I267-V271 PolarHBondContact O-N 3.4Å; I267-S301 WeakPolarHBondContact CG2-OG 2.92Å
268	E	88.8	Confident	87.9	Confident	49 Å²	49	66.2 Å²	66.2	23%	0.229	32%	0.315	C	S	.	.	H	α-helix	trans	-57.6	-39.8	175.9	-76.3	176.9	-160.8	0	0	112.2	R264 K265 R270 V271 K272 Y300	R264-E268 WeakPolarHBondContact O-CB 3.27Å; R264-E268 WeakPolarHBondContact O-CG 3.15Å; R264-E268 PolarHBondContact O-N 2.85Å; K265-E268 PolarHBondContact O-N 3.49Å; E268-R270 VanDerWaalsContact C-N 3.34Å; E268-R270 PolarHBondContact O-N 3.22Å; E268-V271 PolarHBondContact O-N 3.05Å; E268-K272 WeakPolarHBondContact O-CB 3.33Å; E268-K272 WeakPolarHBondContact O-CG 3.38Å; E268-K272 PolarHBondContact O-N 3.46Å; E268-K272 IonicContact OE2-NZ 3.6Å; E268-Y300 HydrophobicContact CG-CD1 4.43Å; E268-Y300 HydrophobicContact CG-CE1 3.85Å
269	E	89.9	Confident	87.9	Confident	111 Å²	111	62.5 Å²	62.5	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-61	-42.2	175.4	-77.6	171.4	-167.5	0	0	111.8	K265 I267 K272 K273	K265-E269 WeakPolarHBondContact O-CB 3.48Å; K265-E269 VanDerWaalsContact O-CG 3.31Å; K265-E269 WeakPolarHBondContact O-CG 3.35Å; K265-E269 PolarHBondContact O-N 3.45Å; I267-E269 VanDerWaalsContact C-N 3.28Å; I267-E269 PolarHBondContact O-N 3.35Å; E269-K272 PolarHBondContact O-N 3.44Å; E269-K273 WeakPolarHBondContact O-CG 3.28Å; E269-K273 PolarHBondContact O-N 3.47Å; E269-K273 VanDerWaalsContact O-N 3.12Å
270	R	89.9	Confident	88	Confident	66 Å²	66	63.9 Å²	63.9	25%	0.249	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-43.7	176	-66.8	175.8	173.9	-164.9	-5.3	111.9	S236 L237 F266 I267 E268 K273 I274 F336	S236-R270 PolarHBondContact O-NH1 2.86Å; L237-R270 HydrophobicContact CD2-CB 3.92Å; F266-R270 VanDerWaalsContact CZ-CZ 3.49Å; I267-R270 WeakPolarHBondContact O-CB 3.28Å; I267-R270 PolarHBondContact O-N 3.38Å; I267-R270 VanDerWaalsContact O-N 3.11Å; E268-R270 VanDerWaalsContact C-N 3.34Å; E268-R270 PolarHBondContact O-N 3.22Å; R270-K273 PolarHBondContact O-N 3.36Å; R270-I274 PolarHBondContact O-N 3.44Å; R270-F336 HydrophobicContact CB-CD2 3.94Å; R270-F336 HydrophobicContact CB-CE2 4.41Å; R270-F336 HydrophobicContact CB-CG 4.42Å; R270-F336 HydrophobicContact CG-CD2 3.91Å
271	V	90.8	Very high	87.9	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.036	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-40.4	177.6	176.1	0	0	0	0	110.8	L237 I267 E268 K273 I274 I275 S301 A304 L305	L237-V271 HydrophobicContact CD2-CG2 4.29Å; I267-V271 HydrophobicContact CG2-CG2 4.38Å; I267-V271 WeakPolarHBondContact O-CG2 3.29Å; I267-V271 PolarHBondContact O-N 3.4Å; E268-V271 PolarHBondContact O-N 3.05Å; V271-K273 VanDerWaalsContact C-N 3.35Å; V271-K273 PolarHBondContact O-N 2.93Å; V271-I274 WeakPolarHBondContact O-CB 3.48Å; V271-I274 PolarHBondContact O-N 3.07Å; V271-I274 VanDerWaalsContact O-N 3.14Å; V271-I275 HydrophobicContact CG1-CD1 3.8Å; V271-I275 HydrophobicContact CG1-CG1 4.35Å; V271-I275 WeakPolarHBondContact O-CG1 3.36Å; V271-I275 PolarHBondContact O-N 2.9Å; V271-S301 WeakPolarHBondContact CG2-OG 3.48Å; V271-A304 HydrophobicContact CG1-CB 3.97Å; V271-L305 HydrophobicContact CG1-CD2 4.14Å; V271-L305 HydrophobicContact CG1-CG 4.28Å
272	K	91.6	Very high	87.3	Confident	106 Å²	106	62 Å²	62	46%	0.461	31%	0.305	S	S	.	.	H	α-helix	trans	-58.4	-44	175.4	-78	167.8	-172.7	167.1	0	111.8	E268 E269 I274 I275 E276	E268-K272 WeakPolarHBondContact O-CB 3.33Å; E268-K272 WeakPolarHBondContact O-CG 3.38Å; E268-K272 PolarHBondContact O-N 3.46Å; E268-K272 IonicContact OE2-NZ 3.6Å; E269-K272 PolarHBondContact O-N 3.44Å; K272-I274 VanDerWaalsContact C-N 3.29Å; K272-I274 PolarHBondContact O-N 3.21Å; K272-I275 CarbonylContact O-C 3.57Å; K272-I275 PolarHBondContact O-N 2.91Å; K272-I275 VanDerWaalsContact O-N 3.08Å; K272-E276 WeakPolarHBondContact O-CB 3.29Å; K272-E276 WeakPolarHBondContact O-CG 3.32Å; K272-E276 PolarHBondContact O-N 3.17Å
273	K	90.3	Very high	86.1	Confident	69 Å²	69	62.9 Å²	62.9	30%	0.3	31%	0.312	S	S	.	.	H	α-helix	trans	-58.9	-38.9	175.5	-68.9	-177.4	-173.2	-175.2	0	112.7	E269 R270 V271 E276 L277 F336 E337 L339	E269-K273 WeakPolarHBondContact O-CG 3.28Å; E269-K273 PolarHBondContact O-N 3.47Å; E269-K273 VanDerWaalsContact O-N 3.12Å; R270-K273 PolarHBondContact O-N 3.36Å; V271-K273 VanDerWaalsContact C-N 3.35Å; V271-K273 PolarHBondContact O-N 2.93Å; K273-E276 PolarHBondContact O-N 3.36Å; K273-L277 WeakPolarHBondContact O-CB 3.22Å; K273-L277 PolarHBondContact O-N 3.24Å; K273-F336 VanDerWaalsContact CD-O 3.23Å; K273-F336 WeakPolarHBondContact CD-O 3.48Å; K273-E337 IonicContact NZ-OE1 3.07Å; K273-E337 PolarHBondContact NZ-OE1 3.26Å; K273-L339 HydrophobicContact CB-CD1 4.35Å
274	I	90.9	Very high	85	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-42	174.9	-62.8	168	0	0	0	110.9	L231 L237 R270 V271 K272 L277 K278 F289 V291 L305 I310 F336 L339	L231-I274 HydrophobicContact CD2-CG1 4.39Å; L231-I274 HydrophobicContact CD2-CG2 4.32Å; L237-I274 HydrophobicContact CD1-CD1 4.02Å; L237-I274 HydrophobicContact CD2-CD1 4.21Å; R270-I274 PolarHBondContact O-N 3.44Å; V271-I274 WeakPolarHBondContact O-CB 3.48Å; V271-I274 PolarHBondContact O-N 3.07Å; V271-I274 VanDerWaalsContact O-N 3.14Å; K272-I274 VanDerWaalsContact C-N 3.29Å; K272-I274 PolarHBondContact O-N 3.21Å; I274-L277 PolarHBondContact O-N 2.88Å; I274-K278 WeakPolarHBondContact O-CB 3.33Å; I274-K278 PolarHBondContact O-N 2.74Å; I274-F289 HydrophobicContact CG2-CE1 4.04Å; I274-V291 HydrophobicContact CG2-CG2 3.88Å; I274-L305 HydrophobicContact CG2-CD2 4.11Å; I274-I310 HydrophobicContact CG2-CD1 4.29Å; I274-F336 HydrophobicContact CD1-CD1 3.97Å; I274-F336 HydrophobicContact CD1-CE1 3.69Å; I274-F336 HydrophobicContact CD1-CZ 4.37Å; I274-F336 HydrophobicContact CG1-CD1 4.01Å; I274-F336 HydrophobicContact CG1-CE1 4.2Å; I274-L339 HydrophobicContact CG1-CD1 4.33Å
275	I	91.2	Very high	83.8	Confident	28 Å²	28	65.7 Å²	65.7	14%	0.144	34%	0.34	C	S	.	.	H	α-helix	trans	-66.7	-40.9	178.2	-64.9	168.8	0	0	0	110.8	V271 K272 K278 N279 E308 I310	V271-I275 HydrophobicContact CG1-CD1 3.8Å; V271-I275 HydrophobicContact CG1-CG1 4.35Å; V271-I275 WeakPolarHBondContact O-CG1 3.36Å; V271-I275 PolarHBondContact O-N 2.9Å; K272-I275 CarbonylContact O-C 3.57Å; K272-I275 PolarHBondContact O-N 2.91Å; K272-I275 VanDerWaalsContact O-N 3.08Å; I275-K278 PolarHBondContact O-N 2.68Å; I275-N279 WeakPolarHBondContact O-CB 3.39Å; I275-N279 VanDerWaalsContact O-CG 3.22Å; I275-N279 PolarHBondContact O-N 3.38Å; I275-N279 PolarHBondContact O-ND2 2.88Å; I275-E308 HydrophobicContact CD1-CG 3.92Å; I275-E308 HydrophobicContact CG1-CG 4.01Å; I275-E308 HydrophobicContact CG2-CG 4Å; I275-I310 HydrophobicContact CG1-CD1 4.48Å
276	E	90.6	Very high	82.9	Confident	125 Å²	125	68 Å²	68	58%	0.584	36%	0.358	S	S	*	.	H	α-helix	trans	-60.3	-45.7	174.4	-74.9	169.7	-169.7	0	0	111.2	K272 K273 K278 N279 A280	K272-E276 WeakPolarHBondContact O-CB 3.29Å; K272-E276 WeakPolarHBondContact O-CG 3.32Å; K272-E276 PolarHBondContact O-N 3.17Å; K273-E276 PolarHBondContact O-N 3.36Å; E276-K278 PolarHBondContact O-N 2.91Å; E276-N279 PolarHBondContact O-N 3.19Å; E276-A280 WeakPolarHBondContact O-CB 3.5Å; E276-A280 PolarHBondContact O-N 3.31Å
277	L	88.1	Confident	82.7	Confident	11 Å²	11	65.6 Å²	65.6	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-45.9	174.9	-176	71.1	0	0	0	111.4	L231 K273 I274 N279 A280 V281 F289 L339 P341 L344	L231-L277 HydrophobicContact CD2-CD2 4.45Å; K273-L277 WeakPolarHBondContact O-CB 3.22Å; K273-L277 PolarHBondContact O-N 3.24Å; I274-L277 PolarHBondContact O-N 2.88Å; L277-N279 VanDerWaalsContact C-N 3.33Å; L277-N279 PolarHBondContact O-N 3.39Å; L277-A280 PolarHBondContact O-N 3.43Å; L277-V281 HydrophobicContact CD1-CG2 4.48Å; L277-V281 WeakPolarHBondContact O-CG2 3.27Å; L277-V281 PolarHBondContact O-N 2.88Å; L277-V281 VanDerWaalsContact O-N 3.12Å; L277-F289 HydrophobicContact CD2-CZ 4.1Å; L277-L339 HydrophobicContact CD1-CB 4.41Å; L277-L339 HydrophobicContact CD2-CB 4.11Å; L277-L339 HydrophobicContact CD2-CD1 4.32Å; L277-L339 HydrophobicContact CD2-CD2 4.39Å; L277-P341 HydrophobicContact CD1-CG 4.43Å; L277-L344 HydrophobicContact CD2-CD1 4.37Å; L277-L344 HydrophobicContact CD2-CD2 3.98Å; L277-L344 HydrophobicContact CD2-CG 4.4Å; L277-L344 HydrophobicContact CG-CD1 4.49Å
278	K	87	Confident	82.5	Confident	32 Å²	32	65.5 Å²	65.5	14%	0.139	35%	0.349	C	S	.	.	H	α-helix	trans	-58.6	-45.6	175.6	174.2	-125.9	167.8	179.1	0	110.7	I274 I275 E276 A280 V281 C282 F289 E308 I310	I274-K278 WeakPolarHBondContact O-CB 3.33Å; I274-K278 PolarHBondContact O-N 2.74Å; I275-K278 PolarHBondContact O-N 2.68Å; E276-K278 PolarHBondContact O-N 2.91Å; K278-A280 PolarHBondContact O-N 2.89Å; K278-V281 PolarHBondContact O-N 3.44Å; K278-C282 WeakPolarHBondContact O-CB 3.46Å; K278-C282 PolarHBondContact O-N 2.95Å; K278-F289 HydrophobicContact CB-CD1 4.14Å; K278-F289 HydrophobicContact CB-CD2 4.13Å; K278-F289 HydrophobicContact CB-CE1 4.38Å; K278-F289 HydrophobicContact CB-CE2 4.37Å; K278-F289 HydrophobicContact CB-CG 4.01Å; K278-F289 HydrophobicContact CG-CB 3.87Å; K278-F289 HydrophobicContact CG-CD1 4.31Å; K278-F289 HydrophobicContact CG-CD2 4.24Å; K278-F289 HydrophobicContact CG-CG 3.89Å; K278-E308 WeakPolarHBondContact CE-O 3.49Å; K278-E308 PolarHBondContact NZ-O 3.23Å; K278-E308 IonicContact NZ-OE2 2.72Å; K278-E308 PolarHBondContact NZ-OE2 2.88Å; K278-I310 HydrophobicContact CB-CD1 4.12Å; K278-I310 HydrophobicContact CD-CD1 3.9Å; K278-I310 HydrophobicContact CD-CG1 3.93Å; K278-I310 HydrophobicContact CG-CD1 4.12Å; K278-I310 HydrophobicContact CG-CG1 4.18Å
279	N	86.9	Confident	82.7	Confident	79 Å²	79	63.3 Å²	63.3	42%	0.422	34%	0.339	S	S	.	.	H	α-helix	trans	-65.9	-37.4	179.3	-69.6	-19.4	0	0	0	112.1	I275 E276 L277 V281 A283	I275-N279 WeakPolarHBondContact O-CB 3.39Å; I275-N279 VanDerWaalsContact O-CG 3.22Å; I275-N279 PolarHBondContact O-N 3.38Å; I275-N279 PolarHBondContact O-ND2 2.88Å; E276-N279 PolarHBondContact O-N 3.19Å; L277-N279 VanDerWaalsContact C-N 3.33Å; L277-N279 PolarHBondContact O-N 3.39Å; N279-V281 VanDerWaalsContact C-N 3.3Å; N279-V281 PolarHBondContact O-N 3.44Å; N279-A283 WeakPolarHBondContact O-CB 3.18Å; N279-A283 PolarHBondContact O-N 3.05Å
280	A	85.1	Confident	82.8	Confident	73 Å²	73	58 Å²	58	60%	0.603	32%	0.315	S	S	*	.	H	α-helix	trans	-64.4	-33.6	176.5	0	0	0	0	0	113.1	E276 L277 K278	E276-A280 WeakPolarHBondContact O-CB 3.5Å; E276-A280 PolarHBondContact O-N 3.31Å; L277-A280 PolarHBondContact O-N 3.43Å; K278-A280 PolarHBondContact O-N 2.89Å
281	V	82.6	Confident	83	Confident	31 Å²	31	55 Å²	55	19%	0.188	30%	0.303	C	S	.	.	H	α-helix	trans	-97.7	-31.1	-173.7	-179.3	0	0	0	0	112.8	F229 L277 K278 N279 P341 L344	F229-V281 HydrophobicContact CD1-CG1 4.46Å; F229-V281 HydrophobicContact CD2-CG1 3.54Å; F229-V281 HydrophobicContact CE1-CG1 4.25Å; F229-V281 HydrophobicContact CE2-CG1 3.25Å; F229-V281 HydrophobicContact CG-CG1 4.13Å; F229-V281 HydrophobicContact CZ-CG1 3.65Å; L277-V281 HydrophobicContact CD1-CG2 4.48Å; L277-V281 WeakPolarHBondContact O-CG2 3.27Å; L277-V281 PolarHBondContact O-N 2.88Å; L277-V281 VanDerWaalsContact O-N 3.12Å; K278-V281 PolarHBondContact O-N 3.44Å; N279-V281 VanDerWaalsContact C-N 3.3Å; N279-V281 PolarHBondContact O-N 3.44Å; V281-P341 HydrophobicContact CG2-CB 3.88Å; V281-P341 HydrophobicContact CG2-CG 3.99Å; V281-L344 HydrophobicContact CB-CD1 4.42Å; V281-L344 HydrophobicContact CG1-CD1 4.17Å; V281-L344 HydrophobicContact CG2-CD1 3.92Å
282	C	74.7	Confident	83.1	Confident	23 Å²	23	54.7 Å²	54.7	16%	0.155	30%	0.301	C	S	.	.	H	α-helix	trans	-102.9	4.6	-176.3	-67.3	0	0	0	0	114.3	K278 D284 K287	K278-C282 WeakPolarHBondContact O-CB 3.46Å; K278-C282 PolarHBondContact O-N 2.95Å; C282-D284 VanDerWaalsContact C-N 3.29Å; C282-D284 PolarHBondContact O-N 2.99Å; C282-K287 PolarHBondContact SG-O 3.44Å; C282-K287 VanDerWaalsContact SG-O 3.35Å
283	A	61.8	Low	83.2	Confident	77 Å²	77	49.6 Å²	49.6	64%	0.636	28%	0.279	S	S	*	.	S	Bend	trans	-61.8	-33.6	179.6	0	0	0	0	0	113.7	N279	N279-A283 WeakPolarHBondContact O-CB 3.18Å; N279-A283 PolarHBondContact O-N 3.05Å
284	D	58	Low	83.3	Confident	156 Å²	156	48.9 Å²	48.9	83%	0.834	28%	0.277	S	S	*	.	S	Bend	trans	-104.9	-13.3	-170.4	-60.9	-39.9	0	0	0	114.2	C282	C282-D284 VanDerWaalsContact C-N 3.29Å; C282-D284 PolarHBondContact O-N 2.99Å
285	N	58.8	Low	83.3	Confident	99 Å²	99	53.4 Å²	53.4	53%	0.529	30%	0.297	S	S	.	.	S	Bend	trans	-134.4	142	-172.3	-97.7	-35.5	0	0	0	110.6	K287	N285-K287 HydrophobicContact CB-CB 4.41Å; N285-K287 HydrophobicContact CB-CD 4Å; N285-K287 HydrophobicContact CB-CG 3.92Å; N285-K287 PolarHBondContact O-N 2.95Å
286	N	70.4	Confident	83.3	Confident	172 Å²	172	52.4 Å²	52.4	92%	0.92	29%	0.293	S	S	*	.			trans	-71.9	38.3	176.8	-155.5	15.4	0	0	0	112.5
287	K	80.4	Confident	83.3	Confident	52 Å²	52	46.4 Å²	46.4	23%	0.226	27%	0.265	C	S	.	.			trans	-84.1	141.3	-177.1	-77.5	179.6	-173.9	-151.9	0	110.6	D227 F229 C282 N285	D227-K287 HydrophobicContact CB-CG 4.31Å; D227-K287 CarbonylContact O-C 3.45Å; D227-K287 WeakPolarHBondContact O-CA 3.33Å; D227-K287 WeakPolarHBondContact O-CB 3.28Å; D227-K287 WeakPolarHBondContact OD2-CE 3.44Å; D227-K287 WeakPolarHBondContact OD2-CG 3.25Å; D227-K287 IonicContact OD2-NZ 2.92Å; F229-K287 HydrophobicContact CD2-CB 4.26Å; F229-K287 HydrophobicContact CD2-CD 4.25Å; F229-K287 HydrophobicContact CE2-CB 4.07Å; F229-K287 HydrophobicContact CE2-CD 3.36Å; F229-K287 HydrophobicContact CE2-CG 4.32Å; F229-K287 HydrophobicContact CZ-CD 3.8Å; C282-K287 PolarHBondContact SG-O 3.44Å; C282-K287 VanDerWaalsContact SG-O 3.35Å; N285-K287 HydrophobicContact CB-CB 4.41Å; N285-K287 HydrophobicContact CB-CD 4Å; N285-K287 HydrophobicContact CB-CG 3.92Å; N285-K287 PolarHBondContact O-N 2.95Å
288	G	85.8	Confident	83.5	Confident	10 Å²	10	48.4 Å²	48.4	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	162	175.5	0	0	0	0	0	113.9	E226 D227 A228 F229	E226-G288 PolarHBondContact O-N 3.4Å; D227-G288 PolarHBondContact O-N 2.91Å; A228-G288 WeakPolarHBondContact CA-O 3.25Å; F229-G288 PolarHBondContact N-O 2.85Å
289	F	91.4	Very high	83.6	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.018	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	126.8	171.6	-159.8	-92.2	0	0	0	110.2	F229 L231 I274 L277 K278 V291 I310 V311 L344	F229-F289 HydrophobicContact CB-CD2 3.9Å; F229-F289 HydrophobicContact CB-CE2 4.19Å; L231-F289 HydrophobicContact CB-CE1 4.17Å; L231-F289 HydrophobicContact CB-CZ 3.96Å; L231-F289 HydrophobicContact CD2-CE1 4.32Å; L231-F289 HydrophobicContact CD2-CZ 4.23Å; I274-F289 HydrophobicContact CG2-CE1 4.04Å; L277-F289 HydrophobicContact CD2-CZ 4.1Å; K278-F289 HydrophobicContact CB-CD1 4.14Å; K278-F289 HydrophobicContact CB-CD2 4.13Å; K278-F289 HydrophobicContact CB-CE1 4.38Å; K278-F289 HydrophobicContact CB-CE2 4.37Å; K278-F289 HydrophobicContact CB-CG 4.01Å; K278-F289 HydrophobicContact CG-CB 3.87Å; K278-F289 HydrophobicContact CG-CD1 4.31Å; K278-F289 HydrophobicContact CG-CD2 4.24Å; K278-F289 HydrophobicContact CG-CG 3.89Å; F289-V291 HydrophobicContact CD1-CG2 3.99Å; F289-V291 HydrophobicContact CE1-CG2 3.63Å; F289-I310 HydrophobicContact CB-CG1 4.34Å; F289-I310 HydrophobicContact CD1-CD1 4.04Å; F289-I310 HydrophobicContact CD1-CG1 4.08Å; F289-I310 HydrophobicContact CD1-CG2 3.91Å; F289-V311 PolarHBondContact O-N 3.2Å; F289-L344 HydrophobicContact CE2-CD1 3.89Å; F289-L344 HydrophobicContact CE2-CD2 3.82Å; F289-L344 HydrophobicContact CZ-CD2 3.88Å
290	V	92.8	Very high	83.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.4	-176.5	-179.4	0	0	0	0	108.7	V225 A228 F229 V230 L231 L292 V311 L313 V350	V225-V290 HydrophobicContact CG1-CG2 4.46Å; A228-V290 HydrophobicContact CB-CG2 3.87Å; F229-V290 PolarHBondContact O-N 2.77Å; V230-V290 WeakPolarHBondContact CA-O 3.3Å; L231-V290 PolarHBondContact N-O 3.47Å; V290-L292 HydrophobicContact CG1-CD2 3.98Å; V290-L292 HydrophobicContact CG1-CG 4.24Å; V290-V311 CarbonylContact C-O 3.28Å; V290-V311 WeakPolarHBondContact CA-O 3.31Å; V290-V311 HydrophobicContact CG1-CB 4.43Å; V290-V311 HydrophobicContact CG2-CB 4.23Å; V290-L313 HydrophobicContact CG1-CD1 4.33Å; V290-V350 HydrophobicContact CG1-CG1 4.48Å; V290-V350 HydrophobicContact CG2-CB 4.18Å; V290-V350 HydrophobicContact CG2-CG1 4.12Å; V290-V350 HydrophobicContact CG2-CG2 4.21Å
291	V	93.3	Very high	84	Confident	1 Å²	1	49 Å²	49	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.2	177.2	178.6	0	0	0	0	109.1	L231 I274 F289 I310 V311 A312 L313	L231-V291 HydrophobicContact CB-CG2 4.37Å; L231-V291 HydrophobicContact CD2-CG2 4.25Å; I274-V291 HydrophobicContact CG2-CG2 3.88Å; F289-V291 HydrophobicContact CD1-CG2 3.99Å; F289-V291 HydrophobicContact CE1-CG2 3.63Å; V291-I310 HydrophobicContact CB-CG2 4.35Å; V291-I310 HydrophobicContact CG2-CG2 3.66Å; V291-V311 PolarHBondContact N-O 3.23Å; V291-A312 WeakPolarHBondContact O-CA 3.46Å; V291-L313 PolarHBondContact O-N 3.35Å
292	L	93.8	Very high	84.5	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	100.8	177.1	-59.2	-179.4	0	0	0	108.4	L212 V230 L231 T232 C233 V290 L313 T316 L324 I363	L212-L292 HydrophobicContact CD1-CD1 4.29Å; L212-L292 HydrophobicContact CD1-CD2 3.81Å; V230-L292 HydrophobicContact CG1-CD1 3.44Å; V230-L292 VanDerWaalsContact CG1-CD1 3.44Å; V230-L292 HydrophobicContact CG1-CG 3.98Å; L231-L292 PolarHBondContact O-N 3.18Å; T232-L292 HydrophobicContact CG2-CB 4.33Å; T232-L292 HydrophobicContact CG2-CD1 4.43Å; C233-L292 PolarHBondContact N-O 3.48Å; V290-L292 HydrophobicContact CG1-CD2 3.98Å; V290-L292 HydrophobicContact CG1-CG 4.24Å; L292-L313 HydrophobicContact CD2-CB 3.72Å; L292-L313 HydrophobicContact CD2-CD1 3.64Å; L292-L313 HydrophobicContact CD2-CD2 3.85Å; L292-L313 HydrophobicContact CD2-CG 3.93Å; L292-T316 HydrophobicContact CB-CG2 4.32Å; L292-L324 HydrophobicContact CB-CD1 4.37Å; L292-L324 HydrophobicContact CD1-CD1 3.4Å; L292-L324 VanDerWaalsContact CD1-CD1 3.4Å; L292-L324 HydrophobicContact CD1-CD2 3.59Å; L292-L324 HydrophobicContact CD1-CG 4.08Å; L292-L324 HydrophobicContact CG-CD1 4.48Å; L292-I363 HydrophobicContact CD1-CD1 3.74Å
293	N	93.1	Very high	85.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.7	179.2	-165.9	7.6	0	0	0	111.7	C233 A235 K295 G296 I297 L313 R314 R315 T316	C233-N293 WeakPolarHBondContact O-CA 3.49Å; C233-N293 PolarHBondContact O-OD1 3.32Å; C233-N293 VanDerWaalsContact O-OD1 3.11Å; A235-N293 VanDerWaalsContact O-CG 3.31Å; A235-N293 PolarHBondContact O-ND2 3.18Å; A235-N293 PolarHBondContact O-OD1 2.76Å; N293-K295 VanDerWaalsContact C-N 3.25Å; N293-K295 PolarHBondContact O-N 3.27Å; N293-K295 PolarHBondContact OD1-N 2.84Å; N293-G296 PolarHBondContact ND2-O 3.47Å; N293-I297 HydrophobicContact CB-CD1 4.09Å; N293-I297 HydrophobicContact CB-CG1 4.18Å; N293-L313 PolarHBondContact N-O 3.47Å; N293-R314 CarbonylContact O-C 3.44Å; N293-R315 PolarHBondContact O-N 3.39Å; N293-T316 VanDerWaalsContact C-OG1 3.23Å; N293-T316 PolarHBondContact O-N 3.28Å; N293-T316 PolarHBondContact O-OG1 2.64Å; N293-T316 VanDerWaalsContact O-OG1 3.13Å
294	Q	92	Very high	86.7	Confident	54 Å²	54	47.3 Å²	47.3	25%	0.252	25%	0.248	S	C	.	.	S	Bend	trans	-66.4	-31.5	171	-168.6	-171.3	-16.9	0	0	111.6	C233 N234 R315 T316 M321	C233-Q294 PolarHBondContact O-N 2.8Å; N234-Q294 HydrophobicContact CB-CB 4.02Å; N234-Q294 VanDerWaalsContact CB-OE1 3.28Å; Q294-R315 WeakPolarHBondContact O-CA 2.98Å; Q294-T316 VanDerWaalsContact CA-OG1 3.32Å; Q294-T316 WeakPolarHBondContact CA-OG1 3.42Å; Q294-T316 WeakPolarHBondContact CG-O 3.36Å; Q294-T316 PolarHBondContact N-OG1 2.72Å; Q294-M321 HydrophobicContact CB-CG 4.38Å
295	K	91.9	Very high	88.4	Confident	95 Å²	95	39.9 Å²	39.9	41%	0.413	21%	0.208	S	C	.	.	S	Bend	trans	-92.6	-179	178.8	-64	-69.3	-177.3	164.7	0	111	N234 N293 R315	N234-K295 WeakPolarHBondContact O-CG 3.49Å; N293-K295 VanDerWaalsContact C-N 3.25Å; N293-K295 PolarHBondContact O-N 3.27Å; N293-K295 PolarHBondContact OD1-N 2.84Å; K295-R315 PolarHBondContact O-N 3.43Å
296	G	90.7	Very high	89.9	Confident	6 Å²	6	35.6 Å²	35.6	6%	0.062	19%	0.186	C	C	.	.			trans	-69.2	162.7	177.4	0	0	0	0	0	113.3	L237 E238 N293	L237-G296 PolarHBondContact N-O 3.39Å; L237-G296 VanDerWaalsContact N-O 3.15Å; E238-G296 WeakPolarHBondContact OE1-CA 3.33Å; N293-G296 PolarHBondContact ND2-O 3.47Å
297	I	91.8	Very high	90.9	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-133	124.1	172.5	-52.4	179.8	0	0	0	107	L237 E238 N293 L302 A312 R314	L237-I297 HydrophobicContact CB-CB 4.36Å; L237-I297 HydrophobicContact CB-CG1 4.28Å; L237-I297 HydrophobicContact CB-CG2 4.11Å; L237-I297 HydrophobicContact CD1-CD1 4.33Å; L237-I297 HydrophobicContact CD1-CG1 4.1Å; L237-I297 HydrophobicContact CD1-CG2 4.26Å; E238-I297 PolarHBondContact OE1-N 3.38Å; N293-I297 HydrophobicContact CB-CD1 4.09Å; N293-I297 HydrophobicContact CB-CG1 4.18Å; I297-L302 HydrophobicContact CB-CD2 4Å; I297-L302 HydrophobicContact CB-CG 4.28Å; I297-L302 HydrophobicContact CD1-CD2 4.33Å; I297-L302 HydrophobicContact CG2-CD2 3.65Å; I297-L302 HydrophobicContact CG2-CG 3.79Å; I297-A312 HydrophobicContact CD1-CB 3.89Å; I297-R314 HydrophobicContact CB-CB 4.09Å; I297-R314 HydrophobicContact CD1-CB 4.04Å; I297-R314 HydrophobicContact CG1-CB 3.73Å
298	D	90.9	Very high	91.3	Very high	53 Å²	53	36.8 Å²	36.8	28%	0.283	18%	0.184	S	C	.	.			trans	-65.5	146.5	178.6	-174.2	68.8	0	0	0	111.7	L237 E238 Y300 S301 L302	L237-D298 WeakPolarHBondContact O-CB 3.45Å; L237-D298 PolarHBondContact O-N 3.29Å; L237-D298 VanDerWaalsContact O-N 3.12Å; E238-D298 HydrophobicContact CG-CB 4.34Å; D298-Y300 VanDerWaalsContact C-N 3.27Å; D298-Y300 PolarHBondContact O-N 2.64Å; D298-Y300 WeakPolarHBondContact OD2-CB 3.43Å; D298-Y300 PolarHBondContact OD2-N 2.73Å; D298-S301 WeakPolarHBondContact O-CB 3.31Å; D298-S301 PolarHBondContact O-N 3.4Å; D298-L302 PolarHBondContact O-N 3.28Å
299	P	90.1	Very high	91.4	Very high	78 Å²	78	37.1 Å²	37.1	51%	0.506	19%	0.187	S	C	.	.	H	α-helix	trans	-53.8	-39.5	177.8	-28.8	37.9	0	0	0	114.1	S301 L302 D303	P299-S301 VanDerWaalsContact C-N 3.3Å; P299-S301 PolarHBondContact O-N 3.42Å; P299-L302 WeakPolarHBondContact O-CB 3.24Å; P299-L302 PolarHBondContact O-N 3.32Å; P299-L302 VanDerWaalsContact O-N 3.13Å; P299-D303 PolarHBondContact O-N 3.34Å
300	Y	89.1	Confident	91.4	Very high	116 Å²	116	37 Å²	37	46%	0.455	19%	0.187	S	C	.	.	H	α-helix	trans	-65.4	-37.4	178.8	-172.8	-97.9	0	0	0	112	E268 D298 L302 D303 A304	E268-Y300 HydrophobicContact CG-CD1 4.43Å; E268-Y300 HydrophobicContact CG-CE1 3.85Å; D298-Y300 VanDerWaalsContact C-N 3.27Å; D298-Y300 PolarHBondContact O-N 2.64Å; D298-Y300 WeakPolarHBondContact OD2-CB 3.43Å; D298-Y300 PolarHBondContact OD2-N 2.73Å; Y300-L302 VanDerWaalsContact C-N 3.34Å; Y300-D303 PolarHBondContact O-N 3.3Å; Y300-A304 PolarHBondContact O-N 3.07Å
301	S	91.3	Very high	91.3	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-65.9	-38.6	173.9	-59.7	0	0	0	0	111.5	I267 V271 D298 P299 A304 L305	I267-S301 WeakPolarHBondContact CG2-OG 2.92Å; V271-S301 WeakPolarHBondContact CG2-OG 3.48Å; D298-S301 WeakPolarHBondContact O-CB 3.31Å; D298-S301 PolarHBondContact O-N 3.4Å; P299-S301 VanDerWaalsContact C-N 3.3Å; P299-S301 PolarHBondContact O-N 3.42Å; S301-A304 PolarHBondContact O-N 3.1Å; S301-L305 WeakPolarHBondContact O-CB 3.47Å; S301-L305 WeakPolarHBondContact O-CG 3.35Å; S301-L305 PolarHBondContact O-N 3.31Å
302	L	91.9	Very high	91.3	Very high	11 Å²	11	37.3 Å²	37.3	6%	0.058	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-43.3	174.5	-68.1	173.5	0	0	0	111.4	R217 H218 M221 I297 D298 P299 Y300 L305 A306 A312	R217-L302 HydrophobicContact CB-CD1 4.29Å; H218-L302 HydrophobicContact CB-CB 4.43Å; M221-L302 HydrophobicContact CE-CB 4.04Å; M221-L302 HydrophobicContact CE-CD2 3.72Å; M221-L302 VanDerWaalsContact CE-O 3.25Å; M221-L302 WeakPolarHBondContact CE-O 3.1Å; I297-L302 HydrophobicContact CB-CD2 4Å; I297-L302 HydrophobicContact CB-CG 4.28Å; I297-L302 HydrophobicContact CD1-CD2 4.33Å; I297-L302 HydrophobicContact CG2-CD2 3.65Å; I297-L302 HydrophobicContact CG2-CG 3.79Å; D298-L302 PolarHBondContact O-N 3.28Å; P299-L302 WeakPolarHBondContact O-CB 3.24Å; P299-L302 PolarHBondContact O-N 3.32Å; P299-L302 VanDerWaalsContact O-N 3.13Å; Y300-L302 VanDerWaalsContact C-N 3.34Å; L302-L305 PolarHBondContact O-N 3.28Å; L302-A306 WeakPolarHBondContact O-CB 3.29Å; L302-A306 PolarHBondContact O-N 2.94Å; L302-A312 HydrophobicContact CD2-CB 4.06Å
303	D	92.3	Very high	91.3	Very high	62 Å²	62	37.5 Å²	37.5	33%	0.332	19%	0.19	S	C	.	.	H	α-helix	trans	-62.8	-42.9	177.7	-63.5	-2	0	0	0	111.3	H218 P299 Y300 A306 K307	H218-D303 IonicContact CD2-OD1 3.88Å; H218-D303 PolarHBondContact CD2-OD1 2.94Å; H218-D303 IonicContact NE2-OD1 2.99Å; H218-D303 PolarHBondContact NE2-OD1 3.1Å; H218-D303 VanDerWaalsContact NE2-OD1 3.07Å; P299-D303 PolarHBondContact O-N 3.34Å; Y300-D303 PolarHBondContact O-N 3.3Å; D303-A306 PolarHBondContact O-N 3.2Å; D303-K307 VanDerWaalsContact O-CG 3.32Å; D303-K307 WeakPolarHBondContact O-CG 3.04Å; D303-K307 PolarHBondContact O-N 2.98Å
304	A	91.9	Very high	91.3	Very high	24 Å²	24	41.1 Å²	41.1	20%	0.198	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-45.7	177.3	0	0	0	0	0	111.9	V271 Y300 S301 A306 K307 E308	V271-A304 HydrophobicContact CG1-CB 3.97Å; Y300-A304 PolarHBondContact O-N 3.07Å; S301-A304 PolarHBondContact O-N 3.1Å; A304-A306 VanDerWaalsContact C-N 3.34Å; A304-K307 PolarHBondContact O-N 3.48Å; A304-E308 PolarHBondContact O-N 3.49Å
305	L	91.8	Very high	91.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-37.1	176.4	-67.3	171.4	0	0	0	111.7	M221 V271 I274 S301 L302 E308 G309 I310 A312	M221-L305 HydrophobicContact CE-CB 4.3Å; V271-L305 HydrophobicContact CG1-CD2 4.14Å; V271-L305 HydrophobicContact CG1-CG 4.28Å; I274-L305 HydrophobicContact CG2-CD2 4.11Å; S301-L305 WeakPolarHBondContact O-CB 3.47Å; S301-L305 WeakPolarHBondContact O-CG 3.35Å; S301-L305 PolarHBondContact O-N 3.31Å; L302-L305 PolarHBondContact O-N 3.28Å; L305-E308 CarbonylContact O-C 3.54Å; L305-E308 PolarHBondContact O-N 2.92Å; L305-G309 PolarHBondContact O-N 3.05Å; L305-I310 HydrophobicContact CB-CB 4.21Å; L305-I310 HydrophobicContact CD2-CB 4.31Å; L305-I310 HydrophobicContact CD2-CD1 3.67Å; L305-I310 HydrophobicContact CD2-CG2 4.26Å; L305-I310 WeakPolarHBondContact O-CB 3.36Å; L305-I310 PolarHBondContact O-N 3.2Å; L305-A312 HydrophobicContact CB-CB 4.43Å; L305-A312 HydrophobicContact CD1-CB 3.64Å
306	A	91.9	Very high	91.2	Very high	9 Å²	9	41.6 Å²	41.6	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-41.1	178.2	0	0	0	0	0	112.5	H218 M221 L302 D303 A304 E308 G309	H218-A306 HydrophobicContact CB-CB 4.35Å; H218-A306 WeakPolarHBondContact ND1-CB 3.11Å; M221-A306 HydrophobicContact CE-CB 4.06Å; M221-A306 HydrophobicContact CG-CB 3.79Å; L302-A306 WeakPolarHBondContact O-CB 3.29Å; L302-A306 PolarHBondContact O-N 2.94Å; D303-A306 PolarHBondContact O-N 3.2Å; A304-A306 VanDerWaalsContact C-N 3.34Å; A306-E308 PolarHBondContact O-N 3.18Å; A306-G309 WeakPolarHBondContact O-CA 3.33Å; A306-G309 PolarHBondContact O-N 3.28Å
307	K	91.1	Very high	91.3	Very high	175 Å²	175	44.7 Å²	44.7	76%	0.761	21%	0.214	S	C	*	.	H	α-helix	trans	-58.7	-37.4	174.1	-75.2	171.3	-175.5	174.9	0	112.1	D303 A304 G309	D303-K307 VanDerWaalsContact O-CG 3.32Å; D303-K307 WeakPolarHBondContact O-CG 3.04Å; D303-K307 PolarHBondContact O-N 2.98Å; A304-K307 PolarHBondContact O-N 3.48Å; K307-G309 PolarHBondContact O-N 3.31Å
308	E	88.8	Confident	91.3	Very high	74 Å²	74	53.1 Å²	53.1	35%	0.346	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-0.9	174.7	-68.9	-59.2	146.1	0	0	113.2	I275 K278 A304 L305 A306 I310	I275-E308 HydrophobicContact CD1-CG 3.92Å; I275-E308 HydrophobicContact CG1-CG 4.01Å; I275-E308 HydrophobicContact CG2-CG 4Å; K278-E308 WeakPolarHBondContact CE-O 3.49Å; K278-E308 PolarHBondContact NZ-O 3.23Å; K278-E308 IonicContact NZ-OE2 2.72Å; K278-E308 PolarHBondContact NZ-OE2 2.88Å; A304-E308 PolarHBondContact O-N 3.49Å; L305-E308 CarbonylContact O-C 3.54Å; L305-E308 PolarHBondContact O-N 2.92Å; A306-E308 PolarHBondContact O-N 3.18Å; E308-I310 HydrophobicContact CB-CD1 4.27Å; E308-I310 HydrophobicContact CB-CG1 4.19Å; E308-I310 PolarHBondContact O-N 3.36Å
309	G	87	Confident	91.3	Very high	16 Å²	16	56.3 Å²	56.3	17%	0.165	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	21.7	-179	0	0	0	0	0	114.1	L305 A306 K307	L305-G309 PolarHBondContact O-N 3.05Å; A306-G309 WeakPolarHBondContact O-CA 3.33Å; A306-G309 PolarHBondContact O-N 3.28Å; K307-G309 PolarHBondContact O-N 3.31Å
310	I	91.4	Very high	91.3	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	23%	0.229	C	C	.	.			trans	-83.2	130.2	173.2	-61.2	175	0	0	0	108.7	I274 I275 K278 F289 V291 L305 E308	I274-I310 HydrophobicContact CG2-CD1 4.29Å; I275-I310 HydrophobicContact CG1-CD1 4.48Å; K278-I310 HydrophobicContact CB-CD1 4.12Å; K278-I310 HydrophobicContact CD-CD1 3.9Å; K278-I310 HydrophobicContact CD-CG1 3.93Å; K278-I310 HydrophobicContact CG-CD1 4.12Å; K278-I310 HydrophobicContact CG-CG1 4.18Å; F289-I310 HydrophobicContact CB-CG1 4.34Å; F289-I310 HydrophobicContact CD1-CD1 4.04Å; F289-I310 HydrophobicContact CD1-CG1 4.08Å; F289-I310 HydrophobicContact CD1-CG2 3.91Å; V291-I310 HydrophobicContact CB-CG2 4.35Å; V291-I310 HydrophobicContact CG2-CG2 3.66Å; L305-I310 HydrophobicContact CB-CB 4.21Å; L305-I310 HydrophobicContact CD2-CB 4.31Å; L305-I310 HydrophobicContact CD2-CD1 3.67Å; L305-I310 HydrophobicContact CD2-CG2 4.26Å; L305-I310 WeakPolarHBondContact O-CB 3.36Å; L305-I310 PolarHBondContact O-N 3.2Å; E308-I310 HydrophobicContact CB-CD1 4.27Å; E308-I310 HydrophobicContact CB-CG1 4.19Å; E308-I310 PolarHBondContact O-N 3.36Å
311	V	92.3	Very high	91.3	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.042	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	116.1	171.7	-179.4	0	0	0	0	108.5	A216 K222 V225 F289 V290 V291 L313	A216-V311 HydrophobicContact CB-CG1 4.24Å; K222-V311 HydrophobicContact CB-CG2 4.08Å; K222-V311 WeakPolarHBondContact O-CG2 3.27Å; V225-V311 HydrophobicContact CG2-CG2 3.51Å; F289-V311 PolarHBondContact O-N 3.2Å; V290-V311 CarbonylContact C-O 3.28Å; V290-V311 WeakPolarHBondContact CA-O 3.31Å; V290-V311 HydrophobicContact CG1-CB 4.43Å; V290-V311 HydrophobicContact CG2-CB 4.23Å; V291-V311 PolarHBondContact N-O 3.23Å; V311-L313 HydrophobicContact CG1-CD1 3.83Å
312	A	93	Very high	91.2	Very high	2 Å²	2	52.6 Å²	52.6	2%	0.017	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123	-178.4	0	0	0	0	0	111.2	M221 V291 I297 L302 L305	M221-A312 HydrophobicContact CE-CB 3.86Å; M221-A312 HydrophobicContact SD-CB 4.36Å; V291-A312 WeakPolarHBondContact O-CA 3.46Å; I297-A312 HydrophobicContact CD1-CB 3.89Å; L302-A312 HydrophobicContact CD2-CB 4.06Å; L305-A312 HydrophobicContact CB-CB 4.43Å; L305-A312 HydrophobicContact CD1-CB 3.64Å
313	L	93.2	Very high	91.1	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.016	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	133.2	172.1	-74.8	81.8	0	0	0	109.4	L212 H214 V290 V291 L292 N293 V311 T316 T361	L212-L313 HydrophobicContact CB-CD2 4.3Å; L212-L313 HydrophobicContact CD1-CD2 3.54Å; H214-L313 WeakPolarHBondContact O-CD2 3.39Å; V290-L313 HydrophobicContact CG1-CD1 4.33Å; V291-L313 PolarHBondContact O-N 3.35Å; L292-L313 HydrophobicContact CD2-CB 3.72Å; L292-L313 HydrophobicContact CD2-CD1 3.64Å; L292-L313 HydrophobicContact CD2-CD2 3.85Å; L292-L313 HydrophobicContact CD2-CG 3.93Å; N293-L313 PolarHBondContact N-O 3.47Å; V311-L313 HydrophobicContact CG1-CD1 3.83Å; L313-T316 HydrophobicContact CB-CG2 4.23Å; L313-T361 HydrophobicContact CD1-CG2 4.4Å; L313-T361 HydrophobicContact CD2-CG2 4.24Å
314	R	92.2	Very high	91	Very high	77 Å²	77	50 Å²	50	29%	0.291	22%	0.218	S	C	.	.			trans	-105.5	153.9	176.8	70.5	-179.4	-171.5	176.9	-0.4	110.7	N293 I297 T316	N293-R314 CarbonylContact O-C 3.44Å; I297-R314 HydrophobicContact CB-CB 4.09Å; I297-R314 HydrophobicContact CD1-CB 4.04Å; I297-R314 HydrophobicContact CG1-CB 3.73Å; R314-T316 VanDerWaalsContact C-N 3.33Å; R314-T316 PolarHBondContact O-N 2.98Å
315	R	91.5	Very high	90.9	Very high	149 Å²	149	50.5 Å²	50.5	56%	0.562	22%	0.219	S	C	*	.	S	Bend	trans	56.2	42.6	172.7	-56.9	-174.6	-177.1	-174.1	-0.8	113.5	N293 Q294 K295	N293-R315 PolarHBondContact O-N 3.39Å; Q294-R315 WeakPolarHBondContact O-CA 2.98Å; K295-R315 PolarHBondContact O-N 3.43Å
316	T	91.9	Very high	90.8	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.055	23%	0.231	C	C	.	.			trans	-64.7	142.2	170.9	57.1	0	0	0	0	110.2	L212 L292 N293 Q294 L313 R314 M321	L212-T316 HydrophobicContact CD1-CG2 4.42Å; L292-T316 HydrophobicContact CB-CG2 4.32Å; N293-T316 VanDerWaalsContact C-OG1 3.23Å; N293-T316 PolarHBondContact O-N 3.28Å; N293-T316 PolarHBondContact O-OG1 2.64Å; N293-T316 VanDerWaalsContact O-OG1 3.13Å; Q294-T316 VanDerWaalsContact CA-OG1 3.32Å; Q294-T316 WeakPolarHBondContact CA-OG1 3.42Å; Q294-T316 WeakPolarHBondContact CG-O 3.36Å; Q294-T316 PolarHBondContact N-OG1 2.72Å; L313-T316 HydrophobicContact CB-CG2 4.23Å; R314-T316 VanDerWaalsContact C-N 3.33Å; R314-T316 PolarHBondContact O-N 2.98Å; T316-M321 PolarHBondContact OG1-SD 3.41Å
317	K	92.4	Very high	90.6	Very high	72 Å²	72	52.4 Å²	52.4	31%	0.313	23%	0.228	S	C	.	.			trans	-64.2	139.9	179.6	-65.5	175.1	-174.8	161.2	0	109.9	D213 R319 N320 M321	D213-K317 IonicContact OD1-NZ 2.86Å; D213-K317 WeakPolarHBondContact OD2-CE 3.2Å; D213-K317 IonicContact OD2-NZ 2.73Å; D213-K317 PolarHBondContact OD2-NZ 3.26Å; K317-R319 VanDerWaalsContact C-N 3.28Å; K317-R319 HydrophobicContact CB-CG 4.08Å; K317-R319 PolarHBondContact O-N 3.43Å; K317-N320 HydrophobicContact CB-CB 4.44Å; K317-N320 WeakPolarHBondContact O-CA 3.42Å; K317-N320 WeakPolarHBondContact O-CB 3.18Å; K317-N320 PolarHBondContact O-N 3Å; K317-M321 PolarHBondContact O-N 2.87Å
318	R	90.6	Very high	90.4	Very high	177 Å²	177	44.7 Å²	44.7	67%	0.668	20%	0.196	S	C	*	.	H	α-helix	trans	-51.7	-46	177.9	-175.2	178.6	170.3	172.5	-0.6	112.5	N320 M321	R318-N320 PolarHBondContact O-N 3.12Å; R318-M321 VanDerWaalsContact O-CB 3.3Å; R318-M321 WeakPolarHBondContact O-CB 3.43Å; R318-M321 PolarHBondContact O-N 2.88Å
319	R	91.3	Very high	90.3	Very high	119 Å²	119	44 Å²	44	45%	0.449	21%	0.209	S	C	.	.	H	α-helix	trans	-57.7	-30.3	177	70.3	-175.7	-169.4	-169.9	7.8	113.7	E192 K317 M321 R323	E192-R319 IonicContact OE1-CZ 3.69Å; E192-R319 IonicContact OE1-NE 3.23Å; E192-R319 PolarHBondContact OE1-NE 2.97Å; E192-R319 IonicContact OE1-NH2 3.86Å; E192-R319 PolarHBondContact OE1-NH2 3.34Å; E192-R319 IonicContact OE2-NH2 2.78Å; K317-R319 VanDerWaalsContact C-N 3.28Å; K317-R319 HydrophobicContact CB-CG 4.08Å; K317-R319 PolarHBondContact O-N 3.43Å; R319-M321 VanDerWaalsContact C-N 3.32Å; R319-R323 WeakPolarHBondContact O-CG 3.49Å; R319-R323 PolarHBondContact O-N 2.97Å
320	N	90.6	Very high	90.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-75.3	-26.2	178.5	-71.3	-0.8	0	0	0	111.2	L210 L212 K317 R318 R323 L324	L210-N320 HydrophobicContact CD2-CB 3.87Å; L212-N320 HydrophobicContact CD2-CB 3.99Å; L212-N320 VanDerWaalsContact CD2-ND2 3.28Å; L212-N320 WeakPolarHBondContact CD2-ND2 3.38Å; K317-N320 HydrophobicContact CB-CB 4.44Å; K317-N320 WeakPolarHBondContact O-CA 3.42Å; K317-N320 WeakPolarHBondContact O-CB 3.18Å; K317-N320 PolarHBondContact O-N 3Å; R318-N320 PolarHBondContact O-N 3.12Å; N320-R323 PolarHBondContact O-N 3.45Å; N320-R323 PolarHBondContact OD1-NH1 3.3Å; N320-L324 WeakPolarHBondContact O-CB 3.15Å; N320-L324 WeakPolarHBondContact O-CD1 3.46Å; N320-L324 WeakPolarHBondContact O-CG 3.39Å; N320-L324 PolarHBondContact O-N 3.48Å
321	M	88.5	Confident	90.2	Very high	10 Å²	10	48.3 Å²	48.3	5%	0.049	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-45.3	177.5	-59.8	-61.2	-75.1	0	0	111.4	T232 C233 Q294 T316 K317 R318 R319 R323 L324 T325	T232-M321 HydrophobicContact CG2-CE 4.18Å; C233-M321 VanDerWaalsContact O-CE 3.25Å; C233-M321 WeakPolarHBondContact O-CE 3.2Å; Q294-M321 HydrophobicContact CB-CG 4.38Å; T316-M321 PolarHBondContact OG1-SD 3.41Å; K317-M321 PolarHBondContact O-N 2.87Å; R318-M321 VanDerWaalsContact O-CB 3.3Å; R318-M321 WeakPolarHBondContact O-CB 3.43Å; R318-M321 PolarHBondContact O-N 2.88Å; R319-M321 VanDerWaalsContact C-N 3.32Å; M321-R323 VanDerWaalsContact C-N 3.28Å; M321-R323 PolarHBondContact O-N 3.05Å; M321-L324 PolarHBondContact O-N 3.16Å; M321-L324 HydrophobicContact SD-CD1 4.23Å; M321-T325 WeakPolarHBondContact O-CG2 3.32Å; M321-T325 PolarHBondContact O-N 3.38Å; M321-T325 PolarHBondContact O-OG1 3Å
322	E	89.1	Confident	90.1	Very high	107 Å²	107	49.8 Å²	49.8	50%	0.5	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-35.6	175.8	-67.6	167.6	-167	0	0	111.9	T325 L326	E322-T325 PolarHBondContact O-OG1 3.28Å; E322-L326 WeakPolarHBondContact O-CG 3.31Å; E322-L326 PolarHBondContact O-N 3.4Å
323	R	90.8	Very high	90	Very high	18 Å²	18	50.7 Å²	50.7	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-72.6	-38.2	175.8	-69.4	176.4	-176.4	154.7	-19	113	F189 E192 L210 R319 N320 M321 L326 A327 S371	F189-R323 VanDerWaalsContact O-CZ 3.25Å; F189-R323 PolarHBondContact O-NE 3.46Å; F189-R323 PolarHBondContact O-NH2 3.42Å; E192-R323 IonicContact OE1-NH1 2.81Å; E192-R323 PolarHBondContact OE1-NH1 3.2Å; E192-R323 IonicContact OE2-CZ 2.62Å; E192-R323 IonicContact OE2-NH1 3.31Å; E192-R323 PolarHBondContact OE2-NH1 2.85Å; E192-R323 IonicContact OE2-NH2 2.94Å; E192-R323 PolarHBondContact OE2-NH2 3.18Å; L210-R323 HydrophobicContact CD1-CB 4.27Å; L210-R323 HydrophobicContact CD2-CB 4.41Å; R319-R323 WeakPolarHBondContact O-CG 3.49Å; R319-R323 PolarHBondContact O-N 2.97Å; N320-R323 PolarHBondContact O-N 3.45Å; N320-R323 PolarHBondContact OD1-NH1 3.3Å; M321-R323 VanDerWaalsContact C-N 3.28Å; M321-R323 PolarHBondContact O-N 3.05Å; R323-L326 PolarHBondContact O-N 3.47Å; R323-A327 VanDerWaalsContact O-CB 3.29Å; R323-A327 WeakPolarHBondContact O-CB 3.37Å; R323-A327 PolarHBondContact O-N 3.09Å; R323-S371 WeakPolarHBondContact CB-OG 3.27Å; R323-S371 WeakPolarHBondContact CG-OG 3.37Å
324	L	90.1	Very high	89.9	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-66	-40.7	178.2	-76.1	161.3	0	0	0	111.8	L210 T232 L292 N320 M321 L326 A327 C328 I363	L210-L324 HydrophobicContact CB-CD2 4.21Å; L210-L324 HydrophobicContact CD2-CD1 4.15Å; L210-L324 HydrophobicContact CD2-CD2 3.63Å; L210-L324 HydrophobicContact CD2-CG 3.5Å; T232-L324 HydrophobicContact CG2-CB 3.85Å; T232-L324 HydrophobicContact CG2-CD1 4.09Å; L292-L324 HydrophobicContact CB-CD1 4.37Å; L292-L324 HydrophobicContact CD1-CD1 3.4Å; L292-L324 VanDerWaalsContact CD1-CD1 3.4Å; L292-L324 HydrophobicContact CD1-CD2 3.59Å; L292-L324 HydrophobicContact CD1-CG 4.08Å; L292-L324 HydrophobicContact CG-CD1 4.48Å; N320-L324 WeakPolarHBondContact O-CB 3.15Å; N320-L324 WeakPolarHBondContact O-CD1 3.46Å; N320-L324 WeakPolarHBondContact O-CG 3.39Å; N320-L324 PolarHBondContact O-N 3.48Å; M321-L324 PolarHBondContact O-N 3.16Å; M321-L324 HydrophobicContact SD-CD1 4.23Å; L324-L326 VanDerWaalsContact C-N 3.31Å; L324-L326 PolarHBondContact O-N 3.01Å; L324-A327 PolarHBondContact O-N 2.83Å; L324-C328 VanDerWaalsContact O-CB 3.29Å; L324-C328 WeakPolarHBondContact O-CB 3.44Å; L324-C328 PolarHBondContact O-N 2.79Å; L324-I363 HydrophobicContact CD2-CD1 3.52Å
325	T	89.7	Confident	89.7	Confident	34 Å²	34	54.3 Å²	54.3	21%	0.209	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-40.6	175.2	55.1	0	0	0	0	110.7	M321 E322 G329 G330 A332	M321-T325 WeakPolarHBondContact O-CG2 3.32Å; M321-T325 PolarHBondContact O-N 3.38Å; M321-T325 PolarHBondContact O-OG1 3Å; E322-T325 PolarHBondContact O-OG1 3.28Å; T325-G329 CarbonylContact O-C 3.56Å; T325-G329 WeakPolarHBondContact O-CA 3.45Å; T325-G329 PolarHBondContact O-N 3.25Å; T325-G330 WeakPolarHBondContact CA-O 3.38Å; T325-G330 WeakPolarHBondContact CB-O 3.42Å; T325-G330 WeakPolarHBondContact CG2-O 3.27Å; T325-A332 HydrophobicContact CG2-CB 3.84Å
326	L	88.8	Confident	89.3	Confident	49 Å²	49	47.6 Å²	47.6	26%	0.257	25%	0.249	S	C	.	.	H	α-helix	trans	-71.9	-37.6	177.4	-71.7	172.2	0	0	0	114	M190 E322 R323 L324 N368 R370	M190-L326 HydrophobicContact CE-CD1 3.52Å; M190-L326 HydrophobicContact CG-CD1 4.46Å; M190-L326 HydrophobicContact SD-CD1 3.27Å; M190-L326 WeakPolarHBondContact SD-CD1 3.5Å; E322-L326 WeakPolarHBondContact O-CG 3.31Å; E322-L326 PolarHBondContact O-N 3.4Å; R323-L326 PolarHBondContact O-N 3.47Å; L324-L326 VanDerWaalsContact C-N 3.31Å; L324-L326 PolarHBondContact O-N 3.01Å; L326-N368 VanDerWaalsContact O-O 3.08Å; L326-R370 HydrophobicContact CB-CB 4.21Å
327	A	88.8	Confident	89	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-76.6	-49.1	-180	0	0	0	0	0	112.1	R323 L324 C366 N368	R323-A327 VanDerWaalsContact O-CB 3.29Å; R323-A327 WeakPolarHBondContact O-CB 3.37Å; R323-A327 PolarHBondContact O-N 3.09Å; L324-A327 PolarHBondContact O-N 2.83Å; A327-C366 HydrophobicContact CB-CB 4.47Å; A327-C366 WeakPolarHBondContact O-CB 3.46Å; A327-N368 CarbonylContact O-C 2.89Å; A327-N368 VanDerWaalsContact O-O 3.12Å
328	C	87.2	Confident	88.6	Confident	12 Å²	12	56 Å²	56	8%	0.081	29%	0.293	C	S	.	.	H	α-helix	trans	-91.8	-14.2	-174.5	-56.3	0	0	0	0	113.5	L324 G345 Q346	L324-C328 VanDerWaalsContact O-CB 3.29Å; L324-C328 WeakPolarHBondContact O-CB 3.44Å; L324-C328 PolarHBondContact O-N 2.79Å; C328-G345 VanDerWaalsContact O-CA 3.31Å; C328-G345 WeakPolarHBondContact O-CA 3.39Å; C328-Q346 PolarHBondContact O-N 2.96Å
329	G	86.3	Confident	88.3	Confident	61 Å²	61	48.9 Å²	48.9	63%	0.629	27%	0.268	S	S	*	.			trans	81.1	5.6	179.2	0	0	0	0	0	115.7	T325	T325-G329 CarbonylContact O-C 3.56Å; T325-G329 WeakPolarHBondContact O-CA 3.45Å; T325-G329 PolarHBondContact O-N 3.25Å
330	G	86.5	Confident	88.1	Confident	7 Å²	7	46.1 Å²	46.1	7%	0.072	26%	0.264	C	S	.	.			trans	-82.5	167.2	-179.7	0	0	0	0	0	113.7	T325 C343	T325-G330 WeakPolarHBondContact CA-O 3.38Å; T325-G330 WeakPolarHBondContact CB-O 3.42Å; T325-G330 WeakPolarHBondContact CG2-O 3.27Å; G330-C343 WeakPolarHBondContact CA-O 3.19Å
331	I	89.7	Confident	87.9	Confident	99 Å²	99	49.8 Å²	49.8	51%	0.508	29%	0.288	S	S	.	.			trans	-101.4	130.3	175.8	-58.2	172.6	0	0	0	108.6	T232 M333 C343	T232-I331 PolarHBondContact OG1-O 3.4Å; I331-M333 HydrophobicContact CG2-SD 4.35Å; I331-M333 PolarHBondContact O-N 2.82Å; I331-C343 HydrophobicContact CB-CB 4.49Å; I331-C343 PolarHBondContact N-O 2.92Å
332	A	90.1	Very high	87.8	Confident	39 Å²	39	57.5 Å²	57.5	32%	0.322	32%	0.324	S	S	.	.			trans	-71.2	115.7	175.3	0	0	0	0	0	110.3	T325	T325-A332 HydrophobicContact CG2-CB 3.84Å
333	M	90.4	Very high	87.7	Confident	21 Å²	21	52.9 Å²	52.9	10%	0.103	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-90.6	134.9	-174.8	-66.7	-57.8	-68.7	0	0	112.5	L231 T232 C233 N234 I331 D338 L339 C343	L231-M333 HydrophobicContact CD1-CG 4.48Å; T232-M333 PolarHBondContact O-N 3.43Å; C233-M333 WeakPolarHBondContact CA-O 3.47Å; N234-M333 PolarHBondContact N-O 2.95Å; N234-M333 PolarHBondContact OD1-O 3.31Å; I331-M333 HydrophobicContact CG2-SD 4.35Å; I331-M333 PolarHBondContact O-N 2.82Å; M333-D338 HydrophobicContact CE-CB 4.22Å; M333-D338 WeakPolarHBondContact CE-O 3.27Å; M333-L339 HydrophobicContact CB-CD2 4.46Å; M333-L339 HydrophobicContact CG-CD2 4.25Å; M333-C343 HydrophobicContact CG-CB 4Å; M333-C343 HydrophobicContact SD-CB 3.84Å
334	N	90.4	Very high	87.6	Confident	112 Å²	112	52.9 Å²	52.9	60%	0.599	31%	0.305	S	S	*	.	S	Bend	trans	-95.1	-24.6	178.8	-62.1	-19.9	0	0	0	114.3	N234	N234-N334 VanDerWaalsContact CG-OD1 3.29Å; N234-N334 PolarHBondContact ND2-OD1 2.92Å; N234-N334 WeakPolarHBondContact OD1-CA 3.32Å; N234-N334 PolarHBondContact OD1-OD1 3.39Å
335	S	88	Confident	87.6	Confident	44 Å²	44	52.9 Å²	52.9	31%	0.308	31%	0.305	S	S	.	.			trans	-131	149.5	-178.5	-176.6	0	0	0	0	109.3	E337	S335-E337 VanDerWaalsContact C-N 3.31Å; S335-E337 PolarHBondContact OG-N 3.09Å
336	F	85	Confident	87.6	Confident	8 Å²	8	55.5 Å²	55.5	4%	0.035	32%	0.315	C	S	.	.	S	Bend	trans	-87.2	-1.8	174.5	-61.3	-67.7	0	0	0	112.8	C233 A235 L237 R270 K273 I274 L339	C233-F336 HydrophobicContact CB-CE1 3.95Å; C233-F336 HydrophobicContact CB-CZ 4.3Å; A235-F336 HydrophobicContact CB-CD2 3.84Å; A235-F336 HydrophobicContact CB-CE2 3.27Å; A235-F336 HydrophobicContact CB-CZ 3.69Å; L237-F336 HydrophobicContact CD1-CZ 4.19Å; L237-F336 HydrophobicContact CD2-CD2 4.39Å; L237-F336 HydrophobicContact CD2-CE1 4.36Å; L237-F336 HydrophobicContact CD2-CE2 3.59Å; L237-F336 HydrophobicContact CD2-CZ 3.59Å; L237-F336 HydrophobicContact CG-CE2 4.07Å; L237-F336 HydrophobicContact CG-CZ 3.73Å; R270-F336 HydrophobicContact CB-CD2 3.94Å; R270-F336 HydrophobicContact CB-CE2 4.41Å; R270-F336 HydrophobicContact CB-CG 4.42Å; R270-F336 HydrophobicContact CG-CD2 3.91Å; K273-F336 VanDerWaalsContact CD-O 3.23Å; K273-F336 WeakPolarHBondContact CD-O 3.48Å; I274-F336 HydrophobicContact CD1-CD1 3.97Å; I274-F336 HydrophobicContact CD1-CE1 3.69Å; I274-F336 HydrophobicContact CD1-CZ 4.37Å; I274-F336 HydrophobicContact CG1-CD1 4.01Å; I274-F336 HydrophobicContact CG1-CE1 4.2Å; F336-L339 HydrophobicContact CB-CD1 4.31Å; F336-L339 HydrophobicContact CD1-CD1 4.3Å; F336-L339 WeakPolarHBondContact O-CD1 3.43Å; F336-L339 WeakPolarHBondContact O-CG 3.27Å
337	E	84.5	Confident	87.7	Confident	141 Å²	141	53.1 Å²	53.1	66%	0.659	30%	0.303	S	S	*	.	S	Bend	trans	-81	-38.2	-178.5	-50.1	-159.4	135.9	0	0	112.3	K273 S335 L339	K273-E337 IonicContact NZ-OE1 3.07Å; K273-E337 PolarHBondContact NZ-OE1 3.26Å; S335-E337 VanDerWaalsContact C-N 3.31Å; S335-E337 PolarHBondContact OG-N 3.09Å; E337-L339 VanDerWaalsContact C-N 3.31Å; E337-L339 PolarHBondContact O-N 2.96Å
338	D	83.4	Confident	87.7	Confident	115 Å²	115	54.3 Å²	54.3	62%	0.615	32%	0.315	S	S	*	.	S	Bend	trans	-96.7	40.3	-175.8	-55.3	-45	0	0	0	112.1	M333 T340	M333-D338 HydrophobicContact CE-CB 4.22Å; M333-D338 WeakPolarHBondContact CE-O 3.27Å; D338-T340 PolarHBondContact O-N 3.34Å
339	L	85	Confident	88	Confident	28 Å²	28	54.6 Å²	54.6	15%	0.147	32%	0.316	C	S	.	.			trans	-79.2	109	-179.3	-71.7	178.4	0	0	0	110.8	L231 K273 I274 L277 M333 F336 E337	L231-L339 HydrophobicContact CD1-CD2 4.01Å; L231-L339 HydrophobicContact CD2-CD2 4.49Å; K273-L339 HydrophobicContact CB-CD1 4.35Å; I274-L339 HydrophobicContact CG1-CD1 4.33Å; L277-L339 HydrophobicContact CD1-CB 4.41Å; L277-L339 HydrophobicContact CD2-CB 4.11Å; L277-L339 HydrophobicContact CD2-CD1 4.32Å; L277-L339 HydrophobicContact CD2-CD2 4.39Å; M333-L339 HydrophobicContact CB-CD2 4.46Å; M333-L339 HydrophobicContact CG-CD2 4.25Å; F336-L339 HydrophobicContact CB-CD1 4.31Å; F336-L339 HydrophobicContact CD1-CD1 4.3Å; F336-L339 WeakPolarHBondContact O-CD1 3.43Å; F336-L339 WeakPolarHBondContact O-CG 3.27Å; E337-L339 VanDerWaalsContact C-N 3.31Å; E337-L339 PolarHBondContact O-N 2.96Å
340	T	86.8	Confident	88.3	Confident	61 Å²	61	51.9 Å²	51.9	37%	0.374	29%	0.286	S	S	.	.			trans	-113.7	154.7	172.1	65.6	0	0	0	0	111	D338 E342 C343	D338-T340 PolarHBondContact O-N 3.34Å; T340-E342 PolarHBondContact O-N 3.2Å; T340-C343 WeakPolarHBondContact O-CB 3.2Å; T340-C343 PolarHBondContact O-N 3.19Å; T340-C343 VanDerWaalsContact O-N 3.13Å; T340-C343 PolarHBondContact OG1-SG 3.37Å
341	P	86.4	Confident	88.7	Confident	77 Å²	77	54.6 Å²	54.6	50%	0.5	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-58.3	-26.8	176.1	-26.8	36.4	0	0	0	114	L277 V281 C343 L344	L277-P341 HydrophobicContact CD1-CG 4.43Å; V281-P341 HydrophobicContact CG2-CB 3.88Å; V281-P341 HydrophobicContact CG2-CG 3.99Å; P341-C343 PolarHBondContact O-N 3.04Å; P341-L344 WeakPolarHBondContact O-CB 3.49Å; P341-L344 PolarHBondContact O-N 3.13Å
342	E	86.6	Confident	88.9	Confident	172 Å²	172	51 Å²	51	80%	0.804	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-68.6	-22.3	179.1	-61.1	-178.6	-178.9	0	0	113	T340 L344	T340-E342 PolarHBondContact O-N 3.2Å; E342-L344 PolarHBondContact O-N 3.08Å
343	C	86.4	Confident	89	Confident	11 Å²	11	52.8 Å²	52.8	7%	0.074	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-74.6	-15.8	178.3	-58.3	0	0	0	0	112.9	G330 I331 M333 T340 P341	G330-C343 WeakPolarHBondContact CA-O 3.19Å; I331-C343 HydrophobicContact CB-CB 4.49Å; I331-C343 PolarHBondContact N-O 2.92Å; M333-C343 HydrophobicContact CG-CB 4Å; M333-C343 HydrophobicContact SD-CB 3.84Å; T340-C343 WeakPolarHBondContact O-CB 3.2Å; T340-C343 PolarHBondContact O-N 3.19Å; T340-C343 VanDerWaalsContact O-N 3.13Å; T340-C343 PolarHBondContact OG1-SG 3.37Å; P341-C343 PolarHBondContact O-N 3.04Å
344	L	89.5	Confident	89	Confident	17 Å²	17	54.8 Å²	54.8	9%	0.089	29%	0.291	C	S	.	.			trans	-77.2	135.1	-174.5	-63	172.2	0	0	0	111.5	F229 L231 L277 V281 F289 P341 E342	F229-L344 HydrophobicContact CB-CB 4.45Å; F229-L344 HydrophobicContact CB-CD1 4.21Å; F229-L344 HydrophobicContact CD1-CB 4.13Å; F229-L344 HydrophobicContact CD1-CD1 4.36Å; F229-L344 HydrophobicContact CG-CD1 4.31Å; L231-L344 HydrophobicContact CB-CD2 3.7Å; L231-L344 HydrophobicContact CD1-CD2 3.85Å; L231-L344 HydrophobicContact CG-CD2 4.31Å; L277-L344 HydrophobicContact CD2-CD1 4.37Å; L277-L344 HydrophobicContact CD2-CD2 3.98Å; L277-L344 HydrophobicContact CD2-CG 4.4Å; L277-L344 HydrophobicContact CG-CD1 4.49Å; V281-L344 HydrophobicContact CB-CD1 4.42Å; V281-L344 HydrophobicContact CG1-CD1 4.17Å; V281-L344 HydrophobicContact CG2-CD1 3.92Å; F289-L344 HydrophobicContact CE2-CD1 3.89Å; F289-L344 HydrophobicContact CE2-CD2 3.82Å; F289-L344 HydrophobicContact CZ-CD2 3.88Å; P341-L344 WeakPolarHBondContact O-CB 3.49Å; P341-L344 PolarHBondContact O-N 3.13Å; E342-L344 PolarHBondContact O-N 3.08Å
345	G	89.7	Confident	88.9	Confident	2 Å²	2	51.7 Å²	51.7	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	165.4	165.7	0	0	0	0	0	111.4	F229 V230 C328	F229-G345 CarbonylContact C-O 3.36Å; F229-G345 WeakPolarHBondContact CA-O 3.23Å; V230-G345 PolarHBondContact N-O 3.42Å; V230-G345 PolarHBondContact O-N 3.5Å; C328-G345 VanDerWaalsContact O-CA 3.31Å; C328-G345 WeakPolarHBondContact O-CA 3.39Å
346	Q	90.1	Very high	88.8	Confident	88 Å²	88	53.1 Å²	53.1	41%	0.411	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.1	175.4	-166.4	179.3	5.6	0	0	111.5	D227 C328	D227-Q346 PolarHBondContact OD1-NE2 2.94Å; C328-Q346 PolarHBondContact O-N 2.96Å
347	A	90.8	Very high	88.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	129.3	174.1	0	0	0	0	0	110.6	A228 V230 L349 V350 I363	A228-A347 PolarHBondContact N-O 3.24Å; A228-A347 PolarHBondContact O-N 2.99Å; V230-A347 HydrophobicContact CG2-CB 3.82Å; A347-L349 PolarHBondContact O-N 2.86Å; A347-V350 HydrophobicContact CB-CG2 3.98Å; A347-I363 HydrophobicContact CB-CG2 3.6Å
348	G	89.5	Confident	89.1	Confident	25 Å²	25	59.9 Å²	59.9	26%	0.258	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-28.5	-176.5	0	0	0	0	0	114.1	D227 E364 K365	D227-G348 PolarHBondContact N-O 3.15Å; G348-E364 PolarHBondContact N-O 3.45Å; G348-K365 PolarHBondContact N-O 3.27Å
349	L	92.7	Very high	89.5	Confident	19 Å²	19	57 Å²	57	10%	0.099	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	126.8	177.3	-179.2	68.1	0	0	0	110.6	R224 E226 A347 Y351 E364	R224-L349 HydrophobicContact CG-CD1 4.13Å; E226-L349 HydrophobicContact CG-CD1 3.99Å; A347-L349 PolarHBondContact O-N 2.86Å; L349-Y351 HydrophobicContact CD2-CD1 3.84Å; L349-Y351 HydrophobicContact CD2-CE1 4.1Å; L349-Y351 HydrophobicContact CG-CD1 3.95Å; L349-E364 HydrophobicContact CB-CB 4.45Å; L349-E364 PolarHBondContact N-O 3.41Å; L349-E364 PolarHBondContact O-N 3.2Å
350	V	93.6	Very high	89.9	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.1	169.7	-177.3	0	0	0	0	108.9	V225 A228 V290 A347 T361 F362 I363	V225-V350 HydrophobicContact CB-CB 4.44Å; V225-V350 PolarHBondContact N-O 2.98Å; V225-V350 PolarHBondContact O-N 3.33Å; A228-V350 HydrophobicContact CB-CG2 3.9Å; V290-V350 HydrophobicContact CG1-CG1 4.48Å; V290-V350 HydrophobicContact CG2-CB 4.18Å; V290-V350 HydrophobicContact CG2-CG1 4.12Å; V290-V350 HydrophobicContact CG2-CG2 4.21Å; A347-V350 HydrophobicContact CB-CG2 3.98Å; V350-T361 HydrophobicContact CG1-CG2 3.79Å; V350-F362 CarbonylContact C-O 3.53Å; V350-F362 VanDerWaalsContact CA-O 3.25Å; V350-F362 WeakPolarHBondContact CA-O 3.25Å; V350-I363 HydrophobicContact CG1-CG1 4.16Å; V350-I363 HydrophobicContact CG2-CB 4.48Å; V350-I363 HydrophobicContact CG2-CG1 4.15Å; V350-I363 HydrophobicContact CG2-CG2 4.2Å
351	Y	94.3	Very high	90.3	Very high	65 Å²	65	53.6 Å²	53.6	26%	0.255	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	149.9	177.5	72.2	-84.9	0	0	0	112.6	K223 L349 H353 T361 F362 E364	K223-Y351 CarbonylContact O-C 3.55Å; K223-Y351 VanDerWaalsContact O-CA 3.3Å; K223-Y351 WeakPolarHBondContact O-CA 3.41Å; L349-Y351 HydrophobicContact CD2-CD1 3.84Å; L349-Y351 HydrophobicContact CD2-CE1 4.1Å; L349-Y351 HydrophobicContact CG-CD1 3.95Å; Y351-H353 HydrophobicContact CE2-CB 4.17Å; Y351-T361 WeakPolarHBondContact O-CA 3.48Å; Y351-F362 HydrophobicContact CD1-CB 3.76Å; Y351-F362 HydrophobicContact CD2-CB 4.38Å; Y351-F362 HydrophobicContact CD2-CD2 4.37Å; Y351-F362 HydrophobicContact CE1-CB 3.37Å; Y351-F362 HydrophobicContact CE1-CD1 4.38Å; Y351-F362 AromaticContact CE1-CG 3.92Å; Y351-F362 HydrophobicContact CE1-CG 3.92Å; Y351-F362 HydrophobicContact CE2-CB 4.03Å; Y351-F362 AromaticContact CE2-CD2 3.78Å; Y351-F362 HydrophobicContact CE2-CD2 3.78Å; Y351-F362 HydrophobicContact CE2-CE2 4.45Å; Y351-F362 AromaticContact CE2-CG 3.86Å; Y351-F362 HydrophobicContact CE2-CG 3.86Å; Y351-F362 HydrophobicContact CG-CB 4.26Å; Y351-F362 AromaticContact CZ-CD1 3.85Å; Y351-F362 AromaticContact CZ-CD2 3.93Å; Y351-F362 AromaticContact CZ-CG 3.49Å; Y351-F362 VanDerWaalsContact CZ-CG 3.49Å; Y351-F362 PolarHBondContact N-O 2.86Å; Y351-F362 PolarHBondContact O-N 2.82Å; Y351-F362 WeakPolarHBondContact OH-CD1 3.41Å; Y351-F362 WeakPolarHBondContact OH-CG 3.47Å; Y351-E364 HydrophobicContact CE1-CG 4.34Å
352	E	93	Very high	90.7	Very high	24 Å²	24	50.2 Å²	50.2	11%	0.112	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.4	173.4	-173.2	-177.3	133.9	0	0	109.6	A216 K223 T354 K359 Y360	A216-E352 WeakPolarHBondContact CB-OE2 3.39Å; A216-E352 PolarHBondContact N-OE2 2.89Å; K223-E352 PolarHBondContact O-N 2.6Å; E352-T354 PolarHBondContact OE1-OG1 2.92Å; E352-K359 HydrophobicContact CG-CB 4.33Å; E352-K359 WeakPolarHBondContact OE1-CD 3.34Å; E352-K359 WeakPolarHBondContact OE1-CE 3.36Å; E352-K359 VanDerWaalsContact OE1-CG 3.27Å; E352-K359 WeakPolarHBondContact OE1-CG 3.47Å; E352-K359 IonicContact OE1-NZ 3.5Å; E352-K359 PolarHBondContact OE1-NZ 3.44Å; E352-K359 IonicContact OE2-NZ 3.32Å; E352-Y360 CarbonylContact C-O 3.5Å; E352-Y360 WeakPolarHBondContact CA-O 3.17Å
353	H	92.1	Very high	91	Very high	76 Å²	76	42 Å²	42	35%	0.352	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	114	169.2	-174.1	-133.7	0	0	0	109	M196 Y351 Y360 F362	M196-H353 WeakPolarHBondContact CE-ND1 3.42Å; Y351-H353 HydrophobicContact CE2-CB 4.17Å; H353-Y360 PolarHBondContact N-O 2.9Å; H353-Y360 PolarHBondContact O-N 2.7Å; H353-F362 HydrophobicContact CB-CD2 3.99Å; H353-F362 HydrophobicContact CB-CE2 3.59Å
354	T	90.8	Very high	91.2	Very high	63 Å²	63	43.7 Å²	43.7	39%	0.387	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.4	177.4	-44.8	0	0	0	0	109.5	E352 E358 K359	E352-T354 PolarHBondContact OE1-OG1 2.92Å; T354-E358 WeakPolarHBondContact CA-O 3.27Å; T354-K359 HydrophobicContact CG2-CG 3.94Å
355	L	88.3	Confident	91.1	Very high	47 Å²	47	50.2 Å²	50.2	25%	0.246	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	106.9	174.9	-164	95.8	0	0	0	109.6	M196 K197 E357 E358	M196-L355 HydrophobicContact CE-CB 3.54Å; M196-L355 HydrophobicContact CE-CD1 3.96Å; M196-L355 HydrophobicContact CE-CD2 3.82Å; M196-L355 HydrophobicContact CE-CG 3.96Å; K197-L355 WeakPolarHBondContact O-CD2 3.46Å; L355-E357 PolarHBondContact O-N 2.96Å; L355-E358 PolarHBondContact N-O 2.82Å; L355-E358 PolarHBondContact O-N 2.86Å; L355-E358 VanDerWaalsContact O-N 3.11Å
356	G	86.3	Confident	90.8	Very high	74 Å²	74	50.6 Å²	50.6	76%	0.763	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	-120.4	-170.9	0	0	0	0	0	110.7
357	E	87.1	Confident	89.9	Confident	197 Å²	197	49.4 Å²	49.4	92%	0.921	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-14	176.2	-61.4	-174.4	172.5	0	0	113.2	L355	L355-E357 PolarHBondContact O-N 2.96Å
358	E	89.3	Confident	89.3	Confident	93 Å²	93	54.7 Å²	54.7	44%	0.435	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	141.3	-178.6	-67.4	-179.6	171.7	0	0	110.5	T354 L355 Y360	T354-E358 WeakPolarHBondContact CA-O 3.27Å; L355-E358 PolarHBondContact N-O 2.82Å; L355-E358 PolarHBondContact O-N 2.86Å; L355-E358 VanDerWaalsContact O-N 3.11Å; E358-Y360 HydrophobicContact CB-CE2 3.99Å; E358-Y360 PolarHBondContact OE2-OH 3.48Å
359	K	91.8	Very high	88.7	Confident	56 Å²	56	55.1 Å²	55.1	24%	0.243	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.1	-179.4	-68.1	171.9	163.5	-122.7	0	108.9	D213 H214 G215 A216 E352 T354	D213-K359 CarbonylContact C-O 3.41Å; D213-K359 VanDerWaalsContact C-O 3.28Å; D213-K359 VanDerWaalsContact O-O 3.1Å; H214-K359 CarbonylContact C-O 3.53Å; H214-K359 WeakPolarHBondContact CA-O 3.34Å; H214-K359 PolarHBondContact N-O 3.12Å; G215-K359 PolarHBondContact N-O 3.48Å; A216-K359 PolarHBondContact O-NZ 2.71Å; E352-K359 HydrophobicContact CG-CB 4.33Å; E352-K359 WeakPolarHBondContact OE1-CD 3.34Å; E352-K359 WeakPolarHBondContact OE1-CE 3.36Å; E352-K359 VanDerWaalsContact OE1-CG 3.27Å; E352-K359 WeakPolarHBondContact OE1-CG 3.47Å; E352-K359 IonicContact OE1-NZ 3.5Å; E352-K359 PolarHBondContact OE1-NZ 3.44Å; E352-K359 IonicContact OE2-NZ 3.32Å; T354-K359 HydrophobicContact CG2-CG 3.94Å
360	Y	93.9	Very high	88.3	Confident	13 Å²	13	59.6 Å²	59.6	5%	0.051	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.4	177.2	-66.5	-89.4	0	0	0	109.5	M194 E195 M196 V211 L212 E352 H353 E358	M194-Y360 HydrophobicContact CG-CE1 4.42Å; M194-Y360 HydrophobicContact SD-CE1 4.32Å; E195-Y360 PolarHBondContact O-OH 3.18Å; M196-Y360 HydrophobicContact CB-CE1 4.5Å; M196-Y360 HydrophobicContact CE-CD2 3.78Å; M196-Y360 HydrophobicContact CE-CE2 3.9Å; M196-Y360 HydrophobicContact CG-CD2 4.47Å; M196-Y360 HydrophobicContact CG-CE2 3.91Å; M196-Y360 HydrophobicContact SD-CD2 4.25Å; M196-Y360 HydrophobicContact SD-CE2 4.28Å; V211-Y360 HydrophobicContact CG1-CD1 4.23Å; L212-Y360 VanDerWaalsContact O-CA 3.29Å; L212-Y360 WeakPolarHBondContact O-CA 3.44Å; E352-Y360 CarbonylContact C-O 3.5Å; E352-Y360 WeakPolarHBondContact CA-O 3.17Å; H353-Y360 PolarHBondContact N-O 2.9Å; H353-Y360 PolarHBondContact O-N 2.7Å; E358-Y360 HydrophobicContact CB-CE2 3.99Å; E358-Y360 PolarHBondContact OE2-OH 3.48Å
361	T	94.3	Very high	88.1	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.2	174.9	-51.6	0	0	0	0	109.4	V211 L212 H214 G215 L313 V350 Y351	V211-T361 WeakPolarHBondContact CA-O 3.38Å; L212-T361 PolarHBondContact N-O 3.07Å; L212-T361 PolarHBondContact O-N 2.97Å; H214-T361 PolarHBondContact O-OG1 3.18Å; G215-T361 VanDerWaalsContact CA-OG1 3.31Å; G215-T361 WeakPolarHBondContact CA-OG1 3.35Å; L313-T361 HydrophobicContact CD1-CG2 4.4Å; L313-T361 HydrophobicContact CD2-CG2 4.24Å; V350-T361 HydrophobicContact CG1-CG2 3.79Å; Y351-T361 WeakPolarHBondContact O-CA 3.48Å
362	F	95	Very high	88.1	Confident	7 Å²	7	56.3 Å²	56.3	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.3	179.5	-70.3	-108	0	0	0	108.2	I207 V211 V350 Y351 H353 E364 L375	I207-F362 HydrophobicContact CD1-CD1 3.66Å; I207-F362 HydrophobicContact CD1-CE1 3.45Å; I207-F362 VanDerWaalsContact CD1-CE1 3.45Å; V211-F362 HydrophobicContact CG1-CE1 4.39Å; V211-F362 HydrophobicContact CG1-CE2 4.31Å; V211-F362 HydrophobicContact CG1-CZ 4.22Å; V211-F362 HydrophobicContact CG2-CD1 3.89Å; V211-F362 HydrophobicContact CG2-CE1 3.94Å; V211-F362 HydrophobicContact CG2-CG 4.5Å; V350-F362 CarbonylContact C-O 3.53Å; V350-F362 VanDerWaalsContact CA-O 3.25Å; V350-F362 WeakPolarHBondContact CA-O 3.25Å; Y351-F362 HydrophobicContact CD1-CB 3.76Å; Y351-F362 HydrophobicContact CD2-CB 4.38Å; Y351-F362 HydrophobicContact CD2-CD2 4.37Å; Y351-F362 HydrophobicContact CE1-CB 3.37Å; Y351-F362 HydrophobicContact CE1-CD1 4.38Å; Y351-F362 AromaticContact CE1-CG 3.92Å; Y351-F362 HydrophobicContact CE1-CG 3.92Å; Y351-F362 HydrophobicContact CE2-CB 4.03Å; Y351-F362 AromaticContact CE2-CD2 3.78Å; Y351-F362 HydrophobicContact CE2-CD2 3.78Å; Y351-F362 HydrophobicContact CE2-CE2 4.45Å; Y351-F362 AromaticContact CE2-CG 3.86Å; Y351-F362 HydrophobicContact CE2-CG 3.86Å; Y351-F362 HydrophobicContact CG-CB 4.26Å; Y351-F362 AromaticContact CZ-CD1 3.85Å; Y351-F362 AromaticContact CZ-CD2 3.93Å; Y351-F362 AromaticContact CZ-CG 3.49Å; Y351-F362 VanDerWaalsContact CZ-CG 3.49Å; Y351-F362 PolarHBondContact N-O 2.86Å; Y351-F362 PolarHBondContact O-N 2.82Å; Y351-F362 WeakPolarHBondContact OH-CD1 3.41Å; Y351-F362 WeakPolarHBondContact OH-CG 3.47Å; H353-F362 HydrophobicContact CB-CD2 3.99Å; H353-F362 HydrophobicContact CB-CE2 3.59Å; F362-E364 HydrophobicContact CB-CG 4.36Å; F362-L375 HydrophobicContact CE1-CD2 3.64Å; F362-L375 HydrophobicContact CZ-CD2 3.69Å
363	I	93.1	Very high	88.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	107.4	172.8	-59.1	168.8	0	0	0	105.7	G209 L210 L212 L292 L324 A347 V350	G209-I363 CarbonylContact C-O 3.55Å; G209-I363 VanDerWaalsContact CA-O 3.29Å; G209-I363 WeakPolarHBondContact CA-O 3.36Å; L210-I363 PolarHBondContact N-O 3.48Å; L210-I363 WeakPolarHBondContact O-CB 3.28Å; L210-I363 PolarHBondContact O-N 3.03Å; L212-I363 HydrophobicContact CD1-CD1 3.99Å; L292-I363 HydrophobicContact CD1-CD1 3.74Å; L324-I363 HydrophobicContact CD2-CD1 3.52Å; A347-I363 HydrophobicContact CB-CG2 3.6Å; V350-I363 HydrophobicContact CG1-CG1 4.16Å; V350-I363 HydrophobicContact CG2-CB 4.48Å; V350-I363 HydrophobicContact CG2-CG1 4.15Å; V350-I363 HydrophobicContact CG2-CG2 4.2Å
364	E	90.8	Very high	88.3	Confident	46 Å²	46	51.7 Å²	51.7	22%	0.215	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	165.1	-173.4	-56.1	-168.1	157.7	0	0	111.6	I207 G348 L349 Y351 F362 C366	I207-E364 HydrophobicContact CG2-CG 3.92Å; G348-E364 PolarHBondContact N-O 3.45Å; L349-E364 HydrophobicContact CB-CB 4.45Å; L349-E364 PolarHBondContact N-O 3.41Å; L349-E364 PolarHBondContact O-N 3.2Å; Y351-E364 HydrophobicContact CE1-CG 4.34Å; F362-E364 HydrophobicContact CB-CG 4.36Å; E364-C366 VanDerWaalsContact C-N 3.28Å; E364-C366 PolarHBondContact O-N 2.9Å
365	K	86.8	Confident	88.5	Confident	154 Å²	154	48.7 Å²	48.7	67%	0.67	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	55.4	44.6	179.7	-56.4	179.7	-179	179.7	0	111.6	G348	G348-K365 PolarHBondContact N-O 3.27Å
366	C	83.9	Confident	88.8	Confident	10 Å²	10	46.4 Å²	46.4	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	149.8	172.1	-47.8	0	0	0	0	109.8	A327 E364 N368	A327-C366 HydrophobicContact CB-CB 4.47Å; A327-C366 WeakPolarHBondContact O-CB 3.46Å; E364-C366 VanDerWaalsContact C-N 3.28Å; E364-C366 PolarHBondContact O-N 2.9Å; C366-N368 PolarHBondContact O-N 3.21Å
367	G	71.8	Confident	89.1	Confident	62 Å²	62	44.3 Å²	44.3	64%	0.639	22%	0.222	S	C	*	.	S	Bend	trans	-59.2	-44.9	-174.4	0	0	0	0	0	113.5
368	N	77.9	Confident	89.3	Confident	112 Å²	112	34.9 Å²	34.9	60%	0.599	18%	0.178	S	C	*	.	S	Bend	trans	-135.3	85.5	176.3	-77.1	-35.7	0	0	0	109.3	L326 A327 C366 R370	L326-N368 VanDerWaalsContact O-O 3.08Å; A327-N368 CarbonylContact O-C 2.89Å; A327-N368 VanDerWaalsContact O-O 3.12Å; C366-N368 PolarHBondContact O-N 3.21Å; N368-R370 PolarHBondContact O-N 3.08Å
369	P	75.9	Confident	89.4	Confident	33 Å²	33	33 Å²	33	21%	0.214	17%	0.174	C	C	.	.			trans	-73.8	75.2	-175.1	31.5	-34.2	0	0	0	110.8	R208 S371	R208-P369 HydrophobicContact CB-CB 4.35Å; R208-P369 HydrophobicContact CB-CG 4.24Å; P369-S371 PolarHBondContact O-N 3.03Å
370	R	85.1	Confident	89.3	Confident	113 Å²	113	35 Å²	35	43%	0.426	19%	0.187	S	C	.	.	S	Bend	trans	-74.2	-10.5	173.3	-68.1	165.8	167.3	-157.6	5	112.5	L326 N368	L326-R370 HydrophobicContact CB-CB 4.21Å; N368-R370 PolarHBondContact O-N 3.08Å
371	S	89.7	Confident	89.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-125.8	134.4	166.6	178.6	0	0	0	0	107.9	M190 R323 P369	M190-S371 VanDerWaalsContact O-CA 3.31Å; M190-S371 WeakPolarHBondContact O-CA 3.13Å; M190-S371 WeakPolarHBondContact O-CB 3.37Å; M190-S371 PolarHBondContact O-OG 2.95Å; R323-S371 WeakPolarHBondContact CB-OG 3.27Å; R323-S371 WeakPolarHBondContact CG-OG 3.37Å; P369-S371 PolarHBondContact O-N 3.03Å
372	V	93.3	Very high	88.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	157.6	-176.5	-65.3	0	0	0	0	109.4	A175 A178 I179 M190 V191 E192 L206 G209	A175-V372 HydrophobicContact CB-CG2 3.87Å; A178-V372 HydrophobicContact CB-CG1 3.68Å; I179-V372 HydrophobicContact CD1-CG2 4.05Å; I179-V372 HydrophobicContact CG1-CG2 4.43Å; M190-V372 PolarHBondContact O-N 3.5Å; V191-V372 WeakPolarHBondContact CA-O 3.16Å; V191-V372 HydrophobicContact CG1-CG2 4.41Å; V191-V372 HydrophobicContact CG2-CG2 4.26Å; E192-V372 PolarHBondContact N-O 3.27Å; L206-V372 HydrophobicContact CD1-CB 4.02Å; L206-V372 HydrophobicContact CD1-CG2 4.18Å; G209-V372 CarbonylContact O-C 3.57Å; G209-V372 WeakPolarHBondContact O-CA 3.32Å
373	T	94.8	Very high	88.5	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.9	177.3	-53	0	0	0	0	110.4	E192 M194 I207 G209 L210 V211	E192-T373 HydrophobicContact CB-CG2 4.16Å; E192-T373 HydrophobicContact CG-CG2 4.25Å; E192-T373 CarbonylContact O-C 3.58Å; E192-T373 VanDerWaalsContact O-CA 3.27Å; E192-T373 WeakPolarHBondContact O-CA 3.14Å; M194-T373 HydrophobicContact CB-CG2 3.81Å; I207-T373 PolarHBondContact N-O 3.46Å; I207-T373 PolarHBondContact O-N 3.04Å; G209-T373 PolarHBondContact O-N 3.36Å; G209-T373 VanDerWaalsContact O-N 3.08Å; G209-T373 PolarHBondContact O-OG1 3.26Å; L210-T373 VanDerWaalsContact CA-OG1 3.31Å; L210-T373 WeakPolarHBondContact CA-OG1 3.5Å; V211-T373 HydrophobicContact CB-CG2 3.94Å; V211-T373 HydrophobicContact CG2-CG2 3.87Å; V211-T373 PolarHBondContact N-OG1 3.39Å
374	L	95	Very high	88.5	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	106.3	164	-74.4	171.5	0	0	0	108.2	A171 V172 A175 V191 E192 I193 M194 L206 V376 V391 L395	A171-L374 HydrophobicContact CB-CD2 3.7Å; V172-L374 HydrophobicContact CG2-CD1 4.45Å; A175-L374 HydrophobicContact CB-CD1 4.12Å; A175-L374 HydrophobicContact CB-CD2 4.43Å; A175-L374 HydrophobicContact CB-CG 4.25Å; V191-L374 HydrophobicContact CG1-CD1 3.82Å; V191-L374 HydrophobicContact CG1-CG 4.07Å; E192-L374 PolarHBondContact O-N 3.02Å; I193-L374 WeakPolarHBondContact CA-O 3.38Å; M194-L374 PolarHBondContact N-O 2.91Å; L206-L374 HydrophobicContact CB-CD2 4.03Å; L206-L374 HydrophobicContact CD1-CD2 3.74Å; L206-L374 HydrophobicContact CD1-CG 4.18Å; L206-L374 HydrophobicContact CG-CD2 4.47Å; L374-V376 PolarHBondContact O-N 3.08Å; L374-V391 HydrophobicContact CD1-CG1 3.5Å; L374-L395 HydrophobicContact CD1-CD1 4.16Å; L374-L395 HydrophobicContact CD1-CD2 4.17Å; L374-L395 HydrophobicContact CD1-CG 4.44Å
375	L	94.8	Very high	88.5	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	99.1	176.6	179.3	66.9	0	0	0	109.3	M194 M196 T204 Q205 I207 F362 K377	M194-L375 HydrophobicContact CB-CD1 3.98Å; M194-L375 HydrophobicContact CG-CD1 3.86Å; M194-L375 CarbonylContact O-C 3.57Å; M196-L375 HydrophobicContact CB-CD1 3.81Å; M196-L375 HydrophobicContact SD-CD2 4.33Å; T204-L375 WeakPolarHBondContact CA-O 2.97Å; T204-L375 WeakPolarHBondContact CG2-O 3.29Å; Q205-L375 PolarHBondContact N-O 3.25Å; Q205-L375 VanDerWaalsContact N-O 3.13Å; Q205-L375 PolarHBondContact O-N 2.86Å; I207-L375 HydrophobicContact CD1-CB 3.68Å; I207-L375 HydrophobicContact CD1-CD2 3.9Å; I207-L375 HydrophobicContact CD1-CG 4.41Å; F362-L375 HydrophobicContact CE1-CD2 3.64Å; F362-L375 HydrophobicContact CZ-CD2 3.69Å; L375-K377 HydrophobicContact CG-CG 4.45Å
376	V	94.6	Very high	88.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	119.7	175.4	179.3	0	0	0	0	109.2	I193 M194 E195 M196 T204 L374 L384 I387	I193-V376 HydrophobicContact CG2-CG2 3.81Å; M194-V376 PolarHBondContact O-N 2.98Å; E195-V376 WeakPolarHBondContact CA-O 3.31Å; M196-V376 PolarHBondContact N-O 2.89Å; T204-V376 HydrophobicContact CG2-CG2 4.27Å; L374-V376 PolarHBondContact O-N 3.08Å; V376-L384 HydrophobicContact CG1-CD2 3.93Å; V376-I387 HydrophobicContact CB-CG2 4.46Å; V376-I387 HydrophobicContact CG1-CB 3.75Å; V376-I387 HydrophobicContact CG1-CD1 4.39Å; V376-I387 HydrophobicContact CG1-CG2 3.44Å; V376-I387 VanDerWaalsContact CG1-CG2 3.44Å; V376-I387 HydrophobicContact CG2-CG2 4.18Å
377	K	92.5	Very high	89	Confident	29 Å²	29	35.9 Å²	35.9	13%	0.126	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	152.2	172.8	-70	-178.1	-163.7	148.4	0	110.3	M196 H198 D201 D203 T204 L375 L384	M196-K377 HydrophobicContact CB-CG 4.16Å; M196-K377 HydrophobicContact CG-CG 4.5Å; M196-K377 VanDerWaalsContact O-CA 3.3Å; M196-K377 WeakPolarHBondContact O-CA 3.07Å; H198-K377 HydrophobicContact CB-CB 4.09Å; H198-K377 HydrophobicContact CB-CD 4.18Å; H198-K377 HydrophobicContact CB-CG 4.27Å; D201-K377 WeakPolarHBondContact CA-O 3.48Å; D203-K377 HydrophobicContact CB-CD 3.83Å; D203-K377 WeakPolarHBondContact O-CD 3.43Å; D203-K377 PolarHBondContact O-NZ 3.41Å; D203-K377 VanDerWaalsContact O-NZ 3.15Å; T204-K377 PolarHBondContact OG1-N 2.86Å; L375-K377 HydrophobicContact CG-CG 4.45Å; K377-L384 VanDerWaalsContact C-CD2 3.48Å
378	G	91.4	Very high	90	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	152.3	176.5	0	0	0	0	0	113.8	M196 K197 H198 L384	M196-G378 PolarHBondContact O-N 3.25Å; K197-G378 WeakPolarHBondContact CA-O 3.42Å; H198-G378 PolarHBondContact N-O 3.46Å; H198-G378 CarbonylContact O-C 3.59Å; G378-L384 VanDerWaalsContact N-CD2 3.31Å
379	P	91.3	Very high	90.6	Very high	54 Å²	54	31.7 Å²	31.7	35%	0.351	16%	0.156	S	C	.	.	S	Bend	trans	-69.6	-39.6	-173.3	23.7	-32.3	0	0	0	113	H198	H198-P379 WeakPolarHBondContact O-CA 3.31Å
380	N	90.4	Very high	91.3	Very high	97 Å²	97	30.1 Å²	30.1	52%	0.519	15%	0.146	S	C	.	.	S	Bend	trans	-119.5	154.1	-171.2	-62.4	-39.5	0	0	0	110.5	H382 T383 L384	N380-H382 VanDerWaalsContact C-N 3.26Å; N380-H382 PolarHBondContact O-N 3.47Å; N380-T383 HydrophobicContact CB-CG2 4.37Å; N380-T383 PolarHBondContact N-OG1 3.24Å; N380-T383 PolarHBondContact O-N 3.21Å; N380-T383 PolarHBondContact O-OG1 3.29Å; N380-L384 WeakPolarHBondContact O-CG 3.35Å; N380-L384 PolarHBondContact O-N 2.83Å; N380-L384 VanDerWaalsContact O-N 3.08Å
381	K	89	Confident	91.7	Very high	108 Å²	108	24.8 Å²	24.8	47%	0.47	13%	0.126	S	C	.	.	H	α-helix	trans	-59.2	-40.6	175.7	-171.9	-173.7	173.2	-158	0	111.3	D53 L384 T385	D53-K381 IonicContact OD2-NZ 2.68Å; K381-L384 WeakPolarHBondContact O-CB 3.29Å; K381-L384 PolarHBondContact O-N 2.88Å; K381-T385 WeakPolarHBondContact O-CG2 3.34Å; K381-T385 PolarHBondContact O-N 3.35Å; K381-T385 PolarHBondContact O-OG1 3.49Å
382	H	87.8	Confident	91.9	Very high	51 Å²	51	30.4 Å²	30.4	24%	0.236	15%	0.147	C	C	.	.	H	α-helix	trans	-69.2	-35.4	-177.2	-45.6	-53	0	0	0	112.8	D53 I54 L56 N380 T385 Q386	D53-H382 IonicContact OD1-CE1 2.74Å; I54-H382 PolarHBondContact O-CE1 2.94Å; I54-H382 PolarHBondContact O-ND1 3.43Å; L56-H382 HydrophobicContact CD1-CB 4.47Å; N380-H382 VanDerWaalsContact C-N 3.26Å; N380-H382 PolarHBondContact O-N 3.47Å; H382-T385 WeakPolarHBondContact CA-OG1 3.14Å; H382-T385 PolarHBondContact O-OG1 3.41Å; H382-Q386 WeakPolarHBondContact O-CB 3.36Å; H382-Q386 PolarHBondContact O-N 3.03Å
383	T	89.5	Confident	91.8	Very high	31 Å²	31	30.6 Å²	30.6	19%	0.19	15%	0.148	C	C	.	.	H	α-helix	trans	-69.6	-40.6	174.2	52.2	0	0	0	0	110.7	N380 T385 Q386 I387	N380-T383 HydrophobicContact CB-CG2 4.37Å; N380-T383 PolarHBondContact N-OG1 3.24Å; N380-T383 PolarHBondContact O-N 3.21Å; N380-T383 PolarHBondContact O-OG1 3.29Å; T383-T385 PolarHBondContact O-N 2.92Å; T383-Q386 PolarHBondContact O-N 3.48Å; T383-I387 VanDerWaalsContact O-CG1 3.28Å; T383-I387 WeakPolarHBondContact O-CG1 3.43Å; T383-I387 PolarHBondContact O-N 3.48Å
384	L	92.1	Very high	91.8	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-60	-46.4	174.9	-74.3	169.2	0	0	0	111.9	E195 K197 V376 K377 G378 N380 K381 Q386 I387 K388	E195-L384 HydrophobicContact CB-CD2 4.47Å; K197-L384 HydrophobicContact CG-CD1 3.75Å; V376-L384 HydrophobicContact CG1-CD2 3.93Å; K377-L384 VanDerWaalsContact C-CD2 3.48Å; G378-L384 VanDerWaalsContact N-CD2 3.31Å; N380-L384 WeakPolarHBondContact O-CG 3.35Å; N380-L384 PolarHBondContact O-N 2.83Å; N380-L384 VanDerWaalsContact O-N 3.08Å; K381-L384 WeakPolarHBondContact O-CB 3.29Å; K381-L384 PolarHBondContact O-N 2.88Å; L384-Q386 VanDerWaalsContact C-N 3.34Å; L384-Q386 PolarHBondContact O-N 2.96Å; L384-I387 PolarHBondContact O-N 3.03Å; L384-K388 VanDerWaalsContact O-CB 3.27Å; L384-K388 WeakPolarHBondContact O-CB 3.39Å; L384-K388 PolarHBondContact O-N 3.35Å
385	T	90.5	Very high	91.7	Very high	31 Å²	31	30.8 Å²	30.8	19%	0.19	15%	0.149	C	C	.	.	H	α-helix	trans	-63.3	-41	177.5	50.7	0	0	0	0	111.8	K381 H382 T383 K388 D389	K381-T385 WeakPolarHBondContact O-CG2 3.34Å; K381-T385 PolarHBondContact O-N 3.35Å; K381-T385 PolarHBondContact O-OG1 3.49Å; H382-T385 WeakPolarHBondContact CA-OG1 3.14Å; H382-T385 PolarHBondContact O-OG1 3.41Å; T383-T385 PolarHBondContact O-N 2.92Å; T385-K388 PolarHBondContact O-N 3.09Å; T385-D389 WeakPolarHBondContact O-CB 3.29Å; T385-D389 PolarHBondContact O-N 2.86Å
386	Q	89.1	Confident	91.7	Very high	24 Å²	24	33.2 Å²	33.2	11%	0.112	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-46.8	177.6	-180	-177.6	5.7	0	0	111.9	M44 K159 H382 T383 L384 K388 D389 A390	M44-Q386 PolarHBondContact SD-NE2 3.24Å; K159-Q386 PolarHBondContact O-NE2 3.05Å; H382-Q386 WeakPolarHBondContact O-CB 3.36Å; H382-Q386 PolarHBondContact O-N 3.03Å; T383-Q386 PolarHBondContact O-N 3.48Å; L384-Q386 VanDerWaalsContact C-N 3.34Å; L384-Q386 PolarHBondContact O-N 2.96Å; Q386-K388 VanDerWaalsContact C-N 3.32Å; Q386-K388 PolarHBondContact O-N 2.76Å; Q386-D389 PolarHBondContact O-N 2.77Å; Q386-A390 WeakPolarHBondContact O-CB 3.43Å; Q386-A390 PolarHBondContact O-N 2.96Å
387	I	92.4	Very high	91.6	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-40.4	179	-64.2	165.2	0	0	0	110.2	V160 L164 L168 D201 V376 T383 L384 A390 V391	V160-I387 HydrophobicContact CG1-CG1 4.41Å; L164-I387 HydrophobicContact CD2-CD1 3.78Å; L164-I387 HydrophobicContact CD2-CG1 3.84Å; L168-I387 HydrophobicContact CD1-CG2 3.88Å; L168-I387 HydrophobicContact CD2-CG2 4.29Å; D201-I387 HydrophobicContact CB-CD1 3.87Å; V376-I387 HydrophobicContact CB-CG2 4.46Å; V376-I387 HydrophobicContact CG1-CB 3.75Å; V376-I387 HydrophobicContact CG1-CD1 4.39Å; V376-I387 HydrophobicContact CG1-CG2 3.44Å; V376-I387 VanDerWaalsContact CG1-CG2 3.44Å; V376-I387 HydrophobicContact CG2-CG2 4.18Å; T383-I387 VanDerWaalsContact O-CG1 3.28Å; T383-I387 WeakPolarHBondContact O-CG1 3.43Å; T383-I387 PolarHBondContact O-N 3.48Å; L384-I387 PolarHBondContact O-N 3.03Å; I387-A390 PolarHBondContact O-N 3.5Å; I387-V391 HydrophobicContact CG2-CG2 4.15Å; I387-V391 WeakPolarHBondContact O-CB 3.48Å; I387-V391 VanDerWaalsContact O-CG2 3.25Å; I387-V391 WeakPolarHBondContact O-CG2 3.27Å; I387-V391 PolarHBondContact O-N 3.48Å
388	K	92.7	Very high	91.7	Very high	59 Å²	59	31.9 Å²	31.9	26%	0.257	15%	0.153	S	C	.	.	H	α-helix	trans	-61.2	-45.1	176.1	167.9	169.5	169.5	176.2	0	112.8	I193 E195 L384 T385 Q386 A390 V391 R392	I193-K388 HydrophobicContact CG2-CB 4.31Å; I193-K388 HydrophobicContact CG2-CD 4.32Å; I193-K388 HydrophobicContact CG2-CG 4.03Å; E195-K388 HydrophobicContact CG-CD 4.27Å; E195-K388 WeakPolarHBondContact OE1-CD 3.44Å; E195-K388 WeakPolarHBondContact OE1-CE 3.31Å; E195-K388 IonicContact OE1-NZ 3.66Å; E195-K388 PolarHBondContact OE1-NZ 3.21Å; L384-K388 VanDerWaalsContact O-CB 3.27Å; L384-K388 WeakPolarHBondContact O-CB 3.39Å; L384-K388 PolarHBondContact O-N 3.35Å; T385-K388 PolarHBondContact O-N 3.09Å; Q386-K388 VanDerWaalsContact C-N 3.32Å; Q386-K388 PolarHBondContact O-N 2.76Å; K388-A390 VanDerWaalsContact C-N 3.34Å; K388-V391 PolarHBondContact O-N 3.06Å; K388-R392 PolarHBondContact O-N 2.86Å
389	D	90.3	Very high	91.8	Very high	26 Å²	26	34.1 Å²	34.1	14%	0.139	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-43.7	177	-67.3	-20.8	0	0	0	109.7	T385 Q386 V391 R392 D393	T385-D389 WeakPolarHBondContact O-CB 3.29Å; T385-D389 PolarHBondContact O-N 2.86Å; Q386-D389 PolarHBondContact O-N 2.77Å; D389-V391 PolarHBondContact O-N 3.3Å; D389-R392 PolarHBondContact O-N 3.23Å; D389-D393 PolarHBondContact O-N 2.93Å
390	A	91.8	Very high	91.9	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-60.5	-42.9	175.1	0	0	0	0	0	113.4	L156 K159 V160 Q386 I387 K388 D393 G394	L156-A390 HydrophobicContact CD2-CB 4.22Å; L156-A390 VanDerWaalsContact CD2-O 3.31Å; L156-A390 WeakPolarHBondContact CD2-O 3.26Å; K159-A390 HydrophobicContact CB-CB 3.59Å; K159-A390 HydrophobicContact CG-CB 4.24Å; V160-A390 HydrophobicContact CG1-CB 3.71Å; Q386-A390 WeakPolarHBondContact O-CB 3.43Å; Q386-A390 PolarHBondContact O-N 2.96Å; I387-A390 PolarHBondContact O-N 3.5Å; K388-A390 VanDerWaalsContact C-N 3.34Å; A390-D393 PolarHBondContact O-N 3.26Å; A390-G394 PolarHBondContact O-N 3.13Å
391	V	94	Very high	92	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-65.4	-40.8	177.2	166.9	0	0	0	0	110.8	L168 V172 I193 L374 I387 K388 D389 G394 L395	L168-V391 HydrophobicContact CD1-CG2 4.23Å; L168-V391 HydrophobicContact CD2-CG2 4.04Å; V172-V391 HydrophobicContact CG2-CG1 4.26Å; I193-V391 HydrophobicContact CD1-CG1 3.93Å; I193-V391 HydrophobicContact CG1-CG1 4.29Å; L374-V391 HydrophobicContact CD1-CG1 3.5Å; I387-V391 HydrophobicContact CG2-CG2 4.15Å; I387-V391 WeakPolarHBondContact O-CB 3.48Å; I387-V391 VanDerWaalsContact O-CG2 3.25Å; I387-V391 WeakPolarHBondContact O-CG2 3.27Å; I387-V391 PolarHBondContact O-N 3.48Å; K388-V391 PolarHBondContact O-N 3.06Å; D389-V391 PolarHBondContact O-N 3.3Å; V391-G394 PolarHBondContact O-N 3.08Å; V391-L395 HydrophobicContact CG1-CD1 3.9Å; V391-L395 HydrophobicContact CG1-CG 4.24Å; V391-L395 WeakPolarHBondContact O-CB 3.43Å; V391-L395 WeakPolarHBondContact O-CG 2.95Å; V391-L395 PolarHBondContact O-N 3.32Å
392	R	92.6	Very high	92.1	Very high	118 Å²	118	23.9 Å²	23.9	45%	0.445	11%	0.109	S	C	.	.	H	α-helix	trans	-59.5	-47.2	175.4	172.6	-175.7	-88.9	156.1	-13.1	111.3	I193 K388 D389 L395 R396	I193-R392 HydrophobicContact CD1-CB 4.47Å; K388-R392 PolarHBondContact O-N 2.86Å; D389-R392 PolarHBondContact O-N 3.23Å; R392-L395 PolarHBondContact O-N 2.79Å; R392-R396 PolarHBondContact O-N 3.35Å
393	D	92.1	Very high	92.3	Very high	4 Å²	4	26 Å²	26	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-65.6	-43	-179.6	-64.8	-2.8	0	0	0	110.4	K159 D389 A390 L395 R396 A397	K159-D393 IonicContact NZ-OD2 2.91Å; K159-D393 PolarHBondContact NZ-OD2 2.99Å; D389-D393 PolarHBondContact O-N 2.93Å; A390-D393 PolarHBondContact O-N 3.26Å; D393-L395 PolarHBondContact O-N 3.21Å; D393-R396 PolarHBondContact O-N 3.36Å; D393-A397 WeakPolarHBondContact O-CB 3.27Å; D393-A397 PolarHBondContact O-N 3.5Å
394	G	93.2	Very high	92.3	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.7	-42.3	175	0	0	0	0	0	113.4	A390 V391 R396 A397 V398	A390-G394 PolarHBondContact O-N 3.13Å; V391-G394 PolarHBondContact O-N 3.08Å; G394-R396 VanDerWaalsContact C-N 3.35Å; G394-R396 PolarHBondContact O-N 2.81Å; G394-A397 PolarHBondContact O-N 2.85Å; G394-V398 WeakPolarHBondContact O-CG2 3.24Å; G394-V398 PolarHBondContact O-N 2.91Å
395	L	94.7	Very high	92.2	Very high	6 Å²	6	28.1 Å²	28.1	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-61.9	-42	175.2	-74.5	169.1	0	0	0	111.6	V172 A175 V176 L188 V191 I193 L374 V391 R392 D393 K399	V172-L395 HydrophobicContact CG1-CD2 3.97Å; V172-L395 HydrophobicContact CG1-CG 4.22Å; A175-L395 HydrophobicContact CB-CD2 4.25Å; V176-L395 HydrophobicContact CG2-CD2 3.57Å; L188-L395 HydrophobicContact CD2-CB 4.17Å; V191-L395 HydrophobicContact CB-CD1 4.2Å; V191-L395 HydrophobicContact CG1-CD1 3.86Å; V191-L395 HydrophobicContact CG1-CD2 4.35Å; V191-L395 HydrophobicContact CG2-CD1 4.42Å; V191-L395 HydrophobicContact CG2-CD2 4.11Å; I193-L395 HydrophobicContact CD1-CD1 4.21Å; L374-L395 HydrophobicContact CD1-CD1 4.16Å; L374-L395 HydrophobicContact CD1-CD2 4.17Å; L374-L395 HydrophobicContact CD1-CG 4.44Å; V391-L395 HydrophobicContact CG1-CD1 3.9Å; V391-L395 HydrophobicContact CG1-CG 4.24Å; V391-L395 WeakPolarHBondContact O-CB 3.43Å; V391-L395 WeakPolarHBondContact O-CG 2.95Å; V391-L395 PolarHBondContact O-N 3.32Å; R392-L395 PolarHBondContact O-N 2.79Å; D393-L395 PolarHBondContact O-N 3.21Å; L395-K399 WeakPolarHBondContact O-CB 3.32Å; L395-K399 PolarHBondContact O-N 3.1Å
396	R	93.8	Very high	92.2	Very high	51 Å²	51	26.8 Å²	26.8	19%	0.192	13%	0.128	C	C	.	.	H	α-helix	trans	-66.6	-42.7	175.7	-74.3	-178.4	173.6	170.1	-18.2	111.7	D85 G89 L188 R392 D393 G394 V398 K399 N400	D85-R396 PolarHBondContact O-NH1 2.95Å; D85-R396 VanDerWaalsContact O-NH1 3.1Å; D85-R396 IonicContact OD1-NH1 3.05Å; D85-R396 IonicContact OD2-NH1 3.57Å; D85-R396 PolarHBondContact OD2-NH1 3.33Å; G89-R396 VanDerWaalsContact CA-CD 3.4Å; L188-R396 HydrophobicContact CD1-CB 4.36Å; L188-R396 HydrophobicContact CD1-CG 3.53Å; R392-R396 PolarHBondContact O-N 3.35Å; D393-R396 PolarHBondContact O-N 3.36Å; G394-R396 VanDerWaalsContact C-N 3.35Å; G394-R396 PolarHBondContact O-N 2.81Å; R396-V398 PolarHBondContact O-N 3.11Å; R396-K399 WeakPolarHBondContact O-CB 3.15Å; R396-K399 PolarHBondContact O-N 3.4Å; R396-N400 WeakPolarHBondContact O-CB 3.48Å; R396-N400 PolarHBondContact O-N 3.28Å; R396-N400 PolarHBondContact O-ND2 3.41Å; R396-N400 PolarHBondContact O-OD1 3.33Å
397	A	93.6	Very high	92.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.5	-44.2	177.1	0	0	0	0	0	112.3	V151 D393 G394 N400 A401 N497	V151-A397 HydrophobicContact CG1-CB 4.3Å; D393-A397 WeakPolarHBondContact O-CB 3.27Å; D393-A397 PolarHBondContact O-N 3.5Å; G394-A397 PolarHBondContact O-N 2.85Å; A397-N400 PolarHBondContact O-N 3.34Å; A397-A401 PolarHBondContact O-N 3.27Å; A397-A401 VanDerWaalsContact O-N 3.09Å; A397-N497 PolarHBondContact O-ND2 3.4Å; A397-N497 PolarHBondContact O-OD1 3.39Å
398	V	94.4	Very high	92.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.4	-43.2	175.7	175.8	0	0	0	0	111.2	L148 A152 V172 V173 V176 G394 R396 N400 A401 I402	L148-V398 HydrophobicContact CB-CG1 4.43Å; L148-V398 HydrophobicContact CD2-CG1 4.18Å; A152-V398 HydrophobicContact CB-CG2 3.62Å; V172-V398 HydrophobicContact CG1-CG2 4.07Å; V173-V398 HydrophobicContact CG2-CG2 4.24Å; V176-V398 HydrophobicContact CB-CG1 3.89Å; V176-V398 HydrophobicContact CG1-CG1 3.93Å; V176-V398 HydrophobicContact CG2-CB 4.21Å; V176-V398 HydrophobicContact CG2-CG1 3.97Å; G394-V398 WeakPolarHBondContact O-CG2 3.24Å; G394-V398 PolarHBondContact O-N 2.91Å; R396-V398 PolarHBondContact O-N 3.11Å; V398-N400 VanDerWaalsContact C-N 3.34Å; V398-N400 PolarHBondContact O-N 2.82Å; V398-A401 PolarHBondContact O-N 2.82Å; V398-I402 HydrophobicContact CG1-CD1 4.14Å; V398-I402 WeakPolarHBondContact O-CG1 3.47Å; V398-I402 PolarHBondContact O-N 3.46Å; V398-I402 VanDerWaalsContact O-N 3.12Å
399	K	93.4	Very high	92.4	Very high	48 Å²	48	22.9 Å²	22.9	21%	0.209	11%	0.111	C	C	.	.	H	α-helix	trans	-55.3	-50	174.5	165.6	175.8	174.1	170.6	0	111.3	I186 L188 L395 R396 A401 I402 E403	I186-K399 HydrophobicContact CB-CD 4.21Å; I186-K399 HydrophobicContact CB-CG 4.15Å; I186-K399 HydrophobicContact CG2-CD 4.37Å; I186-K399 HydrophobicContact CG2-CG 4.4Å; I186-K399 WeakPolarHBondContact O-CE 3.44Å; I186-K399 PolarHBondContact O-NZ 3Å; L188-K399 HydrophobicContact CD1-CB 4.42Å; L188-K399 HydrophobicContact CD1-CD 3.8Å; L188-K399 HydrophobicContact CD2-CB 4.2Å; L188-K399 HydrophobicContact CD2-CD 4.23Å; L188-K399 HydrophobicContact CG-CD 3.76Å; L395-K399 WeakPolarHBondContact O-CB 3.32Å; L395-K399 PolarHBondContact O-N 3.1Å; R396-K399 WeakPolarHBondContact O-CB 3.15Å; R396-K399 PolarHBondContact O-N 3.4Å; K399-A401 VanDerWaalsContact C-N 3.27Å; K399-A401 PolarHBondContact O-N 3.4Å; K399-I402 PolarHBondContact O-N 3.48Å; K399-I402 VanDerWaalsContact O-N 3.14Å; K399-E403 WeakPolarHBondContact CE-OE1 3.37Å; K399-E403 WeakPolarHBondContact CE-OE2 3.4Å; K399-E403 HydrophobicContact CG-CG 4.41Å; K399-E403 IonicContact NZ-OE1 3.36Å; K399-E403 PolarHBondContact O-N 2.96Å
400	N	93.1	Very high	92.4	Very high	12 Å²	12	21.7 Å²	21.7	6%	0.064	10%	0.104	C	C	.	.	H	α-helix	trans	-61.6	-37.9	-178.8	-64.8	-12.7	0	0	0	111.2	T88 R396 A397 V398 I402 E403 D404 N497	T88-N400 PolarHBondContact O-ND2 3.05Å; R396-N400 WeakPolarHBondContact O-CB 3.48Å; R396-N400 PolarHBondContact O-N 3.28Å; R396-N400 PolarHBondContact O-ND2 3.41Å; R396-N400 PolarHBondContact O-OD1 3.33Å; A397-N400 PolarHBondContact O-N 3.34Å; V398-N400 VanDerWaalsContact C-N 3.34Å; V398-N400 PolarHBondContact O-N 2.82Å; N400-I402 VanDerWaalsContact C-N 3.34Å; N400-I402 PolarHBondContact O-N 2.91Å; N400-E403 PolarHBondContact O-N 2.74Å; N400-D404 WeakPolarHBondContact O-CB 3.3Å; N400-D404 PolarHBondContact O-N 2.89Å; N400-N497 HydrophobicContact CB-CB 4.29Å
401	A	92.3	Very high	92.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.4	-42	176.2	0	0	0	0	0	111.8	M143 L148 V151 A397 V398 K399 G405 V407 N497	M143-A401 VanDerWaalsContact CE-O 3.31Å; M143-A401 WeakPolarHBondContact CE-O 3.33Å; M143-A401 HydrophobicContact SD-CB 4.22Å; L148-A401 HydrophobicContact CD2-CB 4.05Å; V151-A401 HydrophobicContact CG1-CB 4.26Å; V151-A401 HydrophobicContact CG2-CB 4.32Å; A397-A401 PolarHBondContact O-N 3.27Å; A397-A401 VanDerWaalsContact O-N 3.09Å; V398-A401 PolarHBondContact O-N 2.82Å; K399-A401 VanDerWaalsContact C-N 3.27Å; K399-A401 PolarHBondContact O-N 3.4Å; A401-G405 PolarHBondContact O-N 2.87Å; A401-G405 VanDerWaalsContact O-N 3.14Å; A401-V407 HydrophobicContact CB-CG1 4.43Å; A401-N497 PolarHBondContact N-ND2 3.3Å; A401-N497 VanDerWaalsContact N-ND2 3.13Å
402	I	91.8	Very high	92.2	Very high	31 Å²	31	22.4 Å²	22.4	16%	0.159	11%	0.111	C	C	.	.	H	α-helix	trans	-68.6	-41.8	178.3	-61.7	167.5	0	0	0	111.4	L148 V176 I186 V398 K399 N400	L148-I402 HydrophobicContact CD1-CD1 4.1Å; L148-I402 HydrophobicContact CD1-CG1 4.15Å; L148-I402 HydrophobicContact CD2-CD1 4.47Å; L148-I402 HydrophobicContact CD2-CG1 3.85Å; V176-I402 HydrophobicContact CG1-CD1 3.57Å; I186-I402 HydrophobicContact CD1-CB 3.87Å; I186-I402 HydrophobicContact CD1-CD1 3.82Å; I186-I402 HydrophobicContact CD1-CG1 4.46Å; I186-I402 HydrophobicContact CD1-CG2 3.77Å; V398-I402 HydrophobicContact CG1-CD1 4.14Å; V398-I402 WeakPolarHBondContact O-CG1 3.47Å; V398-I402 PolarHBondContact O-N 3.46Å; V398-I402 VanDerWaalsContact O-N 3.12Å; K399-I402 PolarHBondContact O-N 3.48Å; K399-I402 VanDerWaalsContact O-N 3.14Å; N400-I402 VanDerWaalsContact C-N 3.34Å; N400-I402 PolarHBondContact O-N 2.91Å
403	E	90.3	Very high	92.2	Very high	95 Å²	95	16.8 Å²	16.8	44%	0.444	9%	0.09	S	C	.	.	H	α-helix	trans	-71.6	-38.3	-179.7	-70	-175.8	162.5	0	0	112.7	I186 K399 N400	I186-E403 PolarHBondContact N-OE1 3.1Å; K399-E403 WeakPolarHBondContact CE-OE1 3.37Å; K399-E403 WeakPolarHBondContact CE-OE2 3.4Å; K399-E403 HydrophobicContact CG-CG 4.41Å; K399-E403 IonicContact NZ-OE1 3.36Å; K399-E403 PolarHBondContact O-N 2.96Å; N400-E403 PolarHBondContact O-N 2.74Å
404	D	89.9	Confident	92.2	Very high	52 Å²	52	16.8 Å²	16.8	28%	0.278	9%	0.09	S	C	.	.	H	α-helix	trans	-75.4	-27.5	-179.6	-72.1	-26.8	0	0	0	112.7	N400 C406 S499	N400-D404 WeakPolarHBondContact O-CB 3.3Å; N400-D404 PolarHBondContact O-N 2.89Å; D404-C406 PolarHBondContact O-N 2.78Å; D404-C406 PolarHBondContact O-SG 3.45Å; D404-S499 WeakPolarHBondContact OD2-CB 2.99Å; D404-S499 PolarHBondContact OD2-N 3.23Å; D404-S499 PolarHBondContact OD2-OG 3.05Å
405	G	89.9	Confident	92.3	Very high	27 Å²	27	16.9 Å²	16.9	28%	0.278	9%	0.09	S	C	.	.	S	Bend	trans	62.6	10.5	-175.5	0	0	0	0	0	114.5	A401	A401-G405 PolarHBondContact O-N 2.87Å; A401-G405 VanDerWaalsContact O-N 3.14Å
406	C	91.9	Very high	92.2	Very high	4 Å²	4	16.7 Å²	16.7	3%	0.027	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	154.7	177.7	59.1	0	0	0	0	111.3	K138 V139 D404	K138-C406 HydrophobicContact CB-CB 4.29Å; K138-C406 HydrophobicContact CD-CB 4.39Å; K138-C406 HydrophobicContact CG-CB 4.38Å; V139-C406 WeakPolarHBondContact O-CA 3.41Å; D404-C406 PolarHBondContact O-N 2.78Å; D404-C406 PolarHBondContact O-SG 3.45Å
407	V	91.9	Very high	92.2	Very high	4 Å²	4	14.3 Å²	14.3	2%	0.024	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	157.4	176.2	-72.3	0	0	0	0	110.1	V139 M143 V151 A401 W495	V139-V407 HydrophobicContact CB-CG2 4.46Å; V139-V407 PolarHBondContact N-O 3.02Å; V139-V407 PolarHBondContact O-N 3.05Å; M143-V407 HydrophobicContact CE-CG1 4.06Å; M143-V407 HydrophobicContact SD-CG1 4.45Å; V151-V407 HydrophobicContact CG2-CG1 3.95Å; A401-V407 HydrophobicContact CB-CG1 4.43Å; V407-W495 HydrophobicContact CB-CB 4.36Å; V407-W495 HydrophobicContact CB-CD2 4.33Å; V407-W495 HydrophobicContact CB-CE3 3.93Å; V407-W495 HydrophobicContact CG2-CD2 3.9Å; V407-W495 HydrophobicContact CG2-CE3 3.53Å; V407-W495 HydrophobicContact CG2-CG 4.45Å; V407-W495 HydrophobicContact CG2-CZ3 3.9Å
408	V	92.8	Very high	92.2	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.006	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	142.7	179.6	-177.4	0	0	0	0	108.9	L134 G410 F414 W495 D496 Y498	L134-V408 HydrophobicContact CD1-CG1 4.47Å; L134-V408 HydrophobicContact CD1-CG2 3.91Å; V408-G410 PolarHBondContact O-N 2.9Å; V408-F414 HydrophobicContact CG1-CB 4.02Å; V408-F414 HydrophobicContact CG1-CD2 3.95Å; V408-F414 HydrophobicContact CG1-CG 4.13Å; V408-W495 WeakPolarHBondContact O-CA 3.38Å; V408-D496 PolarHBondContact N-O 3.44Å; V408-D496 PolarHBondContact O-N 3.27Å; V408-Y498 HydrophobicContact CG2-CD2 4.42Å
409	S	91.9	Very high	92.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	125.9	176.4	-64	0	0	0	0	111.2	L476 S490	S409-L476 WeakPolarHBondContact OG-CD1 3.45Å; S409-S490 PolarHBondContact OG-OG 3.5Å
410	G	91.1	Very high	92.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-148.1	-176.5	0	0	0	0	0	114	V408 G412 A413 V494 D496	V408-G410 PolarHBondContact O-N 2.9Å; G410-G412 PolarHBondContact O-N 2.8Å; G410-A413 VanDerWaalsContact O-CB 3.25Å; G410-A413 WeakPolarHBondContact O-CB 3.12Å; G410-A413 PolarHBondContact O-N 2.65Å; G410-V494 PolarHBondContact N-O 3.5Å; G410-D496 WeakPolarHBondContact CA-OD2 3.47Å
411	A	90.8	Very high	92.2	Very high	17 Å²	17	13.9 Å²	13.9	14%	0.14	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	22	176.5	0	0	0	0	0	116	G478 V479 A489 V494	A411-G478 WeakPolarHBondContact O-CA 3.33Å; A411-V479 PolarHBondContact O-N 2.73Å; A411-A489 HydrophobicContact CB-CB 4.45Å; A411-V494 HydrophobicContact CB-CG1 4.13Å
412	G	89.7	Confident	92.3	Very high	1 Å²	1	14 Å²	14	1%	0.01	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	-0	-177	0	0	0	0	0	114.6	G410 E415 V416	G410-G412 PolarHBondContact O-N 2.8Å; G412-E415 VanDerWaalsContact C-OE2 3.27Å; G412-E415 WeakPolarHBondContact CA-OE2 3.49Å; G412-E415 PolarHBondContact O-N 2.77Å; G412-V416 WeakPolarHBondContact O-CG2 2.97Å; G412-V416 PolarHBondContact O-N 2.85Å; G412-V416 VanDerWaalsContact O-N 3.17Å
413	A	92.7	Very high	92.3	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-43.2	-177	0	0	0	0	0	111.8	G410 E415 V416 A417 L476 V477 A489	G410-A413 VanDerWaalsContact O-CB 3.25Å; G410-A413 WeakPolarHBondContact O-CB 3.12Å; G410-A413 PolarHBondContact O-N 2.65Å; A413-E415 VanDerWaalsContact C-N 3.34Å; A413-E415 PolarHBondContact O-N 3.28Å; A413-V416 PolarHBondContact O-N 2.74Å; A413-A417 VanDerWaalsContact O-CB 3.3Å; A413-A417 WeakPolarHBondContact O-CB 3.41Å; A413-A417 PolarHBondContact O-N 2.9Å; A413-A417 VanDerWaalsContact O-N 3.07Å; A413-L476 HydrophobicContact CB-CB 4.19Å; A413-V477 VanDerWaalsContact CA-O 3.29Å; A413-V477 WeakPolarHBondContact CA-O 3.2Å; A413-V477 WeakPolarHBondContact CB-O 3.36Å; A413-A489 HydrophobicContact CB-CB 4.22Å
414	F	93.1	Very high	92.4	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.018	10%	0.1	C	C	.	.	H	α-helix	trans	-57.4	-45.9	175	173.6	-108.6	0	0	0	112	L134 M137 V408 V416 A417 V418 K501 L505	L134-F414 HydrophobicContact CB-CE2 3.82Å; L134-F414 HydrophobicContact CB-CZ 3.94Å; L134-F414 HydrophobicContact CD1-CD2 4.07Å; L134-F414 HydrophobicContact CD1-CE1 4.5Å; L134-F414 HydrophobicContact CD1-CE2 3.39Å; L134-F414 HydrophobicContact CD1-CZ 3.63Å; L134-F414 HydrophobicContact CG-CE2 4.17Å; L134-F414 HydrophobicContact CG-CZ 4.24Å; M137-F414 HydrophobicContact SD-CD2 4.45Å; V408-F414 HydrophobicContact CG1-CB 4.02Å; V408-F414 HydrophobicContact CG1-CD2 3.95Å; V408-F414 HydrophobicContact CG1-CG 4.13Å; F414-V416 PolarHBondContact O-N 3.36Å; F414-A417 PolarHBondContact O-N 3.49Å; F414-V418 HydrophobicContact CD1-CG2 4.44Å; F414-V418 HydrophobicContact CD2-CG2 3.92Å; F414-V418 HydrophobicContact CE1-CG2 4.01Å; F414-V418 HydrophobicContact CE2-CG2 3.4Å; F414-V418 HydrophobicContact CG-CG2 4.41Å; F414-V418 HydrophobicContact CZ-CG2 3.47Å; F414-V418 VanDerWaalsContact CZ-CG2 3.47Å; F414-V418 VanDerWaalsContact O-CG2 3.31Å; F414-V418 WeakPolarHBondContact O-CG2 3.12Å; F414-V418 PolarHBondContact O-N 2.83Å; F414-K501 HydrophobicContact CD1-CD 3.87Å; F414-K501 HydrophobicContact CD1-CG 4.34Å; F414-K501 HydrophobicContact CE1-CB 4.32Å; F414-K501 HydrophobicContact CE1-CD 4.2Å; F414-K501 HydrophobicContact CE1-CG 4.48Å; F414-L505 HydrophobicContact CE1-CD1 4.14Å; F414-L505 HydrophobicContact CZ-CD1 3.88Å
415	E	94.4	Very high	92.5	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-65.9	-40.2	-177.1	-69.2	77.5	-174.7	0	0	112.4	G412 A413 A417 H419 L444 I447 K501	G412-E415 VanDerWaalsContact C-OE2 3.27Å; G412-E415 WeakPolarHBondContact CA-OE2 3.49Å; G412-E415 PolarHBondContact O-N 2.77Å; A413-E415 VanDerWaalsContact C-N 3.34Å; A413-E415 PolarHBondContact O-N 3.28Å; E415-A417 VanDerWaalsContact C-N 3.34Å; E415-H419 VanDerWaalsContact O-CB 3.32Å; E415-H419 WeakPolarHBondContact O-CB 3.37Å; E415-H419 PolarHBondContact O-N 2.67Å; E415-L444 HydrophobicContact CB-CB 4.49Å; E415-I447 HydrophobicContact CG-CB 4.15Å; E415-I447 HydrophobicContact CG-CD1 3.94Å; E415-I447 HydrophobicContact CG-CG1 4.46Å; E415-I447 VanDerWaalsContact OE1-CD1 3.24Å; E415-I447 WeakPolarHBondContact OE1-CD1 3.34Å; E415-K501 IonicContact OE1-NZ 3.82Å; E415-K501 PolarHBondContact OE1-NZ 3.36Å; E415-K501 IonicContact OE2-NZ 2.88Å
416	V	93.8	Very high	92.5	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.012	9%	0.094	C	C	.	.	H	α-helix	trans	-64.8	-42.1	175.6	174	0	0	0	0	110.8	G412 A413 F414 H419 D420 L445 P448 L466 Q467 Y470	G412-V416 WeakPolarHBondContact O-CG2 2.97Å; G412-V416 PolarHBondContact O-N 2.85Å; G412-V416 VanDerWaalsContact O-N 3.17Å; A413-V416 PolarHBondContact O-N 2.74Å; F414-V416 PolarHBondContact O-N 3.36Å; V416-H419 PolarHBondContact O-N 2.71Å; V416-D420 PolarHBondContact O-N 2.78Å; V416-D420 VanDerWaalsContact O-N 3.16Å; V416-L445 HydrophobicContact CG2-CD2 4.3Å; V416-P448 HydrophobicContact CG2-CG 4.3Å; V416-L466 HydrophobicContact CG2-CB 4.37Å; V416-L466 HydrophobicContact CG2-CD1 4.36Å; V416-Q467 HydrophobicContact CG1-CG 4.32Å; V416-Y470 HydrophobicContact CG1-CD1 4.44Å; V416-Y470 HydrophobicContact CG1-CG 4.14Å
417	A	92.8	Very high	92.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-68.1	-43.6	-178.1	0	0	0	0	0	112.3	M137 A413 F414 E415 H419 D420 A421 Y470 L476	M137-A417 HydrophobicContact CE-CB 3.39Å; M137-A417 HydrophobicContact SD-CB 3.53Å; M137-A417 VanDerWaalsContact SD-CB 3.53Å; A413-A417 VanDerWaalsContact O-CB 3.3Å; A413-A417 WeakPolarHBondContact O-CB 3.41Å; A413-A417 PolarHBondContact O-N 2.9Å; A413-A417 VanDerWaalsContact O-N 3.07Å; F414-A417 PolarHBondContact O-N 3.49Å; E415-A417 VanDerWaalsContact C-N 3.34Å; A417-H419 VanDerWaalsContact C-N 3.35Å; A417-D420 PolarHBondContact O-N 2.99Å; A417-A421 PolarHBondContact O-N 2.81Å; A417-A421 VanDerWaalsContact O-N 3.15Å; A417-Y470 HydrophobicContact CB-CD2 4.45Å; A417-Y470 HydrophobicContact CB-CE1 4.37Å; A417-Y470 HydrophobicContact CB-CE2 3.6Å; A417-Y470 WeakPolarHBondContact CB-OH 3.45Å; A417-L476 HydrophobicContact CB-CD2 3.89Å
418	V	93.9	Very high	92.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.6	-40.8	173.8	174.1	0	0	0	0	111.2	A130 V133 F414 D420 A421 L422 L444	A130-V418 HydrophobicContact CB-CG1 3.72Å; V133-V418 HydrophobicContact CB-CG2 4.44Å; V133-V418 HydrophobicContact CG1-CG2 3.87Å; F414-V418 HydrophobicContact CD1-CG2 4.44Å; F414-V418 HydrophobicContact CD2-CG2 3.92Å; F414-V418 HydrophobicContact CE1-CG2 4.01Å; F414-V418 HydrophobicContact CE2-CG2 3.4Å; F414-V418 HydrophobicContact CG-CG2 4.41Å; F414-V418 HydrophobicContact CZ-CG2 3.47Å; F414-V418 VanDerWaalsContact CZ-CG2 3.47Å; F414-V418 VanDerWaalsContact O-CG2 3.31Å; F414-V418 WeakPolarHBondContact O-CG2 3.12Å; F414-V418 PolarHBondContact O-N 2.83Å; V418-D420 PolarHBondContact O-N 2.8Å; V418-A421 PolarHBondContact O-N 3.26Å; V418-L422 HydrophobicContact CG1-CD1 3.74Å; V418-L422 HydrophobicContact CG1-CG 4.02Å; V418-L422 WeakPolarHBondContact O-CB 3.35Å; V418-L422 VanDerWaalsContact O-CG 3.29Å; V418-L422 WeakPolarHBondContact O-CG 3.34Å; V418-L422 PolarHBondContact O-N 2.8Å; V418-L444 HydrophobicContact CB-CD1 4.08Å; V418-L444 HydrophobicContact CG1-CD1 3.41Å; V418-L444 VanDerWaalsContact CG1-CD1 3.41Å
419	H	94.8	Very high	91.8	Very high	12 Å²	12	32.8 Å²	32.8	6%	0.056	17%	0.169	C	C	.	.	H	α-helix	trans	-57.7	-46.6	176.8	162.1	-86.2	0	0	0	112.2	E415 V416 A417 A421 L422 I423 A441 D442 L445 Q467	E415-H419 VanDerWaalsContact O-CB 3.32Å; E415-H419 WeakPolarHBondContact O-CB 3.37Å; E415-H419 PolarHBondContact O-N 2.67Å; V416-H419 PolarHBondContact O-N 2.71Å; A417-H419 VanDerWaalsContact C-N 3.35Å; H419-A421 PolarHBondContact O-N 2.81Å; H419-L422 PolarHBondContact O-N 3.45Å; H419-I423 WeakPolarHBondContact CE1-CD1 3.18Å; H419-I423 VanDerWaalsContact NE2-CD1 3.3Å; H419-I423 WeakPolarHBondContact NE2-CD1 3.38Å; H419-I423 WeakPolarHBondContact O-CG1 3.05Å; H419-I423 PolarHBondContact O-N 2.9Å; H419-A441 PolarHBondContact CD2-O 3.01Å; H419-D442 IonicContact NE2-OD1 2.72Å; H419-L445 HydrophobicContact CB-CD2 3.78Å; H419-L445 HydrophobicContact CB-CG 4.24Å; H419-L445 VanDerWaalsContact CD2-CD1 3.48Å; H419-L445 WeakPolarHBondContact CD2-CD1 3.29Å; H419-Q467 PolarHBondContact CE1-NE2 3.37Å
420	D	93.2	Very high	91.3	Very high	18 Å²	18	42.1 Å²	42.1	10%	0.096	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-40.6	177.9	-173.5	72.3	0	0	0	112.2	V416 A417 V418 I423 K424 Y470 K471	V416-D420 PolarHBondContact O-N 2.78Å; V416-D420 VanDerWaalsContact O-N 3.16Å; A417-D420 PolarHBondContact O-N 2.99Å; V418-D420 PolarHBondContact O-N 2.8Å; D420-I423 PolarHBondContact O-N 3.18Å; D420-K424 WeakPolarHBondContact O-CG 3.35Å; D420-K424 PolarHBondContact O-N 3.19Å; D420-K424 VanDerWaalsContact O-N 3.12Å; D420-K424 WeakPolarHBondContact OD2-CE 3.42Å; D420-K424 IonicContact OD2-NZ 2.67Å; D420-K424 PolarHBondContact OD2-NZ 2.95Å; D420-Y470 HydrophobicContact CB-CD1 4.24Å; D420-Y470 HydrophobicContact CB-CE1 3.83Å; D420-K471 WeakPolarHBondContact OD1-CE 3.12Å
421	A	93	Very high	91.1	Very high	22 Å²	22	44.6 Å²	44.6	18%	0.182	24%	0.235	C	C	.	.	H	α-helix	trans	-63.4	-41.1	175.9	0	0	0	0	0	112.4	V133 A417 V418 H419 K424 H425	V133-A421 HydrophobicContact CG1-CB 4.31Å; V133-A421 HydrophobicContact CG2-CB 3.66Å; A417-A421 PolarHBondContact O-N 2.81Å; A417-A421 VanDerWaalsContact O-N 3.15Å; V418-A421 PolarHBondContact O-N 3.26Å; H419-A421 PolarHBondContact O-N 2.81Å; A421-K424 PolarHBondContact O-N 3.16Å; A421-H425 WeakPolarHBondContact O-CB 3.35Å; A421-H425 PolarHBondContact O-N 2.71Å
422	L	94.2	Very high	90.9	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-69.2	-37.3	177.6	-71.2	176.6	0	0	0	112.5	A126 K129 V418 H419 K424 H425 K426 V437 F440 A441 L444	A126-L422 HydrophobicContact CB-CD2 4.08Å; A126-L422 WeakPolarHBondContact O-CD2 3.43Å; K129-L422 HydrophobicContact CB-CD2 4Å; K129-L422 HydrophobicContact CG-CD2 4.16Å; V418-L422 HydrophobicContact CG1-CD1 3.74Å; V418-L422 HydrophobicContact CG1-CG 4.02Å; V418-L422 WeakPolarHBondContact O-CB 3.35Å; V418-L422 VanDerWaalsContact O-CG 3.29Å; V418-L422 WeakPolarHBondContact O-CG 3.34Å; V418-L422 PolarHBondContact O-N 2.8Å; H419-L422 PolarHBondContact O-N 3.45Å; L422-K424 VanDerWaalsContact C-N 3.32Å; L422-K424 PolarHBondContact O-N 3.31Å; L422-H425 PolarHBondContact O-N 3.25Å; L422-K426 PolarHBondContact O-N 2.97Å; L422-V437 HydrophobicContact CB-CG1 4.43Å; L422-V437 HydrophobicContact CD2-CG1 4.43Å; L422-F440 HydrophobicContact CD1-CD1 3.69Å; L422-F440 HydrophobicContact CD1-CE1 4.26Å; L422-A441 HydrophobicContact CB-CB 3.8Å; L422-A441 HydrophobicContact CD1-CB 4.01Å; L422-L444 HydrophobicContact CD1-CD1 4.05Å
423	I	93.3	Very high	90.8	Very high	74 Å²	74	52.4 Å²	52.4	38%	0.379	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-41.4	173.6	-73.9	-177.7	0	0	0	111	H419 D420 K426	H419-I423 WeakPolarHBondContact CE1-CD1 3.18Å; H419-I423 VanDerWaalsContact NE2-CD1 3.3Å; H419-I423 WeakPolarHBondContact NE2-CD1 3.38Å; H419-I423 WeakPolarHBondContact O-CG1 3.05Å; H419-I423 PolarHBondContact O-N 2.9Å; D420-I423 PolarHBondContact O-N 3.18Å; I423-K426 WeakPolarHBondContact O-CB 3.29Å; I423-K426 PolarHBondContact O-N 3.07Å
424	K	91.9	Very high	90.8	Very high	134 Å²	134	55.9 Å²	55.9	58%	0.583	28%	0.279	S	S	*	.	H	α-helix	trans	-65	-42.5	174.2	-71.6	166.7	176.2	162.3	0	111.1	D420 A421 L422 K426 L427	D420-K424 WeakPolarHBondContact O-CG 3.35Å; D420-K424 PolarHBondContact O-N 3.19Å; D420-K424 VanDerWaalsContact O-N 3.12Å; D420-K424 WeakPolarHBondContact OD2-CE 3.42Å; D420-K424 IonicContact OD2-NZ 2.67Å; D420-K424 PolarHBondContact OD2-NZ 2.95Å; A421-K424 PolarHBondContact O-N 3.16Å; L422-K424 VanDerWaalsContact C-N 3.32Å; L422-K424 PolarHBondContact O-N 3.31Å; K424-K426 VanDerWaalsContact C-N 3.31Å; K424-K426 PolarHBondContact O-N 3.37Å; K424-L427 PolarHBondContact O-N 3.13Å
425	H	90.8	Very high	90.8	Very high	45 Å²	45	57.6 Å²	57.6	21%	0.208	29%	0.288	C	S	.	.	H	α-helix	trans	-65.9	-32.3	179	-172.1	70.2	0	0	0	113.1	K129 A421 L422 L427 L428 V429	K129-H425 HydrophobicContact CG-CB 4.09Å; A421-H425 WeakPolarHBondContact O-CB 3.35Å; A421-H425 PolarHBondContact O-N 2.71Å; L422-H425 PolarHBondContact O-N 3.25Å; H425-L427 PolarHBondContact O-N 3.35Å; H425-L427 VanDerWaalsContact O-N 3.09Å; H425-L428 WeakPolarHBondContact O-CB 3.43Å; H425-L428 PolarHBondContact O-N 3.25Å; H425-V429 WeakPolarHBondContact NE2-CG2 3.49Å; H425-V429 PolarHBondContact O-N 2.82Å
426	K	90	Very high	90.7	Very high	48 Å²	48	57.5 Å²	57.5	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-49.8	-37.5	177.2	-176.3	-170.5	170.3	-171.2	0	112.7	L422 I423 K424 L428 V429 Q434 V437 Q438	L422-K426 PolarHBondContact O-N 2.97Å; I423-K426 WeakPolarHBondContact O-CB 3.29Å; I423-K426 PolarHBondContact O-N 3.07Å; K424-K426 VanDerWaalsContact C-N 3.31Å; K424-K426 PolarHBondContact O-N 3.37Å; K426-L428 PolarHBondContact O-N 3.36Å; K426-V429 PolarHBondContact O-N 3.22Å; K426-Q434 HydrophobicContact CG-CB 3.97Å; K426-V437 HydrophobicContact CB-CG1 4.46Å; K426-Q438 HydrophobicContact CD-CB 4.21Å
427	L	89.1	Confident	90.8	Very high	152 Å²	152	57.4 Å²	57.4	80%	0.796	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-22	-179.9	-61.2	176.2	0	0	0	113.4	K424 H425	K424-L427 PolarHBondContact O-N 3.13Å; H425-L427 PolarHBondContact O-N 3.35Å; H425-L427 VanDerWaalsContact O-N 3.09Å
428	L	88.2	Confident	90.9	Very high	129 Å²	129	60.1 Å²	60.1	68%	0.675	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-27.3	179.6	-61.2	169.7	0	0	0	112.1	H425 K426 K430	H425-L428 WeakPolarHBondContact O-CB 3.43Å; H425-L428 PolarHBondContact O-N 3.25Å; K426-L428 PolarHBondContact O-N 3.36Å; L428-K430 PolarHBondContact O-N 2.82Å
429	V	86.3	Confident	90.9	Very high	27 Å²	27	60.1 Å²	60.1	16%	0.164	30%	0.3	C	S	.	.	S	Bend	trans	-73.3	121.3	-178	180	0	0	0	0	109.9	H425 K426 A433 V437	H425-V429 WeakPolarHBondContact NE2-CG2 3.49Å; H425-V429 PolarHBondContact O-N 2.82Å; K426-V429 PolarHBondContact O-N 3.22Å; V429-A433 HydrophobicContact CG1-CB 4.13Å; V429-V437 HydrophobicContact CG2-CG2 4.28Å
430	K	80.8	Confident	91	Very high	197 Å²	197	59.6 Å²	59.6	86%	0.857	30%	0.298	S	S	*	.			trans	-79.4	137.7	-178.1	-66.5	-177.6	-179.7	177.4	0	111.4	L428	L428-K430 PolarHBondContact O-N 2.82Å
431	G	85.8	Confident	91.1	Very high	52 Å²	52	58.8 Å²	58.8	54%	0.536	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	86.4	-155.3	167.2	0	0	0	0	0	114.6	A433 Q434	G431-A433 VanDerWaalsContact C-N 3.32Å; G431-A433 PolarHBondContact O-N 3.41Å; G431-Q434 VanDerWaalsContact O-CG 3.29Å; G431-Q434 WeakPolarHBondContact O-CG 3.25Å
432	R	86.8	Confident	91.2	Very high	170 Å²	170	59.6 Å²	59.6	64%	0.642	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-76.4	-16.4	-174.1	-67.4	-175.4	178.7	-172.5	-0.9	113.7	L114 I118 Q434 L435	L114-R432 HydrophobicContact CD2-CB 4.07Å; I118-R432 HydrophobicContact CD1-CB 4.39Å; I118-R432 HydrophobicContact CG2-CB 3.7Å; R432-Q434 PolarHBondContact O-N 3.12Å; R432-L435 PolarHBondContact O-N 2.8Å; R432-L435 VanDerWaalsContact O-N 3.17Å
433	A	89.3	Confident	91.3	Very high	12 Å²	12	59.6 Å²	59.6	10%	0.099	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-61.7	-21.6	176.9	0	0	0	0	0	113.1	V429 G431 L435 G436 V437	V429-A433 HydrophobicContact CG1-CB 4.13Å; G431-A433 VanDerWaalsContact C-N 3.32Å; G431-A433 PolarHBondContact O-N 3.41Å; A433-L435 PolarHBondContact O-N 3.31Å; A433-L435 VanDerWaalsContact O-N 3.1Å; A433-G436 PolarHBondContact O-N 3.29Å; A433-V437 PolarHBondContact O-N 2.9Å
434	Q	92.2	Very high	91.3	Very high	73 Å²	73	56.1 Å²	56.1	34%	0.341	28%	0.277	S	S	.	.	H	α-helix	trans	-54.3	-29.3	173.4	73.3	179	-27.6	0	0	113.4	K426 G431 R432 V437 Q438	K426-Q434 HydrophobicContact CG-CB 3.97Å; G431-Q434 VanDerWaalsContact O-CG 3.29Å; G431-Q434 WeakPolarHBondContact O-CG 3.25Å; R432-Q434 PolarHBondContact O-N 3.12Å; Q434-V437 PolarHBondContact O-N 3.24Å; Q434-Q438 PolarHBondContact O-N 2.83Å
435	L	92.3	Very high	91.5	Very high	40 Å²	40	50 Å²	50	21%	0.209	25%	0.25	C	S	.	.	H	α-helix	trans	-75.3	-33.6	179.5	-61.8	175.4	0	0	0	111.1	Y109 L114 R432 A433 Q438 A439	Y109-L435 HydrophobicContact CD1-CB 4.3Å; Y109-L435 HydrophobicContact CD1-CD1 4.43Å; Y109-L435 HydrophobicContact CE1-CB 4.26Å; Y109-L435 HydrophobicContact CE1-CD2 4Å; Y109-L435 HydrophobicContact CE2-CB 4.47Å; Y109-L435 VanDerWaalsContact CE2-O 3.32Å; Y109-L435 WeakPolarHBondContact CE2-O 3.43Å; Y109-L435 HydrophobicContact CG-CB 4.44Å; L114-L435 HydrophobicContact CD1-CD1 3.34Å; L114-L435 HydrophobicContact CD2-CD1 4.11Å; L114-L435 HydrophobicContact CG-CD1 4.34Å; R432-L435 PolarHBondContact O-N 2.8Å; R432-L435 VanDerWaalsContact O-N 3.17Å; A433-L435 PolarHBondContact O-N 3.31Å; A433-L435 VanDerWaalsContact O-N 3.1Å; L435-Q438 PolarHBondContact O-N 3.12Å; L435-A439 PolarHBondContact O-N 2.82Å
436	G	93.1	Very high	91.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-41.5	170.8	0	0	0	0	0	111.7	F123 A433 Q438 A439 F440	F123-G436 VanDerWaalsContact CD1-O 3.31Å; F123-G436 WeakPolarHBondContact CD1-O 3.48Å; F123-G436 WeakPolarHBondContact CE1-O 3.3Å; A433-G436 PolarHBondContact O-N 3.29Å; G436-Q438 VanDerWaalsContact C-N 3.31Å; G436-Q438 PolarHBondContact O-N 2.98Å; G436-A439 PolarHBondContact O-N 3.41Å; G436-F440 PolarHBondContact O-N 3.2Å
437	V	95	Very high	92	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-41.2	174.7	179.5	0	0	0	0	111.4	G122 A126 L422 K426 V429 A433 Q434 F440 A441	G122-V437 WeakPolarHBondContact O-CG2 3.46Å; A126-V437 HydrophobicContact CB-CB 4.4Å; A126-V437 HydrophobicContact CB-CG1 4.18Å; A126-V437 HydrophobicContact CB-CG2 4.27Å; L422-V437 HydrophobicContact CB-CG1 4.43Å; L422-V437 HydrophobicContact CD2-CG1 4.43Å; K426-V437 HydrophobicContact CB-CG1 4.46Å; V429-V437 HydrophobicContact CG2-CG2 4.28Å; A433-V437 PolarHBondContact O-N 2.9Å; Q434-V437 PolarHBondContact O-N 3.24Å; V437-F440 PolarHBondContact O-N 3.49Å; V437-A441 PolarHBondContact O-N 3.3Å
438	Q	94.2	Very high	92.3	Very high	57 Å²	57	39.1 Å²	39.1	27%	0.266	20%	0.197	S	C	.	.	H	α-helix	trans	-63.1	-49.4	175.3	-177.8	172.5	-4.5	0	0	112	Y109 K426 Q434 L435 G436 F440 A441 D442	Y109-Q438 VanDerWaalsContact OH-CD 3.25Å; Y109-Q438 PolarHBondContact OH-OE1 3.35Å; K426-Q438 HydrophobicContact CD-CB 4.21Å; Q434-Q438 PolarHBondContact O-N 2.83Å; L435-Q438 PolarHBondContact O-N 3.12Å; G436-Q438 VanDerWaalsContact C-N 3.31Å; G436-Q438 PolarHBondContact O-N 2.98Å; Q438-F440 PolarHBondContact O-N 3.17Å; Q438-A441 PolarHBondContact O-N 2.66Å; Q438-A441 VanDerWaalsContact O-N 3.15Å; Q438-D442 WeakPolarHBondContact CG-OD2 3.43Å; Q438-D442 PolarHBondContact O-N 3.02Å
439	A	95.4	Very high	92.6	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-54.8	-40.2	175.4	0	0	0	0	0	112.1	Q105 Y109 F123 L435 G436 A443	Q105-A439 HydrophobicContact CB-CB 3.76Å; Y109-A439 HydrophobicContact CD2-CB 3.97Å; Y109-A439 HydrophobicContact CE2-CB 3.71Å; F123-A439 HydrophobicContact CE1-CB 3.79Å; F123-A439 HydrophobicContact CZ-CB 4.32Å; L435-A439 PolarHBondContact O-N 2.82Å; G436-A439 PolarHBondContact O-N 3.41Å; A439-A443 VanDerWaalsContact O-CB 3.27Å; A439-A443 WeakPolarHBondContact O-CB 2.83Å; A439-A443 PolarHBondContact O-N 3.19Å
440	F	95.8	Very high	93.1	Very high	1 Å²	1	33.7 Å²	33.7	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-46.7	178.1	-165.9	-85.9	0	0	0	111.9	L102 F123 A126 A130 L422 G436 V437 Q438 D442 A443 L444 L505 T509	L102-F440 HydrophobicContact CD1-CD2 4.38Å; L102-F440 HydrophobicContact CD1-CE2 4.12Å; L102-F440 HydrophobicContact CD2-CB 4.23Å; L102-F440 HydrophobicContact CD2-CD2 3.4Å; L102-F440 HydrophobicContact CD2-CE2 3.94Å; L102-F440 HydrophobicContact CD2-CG 3.99Å; F123-F440 HydrophobicContact CB-CD2 4.31Å; F123-F440 HydrophobicContact CD1-CB 3.89Å; F123-F440 AromaticContact CD1-CD2 3.96Å; F123-F440 HydrophobicContact CD1-CD2 3.96Å; F123-F440 HydrophobicContact CD1-CG 4.43Å; F123-F440 HydrophobicContact CE1-CB 4.1Å; F123-F440 HydrophobicContact CE1-CD2 4.48Å; F123-F440 HydrophobicContact CG-CD2 4.2Å; A126-F440 HydrophobicContact CB-CB 3.71Å; A126-F440 HydrophobicContact CB-CD1 3.69Å; A126-F440 HydrophobicContact CB-CD2 4.32Å; A126-F440 HydrophobicContact CB-CE1 4.39Å; A126-F440 HydrophobicContact CB-CG 3.64Å; A130-F440 HydrophobicContact CB-CE1 4.4Å; L422-F440 HydrophobicContact CD1-CD1 3.69Å; L422-F440 HydrophobicContact CD1-CE1 4.26Å; G436-F440 PolarHBondContact O-N 3.2Å; V437-F440 PolarHBondContact O-N 3.49Å; Q438-F440 PolarHBondContact O-N 3.17Å; F440-D442 PolarHBondContact O-N 2.81Å; F440-A443 PolarHBondContact O-N 2.99Å; F440-L444 HydrophobicContact CD1-CD1 4.12Å; F440-L444 HydrophobicContact CD1-CG 4.35Å; F440-L444 HydrophobicContact CE1-CD1 3.88Å; F440-L444 HydrophobicContact CE1-CD2 4.29Å; F440-L444 HydrophobicContact CE1-CG 4.16Å; F440-L444 PolarHBondContact O-N 3.3Å; F440-L505 HydrophobicContact CE1-CD2 4.45Å; F440-L505 HydrophobicContact CZ-CD2 4.27Å; F440-T509 HydrophobicContact CE2-CG2 4.25Å; F440-T509 VanDerWaalsContact CE2-OG1 3.3Å; F440-T509 WeakPolarHBondContact CE2-OG1 3.37Å
441	A	95.7	Very high	93.7	Very high	1 Å²	1	25 Å²	25	1%	0.008	13%	0.129	C	C	.	.	H	α-helix	trans	-59.4	-47.6	177.6	0	0	0	0	0	111.5	H419 L422 V437 Q438 A443 L444	H419-A441 PolarHBondContact CD2-O 3.01Å; L422-A441 HydrophobicContact CB-CB 3.8Å; L422-A441 HydrophobicContact CD1-CB 4.01Å; V437-A441 PolarHBondContact O-N 3.3Å; Q438-A441 PolarHBondContact O-N 2.66Å; Q438-A441 VanDerWaalsContact O-N 3.15Å; A441-A443 VanDerWaalsContact C-N 3.28Å; A441-A443 PolarHBondContact O-N 3.29Å; A441-L444 PolarHBondContact O-N 2.87Å
442	D	95.1	Very high	94.1	Very high	39 Å²	39	22.6 Å²	22.6	21%	0.209	10%	0.103	C	C	.	.	H	α-helix	trans	-65.7	-32.2	-179.1	-70.5	-34.8	0	0	0	112.3	Q105 H419 Q438 F440	Q105-D442 HydrophobicContact CG-CB 4.39Å; H419-D442 IonicContact NE2-OD1 2.72Å; Q438-D442 WeakPolarHBondContact CG-OD2 3.43Å; Q438-D442 PolarHBondContact O-N 3.02Å; F440-D442 PolarHBondContact O-N 2.81Å
443	A	95.8	Very high	94.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-69.4	-35.2	178	0	0	0	0	0	113.2	E101 L102 Q105 A439 F440 A441 L445 I446	E101-A443 HydrophobicContact CB-CB 4.22Å; E101-A443 HydrophobicContact CG-CB 4.09Å; L102-A443 HydrophobicContact CB-CB 4.39Å; L102-A443 HydrophobicContact CD2-CB 3.55Å; L102-A443 HydrophobicContact CG-CB 3.82Å; Q105-A443 HydrophobicContact CG-CB 4.1Å; A439-A443 VanDerWaalsContact O-CB 3.27Å; A439-A443 WeakPolarHBondContact O-CB 2.83Å; A439-A443 PolarHBondContact O-N 3.19Å; F440-A443 PolarHBondContact O-N 2.99Å; A441-A443 VanDerWaalsContact C-N 3.28Å; A441-A443 PolarHBondContact O-N 3.29Å; A443-L445 PolarHBondContact O-N 2.73Å; A443-I446 WeakPolarHBondContact O-CB 3.49Å; A443-I446 WeakPolarHBondContact O-CG2 3.25Å; A443-I446 PolarHBondContact O-N 2.88Å; A443-I446 VanDerWaalsContact O-N 3.09Å
444	L	94.8	Very high	94.7	Very high	2 Å²	2	20 Å²	20	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-29.7	178.7	-70.5	175.1	0	0	0	112.8	I98 E415 V418 L422 F440 A441 I446 I447 L505	I98-L444 HydrophobicContact CD1-CD2 4.32Å; E415-L444 HydrophobicContact CB-CB 4.49Å; V418-L444 HydrophobicContact CB-CD1 4.08Å; V418-L444 HydrophobicContact CG1-CD1 3.41Å; V418-L444 VanDerWaalsContact CG1-CD1 3.41Å; L422-L444 HydrophobicContact CD1-CD1 4.05Å; F440-L444 HydrophobicContact CD1-CD1 4.12Å; F440-L444 HydrophobicContact CD1-CG 4.35Å; F440-L444 HydrophobicContact CE1-CD1 3.88Å; F440-L444 HydrophobicContact CE1-CD2 4.29Å; F440-L444 HydrophobicContact CE1-CG 4.16Å; F440-L444 PolarHBondContact O-N 3.3Å; A441-L444 PolarHBondContact O-N 2.87Å; L444-I446 PolarHBondContact O-N 3.31Å; L444-I447 PolarHBondContact O-N 3.29Å; L444-L505 HydrophobicContact CD2-CD2 3.85Å
445	L	95.7	Very high	94.7	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.021	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-3.7	177.7	-60	-178	0	0	0	113.5	V416 H419 A443 I447 P448 K449 L463	V416-L445 HydrophobicContact CG2-CD2 4.3Å; H419-L445 HydrophobicContact CB-CD2 3.78Å; H419-L445 HydrophobicContact CB-CG 4.24Å; H419-L445 VanDerWaalsContact CD2-CD1 3.48Å; H419-L445 WeakPolarHBondContact CD2-CD1 3.29Å; A443-L445 PolarHBondContact O-N 2.73Å; L445-I447 VanDerWaalsContact C-N 3.26Å; L445-I447 PolarHBondContact O-N 2.84Å; L445-P448 WeakPolarHBondContact O-CD 3.34Å; L445-P448 WeakPolarHBondContact O-CG 3.42Å; L445-K449 WeakPolarHBondContact O-CB 3.45Å; L445-K449 WeakPolarHBondContact O-CD 3.49Å; L445-K449 WeakPolarHBondContact O-CG 3.35Å; L445-K449 PolarHBondContact O-N 3.31Å; L445-L463 HydrophobicContact CB-CD1 4.11Å; L445-L463 HydrophobicContact CD1-CD1 4.18Å; L445-L463 HydrophobicContact CD1-CD2 4.13Å; L445-L463 HydrophobicContact CD2-CD1 4.09Å; L445-L463 HydrophobicContact CG-CD1 4.36Å
446	I	95.8	Very high	94.8	Very high	8 Å²	8	19 Å²	19	4%	0.041	11%	0.113	C	C	.	.	H	α-helix	trans	-60.4	-36.1	174.8	-165.9	58.2	0	0	0	112.2	L97 I98 E101 A443 L444 K449 V450	L97-I446 HydrophobicContact CB-CG2 4.4Å; I98-I446 HydrophobicContact CG1-CG2 3.92Å; E101-I446 HydrophobicContact CB-CB 3.99Å; E101-I446 HydrophobicContact CB-CG1 4.09Å; E101-I446 HydrophobicContact CB-CG2 4.21Å; E101-I446 HydrophobicContact CG-CB 4Å; E101-I446 HydrophobicContact CG-CD1 4.29Å; E101-I446 HydrophobicContact CG-CG1 4.27Å; A443-I446 WeakPolarHBondContact O-CB 3.49Å; A443-I446 WeakPolarHBondContact O-CG2 3.25Å; A443-I446 PolarHBondContact O-N 2.88Å; A443-I446 VanDerWaalsContact O-N 3.09Å; L444-I446 PolarHBondContact O-N 3.31Å; I446-K449 PolarHBondContact O-N 3.25Å; I446-V450 HydrophobicContact CD1-CG2 3.76Å; I446-V450 HydrophobicContact CG1-CG2 3.86Å; I446-V450 VanDerWaalsContact O-CB 3.3Å; I446-V450 WeakPolarHBondContact O-CB 3.2Å; I446-V450 WeakPolarHBondContact O-CG2 3.45Å; I446-V450 PolarHBondContact O-N 3.11Å
447	I	95.4	Very high	94.8	Very high	7 Å²	7	22.7 Å²	22.7	4%	0.036	13%	0.127	C	C	.	.	H	α-helix	trans	-62.2	-59.1	-178.4	-67.4	177.9	0	0	0	111.1	L38 I98 E415 L444 L445 K449 V450 L451	L38-I447 HydrophobicContact CD2-CG2 4.4Å; I98-I447 HydrophobicContact CD1-CD1 3.67Å; I98-I447 HydrophobicContact CD1-CG1 4.36Å; I98-I447 HydrophobicContact CG1-CD1 4.25Å; I98-I447 HydrophobicContact CG1-CG1 4.42Å; E415-I447 HydrophobicContact CG-CB 4.15Å; E415-I447 HydrophobicContact CG-CD1 3.94Å; E415-I447 HydrophobicContact CG-CG1 4.46Å; E415-I447 VanDerWaalsContact OE1-CD1 3.24Å; E415-I447 WeakPolarHBondContact OE1-CD1 3.34Å; L444-I447 PolarHBondContact O-N 3.29Å; L445-I447 VanDerWaalsContact C-N 3.26Å; L445-I447 PolarHBondContact O-N 2.84Å; I447-K449 VanDerWaalsContact C-N 3.31Å; I447-K449 PolarHBondContact O-N 2.69Å; I447-V450 PolarHBondContact O-N 3.25Å; I447-L451 HydrophobicContact CG2-CD1 3.94Å; I447-L451 HydrophobicContact CG2-CG 4.46Å; I447-L451 WeakPolarHBondContact O-CB 3.3Å; I447-L451 VanDerWaalsContact O-CG 3.31Å; I447-L451 WeakPolarHBondContact O-CG 3.49Å; I447-L451 PolarHBondContact O-N 3.01Å
448	P	95.3	Very high	94.8	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.013	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-37.2	178.3	21.2	-31.8	0	0	0	112.6	V416 L445 V450 L451 A452 L463 L466 V479	V416-P448 HydrophobicContact CG2-CG 4.3Å; L445-P448 WeakPolarHBondContact O-CD 3.34Å; L445-P448 WeakPolarHBondContact O-CG 3.42Å; P448-V450 PolarHBondContact O-N 2.87Å; P448-L451 PolarHBondContact O-N 3.12Å; P448-A452 WeakPolarHBondContact O-CB 3.29Å; P448-A452 PolarHBondContact O-N 3.29Å; P448-L463 HydrophobicContact CG-CD1 4.2Å; P448-L466 HydrophobicContact CB-CD1 4.11Å; P448-V479 HydrophobicContact CB-CG2 4.09Å
449	K	94.8	Very high	94.7	Very high	42 Å²	42	25.4 Å²	25.4	18%	0.183	15%	0.146	C	C	.	.	H	α-helix	trans	-58.9	-47.1	175	-74.9	171.1	-176.7	169.7	0	111.9	L445 I446 I447 Q453 P459 L463	L445-K449 WeakPolarHBondContact O-CB 3.45Å; L445-K449 WeakPolarHBondContact O-CD 3.49Å; L445-K449 WeakPolarHBondContact O-CG 3.35Å; L445-K449 PolarHBondContact O-N 3.31Å; I446-K449 PolarHBondContact O-N 3.25Å; I447-K449 VanDerWaalsContact C-N 3.31Å; I447-K449 PolarHBondContact O-N 2.69Å; K449-Q453 WeakPolarHBondContact O-CB 3.28Å; K449-Q453 PolarHBondContact O-N 3.44Å; K449-P459 HydrophobicContact CB-CB 4.17Å; K449-P459 HydrophobicContact CG-CB 4.42Å; K449-P459 WeakPolarHBondContact O-CB 3.36Å; K449-L463 HydrophobicContact CD-CD2 4.49Å; K449-L463 HydrophobicContact CG-CD1 4.31Å; K449-L463 HydrophobicContact CG-CD2 4.34Å
450	V	95.5	Very high	94.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-69.9	-38.7	-179	172.2	0	0	0	0	111.1	K35 L38 L97 I446 I447 P448 Q453 N454	K35-V450 HydrophobicContact CD-CG2 3.91Å; K35-V450 HydrophobicContact CG-CB 4.33Å; K35-V450 HydrophobicContact CG-CG1 3.59Å; K35-V450 HydrophobicContact CG-CG2 3.76Å; K35-V450 VanDerWaalsContact O-CG1 3.27Å; K35-V450 WeakPolarHBondContact O-CG1 3.31Å; L38-V450 HydrophobicContact CB-CG1 3.9Å; L38-V450 HydrophobicContact CD2-CB 3.89Å; L38-V450 HydrophobicContact CD2-CG1 3.67Å; L38-V450 HydrophobicContact CG-CG1 4.4Å; L97-V450 HydrophobicContact CD1-CG1 4.36Å; I446-V450 HydrophobicContact CD1-CG2 3.76Å; I446-V450 HydrophobicContact CG1-CG2 3.86Å; I446-V450 VanDerWaalsContact O-CB 3.3Å; I446-V450 WeakPolarHBondContact O-CB 3.2Å; I446-V450 WeakPolarHBondContact O-CG2 3.45Å; I446-V450 PolarHBondContact O-N 3.11Å; I447-V450 PolarHBondContact O-N 3.25Å; P448-V450 PolarHBondContact O-N 2.87Å; V450-Q453 PolarHBondContact O-N 2.99Å; V450-N454 WeakPolarHBondContact O-CB 3.17Å; V450-N454 VanDerWaalsContact O-CG 3.26Å; V450-N454 PolarHBondContact O-N 2.87Å
451	L	94.3	Very high	94.5	Very high	16 Å²	16	36 Å²	36	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-45.7	175.9	-73.6	175.1	0	0	0	112.1	L38 I447 P448 S455 L481	L38-L451 HydrophobicContact CD2-CD2 4.15Å; L38-L451 HydrophobicContact CD2-CG 4.11Å; L38-L451 HydrophobicContact CG-CD2 4.07Å; I447-L451 HydrophobicContact CG2-CD1 3.94Å; I447-L451 HydrophobicContact CG2-CG 4.46Å; I447-L451 WeakPolarHBondContact O-CB 3.3Å; I447-L451 VanDerWaalsContact O-CG 3.31Å; I447-L451 WeakPolarHBondContact O-CG 3.49Å; I447-L451 PolarHBondContact O-N 3.01Å; P448-L451 PolarHBondContact O-N 3.12Å; L451-S455 WeakPolarHBondContact O-CB 3.35Å; L451-S455 PolarHBondContact O-N 3.48Å; L451-S455 PolarHBondContact O-OG 2.88Å; L451-L481 HydrophobicContact CB-CD2 3.95Å; L451-L481 HydrophobicContact CD2-CD2 4.47Å
452	A	94.7	Very high	94.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-45.8	175.1	0	0	0	0	0	111.6	P448 N454 S455 G456 Y457 T462 V479	P448-A452 WeakPolarHBondContact O-CB 3.29Å; P448-A452 PolarHBondContact O-N 3.29Å; A452-N454 PolarHBondContact O-N 3.28Å; A452-S455 CarbonylContact O-C 3.56Å; A452-S455 PolarHBondContact O-N 3.24Å; A452-S455 VanDerWaalsContact O-N 3.09Å; A452-G456 PolarHBondContact O-N 2.84Å; A452-Y457 PolarHBondContact O-N 3.45Å; A452-Y457 VanDerWaalsContact O-N 3.11Å; A452-T462 HydrophobicContact CB-CG2 4.22Å; A452-T462 VanDerWaalsContact CB-OG1 3.3Å; A452-T462 WeakPolarHBondContact CB-OG1 3.15Å; A452-V479 HydrophobicContact CB-CG1 4.47Å
453	Q	94.2	Very high	94.3	Very high	90 Å²	90	35.2 Å²	35.2	42%	0.421	19%	0.192	S	C	.	.	H	α-helix	trans	-63.1	-42.4	179.3	-177.1	171.7	1.7	0	0	112.8	K449 V450 S455 G456 P459	K449-Q453 WeakPolarHBondContact O-CB 3.28Å; K449-Q453 PolarHBondContact O-N 3.44Å; V450-Q453 PolarHBondContact O-N 2.99Å; Q453-S455 PolarHBondContact O-N 3.29Å; Q453-G456 PolarHBondContact O-N 3.42Å; Q453-G456 VanDerWaalsContact O-N 3.08Å; Q453-P459 HydrophobicContact CB-CB 4.49Å
454	N	94	Very high	94.2	Very high	38 Å²	38	39.1 Å²	39.1	20%	0.203	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-21.8	176.9	-72.2	-11.2	0	0	0	112.1	K35 L38 V450 A452 G456	K35-N454 PolarHBondContact O-ND2 3.49Å; L38-N454 PolarHBondContact O-ND2 2.95Å; V450-N454 WeakPolarHBondContact O-CB 3.17Å; V450-N454 VanDerWaalsContact O-CG 3.26Å; V450-N454 PolarHBondContact O-N 2.87Å; A452-N454 PolarHBondContact O-N 3.28Å; N454-G456 VanDerWaalsContact C-N 3.34Å
455	S	92.6	Very high	94.1	Very high	24 Å²	24	42.7 Å²	42.7	17%	0.168	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.9	175	-52.6	0	0	0	0	113	L451 A452 Q453 L481	L451-S455 WeakPolarHBondContact O-CB 3.35Å; L451-S455 PolarHBondContact O-N 3.48Å; L451-S455 PolarHBondContact O-OG 2.88Å; A452-S455 CarbonylContact O-C 3.56Å; A452-S455 PolarHBondContact O-N 3.24Å; A452-S455 VanDerWaalsContact O-N 3.09Å; Q453-S455 PolarHBondContact O-N 3.29Å; S455-L481 WeakPolarHBondContact OG-CD2 3.08Å
456	G	93	Very high	93.9	Very high	69 Å²	69	42.6 Å²	42.6	71%	0.711	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.9	7.2	177.1	0	0	0	0	0	115.1	A452 Q453 N454	A452-G456 PolarHBondContact O-N 2.84Å; Q453-G456 PolarHBondContact O-N 3.42Å; Q453-G456 VanDerWaalsContact O-N 3.08Å; N454-G456 VanDerWaalsContact C-N 3.34Å
457	Y	94.3	Very high	93.7	Very high	76 Å²	76	44.1 Å²	44.1	30%	0.298	24%	0.238	S	C	.	.	S	Bend	trans	-91	162	176.4	-57.7	-71.7	0	0	0	111.7	A452 P459 S482 S483	A452-Y457 PolarHBondContact O-N 3.45Å; A452-Y457 VanDerWaalsContact O-N 3.11Å; Y457-P459 VanDerWaalsContact O-CD 3.27Å; Y457-P459 WeakPolarHBondContact O-CD 3.06Å; Y457-S482 PolarHBondContact OH-O 3.35Å; Y457-S483 VanDerWaalsContact CE1-O 3.28Å; Y457-S483 WeakPolarHBondContact CE1-O 3.33Å; Y457-S483 PolarHBondContact OH-N 3.34Å
458	D	94.6	Very high	93.5	Very high	86 Å²	86	47 Å²	47	46%	0.46	26%	0.256	S	S	.	.			trans	-69.6	115.9	172.7	-177	1.2	0	0	0	110.1	M460 E461 T462	D458-M460 PolarHBondContact O-N 3Å; D458-M460 PolarHBondContact OD1-N 2.95Å; D458-E461 HydrophobicContact CB-CB 4.15Å; D458-T462 WeakPolarHBondContact O-CG2 3.38Å; D458-T462 PolarHBondContact O-N 2.91Å; D458-T462 PolarHBondContact O-OG1 3.26Å
459	P	92.9	Very high	93.3	Very high	29 Å²	29	50.2 Å²	50.2	19%	0.188	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-24.6	-179.5	26.8	-36.9	0	0	0	113.7	K449 Q453 Y457 T462 L463	K449-P459 HydrophobicContact CB-CB 4.17Å; K449-P459 HydrophobicContact CG-CB 4.42Å; K449-P459 WeakPolarHBondContact O-CB 3.36Å; Q453-P459 HydrophobicContact CB-CB 4.49Å; Y457-P459 VanDerWaalsContact O-CD 3.27Å; Y457-P459 WeakPolarHBondContact O-CD 3.06Å; P459-T462 WeakPolarHBondContact CA-OG1 3.2Å; P459-T462 PolarHBondContact O-OG1 3.11Å; P459-L463 WeakPolarHBondContact O-CB 3.13Å; P459-L463 PolarHBondContact O-N 3.21Å
460	M	92.8	Very high	93.1	Very high	118 Å²	118	49.7 Å²	49.7	58%	0.581	27%	0.268	S	S	*	.	H	α-helix	trans	-80.4	-46.8	-179.3	-68	-60.9	-174.5	0	0	111.6	D458 L463 V464	D458-M460 PolarHBondContact O-N 3Å; D458-M460 PolarHBondContact OD1-N 2.95Å; M460-L463 PolarHBondContact O-N 2.95Å; M460-V464 WeakPolarHBondContact O-CG2 3.27Å; M460-V464 PolarHBondContact O-N 2.67Å; M460-V464 VanDerWaalsContact O-N 3.08Å
461	E	93.6	Very high	92.8	Very high	106 Å²	106	56.2 Å²	56.2	50%	0.495	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-47.5	178.5	-170.4	-172.5	160	0	0	111.5	D458 L463 V464 K465	D458-E461 HydrophobicContact CB-CB 4.15Å; E461-L463 PolarHBondContact O-N 2.86Å; E461-V464 PolarHBondContact O-N 2.81Å; E461-K465 WeakPolarHBondContact O-CG 3.49Å; E461-K465 PolarHBondContact O-N 3.13Å; E461-K465 VanDerWaalsContact O-N 3.09Å; E461-K465 WeakPolarHBondContact OE1-CE 3.35Å; E461-K465 IonicContact OE1-NZ 2.7Å; E461-K465 PolarHBondContact OE1-NZ 3.33Å
462	T	92.9	Very high	92.6	Very high	9 Å²	9	63.5 Å²	63.5	6%	0.055	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-44.3	178.5	50.4	0	0	0	0	111.9	A452 D458 P459 V464 K465 L466 G484	A452-T462 HydrophobicContact CB-CG2 4.22Å; A452-T462 VanDerWaalsContact CB-OG1 3.3Å; A452-T462 WeakPolarHBondContact CB-OG1 3.15Å; D458-T462 WeakPolarHBondContact O-CG2 3.38Å; D458-T462 PolarHBondContact O-N 2.91Å; D458-T462 PolarHBondContact O-OG1 3.26Å; P459-T462 WeakPolarHBondContact CA-OG1 3.2Å; P459-T462 PolarHBondContact O-OG1 3.11Å; T462-V464 PolarHBondContact O-N 2.82Å; T462-K465 PolarHBondContact O-N 2.9Å; T462-L466 VanDerWaalsContact O-CG 3.3Å; T462-L466 WeakPolarHBondContact O-CG 3.46Å; T462-L466 PolarHBondContact O-N 2.91Å; T462-G484 WeakPolarHBondContact CG2-O 3.2Å
463	L	93.2	Very high	92.1	Very high	13 Å²	13	66 Å²	66	7%	0.068	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-42.6	177.5	-174.2	80.2	0	0	0	112.7	L445 P448 K449 P459 M460 E461 K465 L466 Q467	L445-L463 HydrophobicContact CB-CD1 4.11Å; L445-L463 HydrophobicContact CD1-CD1 4.18Å; L445-L463 HydrophobicContact CD1-CD2 4.13Å; L445-L463 HydrophobicContact CD2-CD1 4.09Å; L445-L463 HydrophobicContact CG-CD1 4.36Å; P448-L463 HydrophobicContact CG-CD1 4.2Å; K449-L463 HydrophobicContact CD-CD2 4.49Å; K449-L463 HydrophobicContact CG-CD1 4.31Å; K449-L463 HydrophobicContact CG-CD2 4.34Å; P459-L463 WeakPolarHBondContact O-CB 3.13Å; P459-L463 PolarHBondContact O-N 3.21Å; M460-L463 PolarHBondContact O-N 2.95Å; E461-L463 PolarHBondContact O-N 2.86Å; L463-K465 VanDerWaalsContact C-N 3.34Å; L463-L466 PolarHBondContact O-N 3.19Å; L463-Q467 WeakPolarHBondContact O-CB 3.08Å; L463-Q467 WeakPolarHBondContact O-CG 3.46Å; L463-Q467 PolarHBondContact O-N 3.38Å
464	V	94	Very high	91.5	Very high	83 Å²	83	64.5 Å²	64.5	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-45.2	177.8	171.5	0	0	0	0	110.1	M460 E461 T462 L466 Q467 T468	M460-V464 WeakPolarHBondContact O-CG2 3.27Å; M460-V464 PolarHBondContact O-N 2.67Å; M460-V464 VanDerWaalsContact O-N 3.08Å; E461-V464 PolarHBondContact O-N 2.81Å; T462-V464 PolarHBondContact O-N 2.82Å; V464-L466 PolarHBondContact O-N 2.88Å; V464-Q467 PolarHBondContact O-N 3.34Å; V464-T468 HydrophobicContact CG1-CG2 4.45Å; V464-T468 WeakPolarHBondContact O-CG2 3.49Å; V464-T468 PolarHBondContact O-N 3.4Å; V464-T468 PolarHBondContact O-OG1 2.79Å; V464-T468 VanDerWaalsContact O-OG1 3.08Å
465	K	92.7	Very high	91.1	Very high	77 Å²	77	67.6 Å²	67.6	34%	0.335	37%	0.369	S	S	.	.	H	α-helix	trans	-58.7	-46.2	176.6	-69.7	176.5	-177.1	171.2	0	112.3	E461 T462 L463 Q467 T468 E469 P486	E461-K465 WeakPolarHBondContact O-CG 3.49Å; E461-K465 PolarHBondContact O-N 3.13Å; E461-K465 VanDerWaalsContact O-N 3.09Å; E461-K465 WeakPolarHBondContact OE1-CE 3.35Å; E461-K465 IonicContact OE1-NZ 2.7Å; E461-K465 PolarHBondContact OE1-NZ 3.33Å; T462-K465 PolarHBondContact O-N 2.9Å; L463-K465 VanDerWaalsContact C-N 3.34Å; K465-Q467 VanDerWaalsContact C-N 3.34Å; K465-Q467 PolarHBondContact O-N 2.96Å; K465-T468 WeakPolarHBondContact CA-OG1 3.44Å; K465-T468 PolarHBondContact O-N 2.97Å; K465-T468 PolarHBondContact O-OG1 3.41Å; K465-E469 WeakPolarHBondContact O-CB 3.33Å; K465-E469 PolarHBondContact O-N 3.31Å; K465-P486 HydrophobicContact CB-CG 3.8Å
466	L	91.3	Very high	90.8	Very high	2 Å²	2	68 Å²	68	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-59.1	-45.3	176	-66.9	166.9	0	0	0	111.8	V416 P448 T462 L463 V464 E469 Y470 V477 G478 V479 P486	V416-L466 HydrophobicContact CG2-CB 4.37Å; V416-L466 HydrophobicContact CG2-CD1 4.36Å; P448-L466 HydrophobicContact CB-CD1 4.11Å; T462-L466 VanDerWaalsContact O-CG 3.3Å; T462-L466 WeakPolarHBondContact O-CG 3.46Å; T462-L466 PolarHBondContact O-N 2.91Å; L463-L466 PolarHBondContact O-N 3.19Å; V464-L466 PolarHBondContact O-N 2.88Å; L466-E469 PolarHBondContact O-N 3.39Å; L466-Y470 WeakPolarHBondContact O-CB 3.2Å; L466-Y470 PolarHBondContact O-N 3.48Å; L466-V477 HydrophobicContact CD2-CG1 4.21Å; L466-G478 VanDerWaalsContact CD2-C 3.45Å; L466-G478 VanDerWaalsContact CD2-O 3.25Å; L466-G478 WeakPolarHBondContact CD2-O 3.44Å; L466-V479 HydrophobicContact CD1-CG2 3.3Å; L466-V479 HydrophobicContact CD2-CG2 4.08Å; L466-V479 HydrophobicContact CG-CG2 4.19Å; L466-P486 HydrophobicContact CD2-CB 3.91Å; L466-P486 HydrophobicContact CD2-CG 4.36Å
467	Q	90.8	Very high	90.7	Very high	40 Å²	40	64.7 Å²	64.7	19%	0.187	34%	0.335	C	S	.	.	H	α-helix	trans	-68.2	-37.5	-178.5	-74.4	-177.8	-11.4	0	0	112.3	V416 H419 L463 V464 K465 K471	V416-Q467 HydrophobicContact CG1-CG 4.32Å; H419-Q467 PolarHBondContact CE1-NE2 3.37Å; L463-Q467 WeakPolarHBondContact O-CB 3.08Å; L463-Q467 WeakPolarHBondContact O-CG 3.46Å; L463-Q467 PolarHBondContact O-N 3.38Å; V464-Q467 PolarHBondContact O-N 3.34Å; K465-Q467 VanDerWaalsContact C-N 3.34Å; K465-Q467 PolarHBondContact O-N 2.96Å; Q467-K471 WeakPolarHBondContact O-CB 3.21Å; Q467-K471 VanDerWaalsContact O-CG 3.22Å; Q467-K471 WeakPolarHBondContact O-CG 3.47Å; Q467-K471 PolarHBondContact O-N 2.78Å; Q467-K471 VanDerWaalsContact O-N 3.16Å
468	T	92.1	Very high	90.6	Very high	66 Å²	66	61.1 Å²	61.1	41%	0.405	32%	0.321	S	S	.	.	H	α-helix	trans	-66.5	-47.1	175.3	46.6	0	0	0	0	110.7	V464 K465 Y470 K471 E472	V464-T468 HydrophobicContact CG1-CG2 4.45Å; V464-T468 WeakPolarHBondContact O-CG2 3.49Å; V464-T468 PolarHBondContact O-N 3.4Å; V464-T468 PolarHBondContact O-OG1 2.79Å; V464-T468 VanDerWaalsContact O-OG1 3.08Å; K465-T468 WeakPolarHBondContact CA-OG1 3.44Å; K465-T468 PolarHBondContact O-N 2.97Å; K465-T468 PolarHBondContact O-OG1 3.41Å; T468-Y470 PolarHBondContact O-N 3.47Å; T468-K471 PolarHBondContact O-N 3.08Å; T468-E472 WeakPolarHBondContact O-CG 3.32Å; T468-E472 PolarHBondContact O-N 3.34Å
469	E	91.4	Very high	90.5	Very high	71 Å²	71	57.1 Å²	57.1	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-68.9	-38.5	-177.1	-164.5	167.2	145.7	0	0	112.3	K465 L466 K471 E472 S473 V477 P486	K465-E469 WeakPolarHBondContact O-CB 3.33Å; K465-E469 PolarHBondContact O-N 3.31Å; L466-E469 PolarHBondContact O-N 3.39Å; E469-K471 VanDerWaalsContact C-N 3.32Å; E469-K471 PolarHBondContact O-N 2.98Å; E469-E472 PolarHBondContact O-N 3.14Å; E469-S473 WeakPolarHBondContact O-CB 3.4Å; E469-S473 PolarHBondContact O-N 3.33Å; E469-S473 PolarHBondContact O-OG 3.04Å; E469-V477 HydrophobicContact CG-CG2 4.28Å; E469-P486 HydrophobicContact CB-CB 4.37Å; E469-P486 WeakPolarHBondContact OE2-CB 3.42Å; E469-P486 WeakPolarHBondContact OE2-CG 3.25Å
470	Y	90.7	Very high	90.5	Very high	30 Å²	30	57.9 Å²	57.9	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-41.3	172.3	-179.9	-98.2	0	0	0	111.8	V416 A417 D420 L466 T468 G474 Q475 L476	V416-Y470 HydrophobicContact CG1-CD1 4.44Å; V416-Y470 HydrophobicContact CG1-CG 4.14Å; A417-Y470 HydrophobicContact CB-CD2 4.45Å; A417-Y470 HydrophobicContact CB-CE1 4.37Å; A417-Y470 HydrophobicContact CB-CE2 3.6Å; A417-Y470 WeakPolarHBondContact CB-OH 3.45Å; D420-Y470 HydrophobicContact CB-CD1 4.24Å; D420-Y470 HydrophobicContact CB-CE1 3.83Å; L466-Y470 WeakPolarHBondContact O-CB 3.2Å; L466-Y470 PolarHBondContact O-N 3.48Å; T468-Y470 PolarHBondContact O-N 3.47Å; Y470-G474 VanDerWaalsContact O-CA 3.27Å; Y470-G474 WeakPolarHBondContact O-CA 3.39Å; Y470-G474 PolarHBondContact O-N 3.01Å; Y470-Q475 WeakPolarHBondContact CD2-O 3.39Å; Y470-L476 HydrophobicContact CE2-CD2 4.32Å
471	K	89.1	Confident	90.3	Very high	137 Å²	137	53.8 Å²	53.8	60%	0.596	28%	0.283	S	S	*	.	H	α-helix	trans	-69.3	-34	178.6	-77.7	175.6	-178.6	178	0	113.2	D420 Q467 T468 E469	D420-K471 WeakPolarHBondContact OD1-CE 3.12Å; Q467-K471 WeakPolarHBondContact O-CB 3.21Å; Q467-K471 VanDerWaalsContact O-CG 3.22Å; Q467-K471 WeakPolarHBondContact O-CG 3.47Å; Q467-K471 PolarHBondContact O-N 2.78Å; Q467-K471 VanDerWaalsContact O-N 3.16Å; T468-K471 PolarHBondContact O-N 3.08Å; E469-K471 VanDerWaalsContact C-N 3.32Å; E469-K471 PolarHBondContact O-N 2.98Å
472	E	89.2	Confident	90.1	Very high	170 Å²	170	53 Å²	53	79%	0.794	29%	0.289	S	S	*	.	H	α-helix	trans	-79.1	-45.6	180	-72.4	177.5	-177.7	0	0	112.2	T468 E469	T468-E472 WeakPolarHBondContact O-CG 3.32Å; T468-E472 PolarHBondContact O-N 3.34Å; E469-E472 PolarHBondContact O-N 3.14Å
473	S	84.6	Confident	89.9	Confident	53 Å²	53	54.9 Å²	54.9	37%	0.371	30%	0.302	S	S	.	.	H	α-helix	trans	-88.5	-30.1	-174.7	66.6	0	0	0	0	113.7	E469 Q475	E469-S473 WeakPolarHBondContact O-CB 3.4Å; E469-S473 PolarHBondContact O-N 3.33Å; E469-S473 PolarHBondContact O-OG 3.04Å; S473-Q475 PolarHBondContact O-N 3.43Å; S473-Q475 VanDerWaalsContact O-N 3.17Å; S473-Q475 PolarHBondContact OG-N 3.48Å; S473-Q475 VanDerWaalsContact OG-N 3.14Å
474	G	81.1	Confident	89.6	Confident	57 Å²	57	54.5 Å²	54.5	59%	0.588	30%	0.302	S	S	*	.			trans	63.6	6.8	-166.9	0	0	0	0	0	114.2	Y470	Y470-G474 VanDerWaalsContact O-CA 3.27Å; Y470-G474 WeakPolarHBondContact O-CA 3.39Å; Y470-G474 PolarHBondContact O-N 3.01Å
475	Q	85.3	Confident	89.5	Confident	104 Å²	104	56.3 Å²	56.3	49%	0.486	31%	0.305	S	S	.	.	S	Bend	trans	-86.5	157.2	178.6	-67.7	-174.8	-20.5	0	0	110.9	Y470 S473 V477	Y470-Q475 WeakPolarHBondContact CD2-O 3.39Å; S473-Q475 PolarHBondContact O-N 3.43Å; S473-Q475 VanDerWaalsContact O-N 3.17Å; S473-Q475 PolarHBondContact OG-N 3.48Å; S473-Q475 VanDerWaalsContact OG-N 3.14Å; Q475-V477 HydrophobicContact CB-CG2 4.42Å; Q475-V477 WeakPolarHBondContact O-CG2 3.48Å; Q475-V477 PolarHBondContact O-N 2.82Å
476	L	88.1	Confident	89.4	Confident	32 Å²	32	53.9 Å²	53.9	17%	0.168	30%	0.297	C	S	.	.			trans	-77.7	90.7	178.5	-65.7	172.4	0	0	0	110.5	M137 S409 A413 A417 Y470 A489	M137-L476 HydrophobicContact SD-CD2 4.1Å; S409-L476 WeakPolarHBondContact OG-CD1 3.45Å; A413-L476 HydrophobicContact CB-CB 4.19Å; A417-L476 HydrophobicContact CB-CD2 3.89Å; Y470-L476 HydrophobicContact CE2-CD2 4.32Å; L476-A489 PolarHBondContact O-N 3.21Å
477	V	90.6	Very high	89.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.8	-177.7	-170.9	0	0	0	0	110.9	A413 L466 E469 Q475 P486 M487	A413-V477 VanDerWaalsContact CA-O 3.29Å; A413-V477 WeakPolarHBondContact CA-O 3.2Å; A413-V477 WeakPolarHBondContact CB-O 3.36Å; L466-V477 HydrophobicContact CD2-CG1 4.21Å; E469-V477 HydrophobicContact CG-CG2 4.28Å; Q475-V477 HydrophobicContact CB-CG2 4.42Å; Q475-V477 WeakPolarHBondContact O-CG2 3.48Å; Q475-V477 PolarHBondContact O-N 2.82Å; V477-P486 HydrophobicContact CG1-CB 3.31Å; V477-M487 CarbonylContact C-O 3.54Å; V477-M487 WeakPolarHBondContact CA-O 3.2Å
478	G	91.2	Very high	89.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-179.4	176.6	0	0	0	0	0	112.5	A411 L466 P486 M487	A411-G478 WeakPolarHBondContact O-CA 3.33Å; L466-G478 VanDerWaalsContact CD2-C 3.45Å; L466-G478 VanDerWaalsContact CD2-O 3.25Å; L466-G478 WeakPolarHBondContact CD2-O 3.44Å; G478-P486 WeakPolarHBondContact O-CA 3.47Å; G478-M487 PolarHBondContact N-O 2.95Å; G478-M487 WeakPolarHBondContact O-CG 3.46Å; G478-M487 PolarHBondContact O-N 2.85Å
479	V	92.3	Very high	89.3	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.018	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.9	-179.4	-178.3	0	0	0	0	110.9	A411 P448 A452 L466 L481	A411-V479 PolarHBondContact O-N 2.73Å; P448-V479 HydrophobicContact CB-CG2 4.09Å; A452-V479 HydrophobicContact CB-CG1 4.47Å; L466-V479 HydrophobicContact CD1-CG2 3.3Å; L466-V479 HydrophobicContact CD2-CG2 4.08Å; L466-V479 HydrophobicContact CG-CG2 4.19Å; V479-L481 HydrophobicContact CG1-CD2 4.17Å
480	D	92.8	Very high	89	Confident	44 Å²	44	50.4 Å²	50.4	24%	0.235	28%	0.283	C	S	.	.			trans	-78	123.7	162.7	-176.8	14	0	0	0	110.4	S482 S483 G484 E485 M487	D480-S482 VanDerWaalsContact C-N 3.26Å; D480-S482 PolarHBondContact O-N 2.92Å; D480-S482 PolarHBondContact OD1-N 3.31Å; D480-S483 WeakPolarHBondContact CB-OG 3.23Å; D480-S483 VanDerWaalsContact CG-OG 3.31Å; D480-S483 WeakPolarHBondContact OD2-CB 3.34Å; D480-S483 PolarHBondContact OD2-N 3.49Å; D480-S483 PolarHBondContact OD2-OG 3Å; D480-G484 VanDerWaalsContact O-CA 3.22Å; D480-G484 WeakPolarHBondContact O-CA 3.45Å; D480-G484 PolarHBondContact O-N 3.39Å; D480-E485 WeakPolarHBondContact CB-O 3.04Å; D480-E485 PolarHBondContact N-O 3.4Å; D480-M487 WeakPolarHBondContact CA-SD 3.46Å; D480-M487 HydrophobicContact CB-CB 4.25Å; D480-M487 HydrophobicContact CB-CG 3.84Å; D480-M487 HydrophobicContact CB-SD 3.41Å; D480-M487 WeakPolarHBondContact CB-SD 3.44Å
481	L	88.9	Confident	88.8	Confident	33 Å²	33	56.7 Å²	56.7	17%	0.173	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-7.2	-177.4	-52.9	175.2	0	0	0	112.7	P40 K41 L451 S455 V479	P40-L481 HydrophobicContact CG-CD1 3.14Å; K41-L481 HydrophobicContact CG-CB 4.19Å; L451-L481 HydrophobicContact CB-CD2 3.95Å; L451-L481 HydrophobicContact CD2-CD2 4.47Å; S455-L481 WeakPolarHBondContact OG-CD2 3.08Å; V479-L481 HydrophobicContact CG1-CD2 4.17Å
482	S	89.5	Confident	88.7	Confident	89 Å²	89	52.7 Å²	52.7	62%	0.622	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-28.8	178	-55.1	0	0	0	0	114	Y457 D480	Y457-S482 PolarHBondContact OH-O 3.35Å; D480-S482 VanDerWaalsContact C-N 3.26Å; D480-S482 PolarHBondContact O-N 2.92Å; D480-S482 PolarHBondContact OD1-N 3.31Å
483	S	89.3	Confident	88.6	Confident	48 Å²	48	44.9 Å²	44.9	34%	0.336	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-25.9	179.9	61.2	0	0	0	0	113.1	Y457 D480 E485	Y457-S483 VanDerWaalsContact CE1-O 3.28Å; Y457-S483 WeakPolarHBondContact CE1-O 3.33Å; Y457-S483 PolarHBondContact OH-N 3.34Å; D480-S483 WeakPolarHBondContact CB-OG 3.23Å; D480-S483 VanDerWaalsContact CG-OG 3.31Å; D480-S483 WeakPolarHBondContact OD2-CB 3.34Å; D480-S483 PolarHBondContact OD2-N 3.49Å; D480-S483 PolarHBondContact OD2-OG 3Å; S483-E485 PolarHBondContact OG-N 2.82Å; S483-E485 VanDerWaalsContact OG-N 3.16Å
484	G	87.2	Confident	89	Confident	6 Å²	6	44.1 Å²	44.1	6%	0.062	26%	0.264	C	S	.	.			trans	75.6	7.6	-168.8	0	0	0	0	0	113.1	T462 D480	T462-G484 WeakPolarHBondContact CG2-O 3.2Å; D480-G484 VanDerWaalsContact O-CA 3.22Å; D480-G484 WeakPolarHBondContact O-CA 3.45Å; D480-G484 PolarHBondContact O-N 3.39Å
485	E	91.4	Very high	89.5	Confident	120 Å²	120	42 Å²	42	56%	0.561	24%	0.238	S	C	*	.	S	Bend	trans	-90.6	157.5	178.5	-63.3	-169.4	157.9	0	0	111.7	D480 S483	D480-E485 WeakPolarHBondContact CB-O 3.04Å; D480-E485 PolarHBondContact N-O 3.4Å; S483-E485 PolarHBondContact OG-N 2.82Å; S483-E485 VanDerWaalsContact OG-N 3.16Å
486	P	91.1	Very high	89.9	Confident	26 Å²	26	39 Å²	39	17%	0.169	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	138.6	172.1	-16.9	32.4	0	0	0	110.6	K465 L466 E469 V477 G478	K465-P486 HydrophobicContact CB-CG 3.8Å; L466-P486 HydrophobicContact CD2-CB 3.91Å; L466-P486 HydrophobicContact CD2-CG 4.36Å; E469-P486 HydrophobicContact CB-CB 4.37Å; E469-P486 WeakPolarHBondContact OE2-CB 3.42Å; E469-P486 WeakPolarHBondContact OE2-CG 3.25Å; V477-P486 HydrophobicContact CG1-CB 3.31Å; G478-P486 WeakPolarHBondContact O-CA 3.47Å
487	M	92.5	Very high	90.2	Very high	36 Å²	36	37.8 Å²	37.8	18%	0.177	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	143.8	179.3	57.3	171.4	-78.8	0	0	111.1	V477 G478 D480 A489 A492 V494	V477-M487 CarbonylContact C-O 3.54Å; V477-M487 WeakPolarHBondContact CA-O 3.2Å; G478-M487 PolarHBondContact N-O 2.95Å; G478-M487 WeakPolarHBondContact O-CG 3.46Å; G478-M487 PolarHBondContact O-N 2.85Å; D480-M487 WeakPolarHBondContact CA-SD 3.46Å; D480-M487 HydrophobicContact CB-CB 4.25Å; D480-M487 HydrophobicContact CB-CG 3.84Å; D480-M487 HydrophobicContact CB-SD 3.41Å; D480-M487 WeakPolarHBondContact CB-SD 3.44Å; M487-A489 PolarHBondContact O-N 3.32Å; M487-A489 VanDerWaalsContact O-N 3.1Å; M487-A492 HydrophobicContact CE-CB 2.97Å; M487-V494 HydrophobicContact CE-CG2 4.36Å
488	V	91	Very high	90.3	Very high	28 Å²	28	38.9 Å²	38.9	17%	0.17	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	109.5	173.4	-177.1	0	0	0	0	109.1	S490 E491 A492	V488-S490 VanDerWaalsContact C-N 3.25Å; V488-S490 PolarHBondContact O-N 3.11Å; V488-E491 HydrophobicContact CB-CB 4.36Å; V488-E491 HydrophobicContact CB-CG 4.16Å; V488-E491 HydrophobicContact CG1-CB 4.43Å; V488-E491 HydrophobicContact CG1-CG 3.92Å; V488-E491 PolarHBondContact O-N 2.78Å; V488-A492 PolarHBondContact O-N 3.38Å
489	A	87.4	Confident	90.4	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.9	-171.9	0	0	0	0	0	112.8	A411 A413 L476 M487 G493 V494	A411-A489 HydrophobicContact CB-CB 4.45Å; A413-A489 HydrophobicContact CB-CB 4.22Å; L476-A489 PolarHBondContact O-N 3.21Å; M487-A489 PolarHBondContact O-N 3.32Å; M487-A489 VanDerWaalsContact O-N 3.1Å; A489-G493 PolarHBondContact O-N 2.81Å; A489-V494 PolarHBondContact O-N 3.36Å
490	S	85.4	Confident	90.5	Very high	42 Å²	42	40.5 Å²	40.5	29%	0.294	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-37.8	177.3	-54.4	0	0	0	0	113	S409 V488 G493 W495	S409-S490 PolarHBondContact OG-OG 3.5Å; V488-S490 VanDerWaalsContact C-N 3.25Å; V488-S490 PolarHBondContact O-N 3.11Å; S490-G493 PolarHBondContact O-N 3.42Å; S490-W495 WeakPolarHBondContact OG-CH2 3.18Å
491	E	87.6	Confident	90.6	Very high	162 Å²	162	38.9 Å²	38.9	76%	0.757	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-35.8	-178.5	-67.1	-174.5	171	0	0	111.9	V488 G493	V488-E491 HydrophobicContact CB-CB 4.36Å; V488-E491 HydrophobicContact CB-CG 4.16Å; V488-E491 HydrophobicContact CG1-CB 4.43Å; V488-E491 HydrophobicContact CG1-CG 3.92Å; V488-E491 PolarHBondContact O-N 2.78Å; E491-G493 PolarHBondContact O-N 3.12Å
492	A	86.4	Confident	90.9	Very high	54 Å²	54	41.8 Å²	41.8	45%	0.446	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-3.2	173.5	0	0	0	0	0	114	M487 V488 V494	M487-A492 HydrophobicContact CE-CB 2.97Å; V488-A492 PolarHBondContact O-N 3.38Å; A492-V494 VanDerWaalsContact C-N 3.35Å; A492-V494 HydrophobicContact CB-CG2 4.27Å; A492-V494 PolarHBondContact O-N 3.43Å
493	G	87.3	Confident	91.2	Very high	5 Å²	5	40.5 Å²	40.5	5%	0.052	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	37.2	179.9	0	0	0	0	0	113.2	H150 A489 S490 E491	H150-G493 WeakPolarHBondContact CB-O 3.33Å; A489-G493 PolarHBondContact O-N 2.81Å; S490-G493 PolarHBondContact O-N 3.42Å; E491-G493 PolarHBondContact O-N 3.12Å
494	V	92.3	Very high	91.4	Very high	38 Å²	38	38.4 Å²	38.4	23%	0.23	21%	0.206	C	C	.	.			trans	-98.3	106.6	173.3	-176.1	0	0	0	0	108.5	T154 G410 A411 M487 A489 A492	T154-V494 HydrophobicContact CG2-CG1 3.81Å; G410-V494 PolarHBondContact N-O 3.5Å; A411-V494 HydrophobicContact CB-CG1 4.13Å; M487-V494 HydrophobicContact CE-CG2 4.36Å; A489-V494 PolarHBondContact O-N 3.36Å; A492-V494 VanDerWaalsContact C-N 3.35Å; A492-V494 HydrophobicContact CB-CG2 4.27Å; A492-V494 PolarHBondContact O-N 3.43Å
495	W	93	Very high	91.8	Very high	11 Å²	11	38.2 Å²	38.2	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.7	-173.2	-61.3	104.1	0	0	0	111.4	V139 V151 T154 V407 V408 S490	V139-W495 HydrophobicContact CB-CZ3 4.28Å; V139-W495 HydrophobicContact CG2-CH2 4.43Å; V139-W495 HydrophobicContact CG2-CZ3 4.1Å; V151-W495 HydrophobicContact CG2-CB 3.97Å; T154-W495 WeakPolarHBondContact CG2-O 3.47Å; T154-W495 PolarHBondContact OG1-N 2.98Å; V407-W495 HydrophobicContact CB-CB 4.36Å; V407-W495 HydrophobicContact CB-CD2 4.33Å; V407-W495 HydrophobicContact CB-CE3 3.93Å; V407-W495 HydrophobicContact CG2-CD2 3.9Å; V407-W495 HydrophobicContact CG2-CE3 3.53Å; V407-W495 HydrophobicContact CG2-CG 4.45Å; V407-W495 HydrophobicContact CG2-CZ3 3.9Å; V408-W495 WeakPolarHBondContact O-CA 3.38Å; S490-W495 WeakPolarHBondContact OG-CH2 3.18Å
496	D	92.9	Very high	91.9	Very high	41 Å²	41	36.3 Å²	36.3	22%	0.219	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	151.8	169.8	-69.8	-18.3	0	0	0	109.8	V408 G410 K501	V408-D496 PolarHBondContact N-O 3.44Å; V408-D496 PolarHBondContact O-N 3.27Å; G410-D496 WeakPolarHBondContact CA-OD2 3.47Å; D496-K501 WeakPolarHBondContact OD2-CE 3.11Å; D496-K501 IonicContact OD2-NZ 3.82Å; D496-K501 PolarHBondContact OD2-NZ 2.97Å
497	N	93.7	Very high	92.1	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	141.4	175.9	-62.6	97.8	0	0	0	112	A397 N400 A401 V500 K501	A397-N497 PolarHBondContact O-ND2 3.4Å; A397-N497 PolarHBondContact O-OD1 3.39Å; N400-N497 HydrophobicContact CB-CB 4.29Å; A401-N497 PolarHBondContact N-ND2 3.3Å; A401-N497 VanDerWaalsContact N-ND2 3.13Å; N497-V500 HydrophobicContact CB-CB 4.2Å; N497-V500 HydrophobicContact CB-CG2 3.79Å; N497-V500 PolarHBondContact O-N 3.11Å; N497-K501 PolarHBondContact O-N 3.35Å
498	Y	94.1	Very high	92.2	Very high	24 Å²	24	34 Å²	34	9%	0.094	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-48.3	176.6	169.3	-93.3	0	0	0	111.9	L134 E135 K138 V408 V500 K501 K502	L134-Y498 HydrophobicContact CD1-CD2 4.06Å; L134-Y498 HydrophobicContact CD1-CE2 4.39Å; L134-Y498 HydrophobicContact CD2-CD2 4.14Å; L134-Y498 HydrophobicContact CD2-CE2 3.9Å; L134-Y498 HydrophobicContact CG-CD2 3.86Å; L134-Y498 HydrophobicContact CG-CE2 3.68Å; E135-Y498 WeakPolarHBondContact OE2-CE2 3.42Å; E135-Y498 VanDerWaalsContact OE2-CZ 3.3Å; E135-Y498 PolarHBondContact OE2-OH 2.94Å; K138-Y498 HydrophobicContact CB-CD2 4.15Å; K138-Y498 HydrophobicContact CD-CD2 4.34Å; K138-Y498 HydrophobicContact CD-CE2 4.15Å; V408-Y498 HydrophobicContact CG2-CD2 4.42Å; Y498-V500 VanDerWaalsContact C-N 3.3Å; Y498-V500 PolarHBondContact O-N 3.15Å; Y498-K501 PolarHBondContact O-N 3.49Å; Y498-K502 HydrophobicContact CE1-CB 4.48Å; Y498-K502 HydrophobicContact CE1-CD 3.64Å; Y498-K502 WeakPolarHBondContact O-CB 3.43Å; Y498-K502 PolarHBondContact O-N 3.24Å; Y498-K502 PolarHBondContact OH-NZ 3.06Å
499	S	93	Very high	92.4	Very high	24 Å²	24	32.7 Å²	32.7	17%	0.168	17%	0.174	C	C	.	.	H	α-helix	trans	-55.6	-41.1	177.6	46.1	0	0	0	0	113.2	D404 Q503	D404-S499 WeakPolarHBondContact OD2-CB 2.99Å; D404-S499 PolarHBondContact OD2-N 3.23Å; D404-S499 PolarHBondContact OD2-OG 3.05Å; S499-Q503 WeakPolarHBondContact O-CB 3.36Å; S499-Q503 PolarHBondContact O-N 3.12Å
500	V	94.5	Very high	92.7	Very high	12 Å²	12	35.2 Å²	35.2	7%	0.073	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-53	176.7	175.7	0	0	0	0	110.4	Q84 T88 D90 N497 Y498 K502 Q503 L504	Q84-V500 PolarHBondContact NE2-O 3.41Å; T88-V500 HydrophobicContact CG2-CG2 4.43Å; D90-V500 HydrophobicContact CB-CG2 4.38Å; N497-V500 HydrophobicContact CB-CB 4.2Å; N497-V500 HydrophobicContact CB-CG2 3.79Å; N497-V500 PolarHBondContact O-N 3.11Å; Y498-V500 VanDerWaalsContact C-N 3.3Å; Y498-V500 PolarHBondContact O-N 3.15Å; V500-K502 PolarHBondContact O-N 3.13Å; V500-Q503 PolarHBondContact O-N 3.25Å; V500-L504 WeakPolarHBondContact O-CB 3.42Å; V500-L504 PolarHBondContact O-N 3.04Å
501	K	94.5	Very high	93.2	Very high	11 Å²	11	34.2 Å²	34.2	5%	0.048	18%	0.181	C	C	.	.	H	α-helix	trans	-63.8	-42.3	-179.4	-66.1	-66.1	-170.3	-175.4	0	112.4	L134 F414 E415 D496 N497 Y498 L504 L505	L134-K501 HydrophobicContact CD1-CB 4.05Å; L134-K501 HydrophobicContact CD2-CB 4.33Å; F414-K501 HydrophobicContact CD1-CD 3.87Å; F414-K501 HydrophobicContact CD1-CG 4.34Å; F414-K501 HydrophobicContact CE1-CB 4.32Å; F414-K501 HydrophobicContact CE1-CD 4.2Å; F414-K501 HydrophobicContact CE1-CG 4.48Å; E415-K501 IonicContact OE1-NZ 3.82Å; E415-K501 PolarHBondContact OE1-NZ 3.36Å; E415-K501 IonicContact OE2-NZ 2.88Å; D496-K501 WeakPolarHBondContact OD2-CE 3.11Å; D496-K501 IonicContact OD2-NZ 3.82Å; D496-K501 PolarHBondContact OD2-NZ 2.97Å; N497-K501 PolarHBondContact O-N 3.35Å; Y498-K501 PolarHBondContact O-N 3.49Å; K501-L504 PolarHBondContact O-N 3.29Å; K501-L505 WeakPolarHBondContact O-CG 3.42Å; K501-L505 PolarHBondContact O-N 3.39Å
502	K	94.9	Very high	93.5	Very high	93 Å²	93	26.5 Å²	26.5	40%	0.404	15%	0.145	S	C	.	.	H	α-helix	trans	-59.4	-50.9	178.1	-177.9	174	-172.6	163.7	0	111.6	L131 L134 Y498 V500 L504 L505 H506	L131-K502 HydrophobicContact CD2-CG 4.03Å; L134-K502 HydrophobicContact CD2-CB 3.78Å; L134-K502 HydrophobicContact CD2-CG 4.47Å; Y498-K502 HydrophobicContact CE1-CB 4.48Å; Y498-K502 HydrophobicContact CE1-CD 3.64Å; Y498-K502 WeakPolarHBondContact O-CB 3.43Å; Y498-K502 PolarHBondContact O-N 3.24Å; Y498-K502 PolarHBondContact OH-NZ 3.06Å; V500-K502 PolarHBondContact O-N 3.13Å; K502-L504 VanDerWaalsContact C-N 3.35Å; K502-L505 PolarHBondContact O-N 2.97Å; K502-H506 PolarHBondContact O-N 3.39Å; K502-H506 VanDerWaalsContact O-N 3.17Å
503	Q	94.9	Very high	93.9	Very high	62 Å²	62	24.6 Å²	24.6	29%	0.29	13%	0.128	S	C	.	.	H	α-helix	trans	-69.1	-36.3	-179.4	-169.8	65.9	4.5	0	0	111.7	T88 S499 V500 H506 S507	T88-Q503 HydrophobicContact CG2-CB 4.21Å; S499-Q503 WeakPolarHBondContact O-CB 3.36Å; S499-Q503 PolarHBondContact O-N 3.12Å; V500-Q503 PolarHBondContact O-N 3.25Å; Q503-H506 PolarHBondContact O-N 3.07Å; Q503-S507 VanDerWaalsContact O-CB 3.22Å; Q503-S507 WeakPolarHBondContact O-CB 3.34Å; Q503-S507 PolarHBondContact O-N 2.99Å; Q503-S507 PolarHBondContact O-OG 2.86Å
504	L	94.9	Very high	94.2	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-59.7	-52.1	174.8	174.9	157.6	0	0	0	111.1	I98 V500 K501 K502 H506 S507 C508	I98-L504 HydrophobicContact CD1-CD1 4.22Å; I98-L504 HydrophobicContact CD1-CD2 3.36Å; I98-L504 HydrophobicContact CD1-CG 4.19Å; V500-L504 WeakPolarHBondContact O-CB 3.42Å; V500-L504 PolarHBondContact O-N 3.04Å; K501-L504 PolarHBondContact O-N 3.29Å; K502-L504 VanDerWaalsContact C-N 3.35Å; L504-H506 VanDerWaalsContact C-N 3.3Å; L504-H506 PolarHBondContact O-N 3.08Å; L504-S507 PolarHBondContact O-N 3.17Å; L504-S507 PolarHBondContact O-OG 2.85Å; L504-C508 WeakPolarHBondContact O-CB 3.49Å; L504-C508 PolarHBondContact O-N 2.99Å; L504-C508 PolarHBondContact O-SG 2.91Å
505	L	94.8	Very high	94.3	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-58.6	-42.2	177.8	-72.2	177.9	0	0	0	112.3	A130 L131 F414 F440 L444 K501 K502 T509	A130-L505 HydrophobicContact CB-CD1 3.95Å; L131-L505 HydrophobicContact CD2-CB 4.4Å; L131-L505 HydrophobicContact CD2-CD1 4.27Å; F414-L505 HydrophobicContact CE1-CD1 4.14Å; F414-L505 HydrophobicContact CZ-CD1 3.88Å; F440-L505 HydrophobicContact CE1-CD2 4.45Å; F440-L505 HydrophobicContact CZ-CD2 4.27Å; L444-L505 HydrophobicContact CD2-CD2 3.85Å; K501-L505 WeakPolarHBondContact O-CG 3.42Å; K501-L505 PolarHBondContact O-N 3.39Å; K502-L505 PolarHBondContact O-N 2.97Å; L505-T509 WeakPolarHBondContact O-CB 3.32Å; L505-T509 PolarHBondContact O-N 3.44Å; L505-T509 PolarHBondContact O-OG1 2.93Å
506	H	94.5	Very high	94.3	Very high	81 Å²	81	27 Å²	27	38%	0.375	14%	0.139	S	C	.	.	H	α-helix	trans	-65	-53.3	178.6	-172	72.8	0	0	0	111.7	K502 Q503 L504 T509 V510	K502-H506 PolarHBondContact O-N 3.39Å; K502-H506 VanDerWaalsContact O-N 3.17Å; Q503-H506 PolarHBondContact O-N 3.07Å; L504-H506 VanDerWaalsContact C-N 3.3Å; L504-H506 PolarHBondContact O-N 3.08Å; H506-T509 PolarHBondContact O-N 3.28Å; H506-V510 VanDerWaalsContact O-CG2 3.31Å; H506-V510 WeakPolarHBondContact O-CG2 3.14Å; H506-V510 PolarHBondContact O-N 3.27Å; H506-V510 VanDerWaalsContact O-N 3.12Å
507	S	94.3	Very high	94.3	Very high	14 Å²	14	29.1 Å²	29.1	10%	0.098	15%	0.15	C	C	.	.	H	α-helix	trans	-64.4	-44	-175.6	67.1	0	0	0	0	112.7	N95 Q503 L504 T509 I511	N95-S507 PolarHBondContact ND2-OG 3.07Å; Q503-S507 VanDerWaalsContact O-CB 3.22Å; Q503-S507 WeakPolarHBondContact O-CB 3.34Å; Q503-S507 PolarHBondContact O-N 2.99Å; Q503-S507 PolarHBondContact O-OG 2.86Å; L504-S507 PolarHBondContact O-N 3.17Å; L504-S507 PolarHBondContact O-OG 2.85Å; S507-T509 PolarHBondContact O-N 2.9Å; S507-I511 WeakPolarHBondContact O-CB 3.31Å; S507-I511 VanDerWaalsContact O-CG1 3.29Å; S507-I511 WeakPolarHBondContact O-CG1 3.48Å; S507-I511 PolarHBondContact O-N 3.12Å; S507-I511 VanDerWaalsContact O-N 3.16Å
508	C	95.1	Very high	94.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.1	-46.8	177.4	-65.3	0	0	0	0	111.7	N95 I98 I99 L102 L504 A512	N95-C508 PolarHBondContact OD1-SG 2.68Å; I98-C508 HydrophobicContact CB-CB 4.49Å; I98-C508 HydrophobicContact CG2-CB 3.81Å; I99-C508 HydrophobicContact CG1-CB 3.98Å; L102-C508 HydrophobicContact CD1-CB 4.13Å; L504-C508 WeakPolarHBondContact O-CB 3.49Å; L504-C508 PolarHBondContact O-N 2.99Å; L504-C508 PolarHBondContact O-SG 2.91Å; C508-A512 WeakPolarHBondContact O-CB 3.45Å; C508-A512 PolarHBondContact O-N 2.75Å
509	T	94.8	Very high	93.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-47.9	-176.4	-49.9	0	0	0	0	111.2	F123 K127 F440 L505 H506 S507 I511 S513	F123-T509 HydrophobicContact CB-CG2 3.92Å; K127-T509 HydrophobicContact CB-CG2 3.77Å; K127-T509 HydrophobicContact CD-CG2 4.07Å; K127-T509 HydrophobicContact CG-CG2 4.18Å; F440-T509 HydrophobicContact CE2-CG2 4.25Å; F440-T509 VanDerWaalsContact CE2-OG1 3.3Å; F440-T509 WeakPolarHBondContact CE2-OG1 3.37Å; L505-T509 WeakPolarHBondContact O-CB 3.32Å; L505-T509 PolarHBondContact O-N 3.44Å; L505-T509 PolarHBondContact O-OG1 2.93Å; H506-T509 PolarHBondContact O-N 3.28Å; S507-T509 PolarHBondContact O-N 2.9Å; T509-I511 VanDerWaalsContact C-N 3.3Å; T509-I511 PolarHBondContact O-N 3.42Å; T509-S513 VanDerWaalsContact O-CB 3.25Å; T509-S513 WeakPolarHBondContact O-CB 3.4Å; T509-S513 PolarHBondContact O-N 3.46Å; T509-S513 PolarHBondContact O-OG 3.11Å; T509-S513 VanDerWaalsContact O-OG 3.05Å
510	V	94.4	Very high	93.6	Very high	52 Å²	52	37.4 Å²	37.4	32%	0.315	19%	0.193	S	C	.	.	H	α-helix	trans	-60	-43.9	-178.8	171.3	0	0	0	0	110.7	H506 N514	H506-V510 VanDerWaalsContact O-CG2 3.31Å; H506-V510 WeakPolarHBondContact O-CG2 3.14Å; H506-V510 PolarHBondContact O-N 3.27Å; H506-V510 VanDerWaalsContact O-N 3.12Å; V510-N514 WeakPolarHBondContact O-CB 3.35Å; V510-N514 PolarHBondContact O-N 2.61Å; V510-N514 PolarHBondContact O-ND2 2.91Å
511	I	94.9	Very high	93.2	Very high	22 Å²	22	39.1 Å²	39.1	11%	0.113	20%	0.202	C	C	.	.	H	α-helix	trans	-76	-42.9	-175.9	-63.7	-67	0	0	0	112	L76 I77 V80 I99 S507 T509 S513 N514 I515	L76-I511 HydrophobicContact CD2-CD1 3.94Å; L76-I511 HydrophobicContact CD2-CG2 3.64Å; I77-I511 HydrophobicContact CG1-CG2 4.48Å; V80-I511 HydrophobicContact CB-CG1 4.25Å; V80-I511 HydrophobicContact CG1-CG1 3.9Å; V80-I511 HydrophobicContact CG2-CB 4.5Å; V80-I511 HydrophobicContact CG2-CD1 3.36Å; V80-I511 HydrophobicContact CG2-CG1 3.47Å; V80-I511 VanDerWaalsContact CG2-CG1 3.47Å; V80-I511 HydrophobicContact CG2-CG2 4.38Å; I99-I511 HydrophobicContact CD1-CB 4.32Å; I99-I511 HydrophobicContact CD1-CG2 4.16Å; S507-I511 WeakPolarHBondContact O-CB 3.31Å; S507-I511 VanDerWaalsContact O-CG1 3.29Å; S507-I511 WeakPolarHBondContact O-CG1 3.48Å; S507-I511 PolarHBondContact O-N 3.12Å; S507-I511 VanDerWaalsContact O-N 3.16Å; T509-I511 VanDerWaalsContact C-N 3.3Å; T509-I511 PolarHBondContact O-N 3.42Å; I511-S513 VanDerWaalsContact C-N 3.34Å; I511-S513 PolarHBondContact O-N 2.99Å; I511-N514 PolarHBondContact O-N 3.44Å; I511-I515 HydrophobicContact CG2-CD1 3.67Å; I511-I515 HydrophobicContact CG2-CG1 4.35Å; I511-I515 WeakPolarHBondContact O-CB 3.25Å; I511-I515 VanDerWaalsContact O-CG1 3.27Å; I511-I515 WeakPolarHBondContact O-CG1 3.45Å; I511-I515 PolarHBondContact O-N 3.25Å
512	A	95.1	Very high	92.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-47.1	174.7	0	0	0	0	0	110.8	L102 L103 F123 C508 N514 I515 L516	L102-A512 HydrophobicContact CB-CB 4.08Å; L102-A512 HydrophobicContact CD1-CB 3.99Å; L103-A512 HydrophobicContact CD2-CB 4.42Å; F123-A512 HydrophobicContact CE2-CB 4.38Å; C508-A512 WeakPolarHBondContact O-CB 3.45Å; C508-A512 PolarHBondContact O-N 2.75Å; A512-N514 PolarHBondContact O-N 3.39Å; A512-I515 PolarHBondContact O-N 3.05Å; A512-L516 WeakPolarHBondContact O-CB 3.49Å; A512-L516 VanDerWaalsContact O-CG 3.28Å; A512-L516 WeakPolarHBondContact O-CG 3.25Å; A512-L516 PolarHBondContact O-N 3.31Å
513	S	94.5	Very high	92.2	Very high	13 Å²	13	47.6 Å²	47.6	9%	0.091	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-44.3	176.6	-68.9	0	0	0	0	112.4	T509 I511 I515 L516 L517	T509-S513 VanDerWaalsContact O-CB 3.25Å; T509-S513 WeakPolarHBondContact O-CB 3.4Å; T509-S513 PolarHBondContact O-N 3.46Å; T509-S513 PolarHBondContact O-OG 3.11Å; T509-S513 VanDerWaalsContact O-OG 3.05Å; I511-S513 VanDerWaalsContact C-N 3.34Å; I511-S513 PolarHBondContact O-N 2.99Å; S513-I515 PolarHBondContact O-N 3.41Å; S513-L516 PolarHBondContact O-N 3.04Å; S513-L517 VanDerWaalsContact O-CG 3.25Å; S513-L517 WeakPolarHBondContact O-CG 3.44Å; S513-L517 PolarHBondContact O-N 2.91Å
514	N	94	Very high	91.2	Very high	94 Å²	94	47.5 Å²	47.5	50%	0.503	25%	0.246	S	C	.	.	H	α-helix	trans	-63.6	-41.8	177.5	-74.5	-18.9	0	0	0	112.3	V510 I511 A512 L517 V518	V510-N514 WeakPolarHBondContact O-CB 3.35Å; V510-N514 PolarHBondContact O-N 2.61Å; V510-N514 PolarHBondContact O-ND2 2.91Å; I511-N514 PolarHBondContact O-N 3.44Å; A512-N514 PolarHBondContact O-N 3.39Å; N514-L517 PolarHBondContact O-N 3.36Å; N514-V518 WeakPolarHBondContact O-CG2 3.32Å
515	I	94.1	Very high	90.2	Very high	6 Å²	6	50.5 Å²	50.5	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-67.3	-38.8	178.5	-67.8	168.3	0	0	0	111.3	N23 T73 L76 I77 L103 I511 A512 S513 L517 V518	N23-I515 HydrophobicContact CB-CG2 3.7Å; T73-I515 HydrophobicContact CG2-CD1 3.87Å; T73-I515 HydrophobicContact CG2-CG1 4.23Å; T73-I515 HydrophobicContact CG2-CG2 3.95Å; L76-I515 HydrophobicContact CD2-CD1 4.25Å; L76-I515 HydrophobicContact CD2-CG1 4.42Å; I77-I515 HydrophobicContact CD1-CD1 4.11Å; I77-I515 HydrophobicContact CG1-CD1 3.9Å; L103-I515 HydrophobicContact CD1-CB 4.47Å; L103-I515 HydrophobicContact CD1-CD1 4.22Å; L103-I515 HydrophobicContact CD1-CG2 3.97Å; L103-I515 HydrophobicContact CD2-CB 4.28Å; L103-I515 HydrophobicContact CD2-CG2 4.05Å; I511-I515 HydrophobicContact CG2-CD1 3.67Å; I511-I515 HydrophobicContact CG2-CG1 4.35Å; I511-I515 WeakPolarHBondContact O-CB 3.25Å; I511-I515 VanDerWaalsContact O-CG1 3.27Å; I511-I515 WeakPolarHBondContact O-CG1 3.45Å; I511-I515 PolarHBondContact O-N 3.25Å; A512-I515 PolarHBondContact O-N 3.05Å; S513-I515 PolarHBondContact O-N 3.41Å; I515-L517 PolarHBondContact O-N 3.49Å; I515-V518 PolarHBondContact O-N 3.15Å
516	L	92.8	Very high	89	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-28.9	177	-75	177.8	0	0	0	113.2	L20 L103 A106 P116 I119 F123 A512 S513 V518	L20-L516 HydrophobicContact CD1-CD2 3.82Å; L103-L516 HydrophobicContact CD2-CD1 4.49Å; L103-L516 HydrophobicContact CD2-CD2 3.62Å; L103-L516 HydrophobicContact CD2-CG 3.64Å; A106-L516 HydrophobicContact CB-CD1 3.79Å; A106-L516 HydrophobicContact CB-CD2 3.76Å; A106-L516 HydrophobicContact CB-CG 4.42Å; P116-L516 HydrophobicContact CB-CB 4.45Å; P116-L516 WeakPolarHBondContact CB-O 3.31Å; I119-L516 HydrophobicContact CG2-CD1 4.15Å; F123-L516 HydrophobicContact CD2-CD1 4.13Å; F123-L516 HydrophobicContact CE2-CD1 3.54Å; F123-L516 HydrophobicContact CZ-CD1 4.35Å; A512-L516 WeakPolarHBondContact O-CB 3.49Å; A512-L516 VanDerWaalsContact O-CG 3.28Å; A512-L516 WeakPolarHBondContact O-CG 3.25Å; A512-L516 PolarHBondContact O-N 3.31Å; S513-L516 PolarHBondContact O-N 3.04Å; L516-V518 VanDerWaalsContact C-N 3.31Å
517	L	92.7	Very high	87.6	Confident	87 Å²	87	60.2 Å²	60.2	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	2.7	-179.2	-66.2	173.2	0	0	0	113.4	R117 A120 S513 N514 I515 D519	R117-L517 HydrophobicContact CB-CD2 4.09Å; R117-L517 HydrophobicContact CG-CD2 4.41Å; A120-L517 HydrophobicContact CB-CD1 4.45Å; S513-L517 VanDerWaalsContact O-CG 3.25Å; S513-L517 WeakPolarHBondContact O-CG 3.44Å; S513-L517 PolarHBondContact O-N 2.91Å; N514-L517 PolarHBondContact O-N 3.36Å; I515-L517 PolarHBondContact O-N 3.49Å; L517-D519 PolarHBondContact O-N 3.5Å
518	V	91.6	Very high	85.6	Confident	52 Å²	52	64.4 Å²	64.4	32%	0.315	37%	0.365	S	S	.	.			trans	-79	111.7	173.1	-178.7	0	0	0	0	109.7	N514 I515 L516 I521	N514-V518 WeakPolarHBondContact O-CG2 3.32Å; I515-V518 PolarHBondContact O-N 3.15Å; L516-V518 VanDerWaalsContact C-N 3.31Å; V518-I521 HydrophobicContact CG1-CG1 4.11Å
519	D	87.6	Confident	83.4	Confident	111 Å²	111	72.2 Å²	72.2	59%	0.594	41%	0.406	S	S	*	.			trans	-89.6	-37.2	176	63.6	-21.4	0	0	0	112.6	R15 A16 A19 L517	R15-D519 CarbonylContact C-O 3.55Å; A16-D519 WeakPolarHBondContact CA-O 3.46Å; A16-D519 PolarHBondContact N-O 3.13Å; A19-D519 WeakPolarHBondContact CB-O 3.15Å; L517-D519 PolarHBondContact O-N 3.5Å
520	E	87.1	Confident	80.9	Confident	65 Å²	65	80.9 Å²	80.9	30%	0.304	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.6	178.9	-63.9	-165	155.5	0	0	112.9	I4 A14 R15 M522	I4-E520 WeakPolarHBondContact CD1-OE2 3.39Å; A14-E520 WeakPolarHBondContact O-CA 3.36Å; R15-E520 HydrophobicContact CB-CG 4.5Å; R15-E520 WeakPolarHBondContact CD-OE1 3.39Å; R15-E520 HydrophobicContact CG-CG 4.13Å; R15-E520 VanDerWaalsContact CG-OE1 3.29Å; R15-E520 WeakPolarHBondContact CG-OE1 3.37Å; E520-M522 HydrophobicContact CB-CG 4.45Å
521	I	86.6	Confident	78.3	Confident	48 Å²	48	85.8 Å²	85.8	25%	0.246	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.4	169	-59.1	168.3	0	0	0	107.2	V13 A14 A19 V22 N23 V518	V13-I521 WeakPolarHBondContact CA-O 3.23Å; A14-I521 HydrophobicContact CB-CB 4.42Å; A14-I521 PolarHBondContact N-O 3.24Å; A14-I521 VanDerWaalsContact N-O 3.08Å; A14-I521 PolarHBondContact O-N 3.39Å; A19-I521 HydrophobicContact CB-CD1 4.1Å; A19-I521 HydrophobicContact CB-CG1 4Å; V22-I521 HydrophobicContact CG1-CD1 4.3Å; N23-I521 WeakPolarHBondContact OD1-CD1 3.39Å; V518-I521 HydrophobicContact CG1-CG1 4.11Å
522	M	85	Confident	77.5	Confident	96 Å²	96	89 Å²	89	47%	0.473	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	122.1	-176.5	-63.9	-179.7	62.6	0	0	110.9	I4 V13 E520 A524	I4-M522 HydrophobicContact CB-CE 4.45Å; I4-M522 HydrophobicContact CD1-CE 3.57Å; I4-M522 HydrophobicContact CD1-CG 4.22Å; I4-M522 HydrophobicContact CD1-SD 3.65Å; I4-M522 HydrophobicContact CG1-CE 3.85Å; I4-M522 HydrophobicContact CG1-SD 4.5Å; I4-M522 HydrophobicContact CG2-CE 3.72Å; V13-M522 HydrophobicContact CG1-CG 4.33Å; V13-M522 HydrophobicContact CG2-CG 4.48Å; E520-M522 HydrophobicContact CB-CG 4.45Å; M522-A524 PolarHBondContact O-N 3.39Å
523	R	82.3	Confident	76.6	Confident	187 Å²	187	93.7 Å²	93.7	71%	0.706	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.5	86.4	166.8	-162.6	180	-173.7	-174.4	2.9	109	E12	E12-R523 HydrophobicContact CB-CB 4.19Å; E12-R523 PolarHBondContact O-N 3.32Å; E12-R523 WeakPolarHBondContact OE2-CD 3.47Å; E12-R523 IonicContact OE2-NH1 3.69Å; E12-R523 PolarHBondContact OE2-NH1 3.38Å
524	A	75.1	Confident	75.6	Confident	60 Å²	60	98.2 Å²	98.2	50%	0.496	58%	0.578	S	S	.	*			trans	-134.6	95.5	176.7	0	0	0	0	0	108.7	A11 M522	A11-A524 HydrophobicContact CB-CB 4.47Å; M522-A524 PolarHBondContact O-N 3.39Å
525	G	74.1	Confident	74.5	Confident	67 Å²	67	98.4 Å²	98.4	69%	0.691	58%	0.583	S	S	*	*			trans	-122.6	151.9	172.8	0	0	0	0	0	109.8	S527	G525-S527 PolarHBondContact O-N 3.45Å
526	M	69.4	Low	73.3	Confident	190 Å²	190	104.2 Å²	104.2	94%	0.936	62%	0.617	S	S	*	*			trans	-56.3	126.5	165	-68.8	-166.5	-70.2	0	0	107.3	S528	M526-S528 PolarHBondContact O-N 2.96Å
527	S	64.1	Low	72	Confident	97 Å²	97	110.9 Å²	110.9	68%	0.678	66%	0.657	S	S	*	*			trans	-56.4	115.1	167.4	53.7	0	0	0	0	106.1	G525 L529	G525-S527 PolarHBondContact O-N 3.45Å; S527-L529 PolarHBondContact O-N 3.44Å
528	S	52.6	Low	70.5	Confident	101 Å²	101	112.6 Å²	112.6	71%	0.706	67%	0.671	S	S	*	*			trans	-60.9	92.4	167.6	172.6	0	0	0	0	106.5	M526 K530	M526-S528 PolarHBondContact O-N 2.96Å; S528-K530 PolarHBondContact O-N 2.94Å
529	L	48.8	Very low	68.8	Low	164 Å²	164	117.2 Å²	117.2	86%	0.859	70%	0.699	S	S	*	*			trans	-68.7	70.6	161.3	-86.3	152.7	0	0	0	106.6	S527	S527-L529 PolarHBondContact O-N 3.44Å
530	K	42.9	Very low	67.3	Low	183 Å²	183	117.8 Å²	117.8	80%	0.796	71%	0.707	S	S	*	*			trans	-141.2	99.9	160.6	-84.6	-166.4	175.4	-178.8	0	107.2	S528	S528-K530 PolarHBondContact O-N 2.94Å
531	G	39.4	Very low	65.5	Low	155 Å²	155	122.5 Å²	122.5	100%	1.598	74%	0.744	S	S	*	*			trans	62.1	0	148.2	0	0	0	0	0	116.5

Retrieved 531 of 531 residues in 116.2 ms (Link to these results)

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