A0A087YJX5_POEFO Loading...

RNA-binding protein 28

Nucleolar component of the spliceosomal ribonucleoprotein complexes.

AlphaFold DB , UniProt , Accession A0A087YJX5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 762 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	51.5	Low	81.2	Confident	186 Å²	186	50.3 Å²	50.3	92%	0.916	30%	0.298	S	S	*	.				0	152.3	0	-74.4	-168.6	-84.6	0	0	109.9	M54	M1-M54 HydrophobicContact CE-CE 3.68Å; M1-M54 HydrophobicContact CE-SD 3.55Å; M1-M54 VanDerWaalsContact CE-SD 3.55Å
2	P	68.3	Low	81	Confident	91 Å²	91	46.8 Å²	46.8	59%	0.591	28%	0.278	S	S	*	.			trans	-69	133.4	178	29.2	-34.5	0	0	0	111.1
3	A	78.3	Confident	80.7	Confident	50 Å²	50	52.4 Å²	52.4	41%	0.413	30%	0.3	S	S	.	.			trans	-77.6	142.9	171.4	0	0	0	0	0	110.3	K31 T51 Y52	A3-K31 HydrophobicContact CB-CD 4.13Å; A3-T51 HydrophobicContact CB-CG2 3.88Å; A3-Y52 WeakPolarHBondContact CB-O 3.05Å
4	V	86.2	Confident	80.7	Confident	25 Å²	25	55.5 Å²	55.5	15%	0.152	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.4	-174.9	177.2	0	0	0	0	110.5	T51 Y52 E55 A58 V77	V4-T51 WeakPolarHBondContact O-CA 3.48Å; V4-Y52 PolarHBondContact N-O 3.44Å; V4-Y52 PolarHBondContact O-N 3.39Å; V4-E55 HydrophobicContact CG2-CB 3.72Å; V4-E55 HydrophobicContact CG2-CG 3.87Å; V4-A58 HydrophobicContact CB-CB 4.02Å; V4-A58 HydrophobicContact CG1-CB 3.86Å; V4-V77 HydrophobicContact CG1-CG1 4.45Å
5	T	89.6	Confident	80.7	Confident	45 Å²	45	51.9 Å²	51.9	28%	0.276	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.8	178.2	-50.2	0	0	0	0	111.1	F49 V50 T51 A78	T5-F49 HydrophobicContact CG2-CB 4.02Å; T5-F49 HydrophobicContact CG2-CD1 4.09Å; T5-V50 CarbonylContact C-O 3.5Å; T5-V50 WeakPolarHBondContact CA-O 3.38Å; T5-T51 WeakPolarHBondContact CG2-OG1 3.39Å; T5-T51 PolarHBondContact OG1-OG1 3.42Å; T5-A78 HydrophobicContact CG2-CB 3.8Å; T5-A78 VanDerWaalsContact O-CB 3.29Å; T5-A78 WeakPolarHBondContact O-CB 3.39Å; T5-A78 PolarHBondContact O-N 3.17Å
6	I	89.4	Confident	80.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.2	167.5	-60	-179	0	0	0	108.6	V8 F49 V50 Y52 A58 A61 L62 L75 S76	I6-V8 HydrophobicContact CG2-CG2 4.33Å; I6-F49 WeakPolarHBondContact O-CA 3.42Å; I6-V50 PolarHBondContact N-O 3.37Å; I6-V50 PolarHBondContact O-N 3.37Å; I6-Y52 HydrophobicContact CD1-CD2 4.05Å; I6-Y52 HydrophobicContact CD1-CE2 3.78Å; I6-A58 HydrophobicContact CD1-CB 4.24Å; I6-A58 WeakPolarHBondContact CD1-O 3.29Å; I6-A58 HydrophobicContact CG1-CB 4.33Å; I6-A61 HydrophobicContact CD1-CB 3.7Å; I6-L62 HydrophobicContact CD1-CD2 4.13Å; I6-L62 HydrophobicContact CD1-CG 4.15Å; I6-L62 HydrophobicContact CG1-CD2 4.31Å; I6-L62 HydrophobicContact CG2-CD2 3.89Å; I6-L75 HydrophobicContact CG2-CB 4.17Å; I6-S76 CarbonylContact C-O 3.55Å; I6-S76 WeakPolarHBondContact CA-O 2.97Å
7	F	89.5	Confident	81.3	Confident	62 Å²	62	51.6 Å²	51.6	27%	0.272	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.5	164.9	175	-116.9	0	0	0	108.9	A9 F47 F49 L75 S76 A78	F7-A9 HydrophobicContact CD1-CB 4.41Å; F7-A9 HydrophobicContact CE1-CB 3.69Å; F7-A9 HydrophobicContact CZ-CB 3.87Å; F7-F47 HydrophobicContact CE2-CB 3.72Å; F7-F47 AromaticContact CE2-CD2 3.66Å; F7-F47 HydrophobicContact CE2-CD2 3.66Å; F7-F47 AromaticContact CE2-CG 3.9Å; F7-F47 HydrophobicContact CE2-CG 3.9Å; F7-F47 HydrophobicContact CZ-CB 3.9Å; F7-F47 HydrophobicContact CZ-CD2 4.34Å; F7-F47 HydrophobicContact CZ-CG 4.18Å; F7-F49 HydrophobicContact CB-CD1 4.37Å; F7-F49 HydrophobicContact CB-CE1 4.23Å; F7-F49 HydrophobicContact CD2-CD1 4.06Å; F7-F49 AromaticContact CD2-CE1 3.5Å; F7-F49 HydrophobicContact CD2-CE1 3.5Å; F7-F49 VanDerWaalsContact CD2-CE1 3.5Å; F7-F49 HydrophobicContact CD2-CE2 4.39Å; F7-F49 AromaticContact CD2-CZ 3.68Å; F7-F49 HydrophobicContact CD2-CZ 3.68Å; F7-F49 HydrophobicContact CE2-CE1 4.29Å; F7-F49 HydrophobicContact CE2-CZ 4.02Å; F7-F49 HydrophobicContact CG-CE1 4.28Å; F7-L75 WeakPolarHBondContact O-CA 3.35Å; F7-S76 PolarHBondContact N-O 3.36Å; F7-S76 PolarHBondContact O-N 3.13Å; F7-A78 HydrophobicContact CB-CB 4.05Å
8	V	88.2	Confident	81.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.8	179.2	-174.8	0	0	0	0	107.8	I6 L11 L20 F24 F47 G48 V50 L73 L75	I6-V8 HydrophobicContact CG2-CG2 4.33Å; V8-L11 HydrophobicContact CG1-CD1 4.05Å; V8-L11 HydrophobicContact CG1-CD2 4.13Å; V8-L11 HydrophobicContact CG1-CG 3.99Å; V8-L20 HydrophobicContact CG1-CD1 4.28Å; V8-F24 HydrophobicContact CG1-CZ 4.48Å; V8-F24 HydrophobicContact CG2-CE1 4.11Å; V8-F24 HydrophobicContact CG2-CE2 4.41Å; V8-F24 HydrophobicContact CG2-CZ 3.73Å; V8-F47 CarbonylContact O-C 3.58Å; V8-F47 WeakPolarHBondContact O-CA 3.44Å; V8-F47 VanDerWaalsContact O-CB 3.28Å; V8-F47 WeakPolarHBondContact O-CB 3.27Å; V8-G48 PolarHBondContact N-O 3.24Å; V8-G48 PolarHBondContact O-N 2.98Å; V8-V50 HydrophobicContact CG2-CG2 3.97Å; V8-L73 HydrophobicContact CG1-CD1 3.95Å; V8-L73 HydrophobicContact CG1-CD2 4.13Å; V8-L75 HydrophobicContact CB-CD2 4.1Å; V8-L75 HydrophobicContact CG1-CD2 3.74Å; V8-L75 HydrophobicContact CG2-CD2 3.98Å
9	A	84.3	Confident	81.8	Confident	17 Å²	17	58.8 Å²	58.8	14%	0.14	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	160.8	176.1	0	0	0	0	0	112.1	F7 G46 F47 S74	F7-A9 HydrophobicContact CD1-CB 4.41Å; F7-A9 HydrophobicContact CE1-CB 3.69Å; F7-A9 HydrophobicContact CZ-CB 3.87Å; A9-G46 CarbonylContact C-O 3.53Å; A9-G46 WeakPolarHBondContact CA-O 3.5Å; A9-F47 HydrophobicContact CB-CB 4.16Å; A9-S74 VanDerWaalsContact C-OG 3.3Å; A9-S74 WeakPolarHBondContact CB-OG 3.43Å; A9-S74 PolarHBondContact N-O 3.36Å; A9-S74 PolarHBondContact O-N 3.09Å; A9-S74 PolarHBondContact O-OG 3.2Å
10	S	83.7	Confident	82.1	Confident	66 Å²	66	55.9 Å²	55.9	46%	0.462	31%	0.309	S	S	.	.	S	Bend	trans	74	32.1	-168.6	-163.4	0	0	0	0	114.3	G46 K72	S10-G46 PolarHBondContact N-O 3.2Å; S10-K72 WeakPolarHBondContact CB-O 3.47Å; S10-K72 PolarHBondContact OG-O 3Å; S10-K72 VanDerWaalsContact OG-O 3.13Å
11	L	83.9	Confident	82.3	Confident	11 Å²	11	56.6 Å²	56.6	6%	0.058	31%	0.31	C	S	.	.			trans	-70.8	147.7	168.3	-72.5	164.3	0	0	0	111.2	V8 A15 L20 V35 G46 Y68 L73	V8-L11 HydrophobicContact CG1-CD1 4.05Å; V8-L11 HydrophobicContact CG1-CD2 4.13Å; V8-L11 HydrophobicContact CG1-CG 3.99Å; L11-A15 HydrophobicContact CB-CB 4.02Å; L11-A15 HydrophobicContact CD2-CB 4.12Å; L11-A15 HydrophobicContact CG-CB 4.49Å; L11-L20 HydrophobicContact CD1-CD2 4.23Å; L11-L20 HydrophobicContact CD2-CD1 4.07Å; L11-V35 HydrophobicContact CD1-CG1 4.25Å; L11-V35 HydrophobicContact CD1-CG2 4.35Å; L11-G46 PolarHBondContact N-O 3.2Å; L11-G46 WeakPolarHBondContact O-CA 3.26Å; L11-Y68 HydrophobicContact CD2-CD2 3.71Å; L11-Y68 HydrophobicContact CD2-CE2 3.95Å; L11-Y68 HydrophobicContact CD2-CG 4.06Å; L11-L73 HydrophobicContact CD2-CD2 3.72Å; L11-L73 HydrophobicContact CG-CD2 4.07Å
12	P	79.2	Confident	84.1	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.058	29%	0.291	C	S	.	.			trans	-67	158	170.7	26.4	-32.3	0	0	0	112.6	S14 A15 Y68 K71	P12-S14 PolarHBondContact O-N 3.01Å; P12-S14 VanDerWaalsContact O-N 3.12Å; P12-A15 HydrophobicContact CG-CB 4.08Å; P12-A15 WeakPolarHBondContact O-CB 3.34Å; P12-A15 PolarHBondContact O-N 2.98Å; P12-Y68 HydrophobicContact CG-CD1 3.6Å; P12-Y68 HydrophobicContact CG-CE1 3.5Å; P12-Y68 VanDerWaalsContact CG-CE1 3.5Å; P12-K71 HydrophobicContact CB-CD 4.17Å
13	E	77.8	Confident	84.9	Confident	119 Å²	119	50.1 Å²	50.1	56%	0.556	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.7	174.7	-67.9	178.8	-141	0	0	113.3	K43 C44	E13-K43 WeakPolarHBondContact OE2-CD 3.41Å; E13-K43 VanDerWaalsContact OE2-CE 3.3Å; E13-K43 WeakPolarHBondContact OE2-CE 3.32Å; E13-K43 IonicContact OE2-NZ 3.7Å; E13-K43 PolarHBondContact OE2-NZ 3.12Å; E13-C44 PolarHBondContact O-N 3.24Å
14	S	80.7	Confident	85.3	Confident	96 Å²	96	47.8 Å²	47.8	67%	0.671	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	4	179.1	58.6	0	0	0	0	114.8	P12 T16	P12-S14 PolarHBondContact O-N 3.01Å; P12-S14 VanDerWaalsContact O-N 3.12Å; S14-T16 PolarHBondContact O-N 2.94Å
15	A	80.3	Confident	85.4	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.008	26%	0.262	C	S	.	.			trans	-65.3	128.1	-178.3	0	0	0	0	0	111.8	L11 P12 C44 Y68	L11-A15 HydrophobicContact CB-CB 4.02Å; L11-A15 HydrophobicContact CD2-CB 4.12Å; L11-A15 HydrophobicContact CG-CB 4.49Å; P12-A15 HydrophobicContact CG-CB 4.08Å; P12-A15 WeakPolarHBondContact O-CB 3.34Å; P12-A15 PolarHBondContact O-N 2.98Å; A15-C44 PolarHBondContact O-SG 2.88Å; A15-Y68 WeakPolarHBondContact CA-OH 3.47Å; A15-Y68 HydrophobicContact CB-CE1 4.15Å; A15-Y68 HydrophobicContact CB-CE2 4.5Å
16	T	83.7	Confident	85.3	Confident	49 Å²	49	55.5 Å²	55.5	30%	0.301	29%	0.288	S	S	.	.			trans	-98.3	165.2	173.6	65.8	0	0	0	0	111.1	S14 R19 L20	S14-T16 PolarHBondContact O-N 2.94Å; T16-R19 VanDerWaalsContact OG1-CB 3.23Å; T16-R19 WeakPolarHBondContact OG1-CB 3.34Å; T16-R19 PolarHBondContact OG1-N 2.84Å; T16-L20 PolarHBondContact O-N 2.69Å
17	N	87.1	Confident	85.1	Confident	50 Å²	50	56.1 Å²	56.1	27%	0.267	29%	0.291	S	S	.	.	H	α-helix	trans	-70.3	-44.7	178.1	-150.7	50.5	0	0	0	110.9	R19 L20 E21 C33 F34 V35	N17-R19 PolarHBondContact O-N 2.6Å; N17-L20 PolarHBondContact O-N 2.74Å; N17-E21 PolarHBondContact O-N 2.95Å; N17-C33 PolarHBondContact ND2-O 3.13Å; N17-C33 VanDerWaalsContact ND2-O 3.08Å; N17-C33 PolarHBondContact ND2-SG 3.13Å; N17-C33 PolarHBondContact OD1-O 3.03Å; N17-F34 WeakPolarHBondContact OD1-CA 3.46Å; N17-F34 PolarHBondContact OD1-N 2.92Å; N17-V35 PolarHBondContact OD1-N 2.89Å
18	E	87.3	Confident	84.9	Confident	142 Å²	142	53.7 Å²	53.7	66%	0.664	28%	0.284	S	S	*	.	H	α-helix	trans	-54.5	-51.1	175.6	-64.5	143.2	-162.4	0	0	111.6	L20 E21 E22	E18-L20 VanDerWaalsContact C-N 3.29Å; E18-L20 PolarHBondContact O-N 3.35Å; E18-E21 CarbonylContact O-C 3.58Å; E18-E21 WeakPolarHBondContact O-CA 3.32Å; E18-E21 WeakPolarHBondContact O-CB 3.47Å; E18-E21 PolarHBondContact O-N 3.41Å; E18-E22 PolarHBondContact O-N 2.96Å
19	R	85.8	Confident	84.8	Confident	99 Å²	99	57.5 Å²	57.5	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-67.2	-29.2	-178.5	-176.1	56.5	173.8	167.2	4.3	113	T16 N17 E22 I23 Y68 D69	T16-R19 VanDerWaalsContact OG1-CB 3.23Å; T16-R19 WeakPolarHBondContact OG1-CB 3.34Å; T16-R19 PolarHBondContact OG1-N 2.84Å; N17-R19 PolarHBondContact O-N 2.6Å; R19-E22 WeakPolarHBondContact CD-OE2 3.32Å; R19-E22 IonicContact CZ-OE2 1.78Å; R19-E22 IonicContact NE-OE2 3.5Å; R19-E22 IonicContact NH1-OE2 3.59Å; R19-E22 PolarHBondContact NH1-OE2 3.44Å; R19-I23 WeakPolarHBondContact O-CD1 3.48Å; R19-I23 WeakPolarHBondContact O-CG1 3.34Å; R19-Y68 WeakPolarHBondContact CB-OH 3.32Å; R19-Y68 HydrophobicContact CG-CE2 4.13Å; R19-Y68 WeakPolarHBondContact CG-OH 3.46Å; R19-D69 IonicContact CZ-OD1 3.79Å; R19-D69 IonicContact NE-OD1 3.66Å; R19-D69 IonicContact NH2-OD1 3.25Å; R19-D69 PolarHBondContact NH2-OD1 2.8Å
20	L	86.8	Confident	85	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-72.5	-35	170.5	-174.3	63.6	0	0	0	111.6	V8 L11 T16 N17 E18 F24 V35 V50 Y68	V8-L20 HydrophobicContact CG1-CD1 4.28Å; L11-L20 HydrophobicContact CD1-CD2 4.23Å; L11-L20 HydrophobicContact CD2-CD1 4.07Å; T16-L20 PolarHBondContact O-N 2.69Å; N17-L20 PolarHBondContact O-N 2.74Å; E18-L20 VanDerWaalsContact C-N 3.29Å; E18-L20 PolarHBondContact O-N 3.35Å; L20-F24 HydrophobicContact CD1-CD2 3.67Å; L20-F24 HydrophobicContact CD1-CE2 3.42Å; L20-F24 VanDerWaalsContact CD1-CE2 3.42Å; L20-F24 HydrophobicContact CD1-CZ 4.37Å; L20-F24 HydrophobicContact CG-CD2 4.23Å; L20-F24 HydrophobicContact CG-CE2 4.37Å; L20-F24 VanDerWaalsContact O-CD2 3.25Å; L20-F24 WeakPolarHBondContact O-CD2 3.45Å; L20-F24 PolarHBondContact O-N 3.48Å; L20-V35 HydrophobicContact CB-CG2 4.17Å; L20-V35 HydrophobicContact CD2-CG2 3.6Å; L20-V50 HydrophobicContact CD2-CG2 3.95Å; L20-V50 HydrophobicContact CG-CG2 4.1Å; L20-Y68 HydrophobicContact CB-CE2 4.45Å; L20-Y68 HydrophobicContact CD1-CD2 4.29Å; L20-Y68 HydrophobicContact CD1-CE2 4.31Å
21	E	87.8	Confident	85.2	Confident	71 Å²	71	60.5 Å²	60.5	33%	0.332	31%	0.312	S	S	.	.	H	α-helix	trans	-70.1	-41.5	177.5	-173.2	161.3	-146.8	0	0	112.5	N17 E18 I23 F24 S25 C33	N17-E21 PolarHBondContact O-N 2.95Å; E18-E21 CarbonylContact O-C 3.58Å; E18-E21 WeakPolarHBondContact O-CA 3.32Å; E18-E21 WeakPolarHBondContact O-CB 3.47Å; E18-E21 PolarHBondContact O-N 3.41Å; E21-I23 PolarHBondContact O-N 3.26Å; E21-F24 PolarHBondContact O-N 2.87Å; E21-S25 VanDerWaalsContact O-CB 3.22Å; E21-S25 WeakPolarHBondContact O-CB 3.35Å; E21-S25 PolarHBondContact O-N 2.83Å; E21-S25 PolarHBondContact O-OG 3.41Å; E21-C33 HydrophobicContact CB-CB 4.06Å; E21-C33 HydrophobicContact CG-CB 4.39Å; E21-C33 PolarHBondContact OE2-SG 2.92Å
22	E	87.6	Confident	85.1	Confident	112 Å²	112	66 Å²	66	52%	0.523	34%	0.338	S	S	.	.	H	α-helix	trans	-50	-56.6	172.1	-73	176.9	173.2	0	0	111.6	E18 R19 F24 S25 E26	E18-E22 PolarHBondContact O-N 2.96Å; R19-E22 WeakPolarHBondContact CD-OE2 3.32Å; R19-E22 IonicContact CZ-OE2 1.78Å; R19-E22 IonicContact NE-OE2 3.5Å; R19-E22 IonicContact NH1-OE2 3.59Å; R19-E22 PolarHBondContact NH1-OE2 3.44Å; E22-F24 VanDerWaalsContact C-N 3.31Å; E22-F24 PolarHBondContact O-N 2.9Å; E22-S25 PolarHBondContact O-N 3.08Å; E22-E26 PolarHBondContact O-N 3.13Å
23	I	86.1	Confident	85.5	Confident	29 Å²	29	66.2 Å²	66.2	15%	0.149	34%	0.34	C	S	.	.	H	α-helix	trans	-64.1	-36.2	-175.3	-64.2	167.2	0	0	0	111.5	R19 E21 I65 Y68	R19-I23 WeakPolarHBondContact O-CD1 3.48Å; R19-I23 WeakPolarHBondContact O-CG1 3.34Å; E21-I23 PolarHBondContact O-N 3.26Å; I23-I65 HydrophobicContact CG2-CD1 4.14Å; I23-I65 HydrophobicContact CG2-CG1 4.19Å; I23-I65 HydrophobicContact CG2-CG2 4.04Å; I23-I65 WeakPolarHBondContact O-CD1 3.48Å; I23-Y68 HydrophobicContact CD1-CD2 3.6Å; I23-Y68 HydrophobicContact CD1-CE2 3.86Å; I23-Y68 HydrophobicContact CD1-CG 4.29Å
24	F	87.1	Confident	85.9	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-84.6	-20.6	-179.3	-80.7	-109.7	0	0	0	113.1	V8 L20 E21 E22 V30 V50 Y52 A61 I65 L73 L75	V8-F24 HydrophobicContact CG1-CZ 4.48Å; V8-F24 HydrophobicContact CG2-CE1 4.11Å; V8-F24 HydrophobicContact CG2-CE2 4.41Å; V8-F24 HydrophobicContact CG2-CZ 3.73Å; L20-F24 HydrophobicContact CD1-CD2 3.67Å; L20-F24 HydrophobicContact CD1-CE2 3.42Å; L20-F24 VanDerWaalsContact CD1-CE2 3.42Å; L20-F24 HydrophobicContact CD1-CZ 4.37Å; L20-F24 HydrophobicContact CG-CD2 4.23Å; L20-F24 HydrophobicContact CG-CE2 4.37Å; L20-F24 VanDerWaalsContact O-CD2 3.25Å; L20-F24 WeakPolarHBondContact O-CD2 3.45Å; L20-F24 PolarHBondContact O-N 3.48Å; E21-F24 PolarHBondContact O-N 2.87Å; E22-F24 VanDerWaalsContact C-N 3.31Å; E22-F24 PolarHBondContact O-N 2.9Å; F24-V30 HydrophobicContact CB-CG2 4.04Å; F24-V50 HydrophobicContact CB-CG1 3.94Å; F24-V50 HydrophobicContact CD1-CB 3.92Å; F24-V50 HydrophobicContact CD1-CG1 3.72Å; F24-V50 HydrophobicContact CD1-CG2 3.88Å; F24-V50 HydrophobicContact CD2-CG2 4.39Å; F24-V50 HydrophobicContact CE1-CB 4.32Å; F24-V50 HydrophobicContact CE1-CG2 4.18Å; F24-V50 HydrophobicContact CG-CB 4.41Å; F24-V50 HydrophobicContact CG-CG1 4.04Å; F24-V50 HydrophobicContact CG-CG2 4Å; F24-Y52 WeakPolarHBondContact CB-OH 3.22Å; F24-Y52 HydrophobicContact CD1-CE2 4.01Å; F24-Y52 VanDerWaalsContact CD1-OH 3.32Å; F24-Y52 WeakPolarHBondContact CD1-OH 3.41Å; F24-Y52 WeakPolarHBondContact O-CE1 3.37Å; F24-Y52 PolarHBondContact O-OH 3.27Å; F24-A61 HydrophobicContact CD1-CB 4.44Å; F24-A61 HydrophobicContact CE1-CB 4.42Å; F24-I65 HydrophobicContact CB-CD1 4.39Å; F24-I65 HydrophobicContact CD1-CD1 3.87Å; F24-I65 HydrophobicContact CD2-CD1 3.82Å; F24-I65 HydrophobicContact CE1-CD1 4.01Å; F24-I65 HydrophobicContact CE2-CD1 3.96Å; F24-I65 HydrophobicContact CE2-CG2 3.86Å; F24-I65 HydrophobicContact CG-CD1 3.77Å; F24-I65 HydrophobicContact CZ-CB 4.49Å; F24-I65 HydrophobicContact CZ-CD1 4.06Å; F24-I65 HydrophobicContact CZ-CG2 3.96Å; F24-L73 HydrophobicContact CE2-CD1 4.43Å; F24-L75 HydrophobicContact CE1-CD1 4.26Å; F24-L75 HydrophobicContact CZ-CD1 4.01Å; F24-L75 HydrophobicContact CZ-CD2 3.94Å
25	S	87.4	Confident	86.2	Confident	57 Å²	57	61.7 Å²	61.7	40%	0.399	31%	0.307	S	S	.	.	H	α-helix	trans	-75.2	-25.9	177.5	-62.4	0	0	0	0	113.4	E21 E22 I27 G28	E21-S25 VanDerWaalsContact O-CB 3.22Å; E21-S25 WeakPolarHBondContact O-CB 3.35Å; E21-S25 PolarHBondContact O-N 2.83Å; E21-S25 PolarHBondContact O-OG 3.41Å; E22-S25 PolarHBondContact O-N 3.08Å; S25-I27 PolarHBondContact O-N 3.36Å; S25-G28 PolarHBondContact O-N 3.42Å
26	E	86.9	Confident	86.5	Confident	175 Å²	175	62.9 Å²	62.9	82%	0.818	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.8	175.1	-175	172.1	-159.8	0	0	112.5	E22	E22-E26 PolarHBondContact O-N 3.13Å
27	I	86	Confident	86.6	Confident	13 Å²	13	65.8 Å²	65.8	7%	0.067	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-35.2	179.5	-71.6	-177.6	0	0	0	112.4	S25 D57 R60 A61 E64 I65	S25-I27 PolarHBondContact O-N 3.36Å; I27-D57 HydrophobicContact CG2-CB 4.36Å; I27-R60 HydrophobicContact CG2-CB 3.85Å; I27-R60 PolarHBondContact O-NH1 3.04Å; I27-R60 PolarHBondContact O-NH2 3.44Å; I27-A61 HydrophobicContact CD1-CB 4.16Å; I27-A61 HydrophobicContact CG2-CB 4.33Å; I27-E64 HydrophobicContact CD1-CB 3.73Å; I27-E64 HydrophobicContact CD1-CG 3.92Å; I27-I65 HydrophobicContact CD1-CD1 3.67Å; I27-I65 HydrophobicContact CD1-CG1 3.7Å; I27-I65 HydrophobicContact CG1-CD1 4.43Å
28	G	84.8	Confident	86.4	Confident	12 Å²	12	68.7 Å²	68.7	12%	0.124	33%	0.331	C	S	.	.	S	Bend	trans	171	176.2	-177.9	0	0	0	0	0	113.9	S25 V30 Y52	S25-G28 PolarHBondContact O-N 3.42Å; G28-V30 PolarHBondContact O-N 3.35Å; G28-V30 VanDerWaalsContact O-N 3.08Å; G28-Y52 WeakPolarHBondContact O-CE1 3.05Å
29	P	86.7	Confident	85.6	Confident	80 Å²	80	72 Å²	72	52%	0.519	34%	0.343	S	S	.	.			trans	-69	108.5	-172.2	26.3	-33.9	0	0	0	112.7	S53	P29-S53 PolarHBondContact O-N 2.8Å
30	V	88.4	Confident	84.6	Confident	26 Å²	26	71.6 Å²	71.6	16%	0.158	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	135.3	168.8	177.8	0	0	0	0	109.4	F24 G28 C33 V50 Y52	F24-V30 HydrophobicContact CB-CG2 4.04Å; G28-V30 PolarHBondContact O-N 3.35Å; G28-V30 VanDerWaalsContact O-N 3.08Å; V30-C33 HydrophobicContact CG1-CB 4.48Å; V30-V50 HydrophobicContact CB-CG1 4.5Å; V30-V50 HydrophobicContact CG1-CG1 3.82Å; V30-V50 HydrophobicContact CG2-CG1 3.84Å; V30-Y52 HydrophobicContact CG2-CD1 4.18Å; V30-Y52 HydrophobicContact CG2-CE1 3.77Å
31	K	86.9	Confident	83.8	Confident	119 Å²	119	73.6 Å²	73.6	52%	0.517	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-30.4	172.3	-81.6	-179.9	167.9	149.9	0	113.1	A3 T51 S53	A3-K31 HydrophobicContact CB-CD 4.13Å; K31-T51 PolarHBondContact N-O 3.17Å; K31-S53 WeakPolarHBondContact CE-OG 3.45Å; K31-S53 PolarHBondContact NZ-OG 2.73Å
32	Q	82.9	Confident	82.8	Confident	128 Å²	128	77.7 Å²	77.7	60%	0.598	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-161.8	125.9	179.2	-168.9	177.5	15.4	0	0	111.4	V50 T51	Q32-V50 WeakPolarHBondContact O-CA 3.44Å; Q32-T51 PolarHBondContact N-O 2.61Å; Q32-T51 PolarHBondContact O-N 2.82Å
33	C	87.2	Confident	82.2	Confident	13 Å²	13	77.8 Å²	77.8	9%	0.088	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.3	168.4	57.1	0	0	0	0	110	N17 E21 V30	N17-C33 PolarHBondContact ND2-O 3.13Å; N17-C33 VanDerWaalsContact ND2-O 3.08Å; N17-C33 PolarHBondContact ND2-SG 3.13Å; N17-C33 PolarHBondContact OD1-O 3.03Å; E21-C33 HydrophobicContact CB-CB 4.06Å; E21-C33 HydrophobicContact CG-CB 4.39Å; E21-C33 PolarHBondContact OE2-SG 2.92Å; V30-C33 HydrophobicContact CG1-CB 4.48Å
34	F	86.5	Confident	81.9	Confident	113 Å²	113	76.8 Å²	76.8	50%	0.496	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	107.2	173.2	-174.1	-109.1	0	0	0	113.5	N17 V36 G48 F49	N17-F34 WeakPolarHBondContact OD1-CA 3.46Å; N17-F34 PolarHBondContact OD1-N 2.92Å; F34-V36 HydrophobicContact CD1-CG2 4.06Å; F34-V36 HydrophobicContact CE1-CG2 3.9Å; F34-G48 CarbonylContact O-C 3.55Å; F34-G48 WeakPolarHBondContact O-CA 3.21Å; F34-F49 PolarHBondContact N-O 3.44Å; F34-F49 PolarHBondContact O-N 3.29Å
35	V	87.5	Confident	81.5	Confident	7 Å²	7	83.6 Å²	83.6	4%	0.042	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	131.7	169.9	-175.9	0	0	0	0	110.9	L11 N17 L20 R37 C44	L11-V35 HydrophobicContact CD1-CG1 4.25Å; L11-V35 HydrophobicContact CD1-CG2 4.35Å; N17-V35 PolarHBondContact OD1-N 2.89Å; L20-V35 HydrophobicContact CB-CG2 4.17Å; L20-V35 HydrophobicContact CD2-CG2 3.6Å; V35-R37 PolarHBondContact O-N 2.73Å; V35-C44 HydrophobicContact CG1-CB 3.82Å; V35-C44 WeakPolarHBondContact CG1-SG 3.41Å
36	V	86.9	Confident	81.1	Confident	25 Å²	25	81.8 Å²	81.8	15%	0.152	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	105.6	-175.9	-171.8	0	0	0	0	111	F34 R45 F47 F49	F34-V36 HydrophobicContact CD1-CG2 4.06Å; F34-V36 HydrophobicContact CE1-CG2 3.9Å; V36-R45 WeakPolarHBondContact O-CB 3.16Å; V36-R45 PolarHBondContact O-N 2.95Å; V36-F47 HydrophobicContact CB-CD2 3.92Å; V36-F47 HydrophobicContact CB-CE2 3.66Å; V36-F47 HydrophobicContact CB-CZ 4.19Å; V36-F47 WeakPolarHBondContact CB-O 3.38Å; V36-F47 HydrophobicContact CG1-CE2 3.86Å; V36-F47 HydrophobicContact CG1-CZ 4.04Å; V36-F47 HydrophobicContact CG2-CD2 3.68Å; V36-F47 HydrophobicContact CG2-CE2 3.53Å; V36-F47 HydrophobicContact CG2-CZ 4.48Å; V36-F47 PolarHBondContact N-O 2.58Å; V36-F49 HydrophobicContact CG2-CD2 4.16Å; V36-F49 HydrophobicContact CG2-CE2 3.95Å
37	R	85.2	Confident	81.2	Confident	111 Å²	111	76 Å²	76	42%	0.419	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	164.4	173.8	-61.5	-175.8	-169.4	-122.5	18.4	112.9	V35 E42 K43 R45	V35-R37 PolarHBondContact O-N 2.73Å; R37-E42 WeakPolarHBondContact CD-O 3.47Å; R37-E42 PolarHBondContact NH1-O 2.82Å; R37-E42 IonicContact NH1-OE1 3.69Å; R37-K43 WeakPolarHBondContact CA-O 3.29Å; R37-R45 WeakPolarHBondContact O-CD 3.05Å
38	E	81.8	Confident	81.3	Confident	110 Å²	110	75.3 Å²	75.3	51%	0.514	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	152.2	176.2	-171.6	145.3	-123.7	0	0	112.3	G40 A41 K43 R45	E38-G40 PolarHBondContact O-N 2.77Å; E38-G40 VanDerWaalsContact O-N 3.1Å; E38-A41 HydrophobicContact CB-CB 4.48Å; E38-A41 VanDerWaalsContact O-O 3.08Å; E38-K43 PolarHBondContact N-O 3.47Å; E38-R45 HydrophobicContact CB-CG 3.98Å
39	K	71.4	Confident	81.7	Confident	213 Å²	213	78.1 Å²	78.1	93%	0.926	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	98	-179.9	-74.7	-164.6	171.5	-163.1	0	110.4
40	G	65.1	Low	81.8	Confident	89 Å²	89	74.3 Å²	74.3	92%	0.918	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.9	1.7	177.9	0	0	0	0	0	114.7	E38	E38-G40 PolarHBondContact O-N 2.77Å; E38-G40 VanDerWaalsContact O-N 3.1Å
41	A	69.6	Low	81.9	Confident	42 Å²	42	74 Å²	74	35%	0.347	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	140.9	171.6	0	0	0	0	0	109.7	E38 K43	E38-A41 HydrophobicContact CB-CB 4.48Å; E38-A41 VanDerWaalsContact O-O 3.08Å; A41-K43 PolarHBondContact O-N 3Å; A41-K43 VanDerWaalsContact O-N 3.15Å
42	E	66.2	Low	82.1	Confident	157 Å²	157	68.4 Å²	68.4	73%	0.734	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	-10.7	-176.5	-169.3	162.6	-156.3	0	0	113.6	R37	R37-E42 WeakPolarHBondContact CD-O 3.47Å; R37-E42 PolarHBondContact NH1-O 2.82Å; R37-E42 IonicContact NH1-OE1 3.69Å
43	K	75	Confident	82.4	Confident	115 Å²	115	63.9 Å²	63.9	50%	0.5	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	146.8	178.1	-65.6	-173.1	168.4	-155.3	0	113.3	E13 R37 E38 A41	E13-K43 WeakPolarHBondContact OE2-CD 3.41Å; E13-K43 VanDerWaalsContact OE2-CE 3.3Å; E13-K43 WeakPolarHBondContact OE2-CE 3.32Å; E13-K43 IonicContact OE2-NZ 3.7Å; E13-K43 PolarHBondContact OE2-NZ 3.12Å; R37-K43 WeakPolarHBondContact CA-O 3.29Å; E38-K43 PolarHBondContact N-O 3.47Å; A41-K43 PolarHBondContact O-N 3Å; A41-K43 VanDerWaalsContact O-N 3.15Å
44	C	79.9	Confident	82.5	Confident	8 Å²	8	66.9 Å²	66.9	5%	0.054	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	136.8	176.9	-67.3	0	0	0	0	112.3	E13 A15 V35 G46	E13-C44 PolarHBondContact O-N 3.24Å; A15-C44 PolarHBondContact O-SG 2.88Å; V35-C44 HydrophobicContact CG1-CB 3.82Å; V35-C44 WeakPolarHBondContact CG1-SG 3.41Å; C44-G46 PolarHBondContact O-N 3.49Å
45	R	78.5	Confident	82.5	Confident	142 Å²	142	65.5 Å²	65.5	54%	0.536	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	19.4	-179.1	-61.3	-176.1	68.2	-165.9	-2.1	113.9	V36 R37 E38 F47	V36-R45 WeakPolarHBondContact O-CB 3.16Å; V36-R45 PolarHBondContact O-N 2.95Å; R37-R45 WeakPolarHBondContact O-CD 3.05Å; E38-R45 HydrophobicContact CB-CG 3.98Å; R45-F47 VanDerWaalsContact C-N 3.3Å; R45-F47 HydrophobicContact CB-CD1 4.2Å; R45-F47 HydrophobicContact CB-CE1 3.83Å; R45-F47 HydrophobicContact CB-CZ 4.46Å; R45-F47 WeakPolarHBondContact O-CD1 3.48Å; R45-F47 PolarHBondContact O-N 2.88Å
46	G	80.5	Confident	82.5	Confident	19 Å²	19	72.4 Å²	72.4	20%	0.196	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.1	10.2	-179.4	0	0	0	0	0	116.1	A9 S10 L11 C44	A9-G46 CarbonylContact C-O 3.53Å; A9-G46 WeakPolarHBondContact CA-O 3.5Å; S10-G46 PolarHBondContact N-O 3.2Å; L11-G46 PolarHBondContact N-O 3.2Å; L11-G46 WeakPolarHBondContact O-CA 3.26Å; C44-G46 PolarHBondContact O-N 3.49Å
47	F	87.8	Confident	82.5	Confident	53 Å²	53	72.4 Å²	72.4	23%	0.232	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	159.2	176.5	65.2	-93.1	0	0	0	114.4	F7 V8 A9 V36 R45 F49	F7-F47 HydrophobicContact CE2-CB 3.72Å; F7-F47 AromaticContact CE2-CD2 3.66Å; F7-F47 HydrophobicContact CE2-CD2 3.66Å; F7-F47 AromaticContact CE2-CG 3.9Å; F7-F47 HydrophobicContact CE2-CG 3.9Å; F7-F47 HydrophobicContact CZ-CB 3.9Å; F7-F47 HydrophobicContact CZ-CD2 4.34Å; F7-F47 HydrophobicContact CZ-CG 4.18Å; V8-F47 CarbonylContact O-C 3.58Å; V8-F47 WeakPolarHBondContact O-CA 3.44Å; V8-F47 VanDerWaalsContact O-CB 3.28Å; V8-F47 WeakPolarHBondContact O-CB 3.27Å; A9-F47 HydrophobicContact CB-CB 4.16Å; V36-F47 HydrophobicContact CB-CD2 3.92Å; V36-F47 HydrophobicContact CB-CE2 3.66Å; V36-F47 HydrophobicContact CB-CZ 4.19Å; V36-F47 WeakPolarHBondContact CB-O 3.38Å; V36-F47 HydrophobicContact CG1-CE2 3.86Å; V36-F47 HydrophobicContact CG1-CZ 4.04Å; V36-F47 HydrophobicContact CG2-CD2 3.68Å; V36-F47 HydrophobicContact CG2-CE2 3.53Å; V36-F47 HydrophobicContact CG2-CZ 4.48Å; V36-F47 PolarHBondContact N-O 2.58Å; R45-F47 VanDerWaalsContact C-N 3.3Å; R45-F47 HydrophobicContact CB-CD1 4.2Å; R45-F47 HydrophobicContact CB-CE1 3.83Å; R45-F47 HydrophobicContact CB-CZ 4.46Å; R45-F47 WeakPolarHBondContact O-CD1 3.48Å; R45-F47 PolarHBondContact O-N 2.88Å; F47-F49 HydrophobicContact CD2-CE2 4.31Å; F47-F49 HydrophobicContact CE2-CE2 4.42Å
48	G	89.1	Confident	82.6	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	-178.5	-179.5	0	0	0	0	0	112.4	V8 F34	V8-G48 PolarHBondContact N-O 3.24Å; V8-G48 PolarHBondContact O-N 2.98Å; F34-G48 CarbonylContact O-C 3.55Å; F34-G48 WeakPolarHBondContact O-CA 3.21Å
49	F	91.7	Very high	82.9	Confident	71 Å²	71	67 Å²	67	31%	0.311	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.4	-179.6	-61.9	-89.8	0	0	0	110.1	T5 I6 F7 F34 V36 F47 A78	T5-F49 HydrophobicContact CG2-CB 4.02Å; T5-F49 HydrophobicContact CG2-CD1 4.09Å; I6-F49 WeakPolarHBondContact O-CA 3.42Å; F7-F49 HydrophobicContact CB-CD1 4.37Å; F7-F49 HydrophobicContact CB-CE1 4.23Å; F7-F49 HydrophobicContact CD2-CD1 4.06Å; F7-F49 AromaticContact CD2-CE1 3.5Å; F7-F49 HydrophobicContact CD2-CE1 3.5Å; F7-F49 VanDerWaalsContact CD2-CE1 3.5Å; F7-F49 HydrophobicContact CD2-CE2 4.39Å; F7-F49 AromaticContact CD2-CZ 3.68Å; F7-F49 HydrophobicContact CD2-CZ 3.68Å; F7-F49 HydrophobicContact CE2-CE1 4.29Å; F7-F49 HydrophobicContact CE2-CZ 4.02Å; F7-F49 HydrophobicContact CG-CE1 4.28Å; F34-F49 PolarHBondContact N-O 3.44Å; F34-F49 PolarHBondContact O-N 3.29Å; V36-F49 HydrophobicContact CG2-CD2 4.16Å; V36-F49 HydrophobicContact CG2-CE2 3.95Å; F47-F49 HydrophobicContact CD2-CE2 4.31Å; F47-F49 HydrophobicContact CE2-CE2 4.42Å; F49-A78 HydrophobicContact CD1-CB 4.1Å; F49-A78 HydrophobicContact CE1-CB 4.25Å
50	V	90.5	Very high	83.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	123.7	175.4	-178.4	0	0	0	0	108.6	T5 I6 V8 L20 F24 V30 Q32 Y52	T5-V50 CarbonylContact C-O 3.5Å; T5-V50 WeakPolarHBondContact CA-O 3.38Å; I6-V50 PolarHBondContact N-O 3.37Å; I6-V50 PolarHBondContact O-N 3.37Å; V8-V50 HydrophobicContact CG2-CG2 3.97Å; L20-V50 HydrophobicContact CD2-CG2 3.95Å; L20-V50 HydrophobicContact CG-CG2 4.1Å; F24-V50 HydrophobicContact CB-CG1 3.94Å; F24-V50 HydrophobicContact CD1-CB 3.92Å; F24-V50 HydrophobicContact CD1-CG1 3.72Å; F24-V50 HydrophobicContact CD1-CG2 3.88Å; F24-V50 HydrophobicContact CD2-CG2 4.39Å; F24-V50 HydrophobicContact CE1-CB 4.32Å; F24-V50 HydrophobicContact CE1-CG2 4.18Å; F24-V50 HydrophobicContact CG-CB 4.41Å; F24-V50 HydrophobicContact CG-CG1 4.04Å; F24-V50 HydrophobicContact CG-CG2 4Å; V30-V50 HydrophobicContact CB-CG1 4.5Å; V30-V50 HydrophobicContact CG1-CG1 3.82Å; V30-V50 HydrophobicContact CG2-CG1 3.84Å; Q32-V50 WeakPolarHBondContact O-CA 3.44Å; V50-Y52 HydrophobicContact CG1-CE2 4.21Å
51	T	90.7	Very high	84.6	Confident	20 Å²	20	57.6 Å²	57.6	12%	0.123	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.7	-179.4	-57	0	0	0	0	110	A3 V4 T5 K31 Q32	A3-T51 HydrophobicContact CB-CG2 3.88Å; V4-T51 WeakPolarHBondContact O-CA 3.48Å; T5-T51 WeakPolarHBondContact CG2-OG1 3.39Å; T5-T51 PolarHBondContact OG1-OG1 3.42Å; K31-T51 PolarHBondContact N-O 3.17Å; Q32-T51 PolarHBondContact N-O 2.61Å; Q32-T51 PolarHBondContact O-N 2.82Å
52	Y	91.1	Very high	85.3	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	154.8	176.1	-78.6	-79.5	0	0	0	112.3	A3 V4 I6 F24 G28 V30 V50 M54 D57 A58 A61	A3-Y52 WeakPolarHBondContact CB-O 3.05Å; V4-Y52 PolarHBondContact N-O 3.44Å; V4-Y52 PolarHBondContact O-N 3.39Å; I6-Y52 HydrophobicContact CD1-CD2 4.05Å; I6-Y52 HydrophobicContact CD1-CE2 3.78Å; F24-Y52 WeakPolarHBondContact CB-OH 3.22Å; F24-Y52 HydrophobicContact CD1-CE2 4.01Å; F24-Y52 VanDerWaalsContact CD1-OH 3.32Å; F24-Y52 WeakPolarHBondContact CD1-OH 3.41Å; F24-Y52 WeakPolarHBondContact O-CE1 3.37Å; F24-Y52 PolarHBondContact O-OH 3.27Å; G28-Y52 WeakPolarHBondContact O-CE1 3.05Å; V30-Y52 HydrophobicContact CG2-CD1 4.18Å; V30-Y52 HydrophobicContact CG2-CE1 3.77Å; V50-Y52 HydrophobicContact CG1-CE2 4.21Å; Y52-M54 VanDerWaalsContact C-N 3.33Å; Y52-M54 WeakPolarHBondContact CB-O 3.28Å; Y52-D57 HydrophobicContact CD1-CB 4.01Å; Y52-D57 HydrophobicContact CE1-CB 4.37Å; Y52-D57 HydrophobicContact CG-CB 4.39Å; Y52-A58 HydrophobicContact CD2-CB 3.87Å; Y52-A58 HydrophobicContact CG-CB 4.37Å; Y52-A61 HydrophobicContact CE2-CB 3.61Å; Y52-A61 WeakPolarHBondContact OH-CB 3.27Å
53	S	88.8	Confident	86.1	Confident	33 Å²	33	57.8 Å²	57.8	23%	0.231	27%	0.267	C	S	.	.	S	Bend	trans	-66.7	-35.5	170.5	-162	0	0	0	0	112.8	P29 K31	P29-S53 PolarHBondContact O-N 2.8Å; K31-S53 WeakPolarHBondContact CE-OG 3.45Å; K31-S53 PolarHBondContact NZ-OG 2.73Å
54	M	88.1	Confident	86.5	Confident	76 Å²	76	58.2 Å²	58.2	37%	0.374	27%	0.27	S	S	.	.	S	Bend	trans	-113.6	148	-177.8	-57.5	-57	-146.9	0	0	112.1	M1 Y52 E56 A58	M1-M54 HydrophobicContact CE-CE 3.68Å; M1-M54 HydrophobicContact CE-SD 3.55Å; M1-M54 VanDerWaalsContact CE-SD 3.55Å; Y52-M54 VanDerWaalsContact C-N 3.33Å; Y52-M54 WeakPolarHBondContact CB-O 3.28Å; M54-E56 VanDerWaalsContact C-N 3.34Å; M54-A58 PolarHBondContact O-N 2.71Å
55	E	86.9	Confident	86.4	Confident	85 Å²	85	58.5 Å²	58.5	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-73.9	-25.5	172.8	179.5	170.6	163.2	0	0	112.7	V4 K59	V4-E55 HydrophobicContact CG2-CB 3.72Å; V4-E55 HydrophobicContact CG2-CG 3.87Å; E55-K59 HydrophobicContact CG-CD 4.22Å; E55-K59 WeakPolarHBondContact O-CG 3.39Å; E55-K59 PolarHBondContact O-N 2.96Å; E55-K59 VanDerWaalsContact O-N 3.08Å; E55-K59 WeakPolarHBondContact OE1-CE 3.44Å; E55-K59 IonicContact OE1-NZ 2.88Å; E55-K59 PolarHBondContact OE1-NZ 2.87Å
56	E	87.1	Confident	86.1	Confident	151 Å²	151	57.5 Å²	57.5	71%	0.706	27%	0.271	S	S	*	.	H	α-helix	trans	-73.1	-46.1	-178.4	-59.1	-169.6	164.2	0	0	111.8	M54 A58 K59 R60	M54-E56 VanDerWaalsContact C-N 3.34Å; E56-A58 VanDerWaalsContact C-N 3.3Å; E56-A58 PolarHBondContact O-N 2.93Å; E56-K59 CarbonylContact O-C 3.19Å; E56-K59 WeakPolarHBondContact O-CA 3.28Å; E56-K59 WeakPolarHBondContact O-CB 3.3Å; E56-K59 PolarHBondContact O-N 3.34Å; E56-R60 PolarHBondContact O-N 2.88Å
57	D	88.7	Confident	86	Confident	26 Å²	26	60.6 Å²	60.6	14%	0.139	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-37.4	173.2	-61.6	-42.5	0	0	0	111.6	I27 Y52 K59 R60 A61	I27-D57 HydrophobicContact CG2-CB 4.36Å; Y52-D57 HydrophobicContact CD1-CB 4.01Å; Y52-D57 HydrophobicContact CE1-CB 4.37Å; Y52-D57 HydrophobicContact CG-CB 4.39Å; D57-K59 VanDerWaalsContact C-N 3.3Å; D57-K59 PolarHBondContact O-N 2.85Å; D57-R60 WeakPolarHBondContact O-CB 3.41Å; D57-R60 PolarHBondContact O-N 2.91Å; D57-R60 VanDerWaalsContact O-N 3.12Å; D57-R60 IonicContact OD1-CZ 2.71Å; D57-R60 IonicContact OD1-NH1 3.48Å; D57-R60 PolarHBondContact OD1-NH1 3.47Å; D57-A61 WeakPolarHBondContact O-CB 3.42Å; D57-A61 PolarHBondContact O-N 3.4Å
58	A	86.4	Confident	85.4	Confident	3 Å²	3	58.2 Å²	58.2	3%	0.025	27%	0.272	C	S	.	.	H	α-helix	trans	-59.5	-40.4	171.6	0	0	0	0	0	112	V4 I6 Y52 M54 E56 R60 L62	V4-A58 HydrophobicContact CB-CB 4.02Å; V4-A58 HydrophobicContact CG1-CB 3.86Å; I6-A58 HydrophobicContact CD1-CB 4.24Å; I6-A58 WeakPolarHBondContact CD1-O 3.29Å; I6-A58 HydrophobicContact CG1-CB 4.33Å; Y52-A58 HydrophobicContact CD2-CB 3.87Å; Y52-A58 HydrophobicContact CG-CB 4.37Å; M54-A58 PolarHBondContact O-N 2.71Å; E56-A58 VanDerWaalsContact C-N 3.3Å; E56-A58 PolarHBondContact O-N 2.93Å; A58-R60 VanDerWaalsContact C-N 3.35Å; A58-L62 WeakPolarHBondContact O-CG 3.45Å; A58-L62 PolarHBondContact O-N 3.1Å
59	K	87.3	Confident	84.4	Confident	105 Å²	105	62.9 Å²	62.9	46%	0.457	30%	0.298	S	S	.	.	H	α-helix	trans	-72.5	-23.4	175.8	-72.3	166	-177	165.4	0	113.6	E55 E56 D57	E55-K59 HydrophobicContact CG-CD 4.22Å; E55-K59 WeakPolarHBondContact O-CG 3.39Å; E55-K59 PolarHBondContact O-N 2.96Å; E55-K59 VanDerWaalsContact O-N 3.08Å; E55-K59 WeakPolarHBondContact OE1-CE 3.44Å; E55-K59 IonicContact OE1-NZ 2.88Å; E55-K59 PolarHBondContact OE1-NZ 2.87Å; E56-K59 CarbonylContact O-C 3.19Å; E56-K59 WeakPolarHBondContact O-CA 3.28Å; E56-K59 WeakPolarHBondContact O-CB 3.3Å; E56-K59 PolarHBondContact O-N 3.34Å; D57-K59 VanDerWaalsContact C-N 3.3Å; D57-K59 PolarHBondContact O-N 2.85Å
60	R	88	Confident	83.2	Confident	103 Å²	103	63.1 Å²	63.1	39%	0.389	32%	0.32	S	S	.	.	H	α-helix	trans	-74.3	-49.6	170.4	-72	173.9	53.7	-134.4	-9.5	111	I27 E56 D57 A58 L62 K63 E64	I27-R60 HydrophobicContact CG2-CB 3.85Å; I27-R60 PolarHBondContact O-NH1 3.04Å; I27-R60 PolarHBondContact O-NH2 3.44Å; E56-R60 PolarHBondContact O-N 2.88Å; D57-R60 WeakPolarHBondContact O-CB 3.41Å; D57-R60 PolarHBondContact O-N 2.91Å; D57-R60 VanDerWaalsContact O-N 3.12Å; D57-R60 IonicContact OD1-CZ 2.71Å; D57-R60 IonicContact OD1-NH1 3.48Å; D57-R60 PolarHBondContact OD1-NH1 3.47Å; A58-R60 VanDerWaalsContact C-N 3.35Å; R60-L62 VanDerWaalsContact C-N 3.29Å; R60-L62 PolarHBondContact O-N 3.48Å; R60-K63 WeakPolarHBondContact O-CA 3.36Å; R60-K63 WeakPolarHBondContact O-CB 3.41Å; R60-K63 PolarHBondContact O-N 3.47Å; R60-E64 IonicContact NH2-OE2 2.7Å; R60-E64 WeakPolarHBondContact O-CB 3.39Å; R60-E64 PolarHBondContact O-N 3.32Å
61	A	85.7	Confident	82.5	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-53.9	-42.1	178.1	0	0	0	0	0	113	I6 F24 I27 Y52 D57 K63 E64 I65 L75	I6-A61 HydrophobicContact CD1-CB 3.7Å; F24-A61 HydrophobicContact CD1-CB 4.44Å; F24-A61 HydrophobicContact CE1-CB 4.42Å; I27-A61 HydrophobicContact CD1-CB 4.16Å; I27-A61 HydrophobicContact CG2-CB 4.33Å; Y52-A61 HydrophobicContact CE2-CB 3.61Å; Y52-A61 WeakPolarHBondContact OH-CB 3.27Å; D57-A61 WeakPolarHBondContact O-CB 3.42Å; D57-A61 PolarHBondContact O-N 3.4Å; A61-K63 PolarHBondContact O-N 3.11Å; A61-K63 VanDerWaalsContact O-N 3.12Å; A61-E64 PolarHBondContact O-N 2.84Å; A61-I65 HydrophobicContact CB-CD1 4.36Å; A61-I65 PolarHBondContact O-N 3.04Å; A61-L75 WeakPolarHBondContact O-CD1 3.37Å
62	L	84.4	Confident	81.9	Confident	52 Å²	52	75 Å²	75	27%	0.272	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-20.3	174.1	-69.5	178.3	0	0	0	115.1	I6 A58 R60 L75 V77	I6-L62 HydrophobicContact CD1-CD2 4.13Å; I6-L62 HydrophobicContact CD1-CG 4.15Å; I6-L62 HydrophobicContact CG1-CD2 4.31Å; I6-L62 HydrophobicContact CG2-CD2 3.89Å; A58-L62 WeakPolarHBondContact O-CG 3.45Å; A58-L62 PolarHBondContact O-N 3.1Å; R60-L62 VanDerWaalsContact C-N 3.29Å; R60-L62 PolarHBondContact O-N 3.48Å; L62-L75 HydrophobicContact CD2-CB 3.6Å; L62-V77 HydrophobicContact CD1-CG2 3.81Å
63	K	82.6	Confident	81.5	Confident	152 Å²	152	75.9 Å²	75.9	66%	0.661	37%	0.374	S	S	*	.	H	α-helix	trans	-102.7	-35.2	-178.5	-63.9	175.7	-177.1	178.4	0	112.6	R60 A61 K66	R60-K63 WeakPolarHBondContact O-CA 3.36Å; R60-K63 WeakPolarHBondContact O-CB 3.41Å; R60-K63 PolarHBondContact O-N 3.47Å; A61-K63 PolarHBondContact O-N 3.11Å; A61-K63 VanDerWaalsContact O-N 3.12Å; K63-K66 PolarHBondContact O-NZ 3.29Å
64	E	82.1	Confident	81	Confident	123 Å²	123	77.3 Å²	77.3	58%	0.575	38%	0.384	S	S	*	.	H	α-helix	trans	-97.9	-47.5	-163.6	-169.7	154.6	-134.4	0	0	111.1	I27 R60 A61 K66	I27-E64 HydrophobicContact CD1-CB 3.73Å; I27-E64 HydrophobicContact CD1-CG 3.92Å; R60-E64 IonicContact NH2-OE2 2.7Å; R60-E64 WeakPolarHBondContact O-CB 3.39Å; R60-E64 PolarHBondContact O-N 3.32Å; A61-E64 PolarHBondContact O-N 2.84Å; E64-K66 PolarHBondContact O-N 2.94Å
65	I	78.1	Confident	80.9	Confident	15 Å²	15	75.4 Å²	75.4	8%	0.077	38%	0.375	C	S	.	.			trans	-79.6	116	173.7	-62.8	161.9	0	0	0	109.4	I23 F24 I27 A61 L73 L75	I23-I65 HydrophobicContact CG2-CD1 4.14Å; I23-I65 HydrophobicContact CG2-CG1 4.19Å; I23-I65 HydrophobicContact CG2-CG2 4.04Å; I23-I65 WeakPolarHBondContact O-CD1 3.48Å; F24-I65 HydrophobicContact CB-CD1 4.39Å; F24-I65 HydrophobicContact CD1-CD1 3.87Å; F24-I65 HydrophobicContact CD2-CD1 3.82Å; F24-I65 HydrophobicContact CE1-CD1 4.01Å; F24-I65 HydrophobicContact CE2-CD1 3.96Å; F24-I65 HydrophobicContact CE2-CG2 3.86Å; F24-I65 HydrophobicContact CG-CD1 3.77Å; F24-I65 HydrophobicContact CZ-CB 4.49Å; F24-I65 HydrophobicContact CZ-CD1 4.06Å; F24-I65 HydrophobicContact CZ-CG2 3.96Å; I27-I65 HydrophobicContact CD1-CD1 3.67Å; I27-I65 HydrophobicContact CD1-CG1 3.7Å; I27-I65 HydrophobicContact CG1-CD1 4.43Å; A61-I65 HydrophobicContact CB-CD1 4.36Å; A61-I65 PolarHBondContact O-N 3.04Å; I65-L73 HydrophobicContact CG2-CD1 4.03Å; I65-L75 HydrophobicContact CB-CD1 4.06Å; I65-L75 HydrophobicContact CG2-CD1 4.22Å; I65-L75 WeakPolarHBondContact O-CD1 3.27Å
66	K	73.3	Confident	80.7	Confident	120 Å²	120	74 Å²	74	52%	0.522	38%	0.375	S	S	.	.			trans	-132.7	-8.5	174.5	-67.7	-164.7	-177.9	88.5	0	114.9	K63 E64 K72 L73	K63-K66 PolarHBondContact O-NZ 3.29Å; E64-K66 PolarHBondContact O-N 2.94Å; K66-K72 CarbonylContact O-C 3.55Å; K66-K72 WeakPolarHBondContact O-CA 3.28Å; K66-L73 PolarHBondContact O-N 3.16Å
67	D	77.6	Confident	80.6	Confident	84 Å²	84	71 Å²	71	45%	0.449	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	145.9	-176.9	-69.2	-74.9	0	0	0	110.4	K71 K72	D67-K71 CarbonylContact C-O 3.58Å; D67-K71 WeakPolarHBondContact CA-O 3.41Å; D67-K72 WeakPolarHBondContact OD1-CG 3.38Å
68	Y	75.3	Confident	80.2	Confident	3 Å²	3	70.7 Å²	70.7	1%	0.012	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	116.8	174.7	179.6	-68.3	0	0	0	107.2	L11 P12 A15 R19 L20 I23 G70 K71	L11-Y68 HydrophobicContact CD2-CD2 3.71Å; L11-Y68 HydrophobicContact CD2-CE2 3.95Å; L11-Y68 HydrophobicContact CD2-CG 4.06Å; P12-Y68 HydrophobicContact CG-CD1 3.6Å; P12-Y68 HydrophobicContact CG-CE1 3.5Å; P12-Y68 VanDerWaalsContact CG-CE1 3.5Å; A15-Y68 WeakPolarHBondContact CA-OH 3.47Å; A15-Y68 HydrophobicContact CB-CE1 4.15Å; A15-Y68 HydrophobicContact CB-CE2 4.5Å; R19-Y68 WeakPolarHBondContact CB-OH 3.32Å; R19-Y68 HydrophobicContact CG-CE2 4.13Å; R19-Y68 WeakPolarHBondContact CG-OH 3.46Å; L20-Y68 HydrophobicContact CB-CE2 4.45Å; L20-Y68 HydrophobicContact CD1-CD2 4.29Å; L20-Y68 HydrophobicContact CD1-CE2 4.31Å; I23-Y68 HydrophobicContact CD1-CD2 3.6Å; I23-Y68 HydrophobicContact CD1-CE2 3.86Å; I23-Y68 HydrophobicContact CD1-CG 4.29Å; Y68-G70 PolarHBondContact O-N 2.98Å; Y68-G70 VanDerWaalsContact O-N 3.07Å; Y68-K71 PolarHBondContact N-O 3.01Å; Y68-K71 PolarHBondContact O-N 2.88Å
69	D	68.9	Low	79.7	Confident	99 Å²	99	80.2 Å²	80.2	53%	0.529	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.3	46.8	-178.8	-57.4	-24.9	0	0	0	113.4	R19 K71	R19-D69 IonicContact CZ-OD1 3.79Å; R19-D69 IonicContact NE-OD1 3.66Å; R19-D69 IonicContact NH2-OD1 3.25Å; R19-D69 PolarHBondContact NH2-OD1 2.8Å; D69-K71 PolarHBondContact O-N 3.09Å
70	G	66.5	Low	78.5	Confident	75 Å²	75	85 Å²	85	77%	0.773	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	1.3	178.9	0	0	0	0	0	116.5	Y68	Y68-G70 PolarHBondContact O-N 2.98Å; Y68-G70 VanDerWaalsContact O-N 3.07Å
71	K	74.4	Confident	77	Confident	114 Å²	114	87.7 Å²	87.7	50%	0.496	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.5	173.8	-69.3	-176.2	-178.6	177.5	0	111.6	P12 D67 Y68 D69 L73	P12-K71 HydrophobicContact CB-CD 4.17Å; D67-K71 CarbonylContact C-O 3.58Å; D67-K71 WeakPolarHBondContact CA-O 3.41Å; Y68-K71 PolarHBondContact N-O 3.01Å; Y68-K71 PolarHBondContact O-N 2.88Å; D69-K71 PolarHBondContact O-N 3.09Å; K71-L73 PolarHBondContact O-N 3.07Å
72	K	79.4	Confident	74.9	Confident	157 Å²	157	91.4 Å²	91.4	68%	0.683	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	124	177.5	-74.7	175.4	179.8	179.2	0	111.3	S10 K66 D67	S10-K72 WeakPolarHBondContact CB-O 3.47Å; S10-K72 PolarHBondContact OG-O 3Å; S10-K72 VanDerWaalsContact OG-O 3.13Å; K66-K72 CarbonylContact O-C 3.55Å; K66-K72 WeakPolarHBondContact O-CA 3.28Å; D67-K72 WeakPolarHBondContact OD1-CG 3.38Å
73	L	82.4	Confident	72.9	Confident	17 Å²	17	95.5 Å²	95.5	9%	0.089	49%	0.491	C	S	.	.			trans	-84.2	153.2	171.4	-66.6	-175	0	0	0	111	V8 L11 F24 I65 K66 K71 L75	V8-L73 HydrophobicContact CG1-CD1 3.95Å; V8-L73 HydrophobicContact CG1-CD2 4.13Å; L11-L73 HydrophobicContact CD2-CD2 3.72Å; L11-L73 HydrophobicContact CG-CD2 4.07Å; F24-L73 HydrophobicContact CE2-CD1 4.43Å; I65-L73 HydrophobicContact CG2-CD1 4.03Å; K66-L73 PolarHBondContact O-N 3.16Å; K71-L73 PolarHBondContact O-N 3.07Å; L73-L75 HydrophobicContact CB-CD2 4.03Å; L73-L75 HydrophobicContact CD1-CD2 4.24Å
74	S	78.3	Confident	70.9	Confident	64 Å²	64	96.2 Å²	96.2	45%	0.448	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	110.8	169.9	53.1	0	0	0	0	108.6	A9	A9-S74 VanDerWaalsContact C-OG 3.3Å; A9-S74 WeakPolarHBondContact CB-OG 3.43Å; A9-S74 PolarHBondContact N-O 3.36Å; A9-S74 PolarHBondContact O-N 3.09Å; A9-S74 PolarHBondContact O-OG 3.2Å
75	L	85	Confident	69.1	Low	35 Å²	35	97.2 Å²	97.2	18%	0.183	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	140.4	-176.8	-50.2	-170.4	0	0	0	110.9	I6 F7 V8 F24 A61 L62 I65 L73	I6-L75 HydrophobicContact CG2-CB 4.17Å; F7-L75 WeakPolarHBondContact O-CA 3.35Å; V8-L75 HydrophobicContact CB-CD2 4.1Å; V8-L75 HydrophobicContact CG1-CD2 3.74Å; V8-L75 HydrophobicContact CG2-CD2 3.98Å; F24-L75 HydrophobicContact CE1-CD1 4.26Å; F24-L75 HydrophobicContact CZ-CD1 4.01Å; F24-L75 HydrophobicContact CZ-CD2 3.94Å; A61-L75 WeakPolarHBondContact O-CD1 3.37Å; L62-L75 HydrophobicContact CD2-CB 3.6Å; I65-L75 HydrophobicContact CB-CD1 4.06Å; I65-L75 HydrophobicContact CG2-CD1 4.22Å; I65-L75 WeakPolarHBondContact O-CD1 3.27Å; L73-L75 HydrophobicContact CB-CD2 4.03Å; L73-L75 HydrophobicContact CD1-CD2 4.24Å
76	S	82.7	Confident	67.1	Low	55 Å²	55	103.5 Å²	103.5	39%	0.385	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	157.5	175.1	59.4	0	0	0	0	111.6	I6 F7 A78	I6-S76 CarbonylContact C-O 3.55Å; I6-S76 WeakPolarHBondContact CA-O 2.97Å; F7-S76 PolarHBondContact N-O 3.36Å; F7-S76 PolarHBondContact O-N 3.13Å; S76-A78 PolarHBondContact O-N 3.46Å
77	V	85	Confident	65.3	Low	88 Å²	88	107.9 Å²	107.9	53%	0.533	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.5	123.4	173.4	-177.7	0	0	0	0	109	V4 L62 K79	V4-V77 HydrophobicContact CG1-CG1 4.45Å; L62-V77 HydrophobicContact CD1-CG2 3.81Å; V77-K79 PolarHBondContact O-N 3.32Å; V77-K79 VanDerWaalsContact O-N 3.14Å
78	A	80.6	Confident	63.4	Low	21 Å²	21	108.4 Å²	108.4	17%	0.174	56%	0.557	C	S	.	*			trans	-68.9	112.9	-177.4	0	0	0	0	0	110.3	T5 F7 F49 S76 K80	T5-A78 HydrophobicContact CG2-CB 3.8Å; T5-A78 VanDerWaalsContact O-CB 3.29Å; T5-A78 WeakPolarHBondContact O-CB 3.39Å; T5-A78 PolarHBondContact O-N 3.17Å; F7-A78 HydrophobicContact CB-CB 4.05Å; F49-A78 HydrophobicContact CD1-CB 4.1Å; F49-A78 HydrophobicContact CE1-CB 4.25Å; S76-A78 PolarHBondContact O-N 3.46Å; A78-K80 PolarHBondContact O-N 2.91Å; A78-K80 VanDerWaalsContact O-N 3.1Å
79	K	76.1	Confident	61.9	Low	203 Å²	203	113 Å²	113	88%	0.883	58%	0.578	S	S	*	*			trans	-60.8	115.1	171.2	-66.8	177.4	-179.1	176.1	0	108.5	V77 K81	V77-K79 PolarHBondContact O-N 3.32Å; V77-K79 VanDerWaalsContact O-N 3.14Å; K79-K81 PolarHBondContact O-N 3.19Å
80	K	62.8	Low	60.3	Low	205 Å²	205	117.8 Å²	117.8	89%	0.891	59%	0.594	S	S	*	*			trans	-52.5	105.7	-177.9	-177.1	173	-178.2	173	0	110.1	A78 S82	A78-K80 PolarHBondContact O-N 2.91Å; A78-K80 VanDerWaalsContact O-N 3.1Å; K80-S82 PolarHBondContact O-N 3.42Å
81	K	55.9	Low	59.1	Low	160 Å²	160	123.1 Å²	123.1	70%	0.696	60%	0.599	S	S	*	*			trans	-63.9	117.6	178.4	-172.7	177.6	-179.9	-177	0	108.3	K79 I83	K79-K81 PolarHBondContact O-N 3.19Å; K81-I83 VanDerWaalsContact C-N 3.26Å; K81-I83 HydrophobicContact CB-CG1 4.42Å; K81-I83 HydrophobicContact CD-CG1 4.35Å; K81-I83 HydrophobicContact CG-CG1 4.19Å; K81-I83 PolarHBondContact O-N 2.91Å
82	S	42.3	Very low	57.3	Low	78 Å²	78	124.4 Å²	124.4	55%	0.545	61%	0.607	S	S	.	*			trans	-69.5	84.5	172.4	36.7	0	0	0	0	109.3	K80 N84 K85	K80-S82 PolarHBondContact O-N 3.42Å; S82-N84 PolarHBondContact O-N 3.08Å; S82-K85 PolarHBondContact O-N 3.41Å
83	I	40.7	Very low	55.5	Low	137 Å²	137	121.3 Å²	121.3	70%	0.703	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-63	-30.1	-175.1	-75.3	170.5	0	0	0	111.6	K81 K85	K81-I83 VanDerWaalsContact C-N 3.26Å; K81-I83 HydrophobicContact CB-CG1 4.42Å; K81-I83 HydrophobicContact CD-CG1 4.35Å; K81-I83 HydrophobicContact CG-CG1 4.19Å; K81-I83 PolarHBondContact O-N 2.91Å; I83-K85 VanDerWaalsContact C-N 3.28Å; I83-K85 PolarHBondContact O-N 3.43Å
84	N	41.5	Very low	53.5	Low	168 Å²	168	125.7 Å²	125.7	90%	0.898	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-85.6	38.8	165.7	-84.6	9.6	0	0	0	114.4	S82	S82-N84 PolarHBondContact O-N 3.08Å
85	K	44.5	Very low	51.6	Low	143 Å²	143	130.5 Å²	130.5	62%	0.622	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-147.8	17	161.1	-139.9	-168.7	173.7	-174.2	0	116.8	S82 I83	S82-K85 PolarHBondContact O-N 3.41Å; I83-K85 VanDerWaalsContact C-N 3.28Å; I83-K85 PolarHBondContact O-N 3.43Å
86	K	35.7	Very low	49.3	Very low	148 Å²	148	133.3 Å²	133.3	64%	0.643	68%	0.676	S	S	*	*	S	Bend	trans	-135.5	60.6	173.2	-72.6	-155.3	175.2	-123.4	0	114.6	E89	K86-E89 WeakPolarHBondContact CE-OE2 3.46Å; K86-E89 IonicContact NZ-OE2 2.63Å; K86-E89 PolarHBondContact NZ-OE2 3.01Å
87	K	36.1	Very low	47.5	Very low	212 Å²	212	135.8 Å²	135.8	92%	0.922	69%	0.694	S	S	*	*	S	Bend	trans	-131.2	9.7	152.4	-128.7	-175.7	179.5	-169.5	0	113.2
88	T	38.1	Very low	45.3	Very low	95 Å²	95	139.9 Å²	139.9	58%	0.583	71%	0.707	S	S	*	*	S	Bend	trans	-138.7	49.2	-172.7	-31.7	0	0	0	0	110.3
89	E	43.5	Very low	43.4	Very low	99 Å²	99	144.7 Å²	144.7	46%	0.463	73%	0.726	S	S	.	*	S	Bend	trans	-143.6	38.6	178.5	-69.6	-171.8	170.6	0	0	110.5	K86	K86-E89 WeakPolarHBondContact CE-OE2 3.46Å; K86-E89 IonicContact NZ-OE2 2.63Å; K86-E89 PolarHBondContact NZ-OE2 3.01Å
90	K	35.8	Very low	41.5	Very low	200 Å²	200	141 Å²	141	87%	0.87	71%	0.712	S	S	*	*	S	Bend	trans	-149.6	-0.6	173.1	-122	-169.4	-179.3	-161.2	0	117.8
91	E	39.8	Very low	40.4	Very low	186 Å²	186	137.9 Å²	137.9	87%	0.869	70%	0.7	S	S	*	*	S	Bend	trans	-117.6	-10.4	172	-69.3	173.4	152.8	0	0	112.2	A93	E91-A93 PolarHBondContact O-N 3.09Å
92	E	38.1	Very low	39.7	Very low	142 Å²	142	136.3 Å²	136.3	66%	0.664	70%	0.695	S	S	*	*			trans	-76.9	59.6	169.1	-65.6	179	-168.6	0	0	111.3
93	A	40.4	Very low	39.6	Very low	91 Å²	91	136 Å²	136	75%	0.752	69%	0.69	S	S	*	*	S	Bend	trans	-113.9	0.6	179	0	0	0	0	0	113.6	E91	E91-A93 PolarHBondContact O-N 3.09Å
94	S	41.4	Very low	39.7	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	68%	0.675	S	S	*	*	S	Bend	trans	-140.5	12.3	-170.9	56	0	0	0	0	115.8
95	E	38.4	Very low	39.9	Very low	166 Å²	166	127.3 Å²	127.3	78%	0.776	65%	0.648	S	S	*	*			trans	-120.7	8.2	176.5	-63.4	-161.6	147	0	0	114.1	S97	E95-S97 PolarHBondContact O-N 3.42Å
96	T	35.2	Very low	40	Very low	93 Å²	93	124.5 Å²	124.5	57%	0.571	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	60.7	-176.9	-39.9	0	0	0	0	113.2	E100	T96-E100 HydrophobicContact CG2-CG 4.26Å
97	S	44.6	Very low	40.7	Very low	108 Å²	108	125 Å²	125	76%	0.755	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138	-8.2	176.8	-66.9	0	0	0	0	115.4	E95	E95-S97 PolarHBondContact O-N 3.42Å
98	Q	40.6	Very low	41.4	Very low	174 Å²	174	119.3 Å²	119.3	81%	0.813	62%	0.62	S	S	*	*	S	Bend	trans	-128	-22.4	-178.4	-63.4	-171	3.4	0	0	115.4
99	H	39	Very low	42.1	Very low	121 Å²	121	123.8 Å²	123.8	56%	0.56	63%	0.626	S	S	*	*	S	Bend	trans	-97.4	2.2	-177.4	-157.9	47.5	0	0	0	115.6	Q101 E102 T103	H99-Q101 VanDerWaalsContact C-N 3.33Å; H99-E102 IonicContact CE1-OE2 3.41Å; H99-E102 PolarHBondContact CE1-OE2 2.97Å; H99-E102 VanDerWaalsContact CE1-OE2 3.31Å; H99-E102 IonicContact ND1-OE2 3.86Å; H99-E102 PolarHBondContact ND1-OE2 3.07Å; H99-T103 PolarHBondContact O-OG1 2.93Å
100	E	37.4	Very low	42.4	Very low	126 Å²	126	123.8 Å²	123.8	59%	0.589	63%	0.628	S	S	*	*	H	α-helix	trans	-73.8	-23.6	170.4	-66.5	-157.1	129.5	0	0	113	T96 T104	T96-E100 HydrophobicContact CG2-CG 4.26Å; E100-T104 WeakPolarHBondContact O-CB 3.15Å; E100-T104 VanDerWaalsContact O-CG2 3.25Å; E100-T104 WeakPolarHBondContact O-CG2 3.49Å; E100-T104 PolarHBondContact O-N 3.47Å; E100-T104 PolarHBondContact O-OG1 3.34Å
101	Q	40.4	Very low	43.3	Very low	140 Å²	140	117.9 Å²	117.9	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-68.6	-51.9	-178.8	-65.1	-170.6	-1.6	0	0	111.4	H99 T103 T104 D105	H99-Q101 VanDerWaalsContact C-N 3.33Å; Q101-T103 PolarHBondContact O-N 3.28Å; Q101-T104 PolarHBondContact O-N 3.37Å; Q101-T104 PolarHBondContact O-OG1 3.19Å; Q101-D105 WeakPolarHBondContact O-CB 3.44Å; Q101-D105 PolarHBondContact O-N 3.16Å
102	E	40.3	Very low	44.3	Very low	126 Å²	126	114.8 Å²	114.8	59%	0.589	60%	0.595	S	S	*	*	H	α-helix	trans	-65.5	-40.7	-178	-65.3	-169.3	119.6	0	0	113.5	H99 T104 D105 V106	H99-E102 IonicContact CE1-OE2 3.41Å; H99-E102 PolarHBondContact CE1-OE2 2.97Å; H99-E102 VanDerWaalsContact CE1-OE2 3.31Å; H99-E102 IonicContact ND1-OE2 3.86Å; H99-E102 PolarHBondContact ND1-OE2 3.07Å; E102-T104 VanDerWaalsContact C-N 3.35Å; E102-T104 PolarHBondContact O-N 2.99Å; E102-D105 PolarHBondContact O-N 3.35Å; E102-V106 WeakPolarHBondContact O-CG2 3.28Å; E102-V106 PolarHBondContact O-N 3.08Å
103	T	39.9	Very low	45.5	Very low	72 Å²	72	114 Å²	114	44%	0.442	59%	0.592	S	S	.	*	H	α-helix	trans	-72.6	-28.3	-179.6	60.2	0	0	0	0	112.6	H99 Q101	H99-T103 PolarHBondContact O-OG1 2.93Å; Q101-T103 PolarHBondContact O-N 3.28Å
104	T	42.8	Very low	47.1	Very low	61 Å²	61	109.9 Å²	109.9	37%	0.374	56%	0.558	S	S	.	*	H	α-helix	trans	-75.7	-35	167.2	63	0	0	0	0	112	E100 Q101 E102 K107 K108	E100-T104 WeakPolarHBondContact O-CB 3.15Å; E100-T104 VanDerWaalsContact O-CG2 3.25Å; E100-T104 WeakPolarHBondContact O-CG2 3.49Å; E100-T104 PolarHBondContact O-N 3.47Å; E100-T104 PolarHBondContact O-OG1 3.34Å; Q101-T104 PolarHBondContact O-N 3.37Å; Q101-T104 PolarHBondContact O-OG1 3.19Å; E102-T104 VanDerWaalsContact C-N 3.35Å; E102-T104 PolarHBondContact O-N 2.99Å; T104-K107 PolarHBondContact O-N 3.27Å; T104-K108 WeakPolarHBondContact O-CB 3.33Å; T104-K108 WeakPolarHBondContact O-CD 3.35Å; T104-K108 VanDerWaalsContact O-CG 3.28Å; T104-K108 WeakPolarHBondContact O-CG 3.29Å; T104-K108 PolarHBondContact O-N 2.93Å; T104-K108 PolarHBondContact OG1-NZ 2.95Å
105	D	46.3	Very low	49.4	Very low	62 Å²	62	107.3 Å²	107.3	33%	0.332	53%	0.532	S	S	.	.	H	α-helix	trans	-73	-32.2	178.6	-77.8	-20.7	0	0	0	113.9	Q101 E102 K108 R109	Q101-D105 WeakPolarHBondContact O-CB 3.44Å; Q101-D105 PolarHBondContact O-N 3.16Å; E102-D105 PolarHBondContact O-N 3.35Å; D105-K108 PolarHBondContact O-N 3.45Å; D105-K108 WeakPolarHBondContact OD1-CD 3.25Å; D105-K108 WeakPolarHBondContact OD1-CE 3.42Å; D105-K108 IonicContact OD1-NZ 3.91Å; D105-K108 PolarHBondContact OD1-NZ 3.2Å; D105-R109 VanDerWaalsContact O-CB 3.29Å; D105-R109 WeakPolarHBondContact O-CB 3.43Å; D105-R109 WeakPolarHBondContact O-CG 3.47Å; D105-R109 PolarHBondContact O-N 3.02Å
106	V	45.8	Very low	51.9	Low	84 Å²	84	99.4 Å²	99.4	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-63.5	-43	167.7	172.8	0	0	0	0	110.4	E102 R109 I110	E102-V106 WeakPolarHBondContact O-CG2 3.28Å; E102-V106 PolarHBondContact O-N 3.08Å; V106-R109 PolarHBondContact O-N 3.03Å; V106-I110 HydrophobicContact CG1-CD1 4Å; V106-I110 WeakPolarHBondContact O-CG1 3.41Å; V106-I110 PolarHBondContact O-N 3.21Å
107	K	49.9	Very low	54.5	Low	159 Å²	159	96.1 Å²	96.1	69%	0.691	48%	0.475	S	S	*	.	H	α-helix	trans	-63.5	-42.2	173.9	-75.1	175.9	178.9	171.3	0	112.4	T104 I110 S111	T104-K107 PolarHBondContact O-N 3.27Å; K107-I110 PolarHBondContact O-N 3.29Å; K107-S111 WeakPolarHBondContact O-CB 3.44Å; K107-S111 PolarHBondContact O-N 3.11Å; K107-S111 PolarHBondContact O-OG 3.16Å
108	K	52.2	Low	56.7	Low	92 Å²	92	91 Å²	91	40%	0.4	44%	0.439	S	S	.	.	H	α-helix	trans	-67.2	-30.1	174.3	-69.6	152.5	176.4	159.4	0	112.9	T104 D105 S111 K112	T104-K108 WeakPolarHBondContact O-CB 3.33Å; T104-K108 WeakPolarHBondContact O-CD 3.35Å; T104-K108 VanDerWaalsContact O-CG 3.28Å; T104-K108 WeakPolarHBondContact O-CG 3.29Å; T104-K108 PolarHBondContact O-N 2.93Å; T104-K108 PolarHBondContact OG1-NZ 2.95Å; D105-K108 PolarHBondContact O-N 3.45Å; D105-K108 WeakPolarHBondContact OD1-CD 3.25Å; D105-K108 WeakPolarHBondContact OD1-CE 3.42Å; D105-K108 IonicContact OD1-NZ 3.91Å; D105-K108 PolarHBondContact OD1-NZ 3.2Å; K108-S111 WeakPolarHBondContact CA-OG 3.17Å; K108-S111 PolarHBondContact O-OG 3.43Å; K108-K112 VanDerWaalsContact O-CD 3.27Å; K108-K112 WeakPolarHBondContact O-CD 3.05Å; K108-K112 WeakPolarHBondContact O-CG 3.42Å; K108-K112 PolarHBondContact O-N 3.19Å
109	R	52.2	Low	59	Low	188 Å²	188	88.5 Å²	88.5	71%	0.709	42%	0.422	S	S	*	.	H	α-helix	trans	-72.1	-42.9	175	-77	170.1	-174	-155.2	2.4	110.5	D105 V106 K112	D105-R109 VanDerWaalsContact O-CB 3.29Å; D105-R109 WeakPolarHBondContact O-CB 3.43Å; D105-R109 WeakPolarHBondContact O-CG 3.47Å; D105-R109 PolarHBondContact O-N 3.02Å; V106-R109 PolarHBondContact O-N 3.03Å; R109-K112 PolarHBondContact O-N 3.34Å
110	I	50.4	Low	61.3	Low	100 Å²	100	87 Å²	87	51%	0.513	42%	0.418	S	S	.	.	H	α-helix	trans	-64.1	-44	172.8	-65.4	165.2	0	0	0	110.5	V106 K107 K112 Q113	V106-I110 HydrophobicContact CG1-CD1 4Å; V106-I110 WeakPolarHBondContact O-CG1 3.41Å; V106-I110 PolarHBondContact O-N 3.21Å; K107-I110 PolarHBondContact O-N 3.29Å; I110-K112 PolarHBondContact O-N 2.74Å; I110-K112 VanDerWaalsContact O-N 3.1Å; I110-Q113 WeakPolarHBondContact O-CB 3.45Å; I110-Q113 PolarHBondContact O-N 3.28Å; I110-Q113 VanDerWaalsContact O-N 3.11Å
111	S	55.1	Low	63.6	Low	75 Å²	75	81.3 Å²	81.3	52%	0.524	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-3.5	178.7	81.4	0	0	0	0	115	K107 K108 Q160	K107-S111 WeakPolarHBondContact O-CB 3.44Å; K107-S111 PolarHBondContact O-N 3.11Å; K107-S111 PolarHBondContact O-OG 3.16Å; K108-S111 WeakPolarHBondContact CA-OG 3.17Å; K108-S111 PolarHBondContact O-OG 3.43Å; S111-Q160 VanDerWaalsContact O-CD 3.28Å; S111-Q160 PolarHBondContact O-NE2 3.42Å; S111-Q160 PolarHBondContact O-OE1 2.89Å
112	K	60.2	Low	65.8	Low	121 Å²	121	75.2 Å²	75.2	53%	0.526	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-7.5	173	-75.7	168	-172.6	178.5	0	113.1	K108 R109 I110 G114 R115	K108-K112 VanDerWaalsContact O-CD 3.27Å; K108-K112 WeakPolarHBondContact O-CD 3.05Å; K108-K112 WeakPolarHBondContact O-CG 3.42Å; K108-K112 PolarHBondContact O-N 3.19Å; R109-K112 PolarHBondContact O-N 3.34Å; I110-K112 PolarHBondContact O-N 2.74Å; I110-K112 VanDerWaalsContact O-N 3.1Å; K112-G114 PolarHBondContact O-N 3.26Å; K112-G114 VanDerWaalsContact O-N 3.11Å; K112-R115 PolarHBondContact O-N 3.31Å; K112-R115 VanDerWaalsContact O-N 3.08Å
113	Q	63.3	Low	67.9	Low	127 Å²	127	74.8 Å²	74.8	59%	0.593	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	111.5	174.2	-66.2	178.3	-17.9	0	0	108.9	I110 Q160	I110-Q113 WeakPolarHBondContact O-CB 3.45Å; I110-Q113 PolarHBondContact O-N 3.28Å; I110-Q113 VanDerWaalsContact O-N 3.11Å; Q113-Q160 PolarHBondContact O-NE2 3.49Å
114	G	74.6	Confident	70	Confident	4 Å²	4	79.6 Å²	79.6	4%	0.041	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	104	11.7	-171.1	0	0	0	0	0	115.9	K112 F161	K112-G114 PolarHBondContact O-N 3.26Å; K112-G114 VanDerWaalsContact O-N 3.11Å; G114-F161 PolarHBondContact O-N 2.79Å; G114-F161 VanDerWaalsContact O-N 3.07Å
115	R	89.2	Confident	71.8	Confident	54 Å²	54	76.8 Å²	76.8	20%	0.204	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.4	168.9	-158.5	174.3	174.8	103.2	-2.4	110.9	K112 E142 F158 V159 Q160 A189	K112-R115 PolarHBondContact O-N 3.31Å; K112-R115 VanDerWaalsContact O-N 3.08Å; R115-E142 IonicContact CZ-OE1 3.16Å; R115-E142 IonicContact NH1-OE1 3.19Å; R115-E142 PolarHBondContact NH1-OE1 2.74Å; R115-E142 IonicContact NH1-OE2 3.21Å; R115-E142 IonicContact NH2-OE1 2.61Å; R115-E142 PolarHBondContact NH2-OE1 3.27Å; R115-F158 VanDerWaalsContact NH2-CB 3.28Å; R115-V159 WeakPolarHBondContact CA-O 3.5Å; R115-Q160 VanDerWaalsContact CB-OE1 3.28Å; R115-A189 HydrophobicContact CB-CB 3.9Å; R115-A189 HydrophobicContact CG-CB 3.71Å; R115-A189 WeakPolarHBondContact O-CB 3.16Å; R115-A189 PolarHBondContact O-N 2.76Å
116	L	89.7	Confident	73.6	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	151.5	170.6	-58.1	-177.6	0	0	0	110.5	F134 F158 V159 F161 A167 A170 L171 V186 D187 W188	L116-F134 HydrophobicContact CD1-CE1 4.4Å; L116-F158 WeakPolarHBondContact O-CA 3.41Å; L116-V159 PolarHBondContact N-O 3Å; L116-V159 PolarHBondContact O-N 3.12Å; L116-F161 HydrophobicContact CD1-CD2 4.33Å; L116-F161 HydrophobicContact CD1-CE2 3.84Å; L116-F161 HydrophobicContact CG-CE2 4.45Å; L116-A167 HydrophobicContact CD1-CB 4.31Å; L116-A167 HydrophobicContact CD2-CB 4.08Å; L116-A167 HydrophobicContact CG-CB 4.11Å; L116-A170 HydrophobicContact CD1-CB 4.04Å; L116-L171 HydrophobicContact CD1-CB 4.47Å; L116-L171 HydrophobicContact CD2-CB 4.49Å; L116-V186 HydrophobicContact CB-CG1 4.23Å; L116-V186 HydrophobicContact CD1-CG1 3.79Å; L116-V186 HydrophobicContact CG-CG1 4.49Å; L116-D187 CarbonylContact C-O 3.6Å; L116-D187 VanDerWaalsContact CA-O 3.28Å; L116-D187 WeakPolarHBondContact CA-O 3.07Å; L116-W188 HydrophobicContact CD2-CD2 4.11Å; L116-W188 HydrophobicContact CD2-CE3 3.68Å; L116-W188 HydrophobicContact CD2-CZ3 3.92Å
117	V	90.9	Very high	75.5	Confident	24 Å²	24	77 Å²	77	15%	0.145	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	140.9	166.3	64.6	0	0	0	0	108.8	F158 D187 A189	V117-F158 HydrophobicContact CB-CD1 3.89Å; V117-F158 HydrophobicContact CB-CE1 3.8Å; V117-F158 HydrophobicContact CG2-CD1 3.91Å; V117-F158 HydrophobicContact CG2-CE1 3.56Å; V117-F158 HydrophobicContact CG2-CZ 4.29Å; V117-D187 HydrophobicContact CG1-CB 3.85Å; V117-D187 PolarHBondContact N-O 3.39Å; V117-D187 PolarHBondContact O-N 2.85Å; V117-A189 HydrophobicContact CB-CB 4.17Å
118	I	90.2	Very high	77.2	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	108.3	-169.3	-61.5	173.7	0	0	0	106.9	L130 F134 F156 A157 V159 V184 A185 V186	I118-L130 HydrophobicContact CD1-CD1 3.98Å; I118-L130 HydrophobicContact CD1-CD2 4.18Å; I118-L130 HydrophobicContact CD1-CG 4.3Å; I118-F134 HydrophobicContact CD1-CD1 4.35Å; I118-F134 HydrophobicContact CD1-CD2 4.39Å; I118-F134 HydrophobicContact CD1-CE1 3.66Å; I118-F134 HydrophobicContact CD1-CE2 3.72Å; I118-F134 HydrophobicContact CD1-CZ 3.31Å; I118-F134 HydrophobicContact CG1-CE1 4.29Å; I118-F134 HydrophobicContact CG1-CZ 3.97Å; I118-F156 CarbonylContact O-C 3.57Å; I118-F156 WeakPolarHBondContact O-CA 3.5Å; I118-F156 WeakPolarHBondContact O-CB 3.37Å; I118-A157 HydrophobicContact CB-CB 4.35Å; I118-A157 PolarHBondContact N-O 3.13Å; I118-A157 PolarHBondContact O-N 3.12Å; I118-V159 HydrophobicContact CD1-CB 4.06Å; I118-V159 HydrophobicContact CD1-CG2 3.45Å; I118-V159 VanDerWaalsContact CD1-CG2 3.45Å; I118-V184 HydrophobicContact CG2-CG1 3.28Å; I118-A185 CarbonylContact C-O 3.54Å; I118-A185 WeakPolarHBondContact CA-O 3.5Å; I118-V186 HydrophobicContact CG1-CG1 4.48Å
119	R	88.8	Confident	78.7	Confident	123 Å²	123	75 Å²	75	46%	0.464	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	155.3	-173.8	-60.1	-172.2	-76.1	159.4	-7.4	111.2	L121 A185 D187	R119-L121 VanDerWaalsContact C-N 3.3Å; R119-L121 PolarHBondContact O-N 3.31Å; R119-A185 HydrophobicContact CB-CB 4.24Å; R119-A185 PolarHBondContact N-O 3.14Å; R119-A185 PolarHBondContact O-N 3.1Å; R119-D187 IonicContact CZ-OD1 2.89Å; R119-D187 IonicContact CZ-OD2 2.6Å; R119-D187 IonicContact NE-OD2 3.43Å; R119-D187 PolarHBondContact NE-OD2 2.78Å; R119-D187 IonicContact NH2-OD1 2.58Å; R119-D187 PolarHBondContact NH2-OD1 2.8Å; R119-D187 IonicContact NH2-OD2 2.73Å; R119-D187 PolarHBondContact NH2-OD2 3.11Å
120	N	87.6	Confident	80.4	Confident	89 Å²	89	66.3 Å²	66.3	48%	0.476	32%	0.318	S	S	.	.	S	Bend	trans	60.8	30.8	-176.3	-162	34.5	0	0	0	114.9	G155 Q183	N120-G155 PolarHBondContact N-O 2.64Å; N120-Q183 PolarHBondContact ND2-O 3.1Å
121	L	86.8	Confident	82.2	Confident	7 Å²	7	66 Å²	66	4%	0.037	31%	0.313	C	S	.	.			trans	-68.5	137.3	178	-170	64	0	0	0	110.7	R119 C125 L130 I145 G155 A157 V184	R119-L121 VanDerWaalsContact C-N 3.3Å; R119-L121 PolarHBondContact O-N 3.31Å; L121-C125 HydrophobicContact CD1-CB 4.05Å; L121-C125 HydrophobicContact CD2-CB 4.17Å; L121-C125 HydrophobicContact CG-CB 3.98Å; L121-L130 HydrophobicContact CD1-CD1 4.15Å; L121-L130 HydrophobicContact CD2-CD1 4.18Å; L121-L130 HydrophobicContact CD2-CD2 4.48Å; L121-I145 HydrophobicContact CD2-CD1 4.23Å; L121-G155 PolarHBondContact N-O 3.44Å; L121-A157 HydrophobicContact CD2-CB 3.84Å; L121-V184 HydrophobicContact CD1-CG2 4.14Å
122	S	86.1	Confident	83.9	Confident	11 Å²	11	68.4 Å²	68.4	8%	0.077	32%	0.316	C	S	.	.			trans	-63.7	134.1	177.8	-170.3	0	0	0	0	111.3	K124 C125 K180	S122-K124 PolarHBondContact O-N 3.21Å; S122-C125 WeakPolarHBondContact O-CB 3.33Å; S122-C125 PolarHBondContact O-N 3.49Å; S122-K180 PolarHBondContact OG-O 2.87Å
123	F	84.4	Confident	85.1	Confident	118 Å²	118	64.7 Å²	64.7	52%	0.518	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	1.1	179.4	-53.1	-62.4	0	0	0	114.2	M153 R182	F123-M153 HydrophobicContact CD1-CB 4.27Å; F123-R182 VanDerWaalsContact CE2-NH1 3.33Å
124	K	82.9	Confident	86.3	Confident	172 Å²	172	58.6 Å²	58.6	75%	0.748	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	2.9	173.2	-63.2	-174.9	178.9	-178.3	0	113.1	S122 K180	S122-K124 PolarHBondContact O-N 3.21Å; K124-K180 HydrophobicContact CB-CD 4.28Å; K124-K180 PolarHBondContact O-NZ 2.95Å
125	C	80.9	Confident	87	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.014	30%	0.295	C	S	.	.			trans	-82.6	142.6	177.2	-67.3	0	0	0	0	111.8	L121 S122 E129 M153	L121-C125 HydrophobicContact CD1-CB 4.05Å; L121-C125 HydrophobicContact CD2-CB 4.17Å; L121-C125 HydrophobicContact CG-CB 3.98Å; S122-C125 WeakPolarHBondContact O-CB 3.33Å; S122-C125 PolarHBondContact O-N 3.49Å; C125-E129 WeakPolarHBondContact CA-OE2 3.32Å; C125-M153 WeakPolarHBondContact O-CE 3.45Å
126	T	85.4	Confident	87	Confident	57 Å²	57	68.4 Å²	68.4	35%	0.35	32%	0.319	S	S	.	.			trans	-103.8	161.9	171.6	70.1	0	0	0	0	111.6	Q128 E129 L130	T126-Q128 PolarHBondContact O-N 2.82Å; T126-E129 PolarHBondContact N-OE2 3.35Å; T126-E129 PolarHBondContact O-N 3.49Å; T126-E129 WeakPolarHBondContact OG1-CG 3.38Å; T126-E129 PolarHBondContact OG1-N 2.84Å; T126-L130 PolarHBondContact O-N 2.98Å; T126-L130 VanDerWaalsContact O-N 3.13Å
127	E	85.7	Confident	86.7	Confident	95 Å²	95	71.2 Å²	71.2	44%	0.444	33%	0.332	S	S	.	.	H	α-helix	trans	-61.1	-31.6	174	173.1	159.8	-170.1	0	0	112.2	L130 K131 A143 S144 I145	E127-L130 PolarHBondContact O-N 3.43Å; E127-K131 WeakPolarHBondContact O-CB 3.44Å; E127-K131 PolarHBondContact O-N 3.18Å; E127-A143 HydrophobicContact CG-CB 3.82Å; E127-A143 WeakPolarHBondContact CG-O 3.49Å; E127-A143 PolarHBondContact OE1-N 3.04Å; E127-S144 PolarHBondContact OE1-N 3.27Å; E127-I145 HydrophobicContact CB-CD1 4.35Å; E127-I145 HydrophobicContact CB-CG1 4.44Å
128	Q	84.1	Confident	86.4	Confident	146 Å²	146	71.2 Å²	71.2	68%	0.682	34%	0.336	S	S	*	.	H	α-helix	trans	-65.9	-49.3	177.8	-68.6	172.5	-20.6	0	0	111.6	T126 L130 K131 E132	T126-Q128 PolarHBondContact O-N 2.82Å; Q128-L130 VanDerWaalsContact C-N 3.28Å; Q128-L130 PolarHBondContact O-N 2.9Å; Q128-K131 WeakPolarHBondContact O-CB 3.35Å; Q128-K131 PolarHBondContact O-N 3.3Å; Q128-K131 VanDerWaalsContact O-N 3.13Å; Q128-E132 WeakPolarHBondContact O-CG 3.41Å; Q128-E132 PolarHBondContact O-N 3.45Å
129	E	85.3	Confident	86.3	Confident	63 Å²	63	75 Å²	75	29%	0.294	36%	0.36	S	S	.	.	H	α-helix	trans	-61.6	-37.4	176.2	-65.5	165.3	165.2	0	0	112	C125 T126 T133 K180	C125-E129 WeakPolarHBondContact CA-OE2 3.32Å; T126-E129 PolarHBondContact N-OE2 3.35Å; T126-E129 PolarHBondContact O-N 3.49Å; T126-E129 WeakPolarHBondContact OG1-CG 3.38Å; T126-E129 PolarHBondContact OG1-N 2.84Å; E129-T133 WeakPolarHBondContact O-CB 3.31Å; E129-T133 WeakPolarHBondContact O-CG2 3.36Å; E129-T133 PolarHBondContact O-N 3.01Å; E129-T133 PolarHBondContact O-OG1 3.47Å; E129-K180 WeakPolarHBondContact OE1-CE 3.48Å; E129-K180 IonicContact OE1-NZ 2.69Å; E129-K180 PolarHBondContact OE1-NZ 3.03Å; E129-K180 WeakPolarHBondContact OE2-CE 3.44Å; E129-K180 IonicContact OE2-NZ 3.55Å; E129-K180 PolarHBondContact OE2-NZ 2.81Å
130	L	87.1	Confident	86.3	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-40.3	175.5	-163.7	71.9	0	0	0	111.3	I118 L121 T126 E127 Q128 T133 F134 I145 A157 V159	I118-L130 HydrophobicContact CD1-CD1 3.98Å; I118-L130 HydrophobicContact CD1-CD2 4.18Å; I118-L130 HydrophobicContact CD1-CG 4.3Å; L121-L130 HydrophobicContact CD1-CD1 4.15Å; L121-L130 HydrophobicContact CD2-CD1 4.18Å; L121-L130 HydrophobicContact CD2-CD2 4.48Å; T126-L130 PolarHBondContact O-N 2.98Å; T126-L130 VanDerWaalsContact O-N 3.13Å; E127-L130 PolarHBondContact O-N 3.43Å; Q128-L130 VanDerWaalsContact C-N 3.28Å; Q128-L130 PolarHBondContact O-N 2.9Å; L130-T133 WeakPolarHBondContact CA-OG1 3.06Å; L130-T133 PolarHBondContact O-OG1 2.77Å; L130-T133 VanDerWaalsContact O-OG1 3.13Å; L130-F134 HydrophobicContact CD1-CD2 4.19Å; L130-F134 HydrophobicContact CD1-CE2 3.89Å; L130-F134 HydrophobicContact CG-CD2 4.4Å; L130-F134 WeakPolarHBondContact O-CB 3.38Å; L130-F134 VanDerWaalsContact O-CD2 3.27Å; L130-F134 WeakPolarHBondContact O-CD2 3.47Å; L130-F134 PolarHBondContact O-N 3.31Å; L130-I145 HydrophobicContact CD2-CG1 4.35Å; L130-A157 HydrophobicContact CD2-CB 3.42Å; L130-A157 VanDerWaalsContact CD2-CB 3.42Å; L130-V159 HydrophobicContact CD2-CG2 3.83Å; L130-V159 HydrophobicContact CG-CG2 4.08Å
131	K	89	Confident	86.1	Confident	94 Å²	94	71.8 Å²	71.8	41%	0.409	35%	0.349	S	S	.	.	H	α-helix	trans	-63.7	-51.7	173.9	-172.5	-179.4	174.2	-174.3	0	111.4	E127 Q128 T133 F134 E135 V140 A143	E127-K131 WeakPolarHBondContact O-CB 3.44Å; E127-K131 PolarHBondContact O-N 3.18Å; Q128-K131 WeakPolarHBondContact O-CB 3.35Å; Q128-K131 PolarHBondContact O-N 3.3Å; Q128-K131 VanDerWaalsContact O-N 3.13Å; K131-T133 VanDerWaalsContact C-N 3.29Å; K131-T133 PolarHBondContact O-N 3.29Å; K131-F134 PolarHBondContact O-N 3.28Å; K131-E135 WeakPolarHBondContact O-CB 3.47Å; K131-E135 PolarHBondContact O-N 3.44Å; K131-V140 HydrophobicContact CG-CB 4.38Å; K131-V140 HydrophobicContact CG-CG1 4.27Å; K131-A143 HydrophobicContact CB-CB 4.38Å
132	E	88.9	Confident	86	Confident	125 Å²	125	75.5 Å²	75.5	58%	0.584	37%	0.366	S	S	*	.	H	α-helix	trans	-59.2	-34.7	179.9	-71.8	173.7	-161.7	0	0	113.9	Q128 K136	Q128-E132 WeakPolarHBondContact O-CG 3.41Å; Q128-E132 PolarHBondContact O-N 3.45Å; E132-K136 WeakPolarHBondContact O-CE 3.24Å
133	T	86.7	Confident	86.1	Confident	43 Å²	43	75 Å²	75	26%	0.264	36%	0.363	S	S	.	.	H	α-helix	trans	-75.9	-34.2	178.1	44.8	0	0	0	0	112.9	E129 L130 K131	E129-T133 WeakPolarHBondContact O-CB 3.31Å; E129-T133 WeakPolarHBondContact O-CG2 3.36Å; E129-T133 PolarHBondContact O-N 3.01Å; E129-T133 PolarHBondContact O-OG1 3.47Å; L130-T133 WeakPolarHBondContact CA-OG1 3.06Å; L130-T133 PolarHBondContact O-OG1 2.77Å; L130-T133 VanDerWaalsContact O-OG1 3.13Å; K131-T133 VanDerWaalsContact C-N 3.29Å; K131-T133 PolarHBondContact O-N 3.29Å
134	F	88.6	Confident	86.1	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-88.4	-27.2	-179.8	-80.4	-107.5	0	0	0	113.5	L116 I118 L130 K131 K136 F137 V140 V159 F161 A170 L174 V186	L116-F134 HydrophobicContact CD1-CE1 4.4Å; I118-F134 HydrophobicContact CD1-CD1 4.35Å; I118-F134 HydrophobicContact CD1-CD2 4.39Å; I118-F134 HydrophobicContact CD1-CE1 3.66Å; I118-F134 HydrophobicContact CD1-CE2 3.72Å; I118-F134 HydrophobicContact CD1-CZ 3.31Å; I118-F134 HydrophobicContact CG1-CE1 4.29Å; I118-F134 HydrophobicContact CG1-CZ 3.97Å; L130-F134 HydrophobicContact CD1-CD2 4.19Å; L130-F134 HydrophobicContact CD1-CE2 3.89Å; L130-F134 HydrophobicContact CG-CD2 4.4Å; L130-F134 WeakPolarHBondContact O-CB 3.38Å; L130-F134 VanDerWaalsContact O-CD2 3.27Å; L130-F134 WeakPolarHBondContact O-CD2 3.47Å; L130-F134 PolarHBondContact O-N 3.31Å; K131-F134 PolarHBondContact O-N 3.28Å; F134-K136 PolarHBondContact O-N 2.84Å; F134-K136 VanDerWaalsContact O-N 3.17Å; F134-F137 PolarHBondContact O-N 3.31Å; F134-V140 HydrophobicContact CB-CG2 3.94Å; F134-V159 HydrophobicContact CB-CG1 4.26Å; F134-V159 HydrophobicContact CD1-CB 4.5Å; F134-V159 HydrophobicContact CD1-CG1 4.19Å; F134-V159 HydrophobicContact CG-CG1 4.38Å; F134-V159 HydrophobicContact CG-CG2 4.47Å; F134-F161 HydrophobicContact CB-CZ 3.98Å; F134-F161 AromaticContact CD1-CE2 3.99Å; F134-F161 HydrophobicContact CD1-CE2 3.99Å; F134-F161 AromaticContact CD1-CZ 3.9Å; F134-F161 HydrophobicContact CD1-CZ 3.9Å; F134-F161 HydrophobicContact CG-CZ 4.45Å; F134-A170 HydrophobicContact CD1-CB 3.96Å; F134-A170 HydrophobicContact CE1-CB 4.23Å; F134-L174 HydrophobicContact CD1-CD1 3.77Å; F134-L174 HydrophobicContact CD2-CD1 3.79Å; F134-L174 HydrophobicContact CE1-CD1 3.59Å; F134-L174 HydrophobicContact CE2-CD1 3.62Å; F134-L174 HydrophobicContact CG-CD1 3.86Å; F134-L174 HydrophobicContact CZ-CB 4.28Å; F134-L174 HydrophobicContact CZ-CD1 3.51Å; F134-V186 HydrophobicContact CE1-CG1 4.38Å; F134-V186 HydrophobicContact CZ-CG2 4.14Å
135	E	88.4	Confident	86.4	Confident	98 Å²	98	64.3 Å²	64.3	46%	0.458	32%	0.323	S	S	.	.	H	α-helix	trans	-59.7	-27.8	178.7	-177.8	153.5	-141.9	0	0	112.9	K131 F137 G138	K131-E135 WeakPolarHBondContact O-CB 3.47Å; K131-E135 PolarHBondContact O-N 3.44Å; E135-F137 PolarHBondContact O-N 3.35Å; E135-F137 VanDerWaalsContact O-N 3.07Å; E135-G138 WeakPolarHBondContact CA-O 3.5Å; E135-G138 PolarHBondContact O-N 3.39Å; E135-G138 VanDerWaalsContact O-N 3.16Å
136	K	88.6	Confident	86.6	Confident	166 Å²	166	66 Å²	66	72%	0.722	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.5	173.3	-64.9	173.5	-174	177.1	0	114.1	E132 F134	E132-K136 WeakPolarHBondContact O-CE 3.24Å; F134-K136 PolarHBondContact O-N 2.84Å; F134-K136 VanDerWaalsContact O-N 3.17Å
137	F	84.5	Confident	86.6	Confident	59 Å²	59	68.6 Å²	68.6	26%	0.259	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-11.2	-178.7	-58.4	-84.6	0	0	0	113.3	F134 E135 G166 K169 A170 A173 L174	F134-F137 PolarHBondContact O-N 3.31Å; E135-F137 PolarHBondContact O-N 3.35Å; E135-F137 VanDerWaalsContact O-N 3.07Å; F137-G166 WeakPolarHBondContact O-CA 3.26Å; F137-K169 HydrophobicContact CB-CB 4.47Å; F137-A170 HydrophobicContact CB-CB 3.88Å; F137-A170 HydrophobicContact CG-CB 4.22Å; F137-A173 HydrophobicContact CD1-CB 4.06Å; F137-A173 HydrophobicContact CE1-CB 3.39Å; F137-A173 HydrophobicContact CZ-CB 3.93Å; F137-L174 HydrophobicContact CD2-CD1 3.85Å; F137-L174 HydrophobicContact CD2-CG 4.27Å; F137-L174 HydrophobicContact CE2-CD1 3.7Å; F137-L174 HydrophobicContact CE2-CD2 3.72Å; F137-L174 HydrophobicContact CE2-CG 3.75Å; F137-L174 HydrophobicContact CZ-CD2 3.98Å; F137-L174 HydrophobicContact CZ-CG 4.12Å
138	G	85.5	Confident	86.3	Confident	24 Å²	24	67.9 Å²	67.9	25%	0.247	34%	0.34	C	S	.	.	S	Bend	trans	160.3	167.3	176.3	0	0	0	0	0	112.9	E135 V140 F161	E135-G138 WeakPolarHBondContact CA-O 3.5Å; E135-G138 PolarHBondContact O-N 3.39Å; E135-G138 VanDerWaalsContact O-N 3.16Å; G138-V140 PolarHBondContact O-N 3.09Å; G138-V140 VanDerWaalsContact O-N 3.09Å; G138-F161 WeakPolarHBondContact O-CE1 3.31Å
139	T	87.8	Confident	85.9	Confident	80 Å²	80	67.2 Å²	67.2	49%	0.491	35%	0.349	S	S	.	.			trans	-63.8	112.1	-178.7	-46	0	0	0	0	111.9	K162	T139-K162 HydrophobicContact CG2-CD 4.49Å; T139-K162 PolarHBondContact O-N 3.21Å
140	V	87.6	Confident	85.5	Confident	9 Å²	9	69 Å²	69	6%	0.055	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.6	172.7	174.8	0	0	0	0	109.9	K131 F134 G138 A143 V159 F161	K131-V140 HydrophobicContact CG-CB 4.38Å; K131-V140 HydrophobicContact CG-CG1 4.27Å; F134-V140 HydrophobicContact CB-CG2 3.94Å; G138-V140 PolarHBondContact O-N 3.09Å; G138-V140 VanDerWaalsContact O-N 3.09Å; V140-A143 HydrophobicContact CG1-CB 4.34Å; V140-V159 HydrophobicContact CG1-CG1 3.89Å; V140-V159 HydrophobicContact CG2-CG1 3.92Å; V140-F161 HydrophobicContact CG2-CD1 4.16Å; V140-F161 HydrophobicContact CG2-CE1 3.75Å; V140-F161 HydrophobicContact CG2-CZ 4.06Å
141	M	84.8	Confident	84.9	Confident	134 Å²	134	71.3 Å²	71.3	66%	0.66	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	-36.8	176.6	-66.4	-175.8	62	0	0	113.2	Q160 K162	M141-Q160 HydrophobicContact CB-CG 4.32Å; M141-Q160 PolarHBondContact N-O 3.24Å; M141-K162 HydrophobicContact CG-CB 3.95Å; M141-K162 HydrophobicContact SD-CB 3.86Å; M141-K162 HydrophobicContact SD-CG 4.08Å
142	E	83.4	Confident	84.3	Confident	85 Å²	85	73.9 Å²	73.9	40%	0.397	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	142.5	-173.5	-174.1	-162.8	130.1	0	0	108.5	R115 V159 Q160	R115-E142 IonicContact CZ-OE1 3.16Å; R115-E142 IonicContact NH1-OE1 3.19Å; R115-E142 PolarHBondContact NH1-OE1 2.74Å; R115-E142 IonicContact NH1-OE2 3.21Å; R115-E142 IonicContact NH2-OE1 2.61Å; R115-E142 PolarHBondContact NH2-OE1 3.27Å; E142-V159 WeakPolarHBondContact O-CA 3.28Å; E142-Q160 HydrophobicContact CB-CB 3.99Å; E142-Q160 PolarHBondContact O-N 3.05Å
143	A	87.5	Confident	84	Confident	2 Å²	2	71 Å²	71	2%	0.017	38%	0.384	C	S	.	.			trans	-138	35.5	-174.6	0	0	0	0	0	113.5	E127 K131 V140 I145 F158 V159	E127-A143 HydrophobicContact CG-CB 3.82Å; E127-A143 WeakPolarHBondContact CG-O 3.49Å; E127-A143 PolarHBondContact OE1-N 3.04Å; K131-A143 HydrophobicContact CB-CB 4.38Å; V140-A143 HydrophobicContact CG1-CB 4.34Å; A143-I145 PolarHBondContact O-N 3.14Å; A143-F158 CarbonylContact C-O 3.48Å; A143-F158 VanDerWaalsContact CA-O 3.3Å; A143-F158 WeakPolarHBondContact CA-O 3.33Å; A143-V159 HydrophobicContact CB-CG2 4.21Å
144	S	85.6	Confident	83.5	Confident	43 Å²	43	75.9 Å²	75.9	30%	0.301	40%	0.398	S	S	.	.			trans	-56.3	131	-171	-174.9	0	0	0	0	114.8	E127 P146 F158	E127-S144 PolarHBondContact OE1-N 3.27Å; S144-P146 WeakPolarHBondContact O-CD 3.41Å; S144-F158 PolarHBondContact N-O 2.8Å; S144-F158 VanDerWaalsContact N-O 3.11Å; S144-F158 PolarHBondContact O-N 3.38Å
145	I	88.2	Confident	83.2	Confident	21 Å²	21	76.6 Å²	76.6	11%	0.108	40%	0.404	C	S	.	.			trans	-107.2	106.7	171.7	-52.5	-175.8	0	0	0	109.9	L121 E127 L130 A143 L147 M153 A157	L121-I145 HydrophobicContact CD2-CD1 4.23Å; E127-I145 HydrophobicContact CB-CD1 4.35Å; E127-I145 HydrophobicContact CB-CG1 4.44Å; L130-I145 HydrophobicContact CD2-CG1 4.35Å; A143-I145 PolarHBondContact O-N 3.14Å; I145-L147 PolarHBondContact O-N 3.47Å; I145-M153 HydrophobicContact CG2-CG 4.38Å; I145-M153 HydrophobicContact CG2-SD 4.46Å; I145-A157 HydrophobicContact CB-CB 4.49Å; I145-A157 HydrophobicContact CG1-CB 3.9Å
146	P	85.3	Confident	83.3	Confident	38 Å²	38	75 Å²	75	25%	0.247	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-66.1	128.8	178	-26.1	38	0	0	0	113.7	S144 R154 F156 F158	S144-P146 WeakPolarHBondContact O-CD 3.41Å; P146-R154 WeakPolarHBondContact O-CB 3.24Å; P146-R154 PolarHBondContact O-N 2.92Å; P146-R154 VanDerWaalsContact O-N 3.08Å; P146-F156 HydrophobicContact CB-CE2 4.22Å; P146-F156 HydrophobicContact CG-CD2 4.39Å; P146-F156 HydrophobicContact CG-CE2 3.87Å; P146-F158 HydrophobicContact CG-CD2 3.97Å; P146-F158 HydrophobicContact CG-CE2 3.94Å
147	L	85	Confident	83.4	Confident	111 Å²	111	67.1 Å²	67.1	58%	0.581	36%	0.362	S	S	*	.	B	Isolated β-bridge	trans	-94.1	153.2	174.4	-63.9	142.7	0	0	0	110	I145 G151 M153	I145-L147 PolarHBondContact O-N 3.47Å; L147-G151 VanDerWaalsContact CD2-O 3.29Å; L147-G151 WeakPolarHBondContact CD2-O 3.28Å; L147-M153 HydrophobicContact CD2-CG 3.85Å
148	K	80.9	Confident	83.8	Confident	81 Å²	81	66.5 Å²	66.5	35%	0.352	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-69.9	162.1	164.7	-74.3	-166.2	179.3	-171.1	0	111	D150 G151 K152	K148-D150 HydrophobicContact CB-CB 4.31Å; K148-D150 WeakPolarHBondContact CD-OD2 3.22Å; K148-D150 IonicContact NZ-OD2 3.2Å; K148-D150 PolarHBondContact O-N 2.62Å; K148-G151 PolarHBondContact O-N 2.63Å; K148-K152 VanDerWaalsContact CB-O 3.32Å; K148-K152 WeakPolarHBondContact CB-O 3.45Å; K148-K152 WeakPolarHBondContact CG-O 3.49Å; K148-K152 PolarHBondContact N-O 2.92Å
149	P	75.8	Confident	84	Confident	132 Å²	132	65.4 Å²	65.4	86%	0.857	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-34.9	163	22.9	-33.8	0	0	0	112.2	G151	P149-G151 PolarHBondContact O-N 2.89Å
150	D	76.3	Confident	84.1	Confident	99 Å²	99	62.1 Å²	62.1	53%	0.529	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	8.8	174.6	-22	-36.9	0	0	0	114.9	K148 K152	K148-D150 HydrophobicContact CB-CB 4.31Å; K148-D150 WeakPolarHBondContact CD-OD2 3.22Å; K148-D150 IonicContact NZ-OD2 3.2Å; K148-D150 PolarHBondContact O-N 2.62Å; D150-K152 PolarHBondContact O-N 3.04Å
151	G	73.9	Confident	84.2	Confident	54 Å²	54	61.8 Å²	61.8	56%	0.557	33%	0.325	S	S	*	.	S	Bend	trans	69.1	-6	-176.3	0	0	0	0	0	115.8	L147 K148 P149	L147-G151 VanDerWaalsContact CD2-O 3.29Å; L147-G151 WeakPolarHBondContact CD2-O 3.28Å; K148-G151 PolarHBondContact O-N 2.63Å; P149-G151 PolarHBondContact O-N 2.89Å
152	K	78	Confident	84.3	Confident	148 Å²	148	62.1 Å²	62.1	64%	0.643	32%	0.322	S	S	*	.			trans	-83.8	134.8	-179	-65.9	170.9	-175.2	173.5	0	111	K148 D150	K148-K152 VanDerWaalsContact CB-O 3.32Å; K148-K152 WeakPolarHBondContact CB-O 3.45Å; K148-K152 WeakPolarHBondContact CG-O 3.49Å; K148-K152 PolarHBondContact N-O 2.92Å; D150-K152 PolarHBondContact O-N 3.04Å
153	M	80.9	Confident	84.4	Confident	65 Å²	65	62.3 Å²	62.3	32%	0.32	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-58.5	141.9	177.9	-67.6	178.9	179.2	0	0	112.1	F123 C125 I145 L147 G155	F123-M153 HydrophobicContact CD1-CB 4.27Å; C125-M153 WeakPolarHBondContact O-CE 3.45Å; I145-M153 HydrophobicContact CG2-CG 4.38Å; I145-M153 HydrophobicContact CG2-SD 4.46Å; L147-M153 HydrophobicContact CD2-CG 3.85Å; M153-G155 VanDerWaalsContact C-N 3.33Å; M153-G155 PolarHBondContact O-N 2.81Å
154	R	77.3	Confident	84.3	Confident	145 Å²	145	67.4 Å²	67.4	55%	0.547	35%	0.351	S	S	.	.			trans	-80.2	-7.7	-174.9	-158	60.5	168.9	104.5	-6.9	115	P146 F156	P146-R154 WeakPolarHBondContact O-CB 3.24Å; P146-R154 PolarHBondContact O-N 2.92Å; P146-R154 VanDerWaalsContact O-N 3.08Å; R154-F156 HydrophobicContact CB-CD1 4.11Å; R154-F156 HydrophobicContact CB-CE1 3.87Å; R154-F156 HydrophobicContact CB-CZ 4.32Å; R154-F156 HydrophobicContact CG-CD1 3.89Å; R154-F156 HydrophobicContact CG-CE1 3.31Å; R154-F156 HydrophobicContact CG-CZ 3.95Å
155	G	82.5	Confident	84.2	Confident	14 Å²	14	69.1 Å²	69.1	14%	0.144	36%	0.363	C	S	.	.	S	Bend	trans	84.4	13.3	-179	0	0	0	0	0	114.4	N120 L121 M153	N120-G155 PolarHBondContact N-O 2.64Å; L121-G155 PolarHBondContact N-O 3.44Å; M153-G155 VanDerWaalsContact C-N 3.33Å; M153-G155 PolarHBondContact O-N 2.81Å
156	F	89.9	Confident	84.1	Confident	66 Å²	66	68.3 Å²	68.3	29%	0.289	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	162	171.3	65.3	-103	0	0	0	111.2	I118 P146 R154 F158	I118-F156 CarbonylContact O-C 3.57Å; I118-F156 WeakPolarHBondContact O-CA 3.5Å; I118-F156 WeakPolarHBondContact O-CB 3.37Å; P146-F156 HydrophobicContact CB-CE2 4.22Å; P146-F156 HydrophobicContact CG-CD2 4.39Å; P146-F156 HydrophobicContact CG-CE2 3.87Å; R154-F156 HydrophobicContact CB-CD1 4.11Å; R154-F156 HydrophobicContact CB-CE1 3.87Å; R154-F156 HydrophobicContact CB-CZ 4.32Å; R154-F156 HydrophobicContact CG-CD1 3.89Å; R154-F156 HydrophobicContact CG-CE1 3.31Å; R154-F156 HydrophobicContact CG-CZ 3.95Å; F156-F158 HydrophobicContact CD2-CE2 4.32Å; F156-F158 AromaticContact CE2-CE2 3.88Å; F156-F158 HydrophobicContact CE2-CE2 3.88Å; F156-F158 HydrophobicContact CE2-CZ 4.13Å
157	A	90.3	Very high	84.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	167.2	178.9	0	0	0	0	0	111.7	I118 L121 L130 I145	I118-A157 HydrophobicContact CB-CB 4.35Å; I118-A157 PolarHBondContact N-O 3.13Å; I118-A157 PolarHBondContact O-N 3.12Å; L121-A157 HydrophobicContact CD2-CB 3.84Å; L130-A157 HydrophobicContact CD2-CB 3.42Å; L130-A157 VanDerWaalsContact CD2-CB 3.42Å; I145-A157 HydrophobicContact CB-CB 4.49Å; I145-A157 HydrophobicContact CG1-CB 3.9Å
158	F	92.5	Very high	84.4	Confident	46 Å²	46	63.5 Å²	63.5	20%	0.202	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.5	173.3	-65.3	-73.4	0	0	0	110.7	R115 L116 V117 A143 S144 P146 F156 A189	R115-F158 VanDerWaalsContact NH2-CB 3.28Å; L116-F158 WeakPolarHBondContact O-CA 3.41Å; V117-F158 HydrophobicContact CB-CD1 3.89Å; V117-F158 HydrophobicContact CB-CE1 3.8Å; V117-F158 HydrophobicContact CG2-CD1 3.91Å; V117-F158 HydrophobicContact CG2-CE1 3.56Å; V117-F158 HydrophobicContact CG2-CZ 4.29Å; A143-F158 CarbonylContact C-O 3.48Å; A143-F158 VanDerWaalsContact CA-O 3.3Å; A143-F158 WeakPolarHBondContact CA-O 3.33Å; S144-F158 PolarHBondContact N-O 2.8Å; S144-F158 VanDerWaalsContact N-O 3.11Å; S144-F158 PolarHBondContact O-N 3.38Å; P146-F158 HydrophobicContact CG-CD2 3.97Å; P146-F158 HydrophobicContact CG-CE2 3.94Å; F156-F158 HydrophobicContact CD2-CE2 4.32Å; F156-F158 AromaticContact CE2-CE2 3.88Å; F156-F158 HydrophobicContact CE2-CE2 3.88Å; F156-F158 HydrophobicContact CE2-CZ 4.13Å; F158-A189 HydrophobicContact CD1-CB 4.04Å; F158-A189 HydrophobicContact CE1-CB 4.19Å
159	V	91.2	Very high	84.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123.4	176.4	171.1	0	0	0	0	109.4	R115 L116 I118 L130 F134 V140 E142 A143 F161	R115-V159 WeakPolarHBondContact CA-O 3.5Å; L116-V159 PolarHBondContact N-O 3Å; L116-V159 PolarHBondContact O-N 3.12Å; I118-V159 HydrophobicContact CD1-CB 4.06Å; I118-V159 HydrophobicContact CD1-CG2 3.45Å; I118-V159 VanDerWaalsContact CD1-CG2 3.45Å; L130-V159 HydrophobicContact CD2-CG2 3.83Å; L130-V159 HydrophobicContact CG-CG2 4.08Å; F134-V159 HydrophobicContact CB-CG1 4.26Å; F134-V159 HydrophobicContact CD1-CB 4.5Å; F134-V159 HydrophobicContact CD1-CG1 4.19Å; F134-V159 HydrophobicContact CG-CG1 4.38Å; F134-V159 HydrophobicContact CG-CG2 4.47Å; V140-V159 HydrophobicContact CG1-CG1 3.89Å; V140-V159 HydrophobicContact CG2-CG1 3.92Å; E142-V159 WeakPolarHBondContact O-CA 3.28Å; A143-V159 HydrophobicContact CB-CG2 4.21Å; V159-F161 HydrophobicContact CG1-CD2 4.09Å; V159-F161 HydrophobicContact CG1-CE2 3.72Å; V159-F161 HydrophobicContact CG1-CZ 4.25Å
160	Q	90.3	Very high	85.4	Confident	12 Å²	12	59.5 Å²	59.5	6%	0.056	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.8	175	-178.7	62.8	60.4	0	0	109.6	S111 Q113 R115 M141 E142	S111-Q160 VanDerWaalsContact O-CD 3.28Å; S111-Q160 PolarHBondContact O-NE2 3.42Å; S111-Q160 PolarHBondContact O-OE1 2.89Å; Q113-Q160 PolarHBondContact O-NE2 3.49Å; R115-Q160 VanDerWaalsContact CB-OE1 3.28Å; M141-Q160 HydrophobicContact CB-CG 4.32Å; M141-Q160 PolarHBondContact N-O 3.24Å; E142-Q160 HydrophobicContact CB-CB 3.99Å; E142-Q160 PolarHBondContact O-N 3.05Å
161	F	89.6	Confident	86.1	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.009	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	151.3	168.2	-75.4	-89.2	0	0	0	111.6	G114 L116 F134 G138 V140 V159 N163 A167 A170	G114-F161 PolarHBondContact O-N 2.79Å; G114-F161 VanDerWaalsContact O-N 3.07Å; L116-F161 HydrophobicContact CD1-CD2 4.33Å; L116-F161 HydrophobicContact CD1-CE2 3.84Å; L116-F161 HydrophobicContact CG-CE2 4.45Å; F134-F161 HydrophobicContact CB-CZ 3.98Å; F134-F161 AromaticContact CD1-CE2 3.99Å; F134-F161 HydrophobicContact CD1-CE2 3.99Å; F134-F161 AromaticContact CD1-CZ 3.9Å; F134-F161 HydrophobicContact CD1-CZ 3.9Å; F134-F161 HydrophobicContact CG-CZ 4.45Å; G138-F161 WeakPolarHBondContact O-CE1 3.31Å; V140-F161 HydrophobicContact CG2-CD1 4.16Å; V140-F161 HydrophobicContact CG2-CE1 3.75Å; V140-F161 HydrophobicContact CG2-CZ 4.06Å; V159-F161 HydrophobicContact CG1-CD2 4.09Å; V159-F161 HydrophobicContact CG1-CE2 3.72Å; V159-F161 HydrophobicContact CG1-CZ 4.25Å; F161-N163 VanDerWaalsContact C-N 3.34Å; F161-A167 HydrophobicContact CB-CB 4.16Å; F161-A167 HydrophobicContact CD2-CB 3.7Å; F161-A167 HydrophobicContact CE2-CB 4.42Å; F161-A167 HydrophobicContact CG-CB 4.12Å; F161-A170 HydrophobicContact CE2-CB 3.81Å; F161-A170 HydrophobicContact CZ-CB 3.56Å
162	K	85.5	Confident	86.7	Confident	140 Å²	140	61.1 Å²	61.1	61%	0.609	29%	0.294	S	S	*	.	S	Bend	trans	-69.7	-31.8	169.3	-172.7	177.1	178.4	178.8	0	112.6	T139 M141	T139-K162 HydrophobicContact CG2-CD 4.49Å; T139-K162 PolarHBondContact O-N 3.21Å; M141-K162 HydrophobicContact CG-CB 3.95Å; M141-K162 HydrophobicContact SD-CB 3.86Å; M141-K162 HydrophobicContact SD-CG 4.08Å
163	N	85.8	Confident	87.1	Confident	89 Å²	89	56.2 Å²	56.2	48%	0.476	28%	0.281	S	S	.	.	S	Bend	trans	-124.2	127.8	-176.8	-63.9	-3.6	0	0	0	109.9	F161 S165 G166 A167	F161-N163 VanDerWaalsContact C-N 3.34Å; N163-S165 PolarHBondContact O-N 3Å; N163-G166 PolarHBondContact O-N 2.93Å; N163-A167 PolarHBondContact O-N 3.46Å
164	M	85.4	Confident	87.3	Confident	110 Å²	110	53.6 Å²	53.6	54%	0.542	27%	0.268	S	S	.	.	H	α-helix	trans	-56.6	-33.6	175.8	-173.9	178	-179.6	0	0	112.7	G166 A167 T168 W188	M164-G166 VanDerWaalsContact C-N 3.26Å; M164-G166 PolarHBondContact O-N 3.28Å; M164-A167 WeakPolarHBondContact O-CB 3.29Å; M164-A167 PolarHBondContact O-N 2.6Å; M164-A167 VanDerWaalsContact O-N 3.16Å; M164-T168 PolarHBondContact O-N 3Å; M164-T168 PolarHBondContact O-OG1 3.2Å; M164-W188 HydrophobicContact CE-CH2 4.11Å; M164-W188 HydrophobicContact CG-CH2 4.12Å; M164-W188 HydrophobicContact CG-CZ3 4.43Å
165	S	84.6	Confident	87.8	Confident	79 Å²	79	50.1 Å²	50.1	55%	0.552	26%	0.261	S	S	*	.	H	α-helix	trans	-67.6	-20.3	175.8	54.7	0	0	0	0	114.6	N163 K169	N163-S165 PolarHBondContact O-N 3Å; S165-K169 WeakPolarHBondContact O-CG 3.44Å
166	G	85.9	Confident	87.9	Confident	4 Å²	4	55 Å²	55	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-77.7	-43.2	168.2	0	0	0	0	0	111.4	F137 N163 M164 T168 K169 A170	F137-G166 WeakPolarHBondContact O-CA 3.26Å; N163-G166 PolarHBondContact O-N 2.93Å; M164-G166 VanDerWaalsContact C-N 3.26Å; M164-G166 PolarHBondContact O-N 3.28Å; G166-T168 PolarHBondContact O-N 3.08Å; G166-K169 PolarHBondContact O-N 3.4Å; G166-A170 PolarHBondContact O-N 3.47Å
167	A	88.3	Confident	87.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.6	-46.5	175.8	0	0	0	0	0	112.2	L116 F161 N163 M164 K169 A170 L171 W188	L116-A167 HydrophobicContact CD1-CB 4.31Å; L116-A167 HydrophobicContact CD2-CB 4.08Å; L116-A167 HydrophobicContact CG-CB 4.11Å; F161-A167 HydrophobicContact CB-CB 4.16Å; F161-A167 HydrophobicContact CD2-CB 3.7Å; F161-A167 HydrophobicContact CE2-CB 4.42Å; F161-A167 HydrophobicContact CG-CB 4.12Å; N163-A167 PolarHBondContact O-N 3.46Å; M164-A167 WeakPolarHBondContact O-CB 3.29Å; M164-A167 PolarHBondContact O-N 2.6Å; M164-A167 VanDerWaalsContact O-N 3.16Å; A167-K169 VanDerWaalsContact C-N 3.3Å; A167-K169 PolarHBondContact O-N 2.88Å; A167-A170 PolarHBondContact O-N 2.88Å; A167-L171 VanDerWaalsContact O-CB 3.28Å; A167-L171 WeakPolarHBondContact O-CB 3.47Å; A167-L171 PolarHBondContact O-N 3.06Å; A167-W188 HydrophobicContact CB-CH2 4.02Å; A167-W188 HydrophobicContact CB-CZ3 3.83Å
168	T	88.6	Confident	87.4	Confident	47 Å²	47	63.3 Å²	63.3	29%	0.288	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-36	177.7	-48.4	0	0	0	0	112.6	M164 G166 Q172	M164-T168 PolarHBondContact O-N 3Å; M164-T168 PolarHBondContact O-OG1 3.2Å; G166-T168 PolarHBondContact O-N 3.08Å; T168-Q172 WeakPolarHBondContact O-CG 3.19Å; T168-Q172 PolarHBondContact O-N 3.35Å; T168-Q172 VanDerWaalsContact O-N 3.1Å
169	K	89	Confident	86.9	Confident	130 Å²	130	62.4 Å²	62.4	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-70.1	-43.8	176.2	-73.7	176	178	-174.7	0	112.2	F137 S165 G166 A167 L171 Q172 A173	F137-K169 HydrophobicContact CB-CB 4.47Å; S165-K169 WeakPolarHBondContact O-CG 3.44Å; G166-K169 PolarHBondContact O-N 3.4Å; A167-K169 VanDerWaalsContact C-N 3.3Å; A167-K169 PolarHBondContact O-N 2.88Å; K169-L171 VanDerWaalsContact C-N 3.34Å; K169-Q172 PolarHBondContact O-N 3.23Å; K169-A173 VanDerWaalsContact O-CB 3.28Å; K169-A173 WeakPolarHBondContact O-CB 3.28Å; K169-A173 PolarHBondContact O-N 3Å
170	A	88.3	Confident	86.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-44.1	175.2	0	0	0	0	0	111.1	L116 F134 F137 F161 G166 A167 Q172 A173 L174	L116-A170 HydrophobicContact CD1-CB 4.04Å; F134-A170 HydrophobicContact CD1-CB 3.96Å; F134-A170 HydrophobicContact CE1-CB 4.23Å; F137-A170 HydrophobicContact CB-CB 3.88Å; F137-A170 HydrophobicContact CG-CB 4.22Å; F161-A170 HydrophobicContact CE2-CB 3.81Å; F161-A170 HydrophobicContact CZ-CB 3.56Å; G166-A170 PolarHBondContact O-N 3.47Å; A167-A170 PolarHBondContact O-N 2.88Å; A170-Q172 PolarHBondContact O-N 2.76Å; A170-A173 PolarHBondContact O-N 2.83Å; A170-L174 HydrophobicContact CB-CD1 4.4Å; A170-L174 VanDerWaalsContact O-CB 3.26Å; A170-L174 WeakPolarHBondContact O-CB 3.14Å; A170-L174 PolarHBondContact O-N 3.07Å
171	L	90.1	Very high	85.6	Confident	30 Å²	30	69.7 Å²	69.7	16%	0.157	37%	0.368	C	S	.	.	H	α-helix	trans	-54.6	-51.3	174.8	-179.9	69.2	0	0	0	111.8	L116 A167 K169 A173 N175 V186 W188	L116-L171 HydrophobicContact CD1-CB 4.47Å; L116-L171 HydrophobicContact CD2-CB 4.49Å; A167-L171 VanDerWaalsContact O-CB 3.28Å; A167-L171 WeakPolarHBondContact O-CB 3.47Å; A167-L171 PolarHBondContact O-N 3.06Å; K169-L171 VanDerWaalsContact C-N 3.34Å; L171-A173 PolarHBondContact O-N 2.85Å; L171-N175 WeakPolarHBondContact O-CB 3.48Å; L171-N175 PolarHBondContact O-N 3.16Å; L171-V186 VanDerWaalsContact CD1-C 3.49Å; L171-V186 HydrophobicContact CD1-CB 4.21Å; L171-V186 HydrophobicContact CD1-CG1 3.93Å; L171-V186 WeakPolarHBondContact CD1-O 3.38Å; L171-W188 HydrophobicContact CD2-CD2 4.48Å; L171-W188 HydrophobicContact CD2-CZ2 3.92Å; L171-W188 VanDerWaalsContact CD2-NE1 3.35Å
172	Q	86.8	Confident	85.3	Confident	156 Å²	156	74.1 Å²	74.1	73%	0.729	39%	0.385	S	S	*	.	H	α-helix	trans	-69.6	-28.9	-178.6	-72.9	175.5	-27.4	0	0	114	T168 K169 A170	T168-Q172 WeakPolarHBondContact O-CG 3.19Å; T168-Q172 PolarHBondContact O-N 3.35Å; T168-Q172 VanDerWaalsContact O-N 3.1Å; K169-Q172 PolarHBondContact O-N 3.23Å; A170-Q172 PolarHBondContact O-N 2.76Å
173	A	85.9	Confident	85.4	Confident	46 Å²	46	72.5 Å²	72.5	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-105.3	-10.2	-171.2	0	0	0	0	0	115.3	F137 K169 A170 L171	F137-A173 HydrophobicContact CD1-CB 4.06Å; F137-A173 HydrophobicContact CE1-CB 3.39Å; F137-A173 HydrophobicContact CZ-CB 3.93Å; K169-A173 VanDerWaalsContact O-CB 3.28Å; K169-A173 WeakPolarHBondContact O-CB 3.28Å; K169-A173 PolarHBondContact O-N 3Å; A170-A173 PolarHBondContact O-N 2.83Å; L171-A173 PolarHBondContact O-N 2.85Å
174	L	84.8	Confident	85.5	Confident	9 Å²	9	68.3 Å²	68.3	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-120.5	-12.8	-179.6	-61.2	177.5	0	0	0	114	F134 F137 A170 L176 K177 V186	F134-L174 HydrophobicContact CD1-CD1 3.77Å; F134-L174 HydrophobicContact CD2-CD1 3.79Å; F134-L174 HydrophobicContact CE1-CD1 3.59Å; F134-L174 HydrophobicContact CE2-CD1 3.62Å; F134-L174 HydrophobicContact CG-CD1 3.86Å; F134-L174 HydrophobicContact CZ-CB 4.28Å; F134-L174 HydrophobicContact CZ-CD1 3.51Å; F137-L174 HydrophobicContact CD2-CD1 3.85Å; F137-L174 HydrophobicContact CD2-CG 4.27Å; F137-L174 HydrophobicContact CE2-CD1 3.7Å; F137-L174 HydrophobicContact CE2-CD2 3.72Å; F137-L174 HydrophobicContact CE2-CG 3.75Å; F137-L174 HydrophobicContact CZ-CD2 3.98Å; F137-L174 HydrophobicContact CZ-CG 4.12Å; A170-L174 HydrophobicContact CB-CD1 4.4Å; A170-L174 VanDerWaalsContact O-CB 3.26Å; A170-L174 WeakPolarHBondContact O-CB 3.14Å; A170-L174 PolarHBondContact O-N 3.07Å; L174-L176 PolarHBondContact O-N 3.42Å; L174-K177 HydrophobicContact CD2-CD 3.74Å; L174-K177 VanDerWaalsContact O-CB 3.32Å; L174-K177 WeakPolarHBondContact O-CB 3.41Å; L174-K177 PolarHBondContact O-N 2.86Å; L174-K177 VanDerWaalsContact O-N 3.12Å; L174-V186 HydrophobicContact CB-CG2 4.2Å
175	N	89	Confident	85.6	Confident	72 Å²	72	64.2 Å²	64.2	39%	0.385	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	135.3	170.8	-168.7	29.4	0	0	0	110.3	L171 K177 A185 V186	L171-N175 WeakPolarHBondContact O-CB 3.48Å; L171-N175 PolarHBondContact O-N 3.16Å; N175-K177 PolarHBondContact O-N 3.38Å; N175-A185 VanDerWaalsContact OD1-CA 3.29Å; N175-A185 WeakPolarHBondContact OD1-CA 3.48Å; N175-V186 HydrophobicContact CB-CB 4.25Å; N175-V186 PolarHBondContact OD1-N 3.28Å
176	L	84.4	Confident	85.9	Confident	117 Å²	117	60.5 Å²	60.5	61%	0.613	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	6.6	-171.3	-51.3	178.2	0	0	0	115.7	L174 V184	L174-L176 PolarHBondContact O-N 3.42Å; L176-V184 WeakPolarHBondContact CA-O 3.47Å; L176-V184 PolarHBondContact N-O 2.9Å
177	K	84.9	Confident	86.1	Confident	116 Å²	116	62.7 Å²	62.7	50%	0.504	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	142.7	179.5	-169.3	168.5	-172.9	165.8	0	112.1	L174 N175 V184	L174-K177 HydrophobicContact CD2-CD 3.74Å; L174-K177 VanDerWaalsContact O-CB 3.32Å; L174-K177 WeakPolarHBondContact O-CB 3.41Å; L174-K177 PolarHBondContact O-N 2.86Å; L174-K177 VanDerWaalsContact O-N 3.12Å; N175-K177 PolarHBondContact O-N 3.38Å; K177-V184 PolarHBondContact O-N 3.28Å
178	E	85	Confident	86.2	Confident	124 Å²	124	67.6 Å²	67.6	58%	0.579	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	128.3	177.2	-67.6	-172.3	-171.5	0	0	113.6	R182 Q183	E178-R182 WeakPolarHBondContact CA-O 3.44Å; E178-Q183 HydrophobicContact CG-CB 4.48Å; E178-Q183 HydrophobicContact CG-CG 3.5Å; E178-Q183 VanDerWaalsContact CG-CG 3.5Å; E178-Q183 PolarHBondContact OE1-NE2 3.23Å
179	I	80.7	Confident	86.2	Confident	27 Å²	27	66.7 Å²	66.7	14%	0.138	34%	0.341	C	S	.	.	S	Bend	trans	-128.3	115.1	170.8	-51.5	-173.9	0	0	0	108.1	G181 R182 V184	I179-G181 PolarHBondContact O-N 3.44Å; I179-R182 PolarHBondContact N-O 3.26Å; I179-R182 PolarHBondContact O-N 2.91Å; I179-V184 HydrophobicContact CB-CG2 3.87Å; I179-V184 HydrophobicContact CD1-CB 4.35Å; I179-V184 HydrophobicContact CD1-CG1 4.5Å; I179-V184 HydrophobicContact CD1-CG2 4.01Å; I179-V184 HydrophobicContact CG1-CB 4.4Å; I179-V184 HydrophobicContact CG1-CG2 3.86Å
180	K	76.9	Confident	85.9	Confident	100 Å²	100	64.3 Å²	64.3	44%	0.435	34%	0.337	S	S	.	.	S	Bend	trans	48.7	51	-176.9	-73	-177.9	167.1	170.2	0	113.5	S122 K124 E129	S122-K180 PolarHBondContact OG-O 2.87Å; K124-K180 HydrophobicContact CB-CD 4.28Å; K124-K180 PolarHBondContact O-NZ 2.95Å; E129-K180 WeakPolarHBondContact OE1-CE 3.48Å; E129-K180 IonicContact OE1-NZ 2.69Å; E129-K180 PolarHBondContact OE1-NZ 3.03Å; E129-K180 WeakPolarHBondContact OE2-CE 3.44Å; E129-K180 IonicContact OE2-NZ 3.55Å; E129-K180 PolarHBondContact OE2-NZ 2.81Å
181	G	77.9	Confident	85.4	Confident	66 Å²	66	67.8 Å²	67.8	68%	0.68	36%	0.36	S	S	*	.	S	Bend	trans	74.6	23.7	172.8	0	0	0	0	0	115.3	I179	I179-G181 PolarHBondContact O-N 3.44Å
182	R	84.4	Confident	84.6	Confident	95 Å²	95	73.9 Å²	73.9	36%	0.358	39%	0.385	S	S	.	.	S	Bend	trans	-140.4	137.2	169	-67.9	-172.2	-179.6	162.2	-1	110.6	F123 E178 I179 V184	F123-R182 VanDerWaalsContact CE2-NH1 3.33Å; E178-R182 WeakPolarHBondContact CA-O 3.44Å; I179-R182 PolarHBondContact N-O 3.26Å; I179-R182 PolarHBondContact O-N 2.91Å; R182-V184 PolarHBondContact O-N 3.18Å
183	Q	86.7	Confident	84	Confident	106 Å²	106	73.5 Å²	73.5	50%	0.495	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.3	171.6	-68.1	176.9	3.9	0	0	109.8	N120 E178	N120-Q183 PolarHBondContact ND2-O 3.1Å; E178-Q183 HydrophobicContact CG-CB 4.48Å; E178-Q183 HydrophobicContact CG-CG 3.5Å; E178-Q183 VanDerWaalsContact CG-CG 3.5Å; E178-Q183 PolarHBondContact OE1-NE2 3.23Å
184	V	87.9	Confident	83.6	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.006	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	125.7	-174.8	171.7	0	0	0	0	109.5	I118 L121 L176 K177 I179 R182 V186	I118-V184 HydrophobicContact CG2-CG1 3.28Å; L121-V184 HydrophobicContact CD1-CG2 4.14Å; L176-V184 WeakPolarHBondContact CA-O 3.47Å; L176-V184 PolarHBondContact N-O 2.9Å; K177-V184 PolarHBondContact O-N 3.28Å; I179-V184 HydrophobicContact CB-CG2 3.87Å; I179-V184 HydrophobicContact CD1-CB 4.35Å; I179-V184 HydrophobicContact CD1-CG1 4.5Å; I179-V184 HydrophobicContact CD1-CG2 4.01Å; I179-V184 HydrophobicContact CG1-CB 4.4Å; I179-V184 HydrophobicContact CG1-CG2 3.86Å; R182-V184 PolarHBondContact O-N 3.18Å; V184-V186 HydrophobicContact CG1-CG2 4.22Å
185	A	88.1	Confident	83	Confident	24 Å²	24	81 Å²	81	20%	0.198	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	136.7	172.6	0	0	0	0	0	109.7	I118 R119 N175	I118-A185 CarbonylContact C-O 3.54Å; I118-A185 WeakPolarHBondContact CA-O 3.5Å; R119-A185 HydrophobicContact CB-CB 4.24Å; R119-A185 PolarHBondContact N-O 3.14Å; R119-A185 PolarHBondContact O-N 3.1Å; N175-A185 VanDerWaalsContact OD1-CA 3.29Å; N175-A185 WeakPolarHBondContact OD1-CA 3.48Å
186	V	90.3	Very high	82.4	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.006	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.4	-179.8	-173.8	0	0	0	0	108.6	L116 I118 F134 L171 L174 N175 V184	L116-V186 HydrophobicContact CB-CG1 4.23Å; L116-V186 HydrophobicContact CD1-CG1 3.79Å; L116-V186 HydrophobicContact CG-CG1 4.49Å; I118-V186 HydrophobicContact CG1-CG1 4.48Å; F134-V186 HydrophobicContact CE1-CG1 4.38Å; F134-V186 HydrophobicContact CZ-CG2 4.14Å; L171-V186 VanDerWaalsContact CD1-C 3.49Å; L171-V186 HydrophobicContact CD1-CB 4.21Å; L171-V186 HydrophobicContact CD1-CG1 3.93Å; L171-V186 WeakPolarHBondContact CD1-O 3.38Å; L174-V186 HydrophobicContact CB-CG2 4.2Å; N175-V186 HydrophobicContact CB-CB 4.25Å; N175-V186 PolarHBondContact OD1-N 3.28Å; V184-V186 HydrophobicContact CG1-CG2 4.22Å
187	D	90.6	Very high	81.8	Confident	49 Å²	49	78.2 Å²	78.2	26%	0.262	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	170.6	-178.6	-50.1	-97.8	0	0	0	111	L116 V117 R119	L116-D187 CarbonylContact C-O 3.6Å; L116-D187 VanDerWaalsContact CA-O 3.28Å; L116-D187 WeakPolarHBondContact CA-O 3.07Å; V117-D187 HydrophobicContact CG1-CB 3.85Å; V117-D187 PolarHBondContact N-O 3.39Å; V117-D187 PolarHBondContact O-N 2.85Å; R119-D187 IonicContact CZ-OD1 2.89Å; R119-D187 IonicContact CZ-OD2 2.6Å; R119-D187 IonicContact NE-OD2 3.43Å; R119-D187 PolarHBondContact NE-OD2 2.78Å; R119-D187 IonicContact NH2-OD1 2.58Å; R119-D187 PolarHBondContact NH2-OD1 2.8Å; R119-D187 IonicContact NH2-OD2 2.73Å; R119-D187 PolarHBondContact NH2-OD2 3.11Å
188	W	89.7	Confident	81.2	Confident	104 Å²	104	74.9 Å²	74.9	39%	0.394	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	136.3	168.2	-64.4	103.8	0	0	0	111	L116 M164 A167 L171 V190	L116-W188 HydrophobicContact CD2-CD2 4.11Å; L116-W188 HydrophobicContact CD2-CE3 3.68Å; L116-W188 HydrophobicContact CD2-CZ3 3.92Å; M164-W188 HydrophobicContact CE-CH2 4.11Å; M164-W188 HydrophobicContact CG-CH2 4.12Å; M164-W188 HydrophobicContact CG-CZ3 4.43Å; A167-W188 HydrophobicContact CB-CH2 4.02Å; A167-W188 HydrophobicContact CB-CZ3 3.83Å; L171-W188 HydrophobicContact CD2-CD2 4.48Å; L171-W188 HydrophobicContact CD2-CZ2 3.92Å; L171-W188 VanDerWaalsContact CD2-NE1 3.35Å; W188-V190 PolarHBondContact O-N 3.37Å
189	A	88.1	Confident	80.3	Confident	27 Å²	27	73.4 Å²	73.4	22%	0.223	39%	0.389	C	S	.	.			trans	-76.7	107.2	-177.1	0	0	0	0	0	112.5	R115 V117 F158	R115-A189 HydrophobicContact CB-CB 3.9Å; R115-A189 HydrophobicContact CG-CB 3.71Å; R115-A189 WeakPolarHBondContact O-CB 3.16Å; R115-A189 PolarHBondContact O-N 2.76Å; V117-A189 HydrophobicContact CB-CB 4.17Å; F158-A189 HydrophobicContact CD1-CB 4.04Å; F158-A189 HydrophobicContact CE1-CB 4.19Å
190	V	83.3	Confident	79.5	Confident	81 Å²	81	78.6 Å²	78.6	49%	0.491	41%	0.412	S	S	.	.			trans	-76.4	142.8	174.4	178.5	0	0	0	0	110.8	W188 N194	W188-V190 PolarHBondContact O-N 3.37Å; V190-N194 HydrophobicContact CG1-CB 3.59Å
191	P	78.5	Confident	78.5	Confident	72 Å²	72	78 Å²	78	47%	0.468	42%	0.421	S	S	.	.			trans	-58	152.4	173.4	-25.5	35.3	0	0	0	113.6	E193 N194 Y195	P191-E193 PolarHBondContact O-N 3.08Å; P191-N194 PolarHBondContact O-N 3.47Å; P191-Y195 WeakPolarHBondContact O-CB 3.35Å; P191-Y195 PolarHBondContact O-N 3.42Å
192	K	73.8	Confident	77.4	Confident	159 Å²	159	81.6 Å²	81.6	69%	0.691	42%	0.424	S	S	*	.	H	α-helix	trans	-60.1	-42.3	-175.8	-171.6	-173.9	174.4	-168.1	0	112.5	Y195 I196	K192-Y195 PolarHBondContact O-N 3.04Å; K192-I196 HydrophobicContact CG-CD1 3.99Å; K192-I196 VanDerWaalsContact O-CG1 3.32Å; K192-I196 WeakPolarHBondContact O-CG1 3.38Å; K192-I196 PolarHBondContact O-N 2.89Å
193	E	74.2	Confident	75.6	Confident	148 Å²	148	85.4 Å²	85.4	69%	0.692	44%	0.443	S	S	*	.	H	α-helix	trans	-57.5	-56	175.2	-62.5	105.9	-107.8	0	0	111.6	P191 Y195 I196 A197	P191-E193 PolarHBondContact O-N 3.08Å; E193-Y195 VanDerWaalsContact C-N 3.27Å; E193-Y195 PolarHBondContact O-N 2.93Å; E193-I196 PolarHBondContact O-N 3.26Å; E193-I196 VanDerWaalsContact O-N 3.09Å; E193-A197 PolarHBondContact O-N 3.01Å
194	N	76.1	Confident	73.3	Confident	96 Å²	96	83.7 Å²	83.7	51%	0.513	45%	0.453	S	S	.	.	H	α-helix	trans	-59.7	-36.1	-179.7	-62.2	37.1	0	0	0	112.3	V190 P191 A198	V190-N194 HydrophobicContact CG1-CB 3.59Å; P191-N194 PolarHBondContact O-N 3.47Å; N194-A198 WeakPolarHBondContact O-CB 3.46Å; N194-A198 PolarHBondContact O-N 2.85Å
195	Y	73.4	Confident	70.9	Confident	116 Å²	116	89.1 Å²	89.1	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-68.3	-39.7	175.9	-176.5	-100.9	0	0	0	112.2	P191 K192 E193 A198 Q199	P191-Y195 WeakPolarHBondContact O-CB 3.35Å; P191-Y195 PolarHBondContact O-N 3.42Å; K192-Y195 PolarHBondContact O-N 3.04Å; E193-Y195 VanDerWaalsContact C-N 3.27Å; E193-Y195 PolarHBondContact O-N 2.93Å; Y195-A198 PolarHBondContact O-N 2.81Å; Y195-Q199 HydrophobicContact CD1-CG 4.21Å; Y195-Q199 VanDerWaalsContact CE1-CD 3.4Å; Y195-Q199 HydrophobicContact CE1-CG 3.81Å; Y195-Q199 VanDerWaalsContact CE1-OE1 3.26Å; Y195-Q199 HydrophobicContact CE2-CG 4.34Å; Y195-Q199 WeakPolarHBondContact O-CB 3.4Å; Y195-Q199 WeakPolarHBondContact O-CG 3.5Å; Y195-Q199 PolarHBondContact O-N 3.12Å; Y195-Q199 PolarHBondContact OH-NE2 3.38Å
196	I	75.3	Confident	68.4	Low	75 Å²	75	97.3 Å²	97.3	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-46.3	175.7	-70.8	166	0	0	0	110.4	K192 E193 A198 Q199 Q200	K192-I196 HydrophobicContact CG-CD1 3.99Å; K192-I196 VanDerWaalsContact O-CG1 3.32Å; K192-I196 WeakPolarHBondContact O-CG1 3.38Å; K192-I196 PolarHBondContact O-N 2.89Å; E193-I196 PolarHBondContact O-N 3.26Å; E193-I196 VanDerWaalsContact O-N 3.09Å; I196-A198 VanDerWaalsContact C-N 3.34Å; I196-A198 PolarHBondContact O-N 3.23Å; I196-Q199 CarbonylContact O-C 3.54Å; I196-Q199 PolarHBondContact O-N 2.86Å; I196-Q199 VanDerWaalsContact O-N 3.08Å; I196-Q200 WeakPolarHBondContact O-CG 3.3Å; I196-Q200 PolarHBondContact O-N 2.86Å
197	A	73	Confident	65.5	Low	55 Å²	55	104.5 Å²	104.5	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-58.4	-45.2	176.2	0	0	0	0	0	112	E193 Q199 Q200 S201	E193-A197 PolarHBondContact O-N 3.01Å; A197-Q199 VanDerWaalsContact C-N 3.31Å; A197-Q199 PolarHBondContact O-N 2.95Å; A197-Q200 PolarHBondContact O-N 3.01Å; A197-S201 PolarHBondContact O-N 2.84Å
198	A	71.5	Confident	62.7	Low	46 Å²	46	105.8 Å²	105.8	38%	0.38	58%	0.579	S	S	.	*	H	α-helix	trans	-67	-26.8	175.6	0	0	0	0	0	113.7	N194 Y195 I196 S201 L202	N194-A198 WeakPolarHBondContact O-CB 3.46Å; N194-A198 PolarHBondContact O-N 2.85Å; Y195-A198 PolarHBondContact O-N 2.81Å; I196-A198 VanDerWaalsContact C-N 3.34Å; I196-A198 PolarHBondContact O-N 3.23Å; A198-S201 PolarHBondContact O-OG 3.48Å; A198-L202 WeakPolarHBondContact O-CB 3.29Å; A198-L202 WeakPolarHBondContact O-CD1 3.5Å; A198-L202 VanDerWaalsContact O-CG 3.27Å; A198-L202 WeakPolarHBondContact O-CG 3.43Å; A198-L202 PolarHBondContact O-N 2.86Å
199	Q	66	Low	59.8	Low	93 Å²	93	108.5 Å²	108.5	44%	0.435	60%	0.601	S	S	.	*	H	α-helix	trans	-80.3	-23.3	172.1	-74.2	-149.7	-59.4	0	0	113.5	Y195 I196 A197 K203	Y195-Q199 HydrophobicContact CD1-CG 4.21Å; Y195-Q199 VanDerWaalsContact CE1-CD 3.4Å; Y195-Q199 HydrophobicContact CE1-CG 3.81Å; Y195-Q199 VanDerWaalsContact CE1-OE1 3.26Å; Y195-Q199 HydrophobicContact CE2-CG 4.34Å; Y195-Q199 WeakPolarHBondContact O-CB 3.4Å; Y195-Q199 WeakPolarHBondContact O-CG 3.5Å; Y195-Q199 PolarHBondContact O-N 3.12Å; Y195-Q199 PolarHBondContact OH-NE2 3.38Å; I196-Q199 CarbonylContact O-C 3.54Å; I196-Q199 PolarHBondContact O-N 2.86Å; I196-Q199 VanDerWaalsContact O-N 3.08Å; A197-Q199 VanDerWaalsContact C-N 3.31Å; A197-Q199 PolarHBondContact O-N 2.95Å; Q199-K203 WeakPolarHBondContact O-CB 3.36Å; Q199-K203 WeakPolarHBondContact O-CG 3.27Å; Q199-K203 PolarHBondContact O-N 3.07Å
200	Q	63.8	Low	57	Low	137 Å²	137	116.5 Å²	116.5	64%	0.64	63%	0.634	S	S	*	*	H	α-helix	trans	-73.5	-45.4	174	-74.7	172.6	-59.4	0	0	110.7	I196 A197 L202 K203	I196-Q200 WeakPolarHBondContact O-CG 3.3Å; I196-Q200 PolarHBondContact O-N 2.86Å; A197-Q200 PolarHBondContact O-N 3.01Å; Q200-L202 PolarHBondContact O-N 3.2Å; Q200-K203 PolarHBondContact O-N 3.16Å; Q200-K203 VanDerWaalsContact O-N 3.13Å
201	S	56.8	Low	54.4	Low	87 Å²	87	117.6 Å²	117.6	61%	0.608	65%	0.651	S	S	*	*	H	α-helix	trans	-63	-40.2	174.1	57.7	0	0	0	0	112.8	A197 A198 K203 G204	A197-S201 PolarHBondContact O-N 2.84Å; A198-S201 PolarHBondContact O-OG 3.48Å; S201-K203 PolarHBondContact O-N 3.38Å; S201-G204 PolarHBondContact O-N 3.1Å
202	L	54.3	Low	52	Low	142 Å²	142	121.9 Å²	121.9	74%	0.743	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-7.2	175.3	-74.2	171.8	0	0	0	114.9	A198 Q200	A198-L202 WeakPolarHBondContact O-CB 3.29Å; A198-L202 WeakPolarHBondContact O-CD1 3.5Å; A198-L202 VanDerWaalsContact O-CG 3.27Å; A198-L202 WeakPolarHBondContact O-CG 3.43Å; A198-L202 PolarHBondContact O-N 2.86Å; Q200-L202 PolarHBondContact O-N 3.2Å
203	K	46.5	Very low	51.1	Low	175 Å²	175	119.3 Å²	119.3	76%	0.761	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-12.1	176.5	-87.7	-172.6	168.1	-160.4	0	114.4	Q199 Q200 S201 T205	Q199-K203 WeakPolarHBondContact O-CB 3.36Å; Q199-K203 WeakPolarHBondContact O-CG 3.27Å; Q199-K203 PolarHBondContact O-N 3.07Å; Q200-K203 PolarHBondContact O-N 3.16Å; Q200-K203 VanDerWaalsContact O-N 3.13Å; S201-K203 PolarHBondContact O-N 3.38Å; K203-T205 PolarHBondContact O-N 2.99Å; K203-T205 VanDerWaalsContact O-N 3.09Å
204	G	38.6	Very low	48.8	Very low	69 Å²	69	120.6 Å²	120.6	71%	0.711	68%	0.679	S	S	*	*	S	Bend	trans	-72.4	10.5	176.1	0	0	0	0	0	114.8	S201	S201-G204 PolarHBondContact O-N 3.1Å
205	T	37.8	Very low	46.4	Very low	115 Å²	115	120.5 Å²	120.5	71%	0.706	69%	0.692	S	S	*	*	S	Bend	trans	-150.8	77	-173.4	-42.3	0	0	0	0	112.1	K203	K203-T205 PolarHBondContact O-N 2.99Å; K203-T205 VanDerWaalsContact O-N 3.09Å
206	K	34	Very low	44.1	Very low	197 Å²	197	118.6 Å²	118.6	86%	0.857	71%	0.708	S	S	*	*			trans	172.5	97.2	145.2	-98.6	169	-178.2	-169.4	0	114.2
207	V	31.3	Very low	41.8	Very low	151 Å²	151	120.6 Å²	120.6	92%	0.915	73%	0.729	S	S	*	*			trans	-152.8	138.8	144.2	-170.6	0	0	0	0	103.9
208	A	30.2	Very low	39.6	Very low	76 Å²	76	126.9 Å²	126.9	63%	0.628	75%	0.748	S	S	*	*			cis	-109.4	-166.2	0.8	0	0	0	0	0	110.1
209	D	29.4	Very low	38	Very low	161 Å²	161	129.5 Å²	129.5	86%	0.861	76%	0.762	S	S	*	*			cis	-133.3	166.7	8.7	-81.4	-64	0	0	0	111.9
210	E	30	Very low	36.1	Very low	196 Å²	196	133.6 Å²	133.6	92%	0.916	78%	0.781	S	S	*	*			trans	-100	134.3	172.3	-68	-169.9	148.9	0	0	112.4
211	A	27.3	Very low	34.2	Very low	103 Å²	103	133.9 Å²	133.9	85%	0.851	79%	0.787	S	S	*	*			trans	-163	120.8	151.8	0	0	0	0	0	111.3
212	D	28.3	Very low	32.8	Very low	163 Å²	163	137.1 Å²	137.1	87%	0.872	79%	0.792	S	S	*	*			trans	-112.6	168.4	170.6	-99.2	-33.7	0	0	0	109.1
213	P	55.3	Low	31.4	Very low	105 Å²	105	136 Å²	136	68%	0.682	78%	0.783	S	S	*	*			cis	-134	-179.3	-38.6	39.4	-24.8	0	0	0	111.2
214	I	25.8	Very low	30.5	Very low	174 Å²	174	135.8 Å²	135.8	89%	0.892	78%	0.782	S	S	*	*			trans	-171.4	163.9	144.9	-105	156.8	0	0	0	113.4
215	A	26.7	Very low	30	Very low	94 Å²	94	139.4 Å²	139.4	78%	0.777	78%	0.779	S	S	*	*			trans	-65.8	130.8	-164.9	0	0	0	0	0	118
216	G	25	Very low	29.3	Very low	77 Å²	77	146.1 Å²	146.1	79%	0.794	79%	0.791	S	S	*	*				66	113.2	101.4	0	0	0	0	0	121.3
217	S	27.2	Very low	28.8	Very low	117 Å²	117	145.4 Å²	145.4	82%	0.818	79%	0.79	S	S	*	*			trans	-163.7	129.9	147.9	58.3	0	0	0	0	111.7
218	E	25.1	Very low	29.2	Very low	186 Å²	186	143 Å²	143	87%	0.869	78%	0.778	S	S	*	*			trans	-75.4	160.9	151.9	-50.5	-178.9	125.5	0	0	108
219	P	38.2	Very low	28.9	Very low	102 Å²	102	144.3 Å²	144.3	66%	0.662	79%	0.789	S	S	*	*				-148.6	175.6	73.1	44.1	-25.8	0	0	0	115.6
220	E	25.8	Very low	28.7	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	78%	0.781	S	S	*	*			trans	33.5	150.5	130.9	-65.4	166	-156.8	0	0	121.4
221	D	24.4	Very low	28.5	Very low	142 Å²	142	142.1 Å²	142.1	76%	0.759	78%	0.778	S	S	*	*			cis	-177	154.4	-21.3	-151.1	-18.1	0	0	0	106.7
222	E	26.8	Very low	28.4	Very low	155 Å²	155	146.1 Å²	146.1	72%	0.724	78%	0.776	S	S	*	*			trans	173.5	133	138.3	-105.7	-132.5	146.6	0	0	112.3	K224	E222-K224 IonicContact OE1-NZ 3.61Å; E222-K224 PolarHBondContact OE1-NZ 2.88Å; E222-K224 IonicContact OE2-NZ 2.77Å; E222-K224 PolarHBondContact OE2-NZ 3.41Å
223	E	26.7	Very low	28.2	Very low	118 Å²	118	147.8 Å²	147.8	55%	0.551	78%	0.775	S	S	*	*			trans	-78.7	152.8	168.3	-54.8	-161.9	119.3	0	0	112.7	K225	E223-K225 WeakPolarHBondContact OE1-CE 3.41Å; E223-K225 IonicContact OE1-NZ 3.14Å; E223-K225 PolarHBondContact OE1-NZ 3.22Å; E223-K225 IonicContact OE2-NZ 2.68Å; E223-K225 PolarHBondContact OE2-NZ 3.4Å
224	K	27.6	Very low	26.7	Very low	171 Å²	171	148.9 Å²	148.9	74%	0.743	79%	0.786	S	S	*	*				-148.9	115.3	120.4	-98.7	114.2	-140.4	161.1	0	112.9	E222	E222-K224 IonicContact OE1-NZ 3.61Å; E222-K224 PolarHBondContact OE1-NZ 2.88Å; E222-K224 IonicContact OE2-NZ 2.77Å; E222-K224 PolarHBondContact OE2-NZ 3.41Å
225	K	26.2	Very low	26.6	Very low	146 Å²	146	143.6 Å²	143.6	64%	0.635	77%	0.774	S	S	*	*			trans	-69.6	152.2	169.5	-50.5	177.7	178.8	82	0	111	E223	E223-K225 WeakPolarHBondContact OE1-CE 3.41Å; E223-K225 IonicContact OE1-NZ 3.14Å; E223-K225 PolarHBondContact OE1-NZ 3.22Å; E223-K225 IonicContact OE2-NZ 2.68Å; E223-K225 PolarHBondContact OE2-NZ 3.4Å
226	R	25	Very low	26.5	Very low	256 Å²	256	146.4 Å²	146.4	97%	0.966	78%	0.775	S	S	*	*			trans	-166.7	115.9	139.4	-105.9	155.8	-155	-135	4.6	113.8
227	E	22.4	Very low	26.3	Very low	181 Å²	181	151.9 Å²	151.9	85%	0.846	78%	0.777	S	S	*	*			trans	-139.4	172.9	165.8	-119	-158.8	-136.5	0	0	106
228	P	39.3	Very low	26.1	Very low	102 Å²	102	150 Å²	150	66%	0.662	77%	0.769	S	S	*	*			cis	-128.8	-171.9	-32.3	35.3	-18.7	0	0	0	111.4
229	A	24.4	Very low	25.9	Very low	102 Å²	102	148.7 Å²	148.7	84%	0.843	77%	0.768	S	S	*	*			trans	-142.9	138.2	163.5	0	0	0	0	0	112.3
230	V	25.5	Very low	25.2	Very low	115 Å²	115	146.8 Å²	146.8	70%	0.697	76%	0.761	S	S	*	*			trans	-139.2	132.4	-172.6	175.5	0	0	0	0	112.5
231	K	25.8	Very low	25.1	Very low	196 Å²	196	146 Å²	146	85%	0.852	76%	0.757	S	S	*	*			trans	-166	133.4	151.1	-93.5	136.6	-175.5	-178.1	0	106.9
232	K	24.2	Very low	25.1	Very low	187 Å²	187	146 Å²	146	81%	0.813	75%	0.752	S	S	*	*			cis	68.7	139	48	-70.9	-173.2	177.9	176.8	0	114.3
233	K	25.1	Very low	25	Very low	198 Å²	198	143.1 Å²	143.1	86%	0.861	75%	0.745	S	S	*	*			cis	-176.7	117.7	-23.2	-155.9	-172	-173.3	-169.6	0	110.4
234	S	24	Very low	24.9	Very low	129 Å²	129	144.4 Å²	144.4	90%	0.902	75%	0.751	S	S	*	*			trans	-177.8	162.4	167.2	45.3	0	0	0	0	111.3
235	G	22.9	Very low	24.6	Very low	62 Å²	62	142.2 Å²	142.2	64%	0.639	75%	0.748	S	S	*	*			cis	164.7	95	-16	0	0	0	0	0	117.5
236	L	24.2	Very low	24.6	Very low	153 Å²	153	141 Å²	141	80%	0.801	75%	0.747	S	S	*	*			trans	69.1	136.6	153.8	-68.6	104.3	0	0	0	123
237	K	22.4	Very low	24.6	Very low	193 Å²	193	136.9 Å²	136.9	84%	0.839	74%	0.739	S	S	*	*			trans	68.2	164.8	145.7	-71.5	174.2	178.3	-174.5	0	118.8
238	A	22.6	Very low	24.7	Very low	78 Å²	78	132.8 Å²	132.8	65%	0.645	73%	0.73	S	S	*	*			cis	-174.7	167.5	-33.2	0	0	0	0	0	109.9
239	N	21.2	Very low	24	Very low	158 Å²	158	132 Å²	132	85%	0.845	73%	0.727	S	S	*	*			trans	65.4	164.2	170.7	-78.9	19.8	0	0	0	117.9
240	A	23.4	Very low	24	Very low	62 Å²	62	133.8 Å²	133.8	51%	0.512	72%	0.723	S	S	.	*			cis	-178.9	153.1	-34.9	0	0	0	0	0	109.9
241	Q	24.1	Very low	24	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.762	73%	0.728	S	S	*	*			trans	63.8	165	161	-65.1	158.2	-90.1	0	0	114.5
242	Q	23	Very low	24.1	Very low	141 Å²	141	134.6 Å²	134.6	66%	0.659	73%	0.727	S	S	*	*			cis	-153.8	-174.9	-16.9	-124.4	165.3	-90.1	0	0	106.2
243	V	24.5	Very low	24.3	Very low	95 Å²	95	132.9 Å²	132.9	58%	0.576	73%	0.727	S	S	*	*			cis	-152.3	168.8	11.7	-111	0	0	0	0	108.8
244	E	24.5	Very low	24.4	Very low	145 Å²	145	130.8 Å²	130.8	68%	0.678	72%	0.723	S	S	*	*			trans	27.1	154.6	136.8	-67.2	130.3	-137.6	0	0	122.7
245	D	22.5	Very low	24.6	Very low	125 Å²	125	133.1 Å²	133.1	67%	0.668	72%	0.72	S	S	*	*			cis	-162.6	164.4	3	-121.3	-10.4	0	0	0	117.2
246	L	25	Very low	24.9	Very low	119 Å²	119	139.5 Å²	139.5	62%	0.623	73%	0.733	S	S	*	*			trans	48.7	128.1	142.9	-62.9	167.2	0	0	0	125.7
247	Q	25.2	Very low	25	Very low	171 Å²	171	141.4 Å²	141.4	80%	0.799	74%	0.738	S	S	*	*				76.1	154.6	127.2	-75.4	173.7	-13.4	0	0	121.1
248	S	24.3	Very low	25.3	Very low	94 Å²	94	141.3 Å²	141.3	66%	0.657	74%	0.74	S	S	*	*			cis	-151.6	176.9	1.6	51.1	0	0	0	0	112.9
249	S	24.5	Very low	25.6	Very low	86 Å²	86	147 Å²	147	60%	0.601	75%	0.754	S	S	*	*			trans	56.2	143	137.7	57.8	0	0	0	0	122.3
250	D	25.2	Very low	26	Very low	139 Å²	139	148.9 Å²	148.9	74%	0.743	76%	0.757	S	S	*	*			cis	-154.7	144.5	-10	-81.6	-29.2	0	0	0	106
251	E	26.2	Very low	26.3	Very low	175 Å²	175	153.9 Å²	153.9	82%	0.818	78%	0.776	S	S	*	*				64.5	167.6	103.5	-51.1	-153.7	136.9	0	0	117.3
252	D	26.8	Very low	26.6	Very low	154 Å²	154	153.9 Å²	153.9	82%	0.824	78%	0.781	S	S	*	*			trans	63.3	102.5	-171.2	-57.4	-16.2	0	0	0	115.5
253	D	27.7	Very low	27	Very low	151 Å²	151	153.1 Å²	153.1	81%	0.807	78%	0.781	S	S	*	*				74.2	119.8	50	-156.3	19	0	0	0	113.8
254	I	29.1	Very low	27.4	Very low	153 Å²	153	156.2 Å²	156.2	79%	0.785	79%	0.794	S	S	*	*			trans	-174.5	104.3	164.9	-97.9	149.3	0	0	0	109.9
255	E	28	Very low	27.7	Very low	178 Å²	178	154.7 Å²	154.7	83%	0.832	79%	0.791	S	S	*	*			trans	42.3	119.8	137.1	-55.7	-177.5	144.2	0	0	120.9
256	E	27.8	Very low	28	Very low	196 Å²	196	156.1 Å²	156.1	92%	0.916	80%	0.798	S	S	*	*			trans	-84.8	129	163.4	-60.3	178.3	129.2	0	0	110.4
257	E	27.7	Very low	28.4	Very low	193 Å²	193	154.5 Å²	154.5	90%	0.902	80%	0.803	S	S	*	*			trans	-110.4	117.4	164	-73.4	-166	138.4	0	0	110.2
258	E	27.3	Very low	28.7	Very low	192 Å²	192	155.3 Å²	155.3	90%	0.897	81%	0.806	S	S	*	*			trans	-87.2	123.5	170.2	-60.9	-174.8	129.5	0	0	109.8
259	E	29	Very low	29.1	Very low	198 Å²	198	157.1 Å²	157.1	93%	0.925	80%	0.802	S	S	*	*			trans	-110	120.1	161	-74	-153.8	137.7	0	0	110.5
260	E	29.7	Very low	29.4	Very low	196 Å²	196	162.5 Å²	162.5	92%	0.916	82%	0.818	S	S	*	*			trans	-74.2	136.1	168.4	-57.7	179.1	126.8	0	0	109.7
261	D	29.5	Very low	29.6	Very low	168 Å²	168	161.2 Å²	161.2	90%	0.898	81%	0.811	S	S	*	*			trans	-135.5	113.3	176	-149.2	8.6	0	0	0	108.2
262	D	31.1	Very low	29.8	Very low	163 Å²	163	161 Å²	161	87%	0.872	82%	0.816	S	S	*	*			trans	-64.4	133.6	-168.1	-77.6	-53.6	0	0	0	113.3
263	D	32.5	Very low	30	Very low	125 Å²	125	160.4 Å²	160.4	67%	0.668	81%	0.812	S	S	*	*			trans	-73.9	137.5	157.3	-110.3	-42.8	0	0	0	108.4	R588	D263-R588 IonicContact OD1-NH2 3.28Å; D263-R588 PolarHBondContact OD1-NH2 2.93Å; D263-R588 IonicContact OD2-NH2 3.31Å
264	D	30.9	Very low	30.2	Very low	159 Å²	159	161.8 Å²	161.8	85%	0.85	81%	0.814	S	S	*	*			trans	-145.1	147.3	147.4	-145.4	-14.3	0	0	0	110.4
265	D	30.8	Very low	30.2	Very low	114 Å²	114	163 Å²	163	61%	0.61	82%	0.817	S	S	*	*			trans	-80.7	153.7	-172.2	-91	-46.5	0	0	0	112.2
266	D	29.4	Very low	30.4	Very low	154 Å²	154	163.3 Å²	163.3	82%	0.824	82%	0.818	S	S	*	*			trans	-149.6	148.8	132.8	-146.9	-21.2	0	0	0	110.5
267	A	32.9	Very low	30.4	Very low	86 Å²	86	160.9 Å²	160.9	71%	0.711	81%	0.811	S	S	*	*			trans	-142.2	86.8	-166.8	0	0	0	0	0	111.9
268	E	31.8	Very low	30.5	Very low	187 Å²	187	157.2 Å²	157.2	87%	0.874	80%	0.802	S	S	*	*			trans	-85.7	129.2	172.2	-67.3	-175.3	137.5	0	0	111.4
269	K	33.3	Very low	30.6	Very low	132 Å²	132	155.3 Å²	155.3	57%	0.574	80%	0.796	S	S	*	*			trans	-89.7	138.1	160.6	-68.3	167.5	103.6	-79.8	0	107.7	D271	K269-D271 IonicContact NZ-OD1 2.75Å; K269-D271 PolarHBondContact NZ-OD1 3.33Å; K269-D271 IonicContact NZ-OD2 3.67Å; K269-D271 PolarHBondContact NZ-OD2 3.37Å
270	E	31.2	Very low	30.6	Very low	199 Å²	199	153.3 Å²	153.3	93%	0.93	78%	0.784	S	S	*	*			trans	-122.1	129.1	143.6	-68	-173.4	134.5	0	0	106.2
271	D	29	Very low	30.6	Very low	113 Å²	113	150.7 Å²	150.7	60%	0.604	77%	0.772	S	S	*	*			trans	-93.2	142	172.3	-58	-71.4	0	0	0	106.7	K269	K269-D271 IonicContact NZ-OD1 2.75Å; K269-D271 PolarHBondContact NZ-OD1 3.33Å; K269-D271 IonicContact NZ-OD2 3.67Å; K269-D271 PolarHBondContact NZ-OD2 3.37Å
272	D	29.8	Very low	30.5	Very low	170 Å²	170	149.2 Å²	149.2	91%	0.909	76%	0.764	S	S	*	*			trans	-153.1	127	165.1	-130.1	-2	0	0	0	106.8
273	D	30.8	Very low	30.4	Very low	141 Å²	141	148 Å²	148	75%	0.754	76%	0.758	S	S	*	*			trans	-101.7	-177.9	-169.5	-72.8	-65.1	0	0	0	112
274	E	32	Very low	30.2	Very low	180 Å²	180	147.6 Å²	147.6	84%	0.841	76%	0.764	S	S	*	*			trans	70.8	137.3	158.5	-75.7	166.2	-164.8	0	0	117.5
275	E	30.5	Very low	30.2	Very low	180 Å²	180	147 Å²	147	84%	0.841	76%	0.761	S	S	*	*			cis	-132.4	158	-0.9	-61.8	-173.9	111.8	0	0	111.2
276	E	30.9	Very low	30.2	Very low	184 Å²	184	149.3 Å²	149.3	86%	0.86	77%	0.774	S	S	*	*			trans	-85.6	140.5	155.4	-69.8	-169.1	142.7	0	0	109
277	D	28.1	Very low	30.5	Very low	144 Å²	144	149.4 Å²	149.4	77%	0.77	77%	0.774	S	S	*	*			trans	-135.9	131.6	162.5	-156.2	-4.4	0	0	0	110.6
278	V	29.9	Very low	30.5	Very low	117 Å²	117	149.2 Å²	149.2	71%	0.709	78%	0.78	S	S	*	*			trans	-124.6	101.9	-167.6	178.1	0	0	0	0	109.6
279	I	28.8	Very low	30.7	Very low	151 Å²	151	147.4 Å²	147.4	77%	0.774	78%	0.777	S	S	*	*			trans	-121	128.1	172	-57	-177.5	0	0	0	109.5
280	K	30.3	Very low	30.7	Very low	156 Å²	156	148.1 Å²	148.1	68%	0.678	79%	0.787	S	S	*	*			trans	-107.1	144.1	173.9	-78.1	166.7	104	-91	0	109.3
281	E	29.3	Very low	30.8	Very low	141 Å²	141	145.9 Å²	145.9	66%	0.659	78%	0.781	S	S	*	*			trans	67.3	150.1	160	-69.5	148.5	-126.5	0	0	114.7
282	N	26.8	Very low	31.4	Very low	137 Å²	137	148.1 Å²	148.1	73%	0.733	79%	0.793	S	S	*	*			cis	-142.9	-179	11.8	-114.3	-37.6	0	0	0	112.2
283	N	28.5	Very low	31.4	Very low	139 Å²	139	142.9 Å²	142.9	74%	0.743	78%	0.78	S	S	*	*			trans	-52.2	149.5	-177.1	-48.9	-14.7	0	0	0	116.2
284	S	28.1	Very low	31.9	Very low	115 Å²	115	139.6 Å²	139.6	80%	0.804	78%	0.779	S	S	*	*			trans	-152	125.6	134.2	61.2	0	0	0	0	109.5
285	D	31.1	Very low	31.7	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	78%	0.778	S	S	*	*			trans	-76.6	147.9	175.3	-40.8	-93	0	0	0	110.8
286	D	31.2	Very low	32	Very low	163 Å²	163	138.1 Å²	138.1	87%	0.872	78%	0.781	S	S	*	*			trans	-157.4	139.7	152.2	-162.2	21.8	0	0	0	108.9
287	D	36.9	Very low	31.9	Very low	157 Å²	157	134.4 Å²	134.4	84%	0.84	78%	0.776	S	S	*	*			trans	-98	157.9	-169.2	-71.3	-58.6	0	0	0	112.6
288	G	31.3	Very low	32	Very low	81 Å²	81	134.9 Å²	134.9	84%	0.835	78%	0.778	S	S	*	*			trans	-169.3	69.7	-176	0	0	0	0	0	111.6
289	D	36.7	Very low	31.9	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	78%	0.779	S	S	*	*			trans	-81.7	176.4	-175.5	-127.9	-22.5	0	0	0	113.3
290	D	33.9	Very low	31.8	Very low	146 Å²	146	136.5 Å²	136.5	78%	0.781	78%	0.779	S	S	*	*			trans	60.5	113.5	164.5	-62.7	-35.6	0	0	0	119.7
291	D	33.7	Very low	31.8	Very low	152 Å²	152	138.8 Å²	138.8	81%	0.813	79%	0.785	S	S	*	*				-167.9	111	102.4	-173	20.5	0	0	0	110.4	G293	D291-G293 PolarHBondContact O-N 3.42Å
292	D	40.1	Very low	31.9	Very low	160 Å²	160	136.9 Å²	136.9	86%	0.856	79%	0.787	S	S	*	*			trans	-94.3	76.3	173.3	-172.9	19.1	0	0	0	109.8	G294	D292-G294 PolarHBondContact O-N 3.1Å
293	G	29.6	Very low	32	Very low	61 Å²	61	137.7 Å²	137.7	63%	0.629	79%	0.792	S	S	*	*			trans	-69.4	53.3	-176.7	0	0	0	0	0	115.1	D291 I295	D291-G293 PolarHBondContact O-N 3.42Å; G293-I295 PolarHBondContact O-N 3.47Å
294	G	41.6	Very low	32.2	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	79%	0.785	S	S	*	*			trans	-70.7	111.7	168	0	0	0	0	0	110.8	D292	D292-G294 PolarHBondContact O-N 3.1Å
295	I	28.8	Very low	32.3	Very low	160 Å²	160	137 Å²	137	82%	0.821	79%	0.785	S	S	*	*			trans	-125.5	115.2	176	-161	135.6	0	0	0	111.8	G293	G293-I295 PolarHBondContact O-N 3.47Å
296	D	36.2	Very low	32.6	Very low	169 Å²	169	137.7 Å²	137.7	90%	0.904	79%	0.789	S	S	*	*			trans	-72.9	136.7	156.4	-84.4	-49.1	0	0	0	108.5
297	S	28.7	Very low	32.8	Very low	106 Å²	106	138.8 Å²	138.8	74%	0.741	79%	0.789	S	S	*	*			trans	-150.9	117.4	154.5	-167.8	0	0	0	0	108.4
298	D	30.2	Very low	32.7	Very low	154 Å²	154	140.8 Å²	140.8	82%	0.824	79%	0.793	S	S	*	*			trans	-68	141	164.5	-69.4	-56.1	0	0	0	109.6
299	E	28.1	Very low	33.1	Very low	154 Å²	154	146 Å²	146	72%	0.72	80%	0.796	S	S	*	*			trans	-134.4	107.1	149.7	-74.2	-163.4	156.5	0	0	108	Y301	E299-Y301 HydrophobicContact CB-CE2 4.36Å
300	D	27.3	Very low	32.8	Very low	148 Å²	148	148.5 Å²	148.5	79%	0.791	80%	0.803	S	S	*	*			trans	-68.1	125.7	173.7	-92.1	-37	0	0	0	110.3
301	Y	29.5	Very low	32.9	Very low	203 Å²	203	150 Å²	150	80%	0.796	81%	0.805	S	S	*	*			trans	-100.2	101.8	166	-77.9	-93	0	0	0	109.4	E299	E299-Y301 HydrophobicContact CB-CE2 4.36Å
302	S	31.1	Very low	32.7	Very low	101 Å²	101	149.5 Å²	149.5	71%	0.706	80%	0.801	S	S	*	*			trans	-79.1	149.8	174	65.5	0	0	0	0	112.3
303	D	30.1	Very low	32.2	Very low	154 Å²	154	147.2 Å²	147.2	82%	0.824	80%	0.798	S	S	*	*			trans	-91.7	173	-173.1	-165.4	25	0	0	0	114.3
304	S	31.3	Very low	32.5	Very low	86 Å²	86	150.2 Å²	150.2	60%	0.601	81%	0.806	S	S	*	*			trans	87.9	98.7	165.6	-166.8	0	0	0	0	119.2
305	D	31.6	Very low	32.4	Very low	153 Å²	153	151 Å²	151	82%	0.818	81%	0.806	S	S	*	*				75	151.6	125	-52.3	-52.3	0	0	0	124.6
306	D	36.6	Very low	32.6	Very low	161 Å²	161	152.7 Å²	152.7	86%	0.861	81%	0.81	S	S	*	*			trans	-77.8	156.3	177.5	-80.3	-54.9	0	0	0	113.7
307	E	34.5	Very low	32.6	Very low	186 Å²	186	154.7 Å²	154.7	87%	0.869	81%	0.811	S	S	*	*				-175.3	124.6	122.4	-104.1	176.4	-166.8	0	0	113.1
308	E	35.4	Very low	32.8	Very low	199 Å²	199	158.2 Å²	158.2	93%	0.93	82%	0.816	S	S	*	*			trans	43.7	169.6	154.8	-56.1	-159.9	148	0	0	123.6
309	E	40	Very low	33.1	Very low	192 Å²	192	159.9 Å²	159.9	90%	0.897	82%	0.816	S	S	*	*			trans	-95	140.9	-170.1	-56.7	-178.4	137.8	0	0	113.8
310	E	30.4	Very low	33.4	Very low	202 Å²	202	158.7 Å²	158.7	94%	0.944	82%	0.821	S	S	*	*			trans	-167.5	172.2	130.3	-113.5	-174.5	-153.1	0	0	112
311	E	36.8	Very low	33.9	Very low	176 Å²	176	160 Å²	160	82%	0.822	82%	0.82	S	S	*	*			trans	-94.9	176.1	-164.3	-58.7	-163.2	141.3	0	0	117.1
312	I	29	Very low	34.2	Very low	143 Å²	143	159.9 Å²	159.9	73%	0.733	82%	0.823	S	S	*	*			trans	94	92.8	153.5	-57.4	153.4	0	0	0	118.9
313	S	28.6	Very low	34.6	Very low	111 Å²	111	163.4 Å²	163.4	78%	0.776	83%	0.828	S	S	*	*			trans	76.1	159.1	138.8	81.9	0	0	0	0	121
314	P	37.6	Very low	35.3	Very low	124 Å²	124	162.8 Å²	162.8	81%	0.805	82%	0.824	S	S	*	*			trans	-117.5	139.6	-162.9	38.5	-25.9	0	0	0	116.1
315	A	37.9	Very low	36.2	Very low	89 Å²	89	163.2 Å²	163.2	74%	0.736	83%	0.825	S	S	*	*				168.9	122.4	125.6	0	0	0	0	0	113.5
316	Q	34.4	Very low	37.4	Very low	196 Å²	196	158.4 Å²	158.4	92%	0.916	80%	0.803	S	S	*	*				176.1	163.8	122.9	-94.5	168.7	57.2	0	0	112.2
317	K	35.6	Very low	38.6	Very low	210 Å²	210	154.1 Å²	154.1	91%	0.913	78%	0.78	S	S	*	*			trans	-87.3	133.5	-165	-62.7	175.8	178.2	178.6	0	113.2
318	Q	33.4	Very low	40.2	Very low	181 Å²	181	147 Å²	147	85%	0.846	75%	0.749	S	S	*	*			trans	-86.6	165.2	165.1	-63.3	-163.8	17.1	0	0	112.4
319	K	35.2	Very low	41.7	Very low	189 Å²	189	143.5 Å²	143.5	82%	0.822	74%	0.737	S	S	*	*			trans	-104.1	153	174.3	-70.4	177.1	179.6	174.3	0	109.9
320	P	34.3	Very low	43.4	Very low	128 Å²	128	138.7 Å²	138.7	83%	0.831	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-62.2	139.7	179.9	25.1	-34.4	0	0	0	112.5
321	K	39.5	Very low	45.7	Very low	176 Å²	176	129.1 Å²	129.1	77%	0.765	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-68	155.7	172.2	-64.4	178.7	-179.6	176.6	0	109.8
322	K	33.8	Very low	48.1	Very low	200 Å²	200	125.1 Å²	125.1	87%	0.87	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-91.2	139.5	174.7	-67.9	-177.5	179.9	-180	0	110.3
323	H	39.6	Very low	51	Low	176 Å²	176	118.5 Å²	118.5	82%	0.815	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-58.9	136.5	174.4	-165.4	-65.4	0	0	0	111.1
324	L	46.5	Very low	54	Low	141 Å²	141	113.3 Å²	113.3	74%	0.738	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-74.6	156.5	179.5	-76	161.2	0	0	0	111.9
325	P	48.8	Very low	56.6	Low	95 Å²	95	109 Å²	109	62%	0.617	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-69.4	156.7	174.6	30.3	-35.1	0	0	0	112	D327	P325-D327 PolarHBondContact O-N 3.46Å; P325-D327 VanDerWaalsContact O-N 3.16Å
326	S	56.7	Low	59.1	Low	51 Å²	51	104.8 Å²	104.8	36%	0.357	51%	0.511	S	S	.	.			trans	-68.7	107.2	-176.9	173.4	0	0	0	0	113	V328 N329	S326-V328 PolarHBondContact O-N 3.1Å; S326-V328 VanDerWaalsContact O-N 3.1Å; S326-N329 WeakPolarHBondContact O-CB 3.45Å; S326-N329 PolarHBondContact O-N 2.7Å; S326-N329 VanDerWaalsContact OG-CG 3.28Å; S326-N329 PolarHBondContact OG-N 3.44Å; S326-N329 PolarHBondContact OG-OD1 3.25Å
327	D	62.7	Low	61.8	Low	71 Å²	71	100.2 Å²	100.2	38%	0.38	49%	0.485	S	S	.	.	H	α-helix	trans	-50.9	-33.3	172.9	-57.5	-64.1	0	0	0	113.3	P325 G331 Q379	P325-D327 PolarHBondContact O-N 3.46Å; P325-D327 VanDerWaalsContact O-N 3.16Å; D327-G331 PolarHBondContact O-N 3.28Å; D327-Q379 PolarHBondContact OD1-NE2 2.92Å
328	V	67.6	Low	64.4	Low	37 Å²	37	94.3 Å²	94.3	22%	0.224	46%	0.464	C	S	.	.	H	α-helix	trans	-71	-32.7	-178.1	-175.7	0	0	0	0	111.6	S326 G331 A414	S326-V328 PolarHBondContact O-N 3.1Å; S326-V328 VanDerWaalsContact O-N 3.1Å; V328-G331 PolarHBondContact O-N 2.84Å; V328-A414 HydrophobicContact CG1-CB 4.23Å
329	N	66.3	Low	67	Low	126 Å²	126	85.8 Å²	85.8	67%	0.674	42%	0.424	S	S	*	.	H	α-helix	trans	-70.1	-39.3	-178.9	-66.6	11.2	0	0	0	110.9	S326 G331	S326-N329 WeakPolarHBondContact O-CB 3.45Å; S326-N329 PolarHBondContact O-N 2.7Å; S326-N329 VanDerWaalsContact OG-CG 3.28Å; S326-N329 PolarHBondContact OG-N 3.44Å; S326-N329 PolarHBondContact OG-OD1 3.25Å; N329-G331 PolarHBondContact O-N 2.81Å
330	E	76.1	Confident	69.4	Low	90 Å²	90	77 Å²	77	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-67.2	-26.6	174	-57.2	-163	174.6	0	0	112.3	R332	E330-R332 HydrophobicContact CB-CG 4.19Å; E330-R332 IonicContact OE2-CZ 3.86Å; E330-R332 IonicContact OE2-NE 3.82Å; E330-R332 PolarHBondContact OE2-NE 3.44Å; E330-R332 IonicContact OE2-NH2 3.61Å; E330-R332 PolarHBondContact OE2-NH2 3.01Å
331	G	79.4	Confident	71.8	Confident	1 Å²	1	74 Å²	74	1%	0.01	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	17.2	172.6	0	0	0	0	0	115.3	D327 V328 N329 T333	D327-G331 PolarHBondContact O-N 3.28Å; V328-G331 PolarHBondContact O-N 2.84Å; N329-G331 PolarHBondContact O-N 2.81Å; G331-T333 VanDerWaalsContact C-N 3.27Å
332	R	87.7	Confident	73.8	Confident	93 Å²	93	69.8 Å²	69.8	35%	0.351	35%	0.346	S	S	.	.			trans	-75.9	-17.8	172.9	-40.2	-173.2	-161.1	-155.3	10.8	112.8	E330 Q379 F380 K381 K383 A386	E330-R332 HydrophobicContact CB-CG 4.19Å; E330-R332 IonicContact OE2-CZ 3.86Å; E330-R332 IonicContact OE2-NE 3.82Å; E330-R332 PolarHBondContact OE2-NE 3.44Å; E330-R332 IonicContact OE2-NH2 3.61Å; E330-R332 PolarHBondContact OE2-NH2 3.01Å; R332-Q379 HydrophobicContact CB-CG 4.45Å; R332-F380 VanDerWaalsContact CB-O 3.29Å; R332-F380 WeakPolarHBondContact CB-O 3.35Å; R332-F380 PolarHBondContact O-N 3.32Å; R332-K381 PolarHBondContact NH1-O 3.19Å; R332-K383 HydrophobicContact CG-CB 4.5Å; R332-A386 WeakPolarHBondContact O-CB 3.38Å
333	T	89.4	Confident	76.1	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.025	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.5	-179.1	-46.1	0	0	0	0	111.6	G331 F377 A378 A414	G331-T333 VanDerWaalsContact C-N 3.27Å; T333-F377 HydrophobicContact CG2-CB 4.49Å; T333-A378 CarbonylContact C-O 3.55Å; T333-A378 WeakPolarHBondContact CA-O 3.36Å; T333-A378 WeakPolarHBondContact CG2-O 3.06Å; T333-A414 HydrophobicContact CG2-CB 4.03Å; T333-A414 WeakPolarHBondContact O-CB 3.12Å; T333-A414 PolarHBondContact O-N 2.91Å
334	V	91.4	Very high	78.3	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	152.9	173	-59.3	0	0	0	0	111.3	I336 F377 A378 F380 A386 I390 I411	V334-I336 HydrophobicContact CG2-CD1 4.15Å; V334-I336 HydrophobicContact CG2-CG1 4.08Å; V334-F377 WeakPolarHBondContact O-CA 3.39Å; V334-A378 HydrophobicContact CG2-CB 3.98Å; V334-A378 PolarHBondContact N-O 3.2Å; V334-A378 PolarHBondContact O-N 2.67Å; V334-A378 VanDerWaalsContact O-N 3.1Å; V334-F380 HydrophobicContact CG1-CD2 4.23Å; V334-F380 HydrophobicContact CG1-CE2 4.05Å; V334-F380 HydrophobicContact CG2-CD2 4.42Å; V334-F380 HydrophobicContact CG2-CE2 3.89Å; V334-A386 HydrophobicContact CG1-CB 3.89Å; V334-I390 HydrophobicContact CG1-CD1 4.06Å; V334-I390 HydrophobicContact CG1-CG1 4.09Å; V334-I411 HydrophobicContact CB-CG2 3.72Å; V334-I411 HydrophobicContact CG1-CG2 4.15Å; V334-I411 HydrophobicContact CG2-CG2 3.99Å
335	F	92.1	Very high	80.2	Confident	35 Å²	35	56.3 Å²	56.3	15%	0.154	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.2	174.2	178.6	-135.6	0	0	0	109.4	R337 L375 A376 F377 V412 A414	F335-R337 HydrophobicContact CD1-CG 4.35Å; F335-R337 HydrophobicContact CE1-CG 4.1Å; F335-R337 HydrophobicContact CZ-CG 4.36Å; F335-L375 HydrophobicContact CE2-CB 4.19Å; F335-L375 HydrophobicContact CE2-CD2 4.16Å; F335-L375 HydrophobicContact CZ-CD1 4.27Å; F335-L375 HydrophobicContact CZ-CD2 3.86Å; F335-L375 HydrophobicContact CZ-CG 4.48Å; F335-A376 WeakPolarHBondContact CD2-O 3.25Å; F335-F377 HydrophobicContact CB-CD1 4.07Å; F335-F377 HydrophobicContact CB-CE1 3.9Å; F335-F377 AromaticContact CD2-CD1 3.79Å; F335-F377 HydrophobicContact CD2-CD1 3.79Å; F335-F377 HydrophobicContact CD2-CD2 4.46Å; F335-F377 AromaticContact CD2-CE1 3.37Å; F335-F377 HydrophobicContact CD2-CE1 3.37Å; F335-F377 HydrophobicContact CD2-CE2 4.1Å; F335-F377 HydrophobicContact CD2-CG 4.32Å; F335-F377 AromaticContact CD2-CZ 3.55Å; F335-F377 HydrophobicContact CD2-CZ 3.55Å; F335-F377 HydrophobicContact CE2-CE1 4.07Å; F335-F377 HydrophobicContact CE2-CE2 4.13Å; F335-F377 AromaticContact CE2-CZ 3.75Å; F335-F377 HydrophobicContact CE2-CZ 3.75Å; F335-F377 HydrophobicContact CG-CD1 4.3Å; F335-F377 AromaticContact CG-CE1 3.81Å; F335-F377 HydrophobicContact CG-CE1 3.81Å; F335-F377 HydrophobicContact CG-CZ 4.3Å; F335-V412 PolarHBondContact N-O 2.76Å; F335-V412 PolarHBondContact O-N 3.35Å; F335-A414 HydrophobicContact CB-CB 4.44Å
336	I	91.1	Very high	82	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.8	-170.7	-60.2	168.4	0	0	0	108.8	V334 L348 L352 L375 A376 A378 L409 I411	V334-I336 HydrophobicContact CG2-CD1 4.15Å; V334-I336 HydrophobicContact CG2-CG1 4.08Å; I336-L348 HydrophobicContact CD1-CD1 4.28Å; I336-L348 HydrophobicContact CD1-CD2 4.08Å; I336-L348 HydrophobicContact CD1-CG 4.44Å; I336-L352 HydrophobicContact CD1-CD1 3.74Å; I336-L352 HydrophobicContact CD1-CD2 3.96Å; I336-L352 HydrophobicContact CD1-CG 4.41Å; I336-L375 WeakPolarHBondContact O-CA 3.38Å; I336-A376 HydrophobicContact CB-CB 4.33Å; I336-A376 PolarHBondContact N-O 3.05Å; I336-A376 PolarHBondContact O-N 3.18Å; I336-A378 HydrophobicContact CD1-CB 4.13Å; I336-L409 HydrophobicContact CG2-CB 4.34Å; I336-L409 HydrophobicContact CG2-CD1 4.08Å; I336-L409 HydrophobicContact CG2-CD2 4.36Å; I336-I411 HydrophobicContact CG1-CD1 4.2Å; I336-I411 HydrophobicContact CG1-CG1 4.09Å; I336-I411 HydrophobicContact CG1-CG2 4.1Å; I336-I411 HydrophobicContact CG2-CG1 4.41Å
337	R	90.8	Very high	83.4	Confident	100 Å²	100	58.2 Å²	58.2	38%	0.377	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	159.1	-178.9	-51.5	175.6	-176.3	165.6	2	110.2	F335 L339 L375 M410	F335-R337 HydrophobicContact CD1-CG 4.35Å; F335-R337 HydrophobicContact CE1-CG 4.1Å; F335-R337 HydrophobicContact CZ-CG 4.36Å; R337-L339 PolarHBondContact O-N 3.03Å; R337-L375 HydrophobicContact CB-CD2 4.16Å; R337-L375 HydrophobicContact CG-CD2 3.91Å; R337-M410 HydrophobicContact CB-CB 4.3Å; R337-M410 WeakPolarHBondContact CB-O 2.89Å; R337-M410 PolarHBondContact N-O 3.47Å; R337-M410 PolarHBondContact O-N 2.88Å
338	N	89.2	Confident	84.6	Confident	85 Å²	85	54.8 Å²	54.8	46%	0.455	27%	0.268	S	S	.	.	S	Bend	trans	66.5	23.5	-179.3	-160.4	52.4	0	0	0	114.3	G374 K408	N338-G374 PolarHBondContact N-O 3.32Å; N338-G374 VanDerWaalsContact N-O 3.14Å; N338-K408 PolarHBondContact ND2-O 3.43Å
339	L	88.8	Confident	85.5	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	28%	0.277	C	S	.	.			trans	-58.5	156.8	167.4	-166.8	64.6	0	0	0	110.2	R337 T343 L348 V363 G374 A376 A404 L409	R337-L339 PolarHBondContact O-N 3.03Å; L339-T343 HydrophobicContact CD1-CG2 3.9Å; L339-T343 HydrophobicContact CG-CG2 4.48Å; L339-L348 HydrophobicContact CD1-CD1 3.93Å; L339-L348 HydrophobicContact CD1-CD2 3.96Å; L339-L348 HydrophobicContact CD1-CG 4.4Å; L339-L348 HydrophobicContact CD2-CD2 3.94Å; L339-V363 HydrophobicContact CD2-CG1 4.29Å; L339-V363 HydrophobicContact CD2-CG2 4.29Å; L339-G374 PolarHBondContact N-O 3.23Å; L339-A376 HydrophobicContact CD2-CB 4.12Å; L339-A404 HydrophobicContact CD1-CB 4.44Å; L339-L409 HydrophobicContact CB-CD2 4.33Å; L339-L409 HydrophobicContact CD1-CD2 3.87Å
340	S	85.3	Confident	86.6	Confident	5 Å²	5	58.5 Å²	58.5	4%	0.035	28%	0.279	C	S	.	.			trans	-66.4	161.2	167.7	-154.9	0	0	0	0	110.3	T343 D405 R407	S340-T343 WeakPolarHBondContact CA-OG1 3.36Å; S340-T343 WeakPolarHBondContact CB-OG1 3.43Å; S340-T343 PolarHBondContact N-OG1 2.69Å; S340-D405 WeakPolarHBondContact CB-OD2 3.31Å; S340-R407 PolarHBondContact OG-NH2 3.13Å
341	F	84.6	Confident	87.2	Confident	64 Å²	64	55.8 Å²	55.8	28%	0.281	27%	0.269	S	S	.	.	S	Bend	trans	-81.9	-8	170.7	-56.3	-54.2	0	0	0	112.2	S372	F341-S372 VanDerWaalsContact CD1-O 3.24Å; F341-S372 WeakPolarHBondContact CD1-O 3.44Å
342	D	81.3	Confident	87.6	Confident	88 Å²	88	55.8 Å²	55.8	47%	0.471	27%	0.268	S	S	.	.	S	Bend	trans	-118.8	4.6	-174.5	-49.5	-17.9	0	0	0	110.5	R446	D342-R446 IonicContact OD1-CZ 3.98Å; D342-R446 IonicContact OD1-NH1 2.67Å; D342-R446 PolarHBondContact OD1-NH1 3.29Å; D342-R446 IonicContact OD1-NH2 2.74Å; D342-R446 PolarHBondContact OD1-NH2 2.91Å; D342-R446 IonicContact OD2-CZ 2.69Å; D342-R446 IonicContact OD2-NH1 2.88Å; D342-R446 IonicContact OD2-NH2 3.89Å; D342-R446 PolarHBondContact OD2-NH2 3.27Å
343	T	83.6	Confident	87.8	Confident	6 Å²	6	56 Å²	56	4%	0.037	28%	0.276	C	S	.	.			trans	-80.2	125.1	168.1	-34.3	0	0	0	0	107.8	L339 S340 A404 D405	L339-T343 HydrophobicContact CD1-CG2 3.9Å; L339-T343 HydrophobicContact CG-CG2 4.48Å; S340-T343 WeakPolarHBondContact CA-OG1 3.36Å; S340-T343 WeakPolarHBondContact CB-OG1 3.43Å; S340-T343 PolarHBondContact N-OG1 2.69Å; T343-A404 HydrophobicContact CG2-CB 4.43Å; T343-D405 WeakPolarHBondContact CB-OD2 3.39Å; T343-D405 PolarHBondContact OG1-OD2 2.96Å
344	E	85.6	Confident	87.7	Confident	149 Å²	149	63.4 Å²	63.4	70%	0.696	31%	0.31	S	S	*	.			trans	-91	-179.7	172.5	-63.3	-177.1	172.4	0	0	110.1
345	E	86.3	Confident	87.5	Confident	80 Å²	80	65.8 Å²	65.8	37%	0.374	32%	0.32	S	S	.	.	S	Bend	trans	-71.5	-43.2	-169.7	-162.1	145.7	110.2	0	0	112.6	G347 L348 E349 V361 K362 V363	E345-G347 PolarHBondContact O-N 3.4Å; E345-L348 PolarHBondContact O-N 3.42Å; E345-E349 PolarHBondContact O-N 2.84Å; E345-V361 HydrophobicContact CG-CB 3.6Å; E345-V361 HydrophobicContact CG-CG1 3.74Å; E345-V361 VanDerWaalsContact OE1-O 3.04Å; E345-K362 WeakPolarHBondContact OE2-CA 3.5Å; E345-V363 HydrophobicContact CB-CG2 4.41Å; E345-V363 PolarHBondContact OE2-N 3.07Å
346	E	86.3	Confident	87.3	Confident	155 Å²	155	65.2 Å²	65.2	72%	0.724	32%	0.324	S	S	*	.	H	α-helix	trans	-53.9	-51.8	177.8	-57.8	174.8	-177.8	0	0	112.1	L348 E349 E350	E346-L348 PolarHBondContact O-N 3.34Å; E346-L348 VanDerWaalsContact O-N 3.17Å; E346-E349 WeakPolarHBondContact O-CB 3.26Å; E346-E349 PolarHBondContact O-N 3.32Å; E346-E350 PolarHBondContact O-N 2.97Å
347	G	85.4	Confident	87.1	Confident	30 Å²	30	70.9 Å²	70.9	31%	0.309	35%	0.351	S	S	.	.	H	α-helix	trans	-69.7	-9.5	179.7	0	0	0	0	0	114.6	E345 V351	E345-G347 PolarHBondContact O-N 3.4Å; G347-V351 WeakPolarHBondContact O-CG2 3.49Å
348	L	88	Confident	87.1	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-93.1	-34	167.3	-176.3	56.2	0	0	0	111.4	I336 L339 E345 E346 V351 L352 V361 A376 L409	I336-L348 HydrophobicContact CD1-CD1 4.28Å; I336-L348 HydrophobicContact CD1-CD2 4.08Å; I336-L348 HydrophobicContact CD1-CG 4.44Å; L339-L348 HydrophobicContact CD1-CD1 3.93Å; L339-L348 HydrophobicContact CD1-CD2 3.96Å; L339-L348 HydrophobicContact CD1-CG 4.4Å; L339-L348 HydrophobicContact CD2-CD2 3.94Å; E345-L348 PolarHBondContact O-N 3.42Å; E346-L348 PolarHBondContact O-N 3.34Å; E346-L348 VanDerWaalsContact O-N 3.17Å; L348-V351 PolarHBondContact O-N 2.88Å; L348-L352 HydrophobicContact CD1-CD1 4.24Å; L348-L352 HydrophobicContact CD1-CG 4.3Å; L348-L352 HydrophobicContact CG-CD1 3.96Å; L348-L352 HydrophobicContact CG-CG 4.48Å; L348-L352 VanDerWaalsContact O-CG 3.24Å; L348-L352 WeakPolarHBondContact O-CG 3.48Å; L348-L352 PolarHBondContact O-N 3.49Å; L348-L352 VanDerWaalsContact O-N 3.14Å; L348-V361 HydrophobicContact CB-CG1 4.42Å; L348-V361 HydrophobicContact CD2-CG1 3.82Å; L348-V361 HydrophobicContact CG-CG1 4.17Å; L348-A376 HydrophobicContact CD2-CB 3.61Å; L348-L409 HydrophobicContact CD1-CD1 3.7Å
349	E	87.4	Confident	87.1	Confident	87 Å²	87	67.4 Å²	67.4	41%	0.407	34%	0.34	S	S	.	.	H	α-helix	trans	-62.4	-47.7	173.7	-171.1	175.6	-177.4	0	0	111.8	E345 E346 V351 L352 L353 V358 V361	E345-E349 PolarHBondContact O-N 2.84Å; E346-E349 WeakPolarHBondContact O-CB 3.26Å; E346-E349 PolarHBondContact O-N 3.32Å; E349-V351 PolarHBondContact O-N 2.86Å; E349-V351 VanDerWaalsContact O-N 3.16Å; E349-L352 PolarHBondContact O-N 3.4Å; E349-L353 WeakPolarHBondContact O-CB 3.4Å; E349-L353 PolarHBondContact O-N 3Å; E349-V358 HydrophobicContact CG-CG2 4.5Å; E349-V361 HydrophobicContact CB-CG2 4.11Å; E349-V361 HydrophobicContact CG-CG2 4.47Å
350	E	88.6	Confident	87	Confident	154 Å²	154	71.6 Å²	71.6	72%	0.72	36%	0.356	S	S	*	.	H	α-helix	trans	-50.9	-42.3	176.5	-71.3	-170	157.3	0	0	112.5	E346	E346-E350 PolarHBondContact O-N 2.97Å
351	V	88.4	Confident	87.3	Confident	33 Å²	33	71.7 Å²	71.7	20%	0.2	36%	0.357	C	S	.	.	H	α-helix	trans	-75	-29.5	-177.8	174.7	0	0	0	0	112.2	G347 L348 E349 F355 I402	G347-V351 WeakPolarHBondContact O-CG2 3.49Å; L348-V351 PolarHBondContact O-N 2.88Å; E349-V351 PolarHBondContact O-N 2.86Å; E349-V351 VanDerWaalsContact O-N 3.16Å; V351-F355 WeakPolarHBondContact O-CE2 3.41Å; V351-I402 HydrophobicContact CG1-CG2 3.37Å
352	L	89.2	Confident	87.5	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-84	-32.2	177.7	-67.2	170.6	0	0	0	112.3	I336 L348 E349 Q354 F355 V358 V361 A378 F380 I411	I336-L352 HydrophobicContact CD1-CD1 3.74Å; I336-L352 HydrophobicContact CD1-CD2 3.96Å; I336-L352 HydrophobicContact CD1-CG 4.41Å; L348-L352 HydrophobicContact CD1-CD1 4.24Å; L348-L352 HydrophobicContact CD1-CG 4.3Å; L348-L352 HydrophobicContact CG-CD1 3.96Å; L348-L352 HydrophobicContact CG-CG 4.48Å; L348-L352 VanDerWaalsContact O-CG 3.24Å; L348-L352 WeakPolarHBondContact O-CG 3.48Å; L348-L352 PolarHBondContact O-N 3.49Å; L348-L352 VanDerWaalsContact O-N 3.14Å; E349-L352 PolarHBondContact O-N 3.4Å; L352-Q354 PolarHBondContact O-N 2.89Å; L352-Q354 VanDerWaalsContact O-N 3.15Å; L352-F355 PolarHBondContact O-N 2.98Å; L352-V358 HydrophobicContact CB-CG2 3.82Å; L352-V361 HydrophobicContact CD1-CG2 4.13Å; L352-A378 HydrophobicContact CD1-CB 3.57Å; L352-F380 HydrophobicContact CB-CE1 4.34Å; L352-F380 HydrophobicContact CB-CZ 4.1Å; L352-F380 HydrophobicContact CD2-CZ 4.04Å; L352-I411 HydrophobicContact CD2-CD1 4.15Å
353	L	90.7	Very high	87.9	Confident	97 Å²	97	72.1 Å²	72.1	51%	0.508	36%	0.356	S	S	.	.	H	α-helix	trans	-57.9	-28.8	-179.1	-171.6	64.3	0	0	0	112.7	E349 F355 G356	E349-L353 WeakPolarHBondContact O-CB 3.4Å; E349-L353 PolarHBondContact O-N 3Å; L353-F355 PolarHBondContact O-N 3.38Å; L353-G356 PolarHBondContact O-N 3.27Å
354	Q	87.6	Confident	88.1	Confident	161 Å²	161	73.5 Å²	73.5	75%	0.752	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.5	172.1	-177.6	175.3	-2.4	0	0	113.5	L352	L352-Q354 PolarHBondContact O-N 2.89Å; L352-Q354 VanDerWaalsContact O-N 3.15Å
355	F	86.8	Confident	88.1	Confident	50 Å²	50	69.8 Å²	69.8	22%	0.219	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-12.5	-177.9	-58.5	-81.6	0	0	0	113.2	V351 L352 L353 F380 A385 C389 A392 I402	V351-F355 WeakPolarHBondContact O-CE2 3.41Å; L352-F355 PolarHBondContact O-N 2.98Å; L353-F355 PolarHBondContact O-N 3.38Å; F355-F380 HydrophobicContact CB-CE1 4.47Å; F355-A385 VanDerWaalsContact O-CB 3.25Å; F355-A385 WeakPolarHBondContact O-CB 3.46Å; F355-C389 HydrophobicContact CB-CB 4.01Å; F355-C389 HydrophobicContact CG-CB 4.19Å; F355-A392 HydrophobicContact CD1-CB 4.11Å; F355-A392 HydrophobicContact CE1-CB 3.39Å; F355-A392 HydrophobicContact CZ-CB 3.99Å; F355-I402 HydrophobicContact CD2-CD1 3.99Å; F355-I402 HydrophobicContact CE1-CD1 4.22Å; F355-I402 HydrophobicContact CE1-CG1 4.47Å; F355-I402 HydrophobicContact CE2-CD1 3.47Å; F355-I402 VanDerWaalsContact CE2-CD1 3.47Å; F355-I402 HydrophobicContact CE2-CG1 3.7Å; F355-I402 HydrophobicContact CZ-CD1 3.61Å; F355-I402 HydrophobicContact CZ-CG1 3.59Å
356	G	87.8	Confident	87.7	Confident	23 Å²	23	69 Å²	69	24%	0.237	35%	0.345	C	S	.	.	S	Bend	trans	149.1	167.7	175	0	0	0	0	0	112.5	L353 V358	L353-G356 PolarHBondContact O-N 3.27Å; G356-V358 PolarHBondContact O-N 3.32Å
357	E	88.2	Confident	87.2	Confident	120 Å²	120	66.1 Å²	66.1	56%	0.561	34%	0.34	S	S	*	.			trans	-61.7	123.9	-179.7	-66.9	178.8	-143.3	0	0	111.9	K381	E357-K381 HydrophobicContact CB-CB 4.48Å; E357-K381 HydrophobicContact CB-CD 3.73Å; E357-K381 HydrophobicContact CB-CG 4.16Å; E357-K381 PolarHBondContact O-N 3.21Å; E357-K381 WeakPolarHBondContact OE2-CD 3.41Å; E357-K381 WeakPolarHBondContact OE2-CE 3.4Å; E357-K381 IonicContact OE2-NZ 3.61Å; E357-K381 PolarHBondContact OE2-NZ 3.41Å
358	V	90.2	Very high	86	Confident	9 Å²	9	70.7 Å²	70.7	6%	0.055	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	152.8	171.7	-167.5	0	0	0	0	108.9	E349 L352 G356 Y360 V361 A378 Q379 F380 K381	E349-V358 HydrophobicContact CG-CG2 4.5Å; L352-V358 HydrophobicContact CB-CG2 3.82Å; G356-V358 PolarHBondContact O-N 3.32Å; V358-Y360 WeakPolarHBondContact CG1-O 3.48Å; V358-V361 HydrophobicContact CG1-CG2 3.81Å; V358-A378 HydrophobicContact CG1-CB 4.45Å; V358-Q379 CarbonylContact C-O 3.57Å; V358-Q379 WeakPolarHBondContact CG1-O 3.37Å; V358-F380 HydrophobicContact CG2-CD1 4.21Å; V358-F380 HydrophobicContact CG2-CE1 3.98Å; V358-K381 WeakPolarHBondContact O-CE 3.3Å
359	N	89.1	Confident	85.2	Confident	102 Å²	102	74.5 Å²	74.5	55%	0.545	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-40.4	175.7	-162.9	56.4	0	0	0	111.1	Q379 K381	N359-Q379 HydrophobicContact CB-CB 4.42Å; N359-Q379 HydrophobicContact CB-CG 4.26Å; N359-Q379 PolarHBondContact N-O 2.68Å; N359-Q379 PolarHBondContact ND2-OE1 2.77Å; N359-K381 HydrophobicContact CB-CG 4.16Å
360	Y	87.8	Confident	84.6	Confident	90 Å²	90	74.9 Å²	74.9	35%	0.353	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	153.2	162.4	67.4	-92.9	0	0	0	110.2	V358 K362 A378 Q379	V358-Y360 WeakPolarHBondContact CG1-O 3.48Å; Y360-K362 HydrophobicContact CD2-CB 4.3Å; Y360-K362 HydrophobicContact CE2-CB 4.38Å; Y360-A378 WeakPolarHBondContact O-CA 3.12Å; Y360-Q379 HydrophobicContact CD1-CB 3.88Å; Y360-Q379 HydrophobicContact CE1-CB 3.53Å; Y360-Q379 HydrophobicContact CE1-CG 4.23Å; Y360-Q379 VanDerWaalsContact CE1-OE1 3.29Å; Y360-Q379 HydrophobicContact CE2-CB 4.5Å; Y360-Q379 HydrophobicContact CG-CB 4.49Å; Y360-Q379 PolarHBondContact O-N 2.76Å
361	V	89.9	Confident	83.8	Confident	8 Å²	8	70.5 Å²	70.5	5%	0.048	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	160.9	160.3	-176.6	0	0	0	0	107.5	E345 L348 E349 L352 V358 F377 A378	E345-V361 HydrophobicContact CG-CB 3.6Å; E345-V361 HydrophobicContact CG-CG1 3.74Å; E345-V361 VanDerWaalsContact OE1-O 3.04Å; L348-V361 HydrophobicContact CB-CG1 4.42Å; L348-V361 HydrophobicContact CD2-CG1 3.82Å; L348-V361 HydrophobicContact CG-CG1 4.17Å; E349-V361 HydrophobicContact CB-CG2 4.11Å; E349-V361 HydrophobicContact CG-CG2 4.47Å; L352-V361 HydrophobicContact CD1-CG2 4.13Å; V358-V361 HydrophobicContact CG1-CG2 3.81Å; V361-F377 CarbonylContact C-O 3.54Å; V361-A378 HydrophobicContact CG2-CB 4.16Å
362	K	89.8	Confident	83.6	Confident	139 Å²	139	69.9 Å²	69.9	60%	0.604	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152	102.7	172	-158.8	149.4	-168.3	153.8	0	111.7	E345 Y360 A376 F377	E345-K362 WeakPolarHBondContact OE2-CA 3.5Å; Y360-K362 HydrophobicContact CD2-CB 4.3Å; Y360-K362 HydrophobicContact CE2-CB 4.38Å; K362-A376 VanDerWaalsContact O-CA 3.32Å; K362-A376 WeakPolarHBondContact O-CA 3.45Å; K362-F377 PolarHBondContact N-O 2.87Å; K362-F377 PolarHBondContact O-N 3.12Å
363	V	89.6	Confident	83.3	Confident	21 Å²	21	73.9 Å²	73.9	13%	0.127	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	126.5	175.4	-176.5	0	0	0	0	110.5	L339 E345 L365 A376	L339-V363 HydrophobicContact CD2-CG1 4.29Å; L339-V363 HydrophobicContact CD2-CG2 4.29Å; E345-V363 HydrophobicContact CB-CG2 4.41Å; E345-V363 PolarHBondContact OE2-N 3.07Å; V363-L365 HydrophobicContact CG1-CD2 4.29Å; V363-L365 PolarHBondContact O-N 3.36Å; V363-L365 VanDerWaalsContact O-N 3.16Å; V363-A376 HydrophobicContact CG2-CB 4.42Å
364	V	87.9	Confident	83	Confident	35 Å²	35	69.5 Å²	69.5	21%	0.212	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	97.9	-175.5	-174.2	0	0	0	0	110.3	K373 L375 F377	V364-K373 HydrophobicContact CG1-CD 4.1Å; V364-K373 VanDerWaalsContact O-CB 3.27Å; V364-K373 WeakPolarHBondContact O-CB 3.32Å; V364-K373 VanDerWaalsContact O-CG 3.3Å; V364-K373 WeakPolarHBondContact O-CG 3.32Å; V364-K373 PolarHBondContact O-N 2.81Å; V364-L375 HydrophobicContact CB-CB 4.19Å; V364-L375 HydrophobicContact CG2-CB 4.36Å; V364-L375 PolarHBondContact N-O 3.19Å; V364-F377 HydrophobicContact CG2-CD2 3.74Å; V364-F377 HydrophobicContact CG2-CE2 3.76Å
365	L	85.6	Confident	83.2	Confident	71 Å²	71	64.2 Å²	64.2	37%	0.372	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	160.6	174.6	-53.4	-175.5	0	0	0	112.5	V363 H371 K373	V363-L365 HydrophobicContact CG1-CD2 4.29Å; V363-L365 PolarHBondContact O-N 3.36Å; V363-L365 VanDerWaalsContact O-N 3.16Å; L365-H371 CarbonylContact C-O 3.28Å; L365-K373 PolarHBondContact O-NZ 3.36Å
366	H	76.8	Confident	83.4	Confident	63 Å²	63	61.9 Å²	61.9	29%	0.292	32%	0.317	S	S	.	.			trans	-86.5	127	171.3	-165.4	-82.5	0	0	0	110.7	E368 T369 Q370 H371 K373	H366-E368 IonicContact CE1-OE2 2.86Å; H366-E368 PolarHBondContact CE1-OE2 2.98Å; H366-E368 PolarHBondContact O-N 2.92Å; H366-T369 WeakPolarHBondContact CB-OG1 3.42Å; H366-T369 PolarHBondContact O-N 2.88Å; H366-Q370 VanDerWaalsContact O-CA 3.26Å; H366-Q370 WeakPolarHBondContact O-CA 3.42Å; H366-Q370 PolarHBondContact O-N 2.96Å; H366-H371 PolarHBondContact N-O 2.83Å; H366-K373 HydrophobicContact CB-CG 4.4Å
367	P	77	Confident	83.7	Confident	96 Å²	96	64.1 Å²	64.1	62%	0.623	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-47.3	-171.9	-27	34.5	0	0	0	114	Q370	P367-Q370 PolarHBondContact O-NE2 2.7Å
368	E	59.2	Low	83.8	Confident	126 Å²	126	58.4 Å²	58.4	59%	0.589	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-33	-176.3	-58.9	173.2	158	0	0	114	H366 R555	H366-E368 IonicContact CE1-OE2 2.86Å; H366-E368 PolarHBondContact CE1-OE2 2.98Å; H366-E368 PolarHBondContact O-N 2.92Å; E368-R555 IonicContact OE1-CZ 2.72Å; E368-R555 IonicContact OE1-NH1 2.79Å; E368-R555 PolarHBondContact OE1-NH1 2.82Å; E368-R555 IonicContact OE2-CZ 3.66Å; E368-R555 IonicContact OE2-NH1 3.81Å; E368-R555 PolarHBondContact OE2-NH1 2.84Å; E368-R555 IonicContact OE2-NH2 3.08Å; E368-R555 PolarHBondContact OE2-NH2 2.68Å
369	T	72.8	Confident	83.8	Confident	80 Å²	80	58.8 Å²	58.8	49%	0.491	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-6.9	-168.6	60.1	0	0	0	0	113.8	H366 H371	H366-T369 WeakPolarHBondContact CB-OG1 3.42Å; H366-T369 PolarHBondContact O-N 2.88Å; T369-H371 PolarHBondContact O-N 3.24Å
370	Q	73.6	Confident	83.9	Confident	94 Å²	94	54 Å²	54	44%	0.439	27%	0.269	S	S	.	.			trans	51.2	24.4	-174.5	-63	-64.3	-26.7	0	0	114.1	H366 P367	H366-Q370 VanDerWaalsContact O-CA 3.26Å; H366-Q370 WeakPolarHBondContact O-CA 3.42Å; H366-Q370 PolarHBondContact O-N 2.96Å; P367-Q370 PolarHBondContact O-NE2 2.7Å
371	H	72.6	Confident	84	Confident	62 Å²	62	54.1 Å²	54.1	29%	0.287	27%	0.272	S	S	.	.			trans	-95	137.6	179.2	-165.6	40.9	0	0	0	111.3	L365 H366 T369 K373	L365-H371 CarbonylContact C-O 3.28Å; H366-H371 PolarHBondContact N-O 2.83Å; T369-H371 PolarHBondContact O-N 3.24Å; H371-K373 PolarHBondContact O-N 3.47Å
372	S	84.6	Confident	84.1	Confident	20 Å²	20	57.3 Å²	57.3	14%	0.14	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	129.2	177.3	-53.4	0	0	0	0	111.6	F341 G374	F341-S372 VanDerWaalsContact CD1-O 3.24Å; F341-S372 WeakPolarHBondContact CD1-O 3.44Å; S372-G374 PolarHBondContact O-N 2.85Å
373	K	81.2	Confident	84.1	Confident	84 Å²	84	55.4 Å²	55.4	37%	0.365	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	2.4	177.9	-65.6	-170.8	-176.9	102.2	0	113.8	V364 L365 H366 H371 L375	V364-K373 HydrophobicContact CG1-CD 4.1Å; V364-K373 VanDerWaalsContact O-CB 3.27Å; V364-K373 WeakPolarHBondContact O-CB 3.32Å; V364-K373 VanDerWaalsContact O-CG 3.3Å; V364-K373 WeakPolarHBondContact O-CG 3.32Å; V364-K373 PolarHBondContact O-N 2.81Å; L365-K373 PolarHBondContact O-NZ 3.36Å; H366-K373 HydrophobicContact CB-CG 4.4Å; H371-K373 PolarHBondContact O-N 3.47Å; K373-L375 VanDerWaalsContact C-N 3.25Å; K373-L375 HydrophobicContact CB-CB 4.35Å; K373-L375 HydrophobicContact CB-CD1 4.13Å; K373-L375 HydrophobicContact CB-CG 4.22Å
374	G	85.8	Confident	84.1	Confident	6 Å²	6	61.8 Å²	61.8	6%	0.062	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69.7	26	-169.2	0	0	0	0	0	112.7	N338 L339 S372	N338-G374 PolarHBondContact N-O 3.32Å; N338-G374 VanDerWaalsContact N-O 3.14Å; L339-G374 PolarHBondContact N-O 3.23Å; S372-G374 PolarHBondContact O-N 2.85Å
375	L	91.3	Very high	84.3	Confident	50 Å²	50	60.4 Å²	60.4	26%	0.262	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	139.7	-175.1	-61.6	176.4	0	0	0	108.8	F335 I336 R337 V364 K373	F335-L375 HydrophobicContact CE2-CB 4.19Å; F335-L375 HydrophobicContact CE2-CD2 4.16Å; F335-L375 HydrophobicContact CZ-CD1 4.27Å; F335-L375 HydrophobicContact CZ-CD2 3.86Å; F335-L375 HydrophobicContact CZ-CG 4.48Å; I336-L375 WeakPolarHBondContact O-CA 3.38Å; R337-L375 HydrophobicContact CB-CD2 4.16Å; R337-L375 HydrophobicContact CG-CD2 3.91Å; V364-L375 HydrophobicContact CB-CB 4.19Å; V364-L375 HydrophobicContact CG2-CB 4.36Å; V364-L375 PolarHBondContact N-O 3.19Å; K373-L375 VanDerWaalsContact C-N 3.25Å; K373-L375 HydrophobicContact CB-CB 4.35Å; K373-L375 HydrophobicContact CB-CD1 4.13Å; K373-L375 HydrophobicContact CB-CG 4.22Å
376	A	91.4	Very high	84.5	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	159	172	0	0	0	0	0	110.8	F335 I336 L339 L348 K362 V363	F335-A376 WeakPolarHBondContact CD2-O 3.25Å; I336-A376 HydrophobicContact CB-CB 4.33Å; I336-A376 PolarHBondContact N-O 3.05Å; I336-A376 PolarHBondContact O-N 3.18Å; L339-A376 HydrophobicContact CD2-CB 4.12Å; L348-A376 HydrophobicContact CD2-CB 3.61Å; K362-A376 VanDerWaalsContact O-CA 3.32Å; K362-A376 WeakPolarHBondContact O-CA 3.45Å; V363-A376 HydrophobicContact CG2-CB 4.42Å
377	F	92.7	Very high	85.1	Confident	71 Å²	71	57.1 Å²	57.1	31%	0.311	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	151.4	162.3	-66	-85.7	0	0	0	108.7	T333 V334 F335 V361 K362 V364 A414	T333-F377 HydrophobicContact CG2-CB 4.49Å; V334-F377 WeakPolarHBondContact O-CA 3.39Å; F335-F377 HydrophobicContact CB-CD1 4.07Å; F335-F377 HydrophobicContact CB-CE1 3.9Å; F335-F377 AromaticContact CD2-CD1 3.79Å; F335-F377 HydrophobicContact CD2-CD1 3.79Å; F335-F377 HydrophobicContact CD2-CD2 4.46Å; F335-F377 AromaticContact CD2-CE1 3.37Å; F335-F377 HydrophobicContact CD2-CE1 3.37Å; F335-F377 HydrophobicContact CD2-CE2 4.1Å; F335-F377 HydrophobicContact CD2-CG 4.32Å; F335-F377 AromaticContact CD2-CZ 3.55Å; F335-F377 HydrophobicContact CD2-CZ 3.55Å; F335-F377 HydrophobicContact CE2-CE1 4.07Å; F335-F377 HydrophobicContact CE2-CE2 4.13Å; F335-F377 AromaticContact CE2-CZ 3.75Å; F335-F377 HydrophobicContact CE2-CZ 3.75Å; F335-F377 HydrophobicContact CG-CD1 4.3Å; F335-F377 AromaticContact CG-CE1 3.81Å; F335-F377 HydrophobicContact CG-CE1 3.81Å; F335-F377 HydrophobicContact CG-CZ 4.3Å; V361-F377 CarbonylContact C-O 3.54Å; K362-F377 PolarHBondContact N-O 2.87Å; K362-F377 PolarHBondContact O-N 3.12Å; V364-F377 HydrophobicContact CG2-CD2 3.74Å; V364-F377 HydrophobicContact CG2-CE2 3.76Å; F377-A414 HydrophobicContact CD1-CB 4.38Å; F377-A414 HydrophobicContact CE1-CB 4.43Å
378	A	91.3	Very high	85.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	138.1	168.9	0	0	0	0	0	109.3	T333 V334 I336 L352 V358 Y360 V361	T333-A378 CarbonylContact C-O 3.55Å; T333-A378 WeakPolarHBondContact CA-O 3.36Å; T333-A378 WeakPolarHBondContact CG2-O 3.06Å; V334-A378 HydrophobicContact CG2-CB 3.98Å; V334-A378 PolarHBondContact N-O 3.2Å; V334-A378 PolarHBondContact O-N 2.67Å; V334-A378 VanDerWaalsContact O-N 3.1Å; I336-A378 HydrophobicContact CD1-CB 4.13Å; L352-A378 HydrophobicContact CD1-CB 3.57Å; V358-A378 HydrophobicContact CG1-CB 4.45Å; Y360-A378 WeakPolarHBondContact O-CA 3.12Å; V361-A378 HydrophobicContact CG2-CB 4.16Å
379	Q	89.9	Confident	87.1	Confident	17 Å²	17	49.6 Å²	49.6	8%	0.079	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.5	175.6	-179.8	-178.3	61.8	0	0	109.4	D327 R332 V358 N359 Y360	D327-Q379 PolarHBondContact OD1-NE2 2.92Å; R332-Q379 HydrophobicContact CB-CG 4.45Å; V358-Q379 CarbonylContact C-O 3.57Å; V358-Q379 WeakPolarHBondContact CG1-O 3.37Å; N359-Q379 HydrophobicContact CB-CB 4.42Å; N359-Q379 HydrophobicContact CB-CG 4.26Å; N359-Q379 PolarHBondContact N-O 2.68Å; N359-Q379 PolarHBondContact ND2-OE1 2.77Å; Y360-Q379 HydrophobicContact CD1-CB 3.88Å; Y360-Q379 HydrophobicContact CE1-CB 3.53Å; Y360-Q379 HydrophobicContact CE1-CG 4.23Å; Y360-Q379 VanDerWaalsContact CE1-OE1 3.29Å; Y360-Q379 HydrophobicContact CE2-CB 4.5Å; Y360-Q379 HydrophobicContact CG-CB 4.49Å; Y360-Q379 PolarHBondContact O-N 2.76Å
380	F	91.9	Very high	87.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	151.1	169.4	-71.2	-83.7	0	0	0	111.2	R332 V334 L352 F355 V358 T382 A385 A386 C389	R332-F380 VanDerWaalsContact CB-O 3.29Å; R332-F380 WeakPolarHBondContact CB-O 3.35Å; R332-F380 PolarHBondContact O-N 3.32Å; V334-F380 HydrophobicContact CG1-CD2 4.23Å; V334-F380 HydrophobicContact CG1-CE2 4.05Å; V334-F380 HydrophobicContact CG2-CD2 4.42Å; V334-F380 HydrophobicContact CG2-CE2 3.89Å; L352-F380 HydrophobicContact CB-CE1 4.34Å; L352-F380 HydrophobicContact CB-CZ 4.1Å; L352-F380 HydrophobicContact CD2-CZ 4.04Å; F355-F380 HydrophobicContact CB-CE1 4.47Å; V358-F380 HydrophobicContact CG2-CD1 4.21Å; V358-F380 HydrophobicContact CG2-CE1 3.98Å; F380-T382 VanDerWaalsContact C-N 3.3Å; F380-T382 VanDerWaalsContact CB-O 3.32Å; F380-T382 WeakPolarHBondContact CB-O 3.18Å; F380-T382 PolarHBondContact O-N 3.15Å; F380-A385 HydrophobicContact CB-CB 4.03Å; F380-A385 HydrophobicContact CD1-CB 3.66Å; F380-A385 HydrophobicContact CE1-CB 4.28Å; F380-A385 HydrophobicContact CG-CB 3.92Å; F380-A386 HydrophobicContact CB-CB 4.32Å; F380-A386 HydrophobicContact CD2-CB 3.73Å; F380-A386 HydrophobicContact CE2-CB 4.49Å; F380-A386 HydrophobicContact CG-CB 4.35Å; F380-C389 HydrophobicContact CE2-CB 3.88Å; F380-C389 HydrophobicContact CZ-CB 3.81Å
381	K	89.9	Confident	88.6	Confident	93 Å²	93	44.8 Å²	44.8	40%	0.404	23%	0.234	S	C	.	.	S	Bend	trans	-66.3	-34.4	173.3	-62.9	-175.7	-165.6	170.7	0	111.6	R332 E357 V358 N359	R332-K381 PolarHBondContact NH1-O 3.19Å; E357-K381 HydrophobicContact CB-CB 4.48Å; E357-K381 HydrophobicContact CB-CD 3.73Å; E357-K381 HydrophobicContact CB-CG 4.16Å; E357-K381 PolarHBondContact O-N 3.21Å; E357-K381 WeakPolarHBondContact OE2-CD 3.41Å; E357-K381 WeakPolarHBondContact OE2-CE 3.4Å; E357-K381 IonicContact OE2-NZ 3.61Å; E357-K381 PolarHBondContact OE2-NZ 3.41Å; V358-K381 WeakPolarHBondContact O-CE 3.3Å; N359-K381 HydrophobicContact CB-CG 4.16Å
382	T	91.1	Very high	89.2	Confident	75 Å²	75	43 Å²	43	46%	0.46	23%	0.23	S	C	.	.	S	Bend	trans	-111.3	147	175.6	70.5	0	0	0	0	111.9	F380 E384 A385	F380-T382 VanDerWaalsContact C-N 3.3Å; F380-T382 VanDerWaalsContact CB-O 3.32Å; F380-T382 WeakPolarHBondContact CB-O 3.18Å; F380-T382 PolarHBondContact O-N 3.15Å; T382-E384 VanDerWaalsContact C-N 3.29Å; T382-A385 WeakPolarHBondContact OG1-CB 3.49Å; T382-A385 PolarHBondContact OG1-N 2.88Å
383	K	89.6	Confident	89.2	Confident	100 Å²	100	42.5 Å²	42.5	44%	0.435	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-33.4	172.2	180	-180	174	-74.9	0	111.9	R332 A385 A386 D387	R332-K383 HydrophobicContact CG-CB 4.5Å; K383-A385 VanDerWaalsContact C-N 3.35Å; K383-A385 PolarHBondContact O-N 3.42Å; K383-A386 WeakPolarHBondContact O-CB 3.48Å; K383-A386 PolarHBondContact O-N 3.32Å; K383-D387 IonicContact NZ-OD2 3.99Å; K383-D387 PolarHBondContact NZ-OD2 3.01Å; K383-D387 PolarHBondContact O-N 3.39Å
384	E	90.5	Very high	89.1	Confident	154 Å²	154	44.8 Å²	44.8	72%	0.72	24%	0.239	S	C	*	.	H	α-helix	trans	-66.4	-35.3	-178	-64.9	175	177.4	0	0	112.1	T382 S388	T382-E384 VanDerWaalsContact C-N 3.29Å; E384-S388 VanDerWaalsContact O-CB 3.23Å; E384-S388 WeakPolarHBondContact O-CB 3.46Å; E384-S388 PolarHBondContact O-N 3Å; E384-S388 PolarHBondContact O-OG 2.63Å
385	A	90.8	Very high	88.8	Confident	6 Å²	6	48.9 Å²	48.9	5%	0.05	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-43.3	170.4	0	0	0	0	0	111.9	F355 F380 T382 K383 S388 C389	F355-A385 VanDerWaalsContact O-CB 3.25Å; F355-A385 WeakPolarHBondContact O-CB 3.46Å; F380-A385 HydrophobicContact CB-CB 4.03Å; F380-A385 HydrophobicContact CD1-CB 3.66Å; F380-A385 HydrophobicContact CE1-CB 4.28Å; F380-A385 HydrophobicContact CG-CB 3.92Å; T382-A385 WeakPolarHBondContact OG1-CB 3.49Å; T382-A385 PolarHBondContact OG1-N 2.88Å; K383-A385 VanDerWaalsContact C-N 3.35Å; K383-A385 PolarHBondContact O-N 3.42Å; A385-S388 PolarHBondContact O-N 2.9Å; A385-C389 WeakPolarHBondContact O-CB 3.34Å; A385-C389 PolarHBondContact O-N 3.33Å
386	A	89.8	Confident	87.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-47.4	176.9	0	0	0	0	0	112.6	R332 V334 F380 K383 C389 I390	R332-A386 WeakPolarHBondContact O-CB 3.38Å; V334-A386 HydrophobicContact CG1-CB 3.89Å; F380-A386 HydrophobicContact CB-CB 4.32Å; F380-A386 HydrophobicContact CD2-CB 3.73Å; F380-A386 HydrophobicContact CE2-CB 4.49Å; F380-A386 HydrophobicContact CG-CB 4.35Å; K383-A386 WeakPolarHBondContact O-CB 3.48Å; K383-A386 PolarHBondContact O-N 3.32Å; A386-C389 PolarHBondContact O-N 2.96Å; A386-I390 WeakPolarHBondContact O-CD1 3.41Å; A386-I390 VanDerWaalsContact O-CG1 3.28Å; A386-I390 WeakPolarHBondContact O-CG1 3.41Å; A386-I390 PolarHBondContact O-N 2.97Å
387	D	90.8	Very high	86.7	Confident	66 Å²	66	59.6 Å²	59.6	35%	0.353	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-38.1	176.8	-72.5	-33	0	0	0	111.4	K383 I390 A391	K383-D387 IonicContact NZ-OD2 3.99Å; K383-D387 PolarHBondContact NZ-OD2 3.01Å; K383-D387 PolarHBondContact O-N 3.39Å; D387-I390 PolarHBondContact O-N 2.95Å; D387-A391 PolarHBondContact O-N 3.07Å
388	S	88.9	Confident	85.1	Confident	64 Å²	64	65.2 Å²	65.2	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-67.5	-40.5	175.9	-59.2	0	0	0	0	112.7	E384 A385 I390 A391 A392	E384-S388 VanDerWaalsContact O-CB 3.23Å; E384-S388 WeakPolarHBondContact O-CB 3.46Å; E384-S388 PolarHBondContact O-N 3Å; E384-S388 PolarHBondContact O-OG 2.63Å; A385-S388 PolarHBondContact O-N 2.9Å; S388-I390 VanDerWaalsContact C-N 3.33Å; S388-A391 PolarHBondContact O-N 3.22Å; S388-A392 WeakPolarHBondContact O-CB 3.41Å; S388-A392 PolarHBondContact O-N 3.39Å
389	C	89.3	Confident	83.5	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-63.6	-39.1	175	-174.8	0	0	0	0	111.4	F355 F380 A385 A386 A393 I411	F355-C389 HydrophobicContact CB-CB 4.01Å; F355-C389 HydrophobicContact CG-CB 4.19Å; F380-C389 HydrophobicContact CE2-CB 3.88Å; F380-C389 HydrophobicContact CZ-CB 3.81Å; A385-C389 WeakPolarHBondContact O-CB 3.34Å; A385-C389 PolarHBondContact O-N 3.33Å; A386-C389 PolarHBondContact O-N 2.96Å; C389-A393 WeakPolarHBondContact O-CB 3.42Å; C389-A393 PolarHBondContact O-N 3.22Å; C389-A393 VanDerWaalsContact O-N 3.07Å; C389-I411 VanDerWaalsContact SG-CD1 3.56Å
390	I	89.6	Confident	82.2	Confident	19 Å²	19	70.8 Å²	70.8	10%	0.097	38%	0.384	C	S	.	.	H	α-helix	trans	-65.3	-43.1	173.1	-68.8	161.8	0	0	0	111	V334 A386 D387 S388 A393 Q394 I411 K413	V334-I390 HydrophobicContact CG1-CD1 4.06Å; V334-I390 HydrophobicContact CG1-CG1 4.09Å; A386-I390 WeakPolarHBondContact O-CD1 3.41Å; A386-I390 VanDerWaalsContact O-CG1 3.28Å; A386-I390 WeakPolarHBondContact O-CG1 3.41Å; A386-I390 PolarHBondContact O-N 2.97Å; D387-I390 PolarHBondContact O-N 2.95Å; S388-I390 VanDerWaalsContact C-N 3.33Å; I390-A393 PolarHBondContact O-N 3.44Å; I390-Q394 VanDerWaalsContact CG2-NE2 3.28Å; I390-Q394 WeakPolarHBondContact O-CG 3.3Å; I390-Q394 PolarHBondContact O-N 2.98Å; I390-Q394 VanDerWaalsContact O-N 3.13Å; I390-I411 HydrophobicContact CG1-CG2 4.15Å; I390-K413 HydrophobicContact CD1-CB 3.94Å
391	A	88	Confident	81.2	Confident	54 Å²	54	71.5 Å²	71.5	45%	0.446	39%	0.392	S	S	.	.	H	α-helix	trans	-61.4	-50.4	177.1	0	0	0	0	0	111.8	D387 S388 A393 Q394 D395	D387-A391 PolarHBondContact O-N 3.07Å; S388-A391 PolarHBondContact O-N 3.22Å; A391-A393 PolarHBondContact O-N 2.85Å; A391-Q394 PolarHBondContact O-N 3.28Å; A391-D395 PolarHBondContact O-N 3.25Å
392	A	85.6	Confident	80.9	Confident	23 Å²	23	67.7 Å²	67.7	19%	0.19	38%	0.376	C	S	.	.	H	α-helix	trans	-65.2	-20	178	0	0	0	0	0	114	F355 S388 G401 I402	F355-A392 HydrophobicContact CD1-CB 4.11Å; F355-A392 HydrophobicContact CE1-CB 3.39Å; F355-A392 HydrophobicContact CZ-CB 3.99Å; S388-A392 WeakPolarHBondContact O-CB 3.41Å; S388-A392 PolarHBondContact O-N 3.39Å; A392-G401 VanDerWaalsContact O-CA 3.28Å; A392-G401 WeakPolarHBondContact O-CA 3.23Å; A392-I402 HydrophobicContact CB-CD1 4.21Å; A392-I402 HydrophobicContact CB-CG1 4.33Å
393	A	83.9	Confident	80.6	Confident	10 Å²	10	70.1 Å²	70.1	8%	0.083	38%	0.377	C	S	.	.	H	α-helix	trans	-81.2	-24.9	169.8	0	0	0	0	0	113.4	C389 I390 A391 I402 I411	C389-A393 WeakPolarHBondContact O-CB 3.42Å; C389-A393 PolarHBondContact O-N 3.22Å; C389-A393 VanDerWaalsContact O-N 3.07Å; I390-A393 PolarHBondContact O-N 3.44Å; A391-A393 PolarHBondContact O-N 2.85Å; A393-I402 HydrophobicContact CB-CD1 4.37Å; A393-I411 HydrophobicContact CB-CB 3.67Å; A393-I411 HydrophobicContact CB-CD1 4.28Å; A393-I411 HydrophobicContact CB-CG1 3.83Å
394	Q	80	Confident	80.3	Confident	133 Å²	133	65.7 Å²	65.7	62%	0.621	36%	0.358	S	S	*	.	H	α-helix	trans	-84.1	-17.7	-179.3	-75.6	179	22.9	0	0	114.1	I390 A391 E396	I390-Q394 VanDerWaalsContact CG2-NE2 3.28Å; I390-Q394 WeakPolarHBondContact O-CG 3.3Å; I390-Q394 PolarHBondContact O-N 2.98Å; I390-Q394 VanDerWaalsContact O-N 3.13Å; A391-Q394 PolarHBondContact O-N 3.28Å; Q394-E396 WeakPolarHBondContact O-CG 3.27Å; Q394-E396 PolarHBondContact O-N 3.12Å
395	D	78.4	Confident	79.6	Confident	92 Å²	92	62.9 Å²	62.9	49%	0.492	35%	0.349	S	S	.	.			trans	-57	107.3	176	-81.8	-46.1	0	0	0	111.6	A391 T397 K408	A391-D395 PolarHBondContact O-N 3.25Å; D395-T397 VanDerWaalsContact C-N 3.27Å; D395-T397 PolarHBondContact O-N 3.48Å; D395-K408 PolarHBondContact O-NZ 2.86Å
396	E	66	Low	79.1	Confident	185 Å²	185	65.7 Å²	65.7	86%	0.864	38%	0.378	S	S	*	.			trans	-80.2	-0.2	-176.2	-64.4	-160.5	135.4	0	0	114.3	Q394	Q394-E396 WeakPolarHBondContact O-CG 3.27Å; Q394-E396 PolarHBondContact O-N 3.12Å
397	T	73.6	Confident	78.9	Confident	90 Å²	90	70.1 Å²	70.1	55%	0.552	40%	0.395	S	S	*	.	S	Bend	trans	-60.1	148.8	177.1	60.8	0	0	0	0	111.6	D395 S399 G400	D395-T397 VanDerWaalsContact C-N 3.27Å; D395-T397 PolarHBondContact O-N 3.48Å; T397-S399 PolarHBondContact O-N 3.01Å; T397-G400 WeakPolarHBondContact O-CA 3.42Å; T397-G400 PolarHBondContact O-N 3.39Å; T397-G400 WeakPolarHBondContact OG1-CA 3.43Å; T397-G400 PolarHBondContact OG1-N 3.36Å
398	E	58.1	Low	78.7	Confident	189 Å²	189	70.1 Å²	70.1	88%	0.883	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.4	-171.7	-59.8	-173.5	134.3	0	0	113.5	R403	E398-R403 PolarHBondContact O-NH2 2.92Å
399	S	57.4	Low	78.7	Confident	120 Å²	120	67 Å²	67	84%	0.839	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-4.9	171.5	-166	0	0	0	0	113.5	T397	T397-S399 PolarHBondContact O-N 3.01Å
400	G	62.5	Low	78.6	Confident	13 Å²	13	72.4 Å²	72.4	13%	0.134	40%	0.397	C	S	.	.			trans	-101	166.7	-174.6	0	0	0	0	0	114.4	T397 K408	T397-G400 WeakPolarHBondContact O-CA 3.42Å; T397-G400 PolarHBondContact O-N 3.39Å; T397-G400 WeakPolarHBondContact OG1-CA 3.43Å; T397-G400 PolarHBondContact OG1-N 3.36Å; G400-K408 PolarHBondContact O-NZ 2.76Å
401	G	72.4	Confident	78.6	Confident	16 Å²	16	71.8 Å²	71.8	17%	0.165	39%	0.393	C	S	.	.	S	Bend	trans	90.4	131.7	-173.1	0	0	0	0	0	113.5	A392 R403	A392-G401 VanDerWaalsContact O-CA 3.28Å; A392-G401 WeakPolarHBondContact O-CA 3.23Å; G401-R403 WeakPolarHBondContact O-CG 3.35Å
402	I	82.5	Confident	78.8	Confident	12 Å²	12	72 Å²	72	6%	0.062	39%	0.389	C	S	.	.			trans	-56.1	134.1	175.3	-61.2	170.1	0	0	0	110.4	V351 F355 A392 A393 K408 L409 I411	V351-I402 HydrophobicContact CG1-CG2 3.37Å; F355-I402 HydrophobicContact CD2-CD1 3.99Å; F355-I402 HydrophobicContact CE1-CD1 4.22Å; F355-I402 HydrophobicContact CE1-CG1 4.47Å; F355-I402 HydrophobicContact CE2-CD1 3.47Å; F355-I402 VanDerWaalsContact CE2-CD1 3.47Å; F355-I402 HydrophobicContact CE2-CG1 3.7Å; F355-I402 HydrophobicContact CZ-CD1 3.61Å; F355-I402 HydrophobicContact CZ-CG1 3.59Å; A392-I402 HydrophobicContact CB-CD1 4.21Å; A392-I402 HydrophobicContact CB-CG1 4.33Å; A393-I402 HydrophobicContact CB-CD1 4.37Å; I402-K408 WeakPolarHBondContact O-CA 3.45Å; I402-L409 HydrophobicContact CG2-CD1 4.09Å; I402-L409 PolarHBondContact O-N 2.7Å; I402-I411 HydrophobicContact CD1-CD1 3.82Å
403	R	85.1	Confident	79	Confident	127 Å²	127	75 Å²	75	48%	0.479	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.2	179.7	-52.9	-170.4	-174	-164.4	2.4	112.2	E398 G401 R407	E398-R403 PolarHBondContact O-NH2 2.92Å; G401-R403 WeakPolarHBondContact O-CG 3.35Å; R403-R407 WeakPolarHBondContact CA-O 3.38Å
404	A	82.3	Confident	79.3	Confident	6 Å²	6	74.8 Å²	74.8	5%	0.05	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.2	165.5	0	0	0	0	0	108.8	L339 T343 G406 R407 L409	L339-A404 HydrophobicContact CD1-CB 4.44Å; T343-A404 HydrophobicContact CG2-CB 4.43Å; A404-G406 PolarHBondContact O-N 2.81Å; A404-G406 VanDerWaalsContact O-N 3.09Å; A404-R407 PolarHBondContact N-O 2.91Å; A404-R407 WeakPolarHBondContact O-CB 3.39Å; A404-R407 PolarHBondContact O-N 2.8Å; A404-L409 HydrophobicContact CB-CD1 4.11Å; A404-L409 HydrophobicContact CB-CD2 4.27Å; A404-L409 HydrophobicContact CB-CG 4.35Å
405	D	77.1	Confident	79.6	Confident	96 Å²	96	71.8 Å²	71.8	51%	0.513	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	35.8	-174.2	-55.1	-29.7	0	0	0	114.5	S340 T343 R407	S340-D405 WeakPolarHBondContact CB-OD2 3.31Å; T343-D405 WeakPolarHBondContact CB-OD2 3.39Å; T343-D405 PolarHBondContact OG1-OD2 2.96Å; D405-R407 PolarHBondContact O-N 3.21Å
406	G	79	Confident	80	Confident	65 Å²	65	68.5 Å²	68.5	67%	0.67	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	0.8	-175.6	0	0	0	0	0	115.6	A404	A404-G406 PolarHBondContact O-N 2.81Å; A404-G406 VanDerWaalsContact O-N 3.09Å
407	R	85.8	Confident	80.9	Confident	92 Å²	92	70.4 Å²	70.4	35%	0.347	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.1	177.9	-55.2	-176	-170.6	-175.1	7.8	110.7	S340 R403 A404 D405 L409	S340-R407 PolarHBondContact OG-NH2 3.13Å; R403-R407 WeakPolarHBondContact CA-O 3.38Å; A404-R407 PolarHBondContact N-O 2.91Å; A404-R407 WeakPolarHBondContact O-CB 3.39Å; A404-R407 PolarHBondContact O-N 2.8Å; D405-R407 PolarHBondContact O-N 3.21Å; R407-L409 PolarHBondContact O-N 3.13Å
408	K	87.1	Confident	81.2	Confident	66 Å²	66	72.2 Å²	72.2	29%	0.287	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	120.8	170.4	-177.7	163.5	176.5	153.5	0	109.9	N338 D395 G400 I402	N338-K408 PolarHBondContact ND2-O 3.43Å; D395-K408 PolarHBondContact O-NZ 2.86Å; G400-K408 PolarHBondContact O-NZ 2.76Å; I402-K408 WeakPolarHBondContact O-CA 3.45Å
409	L	88.9	Confident	82.4	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-77.2	142.9	174.8	-59.1	-175.8	0	0	0	109.4	I336 L339 L348 I402 A404 R407 I411	I336-L409 HydrophobicContact CG2-CB 4.34Å; I336-L409 HydrophobicContact CG2-CD1 4.08Å; I336-L409 HydrophobicContact CG2-CD2 4.36Å; L339-L409 HydrophobicContact CB-CD2 4.33Å; L339-L409 HydrophobicContact CD1-CD2 3.87Å; L348-L409 HydrophobicContact CD1-CD1 3.7Å; I402-L409 HydrophobicContact CG2-CD1 4.09Å; I402-L409 PolarHBondContact O-N 2.7Å; A404-L409 HydrophobicContact CB-CD1 4.11Å; A404-L409 HydrophobicContact CB-CD2 4.27Å; A404-L409 HydrophobicContact CB-CG 4.35Å; R407-L409 PolarHBondContact O-N 3.13Å; L409-I411 HydrophobicContact CB-CD1 4.48Å; L409-I411 HydrophobicContact CB-CG1 4.18Å
410	M	87.5	Confident	83.5	Confident	113 Å²	113	62.8 Å²	62.8	56%	0.557	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.3	105.5	170.4	-69.6	-161.7	-60.9	0	0	109	R337	R337-M410 HydrophobicContact CB-CB 4.3Å; R337-M410 WeakPolarHBondContact CB-O 2.89Å; R337-M410 PolarHBondContact N-O 3.47Å; R337-M410 PolarHBondContact O-N 2.88Å
411	I	90.3	Very high	84.5	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.2	-175	-48.9	-171	0	0	0	109.1	V334 I336 L352 C389 I390 A393 I402 L409	V334-I411 HydrophobicContact CB-CG2 3.72Å; V334-I411 HydrophobicContact CG1-CG2 4.15Å; V334-I411 HydrophobicContact CG2-CG2 3.99Å; I336-I411 HydrophobicContact CG1-CD1 4.2Å; I336-I411 HydrophobicContact CG1-CG1 4.09Å; I336-I411 HydrophobicContact CG1-CG2 4.1Å; I336-I411 HydrophobicContact CG2-CG1 4.41Å; L352-I411 HydrophobicContact CD2-CD1 4.15Å; C389-I411 VanDerWaalsContact SG-CD1 3.56Å; I390-I411 HydrophobicContact CG1-CG2 4.15Å; A393-I411 HydrophobicContact CB-CB 3.67Å; A393-I411 HydrophobicContact CB-CD1 4.28Å; A393-I411 HydrophobicContact CB-CG1 3.83Å; I402-I411 HydrophobicContact CD1-CD1 3.82Å; L409-I411 HydrophobicContact CB-CD1 4.48Å; L409-I411 HydrophobicContact CB-CG1 4.18Å
412	V	90.6	Very high	84.9	Confident	59 Å²	59	71 Å²	71	36%	0.358	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	150.8	-178.8	-172.9	0	0	0	0	107.9	F335 A414	F335-V412 PolarHBondContact N-O 2.76Å; F335-V412 PolarHBondContact O-N 3.35Å; V412-A414 PolarHBondContact O-N 3.11Å
413	K	90.3	Very high	84.7	Confident	87 Å²	87	75.2 Å²	75.2	38%	0.378	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.2	137.3	170.7	-167.2	-176.7	179.6	-178.9	0	110.7	I390	I390-K413 HydrophobicContact CD1-CB 3.94Å
414	A	90	Very high	84.1	Confident	5 Å²	5	75.7 Å²	75.7	4%	0.041	38%	0.384	C	S	.	.			trans	-63.2	153.6	173.3	0	0	0	0	0	111.4	V328 T333 F335 F377 V412	V328-A414 HydrophobicContact CG1-CB 4.23Å; T333-A414 HydrophobicContact CG2-CB 4.03Å; T333-A414 WeakPolarHBondContact O-CB 3.12Å; T333-A414 PolarHBondContact O-N 2.91Å; F335-A414 HydrophobicContact CB-CB 4.44Å; F377-A414 HydrophobicContact CD1-CB 4.38Å; F377-A414 HydrophobicContact CE1-CB 4.43Å; V412-A414 PolarHBondContact O-N 3.11Å
415	V	87.7	Confident	83.4	Confident	70 Å²	70	81.4 Å²	81.4	42%	0.424	42%	0.418	S	S	.	.			trans	-126.2	152.4	178.7	-66.6	0	0	0	0	109.8	D419 A420	V415-D419 HydrophobicContact CB-CB 4.45Å; V415-A420 HydrophobicContact CG2-CB 4.17Å
416	S	86.4	Confident	82.7	Confident	22 Å²	22	83 Å²	83	15%	0.154	43%	0.427	C	S	.	.			trans	-63.6	160.7	-176.8	78.5	0	0	0	0	111.8	E418 D419 A420	S416-E418 PolarHBondContact O-N 3.24Å; S416-E418 PolarHBondContact OG-N 3.01Å; S416-D419 WeakPolarHBondContact CB-OD2 3.4Å; S416-D419 PolarHBondContact O-N 3.49Å; S416-D419 WeakPolarHBondContact OG-CB 3.11Å; S416-D419 PolarHBondContact OG-N 3.03Å; S416-D419 PolarHBondContact OG-OD2 3.36Å; S416-A420 VanDerWaalsContact O-CB 3.3Å; S416-A420 WeakPolarHBondContact O-CB 3.48Å; S416-A420 PolarHBondContact O-N 3.1Å
417	R	83.4	Confident	81.8	Confident	226 Å²	226	87 Å²	87	85%	0.853	43%	0.425	S	S	*	.	H	α-helix	trans	-56.7	-37.2	174.5	-175.4	174.3	174.1	179.6	-4.8	111.4	L421	R417-L421 VanDerWaalsContact O-CG 3.31Å; R417-L421 WeakPolarHBondContact O-CG 3.45Å; R417-L421 PolarHBondContact O-N 2.97Å
418	E	81.6	Confident	80.3	Confident	128 Å²	128	91.8 Å²	91.8	60%	0.598	45%	0.449	S	S	*	.	H	α-helix	trans	-68.2	-46.4	175.5	-62.5	-179.3	-156.4	0	0	113.1	S416 A420 L421 K422	S416-E418 PolarHBondContact O-N 3.24Å; S416-E418 PolarHBondContact OG-N 3.01Å; E418-A420 VanDerWaalsContact C-N 3.31Å; E418-A420 PolarHBondContact O-N 3.05Å; E418-L421 WeakPolarHBondContact O-CA 3.49Å; E418-L421 WeakPolarHBondContact O-CB 3.4Å; E418-L421 PolarHBondContact O-N 3.41Å; E418-K422 WeakPolarHBondContact O-CG 3.49Å; E418-K422 PolarHBondContact O-N 3.46Å; E418-K422 IonicContact OE2-NZ 2.88Å; E418-K422 PolarHBondContact OE2-NZ 3.18Å; E418-K422 VanDerWaalsContact OE2-NZ 3.09Å
419	D	82	Confident	78.7	Confident	65 Å²	65	97.7 Å²	97.7	35%	0.348	48%	0.475	S	S	.	.	H	α-helix	trans	-71.9	-31.8	-176.6	-57.5	-44.6	0	0	0	111	V415 S416 L421 K422 L423	V415-D419 HydrophobicContact CB-CB 4.45Å; S416-D419 WeakPolarHBondContact CB-OD2 3.4Å; S416-D419 PolarHBondContact O-N 3.49Å; S416-D419 WeakPolarHBondContact OG-CB 3.11Å; S416-D419 PolarHBondContact OG-N 3.03Å; S416-D419 PolarHBondContact OG-OD2 3.36Å; D419-L421 VanDerWaalsContact C-N 3.27Å; D419-L421 PolarHBondContact O-N 2.75Å; D419-K422 PolarHBondContact O-N 2.89Å; D419-K422 WeakPolarHBondContact OD1-CD 3.22Å; D419-K422 IonicContact OD1-NZ 2.8Å; D419-K422 PolarHBondContact OD1-NZ 3.5Å; D419-L423 VanDerWaalsContact O-CB 3.28Å; D419-L423 WeakPolarHBondContact O-CB 3.4Å; D419-L423 VanDerWaalsContact O-CG 3.22Å; D419-L423 WeakPolarHBondContact O-CG 3.13Å; D419-L423 PolarHBondContact O-N 3.08Å
420	A	81.3	Confident	77.2	Confident	46 Å²	46	103.8 Å²	103.8	38%	0.38	51%	0.511	S	S	.	.	H	α-helix	trans	-61.5	-32.5	167.4	0	0	0	0	0	112.9	V415 S416 E418 K424	V415-A420 HydrophobicContact CG2-CB 4.17Å; S416-A420 VanDerWaalsContact O-CB 3.3Å; S416-A420 WeakPolarHBondContact O-CB 3.48Å; S416-A420 PolarHBondContact O-N 3.1Å; E418-A420 VanDerWaalsContact C-N 3.31Å; E418-A420 PolarHBondContact O-N 3.05Å; A420-K424 WeakPolarHBondContact O-CB 3.23Å; A420-K424 PolarHBondContact O-N 3.08Å
421	L	82.4	Confident	75.6	Confident	98 Å²	98	107.1 Å²	107.1	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-74.3	-44.1	173.3	-72.1	167.9	0	0	0	111.6	R417 E418 D419 L423 K424 V425	R417-L421 VanDerWaalsContact O-CG 3.31Å; R417-L421 WeakPolarHBondContact O-CG 3.45Å; R417-L421 PolarHBondContact O-N 2.97Å; E418-L421 WeakPolarHBondContact O-CA 3.49Å; E418-L421 WeakPolarHBondContact O-CB 3.4Å; E418-L421 PolarHBondContact O-N 3.41Å; D419-L421 VanDerWaalsContact C-N 3.27Å; D419-L421 PolarHBondContact O-N 2.75Å; L421-L423 PolarHBondContact O-N 3Å; L421-K424 HydrophobicContact CD2-CD 4.49Å; L421-K424 VanDerWaalsContact O-CB 3.26Å; L421-K424 WeakPolarHBondContact O-CB 3.06Å; L421-K424 PolarHBondContact O-N 3.15Å; L421-V425 PolarHBondContact O-N 3.38Å
422	K	82.1	Confident	73.8	Confident	104 Å²	104	110.9 Å²	110.9	45%	0.452	55%	0.549	S	S	.	.	H	α-helix	trans	-55.6	-52.5	174	-62.8	161.6	-152.3	161	0	109.9	E418 D419 K424 V425	E418-K422 WeakPolarHBondContact O-CG 3.49Å; E418-K422 PolarHBondContact O-N 3.46Å; E418-K422 IonicContact OE2-NZ 2.88Å; E418-K422 PolarHBondContact OE2-NZ 3.18Å; E418-K422 VanDerWaalsContact OE2-NZ 3.09Å; D419-K422 PolarHBondContact O-N 2.89Å; D419-K422 WeakPolarHBondContact OD1-CD 3.22Å; D419-K422 IonicContact OD1-NZ 2.8Å; D419-K422 PolarHBondContact OD1-NZ 3.5Å; K422-K424 PolarHBondContact O-N 3.1Å; K422-K424 VanDerWaalsContact O-N 3.08Å; K422-V425 PolarHBondContact O-N 3.29Å
423	L	77.4	Confident	72.4	Confident	100 Å²	100	110.6 Å²	110.6	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-66.2	-6.6	175.1	-66.6	169.4	0	0	0	115	D419 L421 K427	D419-L423 VanDerWaalsContact O-CB 3.28Å; D419-L423 WeakPolarHBondContact O-CB 3.4Å; D419-L423 VanDerWaalsContact O-CG 3.22Å; D419-L423 WeakPolarHBondContact O-CG 3.13Å; D419-L423 PolarHBondContact O-N 3.08Å; L421-L423 PolarHBondContact O-N 3Å; L423-K427 WeakPolarHBondContact O-CE 3.39Å
424	K	72.5	Confident	71.6	Confident	137 Å²	137	111.5 Å²	111.5	60%	0.596	58%	0.575	S	S	*	*	H	α-helix	trans	-86.1	-29.9	171.8	-170.8	-176.1	175.5	-170.9	0	111.6	A420 L421 K422 K427	A420-K424 WeakPolarHBondContact O-CB 3.23Å; A420-K424 PolarHBondContact O-N 3.08Å; L421-K424 HydrophobicContact CD2-CD 4.49Å; L421-K424 VanDerWaalsContact O-CB 3.26Å; L421-K424 WeakPolarHBondContact O-CB 3.06Å; L421-K424 PolarHBondContact O-N 3.15Å; K422-K424 PolarHBondContact O-N 3.1Å; K422-K424 VanDerWaalsContact O-N 3.08Å; K424-K427 WeakPolarHBondContact O-CB 3.49Å
425	V	69	Low	71.1	Confident	125 Å²	125	113.9 Å²	113.9	76%	0.758	58%	0.583	S	S	*	*	H	α-helix	trans	-71.7	-41.3	179.1	-178.4	0	0	0	0	111.1	L421 K422 K427	L421-V425 PolarHBondContact O-N 3.38Å; K422-V425 PolarHBondContact O-N 3.29Å; V425-K427 PolarHBondContact O-N 3Å
426	D	61.5	Low	71	Confident	130 Å²	130	111 Å²	111	70%	0.695	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-0.1	179	-68	-44.9	0	0	0	114.6	K428	D426-K428 VanDerWaalsContact C-N 3.35Å; D426-K428 PolarHBondContact O-N 3.02Å
427	K	60	Low	71	Confident	148 Å²	148	114.2 Å²	114.2	64%	0.643	58%	0.58	S	S	*	*			trans	-70.9	89.1	177.6	-68.9	-176.6	179.6	178.6	0	110.9	L423 K424 V425 K429	L423-K427 WeakPolarHBondContact O-CE 3.39Å; K424-K427 WeakPolarHBondContact O-CB 3.49Å; V425-K427 PolarHBondContact O-N 3Å; K427-K429 PolarHBondContact O-N 3.24Å
428	K	54.6	Low	70.9	Confident	194 Å²	194	108 Å²	108	84%	0.843	56%	0.557	S	S	*	*			trans	-45.2	115.4	153.8	-72.1	-177.2	-179.6	175.5	0	107.9	D426 V430	D426-K428 VanDerWaalsContact C-N 3.35Å; D426-K428 PolarHBondContact O-N 3.02Å; K428-V430 VanDerWaalsContact C-N 3.34Å; K428-V430 PolarHBondContact O-N 3.49Å
429	K	53.8	Low	71.2	Confident	190 Å²	190	101.9 Å²	101.9	83%	0.826	53%	0.529	S	S	*	.			trans	-64.1	94.5	-178.9	-175.2	175.9	-176.2	173.5	0	108.5	K427 E431	K427-K429 PolarHBondContact O-N 3.24Å; K429-E431 PolarHBondContact O-N 2.95Å
430	V	56.8	Low	71.4	Confident	127 Å²	127	99.6 Å²	99.6	77%	0.77	52%	0.519	S	S	*	.			trans	-54.5	117.5	174.4	179.7	0	0	0	0	107	K428 T432	K428-V430 VanDerWaalsContact C-N 3.34Å; K428-V430 PolarHBondContact O-N 3.49Å; V430-T432 PolarHBondContact O-N 2.89Å
431	E	53.1	Low	71.4	Confident	183 Å²	183	105.6 Å²	105.6	86%	0.855	53%	0.532	S	S	*	.			trans	-61.9	104.9	-175.2	-66.1	-170.9	154.7	0	0	108.7	K429 G433	K429-E431 PolarHBondContact O-N 2.95Å; E431-G433 PolarHBondContact O-N 3.31Å
432	T	53.3	Low	71.5	Confident	85 Å²	85	104 Å²	104	52%	0.521	52%	0.522	S	S	.	.			trans	-63.5	114.7	-175	-43.1	0	0	0	0	107.5	V430 Y438	V430-T432 PolarHBondContact O-N 2.89Å; T432-Y438 HydrophobicContact CG2-CD1 3.55Å; T432-Y438 HydrophobicContact CG2-CE1 3.86Å; T432-Y438 HydrophobicContact CG2-CG 4.43Å
433	G	60.9	Low	71.2	Confident	53 Å²	53	100.2 Å²	100.2	55%	0.546	51%	0.512	S	S	.	.			trans	-48.5	141	-161.2	0	0	0	0	0	113.5	E431 R435 N436	E431-G433 PolarHBondContact O-N 3.31Å; G433-R435 PolarHBondContact O-N 3.01Å; G433-N436 PolarHBondContact O-N 2.85Å
434	S	72.9	Confident	71.5	Confident	106 Å²	106	98.3 Å²	98.3	74%	0.741	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.1	-26	-166.5	56.5	0	0	0	0	116.6	N436	S434-N436 VanDerWaalsContact C-N 3.29Å; S434-N436 PolarHBondContact O-N 3.44Å; S434-N436 PolarHBondContact O-ND2 2.85Å; S434-N436 VanDerWaalsContact O-ND2 3.13Å
435	R	80.6	Confident	72	Confident	55 Å²	55	92.7 Å²	92.7	21%	0.208	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-10.4	177.4	-61.7	-178.8	67.4	-148.4	-5.3	115	G433 L437 L474 D476 I477 V479 F480 V481	G433-R435 PolarHBondContact O-N 3.01Å; R435-L437 HydrophobicContact CB-CD1 3.38Å; R435-L437 PolarHBondContact O-N 3.34Å; R435-L474 PolarHBondContact NH2-O 2.67Å; R435-D476 PolarHBondContact NH2-O 3.26Å; R435-I477 PolarHBondContact NE-O 3.47Å; R435-V479 PolarHBondContact NE-O 3.37Å; R435-V479 PolarHBondContact NH2-O 2.9Å; R435-F480 HydrophobicContact CB-CB 4.28Å; R435-F480 HydrophobicContact CG-CB 4.44Å; R435-V481 PolarHBondContact O-N 2.95Å
436	N	85.9	Confident	72.6	Confident	9 Å²	9	91.2 Å²	91.2	5%	0.048	46%	0.459	C	S	.	.			trans	56	37.3	174.1	-46.7	-57.8	0	0	0	116	G433 S434 Y438 L439 V481 K483	G433-N436 PolarHBondContact O-N 2.85Å; S434-N436 VanDerWaalsContact C-N 3.29Å; S434-N436 PolarHBondContact O-N 3.44Å; S434-N436 PolarHBondContact O-ND2 2.85Å; S434-N436 VanDerWaalsContact O-ND2 3.13Å; N436-Y438 HydrophobicContact CB-CD1 4.46Å; N436-Y438 HydrophobicContact CB-CE1 4.01Å; N436-Y438 PolarHBondContact O-N 3.4Å; N436-L439 HydrophobicContact CB-CD1 4.32Å; N436-L439 PolarHBondContact O-N 2.75Å; N436-V481 HydrophobicContact CB-CB 4.22Å; N436-V481 PolarHBondContact ND2-O 2.96Å; N436-K483 VanDerWaalsContact CG-CE 3.47Å; N436-K483 WeakPolarHBondContact OD1-CE 3.27Å
437	L	84.9	Confident	73.5	Confident	90 Å²	90	89 Å²	89	47%	0.471	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-56.9	-22.2	-172	-81.1	74.1	0	0	0	115.2	R435 L439 A440	R435-L437 HydrophobicContact CB-CD1 3.38Å; R435-L437 PolarHBondContact O-N 3.34Å; L437-L439 VanDerWaalsContact C-N 3.28Å; L437-L439 PolarHBondContact O-N 2.84Å; L437-A440 WeakPolarHBondContact O-CB 3.29Å; L437-A440 PolarHBondContact O-N 3.17Å; L437-A440 VanDerWaalsContact O-N 3.14Å
438	Y	83.2	Confident	74.3	Confident	94 Å²	94	86.2 Å²	86.2	37%	0.369	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-59.3	-40.5	175.1	68.9	-76.9	0	0	0	111.7	T432 N436 A440 R441	T432-Y438 HydrophobicContact CG2-CD1 3.55Å; T432-Y438 HydrophobicContact CG2-CE1 3.86Å; T432-Y438 HydrophobicContact CG2-CG 4.43Å; N436-Y438 HydrophobicContact CB-CD1 4.46Å; N436-Y438 HydrophobicContact CB-CE1 4.01Å; N436-Y438 PolarHBondContact O-N 3.4Å; Y438-A440 PolarHBondContact O-N 2.92Å; Y438-R441 PolarHBondContact O-N 3.23Å; Y438-R441 VanDerWaalsContact O-N 3.11Å
439	L	87.4	Confident	75.6	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.005	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-68.1	-15.4	177.3	-61.8	-177	0	0	0	113.8	N436 L437 R441 E442 V481 K483 F574	N436-L439 HydrophobicContact CB-CD1 4.32Å; N436-L439 PolarHBondContact O-N 2.75Å; L437-L439 VanDerWaalsContact C-N 3.28Å; L437-L439 PolarHBondContact O-N 2.84Å; L439-R441 PolarHBondContact O-N 2.8Å; L439-E442 HydrophobicContact CD2-CG 4.17Å; L439-V481 HydrophobicContact CB-CB 4.37Å; L439-V481 HydrophobicContact CB-CG1 3.69Å; L439-K483 HydrophobicContact CD1-CB 4.32Å; L439-K483 HydrophobicContact CD1-CG 4.09Å; L439-F574 HydrophobicContact CB-CB 4.38Å; L439-F574 HydrophobicContact CB-CD2 3.77Å; L439-F574 HydrophobicContact CB-CE2 4.21Å; L439-F574 HydrophobicContact CB-CG 4.05Å; L439-F574 HydrophobicContact CD1-CD1 4.34Å; L439-F574 HydrophobicContact CD1-CE1 4.4Å; L439-F574 HydrophobicContact CD1-CG 4.45Å; L439-F574 HydrophobicContact CD2-CD2 4.24Å; L439-F574 HydrophobicContact CD2-CE2 3.79Å; L439-F574 HydrophobicContact CD2-CZ 4.04Å; L439-F574 HydrophobicContact CG-CD2 4.42Å; L439-F574 HydrophobicContact CG-CE2 4.42Å; L439-F574 WeakPolarHBondContact O-CD2 3.26Å
440	A	84.8	Confident	76.7	Confident	17 Å²	17	77.5 Å²	77.5	14%	0.14	44%	0.438	C	S	.	.	G	3₁₀ helix	trans	-71.3	-21.9	173.1	0	0	0	0	0	112.9	L437 Y438 K470 L474 V481	L437-A440 WeakPolarHBondContact O-CB 3.29Å; L437-A440 PolarHBondContact O-N 3.17Å; L437-A440 VanDerWaalsContact O-N 3.14Å; Y438-A440 PolarHBondContact O-N 2.92Å; A440-K470 HydrophobicContact CB-CD 4.44Å; A440-L474 HydrophobicContact CB-CD1 3.6Å; A440-V481 HydrophobicContact CB-CG2 3.94Å
441	R	82.4	Confident	77.6	Confident	172 Å²	172	73.6 Å²	73.6	65%	0.649	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-25	179.6	-61.6	-176.3	176.9	-177.2	-0.9	112.9	Y438 L439 G443 L444	Y438-R441 PolarHBondContact O-N 3.23Å; Y438-R441 VanDerWaalsContact O-N 3.11Å; L439-R441 PolarHBondContact O-N 2.8Å; R441-G443 PolarHBondContact O-N 3.03Å; R441-L444 VanDerWaalsContact O-CB 3.32Å; R441-L444 WeakPolarHBondContact O-CB 3.48Å; R441-L444 PolarHBondContact O-N 3.1Å
442	E	83.4	Confident	78.8	Confident	65 Å²	65	65.6 Å²	65.6	30%	0.304	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	134.4	174.2	-65.7	-60.5	146.5	0	0	110.8	L439 L444 F574	L439-E442 HydrophobicContact CD2-CG 4.17Å; E442-L444 VanDerWaalsContact C-N 3.29Å; E442-L444 PolarHBondContact O-N 3.48Å; E442-F574 HydrophobicContact CB-CD2 4.16Å; E442-F574 HydrophobicContact CB-CE2 3.88Å; E442-F574 HydrophobicContact CG-CE2 4.24Å
443	G	77.6	Confident	80	Confident	23 Å²	23	68.7 Å²	68.7	24%	0.237	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-2.1	-178.4	0	0	0	0	0	116.2	R441 N558	R441-G443 PolarHBondContact O-N 3.03Å; G443-N558 WeakPolarHBondContact CA-ND2 3.36Å; G443-N558 PolarHBondContact O-ND2 2.83Å
444	L	83.8	Confident	80.7	Confident	61 Å²	61	69 Å²	69	32%	0.319	40%	0.396	S	S	.	.			trans	-69.9	133.8	175.2	-178.1	62.5	0	0	0	111.4	R441 E442 R446 E467	R441-L444 VanDerWaalsContact O-CB 3.32Å; R441-L444 WeakPolarHBondContact O-CB 3.48Å; R441-L444 PolarHBondContact O-N 3.1Å; E442-L444 VanDerWaalsContact C-N 3.29Å; E442-L444 PolarHBondContact O-N 3.48Å; L444-R446 HydrophobicContact CD2-CG 4.46Å; L444-R446 HydrophobicContact CG-CG 4.48Å; L444-E467 HydrophobicContact CD1-CB 4.3Å; L444-E467 HydrophobicContact CD1-CG 4.13Å; L444-E467 WeakPolarHBondContact CD1-OE2 3.38Å; L444-E467 WeakPolarHBondContact CD2-OE1 3.32Å
445	I	82.5	Confident	81.2	Confident	19 Å²	19	65 Å²	65	10%	0.097	37%	0.366	C	S	.	.			trans	-125.7	110.1	177	-66.1	170.5	0	0	0	108.4	A451 A452 M460 N559	I445-A451 HydrophobicContact CD1-CB 4.22Å; I445-A451 HydrophobicContact CG1-CB 4.09Å; I445-A451 HydrophobicContact CG2-CB 4.01Å; I445-A452 HydrophobicContact CG2-CB 4.01Å; I445-M460 HydrophobicContact CG2-CE 4.47Å; I445-M460 HydrophobicContact CG2-SD 4.46Å; I445-N559 HydrophobicContact CD1-CB 3.54Å
446	R	80.1	Confident	81.4	Confident	94 Å²	94	64.9 Å²	64.9	36%	0.355	37%	0.374	S	S	.	.			trans	-83.9	148.9	177.6	-63	174.6	72.1	-172.5	-0.3	110.1	D342 L444 T449	D342-R446 IonicContact OD1-CZ 3.98Å; D342-R446 IonicContact OD1-NH1 2.67Å; D342-R446 PolarHBondContact OD1-NH1 3.29Å; D342-R446 IonicContact OD1-NH2 2.74Å; D342-R446 PolarHBondContact OD1-NH2 2.91Å; D342-R446 IonicContact OD2-CZ 2.69Å; D342-R446 IonicContact OD2-NH1 2.88Å; D342-R446 IonicContact OD2-NH2 3.89Å; D342-R446 PolarHBondContact OD2-NH2 3.27Å; L444-R446 HydrophobicContact CD2-CG 4.46Å; L444-R446 HydrophobicContact CG-CG 4.48Å; R446-T449 HydrophobicContact CB-CG2 4.08Å; R446-T449 PolarHBondContact O-N 2.78Å; R446-T449 PolarHBondContact O-OG1 2.84Å
447	A	80.9	Confident	81.3	Confident	84 Å²	84	72.6 Å²	72.6	69%	0.694	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	149.7	170.3	0	0	0	0	0	110.7	T449 M460	A447-T449 PolarHBondContact O-N 2.7Å; A447-M460 HydrophobicContact CB-CE 4.13Å
448	G	76.8	Confident	81.3	Confident	88 Å²	88	71.5 Å²	71.5	91%	0.907	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	-14.6	-175.8	0	0	0	0	0	115.5
449	T	82	Confident	81.6	Confident	41 Å²	41	67.2 Å²	67.2	25%	0.252	40%	0.397	S	S	.	.	S	Bend	trans	-76.3	152.4	175.2	64.6	0	0	0	0	112	R446 A447 A451 A452	R446-T449 HydrophobicContact CB-CG2 4.08Å; R446-T449 PolarHBondContact O-N 2.78Å; R446-T449 PolarHBondContact O-OG1 2.84Å; A447-T449 PolarHBondContact O-N 2.7Å; T449-A451 PolarHBondContact O-N 2.87Å; T449-A451 VanDerWaalsContact O-N 3.1Å; T449-A452 WeakPolarHBondContact O-CA 3.26Å; T449-A452 WeakPolarHBondContact O-CB 3.42Å; T449-A452 PolarHBondContact O-N 2.96Å
450	K	77.2	Confident	81.5	Confident	161 Å²	161	68.4 Å²	68.4	70%	0.7	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-54.5	-29.1	172.2	-63.7	-173.4	178.5	-175.2	0	112.7	A452 E453	K450-A452 VanDerWaalsContact C-N 3.28Å; K450-A452 PolarHBondContact O-N 3.16Å; K450-E453 VanDerWaalsContact O-CB 3.23Å; K450-E453 WeakPolarHBondContact O-CB 3.3Å; K450-E453 PolarHBondContact O-N 2.9Å
451	A	75.7	Confident	81.7	Confident	44 Å²	44	69.8 Å²	69.8	36%	0.364	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-72.1	-15.9	174.4	0	0	0	0	0	114.5	I445 T449 N559	I445-A451 HydrophobicContact CD1-CB 4.22Å; I445-A451 HydrophobicContact CG1-CB 4.09Å; I445-A451 HydrophobicContact CG2-CB 4.01Å; T449-A451 PolarHBondContact O-N 2.87Å; T449-A451 VanDerWaalsContact O-N 3.1Å; A451-N559 PolarHBondContact O-ND2 3.31Å
452	A	78.9	Confident	82	Confident	16 Å²	16	64.7 Å²	64.7	13%	0.132	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-88.2	-8.2	170.8	0	0	0	0	0	112.9	I445 T449 K450 V455 M460	I445-A452 HydrophobicContact CG2-CB 4.01Å; T449-A452 WeakPolarHBondContact O-CA 3.26Å; T449-A452 WeakPolarHBondContact O-CB 3.42Å; T449-A452 PolarHBondContact O-N 2.96Å; K450-A452 VanDerWaalsContact C-N 3.28Å; K450-A452 PolarHBondContact O-N 3.16Å; A452-V455 VanDerWaalsContact O-CB 3.29Å; A452-V455 WeakPolarHBondContact O-CB 3.27Å; A452-V455 WeakPolarHBondContact O-CG2 3.4Å; A452-V455 PolarHBondContact O-N 2.82Å; A452-V455 VanDerWaalsContact O-N 3.13Å; A452-M460 HydrophobicContact CB-CE 3.95Å; A452-M460 HydrophobicContact CB-SD 4.01Å
453	E	78.9	Confident	82.3	Confident	149 Å²	149	62.4 Å²	62.4	70%	0.696	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	134.6	178.9	-159.3	175.3	164.9	0	0	111.2	K450 V455	K450-E453 VanDerWaalsContact O-CB 3.23Å; K450-E453 WeakPolarHBondContact O-CB 3.3Å; K450-E453 PolarHBondContact O-N 2.9Å; E453-V455 PolarHBondContact O-N 2.82Å
454	G	75.7	Confident	82.9	Confident	60 Å²	60	64.7 Å²	64.7	62%	0.619	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	14.6	-172.9	0	0	0	0	0	115.1	R569	G454-R569 PolarHBondContact O-NE 2.9Å; G454-R569 PolarHBondContact O-NH2 3.22Å
455	V	81.4	Confident	83.1	Confident	21 Å²	21	70 Å²	70	13%	0.127	41%	0.411	C	S	.	.			trans	-92.3	131.9	171	-175.2	0	0	0	0	109.4	A452 E453 D459 M460 N559	A452-V455 VanDerWaalsContact O-CB 3.29Å; A452-V455 WeakPolarHBondContact O-CB 3.27Å; A452-V455 WeakPolarHBondContact O-CG2 3.4Å; A452-V455 PolarHBondContact O-N 2.82Å; A452-V455 VanDerWaalsContact O-N 3.13Å; E453-V455 PolarHBondContact O-N 2.82Å; V455-D459 HydrophobicContact CG1-CB 3.93Å; V455-M460 HydrophobicContact CB-CG 4.23Å; V455-M460 HydrophobicContact CB-SD 4.09Å; V455-M460 HydrophobicContact CG1-CG 3.79Å; V455-M460 HydrophobicContact CG1-SD 3.71Å; V455-N559 WeakPolarHBondContact CG2-OD1 3.44Å
456	S	84.9	Confident	83.5	Confident	54 Å²	54	72 Å²	72	38%	0.378	42%	0.419	S	S	.	.			trans	-65.2	140.2	176.3	-178	0	0	0	0	111.4	A458 D459 M460	S456-A458 PolarHBondContact O-N 3.1Å; S456-D459 WeakPolarHBondContact O-CA 3.32Å; S456-D459 WeakPolarHBondContact O-CB 3.34Å; S456-D459 PolarHBondContact O-N 2.92Å; S456-M460 PolarHBondContact O-N 3.47Å
457	E	85.1	Confident	83.9	Confident	171 Å²	171	71 Å²	71	80%	0.799	42%	0.418	S	S	*	.	H	α-helix	trans	-48.2	-42.6	172.2	-173	-166.6	173.6	0	0	112	D459 M460 A461	E457-D459 PolarHBondContact O-N 3.17Å; E457-M460 PolarHBondContact O-N 2.95Å; E457-A461 WeakPolarHBondContact O-CB 3.43Å; E457-A461 PolarHBondContact O-N 2.76Å
458	A	85.6	Confident	84.3	Confident	66 Å²	66	72.7 Å²	72.7	55%	0.545	41%	0.412	S	S	.	.	H	α-helix	trans	-67.6	-14.7	178.2	0	0	0	0	0	114	S456 K462	S456-A458 PolarHBondContact O-N 3.1Å; A458-K462 VanDerWaalsContact O-CE 3.26Å; A458-K462 WeakPolarHBondContact O-CE 3.12Å; A458-K462 WeakPolarHBondContact O-CG 3.29Å
459	D	87.6	Confident	85	Confident	4 Å²	4	72 Å²	72	2%	0.021	39%	0.39	C	S	.	.	H	α-helix	trans	-94.3	-40.4	171.8	-154.4	68	0	0	0	111.6	V455 S456 E457 A461 K462 R463 N490	V455-D459 HydrophobicContact CG1-CB 3.93Å; S456-D459 WeakPolarHBondContact O-CA 3.32Å; S456-D459 WeakPolarHBondContact O-CB 3.34Å; S456-D459 PolarHBondContact O-N 2.92Å; E457-D459 PolarHBondContact O-N 3.17Å; D459-A461 VanDerWaalsContact C-N 3.28Å; D459-A461 PolarHBondContact O-N 2.94Å; D459-K462 WeakPolarHBondContact O-CA 3.37Å; D459-K462 WeakPolarHBondContact O-CB 3.44Å; D459-K462 PolarHBondContact O-N 2.92Å; D459-K462 IonicContact OD1-NZ 2.8Å; D459-K462 PolarHBondContact OD1-NZ 3.47Å; D459-R463 WeakPolarHBondContact O-CG 3.45Å; D459-R463 PolarHBondContact O-N 2.68Å; D459-R463 IonicContact OD2-CZ 2.66Å; D459-R463 IonicContact OD2-NE 2.93Å; D459-R463 PolarHBondContact OD2-NE 3.18Å; D459-R463 IonicContact OD2-NH2 2.91Å; D459-R463 PolarHBondContact OD2-NH2 2.98Å; D459-N490 PolarHBondContact OD1-ND2 3.24Å
460	M	87.2	Confident	85.3	Confident	27 Å²	27	71.2 Å²	71.2	13%	0.133	38%	0.383	C	S	.	.	H	α-helix	trans	-56.7	-42.4	169.9	-69.1	-56.9	-64.3	0	0	111.6	I445 A447 A452 V455 S456 E457 K462 R463 V464	I445-M460 HydrophobicContact CG2-CE 4.47Å; I445-M460 HydrophobicContact CG2-SD 4.46Å; A447-M460 HydrophobicContact CB-CE 4.13Å; A452-M460 HydrophobicContact CB-CE 3.95Å; A452-M460 HydrophobicContact CB-SD 4.01Å; V455-M460 HydrophobicContact CB-CG 4.23Å; V455-M460 HydrophobicContact CB-SD 4.09Å; V455-M460 HydrophobicContact CG1-CG 3.79Å; V455-M460 HydrophobicContact CG1-SD 3.71Å; S456-M460 PolarHBondContact O-N 3.47Å; E457-M460 PolarHBondContact O-N 2.95Å; M460-K462 PolarHBondContact O-N 3.43Å; M460-R463 WeakPolarHBondContact O-CB 3.35Å; M460-R463 PolarHBondContact O-N 2.89Å; M460-V464 PolarHBondContact O-N 3.41Å
461	A	88.7	Confident	85.9	Confident	46 Å²	46	72.7 Å²	72.7	38%	0.38	38%	0.384	S	S	.	.	H	α-helix	trans	-62.6	-23.4	174.6	0	0	0	0	0	114	E457 D459 R465	E457-A461 WeakPolarHBondContact O-CB 3.43Å; E457-A461 PolarHBondContact O-N 2.76Å; D459-A461 VanDerWaalsContact C-N 3.28Å; D459-A461 PolarHBondContact O-N 2.94Å; A461-R465 WeakPolarHBondContact O-CD 3.23Å; A461-R465 VanDerWaalsContact O-CG 3.28Å; A461-R465 WeakPolarHBondContact O-CG 3.43Å
462	K	87.8	Confident	86.6	Confident	65 Å²	65	72.8 Å²	72.8	28%	0.283	39%	0.385	S	S	.	.	H	α-helix	trans	-77.4	-44	169.4	-58.8	169	-156.7	152.9	0	110.9	A458 D459 M460 V464 R465 F466 N490 I571	A458-K462 VanDerWaalsContact O-CE 3.26Å; A458-K462 WeakPolarHBondContact O-CE 3.12Å; A458-K462 WeakPolarHBondContact O-CG 3.29Å; D459-K462 WeakPolarHBondContact O-CA 3.37Å; D459-K462 WeakPolarHBondContact O-CB 3.44Å; D459-K462 PolarHBondContact O-N 2.92Å; D459-K462 IonicContact OD1-NZ 2.8Å; D459-K462 PolarHBondContact OD1-NZ 3.47Å; M460-K462 PolarHBondContact O-N 3.43Å; K462-V464 VanDerWaalsContact C-N 3.34Å; K462-V464 PolarHBondContact O-N 2.92Å; K462-R465 PolarHBondContact O-N 3.5Å; K462-R465 VanDerWaalsContact O-N 3.13Å; K462-F466 HydrophobicContact CB-CD2 4.16Å; K462-F466 HydrophobicContact CB-CE2 3.88Å; K462-F466 WeakPolarHBondContact O-CD2 3.28Å; K462-F466 WeakPolarHBondContact O-CG 3.45Å; K462-F466 PolarHBondContact O-N 3.02Å; K462-N490 PolarHBondContact NZ-ND2 3.09Å; K462-N490 PolarHBondContact NZ-OD1 3.32Å; K462-I571 HydrophobicContact CB-CD1 4.26Å
463	R	89.2	Confident	87.1	Confident	16 Å²	16	77.4 Å²	77.4	6%	0.06	40%	0.402	C	S	.	.	H	α-helix	trans	-57.9	-45.9	-178.7	-65.2	170	-165.2	-155.7	-3.5	111	D459 M460 R465 F466 E467 N559 I571	D459-R463 WeakPolarHBondContact O-CG 3.45Å; D459-R463 PolarHBondContact O-N 2.68Å; D459-R463 IonicContact OD2-CZ 2.66Å; D459-R463 IonicContact OD2-NE 2.93Å; D459-R463 PolarHBondContact OD2-NE 3.18Å; D459-R463 IonicContact OD2-NH2 2.91Å; D459-R463 PolarHBondContact OD2-NH2 2.98Å; M460-R463 WeakPolarHBondContact O-CB 3.35Å; M460-R463 PolarHBondContact O-N 2.89Å; R463-R465 PolarHBondContact O-N 3Å; R463-F466 PolarHBondContact O-N 3.41Å; R463-E467 PolarHBondContact O-N 3.03Å; R463-N559 VanDerWaalsContact CZ-OD1 3.28Å; R463-N559 PolarHBondContact NH1-OD1 3.05Å; R463-N559 PolarHBondContact NH2-OD1 3.17Å; R463-I571 HydrophobicContact CG-CD1 3.64Å; R463-I571 HydrophobicContact CG-CG1 4.05Å
464	V	90.1	Very high	87.6	Confident	72 Å²	72	71.7 Å²	71.7	44%	0.436	38%	0.376	S	S	.	.	H	α-helix	trans	-57.8	-48.9	173.3	176.2	0	0	0	0	111.4	M460 K462 F466 E467 E468	M460-V464 PolarHBondContact O-N 3.41Å; K462-V464 VanDerWaalsContact C-N 3.34Å; K462-V464 PolarHBondContact O-N 2.92Å; V464-F466 VanDerWaalsContact C-N 3.35Å; V464-F466 PolarHBondContact O-N 3.47Å; V464-E467 WeakPolarHBondContact O-CB 3.36Å; V464-E467 PolarHBondContact O-N 2.93Å; V464-E467 VanDerWaalsContact O-N 3.13Å; V464-E468 HydrophobicContact CG1-CG 4.42Å; V464-E468 WeakPolarHBondContact O-CG 3.28Å; V464-E468 PolarHBondContact O-N 3.13Å
465	R	89.9	Confident	88.2	Confident	171 Å²	171	78.3 Å²	78.3	65%	0.645	38%	0.382	S	S	*	.	H	α-helix	trans	-62.9	-37.2	178.3	-70.7	172.5	-175.9	-176	3.2	113.4	A461 K462 R463 V469	A461-R465 WeakPolarHBondContact O-CD 3.23Å; A461-R465 VanDerWaalsContact O-CG 3.28Å; A461-R465 WeakPolarHBondContact O-CG 3.43Å; K462-R465 PolarHBondContact O-N 3.5Å; K462-R465 VanDerWaalsContact O-N 3.13Å; R463-R465 PolarHBondContact O-N 3Å; R465-V469 WeakPolarHBondContact O-CB 3.48Å; R465-V469 VanDerWaalsContact O-CG2 3.3Å; R465-V469 WeakPolarHBondContact O-CG2 3.5Å; R465-V469 PolarHBondContact O-N 2.92Å
466	F	89.8	Confident	88.5	Confident	61 Å²	61	80.2 Å²	80.2	27%	0.268	39%	0.392	S	S	.	.	H	α-helix	trans	-67.9	-38.1	174.1	-68.7	-51.8	0	0	0	111.3	K462 R463 V464 K470 H489 I571	K462-F466 HydrophobicContact CB-CD2 4.16Å; K462-F466 HydrophobicContact CB-CE2 3.88Å; K462-F466 WeakPolarHBondContact O-CD2 3.28Å; K462-F466 WeakPolarHBondContact O-CG 3.45Å; K462-F466 PolarHBondContact O-N 3.02Å; R463-F466 PolarHBondContact O-N 3.41Å; V464-F466 VanDerWaalsContact C-N 3.35Å; V464-F466 PolarHBondContact O-N 3.47Å; F466-K470 WeakPolarHBondContact O-CB 3.49Å; F466-K470 PolarHBondContact O-N 3.13Å; F466-H489 AromaticContact CE1-ND1 3.79Å; F466-H489 HydrophobicContact CE2-CB 4.02Å; F466-H489 HydrophobicContact CZ-CB 3.99Å; F466-H489 AromaticContact CZ-CG 3.92Å; F466-H489 AromaticContact CZ-ND1 3.85Å; F466-I571 HydrophobicContact CD2-CD1 4.2Å; F466-I571 HydrophobicContact CD2-CG2 4.44Å; F466-I571 HydrophobicContact CE2-CD1 4.06Å
467	E	88.4	Confident	88.6	Confident	73 Å²	73	84.3 Å²	84.3	34%	0.341	41%	0.408	S	S	.	.	H	α-helix	trans	-63.7	-46.2	172.5	-171.6	-177.7	-175.2	0	0	112.2	L444 R463 V464 V469 K470 R471	L444-E467 HydrophobicContact CD1-CB 4.3Å; L444-E467 HydrophobicContact CD1-CG 4.13Å; L444-E467 WeakPolarHBondContact CD1-OE2 3.38Å; L444-E467 WeakPolarHBondContact CD2-OE1 3.32Å; R463-E467 PolarHBondContact O-N 3.03Å; V464-E467 WeakPolarHBondContact O-CB 3.36Å; V464-E467 PolarHBondContact O-N 2.93Å; V464-E467 VanDerWaalsContact O-N 3.13Å; E467-V469 PolarHBondContact O-N 3.31Å; E467-K470 PolarHBondContact O-N 3.25Å; E467-R471 VanDerWaalsContact O-CB 3.26Å; E467-R471 WeakPolarHBondContact O-CB 3.21Å; E467-R471 PolarHBondContact O-N 2.77Å
468	E	90.1	Very high	88.6	Confident	120 Å²	120	76.9 Å²	76.9	56%	0.561	38%	0.377	S	S	*	.	H	α-helix	trans	-56.2	-49.2	175.3	-72.2	171.6	157.3	0	0	111.4	V464 R471 A472	V464-E468 HydrophobicContact CG1-CG 4.42Å; V464-E468 WeakPolarHBondContact O-CG 3.28Å; V464-E468 PolarHBondContact O-N 3.13Å; E468-R471 PolarHBondContact O-N 2.86Å; E468-A472 VanDerWaalsContact O-CB 3.25Å; E468-A472 WeakPolarHBondContact O-CB 3.34Å; E468-A472 PolarHBondContact O-N 3.22Å
469	V	90.1	Very high	88.9	Confident	74 Å²	74	74.5 Å²	74.5	45%	0.448	36%	0.356	S	S	.	.	H	α-helix	trans	-66.3	-38.3	178.4	170.5	0	0	0	0	111.8	R465 E467 K473	R465-V469 WeakPolarHBondContact O-CB 3.48Å; R465-V469 VanDerWaalsContact O-CG2 3.3Å; R465-V469 WeakPolarHBondContact O-CG2 3.5Å; R465-V469 PolarHBondContact O-N 2.92Å; E467-V469 PolarHBondContact O-N 3.31Å; V469-K473 HydrophobicContact CG1-CD 4.07Å; V469-K473 WeakPolarHBondContact O-CB 3.5Å; V469-K473 VanDerWaalsContact O-CG 3.28Å; V469-K473 WeakPolarHBondContact O-CG 3.37Å; V469-K473 PolarHBondContact O-N 2.84Å
470	K	89.8	Confident	89	Confident	24 Å²	24	76.1 Å²	76.1	10%	0.104	36%	0.363	C	S	.	.	H	α-helix	trans	-63.4	-49.5	174.7	172.9	-176.2	-66.8	167.9	0	111.1	A440 F466 E467 A472 K473 L474 E573 L576	A440-K470 HydrophobicContact CB-CD 4.44Å; F466-K470 WeakPolarHBondContact O-CB 3.49Å; F466-K470 PolarHBondContact O-N 3.13Å; E467-K470 PolarHBondContact O-N 3.25Å; K470-A472 PolarHBondContact O-N 3.14Å; K470-K473 PolarHBondContact O-N 2.94Å; K470-L474 HydrophobicContact CG-CD1 3.87Å; K470-L474 WeakPolarHBondContact O-CB 3.46Å; K470-L474 WeakPolarHBondContact O-CG 3.29Å; K470-L474 PolarHBondContact O-N 2.98Å; K470-E573 WeakPolarHBondContact CE-OE2 3.42Å; K470-E573 IonicContact NZ-OE2 2.69Å; K470-E573 PolarHBondContact NZ-OE2 2.82Å; K470-L576 HydrophobicContact CB-CD1 4.43Å; K470-L576 HydrophobicContact CG-CD1 4.2Å
471	R	89.3	Confident	89.3	Confident	193 Å²	193	74.9 Å²	74.9	73%	0.728	36%	0.356	S	S	*	.	H	α-helix	trans	-62.5	-41.6	177.7	-175.2	175.8	177.8	179.7	-1.9	111.3	E467 E468 L474 R475	E467-R471 VanDerWaalsContact O-CB 3.26Å; E467-R471 WeakPolarHBondContact O-CB 3.21Å; E467-R471 PolarHBondContact O-N 2.77Å; E468-R471 PolarHBondContact O-N 2.86Å; R471-L474 PolarHBondContact O-N 2.79Å; R471-R475 PolarHBondContact O-N 2.87Å
472	A	91.1	Very high	89.3	Confident	45 Å²	45	72.9 Å²	72.9	37%	0.372	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-45	176.1	0	0	0	0	0	112.1	E468 K470 R475	E468-A472 VanDerWaalsContact O-CB 3.25Å; E468-A472 WeakPolarHBondContact O-CB 3.34Å; E468-A472 PolarHBondContact O-N 3.22Å; K470-A472 PolarHBondContact O-N 3.14Å; A472-R475 WeakPolarHBondContact O-CB 3.35Å; A472-R475 PolarHBondContact O-N 3.11Å; A472-R475 PolarHBondContact O-NE 3.45Å
473	K	88.9	Confident	89.5	Confident	114 Å²	114	74.4 Å²	74.4	50%	0.496	35%	0.347	S	S	.	.	H	α-helix	trans	-68.2	-37.9	177.2	-73.3	169.6	179.2	174.8	0	113.2	V469 K470 R475 D476 L576	V469-K473 HydrophobicContact CG1-CD 4.07Å; V469-K473 WeakPolarHBondContact O-CB 3.5Å; V469-K473 VanDerWaalsContact O-CG 3.28Å; V469-K473 WeakPolarHBondContact O-CG 3.37Å; V469-K473 PolarHBondContact O-N 2.84Å; K470-K473 PolarHBondContact O-N 2.94Å; K473-R475 PolarHBondContact O-N 3.02Å; K473-D476 PolarHBondContact O-N 3.42Å; K473-D476 VanDerWaalsContact O-N 3.16Å; K473-L576 HydrophobicContact CB-CD1 3.75Å; K473-L576 HydrophobicContact CD-CD1 3.93Å
474	L	89.9	Confident	89.7	Confident	29 Å²	29	75.5 Å²	75.5	15%	0.152	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.3	178.4	-76.2	169.6	0	0	0	114.2	R435 A440 K470 R471 V479 V481 L576	R435-L474 PolarHBondContact NH2-O 2.67Å; A440-L474 HydrophobicContact CB-CD1 3.6Å; K470-L474 HydrophobicContact CG-CD1 3.87Å; K470-L474 WeakPolarHBondContact O-CB 3.46Å; K470-L474 WeakPolarHBondContact O-CG 3.29Å; K470-L474 PolarHBondContact O-N 2.98Å; R471-L474 PolarHBondContact O-N 2.79Å; L474-V479 HydrophobicContact CD2-CG1 4.5Å; L474-V481 HydrophobicContact CD2-CG2 4.06Å; L474-L576 HydrophobicContact CD1-CD2 4.3Å; L474-L576 HydrophobicContact CD2-CD2 3.75Å; L474-L576 HydrophobicContact CG-CD1 4.39Å; L474-L576 HydrophobicContact CG-CD2 3.99Å
475	R	88.3	Confident	89.8	Confident	199 Å²	199	73.4 Å²	73.4	75%	0.751	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-33.7	167.5	-66.2	-175.1	-66.3	-176.8	1	112.5	R471 A472 K473 I477	R471-R475 PolarHBondContact O-N 2.87Å; A472-R475 WeakPolarHBondContact O-CB 3.35Å; A472-R475 PolarHBondContact O-N 3.11Å; A472-R475 PolarHBondContact O-NE 3.45Å; K473-R475 PolarHBondContact O-N 3.02Å; R475-I477 PolarHBondContact O-N 2.97Å
476	D	88.1	Confident	90	Very high	60 Å²	60	65.3 Å²	65.3	32%	0.321	31%	0.307	S	S	.	.	S	Bend	trans	-70.3	121.1	175.8	-178.2	-6.7	0	0	0	110.2	R435 K473 G478 V479 R580	R435-D476 PolarHBondContact NH2-O 3.26Å; K473-D476 PolarHBondContact O-N 3.42Å; K473-D476 VanDerWaalsContact O-N 3.16Å; D476-G478 PolarHBondContact O-N 3.16Å; D476-G478 PolarHBondContact OD1-N 2.9Å; D476-V479 HydrophobicContact CB-CB 4.45Å; D476-V479 HydrophobicContact CB-CG2 3.93Å; D476-V479 PolarHBondContact O-N 2.6Å; D476-V479 VanDerWaalsContact O-N 3.08Å; D476-R580 IonicContact OD2-CZ 3.74Å; D476-R580 IonicContact OD2-NH1 3.76Å; D476-R580 IonicContact OD2-NH2 3.2Å; D476-R580 PolarHBondContact OD2-NH2 2.97Å
477	I	86.3	Confident	90.1	Very high	141 Å²	141	62.6 Å²	62.6	72%	0.723	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.1	178.9	-59.5	172.1	0	0	0	111.4	R435 R475 V479	R435-I477 PolarHBondContact NE-O 3.47Å; R475-I477 PolarHBondContact O-N 2.97Å; I477-V479 PolarHBondContact O-N 2.95Å
478	G	85.9	Confident	90.3	Very high	15 Å²	15	59.2 Å²	59.2	16%	0.155	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-15.7	178.3	0	0	0	0	0	114.5	D476 S579	D476-G478 PolarHBondContact O-N 3.16Å; D476-G478 PolarHBondContact OD1-N 2.9Å; G478-S579 PolarHBondContact O-N 2.91Å; G478-S579 PolarHBondContact O-OG 3.04Å
479	V	90.2	Very high	90.3	Very high	15 Å²	15	55.2 Å²	55.2	9%	0.091	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	132.4	178.6	179	0	0	0	0	111.1	R435 L474 D476 I477 L576 E577 D578	R435-V479 PolarHBondContact NE-O 3.37Å; R435-V479 PolarHBondContact NH2-O 2.9Å; L474-V479 HydrophobicContact CD2-CG1 4.5Å; D476-V479 HydrophobicContact CB-CB 4.45Å; D476-V479 HydrophobicContact CB-CG2 3.93Å; D476-V479 PolarHBondContact O-N 2.6Å; D476-V479 VanDerWaalsContact O-N 3.08Å; I477-V479 PolarHBondContact O-N 2.95Å; V479-L576 HydrophobicContact CG1-CB 4.14Å; V479-E577 WeakPolarHBondContact CA-O 3.42Å; V479-D578 HydrophobicContact CG2-CB 4.43Å
480	F	91.4	Very high	90.2	Very high	39 Å²	39	52.9 Å²	52.9	17%	0.171	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	165.2	177.3	67.7	-83.5	0	0	0	111.7	R435 E577 L582	R435-F480 HydrophobicContact CB-CB 4.28Å; R435-F480 HydrophobicContact CG-CB 4.44Å; F480-E577 HydrophobicContact CD1-CB 4.42Å; F480-E577 WeakPolarHBondContact CD1-O 3.42Å; F480-E577 HydrophobicContact CE1-CB 3.75Å; F480-E577 WeakPolarHBondContact CE1-O 3.12Å; F480-E577 HydrophobicContact CE2-CB 4Å; F480-E577 HydrophobicContact CZ-CB 3.5Å; F480-E577 VanDerWaalsContact CZ-CB 3.5Å; F480-E577 PolarHBondContact N-O 2.58Å; F480-E577 PolarHBondContact O-N 2.93Å; F480-L582 HydrophobicContact CE1-CD1 4.4Å; F480-L582 HydrophobicContact CZ-CD1 3.79Å
481	V	91.5	Very high	90.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	126.3	173.1	-168.4	0	0	0	0	109.7	R435 N436 L439 A440 L474 F574 L576	R435-V481 PolarHBondContact O-N 2.95Å; N436-V481 HydrophobicContact CB-CB 4.22Å; N436-V481 PolarHBondContact ND2-O 2.96Å; L439-V481 HydrophobicContact CB-CB 4.37Å; L439-V481 HydrophobicContact CB-CG1 3.69Å; A440-V481 HydrophobicContact CB-CG2 3.94Å; L474-V481 HydrophobicContact CD2-CG2 4.06Å; V481-F574 HydrophobicContact CG1-CB 3.4Å; V481-F574 HydrophobicContact CG1-CG 4.34Å; V481-L576 HydrophobicContact CG2-CD2 3.97Å
482	S	90.7	Very high	90	Very high	4 Å²	4	44 Å²	44	3%	0.028	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	128.6	176.9	-46.8	0	0	0	0	110.9	F574 S575 E577	S482-F574 VanDerWaalsContact O-CD1 3.27Å; S482-F574 WeakPolarHBondContact O-CD1 3.14Å; S482-S575 PolarHBondContact N-O 3.04Å; S482-S575 PolarHBondContact OG-O 2.66Å; S482-E577 VanDerWaalsContact OG-CG 3.29Å; S482-E577 WeakPolarHBondContact OG-CG 3.37Å; S482-E577 PolarHBondContact OG-OE2 2.91Å
483	K	90.9	Very high	89.8	Confident	98 Å²	98	48.3 Å²	48.3	43%	0.426	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-36.5	179.2	-66.6	179.6	-178.5	176.4	0	113.7	N436 L439 H547 F574	N436-K483 VanDerWaalsContact CG-CE 3.47Å; N436-K483 WeakPolarHBondContact OD1-CE 3.27Å; L439-K483 HydrophobicContact CD1-CB 4.32Å; L439-K483 HydrophobicContact CD1-CG 4.09Å; K483-H547 PolarHBondContact O-ND1 3.18Å; K483-F574 VanDerWaalsContact O-CE1 3.23Å; K483-F574 WeakPolarHBondContact O-CE1 3.43Å
484	N	92.8	Very high	89.6	Confident	38 Å²	38	46.7 Å²	46.7	20%	0.203	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	9.7	-167.6	-51.2	25.8	0	0	0	112.1	Q543 F544 R545 H547	N484-Q543 PolarHBondContact O-NE2 3.2Å; N484-F544 WeakPolarHBondContact CB-O 3.37Å; N484-F544 PolarHBondContact O-N 2.85Å; N484-R545 PolarHBondContact ND2-O 2.68Å; N484-H547 PolarHBondContact ND2-N 2.87Å
485	R	93.3	Very high	89.5	Confident	29 Å²	29	46 Å²	46	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.4	-177.5	-159.7	179.4	178.5	-154	-10.4	110.8	V542 Q543 F574 S575 E577	R485-V542 CarbonylContact C-O 3.46Å; R485-V542 WeakPolarHBondContact CA-O 3.27Å; R485-Q543 VanDerWaalsContact CB-OE1 3.25Å; R485-Q543 VanDerWaalsContact CD-OE1 3.32Å; R485-Q543 HydrophobicContact CG-CB 4.38Å; R485-Q543 VanDerWaalsContact CG-OE1 3.26Å; R485-F574 WeakPolarHBondContact O-CA 3.37Å; R485-S575 PolarHBondContact O-N 2.9Å; R485-E577 VanDerWaalsContact CD-OE1 3.3Å; R485-E577 WeakPolarHBondContact CD-OE1 3.13Å; R485-E577 IonicContact CZ-OE1 2.98Å; R485-E577 IonicContact NE-OE1 2.74Å; R485-E577 IonicContact NH1-OE1 2.68Å; R485-E577 PolarHBondContact NH1-OE1 3.18Å
486	L	93.2	Very high	89.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	144.8	174.6	-54.8	-177.3	0	0	0	110.6	F541 V542 F544 A550 T553 L554 V572 E573 F574	L486-F541 WeakPolarHBondContact O-CA 3.38Å; L486-V542 PolarHBondContact N-O 2.96Å; L486-V542 PolarHBondContact O-N 3.32Å; L486-F544 HydrophobicContact CD1-CE2 3.83Å; L486-F544 HydrophobicContact CG-CE2 4.15Å; L486-A550 WeakPolarHBondContact CD1-O 3.49Å; L486-A550 HydrophobicContact CD2-CB 4.29Å; L486-A550 HydrophobicContact CG-CB 4.38Å; L486-T553 HydrophobicContact CD1-CG2 4.04Å; L486-L554 HydrophobicContact CD1-CB 4.29Å; L486-L554 HydrophobicContact CD2-CB 4.25Å; L486-L554 HydrophobicContact CD2-CD1 4.13Å; L486-V572 HydrophobicContact CB-CG1 4.25Å; L486-V572 HydrophobicContact CD1-CG1 3.95Å; L486-V572 HydrophobicContact CG-CG1 4.48Å; L486-E573 CarbonylContact C-O 3.57Å; L486-E573 WeakPolarHBondContact CA-O 3.19Å; L486-F574 HydrophobicContact CD2-CD1 3.64Å; L486-F574 HydrophobicContact CD2-CE1 3.67Å; L486-F574 HydrophobicContact CD2-CG 4.15Å; L486-F574 HydrophobicContact CD2-CZ 4.22Å
487	C	92.9	Very high	89.6	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.034	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.8	159.7	-167.2	0	0	0	0	107.8	F541 E573	C487-F541 HydrophobicContact CB-CD1 4.11Å; C487-F541 HydrophobicContact CB-CE1 4.02Å; C487-E573 HydrophobicContact CB-CG 3.98Å; C487-E573 PolarHBondContact N-O 3.47Å; C487-E573 PolarHBondContact O-N 2.77Å
488	I	91.9	Very high	89.8	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	120.2	178.6	-55.4	174.4	0	0	0	106.3	L491 L500 Y539 G540 V542 L557 V572	I488-L491 HydrophobicContact CB-CD1 4.01Å; I488-L491 HydrophobicContact CG2-CD1 3.49Å; I488-L491 VanDerWaalsContact CG2-CD1 3.49Å; I488-L491 WeakPolarHBondContact O-CD1 3.44Å; I488-L500 HydrophobicContact CD1-CD1 3.84Å; I488-L500 HydrophobicContact CD1-CG 4.48Å; I488-L500 HydrophobicContact CG2-CD1 4.49Å; I488-Y539 CarbonylContact O-C 3.55Å; I488-Y539 VanDerWaalsContact O-CA 3.23Å; I488-Y539 WeakPolarHBondContact O-CA 3.23Å; I488-G540 PolarHBondContact N-O 3.21Å; I488-G540 PolarHBondContact O-N 3.34Å; I488-V542 HydrophobicContact CD1-CG2 3.72Å; I488-L557 HydrophobicContact CD1-CD1 3.77Å; I488-V572 HydrophobicContact CG1-CG1 4.14Å; I488-V572 HydrophobicContact CG1-CG2 4.17Å; I488-V572 HydrophobicContact CG2-CG2 4.11Å
489	H	89.8	Confident	90	Very high	35 Å²	35	45.2 Å²	45.2	16%	0.162	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	170.2	178.4	-61.1	-82	0	0	0	111.2	F466 L491 I571 E573	F466-H489 AromaticContact CE1-ND1 3.79Å; F466-H489 HydrophobicContact CE2-CB 4.02Å; F466-H489 HydrophobicContact CZ-CB 3.99Å; F466-H489 AromaticContact CZ-CG 3.92Å; F466-H489 AromaticContact CZ-ND1 3.85Å; H489-L491 VanDerWaalsContact C-N 3.32Å; H489-L491 PolarHBondContact O-N 2.92Å; H489-I571 HydrophobicContact CB-CB 4.28Å; H489-I571 PolarHBondContact N-O 3.02Å; H489-I571 PolarHBondContact O-N 2.95Å; H489-E573 IonicContact CD2-OE1 3.91Å; H489-E573 WeakPolarHBondContact NE2-CG 3.49Å; H489-E573 CovalentContact NE2-OE1 1.78Å; H489-E573 IonicContact NE2-OE1 2.72Å; H489-E573 PolarHBondContact NE2-OE1 2.76Å; H489-E573 IonicContact NE2-OE2 2.63Å; H489-E573 PolarHBondContact NE2-OE2 3.08Å
490	N	87.7	Confident	90	Very high	26 Å²	26	44.6 Å²	44.6	14%	0.139	22%	0.217	C	C	.	.	S	Bend	trans	71.5	18	177.5	-142.3	28.6	0	0	0	114.6	D459 K462 G538 R569	D459-N490 PolarHBondContact OD1-ND2 3.24Å; K462-N490 PolarHBondContact NZ-ND2 3.09Å; K462-N490 PolarHBondContact NZ-OD1 3.32Å; N490-G538 PolarHBondContact N-O 2.82Å; N490-R569 PolarHBondContact ND2-O 3.15Å
491	L	88.6	Confident	89.9	Confident	9 Å²	9	47.3 Å²	47.3	5%	0.047	23%	0.229	C	C	.	.			trans	-61.4	136.3	179.2	-79.8	68	0	0	0	111.2	I488 H489 V495 L500 V521 G538 F564	I488-L491 HydrophobicContact CB-CD1 4.01Å; I488-L491 HydrophobicContact CG2-CD1 3.49Å; I488-L491 VanDerWaalsContact CG2-CD1 3.49Å; I488-L491 WeakPolarHBondContact O-CD1 3.44Å; H489-L491 VanDerWaalsContact C-N 3.32Å; H489-L491 PolarHBondContact O-N 2.92Å; L491-V495 HydrophobicContact CD2-CG1 4.18Å; L491-L500 HydrophobicContact CD2-CD1 4.02Å; L491-L500 HydrophobicContact CD2-CD2 4.16Å; L491-V521 HydrophobicContact CD2-CG2 4Å; L491-G538 PolarHBondContact N-O 3.08Å; L491-G538 WeakPolarHBondContact O-CA 3.21Å; L491-F564 HydrophobicContact CG-CE2 4.35Å; L491-F564 HydrophobicContact CG-CZ 4.15Å
492	P	86.8	Confident	89.8	Confident	22 Å²	22	49.9 Å²	49.9	14%	0.143	25%	0.25	C	C	.	.			trans	-59.9	142.5	163.7	-20.5	31.2	0	0	0	111.6	S494 V495 F564	P492-S494 PolarHBondContact O-N 2.81Å; P492-V495 HydrophobicContact CB-CG2 4.13Å; P492-V495 HydrophobicContact CG-CG2 4.14Å; P492-V495 WeakPolarHBondContact O-CB 3.37Å; P492-V495 PolarHBondContact O-N 3.27Å; P492-F564 VanDerWaalsContact CD-CD1 3.49Å; P492-F564 HydrophobicContact CG-CB 4.09Å; P492-F564 HydrophobicContact CG-CD1 3.64Å; P492-F564 HydrophobicContact CG-CD2 4.38Å; P492-F564 HydrophobicContact CG-CE1 4.19Å; P492-F564 HydrophobicContact CG-CG 3.79Å
493	K	86	Confident	89.7	Confident	135 Å²	135	52.2 Å²	52.2	59%	0.587	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-12.1	178.6	-64.4	-177.3	-179.6	177.7	0	114.6	Q535	K493-Q535 HydrophobicContact CD-CG 4.1Å; K493-Q535 VanDerWaalsContact NZ-CD 3.3Å
494	S	84.9	Confident	89.6	Confident	80 Å²	80	47.5 Å²	47.5	56%	0.559	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	3.9	177.9	51.8	0	0	0	0	114.2	P492 K499	P492-S494 PolarHBondContact O-N 2.81Å; S494-K499 WeakPolarHBondContact O-CD 3.35Å; S494-K499 PolarHBondContact O-NZ 2.89Å
495	V	87.6	Confident	89.3	Confident	15 Å²	15	49.2 Å²	49.2	9%	0.091	25%	0.249	C	C	.	.			trans	-98.4	109.3	178.1	178.5	0	0	0	0	110	L491 P492 K499 L500 F564	L491-V495 HydrophobicContact CD2-CG1 4.18Å; P492-V495 HydrophobicContact CB-CG2 4.13Å; P492-V495 HydrophobicContact CG-CG2 4.14Å; P492-V495 WeakPolarHBondContact O-CB 3.37Å; P492-V495 PolarHBondContact O-N 3.27Å; V495-K499 HydrophobicContact CG1-CB 4.05Å; V495-L500 HydrophobicContact CG1-CB 4.23Å; V495-F564 HydrophobicContact CG2-CD1 4.45Å; V495-F564 HydrophobicContact CG2-CE1 3.81Å; V495-F564 HydrophobicContact CG2-CZ 4.46Å
496	D	89.1	Confident	88.9	Confident	66 Å²	66	52.7 Å²	52.7	35%	0.353	27%	0.265	S	S	.	.			trans	-90.4	167.9	176.3	-45	-74.4	0	0	0	111.9	K498 K499 L500	D496-K498 PolarHBondContact O-N 3.07Å; D496-K498 VanDerWaalsContact O-N 3.13Å; D496-K499 WeakPolarHBondContact O-CA 3.34Å; D496-K499 WeakPolarHBondContact O-CB 3.38Å; D496-K499 PolarHBondContact O-N 2.79Å; D496-K499 WeakPolarHBondContact OD2-CE 3.32Å; D496-K499 IonicContact OD2-NZ 2.62Å; D496-K499 PolarHBondContact OD2-NZ 2.76Å; D496-L500 PolarHBondContact O-N 2.86Å
497	D	90.3	Very high	88.1	Confident	39 Å²	39	53.4 Å²	53.4	21%	0.209	27%	0.272	C	S	.	.	H	α-helix	trans	-45.8	-45.6	177.4	-49.7	-58.1	0	0	0	113	L500 K501 V521 K533	D497-L500 PolarHBondContact O-N 3.45Å; D497-K501 WeakPolarHBondContact O-CB 3.21Å; D497-K501 PolarHBondContact O-N 3.46Å; D497-V521 PolarHBondContact OD1-N 2.89Å; D497-K533 IonicContact OD2-NZ 2.72Å; D497-K533 PolarHBondContact OD2-NZ 3.1Å
498	K	90.4	Very high	87.5	Confident	187 Å²	187	53.6 Å²	53.6	81%	0.813	27%	0.273	S	S	*	.	H	α-helix	trans	-65.4	-39.2	179	-65.4	-175.9	178.1	-177.5	0	112.7	D496 A502	D496-K498 PolarHBondContact O-N 3.07Å; D496-K498 VanDerWaalsContact O-N 3.13Å; K498-A502 PolarHBondContact O-N 2.72Å; K498-A502 VanDerWaalsContact O-N 3.12Å
499	K	89.8	Confident	86.3	Confident	105 Å²	105	60.7 Å²	60.7	46%	0.457	31%	0.306	S	S	.	.	H	α-helix	trans	-71.4	-42.8	178	-68	168.3	-177.8	149.5	0	110.7	S494 V495 D496 K501 A502 M503	S494-K499 WeakPolarHBondContact O-CD 3.35Å; S494-K499 PolarHBondContact O-NZ 2.89Å; V495-K499 HydrophobicContact CG1-CB 4.05Å; D496-K499 WeakPolarHBondContact O-CA 3.34Å; D496-K499 WeakPolarHBondContact O-CB 3.38Å; D496-K499 PolarHBondContact O-N 2.79Å; D496-K499 WeakPolarHBondContact OD2-CE 3.32Å; D496-K499 IonicContact OD2-NZ 2.62Å; D496-K499 PolarHBondContact OD2-NZ 2.76Å; K499-K501 PolarHBondContact O-N 2.77Å; K499-A502 WeakPolarHBondContact O-CB 3.13Å; K499-A502 PolarHBondContact O-N 2.92Å; K499-M503 WeakPolarHBondContact O-CG 3.25Å; K499-M503 PolarHBondContact O-N 3.1Å
500	L	90.5	Very high	84.9	Confident	3 Å²	3	63 Å²	63	2%	0.016	34%	0.339	C	S	.	.	H	α-helix	trans	-59.4	-46.5	175.9	-173.2	62.3	0	0	0	111.1	I488 L491 V495 D496 D497 A502 M503 C504 V521 V542	I488-L500 HydrophobicContact CD1-CD1 3.84Å; I488-L500 HydrophobicContact CD1-CG 4.48Å; I488-L500 HydrophobicContact CG2-CD1 4.49Å; L491-L500 HydrophobicContact CD2-CD1 4.02Å; L491-L500 HydrophobicContact CD2-CD2 4.16Å; V495-L500 HydrophobicContact CG1-CB 4.23Å; D496-L500 PolarHBondContact O-N 2.86Å; D497-L500 PolarHBondContact O-N 3.45Å; L500-A502 VanDerWaalsContact C-N 3.31Å; L500-A502 PolarHBondContact O-N 3.26Å; L500-M503 PolarHBondContact O-N 2.85Å; L500-C504 PolarHBondContact O-N 2.98Å; L500-C504 VanDerWaalsContact O-N 3.07Å; L500-C504 PolarHBondContact O-SG 3.23Å; L500-C504 VanDerWaalsContact O-SG 3.36Å; L500-V521 HydrophobicContact CB-CG2 4.33Å; L500-V521 HydrophobicContact CD2-CG2 3.94Å; L500-V542 HydrophobicContact CD2-CG2 3.99Å; L500-V542 HydrophobicContact CG-CG2 4.23Å
501	K	90.1	Very high	83.9	Confident	96 Å²	96	65 Å²	65	42%	0.417	35%	0.352	S	S	.	.	H	α-helix	trans	-57.6	-42.8	174.8	-168	176.4	-179.8	178.6	0	111.9	D497 K499 C504 L505 I516 C519	D497-K501 WeakPolarHBondContact O-CB 3.21Å; D497-K501 PolarHBondContact O-N 3.46Å; K499-K501 PolarHBondContact O-N 2.77Å; K501-C504 PolarHBondContact O-N 3.29Å; K501-L505 HydrophobicContact CG-CD1 4.2Å; K501-L505 VanDerWaalsContact O-CG 3.29Å; K501-L505 WeakPolarHBondContact O-CG 3.24Å; K501-L505 PolarHBondContact O-N 2.84Å; K501-I516 HydrophobicContact CG-CD1 3.98Å; K501-C519 HydrophobicContact CB-CB 4.46Å
502	A	89.2	Confident	82.3	Confident	54 Å²	54	75 Å²	75	45%	0.446	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-40.1	177.2	0	0	0	0	0	113.1	K498 K499 L500 L505 K506	K498-A502 PolarHBondContact O-N 2.72Å; K498-A502 VanDerWaalsContact O-N 3.12Å; K499-A502 WeakPolarHBondContact O-CB 3.13Å; K499-A502 PolarHBondContact O-N 2.92Å; L500-A502 VanDerWaalsContact C-N 3.31Å; L500-A502 PolarHBondContact O-N 3.26Å; A502-L505 PolarHBondContact O-N 2.8Å; A502-K506 PolarHBondContact O-N 3.41Å
503	M	87.7	Confident	81.3	Confident	52 Å²	52	76.8 Å²	76.8	26%	0.256	42%	0.418	S	S	.	.	H	α-helix	trans	-66.5	-39.9	176.1	-60.9	-53.8	-81.7	0	0	112.1	K499 L500 K506 G507 L557 I563	K499-M503 WeakPolarHBondContact O-CG 3.25Å; K499-M503 PolarHBondContact O-N 3.1Å; L500-M503 PolarHBondContact O-N 2.85Å; M503-K506 PolarHBondContact O-N 2.84Å; M503-G507 PolarHBondContact O-N 3Å; M503-L557 HydrophobicContact CB-CD2 4.44Å; M503-I563 HydrophobicContact CE-CB 4.05Å; M503-I563 HydrophobicContact CE-CG1 3.96Å; M503-I563 HydrophobicContact CE-CG2 3.75Å
504	C	88.1	Confident	80.9	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-63.6	-39.5	173.2	-63.2	0	0	0	0	112.3	L500 K501 G507 I516 F544 T553	L500-C504 PolarHBondContact O-N 2.98Å; L500-C504 VanDerWaalsContact O-N 3.07Å; L500-C504 PolarHBondContact O-SG 3.23Å; L500-C504 VanDerWaalsContact O-SG 3.36Å; K501-C504 PolarHBondContact O-N 3.29Å; C504-G507 PolarHBondContact O-N 3.46Å; C504-I516 HydrophobicContact CB-CD1 4.04Å; C504-F544 HydrophobicContact CB-CZ 4.37Å; C504-T553 HydrophobicContact CB-CG2 4.16Å
505	L	87.4	Confident	80.7	Confident	73 Å²	73	76 Å²	76	38%	0.382	40%	0.403	S	S	.	.	H	α-helix	trans	-67.5	-36.2	175.5	-70.8	170.2	0	0	0	112.3	K501 A502 G507 L508 Q509 V514 I516	K501-L505 HydrophobicContact CG-CD1 4.2Å; K501-L505 VanDerWaalsContact O-CG 3.29Å; K501-L505 WeakPolarHBondContact O-CG 3.24Å; K501-L505 PolarHBondContact O-N 2.84Å; A502-L505 PolarHBondContact O-N 2.8Å; L505-G507 VanDerWaalsContact C-N 3.29Å; L505-G507 PolarHBondContact O-N 3.06Å; L505-L508 PolarHBondContact O-N 2.98Å; L505-L508 VanDerWaalsContact O-N 3.1Å; L505-Q509 PolarHBondContact O-N 2.91Å; L505-V514 HydrophobicContact CD2-CB 4.4Å; L505-V514 HydrophobicContact CD2-CG1 3.77Å; L505-I516 HydrophobicContact CD2-CD1 3.94Å; L505-I516 HydrophobicContact CG-CD1 4Å
506	K	84.9	Confident	80.7	Confident	103 Å²	103	76.5 Å²	76.5	45%	0.448	41%	0.405	S	S	.	.	H	α-helix	trans	-59.3	-41.9	174.2	-167	-174.2	178	-171	0	111.4	A502 M503 L508 Q509	A502-K506 PolarHBondContact O-N 3.41Å; M503-K506 PolarHBondContact O-N 2.84Å; K506-L508 PolarHBondContact O-N 3.36Å; K506-L508 VanDerWaalsContact O-N 3.15Å; K506-Q509 WeakPolarHBondContact O-CB 3.22Å; K506-Q509 WeakPolarHBondContact O-CG 3.25Å; K506-Q509 PolarHBondContact O-N 3.26Å
507	G	76.9	Confident	80.7	Confident	14 Å²	14	77.7 Å²	77.7	14%	0.144	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-0.6	176.1	0	0	0	0	0	116.3	M503 C504 L505 Y556	M503-G507 PolarHBondContact O-N 3Å; C504-G507 PolarHBondContact O-N 3.46Å; L505-G507 VanDerWaalsContact C-N 3.29Å; L505-G507 PolarHBondContact O-N 3.06Å; G507-Y556 VanDerWaalsContact CA-CE1 3.47Å
508	L	80.1	Confident	80.7	Confident	9 Å²	9	78.8 Å²	78.8	5%	0.047	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	9.7	178.6	-66.7	176.1	0	0	0	112.8	L505 K506 G510 T511 V514 F544 L549 A552 T553	L505-L508 PolarHBondContact O-N 2.98Å; L505-L508 VanDerWaalsContact O-N 3.1Å; K506-L508 PolarHBondContact O-N 3.36Å; K506-L508 VanDerWaalsContact O-N 3.15Å; L508-G510 PolarHBondContact O-N 3.35Å; L508-G510 VanDerWaalsContact O-N 3.12Å; L508-T511 PolarHBondContact O-N 3.14Å; L508-T511 PolarHBondContact O-OG1 3.07Å; L508-V514 HydrophobicContact CB-CG2 3.85Å; L508-V514 HydrophobicContact CD1-CB 4.47Å; L508-V514 HydrophobicContact CD1-CG1 3.55Å; L508-V514 HydrophobicContact CD1-CG2 4.01Å; L508-F544 HydrophobicContact CD1-CD1 4.35Å; L508-F544 HydrophobicContact CD1-CE1 3.73Å; L508-L549 HydrophobicContact CD1-CB 4.22Å; L508-L549 HydrophobicContact CD1-CD2 4.37Å; L508-L549 HydrophobicContact CD2-CB 4.44Å; L508-L549 HydrophobicContact CD2-CD2 4.06Å; L508-A552 HydrophobicContact CD2-CB 3.88Å; L508-T553 WeakPolarHBondContact CD1-OG1 3.5Å; L508-T553 WeakPolarHBondContact CG-OG1 3.32Å
509	Q	65.7	Low	80.8	Confident	152 Å²	152	71.4 Å²	71.4	71%	0.71	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	113	173.5	-73.4	175.3	-25	0	0	109.7	L505 K506	L505-Q509 PolarHBondContact O-N 2.91Å; K506-Q509 WeakPolarHBondContact O-CB 3.22Å; K506-Q509 WeakPolarHBondContact O-CG 3.25Å; K506-Q509 PolarHBondContact O-N 3.26Å
510	G	61.6	Low	80.8	Confident	82 Å²	82	73.2 Å²	73.2	85%	0.845	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	125	-27.1	-171.1	0	0	0	0	0	113.4	L508	L508-G510 PolarHBondContact O-N 3.35Å; L508-G510 VanDerWaalsContact O-N 3.12Å
511	T	65.9	Low	80.9	Confident	68 Å²	68	73.1 Å²	73.1	42%	0.417	39%	0.393	S	S	.	.			trans	-92.9	117	178.9	58.5	0	0	0	0	112.2	L508 V514 L549	L508-T511 PolarHBondContact O-N 3.14Å; L508-T511 PolarHBondContact O-OG1 3.07Å; T511-V514 VanDerWaalsContact OG1-CG2 3.24Å; T511-V514 WeakPolarHBondContact OG1-CG2 3.01Å; T511-L549 HydrophobicContact CG2-CD2 4.39Å
512	K	55.4	Low	80.9	Confident	219 Å²	219	70.9 Å²	70.9	95%	0.952	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	126.1	174.8	-66.3	179	-178.4	174.9	0	109.5
513	G	66.4	Low	80.9	Confident	61 Å²	61	70.6 Å²	70.6	63%	0.629	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	105	11.5	170.2	0	0	0	0	0	118.1	R515	G513-R515 PolarHBondContact O-N 2.93Å
514	V	76.2	Confident	80.9	Confident	38 Å²	38	71.4 Å²	71.4	23%	0.23	38%	0.378	C	S	.	.			trans	-51.4	119.3	-177.6	-179	0	0	0	0	113.7	L505 L508 T511 I516 L549	L505-V514 HydrophobicContact CD2-CB 4.4Å; L505-V514 HydrophobicContact CD2-CG1 3.77Å; L508-V514 HydrophobicContact CB-CG2 3.85Å; L508-V514 HydrophobicContact CD1-CB 4.47Å; L508-V514 HydrophobicContact CD1-CG1 3.55Å; L508-V514 HydrophobicContact CD1-CG2 4.01Å; T511-V514 VanDerWaalsContact OG1-CG2 3.24Å; T511-V514 WeakPolarHBondContact OG1-CG2 3.01Å; V514-I516 HydrophobicContact CG1-CG1 4.34Å; V514-L549 HydrophobicContact CG1-CD1 4.46Å; V514-L549 HydrophobicContact CG2-CD2 4.32Å
515	R	80.7	Confident	80.4	Confident	161 Å²	161	83.2 Å²	83.2	61%	0.608	42%	0.423	S	S	*	.			trans	-120.9	105.1	172.6	-65.7	-172.5	-171.6	-152.7	0.5	112.1	G513 R545	G513-R515 PolarHBondContact O-N 2.93Å; R515-R545 HydrophobicContact CB-CB 4.16Å; R515-R545 PolarHBondContact O-N 3.26Å
516	I	88.2	Confident	80	Confident	25 Å²	25	88.1 Å²	88.1	13%	0.128	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	120.3	167.8	-60.5	170.8	0	0	0	108	K501 C504 L505 V514 C519 V542 Q543 F544	K501-I516 HydrophobicContact CG-CD1 3.98Å; C504-I516 HydrophobicContact CB-CD1 4.04Å; L505-I516 HydrophobicContact CD2-CD1 3.94Å; L505-I516 HydrophobicContact CG-CD1 4Å; V514-I516 HydrophobicContact CG1-CG1 4.34Å; I516-C519 HydrophobicContact CG2-CB 4.04Å; I516-V542 HydrophobicContact CG2-CG1 3.82Å; I516-Q543 CarbonylContact C-O 3.56Å; I516-F544 HydrophobicContact CD1-CE1 4.17Å; I516-F544 HydrophobicContact CG1-CD1 3.99Å; I516-F544 HydrophobicContact CG1-CE1 3.67Å; I516-F544 HydrophobicContact CG1-CZ 4.4Å
517	T	88.9	Confident	79.3	Confident	91 Å²	91	87.2 Å²	87.2	56%	0.558	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	-27.8	-173.3	62	0	0	0	0	113.8	Q543 R545	T517-Q543 PolarHBondContact N-O 1.78Å; T517-Q543 WeakPolarHBondContact OG1-CG 3.45Å; T517-Q543 PolarHBondContact OG1-O 3.5Å; T517-R545 HydrophobicContact CG2-CB 4.34Å
518	E	89.8	Confident	79	Confident	62 Å²	62	93.5 Å²	93.5	29%	0.29	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	135.8	172.1	-161.4	179.2	138.7	0	0	107.8	V542 Q543	E518-V542 CarbonylContact O-C 3.5Å; E518-V542 WeakPolarHBondContact O-CA 2.86Å; E518-Q543 HydrophobicContact CB-CB 3.66Å; E518-Q543 PolarHBondContact N-O 2.72Å; E518-Q543 PolarHBondContact O-N 2.92Å
519	C	92.6	Very high	77.7	Confident	31 Å²	31	103.5 Å²	103.5	21%	0.209	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	114.2	172.3	-174.8	0	0	0	0	107.7	K501 I516 F541	K501-C519 HydrophobicContact CB-CB 4.46Å; I516-C519 HydrophobicContact CG2-CB 4.04Å; C519-F541 WeakPolarHBondContact CA-O 3.42Å
520	R	90.9	Very high	77.7	Confident	144 Å²	144	100.5 Å²	100.5	54%	0.543	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	117.1	-169.7	-178.1	175.1	-178.5	160.8	5.6	111.6	M522 G540 F541	R520-M522 HydrophobicContact CG-SD 4.38Å; R520-G540 CarbonylContact O-C 3.57Å; R520-G540 WeakPolarHBondContact O-CA 3.39Å; R520-F541 PolarHBondContact N-O 2.68Å; R520-F541 PolarHBondContact O-N 2.79Å
521	V	92.3	Very high	78	Confident	0 Å²	0	98.4 Å²	98.4	0%	0	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	142.9	164.6	178	0	0	0	0	108.6	L491 D497 L500 Y523	L491-V521 HydrophobicContact CD2-CG2 4Å; D497-V521 PolarHBondContact OD1-N 2.89Å; L500-V521 HydrophobicContact CB-CG2 4.33Å; L500-V521 HydrophobicContact CD2-CG2 3.94Å; V521-Y523 HydrophobicContact CB-CE2 3.74Å; V521-Y523 HydrophobicContact CG1-CD2 4.43Å; V521-Y523 HydrophobicContact CG1-CE1 4.36Å; V521-Y523 HydrophobicContact CG1-CE2 3.9Å; V521-Y523 VanDerWaalsContact O-CD2 3.27Å; V521-Y523 WeakPolarHBondContact O-CD2 3.48Å; V521-Y523 WeakPolarHBondContact O-CE2 3.5Å
522	M	90.4	Very high	78.1	Confident	49 Å²	49	102.4 Å²	102.4	24%	0.241	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	132.4	178.5	-64.1	-63	-68.4	0	0	110.3	R520 L537 Y539 F541	R520-M522 HydrophobicContact CG-SD 4.38Å; M522-L537 HydrophobicContact CB-CD1 4.16Å; M522-L537 WeakPolarHBondContact O-CB 3.24Å; M522-L537 PolarHBondContact O-N 3.23Å; M522-Y539 HydrophobicContact CB-CD1 4.46Å; M522-Y539 HydrophobicContact CB-CD2 4.22Å; M522-Y539 HydrophobicContact CB-CE1 4.07Å; M522-Y539 HydrophobicContact CB-CE2 3.81Å; M522-Y539 HydrophobicContact CG-CD2 4Å; M522-Y539 HydrophobicContact CG-CE2 3.52Å; M522-Y539 PolarHBondContact N-O 2.87Å; M522-F541 HydrophobicContact CG-CD2 4.04Å; M522-F541 HydrophobicContact CG-CE2 3.87Å; M522-F541 HydrophobicContact SD-CD2 4.21Å; M522-F541 HydrophobicContact SD-CE2 4.17Å
523	Y	89.4	Confident	78.8	Confident	49 Å²	49	97.8 Å²	97.8	19%	0.192	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152.4	-176.8	-59.4	-95.6	0	0	0	109.9	V521 K533 G534 Q535	V521-Y523 HydrophobicContact CB-CE2 3.74Å; V521-Y523 HydrophobicContact CG1-CD2 4.43Å; V521-Y523 HydrophobicContact CG1-CE1 4.36Å; V521-Y523 HydrophobicContact CG1-CE2 3.9Å; V521-Y523 VanDerWaalsContact O-CD2 3.27Å; V521-Y523 WeakPolarHBondContact O-CD2 3.48Å; V521-Y523 WeakPolarHBondContact O-CE2 3.5Å; Y523-K533 HydrophobicContact CE2-CD 4.32Å; Y523-G534 WeakPolarHBondContact CD1-O 3.38Å; Y523-Q535 CarbonylContact C-O 3.57Å; Y523-Q535 WeakPolarHBondContact CA-O 3.34Å
524	D	86.6	Confident	79.5	Confident	68 Å²	68	95.4 Å²	95.4	36%	0.364	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	137.3	173.7	-95	-56.4	0	0	0	111.3	K526 G534 Q535	D524-K526 PolarHBondContact O-N 3.01Å; D524-K526 VanDerWaalsContact O-N 3.07Å; D524-G534 WeakPolarHBondContact O-CA 3.28Å; D524-Q535 PolarHBondContact N-O 3.01Å
525	R	78.5	Confident	79.8	Confident	249 Å²	249	97.4 Å²	97.4	94%	0.94	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	-5.7	174.6	-83.6	-175.6	163.3	-167.5	-7.8	114.1	P527	R525-P527 WeakPolarHBondContact O-CD 3.17Å
526	K	77.7	Confident	80.1	Confident	175 Å²	175	90 Å²	90	76%	0.761	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	104.8	179.1	-67.8	177.9	-177.2	173.4	0	108.5	D524 E528 G534	D524-K526 PolarHBondContact O-N 3.01Å; D524-K526 VanDerWaalsContact O-N 3.07Å; K526-E528 PolarHBondContact O-N 3.49Å; K526-G534 WeakPolarHBondContact O-CA 3.35Å
527	P	72.2	Confident	80	Confident	84 Å²	84	92.2 Å²	92.2	55%	0.545	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	133.4	172.3	23.7	-31.7	0	0	0	110.1	R525 G531	R525-P527 WeakPolarHBondContact O-CD 3.17Å; P527-G531 WeakPolarHBondContact CB-O 3.32Å
528	E	68.8	Low	80	Confident	147 Å²	147	88.7 Å²	88.7	69%	0.687	46%	0.455	S	S	*	.			trans	-77.1	151.3	170	-158.7	160.6	-148.8	0	0	109	K526 G530 G531	K526-E528 PolarHBondContact O-N 3.49Å; E528-G530 PolarHBondContact O-N 3.29Å; E528-G531 PolarHBondContact O-N 2.86Å
529	K	53.4	Low	80.1	Confident	219 Å²	219	89 Å²	89	95%	0.952	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	103.5	-159	-67.9	-178.2	179.2	179.7	0	114.2
530	G	65.5	Low	80.1	Confident	88 Å²	88	87.5 Å²	87.5	91%	0.907	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	-2.1	174.8	0	0	0	0	0	116	E528	E528-G530 PolarHBondContact O-N 3.29Å
531	G	67.9	Low	80.3	Confident	38 Å²	38	82.4 Å²	82.4	39%	0.392	43%	0.426	S	S	.	.			trans	-88.7	145.7	173.5	0	0	0	0	0	113.2	P527 E528 K533	P527-G531 WeakPolarHBondContact CB-O 3.32Å; E528-G531 PolarHBondContact O-N 2.86Å; G531-K533 VanDerWaalsContact C-N 3.32Å
532	V	67.9	Low	80.3	Confident	152 Å²	152	82.4 Å²	82.4	92%	0.921	43%	0.426	S	S	*	.	S	Bend	trans	-73.5	-25.5	172.6	-176.9	0	0	0	0	111.8
533	K	71.3	Confident	80.5	Confident	122 Å²	122	82.3 Å²	82.3	53%	0.53	43%	0.425	S	S	.	.	S	Bend	trans	-115.5	143	176.3	-64.8	-174.7	176.9	-175.8	0	110.4	D497 Y523 G531	D497-K533 IonicContact OD2-NZ 2.72Å; D497-K533 PolarHBondContact OD2-NZ 3.1Å; Y523-K533 HydrophobicContact CE2-CD 4.32Å; G531-K533 VanDerWaalsContact C-N 3.32Å
534	G	79.7	Confident	80.7	Confident	12 Å²	12	80 Å²	80	12%	0.124	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-178.6	169.1	0	0	0	0	0	112.9	Y523 D524 K526	Y523-G534 WeakPolarHBondContact CD1-O 3.38Å; D524-G534 WeakPolarHBondContact O-CA 3.28Å; K526-G534 WeakPolarHBondContact O-CA 3.35Å
535	Q	83.6	Confident	80.8	Confident	79 Å²	79	84 Å²	84	37%	0.369	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	140.4	179.7	-166.8	-154.7	-115.2	0	0	111.3	K493 Y523 D524 L537	K493-Q535 HydrophobicContact CD-CG 4.1Å; K493-Q535 VanDerWaalsContact NZ-CD 3.3Å; Y523-Q535 CarbonylContact C-O 3.57Å; Y523-Q535 WeakPolarHBondContact CA-O 3.34Å; D524-Q535 PolarHBondContact N-O 3.01Å; Q535-L537 PolarHBondContact O-N 3.45Å
536	S	87.4	Confident	81.4	Confident	5 Å²	5	75.4 Å²	75.4	4%	0.035	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	136.7	171.7	176	0	0	0	0	111.7	G538	S536-G538 VanDerWaalsContact C-N 3.29Å; S536-G538 PolarHBondContact OG-N 3.41Å
537	L	86.1	Confident	82	Confident	73 Å²	73	69.4 Å²	69.4	38%	0.382	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-2.5	176.9	-67.4	169.3	0	0	0	113.1	M522 Q535 Y539	M522-L537 HydrophobicContact CB-CD1 4.16Å; M522-L537 WeakPolarHBondContact O-CB 3.24Å; M522-L537 PolarHBondContact O-N 3.23Å; Q535-L537 PolarHBondContact O-N 3.45Å; L537-Y539 VanDerWaalsContact C-N 3.33Å; L537-Y539 HydrophobicContact CB-CD1 3.76Å; L537-Y539 HydrophobicContact CB-CE1 3.56Å; L537-Y539 HydrophobicContact CD1-CE1 3.87Å; L537-Y539 HydrophobicContact CG-CE1 4.33Å; L537-Y539 PolarHBondContact O-N 2.9Å
538	G	87.9	Confident	82.8	Confident	17 Å²	17	73 Å²	73	18%	0.175	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	76.1	14.9	177.9	0	0	0	0	0	115.3	N490 L491 S536	N490-G538 PolarHBondContact N-O 2.82Å; L491-G538 PolarHBondContact N-O 3.08Å; L491-G538 WeakPolarHBondContact O-CA 3.21Å; S536-G538 VanDerWaalsContact C-N 3.29Å; S536-G538 PolarHBondContact OG-N 3.41Å
539	Y	91.5	Very high	83.8	Confident	67 Å²	67	67 Å²	67	26%	0.263	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	158.1	169.6	73.4	-82.4	0	0	0	111.4	I488 M522 L537 F541	I488-Y539 CarbonylContact O-C 3.55Å; I488-Y539 VanDerWaalsContact O-CA 3.23Å; I488-Y539 WeakPolarHBondContact O-CA 3.23Å; M522-Y539 HydrophobicContact CB-CD1 4.46Å; M522-Y539 HydrophobicContact CB-CD2 4.22Å; M522-Y539 HydrophobicContact CB-CE1 4.07Å; M522-Y539 HydrophobicContact CB-CE2 3.81Å; M522-Y539 HydrophobicContact CG-CD2 4Å; M522-Y539 HydrophobicContact CG-CE2 3.52Å; M522-Y539 PolarHBondContact N-O 2.87Å; L537-Y539 VanDerWaalsContact C-N 3.33Å; L537-Y539 HydrophobicContact CB-CD1 3.76Å; L537-Y539 HydrophobicContact CB-CE1 3.56Å; L537-Y539 HydrophobicContact CD1-CE1 3.87Å; L537-Y539 HydrophobicContact CG-CE1 4.33Å; L537-Y539 PolarHBondContact O-N 2.9Å; Y539-F541 HydrophobicContact CD2-CE2 4.25Å; Y539-F541 HydrophobicContact CD2-CZ 4.35Å; Y539-F541 AromaticContact CE2-CE2 3.85Å; Y539-F541 HydrophobicContact CE2-CE2 3.85Å; Y539-F541 HydrophobicContact CE2-CZ 4.03Å
540	G	92.9	Very high	85.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	161.3	179.6	0	0	0	0	0	112.7	I488 R520	I488-G540 PolarHBondContact N-O 3.21Å; I488-G540 PolarHBondContact O-N 3.34Å; R520-G540 CarbonylContact O-C 3.57Å; R520-G540 WeakPolarHBondContact O-CA 3.39Å
541	F	94.9	Very high	86.7	Confident	37 Å²	37	54.3 Å²	54.3	16%	0.162	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	142.2	-179.9	-61.6	-78.7	0	0	0	111.3	L486 C487 C519 R520 M522 Y539	L486-F541 WeakPolarHBondContact O-CA 3.38Å; C487-F541 HydrophobicContact CB-CD1 4.11Å; C487-F541 HydrophobicContact CB-CE1 4.02Å; C519-F541 WeakPolarHBondContact CA-O 3.42Å; R520-F541 PolarHBondContact N-O 2.68Å; R520-F541 PolarHBondContact O-N 2.79Å; M522-F541 HydrophobicContact CG-CD2 4.04Å; M522-F541 HydrophobicContact CG-CE2 3.87Å; M522-F541 HydrophobicContact SD-CD2 4.21Å; M522-F541 HydrophobicContact SD-CE2 4.17Å; Y539-F541 HydrophobicContact CD2-CE2 4.25Å; Y539-F541 HydrophobicContact CD2-CZ 4.35Å; Y539-F541 AromaticContact CE2-CE2 3.85Å; Y539-F541 HydrophobicContact CE2-CE2 3.85Å; Y539-F541 HydrophobicContact CE2-CZ 4.03Å
542	V	93.6	Very high	87.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.1	174.3	-170	0	0	0	0	109.2	R485 L486 I488 L500 I516 E518 F544	R485-V542 CarbonylContact C-O 3.46Å; R485-V542 WeakPolarHBondContact CA-O 3.27Å; L486-V542 PolarHBondContact N-O 2.96Å; L486-V542 PolarHBondContact O-N 3.32Å; I488-V542 HydrophobicContact CD1-CG2 3.72Å; L500-V542 HydrophobicContact CD2-CG2 3.99Å; L500-V542 HydrophobicContact CG-CG2 4.23Å; I516-V542 HydrophobicContact CG2-CG1 3.82Å; E518-V542 CarbonylContact O-C 3.5Å; E518-V542 WeakPolarHBondContact O-CA 2.86Å; V542-F544 HydrophobicContact CB-CE2 4.16Å; V542-F544 HydrophobicContact CG1-CD2 4.37Å; V542-F544 HydrophobicContact CG1-CE2 3.6Å; V542-F544 HydrophobicContact CG1-CZ 3.68Å
543	Q	93.7	Very high	88.7	Confident	47 Å²	47	47.2 Å²	47.2	22%	0.22	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.6	178.9	-178.3	77.8	56.4	0	0	109	N484 R485 I516 T517 E518	N484-Q543 PolarHBondContact O-NE2 3.2Å; R485-Q543 VanDerWaalsContact CB-OE1 3.25Å; R485-Q543 VanDerWaalsContact CD-OE1 3.32Å; R485-Q543 HydrophobicContact CG-CB 4.38Å; R485-Q543 VanDerWaalsContact CG-OE1 3.26Å; I516-Q543 CarbonylContact C-O 3.56Å; T517-Q543 PolarHBondContact N-O 1.78Å; T517-Q543 WeakPolarHBondContact OG1-CG 3.45Å; T517-Q543 PolarHBondContact OG1-O 3.5Å; E518-Q543 HydrophobicContact CB-CB 3.66Å; E518-Q543 PolarHBondContact N-O 2.72Å; E518-Q543 PolarHBondContact O-N 2.92Å
544	F	93.1	Very high	89.5	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.009	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	155.7	173	-63.3	-90.6	0	0	0	110	N484 L486 C504 L508 I516 V542 D546 L549 A550 T553	N484-F544 WeakPolarHBondContact CB-O 3.37Å; N484-F544 PolarHBondContact O-N 2.85Å; L486-F544 HydrophobicContact CD1-CE2 3.83Å; L486-F544 HydrophobicContact CG-CE2 4.15Å; C504-F544 HydrophobicContact CB-CZ 4.37Å; L508-F544 HydrophobicContact CD1-CD1 4.35Å; L508-F544 HydrophobicContact CD1-CE1 3.73Å; I516-F544 HydrophobicContact CD1-CE1 4.17Å; I516-F544 HydrophobicContact CG1-CD1 3.99Å; I516-F544 HydrophobicContact CG1-CE1 3.67Å; I516-F544 HydrophobicContact CG1-CZ 4.4Å; V542-F544 HydrophobicContact CB-CE2 4.16Å; V542-F544 HydrophobicContact CG1-CD2 4.37Å; V542-F544 HydrophobicContact CG1-CE2 3.6Å; V542-F544 HydrophobicContact CG1-CZ 3.68Å; F544-D546 VanDerWaalsContact C-N 3.32Å; F544-D546 WeakPolarHBondContact CB-O 3.33Å; F544-L549 HydrophobicContact CB-CB 4.5Å; F544-L549 HydrophobicContact CD1-CB 3.9Å; F544-L549 HydrophobicContact CG-CB 4.38Å; F544-A550 HydrophobicContact CB-CB 4.25Å; F544-A550 HydrophobicContact CD2-CB 3.59Å; F544-A550 HydrophobicContact CE2-CB 4.3Å; F544-A550 HydrophobicContact CG-CB 4.08Å; F544-T553 HydrophobicContact CE2-CG2 4.42Å; F544-T553 HydrophobicContact CZ-CG2 3.86Å; F544-T553 WeakPolarHBondContact CZ-OG1 3.44Å
545	R	90.1	Very high	89.9	Confident	150 Å²	150	47.1 Å²	47.1	57%	0.566	22%	0.223	S	C	*	.	S	Bend	trans	-64.1	-40.8	165.7	-175.3	-177.1	-171	159.8	6.8	111	N484 R515 T517	N484-R545 PolarHBondContact ND2-O 2.68Å; R515-R545 HydrophobicContact CB-CB 4.16Å; R515-R545 PolarHBondContact O-N 3.26Å; T517-R545 HydrophobicContact CG2-CB 4.34Å
546	D	90.5	Very high	90.1	Very high	70 Å²	70	47.2 Å²	47.2	37%	0.374	22%	0.221	S	C	.	.	S	Bend	trans	-121.7	147.1	-166.8	-49	-66.4	0	0	0	112.1	F544 L549 A550	F544-D546 VanDerWaalsContact C-N 3.32Å; F544-D546 WeakPolarHBondContact CB-O 3.33Å; D546-L549 HydrophobicContact CB-CD1 4.28Å; D546-L549 HydrophobicContact CB-CG 4.38Å; D546-A550 PolarHBondContact O-N 2.77Å
547	H	90.5	Very high	90.2	Very high	48 Å²	48	47.2 Å²	47.2	22%	0.222	22%	0.22	C	C	.	.	H	α-helix	trans	-69.7	-39.5	-174.5	175.5	50	0	0	0	112.7	K483 N484 L549 A550 L551 F574	K483-H547 PolarHBondContact O-ND1 3.18Å; N484-H547 PolarHBondContact ND2-N 2.87Å; H547-L549 VanDerWaalsContact C-N 3.35Å; H547-L549 PolarHBondContact O-N 2.79Å; H547-A550 WeakPolarHBondContact O-CB 3.4Å; H547-A550 PolarHBondContact O-N 3.13Å; H547-A550 VanDerWaalsContact O-N 3.1Å; H547-L551 PolarHBondContact O-N 3.35Å; H547-F574 AromaticContact CE1-CZ 3.94Å
548	E	88.7	Confident	90.3	Very high	160 Å²	160	45 Å²	45	75%	0.748	21%	0.209	S	C	*	.	H	α-helix	trans	-62.9	-41	-177.3	-69.1	161.3	-163.3	0	0	111.5	A550 L551 A552	E548-A550 VanDerWaalsContact C-N 3.34Å; E548-A550 PolarHBondContact O-N 3.35Å; E548-L551 PolarHBondContact O-N 3.16Å; E548-A552 WeakPolarHBondContact O-CB 3.39Å; E548-A552 PolarHBondContact O-N 2.81Å
549	L	89.3	Confident	90.1	Very high	22 Å²	22	45.3 Å²	45.3	12%	0.115	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-38.2	173.4	-60.3	179	0	0	0	112.2	L508 T511 V514 F544 D546 H547 T553	L508-L549 HydrophobicContact CD1-CB 4.22Å; L508-L549 HydrophobicContact CD1-CD2 4.37Å; L508-L549 HydrophobicContact CD2-CB 4.44Å; L508-L549 HydrophobicContact CD2-CD2 4.06Å; T511-L549 HydrophobicContact CG2-CD2 4.39Å; V514-L549 HydrophobicContact CG1-CD1 4.46Å; V514-L549 HydrophobicContact CG2-CD2 4.32Å; F544-L549 HydrophobicContact CB-CB 4.5Å; F544-L549 HydrophobicContact CD1-CB 3.9Å; F544-L549 HydrophobicContact CG-CB 4.38Å; D546-L549 HydrophobicContact CB-CD1 4.28Å; D546-L549 HydrophobicContact CB-CG 4.38Å; H547-L549 VanDerWaalsContact C-N 3.35Å; H547-L549 PolarHBondContact O-N 2.79Å; L549-T553 VanDerWaalsContact O-CB 3.27Å; L549-T553 WeakPolarHBondContact O-CB 3.23Å; L549-T553 PolarHBondContact O-N 3.27Å; L549-T553 PolarHBondContact O-OG1 2.79Å
550	A	90.5	Very high	89.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-40.4	175.1	0	0	0	0	0	111.7	L486 F544 D546 H547 E548 L554 F574	L486-A550 WeakPolarHBondContact CD1-O 3.49Å; L486-A550 HydrophobicContact CD2-CB 4.29Å; L486-A550 HydrophobicContact CG-CB 4.38Å; F544-A550 HydrophobicContact CB-CB 4.25Å; F544-A550 HydrophobicContact CD2-CB 3.59Å; F544-A550 HydrophobicContact CE2-CB 4.3Å; F544-A550 HydrophobicContact CG-CB 4.08Å; D546-A550 PolarHBondContact O-N 2.77Å; H547-A550 WeakPolarHBondContact O-CB 3.4Å; H547-A550 PolarHBondContact O-N 3.13Å; H547-A550 VanDerWaalsContact O-N 3.1Å; E548-A550 VanDerWaalsContact C-N 3.34Å; E548-A550 PolarHBondContact O-N 3.35Å; A550-L554 WeakPolarHBondContact O-CB 3.45Å; A550-L554 PolarHBondContact O-N 3.01Å; A550-F574 HydrophobicContact CB-CE1 4.14Å
551	L	89.8	Confident	89	Confident	40 Å²	40	45.6 Å²	45.6	21%	0.209	22%	0.215	C	C	.	.	H	α-helix	trans	-70.7	-43.8	-180	-161.2	158	0	0	0	111.5	H547 E548 L554 R555 F574	H547-L551 PolarHBondContact O-N 3.35Å; E548-L551 PolarHBondContact O-N 3.16Å; L551-L554 PolarHBondContact O-N 2.72Å; L551-R555 HydrophobicContact CD2-CG 4.21Å; L551-R555 VanDerWaalsContact CD2-NE 3.31Å; L551-R555 WeakPolarHBondContact O-CG 3.47Å; L551-R555 PolarHBondContact O-N 2.69Å; L551-F574 HydrophobicContact CB-CZ 4.37Å
552	A	87.9	Confident	88.1	Confident	40 Å²	40	50.9 Å²	50.9	33%	0.331	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-45.1	172.4	0	0	0	0	0	111.8	L508 E548 L554 R555 Y556	L508-A552 HydrophobicContact CD2-CB 3.88Å; E548-A552 WeakPolarHBondContact O-CB 3.39Å; E548-A552 PolarHBondContact O-N 2.81Å; A552-L554 PolarHBondContact O-N 3.2Å; A552-R555 PolarHBondContact O-N 3.4Å; A552-Y556 PolarHBondContact O-N 3.19Å
553	T	88.9	Confident	87.4	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-42.8	175.1	-57.4	0	0	0	0	111.7	L486 C504 L508 F544 L549 R555 Y556 L557	L486-T553 HydrophobicContact CD1-CG2 4.04Å; C504-T553 HydrophobicContact CB-CG2 4.16Å; L508-T553 WeakPolarHBondContact CD1-OG1 3.5Å; L508-T553 WeakPolarHBondContact CG-OG1 3.32Å; F544-T553 HydrophobicContact CE2-CG2 4.42Å; F544-T553 HydrophobicContact CZ-CG2 3.86Å; F544-T553 WeakPolarHBondContact CZ-OG1 3.44Å; L549-T553 VanDerWaalsContact O-CB 3.27Å; L549-T553 WeakPolarHBondContact O-CB 3.23Å; L549-T553 PolarHBondContact O-N 3.27Å; L549-T553 PolarHBondContact O-OG1 2.79Å; T553-R555 PolarHBondContact O-N 3.07Å; T553-Y556 PolarHBondContact O-N 3.45Å; T553-L557 HydrophobicContact CG2-CD1 3.46Å; T553-L557 VanDerWaalsContact CG2-CD1 3.46Å; T553-L557 HydrophobicContact CG2-CG 3.85Å; T553-L557 VanDerWaalsContact O-CB 3.29Å; T553-L557 WeakPolarHBondContact O-CB 3.36Å; T553-L557 VanDerWaalsContact O-CG 3.28Å; T553-L557 WeakPolarHBondContact O-CG 3.24Å; T553-L557 PolarHBondContact O-N 2.85Å
554	L	89.9	Confident	86.5	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-45.9	176.5	-179.5	151.7	0	0	0	111	L486 A550 L551 A552 N558 V572 F574	L486-L554 HydrophobicContact CD1-CB 4.29Å; L486-L554 HydrophobicContact CD2-CB 4.25Å; L486-L554 HydrophobicContact CD2-CD1 4.13Å; A550-L554 WeakPolarHBondContact O-CB 3.45Å; A550-L554 PolarHBondContact O-N 3.01Å; L551-L554 PolarHBondContact O-N 2.72Å; A552-L554 PolarHBondContact O-N 3.2Å; L554-N558 WeakPolarHBondContact O-CB 3.42Å; L554-N558 PolarHBondContact O-N 2.83Å; L554-V572 HydrophobicContact CB-CG1 4.13Å; L554-V572 HydrophobicContact CD1-CG1 4.2Å; L554-V572 HydrophobicContact CG-CB 4.29Å; L554-V572 HydrophobicContact CG-CG1 3.95Å; L554-F574 HydrophobicContact CD1-CD2 3.8Å; L554-F574 HydrophobicContact CD1-CE2 3.67Å; L554-F574 HydrophobicContact CD1-CZ 4.34Å
555	R	87.6	Confident	85.6	Confident	128 Å²	128	52.7 Å²	52.7	48%	0.483	26%	0.26	S	S	.	.	H	α-helix	trans	-62.7	-43	178.2	-73.1	178.9	173.2	-145	-9.9	112.8	E368 L551 A552 T553	E368-R555 IonicContact OE1-CZ 2.72Å; E368-R555 IonicContact OE1-NH1 2.79Å; E368-R555 PolarHBondContact OE1-NH1 2.82Å; E368-R555 IonicContact OE2-CZ 3.66Å; E368-R555 IonicContact OE2-NH1 3.81Å; E368-R555 PolarHBondContact OE2-NH1 2.84Å; E368-R555 IonicContact OE2-NH2 3.08Å; E368-R555 PolarHBondContact OE2-NH2 2.68Å; L551-R555 HydrophobicContact CD2-CG 4.21Å; L551-R555 VanDerWaalsContact CD2-NE 3.31Å; L551-R555 WeakPolarHBondContact O-CG 3.47Å; L551-R555 PolarHBondContact O-N 2.69Å; A552-R555 PolarHBondContact O-N 3.4Å; T553-R555 PolarHBondContact O-N 3.07Å
556	Y	87.7	Confident	84.6	Confident	81 Å²	81	49.6 Å²	49.6	32%	0.318	26%	0.26	S	S	.	.	H	α-helix	trans	-71	-41.6	179.6	178.1	-90.8	0	0	0	113.4	G507 A552 T553 N560 I563	G507-Y556 VanDerWaalsContact CA-CE1 3.47Å; A552-Y556 PolarHBondContact O-N 3.19Å; T553-Y556 PolarHBondContact O-N 3.45Å; Y556-N560 PolarHBondContact O-ND2 3.16Å; Y556-N560 VanDerWaalsContact O-ND2 3.1Å; Y556-I563 HydrophobicContact CE1-CD1 4.27Å
557	L	88.3	Confident	83.7	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-78.1	-46.6	-176.3	-67.2	-177.2	0	0	0	112	I488 M503 T553 N559 N560 I563 P570 V572	I488-L557 HydrophobicContact CD1-CD1 3.77Å; M503-L557 HydrophobicContact CB-CD2 4.44Å; T553-L557 HydrophobicContact CG2-CD1 3.46Å; T553-L557 VanDerWaalsContact CG2-CD1 3.46Å; T553-L557 HydrophobicContact CG2-CG 3.85Å; T553-L557 VanDerWaalsContact O-CB 3.29Å; T553-L557 WeakPolarHBondContact O-CB 3.36Å; T553-L557 VanDerWaalsContact O-CG 3.28Å; T553-L557 WeakPolarHBondContact O-CG 3.24Å; T553-L557 PolarHBondContact O-N 2.85Å; L557-N559 PolarHBondContact O-N 2.75Å; L557-N560 VanDerWaalsContact O-CB 3.24Å; L557-N560 WeakPolarHBondContact O-CB 3.39Å; L557-N560 PolarHBondContact O-N 3.44Å; L557-I563 HydrophobicContact CB-CD1 4.39Å; L557-I563 HydrophobicContact CD2-CD1 3.48Å; L557-I563 VanDerWaalsContact CD2-CD1 3.48Å; L557-P570 WeakPolarHBondContact O-CG 3.5Å; L557-V572 HydrophobicContact CB-CG2 3.76Å; L557-V572 HydrophobicContact CD1-CG2 4.43Å
558	N	88.8	Confident	83.1	Confident	26 Å²	26	56.7 Å²	56.7	14%	0.139	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	136.3	-166.3	-167	40.8	0	0	0	112.5	G443 L554 N560 V572	G443-N558 WeakPolarHBondContact CA-ND2 3.36Å; G443-N558 PolarHBondContact O-ND2 2.83Å; L554-N558 WeakPolarHBondContact O-CB 3.42Å; L554-N558 PolarHBondContact O-N 2.83Å; N558-N560 PolarHBondContact O-N 2.96Å; N558-V572 HydrophobicContact CB-CB 4.13Å; N558-V572 HydrophobicContact CB-CG2 4.4Å; N558-V572 PolarHBondContact OD1-N 3.1Å
559	N	83.5	Confident	83	Confident	25 Å²	25	50.5 Å²	50.5	13%	0.134	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	-4.4	179.4	-157.4	45	0	0	0	116.8	I445 A451 V455 R463 L557 R569 P570	I445-N559 HydrophobicContact CD1-CB 3.54Å; A451-N559 PolarHBondContact O-ND2 3.31Å; V455-N559 WeakPolarHBondContact CG2-OD1 3.44Å; R463-N559 VanDerWaalsContact CZ-OD1 3.28Å; R463-N559 PolarHBondContact NH1-OD1 3.05Å; R463-N559 PolarHBondContact NH2-OD1 3.17Å; L557-N559 PolarHBondContact O-N 2.75Å; N559-R569 VanDerWaalsContact O-CD 3.32Å; N559-R569 WeakPolarHBondContact O-CD 2.98Å; N559-R569 WeakPolarHBondContact O-CG 3.25Å; N559-R569 PolarHBondContact O-NH1 3.41Å; N559-R569 WeakPolarHBondContact OD1-CD 3.49Å; N559-P570 PolarHBondContact N-O 3.18Å
560	N	84.4	Confident	83	Confident	31 Å²	31	49.5 Å²	49.5	17%	0.166	25%	0.253	C	S	.	.			trans	-66.7	119.9	-173.2	-173.3	-33.1	0	0	0	111.8	Y556 L557 N558 D562 I563 P570	Y556-N560 PolarHBondContact O-ND2 3.16Å; Y556-N560 VanDerWaalsContact O-ND2 3.1Å; L557-N560 VanDerWaalsContact O-CB 3.24Å; L557-N560 WeakPolarHBondContact O-CB 3.39Å; L557-N560 PolarHBondContact O-N 3.44Å; N558-N560 PolarHBondContact O-N 2.96Å; N560-D562 PolarHBondContact OD1-N 3.01Å; N560-D562 VanDerWaalsContact OD1-N 3.1Å; N560-I563 HydrophobicContact CB-CD1 3.76Å; N560-I563 HydrophobicContact CB-CG1 4.03Å; N560-P570 VanDerWaalsContact O-CD 3.25Å; N560-P570 WeakPolarHBondContact O-CD 3.47Å
561	P	77.3	Confident	82.9	Confident	41 Å²	41	50.1 Å²	50.1	27%	0.266	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-73	-29.5	-175.2	30.3	-34	0	0	0	113.2	I563 G565	P561-I563 PolarHBondContact O-N 3.03Å; P561-G565 CarbonylContact O-C 3.43Å; P561-G565 VanDerWaalsContact O-C 3.28Å; P561-G565 WeakPolarHBondContact O-CA 3.5Å; P561-G565 PolarHBondContact O-N 2.84Å
562	D	76.9	Confident	83	Confident	148 Å²	148	48.3 Å²	48.3	79%	0.791	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-76.4	-13.8	-170.1	-54.9	-34.1	0	0	0	112.8	N560	N560-D562 PolarHBondContact OD1-N 3.01Å; N560-D562 VanDerWaalsContact OD1-N 3.1Å
563	I	78.8	Confident	83.2	Confident	21 Å²	21	47.4 Å²	47.4	11%	0.108	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-74.7	-41.5	-177	-69	-171.9	0	0	0	112	M503 Y556 L557 N560 P561 P570	M503-I563 HydrophobicContact CE-CB 4.05Å; M503-I563 HydrophobicContact CE-CG1 3.96Å; M503-I563 HydrophobicContact CE-CG2 3.75Å; Y556-I563 HydrophobicContact CE1-CD1 4.27Å; L557-I563 HydrophobicContact CB-CD1 4.39Å; L557-I563 HydrophobicContact CD2-CD1 3.48Å; L557-I563 VanDerWaalsContact CD2-CD1 3.48Å; N560-I563 HydrophobicContact CB-CD1 3.76Å; N560-I563 HydrophobicContact CB-CG1 4.03Å; P561-I563 PolarHBondContact O-N 3.03Å; I563-P570 HydrophobicContact CB-CG 4.34Å; I563-P570 HydrophobicContact CD1-CG 4.41Å; I563-P570 HydrophobicContact CG2-CG 4.11Å
564	F	74.4	Confident	83.4	Confident	39 Å²	39	47.5 Å²	47.5	17%	0.171	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.9	4	-175.6	-63.8	-34.2	0	0	0	113.9	L491 P492 V495 K568 P570	L491-F564 HydrophobicContact CG-CE2 4.35Å; L491-F564 HydrophobicContact CG-CZ 4.15Å; P492-F564 VanDerWaalsContact CD-CD1 3.49Å; P492-F564 HydrophobicContact CG-CB 4.09Å; P492-F564 HydrophobicContact CG-CD1 3.64Å; P492-F564 HydrophobicContact CG-CD2 4.38Å; P492-F564 HydrophobicContact CG-CE1 4.19Å; P492-F564 HydrophobicContact CG-CG 3.79Å; V495-F564 HydrophobicContact CG2-CD1 4.45Å; V495-F564 HydrophobicContact CG2-CE1 3.81Å; V495-F564 HydrophobicContact CG2-CZ 4.46Å; F564-K568 HydrophobicContact CB-CB 4.25Å; F564-K568 VanDerWaalsContact CB-O 3.25Å; F564-K568 WeakPolarHBondContact CB-O 3.46Å; F564-K568 WeakPolarHBondContact CD2-O 3.48Å; F564-P570 HydrophobicContact CD2-CB 4.04Å; F564-P570 HydrophobicContact CD2-CG 4.41Å; F564-P570 HydrophobicContact CE2-CB 3.82Å
565	G	73.6	Confident	83.6	Confident	27 Å²	27	47.6 Å²	47.6	28%	0.278	24%	0.237	S	C	.	.			trans	88.7	160.1	-175.6	0	0	0	0	0	113.9	P561 H567 K568	P561-G565 CarbonylContact O-C 3.43Å; P561-G565 VanDerWaalsContact O-C 3.28Å; P561-G565 WeakPolarHBondContact O-CA 3.5Å; P561-G565 PolarHBondContact O-N 2.84Å; G565-H567 PolarHBondContact O-N 3.42Å; G565-K568 PolarHBondContact O-N 3.14Å; G565-K568 VanDerWaalsContact O-N 3.07Å
566	P	70.2	Confident	83.8	Confident	86 Å²	86	43.3 Å²	43.3	56%	0.558	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.1	-168.6	-28.9	35.6	0	0	0	115.6
567	H	71.3	Confident	83.9	Confident	156 Å²	156	41.4 Å²	41.4	72%	0.722	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-8.2	-175.8	-57.3	-62.3	0	0	0	115	G565	G565-H567 PolarHBondContact O-N 3.42Å
568	K	77.3	Confident	83.9	Confident	110 Å²	110	42.2 Å²	42.2	48%	0.478	22%	0.222	S	C	.	.	S	Bend	trans	-139.1	42.4	-173.6	-68.6	-170.5	179.8	176.8	0	113.2	F564 G565	F564-K568 HydrophobicContact CB-CB 4.25Å; F564-K568 VanDerWaalsContact CB-O 3.25Å; F564-K568 WeakPolarHBondContact CB-O 3.46Å; F564-K568 WeakPolarHBondContact CD2-O 3.48Å; G565-K568 PolarHBondContact O-N 3.14Å; G565-K568 VanDerWaalsContact O-N 3.07Å
569	R	86.3	Confident	83.8	Confident	31 Å²	31	43.2 Å²	43.2	12%	0.117	23%	0.231	C	C	.	.			trans	-48.6	130.2	176.6	-65.2	171.5	-176.9	-109.6	13.8	110.8	G454 N490 N559	G454-R569 PolarHBondContact O-NE 2.9Å; G454-R569 PolarHBondContact O-NH2 3.22Å; N490-R569 PolarHBondContact ND2-O 3.15Å; N559-R569 VanDerWaalsContact O-CD 3.32Å; N559-R569 WeakPolarHBondContact O-CD 2.98Å; N559-R569 WeakPolarHBondContact O-CG 3.25Å; N559-R569 PolarHBondContact O-NH1 3.41Å; N559-R569 WeakPolarHBondContact OD1-CD 3.49Å
570	P	88.8	Confident	83.8	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.006	25%	0.25	C	S	.	.			trans	-59.6	141.9	173.9	28.5	-37.8	0	0	0	110.6	L557 N559 N560 I563 F564 V572	L557-P570 WeakPolarHBondContact O-CG 3.5Å; N559-P570 PolarHBondContact N-O 3.18Å; N560-P570 VanDerWaalsContact O-CD 3.25Å; N560-P570 WeakPolarHBondContact O-CD 3.47Å; I563-P570 HydrophobicContact CB-CG 4.34Å; I563-P570 HydrophobicContact CD1-CG 4.41Å; I563-P570 HydrophobicContact CG2-CG 4.11Å; F564-P570 HydrophobicContact CD2-CB 4.04Å; F564-P570 HydrophobicContact CD2-CG 4.41Å; F564-P570 HydrophobicContact CE2-CB 3.82Å; P570-V572 HydrophobicContact CB-CG2 4.4Å
571	I	90.1	Very high	83.9	Confident	12 Å²	12	54.4 Å²	54.4	6%	0.062	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	114.9	172.6	-62.4	164.7	0	0	0	106.1	K462 R463 F466 H489	K462-I571 HydrophobicContact CB-CD1 4.26Å; R463-I571 HydrophobicContact CG-CD1 3.64Å; R463-I571 HydrophobicContact CG-CG1 4.05Å; F466-I571 HydrophobicContact CD2-CD1 4.2Å; F466-I571 HydrophobicContact CD2-CG2 4.44Å; F466-I571 HydrophobicContact CE2-CD1 4.06Å; H489-I571 HydrophobicContact CB-CB 4.28Å; H489-I571 PolarHBondContact N-O 3.02Å; H489-I571 PolarHBondContact O-N 2.95Å
572	V	91.1	Very high	84.3	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.012	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.3	-174.3	-172.6	0	0	0	0	110.6	L486 I488 L554 L557 N558 P570	L486-V572 HydrophobicContact CB-CG1 4.25Å; L486-V572 HydrophobicContact CD1-CG1 3.95Å; L486-V572 HydrophobicContact CG-CG1 4.48Å; I488-V572 HydrophobicContact CG1-CG1 4.14Å; I488-V572 HydrophobicContact CG1-CG2 4.17Å; I488-V572 HydrophobicContact CG2-CG2 4.11Å; L554-V572 HydrophobicContact CB-CG1 4.13Å; L554-V572 HydrophobicContact CD1-CG1 4.2Å; L554-V572 HydrophobicContact CG-CB 4.29Å; L554-V572 HydrophobicContact CG-CG1 3.95Å; L557-V572 HydrophobicContact CB-CG2 3.76Å; L557-V572 HydrophobicContact CD1-CG2 4.43Å; N558-V572 HydrophobicContact CB-CB 4.13Å; N558-V572 HydrophobicContact CB-CG2 4.4Å; N558-V572 PolarHBondContact OD1-N 3.1Å; P570-V572 HydrophobicContact CB-CG2 4.4Å
573	E	92.1	Very high	84.8	Confident	21 Å²	21	55.5 Å²	55.5	10%	0.098	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	157.6	179.3	60.7	-177.5	-167	0	0	110.8	K470 L486 C487 H489	K470-E573 WeakPolarHBondContact CE-OE2 3.42Å; K470-E573 IonicContact NZ-OE2 2.69Å; K470-E573 PolarHBondContact NZ-OE2 2.82Å; L486-E573 CarbonylContact C-O 3.57Å; L486-E573 WeakPolarHBondContact CA-O 3.19Å; C487-E573 HydrophobicContact CB-CG 3.98Å; C487-E573 PolarHBondContact N-O 3.47Å; C487-E573 PolarHBondContact O-N 2.77Å; H489-E573 IonicContact CD2-OE1 3.91Å; H489-E573 WeakPolarHBondContact NE2-CG 3.49Å; H489-E573 CovalentContact NE2-OE1 1.78Å; H489-E573 IonicContact NE2-OE1 2.72Å; H489-E573 PolarHBondContact NE2-OE1 2.76Å; H489-E573 IonicContact NE2-OE2 2.63Å; H489-E573 PolarHBondContact NE2-OE2 3.08Å
574	F	93.9	Very high	85.2	Confident	3 Å²	3	58.9 Å²	58.9	1%	0.013	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	140.6	166.3	-71.5	-82.8	0	0	0	110.4	L439 E442 V481 S482 K483 R485 L486 H547 A550 L551 L554	L439-F574 HydrophobicContact CB-CB 4.38Å; L439-F574 HydrophobicContact CB-CD2 3.77Å; L439-F574 HydrophobicContact CB-CE2 4.21Å; L439-F574 HydrophobicContact CB-CG 4.05Å; L439-F574 HydrophobicContact CD1-CD1 4.34Å; L439-F574 HydrophobicContact CD1-CE1 4.4Å; L439-F574 HydrophobicContact CD1-CG 4.45Å; L439-F574 HydrophobicContact CD2-CD2 4.24Å; L439-F574 HydrophobicContact CD2-CE2 3.79Å; L439-F574 HydrophobicContact CD2-CZ 4.04Å; L439-F574 HydrophobicContact CG-CD2 4.42Å; L439-F574 HydrophobicContact CG-CE2 4.42Å; L439-F574 WeakPolarHBondContact O-CD2 3.26Å; E442-F574 HydrophobicContact CB-CD2 4.16Å; E442-F574 HydrophobicContact CB-CE2 3.88Å; E442-F574 HydrophobicContact CG-CE2 4.24Å; V481-F574 HydrophobicContact CG1-CB 3.4Å; V481-F574 HydrophobicContact CG1-CG 4.34Å; S482-F574 VanDerWaalsContact O-CD1 3.27Å; S482-F574 WeakPolarHBondContact O-CD1 3.14Å; K483-F574 VanDerWaalsContact O-CE1 3.23Å; K483-F574 WeakPolarHBondContact O-CE1 3.43Å; R485-F574 WeakPolarHBondContact O-CA 3.37Å; L486-F574 HydrophobicContact CD2-CD1 3.64Å; L486-F574 HydrophobicContact CD2-CE1 3.67Å; L486-F574 HydrophobicContact CD2-CG 4.15Å; L486-F574 HydrophobicContact CD2-CZ 4.22Å; H547-F574 AromaticContact CE1-CZ 3.94Å; A550-F574 HydrophobicContact CB-CE1 4.14Å; L551-F574 HydrophobicContact CB-CZ 4.37Å; L554-F574 HydrophobicContact CD1-CD2 3.8Å; L554-F574 HydrophobicContact CD1-CE2 3.67Å; L554-F574 HydrophobicContact CD1-CZ 4.34Å
575	S	92.5	Very high	85.7	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.035	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	142.4	-178.9	-171	0	0	0	0	111	S482 R485	S482-S575 PolarHBondContact N-O 3.04Å; S482-S575 PolarHBondContact OG-O 2.66Å; R485-S575 PolarHBondContact O-N 2.9Å
576	L	92	Very high	86.4	Confident	39 Å²	39	65.7 Å²	65.7	20%	0.204	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.7	164.9	-63.2	-175.7	0	0	0	109.2	K470 K473 L474 V479 V481	K470-L576 HydrophobicContact CB-CD1 4.43Å; K470-L576 HydrophobicContact CG-CD1 4.2Å; K473-L576 HydrophobicContact CB-CD1 3.75Å; K473-L576 HydrophobicContact CD-CD1 3.93Å; L474-L576 HydrophobicContact CD1-CD2 4.3Å; L474-L576 HydrophobicContact CD2-CD2 3.75Å; L474-L576 HydrophobicContact CG-CD1 4.39Å; L474-L576 HydrophobicContact CG-CD2 3.99Å; V479-L576 HydrophobicContact CG1-CB 4.14Å; V481-L576 HydrophobicContact CG2-CD2 3.97Å
577	E	89.9	Confident	87.2	Confident	40 Å²	40	67.3 Å²	67.3	19%	0.187	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.4	179.4	-74.6	179.5	147.3	0	0	110.7	V479 F480 S482 R485	V479-E577 WeakPolarHBondContact CA-O 3.42Å; F480-E577 HydrophobicContact CD1-CB 4.42Å; F480-E577 WeakPolarHBondContact CD1-O 3.42Å; F480-E577 HydrophobicContact CE1-CB 3.75Å; F480-E577 WeakPolarHBondContact CE1-O 3.12Å; F480-E577 HydrophobicContact CE2-CB 4Å; F480-E577 HydrophobicContact CZ-CB 3.5Å; F480-E577 VanDerWaalsContact CZ-CB 3.5Å; F480-E577 PolarHBondContact N-O 2.58Å; F480-E577 PolarHBondContact O-N 2.93Å; S482-E577 VanDerWaalsContact OG-CG 3.29Å; S482-E577 WeakPolarHBondContact OG-CG 3.37Å; S482-E577 PolarHBondContact OG-OE2 2.91Å; R485-E577 VanDerWaalsContact CD-OE1 3.3Å; R485-E577 WeakPolarHBondContact CD-OE1 3.13Å; R485-E577 IonicContact CZ-OE1 2.98Å; R485-E577 IonicContact NE-OE1 2.74Å; R485-E577 IonicContact NH1-OE1 2.68Å; R485-E577 PolarHBondContact NH1-OE1 3.18Å
578	D	89.9	Confident	88	Confident	23 Å²	23	65.3 Å²	65.3	12%	0.123	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.4	174.8	179.1	-19.5	0	0	0	108.6	V479 R580 K581 L582	V479-D578 HydrophobicContact CG2-CB 4.43Å; D578-R580 PolarHBondContact O-N 2.95Å; D578-R580 VanDerWaalsContact OD1-CB 3.27Å; D578-R580 WeakPolarHBondContact OD1-CB 3.4Å; D578-R580 IonicContact OD1-CZ 3.38Å; D578-R580 PolarHBondContact OD1-N 2.78Å; D578-R580 IonicContact OD1-NE 3.13Å; D578-R580 PolarHBondContact OD1-NE 3.06Å; D578-R580 VanDerWaalsContact OD1-NE 3.08Å; D578-R580 IonicContact OD1-NH2 2.77Å; D578-R580 IonicContact OD2-CZ 2.82Å; D578-R580 IonicContact OD2-NE 3.04Å; D578-R580 PolarHBondContact OD2-NE 3.29Å; D578-R580 VanDerWaalsContact OD2-NE 3.13Å; D578-R580 IonicContact OD2-NH2 3.34Å; D578-R580 PolarHBondContact OD2-NH2 3.5Å; D578-K581 HydrophobicContact CB-CB 4.16Å; D578-K581 HydrophobicContact CB-CD 4.33Å; D578-K581 HydrophobicContact CB-CG 4.07Å; D578-K581 PolarHBondContact O-N 2.93Å; D578-K581 VanDerWaalsContact O-N 3.09Å; D578-L582 PolarHBondContact O-N 2.84Å
579	S	84.8	Confident	88.4	Confident	47 Å²	47	66.2 Å²	66.2	33%	0.329	30%	0.303	S	S	.	.	H	α-helix	trans	-57.8	-30.1	179.7	57	0	0	0	0	114	G478 K583	G478-S579 PolarHBondContact O-N 2.91Å; G478-S579 PolarHBondContact O-OG 3.04Å; S579-K583 WeakPolarHBondContact O-CG 3.14Å; S579-K583 PolarHBondContact O-N 3.06Å
580	R	85.4	Confident	88.5	Confident	140 Å²	140	68.9 Å²	68.9	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-68.2	-48	174	-59.1	168.8	-69.3	-150.3	-5.8	110.6	D476 D578 K583 L584	D476-R580 IonicContact OD2-CZ 3.74Å; D476-R580 IonicContact OD2-NH1 3.76Å; D476-R580 IonicContact OD2-NH2 3.2Å; D476-R580 PolarHBondContact OD2-NH2 2.97Å; D578-R580 PolarHBondContact O-N 2.95Å; D578-R580 VanDerWaalsContact OD1-CB 3.27Å; D578-R580 WeakPolarHBondContact OD1-CB 3.4Å; D578-R580 IonicContact OD1-CZ 3.38Å; D578-R580 PolarHBondContact OD1-N 2.78Å; D578-R580 IonicContact OD1-NE 3.13Å; D578-R580 PolarHBondContact OD1-NE 3.06Å; D578-R580 VanDerWaalsContact OD1-NE 3.08Å; D578-R580 IonicContact OD1-NH2 2.77Å; D578-R580 IonicContact OD2-CZ 2.82Å; D578-R580 IonicContact OD2-NE 3.04Å; D578-R580 PolarHBondContact OD2-NE 3.29Å; D578-R580 VanDerWaalsContact OD2-NE 3.13Å; D578-R580 IonicContact OD2-NH2 3.34Å; D578-R580 PolarHBondContact OD2-NH2 3.5Å; R580-K583 PolarHBondContact O-N 3.48Å; R580-L584 PolarHBondContact O-N 3.13Å
581	K	86.3	Confident	88.5	Confident	150 Å²	150	77 Å²	77	65%	0.652	35%	0.347	S	S	*	.	H	α-helix	trans	-72.3	-29.8	-177	-58.4	-170.6	-178.8	-167.5	0	112	D578 K585	D578-K581 HydrophobicContact CB-CB 4.16Å; D578-K581 HydrophobicContact CB-CD 4.33Å; D578-K581 HydrophobicContact CB-CG 4.07Å; D578-K581 PolarHBondContact O-N 2.93Å; D578-K581 VanDerWaalsContact O-N 3.09Å; K581-K585 WeakPolarHBondContact O-CB 3.44Å; K581-K585 PolarHBondContact O-N 3.09Å
582	L	85.9	Confident	88.5	Confident	71 Å²	71	80.9 Å²	80.9	37%	0.372	37%	0.368	S	S	.	.	H	α-helix	trans	-64.3	-51.3	170.2	-168.9	157.1	0	0	0	111.1	F480 D578 L584 K585 E586	F480-L582 HydrophobicContact CE1-CD1 4.4Å; F480-L582 HydrophobicContact CZ-CD1 3.79Å; D578-L582 PolarHBondContact O-N 2.84Å; L582-L584 VanDerWaalsContact C-N 3.31Å; L582-L584 PolarHBondContact O-N 3.27Å; L582-K585 WeakPolarHBondContact O-CB 3.39Å; L582-K585 PolarHBondContact O-N 3.46Å; L582-K585 VanDerWaalsContact O-N 3.11Å; L582-E586 PolarHBondContact O-N 2.87Å
583	K	85.8	Confident	88.4	Confident	141 Å²	141	87.4 Å²	87.4	61%	0.613	40%	0.396	S	S	*	.	H	α-helix	trans	-56.6	-42.9	175.9	-73.9	174.4	178.2	-177.5	0	112.2	S579 R580 K585 E586 M587	S579-K583 WeakPolarHBondContact O-CG 3.14Å; S579-K583 PolarHBondContact O-N 3.06Å; R580-K583 PolarHBondContact O-N 3.48Å; K583-K585 PolarHBondContact O-N 2.86Å; K583-E586 WeakPolarHBondContact O-CB 3.28Å; K583-E586 PolarHBondContact O-N 3.45Å; K583-M587 WeakPolarHBondContact O-CG 3.42Å; K583-M587 PolarHBondContact O-N 2.84Å
584	L	87.4	Confident	88.2	Confident	92 Å²	92	90.1 Å²	90.1	48%	0.482	41%	0.411	S	S	.	.	H	α-helix	trans	-64.1	-40.1	176.7	-172.5	61.9	0	0	0	112.4	R580 L582 E586 R588	R580-L584 PolarHBondContact O-N 3.13Å; L582-L584 VanDerWaalsContact C-N 3.31Å; L582-L584 PolarHBondContact O-N 3.27Å; L584-E586 VanDerWaalsContact C-N 3.29Å; L584-E586 PolarHBondContact O-N 3.25Å; L584-R588 WeakPolarHBondContact O-CB 3.46Å; L584-R588 VanDerWaalsContact O-CG 3.31Å; L584-R588 WeakPolarHBondContact O-CG 3.49Å; L584-R588 PolarHBondContact O-N 2.92Å
585	K	86.5	Confident	87.8	Confident	99 Å²	99	96.6 Å²	96.6	43%	0.43	44%	0.44	S	S	.	.	H	α-helix	trans	-63.9	-33.7	173.1	-173.4	-178.6	179.7	-174.1	0	112	K581 L582 K583 K589	K581-K585 WeakPolarHBondContact O-CB 3.44Å; K581-K585 PolarHBondContact O-N 3.09Å; L582-K585 WeakPolarHBondContact O-CB 3.39Å; L582-K585 PolarHBondContact O-N 3.46Å; L582-K585 VanDerWaalsContact O-N 3.11Å; K583-K585 PolarHBondContact O-N 2.86Å; K585-K589 WeakPolarHBondContact O-CG 3.41Å; K585-K589 PolarHBondContact O-N 2.78Å; K585-K589 VanDerWaalsContact O-N 3.13Å
586	E	86.7	Confident	87.4	Confident	110 Å²	110	101.5 Å²	101.5	51%	0.514	47%	0.465	S	S	.	.	H	α-helix	trans	-73.2	-48.8	177.9	-171.3	155.9	-131.2	0	0	112.1	L582 K583 L584 R588 K589 Q590	L582-E586 PolarHBondContact O-N 2.87Å; K583-E586 WeakPolarHBondContact O-CB 3.28Å; K583-E586 PolarHBondContact O-N 3.45Å; L584-E586 VanDerWaalsContact C-N 3.29Å; L584-E586 PolarHBondContact O-N 3.25Å; E586-R588 VanDerWaalsContact C-N 3.33Å; E586-R588 PolarHBondContact O-N 2.82Å; E586-K589 CarbonylContact O-C 3.55Å; E586-K589 WeakPolarHBondContact O-CA 3.47Å; E586-K589 WeakPolarHBondContact O-CB 3.29Å; E586-K589 PolarHBondContact O-N 3.43Å; E586-Q590 PolarHBondContact O-N 3.07Å
587	M	88	Confident	86.9	Confident	121 Å²	121	107.1 Å²	107.1	60%	0.596	49%	0.49	S	S	*	.	H	α-helix	trans	-58	-42.9	173	-66.6	-61.8	-59.2	0	0	112	K583 K589 Q590 R591	K583-M587 WeakPolarHBondContact O-CG 3.42Å; K583-M587 PolarHBondContact O-N 2.84Å; M587-K589 VanDerWaalsContact C-N 3.29Å; M587-K589 PolarHBondContact O-N 2.81Å; M587-Q590 PolarHBondContact O-N 3.5Å; M587-Q590 PolarHBondContact SD-OE1 3.46Å; M587-R591 PolarHBondContact O-N 3.34Å
588	R	88.6	Confident	86.4	Confident	114 Å²	114	111.3 Å²	111.3	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-63.5	-32.4	174.9	-72	-179	-175.8	-159.8	2	111.8	D263 L584 E586 N592	D263-R588 IonicContact OD1-NH2 3.28Å; D263-R588 PolarHBondContact OD1-NH2 2.93Å; D263-R588 IonicContact OD2-NH2 3.31Å; L584-R588 WeakPolarHBondContact O-CB 3.46Å; L584-R588 VanDerWaalsContact O-CG 3.31Å; L584-R588 WeakPolarHBondContact O-CG 3.49Å; L584-R588 PolarHBondContact O-N 2.92Å; E586-R588 VanDerWaalsContact C-N 3.33Å; E586-R588 PolarHBondContact O-N 2.82Å; R588-N592 PolarHBondContact O-N 3.43Å
589	K	85.8	Confident	85.9	Confident	129 Å²	129	118.5 Å²	118.5	56%	0.561	54%	0.539	S	S	*	.	H	α-helix	trans	-72.9	-40.6	173.1	-83.1	-177.4	173.1	-168.2	0	113.3	K585 E586 M587 N592 K593	K585-K589 WeakPolarHBondContact O-CG 3.41Å; K585-K589 PolarHBondContact O-N 2.78Å; K585-K589 VanDerWaalsContact O-N 3.13Å; E586-K589 CarbonylContact O-C 3.55Å; E586-K589 WeakPolarHBondContact O-CA 3.47Å; E586-K589 WeakPolarHBondContact O-CB 3.29Å; E586-K589 PolarHBondContact O-N 3.43Å; M587-K589 VanDerWaalsContact C-N 3.29Å; M587-K589 PolarHBondContact O-N 2.81Å; K589-N592 PolarHBondContact O-N 3.44Å; K589-K593 PolarHBondContact O-N 3.07Å
590	Q	87.1	Confident	84.6	Confident	86 Å²	86	121.6 Å²	121.6	40%	0.402	56%	0.558	S	S	.	*	H	α-helix	trans	-60.3	-56.6	174.6	-75	170.1	-53.3	0	0	109.6	E586 M587 N592 K593 D594	E586-Q590 PolarHBondContact O-N 3.07Å; M587-Q590 PolarHBondContact O-N 3.5Å; M587-Q590 PolarHBondContact SD-OE1 3.46Å; Q590-N592 PolarHBondContact O-N 3.32Å; Q590-K593 WeakPolarHBondContact O-CA 3.41Å; Q590-K593 WeakPolarHBondContact O-CB 3.03Å; Q590-K593 PolarHBondContact O-N 3.45Å; Q590-D594 PolarHBondContact O-N 2.84Å; Q590-D594 VanDerWaalsContact O-OD2 3.05Å
591	R	89.1	Confident	83	Confident	173 Å²	173	121.9 Å²	121.9	65%	0.653	58%	0.575	S	S	*	*	H	α-helix	trans	-50.4	-35.5	177.8	-165.8	-179.3	81.8	175.9	3.8	113.4	M587 D594 F595	M587-R591 PolarHBondContact O-N 3.34Å; R591-D594 WeakPolarHBondContact CA-OD2 3.44Å; R591-D594 PolarHBondContact N-OD2 3.38Å; R591-F595 VanDerWaalsContact O-CB 3.26Å; R591-F595 WeakPolarHBondContact O-CB 3.36Å; R591-F595 PolarHBondContact O-N 3.28Å
592	N	90.4	Very high	81.1	Confident	92 Å²	92	124.4 Å²	124.4	49%	0.492	59%	0.586	S	S	.	*	H	α-helix	trans	-73.8	-41.4	175.9	-165.2	26.4	0	0	0	113	R588 K589 Q590 D594 F595 I596	R588-N592 PolarHBondContact O-N 3.43Å; K589-N592 PolarHBondContact O-N 3.44Å; Q590-N592 PolarHBondContact O-N 3.32Å; N592-D594 VanDerWaalsContact C-N 3.34Å; N592-F595 PolarHBondContact O-N 2.92Å; N592-I596 WeakPolarHBondContact O-CD1 3.14Å; N592-I596 VanDerWaalsContact O-CG1 3.24Å; N592-I596 WeakPolarHBondContact O-CG1 3.5Å; N592-I596 PolarHBondContact O-N 3.2Å
593	K	89.4	Confident	78.9	Confident	140 Å²	140	124 Å²	124	61%	0.609	60%	0.599	S	S	*	*	H	α-helix	trans	-59.1	-46.6	171	-72.8	179.8	173.6	-173	0	111.2	K589 Q590 F595 I596 Q597	K589-K593 PolarHBondContact O-N 3.07Å; Q590-K593 WeakPolarHBondContact O-CA 3.41Å; Q590-K593 WeakPolarHBondContact O-CB 3.03Å; Q590-K593 PolarHBondContact O-N 3.45Å; K593-F595 VanDerWaalsContact C-N 3.3Å; K593-F595 PolarHBondContact O-N 3.38Å; K593-I596 PolarHBondContact O-N 3.27Å; K593-I596 VanDerWaalsContact O-N 3.16Å; K593-Q597 WeakPolarHBondContact O-CB 3.44Å; K593-Q597 WeakPolarHBondContact O-CG 3.45Å; K593-Q597 PolarHBondContact O-N 3.35Å
594	D	86.4	Confident	76.7	Confident	77 Å²	77	126.5 Å²	126.5	41%	0.412	61%	0.613	S	S	.	*	H	α-helix	trans	-63.3	-39.5	-178.5	-46.8	-29.8	0	0	0	110.5	Q590 R591 N592 N598	Q590-D594 PolarHBondContact O-N 2.84Å; Q590-D594 VanDerWaalsContact O-OD2 3.05Å; R591-D594 WeakPolarHBondContact CA-OD2 3.44Å; R591-D594 PolarHBondContact N-OD2 3.38Å; N592-D594 VanDerWaalsContact C-N 3.34Å; D594-N598 VanDerWaalsContact O-CB 3.28Å; D594-N598 WeakPolarHBondContact O-CB 3.26Å; D594-N598 PolarHBondContact O-N 3.45Å; D594-N598 PolarHBondContact O-ND2 3.06Å
595	F	86.5	Confident	74.3	Confident	140 Å²	140	130.3 Å²	130.3	61%	0.614	63%	0.633	S	S	*	*	H	α-helix	trans	-65.9	-39.6	173.9	178.2	-100.6	0	0	0	113	R591 N592 K593 R599	R591-F595 VanDerWaalsContact O-CB 3.26Å; R591-F595 WeakPolarHBondContact O-CB 3.36Å; R591-F595 PolarHBondContact O-N 3.28Å; N592-F595 PolarHBondContact O-N 2.92Å; K593-F595 VanDerWaalsContact C-N 3.3Å; K593-F595 PolarHBondContact O-N 3.38Å; F595-R599 PolarHBondContact O-N 3.44Å
596	I	84.2	Confident	72	Confident	108 Å²	108	135.1 Å²	135.1	55%	0.554	65%	0.654	S	S	*	*	H	α-helix	trans	-67.9	-45.4	176.5	-69.7	163.8	0	0	0	110.7	N592 K593 R599	N592-I596 WeakPolarHBondContact O-CD1 3.14Å; N592-I596 VanDerWaalsContact O-CG1 3.24Å; N592-I596 WeakPolarHBondContact O-CG1 3.5Å; N592-I596 PolarHBondContact O-N 3.2Å; K593-I596 PolarHBondContact O-N 3.27Å; K593-I596 VanDerWaalsContact O-N 3.16Å; I596-R599 WeakPolarHBondContact O-CB 3.3Å; I596-R599 PolarHBondContact O-N 3.27Å
597	Q	82.1	Confident	69.4	Low	156 Å²	156	137.3 Å²	137.3	73%	0.729	67%	0.669	S	S	*	*	H	α-helix	trans	-66.9	-38.3	179.2	-73	-176.9	-10.9	0	0	112.8	K593 R599	K593-Q597 WeakPolarHBondContact O-CB 3.44Å; K593-Q597 WeakPolarHBondContact O-CG 3.45Å; K593-Q597 PolarHBondContact O-N 3.35Å; Q597-R599 VanDerWaalsContact C-N 3.3Å; Q597-R599 PolarHBondContact O-N 2.81Å
598	N	78.6	Confident	67.1	Low	129 Å²	129	137.2 Å²	137.2	69%	0.69	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	12.2	179	-65.7	-69.3	0	0	0	113.7	D594 P600	D594-N598 VanDerWaalsContact O-CB 3.28Å; D594-N598 WeakPolarHBondContact O-CB 3.26Å; D594-N598 PolarHBondContact O-N 3.45Å; D594-N598 PolarHBondContact O-ND2 3.06Å; N598-P600 VanDerWaalsContact O-CD 3.31Å; N598-P600 WeakPolarHBondContact O-CD 3.45Å
599	R	79.3	Confident	64.6	Low	173 Å²	173	140.4 Å²	140.4	65%	0.653	70%	0.697	S	S	*	*			trans	-67.9	116	175.8	-176.8	-179.7	177.3	-168.9	-1.6	109.6	F595 I596 Q597 V601	F595-R599 PolarHBondContact O-N 3.44Å; I596-R599 WeakPolarHBondContact O-CB 3.3Å; I596-R599 PolarHBondContact O-N 3.27Å; Q597-R599 VanDerWaalsContact C-N 3.3Å; Q597-R599 PolarHBondContact O-N 2.81Å; R599-V601 PolarHBondContact O-N 2.9Å; R599-V601 VanDerWaalsContact O-N 3.14Å
600	P	56.4	Low	62	Low	112 Å²	112	141.6 Å²	141.6	73%	0.727	72%	0.715	S	S	*	*			trans	-68.7	116.1	-175.8	26.3	-33.8	0	0	0	111.4	N598 K602	N598-P600 VanDerWaalsContact O-CD 3.31Å; N598-P600 WeakPolarHBondContact O-CD 3.45Å; P600-K602 PolarHBondContact O-N 3.13Å
601	V	53	Low	59.2	Low	146 Å²	146	140.5 Å²	140.5	89%	0.885	73%	0.728	S	S	*	*			trans	-61.3	119.3	173.3	-179.8	0	0	0	0	109	R599	R599-V601 PolarHBondContact O-N 2.9Å; R599-V601 VanDerWaalsContact O-N 3.14Å
602	K	45.2	Very low	56.3	Low	203 Å²	203	137.5 Å²	137.5	88%	0.883	73%	0.733	S	S	*	*			trans	-111	74.9	-166.1	-160.6	175.9	-176.5	179.9	0	113.6	P600	P600-K602 PolarHBondContact O-N 3.13Å
603	G	40.5	Very low	53.4	Low	64 Å²	64	140.4 Å²	140.4	66%	0.66	75%	0.749	S	S	*	*			trans	105.7	92.6	153.7	0	0	0	0	0	116.3	L605	G603-L605 PolarHBondContact O-N 3.01Å
604	E	39	Very low	50.6	Low	192 Å²	192	140.7 Å²	140.7	90%	0.897	76%	0.755	S	S	*	*			trans	-63.7	123.8	150.3	-68.2	176.4	98	0	0	109.4	K606	E604-K606 PolarHBondContact O-N 3.01Å
605	L	37.3	Very low	47.9	Very low	172 Å²	172	146 Å²	146	90%	0.901	78%	0.775	S	S	*	*			trans	-83.9	110.3	170.5	-84.9	162.3	0	0	0	109.5	G603 N607	G603-L605 PolarHBondContact O-N 3.01Å; L605-N607 PolarHBondContact O-N 3.27Å
606	K	39.2	Very low	45.1	Very low	200 Å²	200	148.7 Å²	148.7	87%	0.87	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-67.1	117.8	175.3	-67.8	-175.3	177.3	-176.5	0	110.7	E604 P608	E604-K606 PolarHBondContact O-N 3.01Å; K606-P608 WeakPolarHBondContact O-CD 3.38Å
607	N	32	Very low	42.5	Very low	156 Å²	156	150 Å²	150	83%	0.834	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-65	130.1	167	-93.1	-15.5	0	0	0	111	L605	L605-N607 PolarHBondContact O-N 3.27Å
608	P	39	Very low	39.9	Very low	119 Å²	119	152 Å²	152	77%	0.773	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-72	148.5	158.7	-12	28.9	0	0	0	110.8	K606	K606-P608 WeakPolarHBondContact O-CD 3.38Å
609	Q	36.8	Very low	37.5	Very low	182 Å²	182	154.6 Å²	154.6	85%	0.85	81%	0.811	S	S	*	*			trans	-89.5	177	169.7	-73.1	-174.7	-27.3	0	0	111.8
610	T	30.7	Very low	34.9	Very low	153 Å²	153	153.2 Å²	153.2	94%	0.939	82%	0.817	S	S	*	*			trans	80.8	134.6	-173	74.8	0	0	0	0	113.8
611	G	28.7	Very low	33.5	Very low	64 Å²	64	151.6 Å²	151.6	66%	0.66	82%	0.82	S	S	*	*			cis	-179.8	168	-6.3	0	0	0	0	0	112.4
612	S	28.3	Very low	32.3	Very low	109 Å²	109	150.9 Å²	150.9	76%	0.762	81%	0.811	S	S	*	*			trans	54.6	107.8	170.3	60.3	0	0	0	0	120.1
613	D	29.1	Very low	31.5	Very low	154 Å²	154	150.5 Å²	150.5	82%	0.824	81%	0.81	S	S	*	*				74.5	155.9	121.3	-75.7	-74.3	0	0	0	125.6
614	I	30.7	Very low	30.9	Very low	146 Å²	146	150.8 Å²	150.8	75%	0.749	81%	0.812	S	S	*	*			trans	84.5	97.4	160.1	-64.4	144.1	0	0	0	120
615	K	29.7	Very low	30.4	Very low	187 Å²	187	150.6 Å²	150.6	81%	0.813	81%	0.812	S	S	*	*			trans	51.8	120.7	133.2	-60.8	178	-178.2	171.4	0	122.7
616	K	27.4	Very low	29.9	Very low	197 Å²	197	147.8 Å²	147.8	86%	0.857	81%	0.806	S	S	*	*				15.8	121.4	123.1	-60.9	177.9	178.5	179	0	118.8
617	T	28.7	Very low	29.3	Very low	137 Å²	137	143 Å²	143	84%	0.84	80%	0.798	S	S	*	*				-177	129.1	106.2	31.7	0	0	0	0	109.3
618	K	27.8	Very low	29.1	Very low	196 Å²	196	139.9 Å²	139.9	85%	0.852	79%	0.788	S	S	*	*				52.8	95.5	77.8	-98.3	-155.7	176.4	-165.8	0	116.1
619	K	27.9	Very low	28.5	Very low	185 Å²	185	142.3 Å²	142.3	80%	0.804	79%	0.789	S	S	*	*				176.4	129.6	125.1	-93.6	-158.8	166.7	-175.1	0	109.1
620	D	26.1	Very low	28.1	Very low	144 Å²	144	139.9 Å²	139.9	77%	0.77	78%	0.781	S	S	*	*				62	118.9	77.4	-60.6	-41.8	0	0	0	113.2
621	G	26.5	Very low	27.9	Very low	78 Å²	78	139 Å²	139	80%	0.804	78%	0.775	S	S	*	*			trans	-178.5	12.5	-176.3	0	0	0	0	0	123.6
622	N	28.1	Very low	27.8	Very low	130 Å²	130	139.7 Å²	139.7	70%	0.695	78%	0.783	S	S	*	*			trans	38.7	117.6	150.6	-174.9	71.9	0	0	0	122.8
623	K	27.4	Very low	27.8	Very low	196 Å²	196	143 Å²	143	85%	0.852	78%	0.784	S	S	*	*			trans	42	138.1	142	-59.4	177.8	-169.1	176.5	0	122.8
624	G	27.6	Very low	27.6	Very low	69 Å²	69	141.9 Å²	141.9	71%	0.711	77%	0.774	S	S	*	*			trans	147.6	87.3	156.3	0	0	0	0	0	111.7
625	Q	29.1	Very low	27.5	Very low	189 Å²	189	143.8 Å²	143.8	88%	0.883	78%	0.777	S	S	*	*				53.9	128.1	83.3	-78	-167.4	-39.4	0	0	116.3
626	S	26.3	Very low	27.3	Very low	112 Å²	112	141.2 Å²	141.2	78%	0.783	77%	0.772	S	S	*	*			trans	61.7	150.5	160.3	45.1	0	0	0	0	118.9
627	S	27.7	Very low	27.3	Very low	100 Å²	100	137.7 Å²	137.7	70%	0.699	77%	0.767	S	S	*	*			cis	-167.8	171.4	-21.2	53.3	0	0	0	0	110.2
628	S	28.4	Very low	27.2	Very low	90 Å²	90	135 Å²	135	63%	0.629	77%	0.766	S	S	*	*			trans	53.4	115	144.4	60.2	0	0	0	0	121.2
629	H	25.9	Very low	27.7	Very low	171 Å²	171	135.7 Å²	135.7	79%	0.792	77%	0.772	S	S	*	*				62.3	148.1	129.6	-73.4	-28.2	0	0	0	120.5
630	L	28	Very low	27.8	Very low	130 Å²	130	130.3 Å²	130.3	68%	0.681	77%	0.769	S	S	*	*			cis	-160.8	164.3	8.7	-116.8	161.1	0	0	0	110.5
631	T	25.8	Very low	28.3	Very low	134 Å²	134	133 Å²	133	82%	0.822	78%	0.777	S	S	*	*			trans	57.3	141	157.2	53.2	0	0	0	0	121.9
632	G	27.2	Very low	28.8	Very low	80 Å²	80	138.2 Å²	138.2	83%	0.825	78%	0.777	S	S	*	*			trans	159.5	72.7	162.5	0	0	0	0	0	118.4
633	K	27.5	Very low	29.3	Very low	179 Å²	179	140.9 Å²	140.9	78%	0.778	79%	0.786	S	S	*	*			trans	-21.4	143.3	172.7	-89.4	-179.1	154.7	-140.7	0	121.7
634	E	26.6	Very low	29.8	Very low	130 Å²	130	138.8 Å²	138.8	61%	0.607	78%	0.784	S	S	*	*			trans	76	119.9	138.4	-69.8	178.8	-129.4	0	0	122.5
635	K	27.2	Very low	30.3	Very low	186 Å²	186	144.4 Å²	144.4	81%	0.809	79%	0.789	S	S	*	*			trans	43.5	140.3	143.3	-56.1	179.1	-174.6	169.3	0	119.7
636	D	25.9	Very low	31.1	Very low	133 Å²	133	141.5 Å²	141.5	71%	0.711	79%	0.79	S	S	*	*			cis	-153.4	178	29.9	-165.1	32.8	0	0	0	113.7
637	T	27.4	Very low	32.3	Very low	123 Å²	123	138 Å²	138	76%	0.755	77%	0.771	S	S	*	*			trans	28.5	110.4	156.9	37.9	0	0	0	0	120.4
638	G	27.2	Very low	32.9	Very low	79 Å²	79	142.6 Å²	142.6	81%	0.814	78%	0.779	S	S	*	*			trans	-167.2	138.6	164.5	0	0	0	0	0	112.2
639	E	38.8	Very low	33.5	Very low	212 Å²	212	146.2 Å²	146.2	99%	0.991	79%	0.786	S	S	*	*			trans	-78.3	137.2	-172.5	-63.1	-178	116.7	0	0	113.1
640	G	29.9	Very low	34.4	Very low	71 Å²	71	142.9 Å²	142.9	73%	0.732	78%	0.778	S	S	*	*			trans	-134.8	139.5	179.4	0	0	0	0	0	111.9
641	Q	36.2	Very low	35.3	Very low	200 Å²	200	146.1 Å²	146.1	94%	0.935	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-76.1	145.3	-164.9	-66.9	168	-15.9	0	0	113.7
642	K	37.3	Very low	36.2	Very low	188 Å²	188	144 Å²	144	82%	0.817	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-79.2	122.6	175.4	-68.4	176	-178.8	170.7	0	111.1
643	Q	38.3	Very low	37	Very low	187 Å²	187	149.3 Å²	149.3	87%	0.874	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68.3	133.2	155.9	-74.5	-68.4	-6.7	0	0	109.4	F645	Q643-F645 PolarHBondContact O-N 2.74Å
644	N	37.9	Very low	38	Very low	152 Å²	152	145.3 Å²	145.3	81%	0.813	76%	0.764	S	S	*	*			trans	-86.1	98.4	-171.9	-81.5	-40.4	0	0	0	112	S646	N644-S646 PolarHBondContact O-N 2.82Å
645	F	36.8	Very low	39.1	Very low	187 Å²	187	147 Å²	147	82%	0.82	77%	0.772	S	S	*	*			trans	-74.2	109.5	177.9	-164.3	-91.7	0	0	0	111.8	Q643 G647	Q643-F645 PolarHBondContact O-N 2.74Å; F645-G647 VanDerWaalsContact C-N 3.32Å; F645-G647 PolarHBondContact O-N 3.2Å; F645-G647 VanDerWaalsContact O-N 3.1Å
646	S	45.9	Very low	40	Very low	128 Å²	128	143.8 Å²	143.8	90%	0.895	76%	0.76	S	S	*	*			trans	-87.8	58.4	-176.2	63.1	0	0	0	0	113.7	N644	N644-S646 PolarHBondContact O-N 2.82Å
647	G	53	Low	41.5	Very low	39 Å²	39	142.7 Å²	142.7	40%	0.402	76%	0.758	S	S	.	*	S	Bend	trans	-100.8	164	171.3	0	0	0	0	0	112.9	F645 Q649	F645-G647 VanDerWaalsContact C-N 3.32Å; F645-G647 PolarHBondContact O-N 3.2Å; F645-G647 VanDerWaalsContact O-N 3.1Å; G647-Q649 PolarHBondContact O-N 2.98Å
648	F	39.8	Very low	42.5	Very low	195 Å²	195	141.6 Å²	141.6	86%	0.855	75%	0.747	S	S	*	*			trans	-68.6	100.9	177.3	-171.7	-93.9	0	0	0	111.1	T650	F648-T650 HydrophobicContact CD1-CG2 4.13Å; F648-T650 HydrophobicContact CE1-CG2 3.75Å; F648-T650 PolarHBondContact O-N 3.18Å
649	Q	40.8	Very low	44	Very low	167 Å²	167	144.9 Å²	144.9	78%	0.78	75%	0.745	S	S	*	*			trans	-85.4	105.6	176.9	-72.9	-171.3	-13.9	0	0	111.5	G647	G647-Q649 PolarHBondContact O-N 2.98Å
650	T	44	Very low	45	Very low	100 Å²	100	144.3 Å²	144.3	61%	0.613	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-70.4	128.5	158.9	47	0	0	0	0	109.3	F648 P652	F648-T650 HydrophobicContact CD1-CG2 4.13Å; F648-T650 HydrophobicContact CE1-CG2 3.75Å; F648-T650 PolarHBondContact O-N 3.18Å; T650-P652 WeakPolarHBondContact O-CD 3.25Å
651	K	48.3	Very low	46.4	Very low	199 Å²	199	148.3 Å²	148.3	87%	0.865	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-83.2	116.8	172.1	-66.8	179.7	-177.8	176.2	0	108.3	E653	K651-E653 PolarHBondContact O-N 3.23Å
652	P	44	Very low	47.5	Very low	89 Å²	89	142.2 Å²	142.2	58%	0.578	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-72	127.6	171.2	29.6	-32.6	0	0	0	109.3	T650	T650-P652 WeakPolarHBondContact O-CD 3.25Å
653	E	44.6	Very low	48.4	Very low	192 Å²	192	142.5 Å²	142.5	90%	0.897	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-76.8	125.4	168.9	-169.3	159.4	-144	0	0	108.7	K651	K651-E653 PolarHBondContact O-N 3.23Å
654	I	48.6	Very low	49.1	Very low	94 Å²	94	140.5 Å²	140.5	48%	0.482	73%	0.728	S	S	.	*			trans	-117.6	86.5	-171.5	-50.4	179.6	0	0	0	109.7	H656	I654-H656 PolarHBondContact O-ND1 3.06Å
655	E	49.6	Very low	49.8	Very low	166 Å²	166	144 Å²	144	78%	0.776	73%	0.73	S	S	*	*			trans	-64.5	134.3	169.4	-166.3	176.4	-134.9	0	0	110.4
656	H	46.6	Very low	50.8	Low	119 Å²	119	143.2 Å²	143.2	55%	0.551	73%	0.726	S	S	*	*			trans	-113.2	121.3	-179.2	-75.6	72.4	0	0	0	109.9	I654	I654-H656 PolarHBondContact O-ND1 3.06Å
657	V	55.6	Low	50.9	Low	110 Å²	110	145.7 Å²	145.7	67%	0.667	72%	0.721	S	S	*	*			trans	-108.7	115.4	173.1	-177.7	0	0	0	0	108.6
658	D	48.8	Very low	50.7	Low	99 Å²	99	149.8 Å²	149.8	53%	0.529	74%	0.738	S	S	.	*			trans	-82.6	143	173	-76.9	-40.7	0	0	0	111	K664	D658-K664 WeakPolarHBondContact OD1-CD 3.28Å; D658-K664 WeakPolarHBondContact OD1-CE 3.37Å; D658-K664 WeakPolarHBondContact OD1-CG 3.36Å; D658-K664 IonicContact OD1-NZ 2.74Å; D658-K664 PolarHBondContact OD1-NZ 2.85Å; D658-K664 IonicContact OD2-NZ 3.09Å; D658-K664 PolarHBondContact OD2-NZ 3.13Å
659	L	59.9	Low	51.2	Low	148 Å²	148	146.3 Å²	146.3	78%	0.775	73%	0.727	S	S	*	*			trans	-124	149.3	173.9	-72.9	171.6	0	0	0	109.1	N661 G662	L659-N661 PolarHBondContact O-N 3.38Å; L659-G662 PolarHBondContact O-N 3.43Å
660	Q	58.7	Low	51.6	Low	201 Å²	201	144.1 Å²	144.1	94%	0.939	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-18.8	-162.3	-70.4	172.1	-27	0	0	116	G662	Q660-G662 PolarHBondContact O-N 3.02Å
661	N	59.6	Low	51.9	Low	154 Å²	154	146.9 Å²	146.9	82%	0.824	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	39.1	178.3	-71.7	-7.7	0	0	0	114.3	L659 K663	L659-N661 PolarHBondContact O-N 3.38Å; N661-K663 PolarHBondContact O-N 3.05Å
662	G	59.1	Low	51.7	Low	73 Å²	73	143.3 Å²	143.3	75%	0.753	73%	0.728	S	S	*	*	S	Bend	trans	65.3	-7.4	154.2	0	0	0	0	0	119.6	L659 Q660	L659-G662 PolarHBondContact O-N 3.43Å; Q660-G662 PolarHBondContact O-N 3.02Å
663	K	57.4	Low	51.8	Low	194 Å²	194	143.8 Å²	143.8	84%	0.843	73%	0.734	S	S	*	*			trans	-108.4	97.8	-175.4	-69.2	-176.3	179.8	178.9	0	111.7	N661 R665	N661-K663 PolarHBondContact O-N 3.05Å; K663-R665 PolarHBondContact O-N 2.8Å
664	K	51.9	Low	51.9	Low	144 Å²	144	144.2 Å²	144.2	63%	0.626	74%	0.735	S	S	*	*			trans	-63	128.6	179	-52.5	-162.2	-178.2	-126.5	0	111.2	D658	D658-K664 WeakPolarHBondContact OD1-CD 3.28Å; D658-K664 WeakPolarHBondContact OD1-CE 3.37Å; D658-K664 WeakPolarHBondContact OD1-CG 3.36Å; D658-K664 IonicContact OD1-NZ 2.74Å; D658-K664 PolarHBondContact OD1-NZ 2.85Å; D658-K664 IonicContact OD2-NZ 3.09Å; D658-K664 PolarHBondContact OD2-NZ 3.13Å
665	R	52.7	Low	51.7	Low	227 Å²	227	150.8 Å²	150.8	86%	0.857	75%	0.754	S	S	*	*			trans	-118.3	129.1	170.9	-74.9	-174.8	64.5	138.3	-0.5	109.8	K663 K667	K663-R665 PolarHBondContact O-N 2.8Å; R665-K667 PolarHBondContact O-N 3.22Å
666	K	57.1	Low	51.5	Low	170 Å²	170	145.9 Å²	145.9	74%	0.739	75%	0.748	S	S	*	*			trans	-68	123.7	170.8	-63.5	-176.9	179.7	-177.7	0	109.2
667	K	49.7	Very low	51.4	Low	180 Å²	180	145.8 Å²	145.8	78%	0.783	76%	0.758	S	S	*	*			trans	-99.9	102.5	173.9	-165	-177.8	-175.1	-173	0	107.7	R665 L669	R665-K667 PolarHBondContact O-N 3.22Å; K667-L669 PolarHBondContact O-N 3.39Å
668	V	47.4	Very low	50.7	Low	125 Å²	125	150.5 Å²	150.5	76%	0.758	77%	0.769	S	S	*	*			trans	-73.1	114.5	174.9	-179.1	0	0	0	0	107.7
669	L	50.5	Low	50.4	Low	122 Å²	122	152.7 Å²	152.7	64%	0.639	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-68.9	135	169	-67.7	173.9	0	0	0	108.8	K667 F671	K667-L669 PolarHBondContact O-N 3.39Å; L669-F671 PolarHBondContact O-N 3.04Å
670	P	50	Low	49.7	Very low	120 Å²	120	155.7 Å²	155.7	78%	0.779	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.7	125.6	174.4	28.3	-32.7	0	0	0	109.5
671	F	50.2	Low	49	Very low	159 Å²	159	155.2 Å²	155.2	70%	0.697	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.9	169.7	-78.9	-85.9	0	0	0	110.4	L669 S673	L669-F671 PolarHBondContact O-N 3.04Å; F671-S673 PolarHBondContact O-N 2.84Å
672	P	44.5	Very low	48.5	Very low	123 Å²	123	158.7 Å²	158.7	80%	0.799	78%	0.782	S	S	*	*			trans	-57.3	114.4	171.1	-22.6	33.5	0	0	0	110.1	H674	P672-H674 PolarHBondContact O-N 2.76Å
673	S	44.7	Very low	48	Very low	100 Å²	100	162.2 Å²	162.2	70%	0.699	78%	0.784	S	S	*	*			trans	-69.9	119.8	178	48.5	0	0	0	0	109.5	F671 R675	F671-S673 PolarHBondContact O-N 2.84Å; S673-R675 PolarHBondContact O-N 2.86Å
674	H	47.2	Very low	47.1	Very low	201 Å²	201	161.8 Å²	161.8	93%	0.931	78%	0.782	S	S	*	*	S	Bend	trans	-74.5	35.4	-179.8	-141.9	-78.8	0	0	0	113.7	P672	P672-H674 PolarHBondContact O-N 2.76Å
675	R	45.6	Very low	46.6	Very low	232 Å²	232	162.4 Å²	162.4	88%	0.875	79%	0.792	S	S	*	*			trans	-134.4	82.9	167.5	-80.2	-172.1	170.4	-171.5	-1.9	107.7	S673	S673-R675 PolarHBondContact O-N 2.86Å
676	G	43.7	Very low	45.8	Very low	63 Å²	63	161.1 Å²	161.1	65%	0.649	79%	0.793	S	S	*	*			trans	-61.3	152.5	165.7	0	0	0	0	0	110.8	K678	G676-K678 PolarHBondContact O-N 3.42Å
677	P	45.1	Very low	44.9	Very low	116 Å²	116	162.8 Å²	162.8	75%	0.753	80%	0.803	S	S	*	*			trans	-60.6	135	173.9	26.4	-33.6	0	0	0	109.9	I679	P677-I679 VanDerWaalsContact C-N 3.29Å; P677-I679 PolarHBondContact O-N 3.28Å
678	K	41	Very low	44.2	Very low	209 Å²	209	163 Å²	163	91%	0.909	81%	0.807	S	S	*	*			trans	-74.7	78.7	-174.6	-159.7	169.3	-168.6	174	0	110.8	G676 R680	G676-K678 PolarHBondContact O-N 3.42Å; K678-R680 PolarHBondContact O-N 2.82Å
679	I	43.6	Very low	43.5	Very low	145 Å²	145	164 Å²	164	74%	0.744	81%	0.813	S	S	*	*			trans	-55.7	123.4	177	-63.3	172.1	0	0	0	108.6	P677	P677-I679 VanDerWaalsContact C-N 3.29Å; P677-I679 PolarHBondContact O-N 3.28Å
680	R	44.8	Very low	43.5	Very low	212 Å²	212	163.6 Å²	163.6	80%	0.8	82%	0.818	S	S	*	*			trans	-81.4	134.2	173.3	-71	178.2	171.4	172.7	-4.1	109.2	K678 R682	K678-R680 PolarHBondContact O-N 2.82Å; R680-R682 PolarHBondContact O-N 2.81Å
681	M	43.5	Very low	43.3	Very low	191 Å²	191	163.4 Å²	163.4	94%	0.941	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	73	172.3	-72.9	-77.7	-82.9	0	0	110.5
682	R	49.3	Very low	43.1	Very low	227 Å²	227	160.8 Å²	160.8	86%	0.857	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.5	-14.9	173.2	-136.1	172.2	-163.2	144.2	10.5	115.8	R680	R680-R682 PolarHBondContact O-N 2.81Å
683	D	47.5	Very low	42.5	Very low	147 Å²	147	164 Å²	164	79%	0.786	82%	0.817	S	S	*	*	S	Bend	trans	-116	34	-174.9	-64	-66.5	0	0	0	113.5
684	K	39.3	Very low	42	Very low	184 Å²	184	168.1 Å²	168.1	80%	0.8	82%	0.822	S	S	*	*			trans	-116.7	94.4	160.8	-82.3	-171.7	173.3	-175.6	0	109.1
685	D	42	Very low	41.3	Very low	158 Å²	158	164.9 Å²	164.9	85%	0.845	82%	0.817	S	S	*	*			trans	162.1	91.3	132.4	-81.2	-5.5	0	0	0	110.6
686	K	35.8	Very low	40.8	Very low	200 Å²	200	163.4 Å²	163.4	87%	0.87	82%	0.817	S	S	*	*			trans	-144.2	82.7	169.7	-73.8	-173.1	-179	164.8	0	110.8
687	Q	37.4	Very low	40.7	Very low	205 Å²	205	166.8 Å²	166.8	96%	0.958	83%	0.827	S	S	*	*			trans	-98.7	143	149.5	-72.8	-174.9	-17.2	0	0	108.3
688	Q	34.3	Very low	40	Very low	185 Å²	185	165.1 Å²	165.1	86%	0.864	83%	0.831	S	S	*	*			trans	-111.4	142	-179.2	-66.7	-177.3	1.3	0	0	110.9
689	V	34.5	Very low	39.7	Very low	145 Å²	145	160.4 Å²	160.4	88%	0.879	83%	0.825	S	S	*	*			trans	-150	153.8	135.2	-104.9	0	0	0	0	110.1
690	P	50	Low	39.3	Very low	113 Å²	113	162.4 Å²	162.4	73%	0.734	83%	0.828	S	S	*	*			trans	-92.8	-170.1	-172.7	42.5	-39.5	0	0	0	111.6
691	P	46	Very low	38.8	Very low	117 Å²	117	162.1 Å²	162.1	76%	0.76	83%	0.827	S	S	*	*			cis	-143.2	-144.8	15.8	41.5	-16.8	0	0	0	114
692	P	44.7	Very low	38.3	Very low	103 Å²	103	158.9 Å²	158.9	67%	0.669	81%	0.813	S	S	*	*				-126.9	144.6	-50.6	25.3	-5	0	0	0	117.2
693	K	33.1	Very low	37.4	Very low	191 Å²	191	155.6 Å²	155.6	83%	0.83	81%	0.805	S	S	*	*			trans	57.7	130.7	134.3	-68.4	176.4	177	170.5	0	124.5
694	K	33.8	Very low	36.7	Very low	186 Å²	186	158.6 Å²	158.6	81%	0.809	81%	0.806	S	S	*	*			trans	77	149.1	150.8	-66.6	176.1	178.5	-174.9	0	117.6
695	T	31.4	Very low	36.4	Very low	134 Å²	134	156.1 Å²	156.1	82%	0.822	80%	0.797	S	S	*	*			cis	-153.2	169.7	-3.5	0.5	0	0	0	0	112.6
696	K	35.2	Very low	35.9	Very low	201 Å²	201	154.7 Å²	154.7	87%	0.874	79%	0.794	S	S	*	*			trans	-85.2	-176	168.2	-48.8	-179.3	-179.2	179.3	0	110.9
697	P	42.8	Very low	35.8	Very low	133 Å²	133	151.2 Å²	151.2	86%	0.864	78%	0.781	S	S	*	*			cis	-138.4	-166.8	-4.1	44.4	-26.2	0	0	0	114.9
698	G	29.9	Very low	35.5	Very low	81 Å²	81	148.4 Å²	148.4	84%	0.835	77%	0.767	S	S	*	*			trans	146.2	121.6	149.9	0	0	0	0	0	118.8
699	S	35.9	Very low	35.3	Very low	111 Å²	111	147.2 Å²	147.2	78%	0.776	76%	0.76	S	S	*	*			trans	-102.5	150.9	-179.7	166.3	0	0	0	0	113.6
700	K	34.5	Very low	35.1	Very low	187 Å²	187	145.8 Å²	145.8	81%	0.813	74%	0.744	S	S	*	*				171.2	144.8	123	-94	162.6	-174.8	173.7	0	118.4
701	R	33.4	Very low	34.2	Very low	205 Å²	205	148 Å²	148	77%	0.774	74%	0.742	S	S	*	*			trans	72.2	118.7	138.7	-81.7	174	55.8	142	-7.5	124.2
702	N	32.7	Very low	34	Very low	124 Å²	124	148.4 Å²	148.4	66%	0.663	74%	0.744	S	S	*	*				73.9	160.8	124.6	-70.5	0.7	0	0	0	122.3
703	K	31.8	Very low	33.3	Very low	157 Å²	157	150.6 Å²	150.6	68%	0.683	75%	0.75	S	S	*	*			cis	175.9	138.9	-29.1	-176.5	172.3	-173.3	175.9	0	110.6
704	R	33.1	Very low	33.3	Very low	211 Å²	211	150.9 Å²	150.9	80%	0.796	76%	0.755	S	S	*	*			trans	68.1	165.4	168	-86	172.1	174.3	-177.5	-6	115.3
705	Q	31.7	Very low	33.2	Very low	131 Å²	131	146.1 Å²	146.1	61%	0.612	75%	0.75	S	S	*	*			cis	-150	147.9	12.8	-135.8	168	130.5	0	0	109.8
706	T	31.6	Very low	33.1	Very low	128 Å²	128	149.4 Å²	149.4	79%	0.785	75%	0.753	S	S	*	*				-155.5	146.4	85.3	34.5	0	0	0	0	110.3
707	Q	33.2	Very low	32.9	Very low	128 Å²	128	149.9 Å²	149.9	60%	0.598	76%	0.755	S	S	*	*				57.3	108	72.9	-55.1	-164.9	42.2	0	0	113.2
708	Q	31.8	Very low	32.5	Very low	145 Å²	145	152.3 Å²	152.3	68%	0.678	75%	0.754	S	S	*	*				85.4	144.6	51.4	-67.1	169.7	-108.8	0	0	112.5
709	F	30.7	Very low	32.4	Very low	161 Å²	161	158.9 Å²	158.9	71%	0.706	76%	0.76	S	S	*	*			cis	-169.4	173.5	7	-112.9	0.4	0	0	0	108.5
710	E	28.8	Very low	32.3	Very low	115 Å²	115	163.4 Å²	163.4	54%	0.537	77%	0.766	S	S	.	*			cis	-167.4	166	-4.1	-133.5	-169.5	143	0	0	111.9
711	K	31.9	Very low	32.1	Very low	160 Å²	160	160.3 Å²	160.3	70%	0.696	77%	0.768	S	S	*	*			trans	67.3	165.5	148.6	-77.7	165.3	-180	138.9	0	121.9
712	P	41.8	Very low	32	Very low	125 Å²	125	155.3 Å²	155.3	81%	0.812	77%	0.77	S	S	*	*			cis	-127	178.5	-10.9	28.6	-6.8	0	0	0	116
713	N	29.5	Very low	32.1	Very low	148 Å²	148	155.7 Å²	155.7	79%	0.791	78%	0.777	S	S	*	*			trans	-95.9	152.3	179	-123.6	-28.2	0	0	0	112.9
714	Q	34.1	Very low	32.2	Very low	198 Å²	198	157.8 Å²	157.8	93%	0.925	79%	0.787	S	S	*	*				-169.9	172.1	129.2	-107	173.9	80.5	0	0	113.2
715	A	30.4	Very low	32.2	Very low	85 Å²	85	156.5 Å²	156.5	70%	0.702	79%	0.789	S	S	*	*			trans	-150.1	173.8	-147.8	0	0	0	0	0	117.3
716	K	29.4	Very low	32.2	Very low	203 Å²	203	160.2 Å²	160.2	88%	0.883	80%	0.804	S	S	*	*			trans	79.1	119.1	167.9	-59.2	177.1	178	175.1	0	118.3
717	K	31.2	Very low	32.6	Very low	212 Å²	212	161.4 Å²	161.4	92%	0.922	80%	0.798	S	S	*	*				-160.3	164.1	100.4	-102.2	169.6	-174.9	176.8	0	111
718	Q	34.1	Very low	32.9	Very low	183 Å²	183	166.1 Å²	166.1	86%	0.855	81%	0.811	S	S	*	*			trans	-98.6	146.7	179.4	-64.4	172.4	-34.7	0	0	110.6
719	F	29.3	Very low	33.7	Very low	219 Å²	219	168 Å²	168	96%	0.961	82%	0.816	S	S	*	*			trans	-145.7	160.3	148	-109.5	-80.8	0	0	0	110.4
720	K	33.9	Very low	34.5	Very low	207 Å²	207	166.4 Å²	166.4	90%	0.9	82%	0.815	S	S	*	*			trans	-110.1	137	-174.5	-59.8	174.2	-177	173.2	0	111.3
721	S	28.7	Very low	35.6	Very low	121 Å²	121	162.7 Å²	162.7	85%	0.846	81%	0.808	S	S	*	*			trans	-149.7	158.9	148.3	61.3	0	0	0	0	108.5
722	A	33	Very low	36.7	Very low	100 Å²	100	159.2 Å²	159.2	83%	0.826	80%	0.797	S	S	*	*			trans	-119.5	112.4	-163.5	0	0	0	0	0	113.1
723	T	33.1	Very low	37.9	Very low	132 Å²	132	163.1 Å²	163.1	81%	0.81	80%	0.796	S	S	*	*			trans	-97.7	108.1	177.6	-35.8	0	0	0	0	110.7	Q725	T723-Q725 PolarHBondContact O-N 3.42Å; T723-Q725 VanDerWaalsContact O-N 3.16Å
724	K	33.9	Very low	39.2	Very low	202 Å²	202	162.8 Å²	162.8	88%	0.878	79%	0.787	S	S	*	*			trans	-74.8	99.8	173.3	-74.7	-179.6	178.5	174.3	0	110.3
725	Q	33.1	Very low	41.1	Very low	183 Å²	183	157.9 Å²	157.9	86%	0.855	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-75.1	129.1	168.7	-73.7	-175.6	-23.3	0	0	111.1	T723	T723-Q725 PolarHBondContact O-N 3.42Å; T723-Q725 VanDerWaalsContact O-N 3.16Å
726	F	33.8	Very low	43.3	Very low	209 Å²	209	156.8 Å²	156.8	92%	0.917	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-73.2	126.1	170.2	-100.4	-102.8	0	0	0	110.4
727	K	39.8	Very low	45.4	Very low	153 Å²	153	152.4 Å²	152.4	67%	0.665	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-68.6	132.4	176.7	-78.5	-170.8	161.5	-126.7	0	112	D732	K727-D732 IonicContact NZ-OD1 2.82Å; K727-D732 PolarHBondContact NZ-OD1 3.27Å; K727-D732 IonicContact NZ-OD2 2.65Å; K727-D732 PolarHBondContact NZ-OD2 3.16Å
728	R	38.1	Very low	47.4	Very low	228 Å²	228	144.3 Å²	144.3	86%	0.86	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-77.4	135.3	158.3	-68.1	-175.7	177	-173	-0.8	108.6	D730	R728-D730 PolarHBondContact O-N 2.96Å
729	K	48.3	Very low	49.1	Very low	183 Å²	183	141.8 Å²	141.8	80%	0.796	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-11.7	-161.5	-155.6	170.9	-178	178.3	0	114.7
730	D	48.1	Very low	51.1	Low	128 Å²	128	137.5 Å²	137.5	68%	0.684	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-25.4	-168.5	-51.2	-74.6	0	0	0	113.9	R728 R733 F734	R728-D730 PolarHBondContact O-N 2.96Å; D730-R733 PolarHBondContact O-N 2.65Å; D730-F734 PolarHBondContact O-N 3.34Å
731	G	51.8	Low	52.4	Low	38 Å²	38	135.3 Å²	135.3	39%	0.392	67%	0.667	S	S	.	*	H	α-helix	trans	-63.5	-52.1	176.8	0	0	0	0	0	112.4	R733 F734 D735	G731-R733 PolarHBondContact O-N 2.82Å; G731-F734 PolarHBondContact O-N 3.01Å; G731-D735 PolarHBondContact O-N 2.93Å
732	D	56	Low	54.2	Low	86 Å²	86	135.4 Å²	135.4	46%	0.46	65%	0.652	S	S	.	*	H	α-helix	trans	-49.4	-30.5	176	-74	8.3	0	0	0	112.7	K727 S736	K727-D732 IonicContact NZ-OD1 2.82Å; K727-D732 PolarHBondContact NZ-OD1 3.27Å; K727-D732 IonicContact NZ-OD2 2.65Å; K727-D732 PolarHBondContact NZ-OD2 3.16Å; D732-S736 VanDerWaalsContact O-CB 3.24Å; D732-S736 WeakPolarHBondContact O-CB 3.44Å; D732-S736 PolarHBondContact O-N 3.35Å
733	R	66	Low	55.8	Low	207 Å²	207	140 Å²	140	78%	0.781	65%	0.648	S	S	*	*	H	α-helix	trans	-79.9	-37.6	178.6	-173.1	177	-178.1	177	0.7	113.1	D730 G731 L737	D730-R733 PolarHBondContact O-N 2.65Å; G731-R733 PolarHBondContact O-N 2.82Å; R733-L737 PolarHBondContact O-N 3.26Å
734	F	58.1	Low	57.3	Low	141 Å²	141	142.3 Å²	142.3	62%	0.618	65%	0.647	S	S	*	*	H	α-helix	trans	-69.3	-48	176.2	-178.2	-100.2	0	0	0	110.7	D730 G731 S736 L737 V738	D730-F734 PolarHBondContact O-N 3.34Å; G731-F734 PolarHBondContact O-N 3.01Å; F734-S736 VanDerWaalsContact C-N 3.35Å; F734-S736 PolarHBondContact O-N 3.49Å; F734-L737 WeakPolarHBondContact O-CB 3.47Å; F734-L737 PolarHBondContact O-N 3.22Å; F734-L737 VanDerWaalsContact O-N 3.08Å; F734-V738 HydrophobicContact CD1-CG2 4.04Å; F734-V738 HydrophobicContact CE1-CG2 3.69Å; F734-V738 HydrophobicContact CE2-CG2 4.38Å; F734-V738 HydrophobicContact CZ-CG2 3.88Å; F734-V738 WeakPolarHBondContact O-CG2 3.24Å; F734-V738 PolarHBondContact O-N 3.37Å
735	D	72.6	Confident	58.5	Low	96 Å²	96	138.8 Å²	138.8	51%	0.513	64%	0.637	S	S	.	*	H	α-helix	trans	-62.6	-40.8	179.9	-70.6	-41.7	0	0	0	111.9	G731 L737 V738 E739	G731-D735 PolarHBondContact O-N 2.93Å; D735-L737 VanDerWaalsContact C-N 3.31Å; D735-L737 PolarHBondContact O-N 2.91Å; D735-V738 PolarHBondContact O-N 3.08Å; D735-E739 WeakPolarHBondContact O-CG 3.46Å; D735-E739 PolarHBondContact O-N 2.96Å
736	S	76.4	Confident	60.1	Low	61 Å²	61	137.1 Å²	137.1	43%	0.427	63%	0.633	S	S	.	*	H	α-helix	trans	-60.3	-38.2	173.5	-173.7	0	0	0	0	112.8	D732 F734 E739 Q740	D732-S736 VanDerWaalsContact O-CB 3.24Å; D732-S736 WeakPolarHBondContact O-CB 3.44Å; D732-S736 PolarHBondContact O-N 3.35Å; F734-S736 VanDerWaalsContact C-N 3.35Å; F734-S736 PolarHBondContact O-N 3.49Å; S736-E739 PolarHBondContact O-N 3.41Å; S736-Q740 WeakPolarHBondContact O-CG 3.37Å; S736-Q740 PolarHBondContact O-N 2.81Å
737	L	73.6	Confident	60.8	Low	112 Å²	112	129.7 Å²	129.7	59%	0.586	62%	0.616	S	S	*	*	H	α-helix	trans	-70.3	-39.5	176.7	-155.4	76.2	0	0	0	111.5	R733 F734 D735 Q740 Y741	R733-L737 PolarHBondContact O-N 3.26Å; F734-L737 WeakPolarHBondContact O-CB 3.47Å; F734-L737 PolarHBondContact O-N 3.22Å; F734-L737 VanDerWaalsContact O-N 3.08Å; D735-L737 VanDerWaalsContact C-N 3.31Å; D735-L737 PolarHBondContact O-N 2.91Å; L737-Q740 PolarHBondContact O-N 3.39Å; L737-Y741 WeakPolarHBondContact O-CB 3.41Å; L737-Y741 PolarHBondContact O-N 2.92Å
738	V	73.1	Confident	61.6	Low	41 Å²	41	126.2 Å²	126.2	25%	0.248	62%	0.624	C	S	.	*	H	α-helix	trans	-65.2	-39.3	174.5	168.8	0	0	0	0	111.3	F734 D735 Y741 K742	F734-V738 HydrophobicContact CD1-CG2 4.04Å; F734-V738 HydrophobicContact CE1-CG2 3.69Å; F734-V738 HydrophobicContact CE2-CG2 4.38Å; F734-V738 HydrophobicContact CZ-CG2 3.88Å; F734-V738 WeakPolarHBondContact O-CG2 3.24Å; F734-V738 PolarHBondContact O-N 3.37Å; D735-V738 PolarHBondContact O-N 3.08Å; V738-Y741 PolarHBondContact O-N 3.36Å; V738-K742 HydrophobicContact CG1-CD 3.9Å; V738-K742 VanDerWaalsContact CG1-CE 3.42Å; V738-K742 HydrophobicContact CG1-CG 4.46Å; V738-K742 WeakPolarHBondContact O-CB 3.25Å; V738-K742 VanDerWaalsContact O-CG 3.25Å; V738-K742 WeakPolarHBondContact O-CG 3.42Å; V738-K742 PolarHBondContact O-N 3.42Å
739	E	70.3	Confident	61.8	Low	130 Å²	130	122.8 Å²	122.8	61%	0.607	62%	0.622	S	S	*	*	H	α-helix	trans	-66.3	-43	173	-75.4	-160.1	141.3	0	0	112.5	D735 S736 Y741 K742 R743	D735-E739 WeakPolarHBondContact O-CG 3.46Å; D735-E739 PolarHBondContact O-N 2.96Å; S736-E739 PolarHBondContact O-N 3.41Å; E739-Y741 VanDerWaalsContact C-N 3.3Å; E739-Y741 PolarHBondContact O-N 3.14Å; E739-K742 PolarHBondContact O-N 2.89Å; E739-R743 WeakPolarHBondContact O-CB 3.46Å; E739-R743 WeakPolarHBondContact O-CG 3.39Å; E739-R743 PolarHBondContact O-N 3.44Å
740	Q	71.3	Confident	61.9	Low	129 Å²	129	123.3 Å²	123.3	60%	0.603	62%	0.624	S	S	*	*	H	α-helix	trans	-58.4	-44.1	172.4	-78.9	-169.7	-11.4	0	0	111.2	S736 L737 R743 K744	S736-Q740 WeakPolarHBondContact O-CG 3.37Å; S736-Q740 PolarHBondContact O-N 2.81Å; L737-Q740 PolarHBondContact O-N 3.39Å; Q740-R743 PolarHBondContact O-N 2.98Å; Q740-K744 WeakPolarHBondContact O-CB 3.39Å; Q740-K744 PolarHBondContact O-N 3.39Å
741	Y	61.6	Low	62	Low	162 Å²	162	125.1 Å²	125.1	64%	0.635	63%	0.634	S	S	*	*	H	α-helix	trans	-67.7	-42	179.7	-148.6	-101	0	0	0	112.2	L737 V738 E739 K744 L745	L737-Y741 WeakPolarHBondContact O-CB 3.41Å; L737-Y741 PolarHBondContact O-N 2.92Å; V738-Y741 PolarHBondContact O-N 3.36Å; E739-Y741 VanDerWaalsContact C-N 3.3Å; E739-Y741 PolarHBondContact O-N 3.14Å; Y741-K744 PolarHBondContact O-N 2.93Å; Y741-K744 VanDerWaalsContact O-N 3.14Å; Y741-L745 HydrophobicContact CD1-CD1 3.51Å; Y741-L745 HydrophobicContact CE1-CD1 3.39Å; Y741-L745 HydrophobicContact CG-CD1 4.47Å; Y741-L745 PolarHBondContact O-N 3.26Å
742	K	66.6	Low	61.3	Low	123 Å²	123	127.1 Å²	127.1	54%	0.535	65%	0.647	S	S	.	*	H	α-helix	trans	-59.6	-45.6	172.9	-75.8	167.6	179.6	169.9	0	111.8	V738 E739 K744 L745 L746	V738-K742 HydrophobicContact CG1-CD 3.9Å; V738-K742 VanDerWaalsContact CG1-CE 3.42Å; V738-K742 HydrophobicContact CG1-CG 4.46Å; V738-K742 WeakPolarHBondContact O-CB 3.25Å; V738-K742 VanDerWaalsContact O-CG 3.25Å; V738-K742 WeakPolarHBondContact O-CG 3.42Å; V738-K742 PolarHBondContact O-N 3.42Å; E739-K742 PolarHBondContact O-N 2.89Å; K742-K744 VanDerWaalsContact C-N 3.25Å; K742-K744 PolarHBondContact O-N 3.01Å; K742-L745 PolarHBondContact O-N 3.4Å; K742-L746 WeakPolarHBondContact O-CB 3.34Å; K742-L746 WeakPolarHBondContact O-CG 3.34Å; K742-L746 PolarHBondContact O-N 2.87Å
743	R	66.3	Low	61	Low	195 Å²	195	129.2 Å²	129.2	74%	0.736	67%	0.668	S	S	*	*	H	α-helix	trans	-65.1	-27.2	175.2	-71.9	178	69.4	168.9	-0.9	113	E739 Q740	E739-R743 WeakPolarHBondContact O-CB 3.46Å; E739-R743 WeakPolarHBondContact O-CG 3.39Å; E739-R743 PolarHBondContact O-N 3.44Å; Q740-R743 PolarHBondContact O-N 2.98Å
744	K	64.7	Low	59.8	Low	181 Å²	181	126.6 Å²	126.6	79%	0.787	67%	0.668	S	S	*	*	H	α-helix	trans	-80.5	-29	175.7	-149.7	172.1	-172.1	179.5	0	113	Q740 Y741 K742	Q740-K744 WeakPolarHBondContact O-CB 3.39Å; Q740-K744 PolarHBondContact O-N 3.39Å; Y741-K744 PolarHBondContact O-N 2.93Å; Y741-K744 VanDerWaalsContact O-N 3.14Å; K742-K744 VanDerWaalsContact C-N 3.25Å; K742-K744 PolarHBondContact O-N 3.01Å
745	L	58.3	Low	59.4	Low	129 Å²	129	129.5 Å²	129.5	68%	0.675	68%	0.681	S	S	*	*	H	α-helix	trans	-78.7	-35.3	173.6	-106.3	96.6	0	0	0	114	Y741 K742	Y741-L745 HydrophobicContact CD1-CD1 3.51Å; Y741-L745 HydrophobicContact CE1-CD1 3.39Å; Y741-L745 HydrophobicContact CG-CD1 4.47Å; Y741-L745 PolarHBondContact O-N 3.26Å; K742-L745 PolarHBondContact O-N 3.4Å
746	L	66.5	Low	57.9	Low	147 Å²	147	136.9 Å²	136.9	77%	0.77	70%	0.701	S	S	*	*	S	Bend	trans	-87.4	-4	-168	-72.6	168.5	0	0	0	115.4	K742	K742-L746 WeakPolarHBondContact O-CB 3.34Å; K742-L746 WeakPolarHBondContact O-CG 3.34Å; K742-L746 PolarHBondContact O-N 2.87Å
747	G	48.8	Very low	56.3	Low	54 Å²	54	138.8 Å²	138.8	56%	0.557	71%	0.714	S	S	*	*			trans	81.6	138.2	-175.3	0	0	0	0	0	112.6	D749	G747-D749 PolarHBondContact O-N 3.38Å
748	G	57.2	Low	55	Low	80 Å²	80	143.9 Å²	143.9	83%	0.825	73%	0.732	S	S	*	*	S	Bend	trans	-88.3	34.4	-167.6	0	0	0	0	0	116.4
749	D	42.7	Very low	53.3	Low	156 Å²	156	153.2 Å²	153.2	83%	0.834	76%	0.763	S	S	*	*			trans	-111.3	130.4	-174	-96.3	-53.5	0	0	0	114.9	G747 N751	G747-D749 PolarHBondContact O-N 3.38Å; D749-N751 PolarHBondContact O-N 3.23Å
750	K	50.8	Low	51.7	Low	193 Å²	193	156.3 Å²	156.3	84%	0.839	78%	0.775	S	S	*	*	S	Bend	trans	-95.5	48.9	-177.3	-65.2	-176.8	179.9	176.7	0	113
751	N	48.3	Very low	50.3	Low	167 Å²	167	157.8 Å²	157.8	89%	0.893	79%	0.787	S	S	*	*			trans	-174.3	84.3	159.3	-97.4	-23	0	0	0	112.5	D749	D749-N751 PolarHBondContact O-N 3.23Å
752	A	38.3	Very low	49.2	Very low	79 Å²	79	159.6 Å²	159.6	65%	0.653	82%	0.823	S	S	*	*			trans	-149.5	114.5	165.4	0	0	0	0	0	111.3	I754	A752-I754 HydrophobicContact CB-CG1 4.44Å; A752-I754 PolarHBondContact O-N 2.96Å; A752-I754 VanDerWaalsContact O-N 3.17Å
753	S	49.2	Very low	48.4	Very low	130 Å²	130	161.4 Å²	161.4	91%	0.909	84%	0.837	S	S	*	*			trans	-86.9	78.6	-178.1	46	0	0	0	0	112.2
754	I	41.5	Very low	47.4	Very low	153 Å²	153	159.6 Å²	159.6	79%	0.785	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-92.5	129.8	-179.4	-58.8	-179.5	0	0	0	111.1	A752	A752-I754 HydrophobicContact CB-CG1 4.44Å; A752-I754 PolarHBondContact O-N 2.96Å; A752-I754 VanDerWaalsContact O-N 3.17Å
755	K	49.2	Very low	46.5	Very low	201 Å²	201	158.4 Å²	158.4	87%	0.874	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-73.8	127.4	-174.5	-61.8	173.7	-176.7	174.4	0	110.9
756	R	42.2	Very low	45.8	Very low	252 Å²	252	160.2 Å²	160.2	95%	0.951	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-62.3	133.4	172.9	-83.2	178.6	151.2	107.2	-7.9	111.2
757	S	41.8	Very low	44.5	Very low	100 Å²	100	161 Å²	161	70%	0.699	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-96.1	154.5	170.1	55.5	0	0	0	0	111.4	W759	S757-W759 VanDerWaalsContact C-N 3.28Å; S757-W759 PolarHBondContact O-N 3.17Å
758	K	45.5	Very low	44.2	Very low	220 Å²	220	168.1 Å²	168.1	96%	0.957	88%	0.881	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	55.1	-170.7	-63.5	-176	172.7	-173.9	0	114.1
759	W	37.8	Very low	43.2	Very low	236 Å²	236	174.4 Å²	174.4	89%	0.894	89%	0.886	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	-3	176.8	-143.6	-68.1	0	0	0	113.8	S757	S757-W759 VanDerWaalsContact C-N 3.28Å; S757-W759 PolarHBondContact O-N 3.17Å
760	F	37.3	Very low	43.3	Very low	195 Å²	195	175.8 Å²	175.8	86%	0.855	89%	0.889	S	S	*	*	S	Bend	trans	-110	16.2	-166.2	-115.1	-74.8	0	0	0	116.2
761	D	41.8	Very low	42.7	Very low	160 Å²	160	174.4 Å²	174.4	86%	0.856	89%	0.894	S	S	*	*			trans	-137.7	91.7	173.2	-69.3	-70.6	0	0	0	109.7
762	S	39.1	Very low	42.2	Very low	200 Å²	200	175.1 Å²	175.1	100%	1.399	89%	0.894	S	S	*	*			trans	-163.5	0	164.8	-69.7	0	0	0	0	108.6

Retrieved 762 of 762 residues in 3339.6 ms (Link to these results)

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