A0A087WTT1_HUMAN Loading...

Polyadenylate-binding protein

Binds the poly(A) tail of mRNA.

AlphaFold DB , UniProt , Accession A0A087WTT1, Species HUMAN (Homo sapiens, Human), Gene PABPC1, Length 588 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	34.9	Very low	43.7	Very low	244 Å²	244	118.7 Å²	118.7	100%	1.202	69%	0.693	S	S	*	*				0	135.8	0	-71.3	135.8	164.8	0	0	108
2	N	31.3	Very low	46.8	Very low	158 Å²	158	115.5 Å²	115.5	85%	0.845	68%	0.682	S	S	*	*			trans	-122.5	136.1	166.9	-118.7	-7.5	0	0	0	106.5	S4	N2-S4 PolarHBondContact O-N 2.76Å
3	P	37.4	Very low	49.7	Very low	122 Å²	122	106.9 Å²	106.9	79%	0.792	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-66.6	129.6	-176.6	26.9	-33.3	0	0	0	110.4	A5	P3-A5 PolarHBondContact O-N 3.24Å
4	S	35.5	Very low	52.1	Low	112 Å²	112	105 Å²	105	78%	0.783	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-62.9	122.6	172.8	49.4	0	0	0	0	110.1	N2	N2-S4 PolarHBondContact O-N 2.76Å
5	A	35.2	Very low	54.4	Low	91 Å²	91	98 Å²	98	75%	0.752	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-58.6	134.4	169.1	0	0	0	0	0	109.5	P3 S7	P3-A5 PolarHBondContact O-N 3.24Å; A5-S7 PolarHBondContact O-N 3.16Å
6	P	37.7	Very low	56.2	Low	94 Å²	94	91.9 Å²	91.9	61%	0.61	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-64.5	125.7	-179.3	25.3	-33.1	0	0	0	110.4	Y8	P6-Y8 HydrophobicContact CG-CD2 4.41Å; P6-Y8 HydrophobicContact CG-CE2 3.83Å; P6-Y8 VanDerWaalsContact O-CD2 3.31Å; P6-Y8 WeakPolarHBondContact O-CD2 3.24Å; P6-Y8 PolarHBondContact O-N 3.4Å
7	S	40.8	Very low	57.8	Low	114 Å²	114	92.4 Å²	92.4	80%	0.797	53%	0.533	S	S	*	.			trans	-72.8	88.4	172.3	172	0	0	0	0	109.5	A5 P9	A5-S7 PolarHBondContact O-N 3.16Å; S7-P9 WeakPolarHBondContact O-CD 3.26Å
8	Y	42.9	Very low	59.3	Low	144 Å²	144	87.4 Å²	87.4	57%	0.565	50%	0.504	S	S	*	.			trans	-59.1	112.6	175.4	-75.5	-89.5	0	0	0	111.7	P6	P6-Y8 HydrophobicContact CG-CD2 4.41Å; P6-Y8 HydrophobicContact CG-CE2 3.83Å; P6-Y8 VanDerWaalsContact O-CD2 3.31Å; P6-Y8 WeakPolarHBondContact O-CD2 3.24Å; P6-Y8 PolarHBondContact O-N 3.4Å
9	P	52	Low	60.7	Low	88 Å²	88	85.8 Å²	85.8	57%	0.571	49%	0.491	S	S	*	.			trans	-85.7	136.5	169.3	-0.9	22.7	0	0	0	109.4	S7 A11 P62	S7-P9 WeakPolarHBondContact O-CD 3.26Å; P9-A11 VanDerWaalsContact C-N 3.34Å; P9-A11 PolarHBondContact O-N 2.91Å; P9-P62 WeakPolarHBondContact O-CG 3.44Å
10	M	61.4	Low	61.9	Low	133 Å²	133	84.6 Å²	84.6	66%	0.655	49%	0.487	S	S	*	.	S	Bend	trans	60	23.2	152.6	-50.2	-174.2	75.2	0	0	118.5	P62	M10-P62 HydrophobicContact CB-CB 4.37Å; M10-P62 WeakPolarHBondContact O-CA 3.42Å; M10-P62 WeakPolarHBondContact O-CB 3.3Å
11	A	71.9	Confident	63.2	Low	6 Å²	6	85.1 Å²	85.1	5%	0.05	49%	0.488	C	S	.	.			trans	-100.6	13.2	172.3	0	0	0	0	0	114.3	P9 N58 F59 P62	P9-A11 VanDerWaalsContact C-N 3.34Å; P9-A11 PolarHBondContact O-N 2.91Å; A11-N58 CarbonylContact O-C 3.56Å; A11-N58 WeakPolarHBondContact O-CA 3.25Å; A11-F59 PolarHBondContact O-N 3.08Å; A11-P62 HydrophobicContact CB-CG 4.39Å
12	S	81.3	Confident	65.8	Low	80 Å²	80	73.5 Å²	73.5	56%	0.559	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	114.1	-172.7	-66	0	0	0	0	112.3	N58	S12-N58 VanDerWaalsContact CB-OD1 3.27Å; S12-N58 WeakPolarHBondContact CB-OD1 3.12Å; S12-N58 PolarHBondContact OG-OD1 3.09Å
13	L	83.6	Confident	68.6	Low	4 Å²	4	68.7 Å²	68.7	2%	0.021	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.3	-179.9	-166.6	64	0	0	0	111.2	V15 F31 Y56 V57 F59 A68 L69 C84	L13-V15 HydrophobicContact CD2-CG2 4.39Å; L13-V15 HydrophobicContact CG-CG2 4.28Å; L13-F31 HydrophobicContact CD2-CD1 4.47Å; L13-F31 HydrophobicContact CD2-CE1 3.89Å; L13-Y56 WeakPolarHBondContact O-CA 3.47Å; L13-V57 PolarHBondContact N-O 2.88Å; L13-V57 PolarHBondContact O-N 3.43Å; L13-F59 HydrophobicContact CB-CE2 4.49Å; L13-F59 HydrophobicContact CD2-CE2 4.37Å; L13-A68 HydrophobicContact CD2-CB 3.94Å; L13-L69 HydrophobicContact CD1-CB 4.34Å; L13-L69 HydrophobicContact CD1-CD1 4.46Å; L13-C84 HydrophobicContact CD1-CB 4.17Å; L13-C84 HydrophobicContact CD2-CB 4.2Å; L13-C84 HydrophobicContact CG-CB 4.36Å
14	Y	84.3	Confident	71.2	Confident	80 Å²	80	66.1 Å²	66.1	31%	0.314	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	134.6	165.6	171.2	-91.2	0	0	0	109.9	Y54 Y56 C84 D85	Y14-Y54 HydrophobicContact CD2-CD2 4.32Å; Y14-Y54 AromaticContact CE2-CD2 3.58Å; Y14-Y54 HydrophobicContact CE2-CD2 3.58Å; Y14-Y54 HydrophobicContact CE2-CE2 4.39Å; Y14-Y54 AromaticContact CE2-CG 3.9Å; Y14-Y54 HydrophobicContact CE2-CG 3.9Å; Y14-Y54 WeakPolarHBondContact OH-CB 3.49Å; Y14-Y56 HydrophobicContact CD2-CD1 4.41Å; Y14-Y56 AromaticContact CD2-CE1 3.77Å; Y14-Y56 HydrophobicContact CD2-CE1 3.77Å; Y14-Y56 HydrophobicContact CG-CE1 4.49Å; Y14-C84 WeakPolarHBondContact O-CA 3.3Å; Y14-D85 HydrophobicContact CD1-CB 4.03Å; Y14-D85 PolarHBondContact O-N 2.91Å
15	V	85.6	Confident	73.9	Confident	0 Å²	0	64 Å²	64	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	98.8	-173.3	-174.4	0	0	0	0	109.4	L13 L18 L27 F31 Y54 A55 V57 V82	L13-V15 HydrophobicContact CD2-CG2 4.39Å; L13-V15 HydrophobicContact CG-CG2 4.28Å; V15-L18 HydrophobicContact CG1-CD1 4.39Å; V15-L18 HydrophobicContact CG1-CD2 3.98Å; V15-L18 HydrophobicContact CG1-CG 4.46Å; V15-L27 HydrophobicContact CG1-CD2 4.12Å; V15-F31 HydrophobicContact CG1-CE2 3.91Å; V15-F31 HydrophobicContact CG1-CZ 4.04Å; V15-F31 HydrophobicContact CG2-CE2 4.26Å; V15-F31 HydrophobicContact CG2-CZ 4.12Å; V15-Y54 CarbonylContact O-C 3.52Å; V15-Y54 WeakPolarHBondContact O-CA 3.46Å; V15-Y54 WeakPolarHBondContact O-CB 3.46Å; V15-A55 HydrophobicContact CB-CB 4.38Å; V15-A55 PolarHBondContact N-O 3.46Å; V15-A55 PolarHBondContact O-N 3Å; V15-V57 HydrophobicContact CG2-CB 4.24Å; V15-V57 HydrophobicContact CG2-CG2 3.78Å; V15-V82 HydrophobicContact CG1-CG1 3.38Å
16	G	84.3	Confident	76.5	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	177.8	-172.8	0	0	0	0	0	115.8	L18 G53 V83	G16-L18 PolarHBondContact O-N 3.02Å; G16-G53 CarbonylContact C-O 3.43Å; G16-V83 PolarHBondContact N-O 3.43Å; G16-V83 PolarHBondContact O-N 3.45Å; G16-V83 VanDerWaalsContact O-N 3.08Å
17	D	82	Confident	79.1	Confident	100 Å²	100	57.8 Å²	57.8	54%	0.535	32%	0.322	S	S	.	.	S	Bend	trans	55.1	22.3	-180	-101.8	-42.6	0	0	0	116.5	G53 K80 V83	D17-G53 CarbonylContact C-O 3.53Å; D17-G53 PolarHBondContact N-O 2.77Å; D17-K80 WeakPolarHBondContact O-CD 3.45Å; D17-K80 PolarHBondContact O-NZ 3.24Å; D17-V83 HydrophobicContact CB-CG2 4.19Å
18	L	85.9	Confident	81.5	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.016	31%	0.307	C	S	.	.			trans	-58.9	152.1	-178.9	-60.7	-179.9	0	0	0	113.5	V15 G16 V22 L27 G53 A55 K80 V82	V15-L18 HydrophobicContact CG1-CD1 4.39Å; V15-L18 HydrophobicContact CG1-CD2 3.98Å; V15-L18 HydrophobicContact CG1-CG 4.46Å; G16-L18 PolarHBondContact O-N 3.02Å; L18-V22 HydrophobicContact CB-CB 4.25Å; L18-V22 HydrophobicContact CB-CG2 4.13Å; L18-V22 HydrophobicContact CD1-CG1 4.13Å; L18-V22 HydrophobicContact CD2-CG1 4.4Å; L18-V22 HydrophobicContact CD2-CG2 4.43Å; L18-L27 HydrophobicContact CD1-CD1 4.08Å; L18-L27 HydrophobicContact CD1-CD2 4.22Å; L18-L27 HydrophobicContact CD2-CD2 4.06Å; L18-G53 PolarHBondContact N-O 2.93Å; L18-A55 HydrophobicContact CD1-CB 3.71Å; L18-K80 PolarHBondContact O-NZ 3.35Å; L18-V82 HydrophobicContact CD2-CG1 4.41Å; L18-V82 HydrophobicContact CD2-CG2 3.95Å
19	H	85.1	Confident	83.7	Confident	56 Å²	56	58.4 Å²	58.4	26%	0.259	31%	0.313	S	S	.	.			trans	-68	143.8	167.6	-166.6	-94	0	0	0	109.6	D21 V22 K78	H19-D21 IonicContact CE1-OD2 3.9Å; H19-D21 PolarHBondContact CE1-OD2 2.96Å; H19-D21 PolarHBondContact ND1-N 3.25Å; H19-D21 IonicContact ND1-OD2 3.26Å; H19-D21 PolarHBondContact ND1-OD2 3.36Å; H19-D21 PolarHBondContact O-N 3.36Å; H19-V22 HydrophobicContact CB-CG2 3.96Å; H19-V22 WeakPolarHBondContact O-CB 3.45Å; H19-V22 WeakPolarHBondContact O-CG2 3.4Å; H19-V22 PolarHBondContact O-N 3.08Å; H19-K78 HydrophobicContact CB-CB 3.78Å
20	P	85.8	Confident	85.4	Confident	61 Å²	61	57.1 Å²	57.1	40%	0.396	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-31.3	-178.7	-30.4	37.3	0	0	0	114.6	S51	P20-S51 WeakPolarHBondContact O-CB 3.49Å
21	D	87.5	Confident	86.8	Confident	96 Å²	96	50.8 Å²	50.8	51%	0.513	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	13.9	179.7	-44.9	-37.5	0	0	0	114	H19 K78	H19-D21 IonicContact CE1-OD2 3.9Å; H19-D21 PolarHBondContact CE1-OD2 2.96Å; H19-D21 PolarHBondContact ND1-N 3.25Å; H19-D21 IonicContact ND1-OD2 3.26Å; H19-D21 PolarHBondContact ND1-OD2 3.36Å; H19-D21 PolarHBondContact O-N 3.36Å; D21-K78 HydrophobicContact CB-CD 4.21Å; D21-K78 PolarHBondContact O-NZ 3.5Å
22	V	89.5	Confident	87.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.279	C	S	.	.			trans	-69.1	133.3	169.2	174.7	0	0	0	0	109	L18 H19 M26 L27 R44 I77	L18-V22 HydrophobicContact CB-CB 4.25Å; L18-V22 HydrophobicContact CB-CG2 4.13Å; L18-V22 HydrophobicContact CD1-CG1 4.13Å; L18-V22 HydrophobicContact CD2-CG1 4.4Å; L18-V22 HydrophobicContact CD2-CG2 4.43Å; H19-V22 HydrophobicContact CB-CG2 3.96Å; H19-V22 WeakPolarHBondContact O-CB 3.45Å; H19-V22 WeakPolarHBondContact O-CG2 3.4Å; H19-V22 PolarHBondContact O-N 3.08Å; V22-M26 HydrophobicContact CG1-CB 4.48Å; V22-L27 HydrophobicContact CG1-CD1 4.14Å; V22-L27 HydrophobicContact CG1-CD2 3.87Å; V22-L27 HydrophobicContact CG1-CG 3.69Å; V22-R44 PolarHBondContact O-NH2 3.4Å; V22-R44 VanDerWaalsContact O-NH2 3.11Å; V22-I77 HydrophobicContact CG2-CG2 3.77Å
23	T	91.3	Very high	88.3	Confident	57 Å²	57	53.7 Å²	53.7	35%	0.35	28%	0.284	S	S	.	.			trans	-111.1	160.4	173.2	66	0	0	0	0	110.7	A25 M26 L27	T23-A25 PolarHBondContact O-N 3.34Å; T23-M26 PolarHBondContact O-N 2.73Å; T23-M26 PolarHBondContact OG1-N 2.64Å; T23-L27 PolarHBondContact O-N 2.77Å; T23-L27 VanDerWaalsContact O-N 3.14Å
24	E	92.3	Very high	88.4	Confident	69 Å²	69	53.8 Å²	53.8	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-52	-36.8	174	-65.8	75.3	179.3	0	0	110.6	L27 Y28 I40 V42 R44	E24-L27 PolarHBondContact O-N 3.16Å; E24-Y28 PolarHBondContact O-N 2.95Å; E24-I40 HydrophobicContact CB-CG2 4.3Å; E24-I40 HydrophobicContact CG-CG2 4.44Å; E24-V42 HydrophobicContact CG-CB 4.38Å; E24-V42 HydrophobicContact CG-CG2 3.91Å; E24-V42 WeakPolarHBondContact OE1-CB 3.46Å; E24-R44 IonicContact OE1-CZ 2.72Å; E24-R44 IonicContact OE1-NE 3.36Å; E24-R44 PolarHBondContact OE1-NE 2.94Å; E24-R44 IonicContact OE1-NH2 3.12Å; E24-R44 PolarHBondContact OE1-NH2 3.12Å; E24-R44 IonicContact OE2-CZ 3.08Å; E24-R44 IonicContact OE2-NE 2.66Å; E24-R44 IonicContact OE2-NH2 3.61Å; E24-R44 PolarHBondContact OE2-NH2 2.91Å
25	A	91.6	Very high	88.7	Confident	67 Å²	67	50.5 Å²	50.5	55%	0.554	28%	0.276	S	S	*	.	H	α-helix	trans	-68.2	-40.2	175.3	0	0	0	0	0	113.7	T23 L27 Y28 E29	T23-A25 PolarHBondContact O-N 3.34Å; A25-L27 VanDerWaalsContact C-N 3.3Å; A25-L27 PolarHBondContact O-N 2.6Å; A25-Y28 WeakPolarHBondContact O-CB 3.3Å; A25-Y28 PolarHBondContact O-N 3.34Å; A25-E29 PolarHBondContact O-N 3.17Å
26	M	90.6	Very high	89	Confident	54 Å²	54	54.7 Å²	54.7	27%	0.266	30%	0.303	S	S	.	.	H	α-helix	trans	-66.9	-33.9	176.6	-63.7	-169.9	75.8	0	0	112.1	V22 T23 K30 I77 K78	V22-M26 HydrophobicContact CG1-CB 4.48Å; T23-M26 PolarHBondContact O-N 2.73Å; T23-M26 PolarHBondContact OG1-N 2.64Å; M26-K30 WeakPolarHBondContact O-CB 3.1Å; M26-K30 PolarHBondContact O-N 3.42Å; M26-I77 HydrophobicContact CE-CG2 4.1Å; M26-K78 HydrophobicContact CE-CD 4.16Å; M26-K78 HydrophobicContact CE-CG 3.91Å; M26-K78 HydrophobicContact SD-CD 4Å; M26-K78 WeakPolarHBondContact SD-CE 3.36Å; M26-K78 HydrophobicContact SD-CG 4.41Å
27	L	90.4	Very high	89.3	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-69.2	-40.3	171.6	-65.2	174.9	0	0	0	110.9	V15 L18 V22 T23 E24 A25 K30 F31 I40 V42 A55 I77	V15-L27 HydrophobicContact CG1-CD2 4.12Å; L18-L27 HydrophobicContact CD1-CD1 4.08Å; L18-L27 HydrophobicContact CD1-CD2 4.22Å; L18-L27 HydrophobicContact CD2-CD2 4.06Å; V22-L27 HydrophobicContact CG1-CD1 4.14Å; V22-L27 HydrophobicContact CG1-CD2 3.87Å; V22-L27 HydrophobicContact CG1-CG 3.69Å; T23-L27 PolarHBondContact O-N 2.77Å; T23-L27 VanDerWaalsContact O-N 3.14Å; E24-L27 PolarHBondContact O-N 3.16Å; A25-L27 VanDerWaalsContact C-N 3.3Å; A25-L27 PolarHBondContact O-N 2.6Å; L27-K30 PolarHBondContact O-N 3.24Å; L27-F31 HydrophobicContact CB-CD2 4.41Å; L27-F31 HydrophobicContact CD2-CD2 4.32Å; L27-F31 HydrophobicContact CD2-CE2 4.02Å; L27-F31 WeakPolarHBondContact O-CB 3.41Å; L27-F31 WeakPolarHBondContact O-CD2 3.45Å; L27-F31 PolarHBondContact O-N 3.14Å; L27-I40 HydrophobicContact CB-CD1 3.91Å; L27-I40 HydrophobicContact CB-CG2 4.01Å; L27-I40 HydrophobicContact CD1-CG2 3.81Å; L27-V42 HydrophobicContact CD1-CG2 3.74Å; L27-A55 HydrophobicContact CD1-CB 3.4Å; L27-I77 HydrophobicContact CD2-CD1 3.94Å
28	Y	91.4	Very high	89.7	Confident	126 Å²	126	55 Å²	55	49%	0.494	30%	0.304	S	S	.	.	H	α-helix	trans	-60.8	-47.9	175.5	-172.3	-87.4	0	0	0	111.9	E24 A25 K30 F31 S32 I37 I40	E24-Y28 PolarHBondContact O-N 2.95Å; A25-Y28 WeakPolarHBondContact O-CB 3.3Å; A25-Y28 PolarHBondContact O-N 3.34Å; Y28-K30 VanDerWaalsContact C-N 3.33Å; Y28-K30 PolarHBondContact O-N 3.19Å; Y28-F31 PolarHBondContact O-N 3.45Å; Y28-S32 WeakPolarHBondContact O-CB 3.49Å; Y28-S32 PolarHBondContact O-N 2.99Å; Y28-S32 PolarHBondContact O-OG 2.8Å; Y28-I37 HydrophobicContact CD2-CB 4.24Å; Y28-I37 HydrophobicContact CD2-CD1 4.06Å; Y28-I37 HydrophobicContact CD2-CG2 4.41Å; Y28-I37 HydrophobicContact CE2-CB 4.08Å; Y28-I37 HydrophobicContact CE2-CD1 4.46Å; Y28-I40 VanDerWaalsContact CA-CD1 3.48Å; Y28-I40 HydrophobicContact CD2-CD1 4.24Å; Y28-I40 HydrophobicContact CG-CD1 4.5Å; Y28-I40 VanDerWaalsContact N-CD1 3.29Å
29	E	90.3	Very high	89.7	Confident	145 Å²	145	57.4 Å²	57.4	68%	0.678	32%	0.321	S	S	*	.	H	α-helix	trans	-57.4	-45.3	175.2	-175.1	178.1	-164.1	0	0	111.5	A25	A25-E29 PolarHBondContact O-N 3.17Å
30	K	88.4	Confident	90	Very high	61 Å²	61	56.3 Å²	56.3	27%	0.265	32%	0.317	S	S	.	.	H	α-helix	trans	-70	-40.9	-179.2	-176.3	60.3	-173.1	177.9	0	113.8	M26 L27 Y28 P33 M72 D75 I77	M26-K30 WeakPolarHBondContact O-CB 3.1Å; M26-K30 PolarHBondContact O-N 3.42Å; L27-K30 PolarHBondContact O-N 3.24Å; Y28-K30 VanDerWaalsContact C-N 3.33Å; Y28-K30 PolarHBondContact O-N 3.19Å; K30-P33 WeakPolarHBondContact O-CD 3.45Å; K30-M72 VanDerWaalsContact O-CE 3.25Å; K30-M72 WeakPolarHBondContact O-CE 3.23Å; K30-D75 WeakPolarHBondContact CE-OD2 3.45Å; K30-D75 IonicContact NZ-OD1 3.36Å; K30-D75 PolarHBondContact NZ-OD1 2.85Å; K30-D75 VanDerWaalsContact NZ-OD1 3.12Å; K30-D75 IonicContact NZ-OD2 3.97Å; K30-D75 PolarHBondContact NZ-OD2 2.91Å; K30-I77 HydrophobicContact CB-CD1 4.04Å; K30-I77 HydrophobicContact CG-CD1 4Å; K30-I77 HydrophobicContact CG-CG1 4.37Å
31	F	89.6	Confident	90.1	Very high	1 Å²	1	61.9 Å²	61.9	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-95.2	-20.1	-170.6	-77.4	-78.1	0	0	0	114.7	L13 V15 L27 Y28 P33 A34 I37 V57 F59 A68 M72 V82	L13-F31 HydrophobicContact CD2-CD1 4.47Å; L13-F31 HydrophobicContact CD2-CE1 3.89Å; V15-F31 HydrophobicContact CG1-CE2 3.91Å; V15-F31 HydrophobicContact CG1-CZ 4.04Å; V15-F31 HydrophobicContact CG2-CE2 4.26Å; V15-F31 HydrophobicContact CG2-CZ 4.12Å; L27-F31 HydrophobicContact CB-CD2 4.41Å; L27-F31 HydrophobicContact CD2-CD2 4.32Å; L27-F31 HydrophobicContact CD2-CE2 4.02Å; L27-F31 WeakPolarHBondContact O-CB 3.41Å; L27-F31 WeakPolarHBondContact O-CD2 3.45Å; L27-F31 PolarHBondContact O-N 3.14Å; Y28-F31 PolarHBondContact O-N 3.45Å; F31-P33 VanDerWaalsContact C-N 3.32Å; F31-A34 WeakPolarHBondContact O-CB 3.49Å; F31-A34 PolarHBondContact O-N 3.32Å; F31-I37 HydrophobicContact CB-CD1 3.71Å; F31-V57 HydrophobicContact CB-CG1 4.34Å; F31-V57 HydrophobicContact CD2-CG2 4.22Å; F31-F59 HydrophobicContact CB-CZ 4.09Å; F31-F59 HydrophobicContact CD1-CZ 4.15Å; F31-A68 HydrophobicContact CD1-CB 3.88Å; F31-A68 HydrophobicContact CE1-CB 4.15Å; F31-M72 HydrophobicContact CB-SD 4.47Å; F31-M72 HydrophobicContact CD1-CB 4.49Å; F31-M72 HydrophobicContact CD1-SD 3.51Å; F31-M72 VanDerWaalsContact CD1-SD 3.51Å; F31-M72 HydrophobicContact CE1-CB 3.98Å; F31-M72 HydrophobicContact CE1-SD 3.97Å; F31-M72 HydrophobicContact CG-SD 4.17Å; F31-V82 HydrophobicContact CZ-CG1 4.12Å
32	S	91.5	Very high	90.3	Very high	44 Å²	44	57.6 Å²	57.6	31%	0.308	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.1	178.6	55.3	0	0	0	0	115.9	Y28 A34 G35	Y28-S32 WeakPolarHBondContact O-CB 3.49Å; Y28-S32 PolarHBondContact O-N 2.99Å; Y28-S32 PolarHBondContact O-OG 2.8Å; S32-A34 PolarHBondContact O-N 3.08Å; S32-G35 PolarHBondContact O-N 3.04Å
33	P	92.7	Very high	90.1	Very high	102 Å²	102	58.5 Å²	58.5	66%	0.662	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.2	170.1	-22.5	34.7	0	0	0	114.3	K30 F31 M72	K30-P33 WeakPolarHBondContact O-CD 3.45Å; F31-P33 VanDerWaalsContact C-N 3.32Å; P33-M72 HydrophobicContact CB-CE 3.98Å; P33-M72 HydrophobicContact CG-CE 4.37Å
34	A	87.4	Confident	89.9	Confident	7 Å²	7	59.6 Å²	59.6	6%	0.058	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-37.8	175.5	0	0	0	0	0	111.4	F31 S32 F59 R67 A68 M72	F31-A34 WeakPolarHBondContact O-CB 3.49Å; F31-A34 PolarHBondContact O-N 3.32Å; S32-A34 PolarHBondContact O-N 3.08Å; A34-F59 HydrophobicContact CB-CE1 4.04Å; A34-F59 HydrophobicContact CB-CZ 4.2Å; A34-R67 VanDerWaalsContact O-CZ 3.22Å; A34-R67 PolarHBondContact O-NE 2.85Å; A34-R67 PolarHBondContact O-NH2 3.12Å; A34-A68 HydrophobicContact CB-CB 3.63Å; A34-M72 HydrophobicContact CB-CE 3.75Å; A34-M72 HydrophobicContact CB-SD 4.13Å
35	G	89.7	Confident	89.2	Confident	10 Å²	10	58.4 Å²	58.4	10%	0.103	31%	0.307	C	S	.	.	S	Bend	trans	166.4	179.5	174.7	0	0	0	0	0	113.3	S32 I37	S32-G35 PolarHBondContact O-N 3.04Å; G35-I37 PolarHBondContact O-N 3.44Å
36	P	91.4	Very high	88.2	Confident	88 Å²	88	60.5 Å²	60.5	57%	0.571	31%	0.307	S	S	*	.			trans	-59.7	125.3	-179.7	-24.6	35.2	0	0	0	113	F59 Q60 D64	P36-F59 CarbonylContact O-C 3.56Å; P36-F59 WeakPolarHBondContact O-CA 3.49Å; P36-Q60 HydrophobicContact CB-CB 4.03Å; P36-Q60 PolarHBondContact O-N 3.15Å; P36-D64 WeakPolarHBondContact CD-OD2 3.39Å
37	I	91.3	Very high	87.2	Confident	27 Å²	27	63.8 Å²	63.8	14%	0.138	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.9	-179	-62.7	177.4	0	0	0	109.9	Y28 F31 G35 I40 V57 N58 F59	Y28-I37 HydrophobicContact CD2-CB 4.24Å; Y28-I37 HydrophobicContact CD2-CD1 4.06Å; Y28-I37 HydrophobicContact CD2-CG2 4.41Å; Y28-I37 HydrophobicContact CE2-CB 4.08Å; Y28-I37 HydrophobicContact CE2-CD1 4.46Å; F31-I37 HydrophobicContact CB-CD1 3.71Å; G35-I37 PolarHBondContact O-N 3.44Å; I37-I40 HydrophobicContact CD1-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CG1 3.62Å; I37-V57 HydrophobicContact CD1-CG1 4.15Å; I37-V57 HydrophobicContact CG1-CG1 4.35Å; I37-V57 HydrophobicContact CG2-CG1 4.19Å; I37-N58 CarbonylContact C-O 3.58Å; I37-N58 WeakPolarHBondContact CG2-O 3.5Å; I37-F59 HydrophobicContact CD1-CE1 4.4Å; I37-F59 HydrophobicContact CG1-CD1 4Å; I37-F59 HydrophobicContact CG1-CE1 3.77Å; I37-F59 HydrophobicContact CG1-CZ 4.43Å
38	L	89.4	Confident	86.9	Confident	80 Å²	80	66.8 Å²	66.8	42%	0.419	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-39.6	176.2	175.9	62.8	0	0	0	112.2	N58	L38-N58 WeakPolarHBondContact CA-O 3.2Å; L38-N58 HydrophobicContact CB-CB 4.36Å; L38-N58 PolarHBondContact N-O 3.46Å
39	S	86.9	Confident	86.4	Confident	54 Å²	54	69.5 Å²	69.5	38%	0.378	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	155.5	173.8	48.5	0	0	0	0	113.3	N58	S39-N58 PolarHBondContact N-O 3.42Å; S39-N58 VanDerWaalsContact N-O 3.17Å; S39-N58 PolarHBondContact O-N 2.91Å; S39-N58 PolarHBondContact OG-ND2 3.29Å
40	I	91.3	Very high	85.8	Confident	34 Å²	34	70.6 Å²	70.6	17%	0.174	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.1	172.4	-55.2	-173.7	0	0	0	109.5	E24 L27 Y28 I37 Y56 V57	E24-I40 HydrophobicContact CB-CG2 4.3Å; E24-I40 HydrophobicContact CG-CG2 4.44Å; L27-I40 HydrophobicContact CB-CD1 3.91Å; L27-I40 HydrophobicContact CB-CG2 4.01Å; L27-I40 HydrophobicContact CD1-CG2 3.81Å; Y28-I40 VanDerWaalsContact CA-CD1 3.48Å; Y28-I40 HydrophobicContact CD2-CD1 4.24Å; Y28-I40 HydrophobicContact CG-CD1 4.5Å; Y28-I40 VanDerWaalsContact N-CD1 3.29Å; I37-I40 HydrophobicContact CD1-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CG1 3.62Å; I40-Y56 WeakPolarHBondContact CA-O 3.42Å; I40-V57 HydrophobicContact CD1-CG2 4.33Å; I40-V57 HydrophobicContact CG1-CG1 4.32Å; I40-V57 HydrophobicContact CG1-CG2 4.22Å; I40-V57 HydrophobicContact CG2-CG2 4.19Å
41	R	88.8	Confident	85.7	Confident	177 Å²	177	68.3 Å²	68.3	67%	0.668	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	105.5	174.2	-177.6	-170.8	-60	-91.6	-0.2	109.7	C43 A55 Y56	R41-C43 PolarHBondContact O-N 3.04Å; R41-A55 CarbonylContact O-C 3.55Å; R41-A55 WeakPolarHBondContact O-CA 3.35Å; R41-A55 WeakPolarHBondContact O-CB 3.2Å; R41-Y56 PolarHBondContact N-O 3.44Å; R41-Y56 PolarHBondContact O-N 3.41Å
42	V	90	Very high	85.3	Confident	7 Å²	7	72.5 Å²	72.5	4%	0.042	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	127.8	163.5	-178.5	0	0	0	0	107.5	E24 L27 R44 S51 A55	E24-V42 HydrophobicContact CG-CB 4.38Å; E24-V42 HydrophobicContact CG-CG2 3.91Å; E24-V42 WeakPolarHBondContact OE1-CB 3.46Å; L27-V42 HydrophobicContact CD1-CG2 3.74Å; V42-R44 HydrophobicContact CB-CG 4.47Å; V42-R44 HydrophobicContact CG1-CG 4.11Å; V42-R44 PolarHBondContact O-N 3.44Å; V42-S51 WeakPolarHBondContact CG1-OG 3.34Å; V42-A55 HydrophobicContact CB-CB 4.42Å; V42-A55 HydrophobicContact CG2-CB 4.16Å
43	C	85.4	Confident	84.9	Confident	19 Å²	19	71.2 Å²	71.2	13%	0.128	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	115.7	176	-75.2	0	0	0	0	108.6	R41 L52 Y54	R41-C43 PolarHBondContact O-N 3.04Å; C43-L52 HydrophobicContact CB-CD1 4.35Å; C43-L52 WeakPolarHBondContact O-CB 3.33Å; C43-L52 PolarHBondContact O-N 3.38Å; C43-Y54 HydrophobicContact CB-CD1 4.31Å; C43-Y54 HydrophobicContact CB-CD2 3.81Å; C43-Y54 HydrophobicContact CB-CE1 3.89Å; C43-Y54 HydrophobicContact CB-CE2 3.34Å; C43-Y54 HydrophobicContact CB-CG 4.27Å; C43-Y54 PolarHBondContact N-O 3.31Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.32Å
44	R	87.3	Confident	84.6	Confident	79 Å²	79	69.5 Å²	69.5	30%	0.298	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.8	-175.2	-63.1	174.4	-175.7	-72.1	-6.5	109.6	V22 E24 V42 M46 R50	V22-R44 PolarHBondContact O-NH2 3.4Å; V22-R44 VanDerWaalsContact O-NH2 3.11Å; E24-R44 IonicContact OE1-CZ 2.72Å; E24-R44 IonicContact OE1-NE 3.36Å; E24-R44 PolarHBondContact OE1-NE 2.94Å; E24-R44 IonicContact OE1-NH2 3.12Å; E24-R44 PolarHBondContact OE1-NH2 3.12Å; E24-R44 IonicContact OE2-CZ 3.08Å; E24-R44 IonicContact OE2-NE 2.66Å; E24-R44 IonicContact OE2-NH2 3.61Å; E24-R44 PolarHBondContact OE2-NH2 2.91Å; V42-R44 HydrophobicContact CB-CG 4.47Å; V42-R44 HydrophobicContact CG1-CG 4.11Å; V42-R44 PolarHBondContact O-N 3.44Å; R44-M46 PolarHBondContact O-N 3.46Å; R44-R50 CarbonylContact C-O 3.59Å; R44-R50 VanDerWaalsContact CA-O 3.27Å; R44-R50 WeakPolarHBondContact CA-O 3.4Å
45	D	78.8	Confident	84.6	Confident	45 Å²	45	69.1 Å²	69.1	24%	0.241	34%	0.335	C	S	.	.			trans	-57.1	127.8	171.6	-179.3	-91.7	0	0	0	109.6	I47 T48 R49 R50 L52	D45-I47 VanDerWaalsContact C-N 3.29Å; D45-I47 PolarHBondContact O-N 2.82Å; D45-I47 PolarHBondContact OD1-N 2.84Å; D45-T48 WeakPolarHBondContact CB-OG1 3.49Å; D45-T48 WeakPolarHBondContact OD1-CA 3.42Å; D45-T48 WeakPolarHBondContact OD1-CB 3.39Å; D45-T48 WeakPolarHBondContact OD1-CG2 3.37Å; D45-T48 PolarHBondContact OD1-N 2.86Å; D45-T48 PolarHBondContact OD1-OG1 2.99Å; D45-R49 WeakPolarHBondContact O-CA 3.35Å; D45-R49 PolarHBondContact O-N 2.89Å; D45-R50 PolarHBondContact N-O 2.8Å; D45-L52 HydrophobicContact CB-CD2 3.88Å
46	M	70.8	Confident	84.5	Confident	111 Å²	111	73.3 Å²	73.3	55%	0.547	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-30.7	-167.3	-166.6	166.1	76	0	0	112.7	R44 R49 E98	R44-M46 PolarHBondContact O-N 3.46Å; M46-R49 PolarHBondContact O-NE 3.33Å; M46-E98 HydrophobicContact CE-CB 4.09Å; M46-E98 HydrophobicContact CE-CG 4.37Å
47	I	69.6	Low	84.4	Confident	123 Å²	123	69.1 Å²	69.1	63%	0.631	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-50.7	-175.6	-58.8	173.2	0	0	0	110.3	D45	D45-I47 VanDerWaalsContact C-N 3.29Å; D45-I47 PolarHBondContact O-N 2.82Å; D45-I47 PolarHBondContact OD1-N 2.84Å
48	T	82.7	Confident	84.3	Confident	62 Å²	62	69.7 Å²	69.7	38%	0.38	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-5.7	-172.4	69.6	0	0	0	0	114	D45 R50	D45-T48 WeakPolarHBondContact CB-OG1 3.49Å; D45-T48 WeakPolarHBondContact OD1-CA 3.42Å; D45-T48 WeakPolarHBondContact OD1-CB 3.39Å; D45-T48 WeakPolarHBondContact OD1-CG2 3.37Å; D45-T48 PolarHBondContact OD1-N 2.86Å; D45-T48 PolarHBondContact OD1-OG1 2.99Å; T48-R50 PolarHBondContact O-N 2.75Å
49	R	81	Confident	84.3	Confident	184 Å²	184	65.9 Å²	65.9	69%	0.694	30%	0.304	S	S	*	.			trans	57.3	1.7	179	-60.8	-60.7	-173.8	127.3	0.8	116.7	D45 M46	D45-R49 WeakPolarHBondContact O-CA 3.35Å; D45-R49 PolarHBondContact O-N 2.89Å; M46-R49 PolarHBondContact O-NE 3.33Å
50	R	78.1	Confident	84.3	Confident	167 Å²	167	67 Å²	67	63%	0.63	30%	0.304	S	S	*	.			trans	-66	146.7	172.6	-71.6	-176.6	-73	-122.7	3	110.9	R44 D45 T48	R44-R50 CarbonylContact C-O 3.59Å; R44-R50 VanDerWaalsContact CA-O 3.27Å; R44-R50 WeakPolarHBondContact CA-O 3.4Å; D45-R50 PolarHBondContact N-O 2.8Å; T48-R50 PolarHBondContact O-N 2.75Å
51	S	85.4	Confident	84	Confident	14 Å²	14	70.5 Å²	70.5	10%	0.098	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	139.2	172.9	177.6	0	0	0	0	110.8	P20 V42 G53	P20-S51 WeakPolarHBondContact O-CB 3.49Å; V42-S51 WeakPolarHBondContact CG1-OG 3.34Å; S51-G53 PolarHBondContact O-N 3.27Å; S51-G53 PolarHBondContact OG-N 3.44Å; S51-G53 VanDerWaalsContact OG-N 3.11Å
52	L	81.8	Confident	83.8	Confident	88 Å²	88	64.1 Å²	64.1	46%	0.461	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	6.5	172	-61.4	174.2	0	0	0	112.4	C43 D45 Y54	C43-L52 HydrophobicContact CB-CD1 4.35Å; C43-L52 WeakPolarHBondContact O-CB 3.33Å; C43-L52 PolarHBondContact O-N 3.38Å; D45-L52 HydrophobicContact CB-CD2 3.88Å; L52-Y54 HydrophobicContact CB-CD1 3.84Å; L52-Y54 HydrophobicContact CB-CE1 3.54Å; L52-Y54 HydrophobicContact CD1-CE1 4Å; L52-Y54 HydrophobicContact CG-CE1 4.43Å
53	G	83.3	Confident	83.5	Confident	17 Å²	17	66 Å²	66	18%	0.175	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	82.5	13.8	-179.6	0	0	0	0	0	114.3	G16 D17 L18 S51	G16-G53 CarbonylContact C-O 3.43Å; D17-G53 CarbonylContact C-O 3.53Å; D17-G53 PolarHBondContact N-O 2.77Å; L18-G53 PolarHBondContact N-O 2.93Å; S51-G53 PolarHBondContact O-N 3.27Å; S51-G53 PolarHBondContact OG-N 3.44Å; S51-G53 VanDerWaalsContact OG-N 3.11Å
54	Y	86.4	Confident	83.7	Confident	66 Å²	66	65.6 Å²	65.6	26%	0.259	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	162.5	175.6	72	-83.6	0	0	0	113.1	Y14 V15 C43 L52 Y56	Y14-Y54 HydrophobicContact CD2-CD2 4.32Å; Y14-Y54 AromaticContact CE2-CD2 3.58Å; Y14-Y54 HydrophobicContact CE2-CD2 3.58Å; Y14-Y54 HydrophobicContact CE2-CE2 4.39Å; Y14-Y54 AromaticContact CE2-CG 3.9Å; Y14-Y54 HydrophobicContact CE2-CG 3.9Å; Y14-Y54 WeakPolarHBondContact OH-CB 3.49Å; V15-Y54 CarbonylContact O-C 3.52Å; V15-Y54 WeakPolarHBondContact O-CA 3.46Å; V15-Y54 WeakPolarHBondContact O-CB 3.46Å; C43-Y54 HydrophobicContact CB-CD1 4.31Å; C43-Y54 HydrophobicContact CB-CD2 3.81Å; C43-Y54 HydrophobicContact CB-CE1 3.89Å; C43-Y54 HydrophobicContact CB-CE2 3.34Å; C43-Y54 HydrophobicContact CB-CG 4.27Å; C43-Y54 PolarHBondContact N-O 3.31Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.32Å; L52-Y54 HydrophobicContact CB-CD1 3.84Å; L52-Y54 HydrophobicContact CB-CE1 3.54Å; L52-Y54 HydrophobicContact CD1-CE1 4Å; L52-Y54 HydrophobicContact CG-CE1 4.43Å; Y54-Y56 HydrophobicContact CD2-CE2 4.27Å; Y54-Y56 AromaticContact CE2-CE2 3.89Å; Y54-Y56 HydrophobicContact CE2-CE2 3.89Å
55	A	87.4	Confident	83.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	169.7	178.5	0	0	0	0	0	111.3	V15 L18 L27 R41 V42	V15-A55 HydrophobicContact CB-CB 4.38Å; V15-A55 PolarHBondContact N-O 3.46Å; V15-A55 PolarHBondContact O-N 3Å; L18-A55 HydrophobicContact CD1-CB 3.71Å; L27-A55 HydrophobicContact CD1-CB 3.4Å; R41-A55 CarbonylContact O-C 3.55Å; R41-A55 WeakPolarHBondContact O-CA 3.35Å; R41-A55 WeakPolarHBondContact O-CB 3.2Å; V42-A55 HydrophobicContact CB-CB 4.42Å; V42-A55 HydrophobicContact CG2-CB 4.16Å
56	Y	87.2	Confident	83.5	Confident	97 Å²	97	65 Å²	65	38%	0.38	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.2	164.5	-63.7	-81.5	0	0	0	109.6	L13 Y14 I40 R41 Y54	L13-Y56 WeakPolarHBondContact O-CA 3.47Å; Y14-Y56 HydrophobicContact CD2-CD1 4.41Å; Y14-Y56 AromaticContact CD2-CE1 3.77Å; Y14-Y56 HydrophobicContact CD2-CE1 3.77Å; Y14-Y56 HydrophobicContact CG-CE1 4.49Å; I40-Y56 WeakPolarHBondContact CA-O 3.42Å; R41-Y56 PolarHBondContact N-O 3.44Å; R41-Y56 PolarHBondContact O-N 3.41Å; Y54-Y56 HydrophobicContact CD2-CE2 4.27Å; Y54-Y56 AromaticContact CE2-CE2 3.89Å; Y54-Y56 HydrophobicContact CE2-CE2 3.89Å
57	V	90.4	Very high	84.2	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.1	174.1	177.5	0	0	0	0	107.8	L13 V15 F31 I37 I40 F59	L13-V57 PolarHBondContact N-O 2.88Å; L13-V57 PolarHBondContact O-N 3.43Å; V15-V57 HydrophobicContact CG2-CB 4.24Å; V15-V57 HydrophobicContact CG2-CG2 3.78Å; F31-V57 HydrophobicContact CB-CG1 4.34Å; F31-V57 HydrophobicContact CD2-CG2 4.22Å; I37-V57 HydrophobicContact CD1-CG1 4.15Å; I37-V57 HydrophobicContact CG1-CG1 4.35Å; I37-V57 HydrophobicContact CG2-CG1 4.19Å; I40-V57 HydrophobicContact CD1-CG2 4.33Å; I40-V57 HydrophobicContact CG1-CG1 4.32Å; I40-V57 HydrophobicContact CG1-CG2 4.22Å; I40-V57 HydrophobicContact CG2-CG2 4.19Å; V57-F59 HydrophobicContact CB-CE2 4.45Å; V57-F59 HydrophobicContact CG1-CD2 4.17Å; V57-F59 HydrophobicContact CG1-CE2 3.64Å; V57-F59 HydrophobicContact CG1-CZ 3.91Å
58	N	88.4	Confident	84.9	Confident	39 Å²	39	59.2 Å²	59.2	21%	0.209	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.7	176.2	-57.7	-51.7	0	0	0	108.8	A11 S12 I37 L38 S39	A11-N58 CarbonylContact O-C 3.56Å; A11-N58 WeakPolarHBondContact O-CA 3.25Å; S12-N58 VanDerWaalsContact CB-OD1 3.27Å; S12-N58 WeakPolarHBondContact CB-OD1 3.12Å; S12-N58 PolarHBondContact OG-OD1 3.09Å; I37-N58 CarbonylContact C-O 3.58Å; I37-N58 WeakPolarHBondContact CG2-O 3.5Å; L38-N58 WeakPolarHBondContact CA-O 3.2Å; L38-N58 HydrophobicContact CB-CB 4.36Å; L38-N58 PolarHBondContact N-O 3.46Å; S39-N58 PolarHBondContact N-O 3.42Å; S39-N58 VanDerWaalsContact N-O 3.17Å; S39-N58 PolarHBondContact O-N 2.91Å; S39-N58 PolarHBondContact OG-ND2 3.29Å
59	F	88.8	Confident	84.8	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	167.5	173.7	-71.4	-88.1	0	0	0	111.5	A11 L13 F31 A34 P36 I37 V57 D64 A65 A68	A11-F59 PolarHBondContact O-N 3.08Å; L13-F59 HydrophobicContact CB-CE2 4.49Å; L13-F59 HydrophobicContact CD2-CE2 4.37Å; F31-F59 HydrophobicContact CB-CZ 4.09Å; F31-F59 HydrophobicContact CD1-CZ 4.15Å; A34-F59 HydrophobicContact CB-CE1 4.04Å; A34-F59 HydrophobicContact CB-CZ 4.2Å; P36-F59 CarbonylContact O-C 3.56Å; P36-F59 WeakPolarHBondContact O-CA 3.49Å; I37-F59 HydrophobicContact CD1-CE1 4.4Å; I37-F59 HydrophobicContact CG1-CD1 4Å; I37-F59 HydrophobicContact CG1-CE1 3.77Å; I37-F59 HydrophobicContact CG1-CZ 4.43Å; V57-F59 HydrophobicContact CB-CE2 4.45Å; V57-F59 HydrophobicContact CG1-CD2 4.17Å; V57-F59 HydrophobicContact CG1-CE2 3.64Å; V57-F59 HydrophobicContact CG1-CZ 3.91Å; F59-D64 HydrophobicContact CB-CB 3.96Å; F59-D64 HydrophobicContact CD1-CB 3.66Å; F59-D64 HydrophobicContact CE1-CB 4.4Å; F59-D64 HydrophobicContact CG-CB 3.95Å; F59-A65 HydrophobicContact CD2-CB 3.64Å; F59-A65 HydrophobicContact CE2-CB 4.23Å; F59-A65 HydrophobicContact CG-CB 4.32Å; F59-A68 HydrophobicContact CE1-CB 4.48Å; F59-A68 HydrophobicContact CE2-CB 3.78Å; F59-A68 HydrophobicContact CZ-CB 3.54Å
60	Q	87.3	Confident	84.6	Confident	78 Å²	78	55.5 Å²	55.5	36%	0.364	27%	0.27	S	S	.	.	S	Bend	trans	-79.4	-27.3	174.7	-170.2	58.6	65.6	0	0	112.6	P36	P36-Q60 HydrophobicContact CB-CB 4.03Å; P36-Q60 PolarHBondContact O-N 3.15Å
61	Q	85.3	Confident	84.7	Confident	108 Å²	108	52.3 Å²	52.3	51%	0.505	27%	0.269	S	S	.	.	S	Bend	trans	-130.3	145	176.6	-55.3	-63.3	-23.1	0	0	111.3	A63 D64	Q61-A63 PolarHBondContact O-N 3.47Å; Q61-D64 WeakPolarHBondContact CB-OD2 3.28Å; Q61-D64 WeakPolarHBondContact O-CB 3.22Å; Q61-D64 PolarHBondContact O-N 2.97Å; Q61-D64 VanDerWaalsContact O-N 3.14Å
62	P	83.8	Confident	84.4	Confident	43 Å²	43	52.3 Å²	52.3	28%	0.279	27%	0.268	S	S	.	.	H	α-helix	trans	-57.3	-43.7	176.2	-27.6	37.4	0	0	0	113.7	P9 M10 A11 D64 A65 E66	P9-P62 WeakPolarHBondContact O-CG 3.44Å; M10-P62 HydrophobicContact CB-CB 4.37Å; M10-P62 WeakPolarHBondContact O-CA 3.42Å; M10-P62 WeakPolarHBondContact O-CB 3.3Å; A11-P62 HydrophobicContact CB-CG 4.39Å; P62-D64 PolarHBondContact O-N 3.48Å; P62-A65 WeakPolarHBondContact O-CA 3.25Å; P62-A65 WeakPolarHBondContact O-CB 3.32Å; P62-A65 PolarHBondContact O-N 3.02Å; P62-E66 PolarHBondContact O-N 3.34Å; P62-E66 VanDerWaalsContact O-N 3.1Å
63	A	84.1	Confident	84.2	Confident	45 Å²	45	50.2 Å²	50.2	37%	0.372	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-17.2	179	0	0	0	0	0	113.8	Q61 R67	Q61-A63 PolarHBondContact O-N 3.47Å; A63-R67 WeakPolarHBondContact O-CG 3.45Å; A63-R67 PolarHBondContact O-N 3.44Å; A63-R67 PolarHBondContact O-NH1 3.04Å
64	D	89	Confident	83.7	Confident	12 Å²	12	56.1 Å²	56.1	6%	0.064	28%	0.278	C	S	.	.	H	α-helix	trans	-80.7	-34	174.2	-54.3	-19.9	0	0	0	111.1	P36 F59 Q61 P62 R67 A68	P36-D64 WeakPolarHBondContact CD-OD2 3.39Å; F59-D64 HydrophobicContact CB-CB 3.96Å; F59-D64 HydrophobicContact CD1-CB 3.66Å; F59-D64 HydrophobicContact CE1-CB 4.4Å; F59-D64 HydrophobicContact CG-CB 3.95Å; Q61-D64 WeakPolarHBondContact CB-OD2 3.28Å; Q61-D64 WeakPolarHBondContact O-CB 3.22Å; Q61-D64 PolarHBondContact O-N 2.97Å; Q61-D64 VanDerWaalsContact O-N 3.14Å; P62-D64 PolarHBondContact O-N 3.48Å; D64-R67 IonicContact OD1-CZ 2.72Å; D64-R67 IonicContact OD1-NH1 2.68Å; D64-R67 PolarHBondContact OD1-NH1 3.06Å; D64-R67 IonicContact OD1-NH2 3.66Å; D64-R67 PolarHBondContact OD1-NH2 3.04Å; D64-A68 WeakPolarHBondContact O-CB 3.43Å; D64-A68 PolarHBondContact O-N 3.1Å
65	A	82.4	Confident	83.4	Confident	9 Å²	9	55.7 Å²	55.7	7%	0.074	28%	0.28	C	S	.	.	H	α-helix	trans	-70.2	-37.1	173.6	0	0	0	0	0	111.7	F59 P62 A68 L69	F59-A65 HydrophobicContact CD2-CB 3.64Å; F59-A65 HydrophobicContact CE2-CB 4.23Å; F59-A65 HydrophobicContact CG-CB 4.32Å; P62-A65 WeakPolarHBondContact O-CA 3.25Å; P62-A65 WeakPolarHBondContact O-CB 3.32Å; P62-A65 PolarHBondContact O-N 3.02Å; A65-A68 WeakPolarHBondContact O-CB 3.34Å; A65-A68 PolarHBondContact O-N 2.87Å; A65-L69 WeakPolarHBondContact O-CB 3.28Å; A65-L69 PolarHBondContact O-N 2.89Å
66	E	80.9	Confident	83.1	Confident	101 Å²	101	60.2 Å²	60.2	47%	0.472	31%	0.308	S	S	.	.	H	α-helix	trans	-60.7	-50.1	171.1	-67.8	168.3	-175.8	0	0	111.1	P62 A68 L69 D70	P62-E66 PolarHBondContact O-N 3.34Å; P62-E66 VanDerWaalsContact O-N 3.1Å; E66-A68 VanDerWaalsContact C-N 3.28Å; E66-A68 PolarHBondContact O-N 3.43Å; E66-L69 WeakPolarHBondContact O-CB 3.35Å; E66-L69 PolarHBondContact O-N 3.39Å; E66-L69 VanDerWaalsContact O-N 3.08Å; E66-D70 PolarHBondContact O-N 3.47Å
67	R	84.1	Confident	82.8	Confident	113 Å²	113	56.2 Å²	56.2	43%	0.426	29%	0.293	S	S	.	.	H	α-helix	trans	-60.9	-36.1	175.8	-69.9	-171	-43.6	-88.1	15.9	112.8	A34 A63 D64 T71	A34-R67 VanDerWaalsContact O-CZ 3.22Å; A34-R67 PolarHBondContact O-NE 2.85Å; A34-R67 PolarHBondContact O-NH2 3.12Å; A63-R67 WeakPolarHBondContact O-CG 3.45Å; A63-R67 PolarHBondContact O-N 3.44Å; A63-R67 PolarHBondContact O-NH1 3.04Å; D64-R67 IonicContact OD1-CZ 2.72Å; D64-R67 IonicContact OD1-NH1 2.68Å; D64-R67 PolarHBondContact OD1-NH1 3.06Å; D64-R67 IonicContact OD1-NH2 3.66Å; D64-R67 PolarHBondContact OD1-NH2 3.04Å; R67-T71 WeakPolarHBondContact O-CB 3.36Å; R67-T71 PolarHBondContact O-N 2.85Å; R67-T71 PolarHBondContact O-OG1 3.05Å
68	A	85.3	Confident	82.4	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.4	-40	173.7	0	0	0	0	0	112.5	L13 F31 A34 F59 D64 A65 E66 M72	L13-A68 HydrophobicContact CD2-CB 3.94Å; F31-A68 HydrophobicContact CD1-CB 3.88Å; F31-A68 HydrophobicContact CE1-CB 4.15Å; A34-A68 HydrophobicContact CB-CB 3.63Å; F59-A68 HydrophobicContact CE1-CB 4.48Å; F59-A68 HydrophobicContact CE2-CB 3.78Å; F59-A68 HydrophobicContact CZ-CB 3.54Å; D64-A68 WeakPolarHBondContact O-CB 3.43Å; D64-A68 PolarHBondContact O-N 3.1Å; A65-A68 WeakPolarHBondContact O-CB 3.34Å; A65-A68 PolarHBondContact O-N 2.87Å; E66-A68 VanDerWaalsContact C-N 3.28Å; E66-A68 PolarHBondContact O-N 3.43Å; A68-M72 HydrophobicContact CB-SD 4.47Å; A68-M72 WeakPolarHBondContact O-CA 3.38Å; A68-M72 VanDerWaalsContact O-CB 3.25Å; A68-M72 WeakPolarHBondContact O-CB 3.3Å; A68-M72 PolarHBondContact O-N 3.43Å
69	L	80.9	Confident	81.9	Confident	25 Å²	25	62.3 Å²	62.3	13%	0.131	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-49.2	176.7	177.6	63.2	0	0	0	111.6	L13 A65 E66 N73 C84 E86	L13-L69 HydrophobicContact CD1-CB 4.34Å; L13-L69 HydrophobicContact CD1-CD1 4.46Å; A65-L69 WeakPolarHBondContact O-CB 3.28Å; A65-L69 PolarHBondContact O-N 2.89Å; E66-L69 WeakPolarHBondContact O-CB 3.35Å; E66-L69 PolarHBondContact O-N 3.39Å; E66-L69 VanDerWaalsContact O-N 3.08Å; L69-N73 WeakPolarHBondContact O-CB 3.39Å; L69-C84 HydrophobicContact CD1-CB 3.52Å; L69-E86 HydrophobicContact CD2-CB 3.7Å; L69-E86 HydrophobicContact CD2-CG 3.91Å
70	D	77.4	Confident	81.3	Confident	144 Å²	144	65.7 Å²	65.7	77%	0.77	35%	0.351	S	S	*	.	H	α-helix	trans	-68.6	-36.3	-179	-78.9	-17.5	0	0	0	113	E66	E66-D70 PolarHBondContact O-N 3.47Å
71	T	79.1	Confident	80.6	Confident	100 Å²	100	65 Å²	65	61%	0.613	35%	0.353	S	S	*	.	H	α-helix	trans	-95.2	-26.1	-170.5	-42.8	0	0	0	0	113.8	R67	R67-T71 WeakPolarHBondContact O-CB 3.36Å; R67-T71 PolarHBondContact O-N 2.85Å; R67-T71 PolarHBondContact O-OG1 3.05Å
72	M	79.9	Confident	80.1	Confident	13 Å²	13	59.9 Å²	59.9	6%	0.064	33%	0.33	C	S	.	.	H	α-helix	trans	-124.8	8.6	-167.1	-49.7	174.2	171.7	0	0	114.2	K30 F31 P33 A34 A68 D75	K30-M72 VanDerWaalsContact O-CE 3.25Å; K30-M72 WeakPolarHBondContact O-CE 3.23Å; F31-M72 HydrophobicContact CB-SD 4.47Å; F31-M72 HydrophobicContact CD1-CB 4.49Å; F31-M72 HydrophobicContact CD1-SD 3.51Å; F31-M72 VanDerWaalsContact CD1-SD 3.51Å; F31-M72 HydrophobicContact CE1-CB 3.98Å; F31-M72 HydrophobicContact CE1-SD 3.97Å; F31-M72 HydrophobicContact CG-SD 4.17Å; P33-M72 HydrophobicContact CB-CE 3.98Å; P33-M72 HydrophobicContact CG-CE 4.37Å; A34-M72 HydrophobicContact CB-CE 3.75Å; A34-M72 HydrophobicContact CB-SD 4.13Å; A68-M72 HydrophobicContact CB-SD 4.47Å; A68-M72 WeakPolarHBondContact O-CA 3.38Å; A68-M72 VanDerWaalsContact O-CB 3.25Å; A68-M72 WeakPolarHBondContact O-CB 3.3Å; A68-M72 PolarHBondContact O-N 3.43Å; M72-D75 VanDerWaalsContact O-CB 3.32Å; M72-D75 WeakPolarHBondContact O-CB 3.41Å
73	N	76.8	Confident	79.6	Confident	45 Å²	45	60 Å²	60	24%	0.241	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	142.3	170	-159	1.7	0	0	0	110.5	L69 D75 V82 V83 C84	L69-N73 WeakPolarHBondContact O-CB 3.39Å; N73-D75 PolarHBondContact O-N 3.39Å; N73-V82 PolarHBondContact OD1-O 3.34Å; N73-V83 WeakPolarHBondContact OD1-CA 3.21Å; N73-C84 HydrophobicContact CB-CB 4.07Å; N73-C84 PolarHBondContact ND2-O 2.89Å; N73-C84 PolarHBondContact OD1-N 2.8Å
74	F	73.1	Confident	78.9	Confident	140 Å²	140	58.2 Å²	58.2	61%	0.614	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	3.9	-170.1	-52.7	-76.2	0	0	0	116.6	P81 V82 V83	F74-P81 HydrophobicContact CB-CB 4.49Å; F74-P81 VanDerWaalsContact O-CB 3.3Å; F74-P81 WeakPolarHBondContact O-CB 3.49Å; F74-V82 WeakPolarHBondContact CA-O 3.36Å; F74-V82 PolarHBondContact N-O 3.11Å; F74-V83 HydrophobicContact CE1-CG2 4.43Å
75	D	79.1	Confident	77.7	Confident	57 Å²	57	60 Å²	60	31%	0.305	32%	0.324	S	S	.	.			trans	-69.3	142.2	-179	-135.2	-37.3	0	0	0	111.6	K30 M72 N73 V82	K30-D75 WeakPolarHBondContact CE-OD2 3.45Å; K30-D75 IonicContact NZ-OD1 3.36Å; K30-D75 PolarHBondContact NZ-OD1 2.85Å; K30-D75 VanDerWaalsContact NZ-OD1 3.12Å; K30-D75 IonicContact NZ-OD2 3.97Å; K30-D75 PolarHBondContact NZ-OD2 2.91Å; M72-D75 VanDerWaalsContact O-CB 3.32Å; M72-D75 WeakPolarHBondContact O-CB 3.41Å; N73-D75 PolarHBondContact O-N 3.39Å; D75-V82 WeakPolarHBondContact O-CB 3.27Å; D75-V82 WeakPolarHBondContact O-CG2 3.49Å; D75-V82 PolarHBondContact O-N 3.22Å
76	V	80.9	Confident	76.4	Confident	95 Å²	95	64.8 Å²	64.8	58%	0.576	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	112.3	-164.1	-179.9	0	0	0	0	112.8	K80	V76-K80 CarbonylContact C-O 3.57Å; V76-K80 WeakPolarHBondContact CA-O 3.29Å
77	I	82.9	Confident	74.7	Confident	14 Å²	14	65.6 Å²	65.6	7%	0.072	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.2	168.7	-56.6	-179.8	0	0	0	109.5	V22 M26 L27 K30 G79 K80 V82	V22-I77 HydrophobicContact CG2-CG2 3.77Å; M26-I77 HydrophobicContact CE-CG2 4.1Å; L27-I77 HydrophobicContact CD2-CD1 3.94Å; K30-I77 HydrophobicContact CB-CD1 4.04Å; K30-I77 HydrophobicContact CG-CD1 4Å; K30-I77 HydrophobicContact CG-CG1 4.37Å; I77-G79 PolarHBondContact O-N 2.98Å; I77-K80 PolarHBondContact N-O 3.12Å; I77-K80 PolarHBondContact O-N 3.28Å; I77-V82 HydrophobicContact CB-CG2 4.1Å; I77-V82 HydrophobicContact CD1-CG2 3.52Å; I77-V82 HydrophobicContact CG1-CG2 3.59Å
78	K	81.9	Confident	73.3	Confident	99 Å²	99	63.2 Å²	63.2	43%	0.43	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	43.9	179.9	-73.7	-173.6	165.5	176.2	0	113.3	H19 D21 M26 K80	H19-K78 HydrophobicContact CB-CB 3.78Å; D21-K78 HydrophobicContact CB-CD 4.21Å; D21-K78 PolarHBondContact O-NZ 3.5Å; M26-K78 HydrophobicContact CE-CD 4.16Å; M26-K78 HydrophobicContact CE-CG 3.91Å; M26-K78 HydrophobicContact SD-CD 4Å; M26-K78 WeakPolarHBondContact SD-CE 3.36Å; M26-K78 HydrophobicContact SD-CG 4.41Å; K78-K80 VanDerWaalsContact C-N 3.29Å; K78-K80 PolarHBondContact O-N 3.28Å
79	G	77.4	Confident	71.7	Confident	68 Å²	68	68.7 Å²	68.7	70%	0.701	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	6	176.8	0	0	0	0	0	115.7	I77	I77-G79 PolarHBondContact O-N 2.98Å
80	K	74.8	Confident	70.5	Confident	70 Å²	70	72.3 Å²	72.3	30%	0.304	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.5	170.6	-71.3	-160.1	-177.7	-176.6	0	111.9	D17 L18 V76 I77 K78	D17-K80 WeakPolarHBondContact O-CD 3.45Å; D17-K80 PolarHBondContact O-NZ 3.24Å; L18-K80 PolarHBondContact O-NZ 3.35Å; V76-K80 CarbonylContact C-O 3.57Å; V76-K80 WeakPolarHBondContact CA-O 3.29Å; I77-K80 PolarHBondContact N-O 3.12Å; I77-K80 PolarHBondContact O-N 3.28Å; K78-K80 VanDerWaalsContact C-N 3.29Å; K78-K80 PolarHBondContact O-N 3.28Å
81	P	73.8	Confident	69.6	Low	63 Å²	63	68.9 Å²	68.9	41%	0.409	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	136.2	168.8	31	-33.8	0	0	0	110.1	F74	F74-P81 HydrophobicContact CB-CB 4.49Å; F74-P81 VanDerWaalsContact O-CB 3.3Å; F74-P81 WeakPolarHBondContact O-CB 3.49Å
82	V	75.4	Confident	69.2	Low	2 Å²	2	71.1 Å²	71.1	1%	0.012	41%	0.413	C	S	.	.			trans	-81.1	135.5	173.7	175.4	0	0	0	0	109.5	V15 L18 F31 N73 F74 D75 I77	V15-V82 HydrophobicContact CG1-CG1 3.38Å; L18-V82 HydrophobicContact CD2-CG1 4.41Å; L18-V82 HydrophobicContact CD2-CG2 3.95Å; F31-V82 HydrophobicContact CZ-CG1 4.12Å; N73-V82 PolarHBondContact OD1-O 3.34Å; F74-V82 WeakPolarHBondContact CA-O 3.36Å; F74-V82 PolarHBondContact N-O 3.11Å; D75-V82 WeakPolarHBondContact O-CB 3.27Å; D75-V82 WeakPolarHBondContact O-CG2 3.49Å; D75-V82 PolarHBondContact O-N 3.22Å; I77-V82 HydrophobicContact CB-CG2 4.1Å; I77-V82 HydrophobicContact CD1-CG2 3.52Å; I77-V82 HydrophobicContact CG1-CG2 3.59Å
83	V	72.8	Confident	68.6	Low	46 Å²	46	73.3 Å²	73.3	28%	0.279	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113.1	175.5	-179.7	0	0	0	0	110.5	G16 D17 N73 F74	G16-V83 PolarHBondContact N-O 3.43Å; G16-V83 PolarHBondContact O-N 3.45Å; G16-V83 VanDerWaalsContact O-N 3.08Å; D17-V83 HydrophobicContact CB-CG2 4.19Å; N73-V83 WeakPolarHBondContact OD1-CA 3.21Å; F74-V83 HydrophobicContact CE1-CG2 4.43Å
84	C	69.9	Low	68.6	Low	7 Å²	7	77.5 Å²	77.5	5%	0.047	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	134.2	175.7	-63.2	0	0	0	0	110.3	L13 Y14 L69 N73	L13-C84 HydrophobicContact CD1-CB 4.17Å; L13-C84 HydrophobicContact CD2-CB 4.2Å; L13-C84 HydrophobicContact CG-CB 4.36Å; Y14-C84 WeakPolarHBondContact O-CA 3.3Å; L69-C84 HydrophobicContact CD1-CB 3.52Å; N73-C84 HydrophobicContact CB-CB 4.07Å; N73-C84 PolarHBondContact ND2-O 2.89Å; N73-C84 PolarHBondContact OD1-N 2.8Å
85	D	63.4	Low	68.7	Low	49 Å²	49	76.1 Å²	76.1	26%	0.262	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127.5	179.2	-173.9	-3.1	0	0	0	110.5	Y14 N87 K90	Y14-D85 HydrophobicContact CD1-CB 4.03Å; Y14-D85 PolarHBondContact O-N 2.91Å; D85-N87 WeakPolarHBondContact OD1-CB 3.35Å; D85-N87 PolarHBondContact OD1-N 3.1Å; D85-K90 IonicContact OD1-NZ 2.69Å; D85-K90 IonicContact OD2-NZ 3.57Å; D85-K90 PolarHBondContact OD2-NZ 3.33Å
86	E	53.8	Low	68.3	Low	110 Å²	110	80.1 Å²	80.1	51%	0.514	47%	0.474	S	S	.	.			trans	-86	-21.5	-179.4	-151.4	-157.8	127.6	0	0	112.8	L69 G88	L69-E86 HydrophobicContact CD2-CB 3.7Å; L69-E86 HydrophobicContact CD2-CG 3.91Å; E86-G88 PolarHBondContact O-N 2.75Å
87	N	45.9	Very low	68.2	Low	117 Å²	117	79.3 Å²	79.3	63%	0.626	46%	0.463	S	S	*	.			trans	-72.5	91.6	-172.3	-73.1	143	0	0	0	111.3	D85 K90	D85-N87 WeakPolarHBondContact OD1-CB 3.35Å; D85-N87 PolarHBondContact OD1-N 3.1Å; N87-K90 VanDerWaalsContact O-CE 3.29Å; N87-K90 WeakPolarHBondContact O-CE 3.28Å
88	G	55.5	Low	68	Low	63 Å²	63	85.7 Å²	85.7	65%	0.649	49%	0.493	S	S	*	.			trans	-51.4	163.6	171.7	0	0	0	0	0	114	E86 K90	E86-G88 PolarHBondContact O-N 2.75Å; G88-K90 PolarHBondContact O-N 3.43Å; G88-K90 VanDerWaalsContact O-N 3.15Å
89	S	50.7	Low	68.1	Low	116 Å²	116	84 Å²	84	81%	0.811	49%	0.491	S	S	*	.			trans	-24	105.6	-165.6	-171.3	0	0	0	0	115.6	G91	S89-G91 PolarHBondContact O-N 2.89Å
90	K	54.9	Low	68.3	Low	101 Å²	101	87 Å²	87	44%	0.439	49%	0.487	S	S	.	.			trans	-73.2	26.4	-173.4	-65.3	170.8	-178.4	171.5	0	113.7	D85 N87 G88 Y92	D85-K90 IonicContact OD1-NZ 2.69Å; D85-K90 IonicContact OD2-NZ 3.57Å; D85-K90 PolarHBondContact OD2-NZ 3.33Å; N87-K90 VanDerWaalsContact O-CE 3.29Å; N87-K90 WeakPolarHBondContact O-CE 3.28Å; G88-K90 PolarHBondContact O-N 3.43Å; G88-K90 VanDerWaalsContact O-N 3.15Å; K90-Y92 HydrophobicContact CB-CD1 4.21Å; K90-Y92 HydrophobicContact CB-CE1 3.67Å; K90-Y92 WeakPolarHBondContact O-CD1 3.34Å; K90-Y92 PolarHBondContact O-N 2.62Å
91	G	59	Low	69	Low	71 Å²	71	89 Å²	89	73%	0.732	50%	0.497	S	S	*	.	S	Bend	trans	76.5	-1.5	-178.5	0	0	0	0	0	115.3	S89	S89-G91 PolarHBondContact O-N 2.89Å
92	Y	70.4	Confident	69.7	Low	147 Å²	147	87.1 Å²	87.1	58%	0.576	49%	0.487	S	S	*	.			trans	-140.6	160.8	178.4	65.6	-94.2	0	0	0	111.1	K90 F94	K90-Y92 HydrophobicContact CB-CD1 4.21Å; K90-Y92 HydrophobicContact CB-CE1 3.67Å; K90-Y92 WeakPolarHBondContact O-CD1 3.34Å; K90-Y92 PolarHBondContact O-N 2.62Å; Y92-F94 HydrophobicContact CD2-CE1 4.35Å; Y92-F94 HydrophobicContact CD2-CZ 4.06Å; Y92-F94 HydrophobicContact CE2-CE2 4.22Å; Y92-F94 AromaticContact CE2-CZ 3.89Å; Y92-F94 HydrophobicContact CE2-CZ 3.89Å
93	G	68.4	Low	70	Confident	59 Å²	59	88.4 Å²	88.4	61%	0.608	50%	0.498	S	S	*	.			trans	-149.3	168	172.5	0	0	0	0	0	110.9
94	F	75.7	Confident	70.8	Confident	133 Å²	133	89 Å²	89	58%	0.583	50%	0.497	S	S	*	.			trans	-112.5	116.2	176.6	-55	-54.8	0	0	0	109.2	Y92 F125	Y92-F94 HydrophobicContact CD2-CE1 4.35Å; Y92-F94 HydrophobicContact CD2-CZ 4.06Å; Y92-F94 HydrophobicContact CE2-CE2 4.22Å; Y92-F94 AromaticContact CE2-CZ 3.89Å; Y92-F94 HydrophobicContact CE2-CZ 3.89Å; F94-F125 HydrophobicContact CB-CD2 4.47Å; F94-F125 AromaticContact CD1-CD2 3.55Å; F94-F125 HydrophobicContact CD1-CD2 3.55Å; F94-F125 AromaticContact CD1-CE2 3.62Å; F94-F125 HydrophobicContact CD1-CE2 3.62Å; F94-F125 HydrophobicContact CD2-CE2 4.15Å; F94-F125 AromaticContact CE1-CD2 3.94Å; F94-F125 HydrophobicContact CE1-CD2 3.94Å; F94-F125 AromaticContact CE1-CE2 3.76Å; F94-F125 HydrophobicContact CE1-CE2 3.76Å; F94-F125 HydrophobicContact CE2-CE2 4.27Å; F94-F125 HydrophobicContact CG-CD2 4.02Å; F94-F125 AromaticContact CG-CE2 3.83Å; F94-F125 HydrophobicContact CG-CE2 3.83Å; F94-F125 HydrophobicContact CZ-CE2 4.09Å
95	V	76.7	Confident	71.8	Confident	112 Å²	112	94 Å²	94	68%	0.679	52%	0.516	S	S	*	.			trans	-100.8	121.1	178.6	-174.2	0	0	0	0	108.2	F97	V95-F97 HydrophobicContact CB-CE2 4.04Å; V95-F97 HydrophobicContact CG1-CD2 4.02Å; V95-F97 HydrophobicContact CG1-CE2 3.47Å; V95-F97 VanDerWaalsContact CG1-CE2 3.47Å; V95-F97 HydrophobicContact CG1-CZ 3.77Å
96	H	69.6	Low	72.9	Confident	140 Å²	140	92.3 Å²	92.3	65%	0.648	51%	0.508	S	S	*	.			trans	-94.8	130.9	171.2	-174.2	78.3	0	0	0	109
97	F	78.2	Confident	74.6	Confident	79 Å²	79	89 Å²	89	35%	0.346	49%	0.493	S	S	.	.			trans	-109.1	144.8	173.7	-70.3	-93.8	0	0	0	109.3	V95 T99 A102 A103 A106	V95-F97 HydrophobicContact CB-CE2 4.04Å; V95-F97 HydrophobicContact CG1-CD2 4.02Å; V95-F97 HydrophobicContact CG1-CE2 3.47Å; V95-F97 VanDerWaalsContact CG1-CE2 3.47Å; V95-F97 HydrophobicContact CG1-CZ 3.77Å; F97-T99 PolarHBondContact O-N 2.91Å; F97-A102 HydrophobicContact CB-CB 4.1Å; F97-A102 HydrophobicContact CD1-CB 3.99Å; F97-A102 HydrophobicContact CG-CB 4.37Å; F97-A103 HydrophobicContact CB-CB 4.06Å; F97-A103 HydrophobicContact CD2-CB 3.83Å; F97-A103 HydrophobicContact CG-CB 4.17Å; F97-A106 HydrophobicContact CE1-CB 3.79Å; F97-A106 HydrophobicContact CE2-CB 3.72Å; F97-A106 HydrophobicContact CZ-CB 3.27Å
98	E	80.2	Confident	76.6	Confident	148 Å²	148	90.8 Å²	90.8	69%	0.692	50%	0.498	S	S	*	.	S	Bend	trans	-60.7	-29.9	-179.3	-176.2	172.4	-152.5	0	0	113.5	M46	M46-E98 HydrophobicContact CE-CB 4.09Å; M46-E98 HydrophobicContact CE-CG 4.37Å
99	T	84.4	Confident	78.1	Confident	64 Å²	64	95 Å²	95	39%	0.393	50%	0.499	S	S	.	.	S	Bend	trans	-128.1	146.9	175.5	60.7	0	0	0	0	111.5	F97 E101 A102 A103	F97-T99 PolarHBondContact O-N 2.91Å; T99-E101 VanDerWaalsContact C-N 3.27Å; T99-E101 PolarHBondContact O-N 3.39Å; T99-A102 PolarHBondContact O-N 3.33Å; T99-A102 VanDerWaalsContact O-N 3.08Å; T99-A102 VanDerWaalsContact OG1-CB 3.26Å; T99-A102 WeakPolarHBondContact OG1-CB 3.47Å; T99-A102 PolarHBondContact OG1-N 3.45Å; T99-A103 PolarHBondContact O-N 2.84Å; T99-A103 VanDerWaalsContact O-N 3.15Å
100	Q	81.7	Confident	79.8	Confident	130 Å²	130	93.1 Å²	93.1	61%	0.607	48%	0.478	S	S	*	.	H	α-helix	trans	-57.2	-42.4	175.6	-176.4	-173.1	-49.2	0	0	111.2	A102 A103 E104	Q100-A102 VanDerWaalsContact C-N 3.28Å; Q100-A102 PolarHBondContact O-N 3.48Å; Q100-A103 WeakPolarHBondContact O-CA 3.5Å; Q100-A103 WeakPolarHBondContact O-CB 3.48Å; Q100-A103 PolarHBondContact O-N 2.96Å; Q100-A103 VanDerWaalsContact O-N 3.09Å; Q100-E104 WeakPolarHBondContact CG-OE1 3.32Å; Q100-E104 PolarHBondContact NE2-OE1 2.67Å; Q100-E104 WeakPolarHBondContact O-CG 3.17Å; Q100-E104 PolarHBondContact O-N 2.92Å
101	E	88.9	Confident	81.3	Confident	111 Å²	111	91.8 Å²	91.8	52%	0.519	48%	0.476	S	S	.	.	H	α-helix	trans	-60	-36.3	176.5	-54.7	177.1	-175.7	0	0	112.8	T99 E104 R105	T99-E101 VanDerWaalsContact C-N 3.27Å; T99-E101 PolarHBondContact O-N 3.39Å; E101-E104 PolarHBondContact O-N 2.79Å; E101-R105 VanDerWaalsContact CB-NH2 3.3Å; E101-R105 WeakPolarHBondContact O-CB 3.24Å; E101-R105 VanDerWaalsContact O-CG 3.27Å; E101-R105 WeakPolarHBondContact O-CG 3.34Å; E101-R105 PolarHBondContact O-N 3.31Å; E101-R105 PolarHBondContact O-NE 2.82Å; E101-R105 IonicContact OE2-CZ 3.05Å; E101-R105 IonicContact OE2-NH1 3.65Å; E101-R105 PolarHBondContact OE2-NH1 2.78Å; E101-R105 IonicContact OE2-NH2 3.39Å; E101-R105 PolarHBondContact OE2-NH2 2.88Å; E101-R105 VanDerWaalsContact OE2-NH2 3.08Å
102	A	87.5	Confident	82.3	Confident	25 Å²	25	89.9 Å²	89.9	21%	0.207	46%	0.456	C	S	.	.	H	α-helix	trans	-69.1	-36.5	176.2	0	0	0	0	0	111.2	F97 T99 Q100 A106	F97-A102 HydrophobicContact CB-CB 4.1Å; F97-A102 HydrophobicContact CD1-CB 3.99Å; F97-A102 HydrophobicContact CG-CB 4.37Å; T99-A102 PolarHBondContact O-N 3.33Å; T99-A102 VanDerWaalsContact O-N 3.08Å; T99-A102 VanDerWaalsContact OG1-CB 3.26Å; T99-A102 WeakPolarHBondContact OG1-CB 3.47Å; T99-A102 PolarHBondContact OG1-N 3.45Å; Q100-A102 VanDerWaalsContact C-N 3.28Å; Q100-A102 PolarHBondContact O-N 3.48Å; A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.06Å
103	A	83.1	Confident	83.1	Confident	29 Å²	29	87 Å²	87	24%	0.24	45%	0.449	C	S	.	.	H	α-helix	trans	-63.9	-40	170.2	0	0	0	0	0	112	F97 T99 Q100 A106 I107	F97-A103 HydrophobicContact CB-CB 4.06Å; F97-A103 HydrophobicContact CD2-CB 3.83Å; F97-A103 HydrophobicContact CG-CB 4.17Å; T99-A103 PolarHBondContact O-N 2.84Å; T99-A103 VanDerWaalsContact O-N 3.15Å; Q100-A103 WeakPolarHBondContact O-CA 3.5Å; Q100-A103 WeakPolarHBondContact O-CB 3.48Å; Q100-A103 PolarHBondContact O-N 2.96Å; Q100-A103 VanDerWaalsContact O-N 3.09Å; A103-A106 PolarHBondContact O-N 3.36Å; A103-I107 WeakPolarHBondContact O-CD1 3.48Å; A103-I107 WeakPolarHBondContact O-CG1 3.43Å; A103-I107 PolarHBondContact O-N 3.24Å
104	E	88.9	Confident	83.9	Confident	57 Å²	57	90.3 Å²	90.3	27%	0.266	45%	0.452	S	S	.	.	H	α-helix	trans	-68.8	-48.7	179.1	-74	163.6	171.9	0	0	111.8	Q100 E101 A106 I107 E108 R124	Q100-E104 WeakPolarHBondContact CG-OE1 3.32Å; Q100-E104 PolarHBondContact NE2-OE1 2.67Å; Q100-E104 WeakPolarHBondContact O-CG 3.17Å; Q100-E104 PolarHBondContact O-N 2.92Å; E101-E104 PolarHBondContact O-N 2.79Å; E104-A106 PolarHBondContact O-N 2.79Å; E104-I107 WeakPolarHBondContact O-CB 3.24Å; E104-I107 PolarHBondContact O-N 2.92Å; E104-E108 WeakPolarHBondContact O-CG 3.44Å; E104-E108 PolarHBondContact O-N 2.65Å; E104-R124 IonicContact OE1-CZ 2.8Å; E104-R124 IonicContact OE1-NE 3.39Å; E104-R124 IonicContact OE1-NH2 3.32Å; E104-R124 PolarHBondContact OE1-NH2 2.97Å
105	R	90.5	Very high	83.9	Confident	114 Å²	114	89.1 Å²	89.1	43%	0.43	45%	0.451	S	S	.	.	H	α-helix	trans	-58	-31	171.6	-70.8	-179.3	-70.1	-111	1.7	112.5	E101 K109	E101-R105 VanDerWaalsContact CB-NH2 3.3Å; E101-R105 WeakPolarHBondContact O-CB 3.24Å; E101-R105 VanDerWaalsContact O-CG 3.27Å; E101-R105 WeakPolarHBondContact O-CG 3.34Å; E101-R105 PolarHBondContact O-N 3.31Å; E101-R105 PolarHBondContact O-NE 2.82Å; E101-R105 IonicContact OE2-CZ 3.05Å; E101-R105 IonicContact OE2-NH1 3.65Å; E101-R105 PolarHBondContact OE2-NH1 2.78Å; E101-R105 IonicContact OE2-NH2 3.39Å; E101-R105 PolarHBondContact OE2-NH2 2.88Å; E101-R105 VanDerWaalsContact OE2-NH2 3.08Å; R105-K109 WeakPolarHBondContact O-CB 3.34Å; R105-K109 VanDerWaalsContact O-CG 3.28Å; R105-K109 WeakPolarHBondContact O-CG 3.27Å; R105-K109 PolarHBondContact O-N 3.46Å
106	A	86	Confident	83.7	Confident	13 Å²	13	90.9 Å²	90.9	11%	0.107	46%	0.456	C	S	.	.	H	α-helix	trans	-76.8	-37.5	173.7	0	0	0	0	0	112.7	F97 A102 A103 E104 M110	F97-A106 HydrophobicContact CE1-CB 3.79Å; F97-A106 HydrophobicContact CE2-CB 3.72Å; F97-A106 HydrophobicContact CZ-CB 3.27Å; A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.06Å; A103-A106 PolarHBondContact O-N 3.36Å; E104-A106 PolarHBondContact O-N 2.79Å; A106-M110 WeakPolarHBondContact O-CA 3.49Å; A106-M110 WeakPolarHBondContact O-CB 3.46Å; A106-M110 WeakPolarHBondContact O-CG 3.47Å; A106-M110 PolarHBondContact O-N 2.94Å
107	I	89.5	Confident	84.1	Confident	39 Å²	39	91.6 Å²	91.6	20%	0.2	47%	0.465	C	S	.	.	H	α-helix	trans	-61.1	-51.6	172.4	-71.4	160.4	0	0	0	109.6	A103 E104 K109 N111 V122 R124	A103-I107 WeakPolarHBondContact O-CD1 3.48Å; A103-I107 WeakPolarHBondContact O-CG1 3.43Å; A103-I107 PolarHBondContact O-N 3.24Å; E104-I107 WeakPolarHBondContact O-CB 3.24Å; E104-I107 PolarHBondContact O-N 2.92Å; I107-K109 PolarHBondContact O-N 3.01Å; I107-N111 WeakPolarHBondContact O-CB 3.3Å; I107-N111 PolarHBondContact O-N 3.04Å; I107-V122 HydrophobicContact CG1-CG1 3.97Å; I107-R124 HydrophobicContact CD1-CG 3.81Å
108	E	87.9	Confident	83.6	Confident	156 Å²	156	97.2 Å²	97.2	73%	0.729	48%	0.484	S	S	*	.	H	α-helix	trans	-58.5	-43.8	-179.9	-70.4	175.5	165.9	0	0	113	E104	E104-E108 WeakPolarHBondContact O-CG 3.44Å; E104-E108 PolarHBondContact O-N 2.65Å
109	K	88.1	Confident	83.9	Confident	151 Å²	151	97.7 Å²	97.7	66%	0.657	48%	0.484	S	S	*	.	H	α-helix	trans	-85	-35.1	-175.1	-67.7	-179.3	-179.4	-173.8	0	114.1	R105 I107 M113	R105-K109 WeakPolarHBondContact O-CB 3.34Å; R105-K109 VanDerWaalsContact O-CG 3.28Å; R105-K109 WeakPolarHBondContact O-CG 3.27Å; R105-K109 PolarHBondContact O-N 3.46Å; I107-K109 PolarHBondContact O-N 3.01Å; K109-M113 WeakPolarHBondContact O-CE 3.47Å; K109-M113 VanDerWaalsContact O-CG 3.3Å; K109-M113 WeakPolarHBondContact O-CG 3.24Å
110	M	85.5	Confident	83.8	Confident	77 Å²	77	96.6 Å²	96.6	38%	0.379	48%	0.477	S	S	.	.	H	α-helix	trans	-94.6	-26.6	-173.5	-54	-65.5	-59.9	0	0	112.9	A106 G112 M113 V120 V122	A106-M110 WeakPolarHBondContact O-CA 3.49Å; A106-M110 WeakPolarHBondContact O-CB 3.46Å; A106-M110 WeakPolarHBondContact O-CG 3.47Å; A106-M110 PolarHBondContact O-N 2.94Å; M110-G112 PolarHBondContact O-N 3.08Å; M110-G112 VanDerWaalsContact O-N 3.11Å; M110-M113 HydrophobicContact CE-CE 3.77Å; M110-M113 HydrophobicContact CG-CE 4.5Å; M110-M113 PolarHBondContact O-N 3.01Å; M110-M113 VanDerWaalsContact O-N 3.12Å; M110-M113 HydrophobicContact SD-CE 3.34Å; M110-M113 WeakPolarHBondContact SD-CE 3.42Å; M110-V120 WeakPolarHBondContact O-CG2 3.21Å; M110-V122 HydrophobicContact CB-CB 4.3Å; M110-V122 HydrophobicContact CB-CG2 3.72Å
111	N	86.6	Confident	83.9	Confident	73 Å²	73	98.6 Å²	98.6	39%	0.39	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	113.4	-175.2	-172.5	28.9	0	0	0	111.4	I107 F121 V122	I107-N111 WeakPolarHBondContact O-CB 3.3Å; I107-N111 PolarHBondContact O-N 3.04Å; N111-F121 WeakPolarHBondContact OD1-CA 3.49Å; N111-F121 VanDerWaalsContact OD1-CD2 3.25Å; N111-F121 WeakPolarHBondContact OD1-CD2 3.33Å; N111-V122 HydrophobicContact CB-CB 4.12Å; N111-V122 VanDerWaalsContact CB-O 3.32Å; N111-V122 WeakPolarHBondContact CB-O 3.45Å; N111-V122 PolarHBondContact ND2-O 2.9Å; N111-V122 PolarHBondContact OD1-N 3.03Å; N111-V122 PolarHBondContact OD1-O 2.87Å
112	G	81.4	Confident	83.9	Confident	30 Å²	30	95.2 Å²	95.2	31%	0.309	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	3.2	-178.2	0	0	0	0	0	115.4	M110 K119 V120	M110-G112 PolarHBondContact O-N 3.08Å; M110-G112 VanDerWaalsContact O-N 3.11Å; G112-K119 WeakPolarHBondContact O-CE 3.25Å; G112-V120 WeakPolarHBondContact CA-O 2.97Å; G112-V120 PolarHBondContact N-O 3.13Å
113	M	87	Confident	83.8	Confident	88 Å²	88	95.7 Å²	95.7	43%	0.433	48%	0.478	S	S	.	.			trans	-68.9	157.5	168.6	-73.5	-145.5	-71.1	0	0	111.9	K109 M110 K119 V120	K109-M113 WeakPolarHBondContact O-CE 3.47Å; K109-M113 VanDerWaalsContact O-CG 3.3Å; K109-M113 WeakPolarHBondContact O-CG 3.24Å; M110-M113 HydrophobicContact CE-CE 3.77Å; M110-M113 HydrophobicContact CG-CE 4.5Å; M110-M113 PolarHBondContact O-N 3.01Å; M110-M113 VanDerWaalsContact O-N 3.12Å; M110-M113 HydrophobicContact SD-CE 3.34Å; M110-M113 WeakPolarHBondContact SD-CE 3.42Å; M113-K119 CarbonylContact O-C 3.42Å; M113-K119 WeakPolarHBondContact O-CA 3.08Å; M113-V120 HydrophobicContact CB-CG2 4.39Å; M113-V120 WeakPolarHBondContact O-CG2 3.4Å; M113-V120 PolarHBondContact O-N 3.14Å
114	L	83.8	Confident	83.9	Confident	128 Å²	128	102.7 Å²	102.7	67%	0.67	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.9	173.9	-71.1	159.2	0	0	0	109.4	R118 K119	L114-R118 WeakPolarHBondContact CA-O 3.38Å; L114-K119 HydrophobicContact CD2-CB 4.21Å
115	L	75.6	Confident	83.5	Confident	107 Å²	107	106.3 Å²	106.3	56%	0.56	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	115	175.1	-168.9	72.3	0	0	0	108.2	D117 R118 V120	L115-D117 VanDerWaalsContact C-N 3.31Å; L115-D117 PolarHBondContact O-N 3.38Å; L115-R118 PolarHBondContact N-O 3.33Å; L115-R118 PolarHBondContact O-N 3.4Å; L115-R118 VanDerWaalsContact O-N 3.12Å; L115-V120 HydrophobicContact CB-CG1 3.97Å; L115-V120 HydrophobicContact CD2-CG1 4.41Å
116	N	73.9	Confident	82.7	Confident	149 Å²	149	104.6 Å²	104.6	80%	0.797	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	53.7	-169.7	-56.8	-16.8	0	0	0	111.4	R118	N116-R118 PolarHBondContact O-N 3.45Å
117	D	77.4	Confident	82	Confident	156 Å²	156	106 Å²	106	83%	0.834	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	6.3	-177.6	-51.8	-43.9	0	0	0	116.5	L115	L115-D117 VanDerWaalsContact C-N 3.31Å; L115-D117 PolarHBondContact O-N 3.38Å
118	R	68.6	Low	80.6	Confident	196 Å²	196	113.5 Å²	113.5	74%	0.74	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.5	176.1	-63.1	-178.9	-174.5	-160.8	0.4	110.5	L114 L115 N116 V120	L114-R118 WeakPolarHBondContact CA-O 3.38Å; L115-R118 PolarHBondContact N-O 3.33Å; L115-R118 PolarHBondContact O-N 3.4Å; L115-R118 VanDerWaalsContact O-N 3.12Å; N116-R118 PolarHBondContact O-N 3.45Å; R118-V120 PolarHBondContact O-N 3.37Å
119	K	85.4	Confident	79.8	Confident	159 Å²	159	114.5 Å²	114.5	69%	0.691	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	109	174.9	-172.2	169.8	-174.5	172.6	0	109.6	G112 M113 L114	G112-K119 WeakPolarHBondContact O-CE 3.25Å; M113-K119 CarbonylContact O-C 3.42Å; M113-K119 WeakPolarHBondContact O-CA 3.08Å; L114-K119 HydrophobicContact CD2-CB 4.21Å
120	V	82.2	Confident	79.1	Confident	41 Å²	41	111.6 Å²	111.6	25%	0.248	53%	0.534	C	S	.	.			trans	-78.1	140.3	178.7	-67.6	0	0	0	0	110.7	M110 G112 M113 L115 R118	M110-V120 WeakPolarHBondContact O-CG2 3.21Å; G112-V120 WeakPolarHBondContact CA-O 2.97Å; G112-V120 PolarHBondContact N-O 3.13Å; M113-V120 HydrophobicContact CB-CG2 4.39Å; M113-V120 WeakPolarHBondContact O-CG2 3.4Å; M113-V120 PolarHBondContact O-N 3.14Å; L115-V120 HydrophobicContact CB-CG1 3.97Å; L115-V120 HydrophobicContact CD2-CG1 4.41Å; R118-V120 PolarHBondContact O-N 3.37Å
121	F	84.8	Confident	78	Confident	172 Å²	172	113 Å²	113	75%	0.754	54%	0.536	S	S	*	.			trans	-103.3	130.1	169.9	176.3	-95.9	0	0	0	109.2	N111	N111-F121 WeakPolarHBondContact OD1-CA 3.49Å; N111-F121 VanDerWaalsContact OD1-CD2 3.25Å; N111-F121 WeakPolarHBondContact OD1-CD2 3.33Å
122	V	87.3	Confident	76.9	Confident	39 Å²	39	115.1 Å²	115.1	24%	0.236	54%	0.543	C	S	.	.			trans	-131.3	131	178.9	-172.6	0	0	0	0	108.6	I107 M110 N111	I107-V122 HydrophobicContact CG1-CG1 3.97Å; M110-V122 HydrophobicContact CB-CB 4.3Å; M110-V122 HydrophobicContact CB-CG2 3.72Å; N111-V122 HydrophobicContact CB-CB 4.12Å; N111-V122 VanDerWaalsContact CB-O 3.32Å; N111-V122 WeakPolarHBondContact CB-O 3.45Å; N111-V122 PolarHBondContact ND2-O 2.9Å; N111-V122 PolarHBondContact OD1-N 3.03Å; N111-V122 PolarHBondContact OD1-O 2.87Å
123	G	85.9	Confident	76.2	Confident	35 Å²	35	116.8 Å²	116.8	36%	0.361	55%	0.554	S	S	.	*			trans	-160.6	168.3	-176.2	0	0	0	0	0	111.2	F125	G123-F125 PolarHBondContact O-N 3.24Å
124	R	86.1	Confident	75.1	Confident	176 Å²	176	116.8 Å²	116.8	66%	0.664	55%	0.553	S	S	*	*			trans	-57.3	136.2	176.8	-74.5	-176.9	168.4	-168.9	-1.9	110.5	E104 I107 K126	E104-R124 IonicContact OE1-CZ 2.8Å; E104-R124 IonicContact OE1-NE 3.39Å; E104-R124 IonicContact OE1-NH2 3.32Å; E104-R124 PolarHBondContact OE1-NH2 2.97Å; I107-R124 HydrophobicContact CD1-CG 3.81Å; R124-K126 PolarHBondContact O-N 3.07Å; R124-K126 VanDerWaalsContact O-N 3.12Å
125	F	79.9	Confident	73.6	Confident	133 Å²	133	116 Å²	116	58%	0.583	55%	0.548	S	S	*	.			trans	-65.6	111.4	-180	174.4	-97.7	0	0	0	110.9	F94 G123	F94-F125 HydrophobicContact CB-CD2 4.47Å; F94-F125 AromaticContact CD1-CD2 3.55Å; F94-F125 HydrophobicContact CD1-CD2 3.55Å; F94-F125 AromaticContact CD1-CE2 3.62Å; F94-F125 HydrophobicContact CD1-CE2 3.62Å; F94-F125 HydrophobicContact CD2-CE2 4.15Å; F94-F125 AromaticContact CE1-CD2 3.94Å; F94-F125 HydrophobicContact CE1-CD2 3.94Å; F94-F125 AromaticContact CE1-CE2 3.76Å; F94-F125 HydrophobicContact CE1-CE2 3.76Å; F94-F125 HydrophobicContact CE2-CE2 4.27Å; F94-F125 HydrophobicContact CG-CD2 4.02Å; F94-F125 AromaticContact CG-CE2 3.83Å; F94-F125 HydrophobicContact CG-CE2 3.83Å; F94-F125 HydrophobicContact CZ-CE2 4.09Å; G123-F125 PolarHBondContact O-N 3.24Å
126	K	74.8	Confident	72.7	Confident	78 Å²	78	112.3 Å²	112.3	34%	0.339	54%	0.537	S	S	.	.			trans	-96	127	166.4	-65.3	-171.2	166.2	176.5	0	110	R124 E130 R131 E134	R124-K126 PolarHBondContact O-N 3.07Å; R124-K126 VanDerWaalsContact O-N 3.12Å; K126-E130 VanDerWaalsContact CA-OE2 3.31Å; K126-E130 WeakPolarHBondContact CA-OE2 3.24Å; K126-E130 HydrophobicContact CB-CG 4.42Å; K126-E130 WeakPolarHBondContact CG-OE1 3.49Å; K126-R131 PolarHBondContact O-NH2 2.84Å; K126-E134 VanDerWaalsContact CD-OE2 3.26Å; K126-E134 WeakPolarHBondContact CD-OE2 3.25Å; K126-E134 IonicContact NZ-OE1 3.75Å; K126-E134 PolarHBondContact NZ-OE1 2.99Å; K126-E134 IonicContact NZ-OE2 2.67Å; K126-E134 PolarHBondContact NZ-OE2 3.39Å
127	S	70.5	Confident	72	Confident	43 Å²	43	107.5 Å²	107.5	30%	0.301	52%	0.518	S	S	.	.			trans	-63.7	160.9	-179.9	70.7	0	0	0	0	111.8	K129 E130 R131	S127-K129 VanDerWaalsContact C-N 3.35Å; S127-K129 PolarHBondContact O-N 3.19Å; S127-E130 PolarHBondContact N-OE2 3.41Å; S127-E130 PolarHBondContact O-N 2.94Å; S127-E130 WeakPolarHBondContact OG-CB 3.36Å; S127-E130 PolarHBondContact OG-N 3.47Å; S127-E130 PolarHBondContact OG-OE2 3.16Å; S127-R131 VanDerWaalsContact O-CB 3.31Å; S127-R131 WeakPolarHBondContact O-CB 3.4Å; S127-R131 PolarHBondContact O-N 2.96Å
128	R	60.9	Low	71	Confident	196 Å²	196	108.7 Å²	108.7	74%	0.74	51%	0.511	S	S	*	.	H	α-helix	trans	-56.2	-49.8	177	178.4	178.8	170.7	167.6	1	111.2	E130 R131 E132	R128-E130 VanDerWaalsContact C-N 3.33Å; R128-E130 PolarHBondContact O-N 3.26Å; R128-R131 PolarHBondContact O-N 3.33Å; R128-E132 IonicContact NE-OE2 2.76Å; R128-E132 PolarHBondContact NE-OE2 2.8Å; R128-E132 IonicContact NH2-OE2 3.66Å; R128-E132 WeakPolarHBondContact O-CB 3.36Å; R128-E132 PolarHBondContact O-N 2.99Å
129	K	70.4	Confident	70.3	Confident	178 Å²	178	102.8 Å²	102.8	77%	0.774	50%	0.504	S	S	*	.	H	α-helix	trans	-60.8	-40	-178.6	-176.3	178.6	178.2	-178.6	0	112.6	S127 A133	S127-K129 VanDerWaalsContact C-N 3.35Å; S127-K129 PolarHBondContact O-N 3.19Å; K129-A133 VanDerWaalsContact O-CB 3.24Å; K129-A133 WeakPolarHBondContact O-CB 3.27Å; K129-A133 PolarHBondContact O-N 3.24Å
130	E	73.1	Confident	69.2	Low	89 Å²	89	102.4 Å²	102.4	42%	0.416	50%	0.502	S	S	.	.	H	α-helix	trans	-67.9	-47.3	176.1	176.9	-169.6	175.5	0	0	111.8	K126 S127 R128 E132 A133 E134	K126-E130 VanDerWaalsContact CA-OE2 3.31Å; K126-E130 WeakPolarHBondContact CA-OE2 3.24Å; K126-E130 HydrophobicContact CB-CG 4.42Å; K126-E130 WeakPolarHBondContact CG-OE1 3.49Å; S127-E130 PolarHBondContact N-OE2 3.41Å; S127-E130 PolarHBondContact O-N 2.94Å; S127-E130 WeakPolarHBondContact OG-CB 3.36Å; S127-E130 PolarHBondContact OG-N 3.47Å; S127-E130 PolarHBondContact OG-OE2 3.16Å; R128-E130 VanDerWaalsContact C-N 3.33Å; R128-E130 PolarHBondContact O-N 3.26Å; E130-E132 VanDerWaalsContact C-N 3.3Å; E130-E132 PolarHBondContact O-N 3.32Å; E130-A133 CarbonylContact O-C 3.46Å; E130-A133 PolarHBondContact O-N 2.85Å; E130-E134 WeakPolarHBondContact O-CB 3.41Å; E130-E134 PolarHBondContact O-N 2.68Å
131	R	63.4	Low	68.9	Low	108 Å²	108	105.1 Å²	105.1	41%	0.408	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-36.7	177.3	-164.4	-174.3	-49	168.2	7.6	112	K126 S127 R128 L135	K126-R131 PolarHBondContact O-NH2 2.84Å; S127-R131 VanDerWaalsContact O-CB 3.31Å; S127-R131 WeakPolarHBondContact O-CB 3.4Å; S127-R131 PolarHBondContact O-N 2.96Å; R128-R131 PolarHBondContact O-N 3.33Å; R131-L135 HydrophobicContact CG-CD1 4.26Å; R131-L135 VanDerWaalsContact O-CB 3.26Å; R131-L135 WeakPolarHBondContact O-CB 3.45Å; R131-L135 WeakPolarHBondContact O-CD1 3.44Å; R131-L135 VanDerWaalsContact O-CG 3.24Å; R131-L135 WeakPolarHBondContact O-CG 3.43Å; R131-L135 PolarHBondContact O-N 3.11Å
132	E	63.1	Low	68.8	Low	116 Å²	116	98.4 Å²	98.4	54%	0.542	48%	0.483	S	S	.	.	H	α-helix	trans	-72.9	-33.4	175.7	-164.9	169.1	154.2	0	0	111.5	R128 E130 G136	R128-E132 IonicContact NE-OE2 2.76Å; R128-E132 PolarHBondContact NE-OE2 2.8Å; R128-E132 IonicContact NH2-OE2 3.66Å; R128-E132 WeakPolarHBondContact O-CB 3.36Å; R128-E132 PolarHBondContact O-N 2.99Å; E130-E132 VanDerWaalsContact C-N 3.3Å; E130-E132 PolarHBondContact O-N 3.32Å; E132-G136 WeakPolarHBondContact O-CA 3.37Å; E132-G136 PolarHBondContact O-N 2.97Å
133	A	65.9	Low	69	Low	65 Å²	65	99 Å²	99	54%	0.537	49%	0.486	S	S	.	.	H	α-helix	trans	-71.9	-38.4	170.6	0	0	0	0	0	112.8	K129 E130 G136 A137	K129-A133 VanDerWaalsContact O-CB 3.24Å; K129-A133 WeakPolarHBondContact O-CB 3.27Å; K129-A133 PolarHBondContact O-N 3.24Å; E130-A133 CarbonylContact O-C 3.46Å; E130-A133 PolarHBondContact O-N 2.85Å; A133-G136 CarbonylContact O-C 3.57Å; A133-G136 PolarHBondContact O-N 3.21Å; A133-A137 WeakPolarHBondContact O-CB 3.34Å; A133-A137 PolarHBondContact O-N 3.23Å
134	E	63.4	Low	69.2	Low	88 Å²	88	101 Å²	101	41%	0.411	49%	0.489	S	S	.	.	H	α-helix	trans	-68.2	-48.2	176.2	-178.2	177.1	-158.3	0	0	111.2	K126 E130 G136 A137 R138	K126-E134 VanDerWaalsContact CD-OE2 3.26Å; K126-E134 WeakPolarHBondContact CD-OE2 3.25Å; K126-E134 IonicContact NZ-OE1 3.75Å; K126-E134 PolarHBondContact NZ-OE1 2.99Å; K126-E134 IonicContact NZ-OE2 2.67Å; K126-E134 PolarHBondContact NZ-OE2 3.39Å; E130-E134 WeakPolarHBondContact O-CB 3.41Å; E130-E134 PolarHBondContact O-N 2.68Å; E134-G136 VanDerWaalsContact C-N 3.3Å; E134-G136 PolarHBondContact O-N 2.83Å; E134-A137 PolarHBondContact O-N 3.04Å; E134-R138 PolarHBondContact O-N 3.33Å
135	L	53.5	Low	69.6	Low	111 Å²	111	92.7 Å²	92.7	58%	0.581	46%	0.457	S	S	*	.	H	α-helix	trans	-62.5	-37.8	171	-72.8	167.4	0	0	0	111.5	R131 A137 R138 A139	R131-L135 HydrophobicContact CG-CD1 4.26Å; R131-L135 VanDerWaalsContact O-CB 3.26Å; R131-L135 WeakPolarHBondContact O-CB 3.45Å; R131-L135 WeakPolarHBondContact O-CD1 3.44Å; R131-L135 VanDerWaalsContact O-CG 3.24Å; R131-L135 WeakPolarHBondContact O-CG 3.43Å; R131-L135 PolarHBondContact O-N 3.11Å; L135-A137 VanDerWaalsContact C-N 3.31Å; L135-A137 PolarHBondContact O-N 3.26Å; L135-R138 CarbonylContact O-C 3.54Å; L135-R138 PolarHBondContact O-N 2.9Å; L135-A139 WeakPolarHBondContact O-CB 3.36Å; L135-A139 PolarHBondContact O-N 3.35Å
136	G	56.5	Low	70.3	Confident	31 Å²	31	87.5 Å²	87.5	32%	0.32	43%	0.434	S	S	.	.	H	α-helix	trans	-69.9	-22.8	175.4	0	0	0	0	0	114.4	E132 A133 E134 K140	E132-G136 WeakPolarHBondContact O-CA 3.37Å; E132-G136 PolarHBondContact O-N 2.97Å; A133-G136 CarbonylContact O-C 3.57Å; A133-G136 PolarHBondContact O-N 3.21Å; E134-G136 VanDerWaalsContact C-N 3.3Å; E134-G136 PolarHBondContact O-N 2.83Å; G136-K140 WeakPolarHBondContact O-CG 3.4Å
137	A	58.8	Low	71.2	Confident	48 Å²	48	83.8 Å²	83.8	40%	0.397	42%	0.418	S	S	.	.	H	α-helix	trans	-78.2	-49.5	168.2	0	0	0	0	0	110.3	A133 E134 L135 A139 K140 E141	A133-A137 WeakPolarHBondContact O-CB 3.34Å; A133-A137 PolarHBondContact O-N 3.23Å; E134-A137 PolarHBondContact O-N 3.04Å; L135-A137 VanDerWaalsContact C-N 3.31Å; L135-A137 PolarHBondContact O-N 3.26Å; A137-A139 PolarHBondContact O-N 3.42Å; A137-A139 VanDerWaalsContact O-N 3.14Å; A137-K140 WeakPolarHBondContact O-CA 3.36Å; A137-K140 WeakPolarHBondContact O-CB 3.5Å; A137-K140 PolarHBondContact O-N 2.91Å; A137-E141 PolarHBondContact O-N 3.42Å
138	R	56.2	Low	72.3	Confident	181 Å²	181	86.4 Å²	86.4	68%	0.683	42%	0.424	S	S	*	.	H	α-helix	trans	-63.5	-16.9	175	-107.9	-173.7	71.5	172.8	3.6	114.9	E134 L135 E141	E134-R138 PolarHBondContact O-N 3.33Å; L135-R138 CarbonylContact O-C 3.54Å; L135-R138 PolarHBondContact O-N 2.9Å; R138-E141 VanDerWaalsContact CG-OE1 3.24Å; R138-E141 WeakPolarHBondContact CG-OE1 3.35Å; R138-E141 WeakPolarHBondContact CG-OE2 3.43Å
139	A	55.2	Low	73.7	Confident	72 Å²	72	80.3 Å²	80.3	60%	0.595	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-8.8	170.7	0	0	0	0	0	113.7	L135 A137	L135-A139 WeakPolarHBondContact O-CB 3.36Å; L135-A139 PolarHBondContact O-N 3.35Å; A137-A139 PolarHBondContact O-N 3.42Å; A137-A139 VanDerWaalsContact O-N 3.14Å
140	K	62.2	Low	74.6	Confident	151 Å²	151	72 Å²	72	66%	0.657	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-33.5	166.7	-71.2	168.6	-176.7	176	0	111.5	G136 A137 F142	G136-K140 WeakPolarHBondContact O-CG 3.4Å; A137-K140 WeakPolarHBondContact O-CA 3.36Å; A137-K140 WeakPolarHBondContact O-CB 3.5Å; A137-K140 PolarHBondContact O-N 2.91Å; K140-F142 WeakPolarHBondContact O-CD1 3.17Å; K140-F142 PolarHBondContact O-N 2.99Å
141	E	75.3	Confident	75.1	Confident	98 Å²	98	67.9 Å²	67.9	46%	0.458	35%	0.352	S	S	.	.			trans	-50.5	123.5	169.5	-68.3	170.7	-145.2	0	0	110.1	A137 R138 H193	A137-E141 PolarHBondContact O-N 3.42Å; R138-E141 VanDerWaalsContact CG-OE1 3.24Å; R138-E141 WeakPolarHBondContact CG-OE1 3.35Å; R138-E141 WeakPolarHBondContact CG-OE2 3.43Å; E141-H193 HydrophobicContact CB-CB 4.06Å; E141-H193 HydrophobicContact CG-CB 4.41Å
142	F	83.4	Confident	76	Confident	31 Å²	31	67.8 Å²	67.8	14%	0.136	36%	0.356	C	S	.	.			trans	-130.7	131	177.9	66.9	-90.1	0	0	0	110.4	K140 V145 H193 A196 Q197 V200 R217	K140-F142 WeakPolarHBondContact O-CD1 3.17Å; K140-F142 PolarHBondContact O-N 2.99Å; F142-V145 HydrophobicContact CE2-CG2 4.25Å; F142-H193 AromaticContact CD1-CE1 3.62Å; F142-H193 AromaticContact CD1-ND1 3.84Å; F142-H193 AromaticContact CE1-CE1 3.6Å; F142-H193 PolarHBondContact N-ND1 3.32Å; F142-H193 WeakPolarHBondContact O-CA 3.38Å; F142-H193 PolarHBondContact O-ND1 2.89Å; F142-A196 HydrophobicContact CD2-CB 4.15Å; F142-A196 HydrophobicContact CE2-CB 4.07Å; F142-A196 VanDerWaalsContact O-CB 3.24Å; F142-A196 WeakPolarHBondContact O-CB 3.27Å; F142-Q197 VanDerWaalsContact CZ-OE1 3.26Å; F142-V200 HydrophobicContact CE2-CG2 3.87Å; F142-V200 HydrophobicContact CZ-CG2 3.99Å; F142-R217 HydrophobicContact CB-CG 3.72Å; F142-R217 HydrophobicContact CD1-CB 4.08Å; F142-R217 HydrophobicContact CD1-CG 3.91Å; F142-R217 HydrophobicContact CD2-CB 3.99Å; F142-R217 HydrophobicContact CD2-CG 3.88Å; F142-R217 HydrophobicContact CE1-CB 4.2Å; F142-R217 HydrophobicContact CE2-CB 4.13Å; F142-R217 HydrophobicContact CG-CB 3.98Å; F142-R217 HydrophobicContact CG-CG 3.55Å; F142-R217 HydrophobicContact CZ-CB 4.24Å
143	T	89.5	Confident	76.9	Confident	51 Å²	51	67.2 Å²	67.2	31%	0.313	36%	0.356	S	S	.	.			trans	-92.8	-23.3	169.9	44	0	0	0	0	112.4	F190	T143-F190 WeakPolarHBondContact CB-O 3.31Å; T143-F190 VanDerWaalsContact CG2-O 3.24Å; T143-F190 WeakPolarHBondContact CG2-O 3.37Å; T143-F190 PolarHBondContact O-N 3Å
144	N	91.9	Very high	77.9	Confident	78 Å²	78	65.5 Å²	65.5	42%	0.417	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	117.3	-173.8	-65	-14.8	0	0	0	111.4	V188 S189 A218	N144-V188 WeakPolarHBondContact CA-O 3.22Å; N144-S189 VanDerWaalsContact OD1-CB 3.22Å; N144-S189 WeakPolarHBondContact OD1-CB 3.44Å; N144-S189 PolarHBondContact OD1-OG 3.34Å; N144-A218 HydrophobicContact CB-CB 3.86Å; N144-A218 WeakPolarHBondContact O-CB 3.37Å; N144-A218 PolarHBondContact O-N 3.43Å
145	V	94.4	Very high	79.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	140.2	177.3	-177.6	0	0	0	0	109.5	F142 I147 F187 V188 F190 A196 V200 V215 G216	F142-V145 HydrophobicContact CE2-CG2 4.25Å; V145-I147 HydrophobicContact CB-CD1 4.38Å; V145-I147 HydrophobicContact CG1-CD1 4.05Å; V145-I147 HydrophobicContact CG1-CG1 4.18Å; V145-F187 VanDerWaalsContact O-CA 3.28Å; V145-F187 WeakPolarHBondContact O-CA 3.3Å; V145-V188 PolarHBondContact N-O 2.89Å; V145-V188 PolarHBondContact O-N 3.3Å; V145-F190 HydrophobicContact CB-CE2 4.44Å; V145-F190 HydrophobicContact CG2-CD2 3.93Å; V145-F190 HydrophobicContact CG2-CE2 3.82Å; V145-A196 HydrophobicContact CG2-CB 3.66Å; V145-V200 HydrophobicContact CG1-CG2 4.02Å; V145-V200 HydrophobicContact CG2-CG2 4.23Å; V145-V215 HydrophobicContact CG1-CG1 3.36Å; V145-G216 WeakPolarHBondContact CA-O 3.31Å
146	Y	93.9	Very high	80.9	Confident	24 Å²	24	62.3 Å²	62.3	9%	0.094	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.9	170	169	-107	0	0	0	109.1	K148 F185 F187 Y214 V215 G216	Y146-K148 HydrophobicContact CE1-CB 3.87Å; Y146-K148 HydrophobicContact CE1-CG 4.35Å; Y146-K148 WeakPolarHBondContact OH-CG 3.38Å; Y146-F185 HydrophobicContact CD2-CD2 4.4Å; Y146-F185 HydrophobicContact CE2-CB 4.04Å; Y146-F185 AromaticContact CE2-CD2 3.55Å; Y146-F185 HydrophobicContact CE2-CD2 3.55Å; Y146-F185 HydrophobicContact CE2-CE2 4.25Å; Y146-F185 HydrophobicContact CE2-CG 4.07Å; Y146-F187 HydrophobicContact CD2-CD1 4.04Å; Y146-F187 AromaticContact CD2-CE1 3.54Å; Y146-F187 HydrophobicContact CD2-CE1 3.54Å; Y146-F187 AromaticContact CD2-CZ 3.9Å; Y146-F187 HydrophobicContact CD2-CZ 3.9Å; Y146-F187 HydrophobicContact CE2-CE1 4.37Å; Y146-F187 HydrophobicContact CE2-CZ 4.32Å; Y146-F187 HydrophobicContact CG-CE1 4.3Å; Y146-Y214 HydrophobicContact CD1-CD1 4.06Å; Y146-Y214 AromaticContact CD1-CE1 3.99Å; Y146-Y214 HydrophobicContact CD1-CE1 3.99Å; Y146-Y214 HydrophobicContact CE1-CD1 4.09Å; Y146-Y214 HydrophobicContact CE1-CE1 4.26Å; Y146-V215 WeakPolarHBondContact O-CA 3.09Å; Y146-G216 PolarHBondContact N-O 3.08Å; Y146-G216 PolarHBondContact O-N 3.1Å; Y146-G216 VanDerWaalsContact O-N 3.07Å
147	I	93.4	Very high	82.6	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.5	-177.1	-47.7	82	0	0	0	107.6	V145 F150 L159 F163 F185 G186 V188 Y214 V215	V145-I147 HydrophobicContact CB-CD1 4.38Å; V145-I147 HydrophobicContact CG1-CD1 4.05Å; V145-I147 HydrophobicContact CG1-CG1 4.18Å; I147-F150 HydrophobicContact CB-CD1 4.26Å; I147-F150 HydrophobicContact CB-CE1 4.18Å; I147-F150 HydrophobicContact CG2-CD1 3.67Å; I147-F150 HydrophobicContact CG2-CE1 4.1Å; I147-L159 HydrophobicContact CB-CD1 4.5Å; I147-L159 HydrophobicContact CG1-CD1 4.49Å; I147-L159 HydrophobicContact CG2-CD1 4.33Å; I147-F163 HydrophobicContact CG1-CE1 4.18Å; I147-F163 HydrophobicContact CG1-CE2 4Å; I147-F163 HydrophobicContact CG1-CZ 3.75Å; I147-F163 HydrophobicContact CG2-CE2 3.98Å; I147-F163 HydrophobicContact CG2-CZ 3.87Å; I147-F185 CarbonylContact O-C 3.55Å; I147-F185 WeakPolarHBondContact O-CA 3.38Å; I147-F185 WeakPolarHBondContact O-CB 3.33Å; I147-G186 PolarHBondContact N-O 3.35Å; I147-G186 PolarHBondContact O-N 3.13Å; I147-V188 HydrophobicContact CD1-CB 3.98Å; I147-V188 HydrophobicContact CD1-CG2 3.62Å; I147-Y214 CarbonylContact C-O 3.45Å; I147-Y214 WeakPolarHBondContact CA-O 3.33Å; I147-V215 HydrophobicContact CG1-CG1 4.36Å; I147-V215 HydrophobicContact CG2-CG2 4.15Å
148	K	92.9	Very high	84.1	Confident	98 Å²	98	72.3 Å²	72.3	43%	0.426	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	155.4	-177.6	-159.2	-151.7	178.7	-159.6	0	111.5	Y146 G184 F185 I213 Y214	Y146-K148 HydrophobicContact CE1-CB 3.87Å; Y146-K148 HydrophobicContact CE1-CG 4.35Å; Y146-K148 WeakPolarHBondContact OH-CG 3.38Å; K148-G184 CarbonylContact C-O 3.41Å; K148-F185 HydrophobicContact CB-CB 4.21Å; K148-F185 HydrophobicContact CG-CB 3.85Å; K148-I213 CarbonylContact O-C 3.52Å; K148-I213 VanDerWaalsContact O-CA 3.28Å; K148-I213 WeakPolarHBondContact O-CA 2.82Å; K148-Y214 PolarHBondContact N-O 2.87Å; K148-Y214 PolarHBondContact O-N 3.43Å
149	N	90.7	Very high	85.7	Confident	69 Å²	69	63.8 Å²	63.8	37%	0.369	32%	0.317	S	S	.	.			trans	73.9	23.1	170	-156.6	43.3	0	0	0	115.5	G151 G184 K211 Q212	N149-G151 VanDerWaalsContact C-N 3.32Å; N149-G151 PolarHBondContact O-N 3.07Å; N149-G184 PolarHBondContact N-O 2.74Å; N149-K211 VanDerWaalsContact O-CB 3.29Å; N149-K211 WeakPolarHBondContact O-CB 3.37Å; N149-Q212 PolarHBondContact ND2-O 2.69Å
150	F	88.6	Confident	87.5	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.009	31%	0.312	C	S	.	.			trans	-80.4	-1.6	-179.9	49.9	-127.7	0	0	0	115.6	I147 M154 L159 V174 F185 I213	I147-F150 HydrophobicContact CB-CD1 4.26Å; I147-F150 HydrophobicContact CB-CE1 4.18Å; I147-F150 HydrophobicContact CG2-CD1 3.67Å; I147-F150 HydrophobicContact CG2-CE1 4.1Å; F150-M154 HydrophobicContact CB-CG 4.22Å; F150-M154 HydrophobicContact CD2-CB 3.39Å; F150-M154 HydrophobicContact CD2-CG 3.86Å; F150-M154 HydrophobicContact CE2-CB 3.65Å; F150-M154 HydrophobicContact CG-CB 4.15Å; F150-M154 HydrophobicContact CG-CG 4.28Å; F150-M154 WeakPolarHBondContact O-CG 3.43Å; F150-L159 HydrophobicContact CD1-CD1 4.18Å; F150-L159 HydrophobicContact CE1-CD1 4.07Å; F150-L159 HydrophobicContact CE1-CD2 4.29Å; F150-V174 HydrophobicContact CZ-CG1 4.29Å; F150-V174 HydrophobicContact CZ-CG2 4.11Å; F150-F185 VanDerWaalsContact CZ-CA 3.47Å; F150-I213 HydrophobicContact CB-CG2 3.91Å
151	G	84.7	Confident	88.9	Confident	3 Å²	3	64.3 Å²	64.3	3%	0.031	31%	0.311	C	S	.	.			trans	103.4	-179	-176.4	0	0	0	0	0	113.9	N149 G184	N149-G151 VanDerWaalsContact C-N 3.32Å; N149-G151 PolarHBondContact O-N 3.07Å; G151-G184 WeakPolarHBondContact O-CA 3.29Å
152	E	83.1	Confident	89.7	Confident	107 Å²	107	61.6 Å²	61.6	50%	0.5	30%	0.3	S	S	.	.	S	Bend	trans	-90.3	-24.6	175.6	-72.6	174.4	-134.4	0	0	111.3	M154 K181 S182	E152-M154 PolarHBondContact O-N 3.29Å; E152-K181 IonicContact OE2-NZ 3.88Å; E152-S182 VanDerWaalsContact O-CB 3.25Å; E152-S182 WeakPolarHBondContact O-CB 3.47Å
153	D	81.6	Confident	90.1	Very high	103 Å²	103	60.1 Å²	60.1	55%	0.551	29%	0.293	S	S	*	.	S	Bend	trans	-80.4	28.2	-174.6	-34.1	-91.7	0	0	0	113.8	R158	D153-R158 PolarHBondContact O-NH1 2.86Å
154	M	86.4	Confident	90.2	Very high	29 Å²	29	59.6 Å²	59.6	14%	0.143	30%	0.297	C	S	.	.			trans	-130.2	111.1	-170	-75.3	-68.4	142.8	0	0	111.1	F150 E152 R158 V174 S182	F150-M154 HydrophobicContact CB-CG 4.22Å; F150-M154 HydrophobicContact CD2-CB 3.39Å; F150-M154 HydrophobicContact CD2-CG 3.86Å; F150-M154 HydrophobicContact CE2-CB 3.65Å; F150-M154 HydrophobicContact CG-CB 4.15Å; F150-M154 HydrophobicContact CG-CG 4.28Å; F150-M154 WeakPolarHBondContact O-CG 3.43Å; E152-M154 PolarHBondContact O-N 3.29Å; M154-R158 HydrophobicContact SD-CB 4.02Å; M154-V174 WeakPolarHBondContact O-CG1 3.27Å; M154-S182 PolarHBondContact O-OG 3.01Å
155	D	89.5	Confident	90.2	Very high	82 Å²	82	63.8 Å²	63.8	44%	0.439	31%	0.312	S	S	.	.			trans	-106.4	171.1	-174.8	-47.2	-72.1	0	0	0	111.9	E157 R158 L159	D155-E157 VanDerWaalsContact C-N 3.28Å; D155-E157 PolarHBondContact O-N 3.06Å; D155-R158 PolarHBondContact O-N 2.84Å; D155-R158 IonicContact OD2-NE 3.98Å; D155-L159 WeakPolarHBondContact O-CB 3.43Å; D155-L159 PolarHBondContact O-N 3.08Å
156	D	91.3	Very high	90.1	Very high	50 Å²	50	65.1 Å²	65.1	27%	0.267	32%	0.318	S	S	.	.	H	α-helix	trans	-52.6	-43.1	-178.5	-69.3	-17.5	0	0	0	112.7	K160 V172 K173 V174	D156-K160 VanDerWaalsContact O-CB 3.3Å; D156-K160 WeakPolarHBondContact O-CB 3.37Å; D156-K160 PolarHBondContact O-N 3.34Å; D156-V172 WeakPolarHBondContact O-CG1 3.47Å; D156-K173 WeakPolarHBondContact OD1-CA 3.42Å; D156-K173 IonicContact OD1-NZ 3.93Å; D156-K173 IonicContact OD2-NZ 2.74Å; D156-K173 PolarHBondContact OD2-NZ 2.85Å; D156-V174 WeakPolarHBondContact OD1-CB 3.14Å; D156-V174 PolarHBondContact OD1-N 3.19Å
157	E	91.2	Very high	90	Very high	156 Å²	156	64.6 Å²	64.6	73%	0.729	32%	0.32	S	S	*	.	H	α-helix	trans	-68.1	-47.9	-179.2	-61.5	-175.9	157	0	0	111.9	D155 L159 K160 D161	D155-E157 VanDerWaalsContact C-N 3.28Å; D155-E157 PolarHBondContact O-N 3.06Å; E157-L159 VanDerWaalsContact C-N 3.29Å; E157-L159 PolarHBondContact O-N 3.2Å; E157-K160 WeakPolarHBondContact O-CA 3.42Å; E157-K160 WeakPolarHBondContact O-CB 3.39Å; E157-K160 PolarHBondContact O-N 2.89Å; E157-K160 VanDerWaalsContact O-N 3.08Å; E157-D161 PolarHBondContact O-N 2.93Å
158	R	89.7	Confident	89.9	Confident	134 Å²	134	67.8 Å²	67.8	51%	0.506	34%	0.341	S	S	.	.	H	α-helix	trans	-61.2	-39.6	177.5	-67.8	179.7	175.3	178.8	1.6	111.7	D153 M154 D155 L162	D153-R158 PolarHBondContact O-NH1 2.86Å; M154-R158 HydrophobicContact SD-CB 4.02Å; D155-R158 PolarHBondContact O-N 2.84Å; D155-R158 IonicContact OD2-NE 3.98Å; R158-L162 VanDerWaalsContact O-CB 3.24Å; R158-L162 WeakPolarHBondContact O-CB 3.48Å; R158-L162 PolarHBondContact O-N 3.23Å; R158-L162 VanDerWaalsContact O-N 3.08Å
159	L	91.4	Very high	89.8	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-37	175.8	-169.6	66.8	0	0	0	111.3	I147 F150 D155 E157 F163 V172 V174 V188	I147-L159 HydrophobicContact CB-CD1 4.5Å; I147-L159 HydrophobicContact CG1-CD1 4.49Å; I147-L159 HydrophobicContact CG2-CD1 4.33Å; F150-L159 HydrophobicContact CD1-CD1 4.18Å; F150-L159 HydrophobicContact CE1-CD1 4.07Å; F150-L159 HydrophobicContact CE1-CD2 4.29Å; D155-L159 WeakPolarHBondContact O-CB 3.43Å; D155-L159 PolarHBondContact O-N 3.08Å; E157-L159 VanDerWaalsContact C-N 3.29Å; E157-L159 PolarHBondContact O-N 3.2Å; L159-F163 HydrophobicContact CD1-CD2 3.62Å; L159-F163 HydrophobicContact CD1-CE2 3.61Å; L159-F163 HydrophobicContact CG-CD2 4.24Å; L159-F163 WeakPolarHBondContact O-CB 3.45Å; L159-F163 WeakPolarHBondContact O-CD2 2.97Å; L159-F163 PolarHBondContact O-N 3.16Å; L159-V172 HydrophobicContact CB-CG1 3.92Å; L159-V172 HydrophobicContact CD2-CG1 3.83Å; L159-V172 HydrophobicContact CG-CG1 3.94Å; L159-V174 HydrophobicContact CB-CG2 4.26Å; L159-V174 HydrophobicContact CD2-CG2 3.82Å; L159-V188 HydrophobicContact CD2-CG2 4.25Å; L159-V188 HydrophobicContact CG-CG2 4.2Å
160	K	92.7	Very high	89.8	Confident	116 Å²	116	66.9 Å²	66.9	50%	0.504	34%	0.344	S	S	.	.	H	α-helix	trans	-66.2	-45.8	175.6	-175	-178.1	177	-173	0	112.4	D156 E157 L162 F163 G164 V172	D156-K160 VanDerWaalsContact O-CB 3.3Å; D156-K160 WeakPolarHBondContact O-CB 3.37Å; D156-K160 PolarHBondContact O-N 3.34Å; E157-K160 WeakPolarHBondContact O-CA 3.42Å; E157-K160 WeakPolarHBondContact O-CB 3.39Å; E157-K160 PolarHBondContact O-N 2.89Å; E157-K160 VanDerWaalsContact O-N 3.08Å; K160-L162 VanDerWaalsContact C-N 3.3Å; K160-L162 PolarHBondContact O-N 3.18Å; K160-F163 PolarHBondContact O-N 3.26Å; K160-G164 WeakPolarHBondContact O-CA 3.24Å; K160-G164 PolarHBondContact O-N 2.95Å; K160-V172 HydrophobicContact CB-CB 4.27Å; K160-V172 HydrophobicContact CB-CG1 4.27Å; K160-V172 HydrophobicContact CB-CG2 3.9Å; K160-V172 HydrophobicContact CG-CG2 4.01Å
161	D	92	Very high	89.9	Confident	118 Å²	118	70.1 Å²	70.1	63%	0.631	37%	0.367	S	S	*	.	H	α-helix	trans	-68.2	-31.4	178.5	-71	-12.8	0	0	0	112.6	E157 K165	E157-D161 PolarHBondContact O-N 2.93Å; D161-K165 WeakPolarHBondContact O-CE 3.28Å
162	L	91.1	Very high	90.3	Very high	41 Å²	41	71.1 Å²	71.1	22%	0.215	37%	0.372	C	S	.	.	H	α-helix	trans	-70.6	-44.8	175.7	-178.1	63	0	0	0	112	R158 K160 M203 L208	R158-L162 VanDerWaalsContact O-CB 3.24Å; R158-L162 WeakPolarHBondContact O-CB 3.48Å; R158-L162 PolarHBondContact O-N 3.23Å; R158-L162 VanDerWaalsContact O-N 3.08Å; K160-L162 VanDerWaalsContact C-N 3.3Å; K160-L162 PolarHBondContact O-N 3.18Å; L162-M203 HydrophobicContact CD1-CE 3.78Å; L162-M203 HydrophobicContact CD2-CE 3.84Å; L162-M203 HydrophobicContact CG-CE 3.74Å; L162-L208 HydrophobicContact CD2-CD1 3.67Å
163	F	92.2	Very high	90.8	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-94.2	-20.9	-174.2	-80.5	-90.2	0	0	0	114.8	I147 L159 K160 K165 F166 V188 F190 A199 M203 V215	I147-F163 HydrophobicContact CG1-CE1 4.18Å; I147-F163 HydrophobicContact CG1-CE2 4Å; I147-F163 HydrophobicContact CG1-CZ 3.75Å; I147-F163 HydrophobicContact CG2-CE2 3.98Å; I147-F163 HydrophobicContact CG2-CZ 3.87Å; L159-F163 HydrophobicContact CD1-CD2 3.62Å; L159-F163 HydrophobicContact CD1-CE2 3.61Å; L159-F163 HydrophobicContact CG-CD2 4.24Å; L159-F163 WeakPolarHBondContact O-CB 3.45Å; L159-F163 WeakPolarHBondContact O-CD2 2.97Å; L159-F163 PolarHBondContact O-N 3.16Å; K160-F163 PolarHBondContact O-N 3.26Å; F163-K165 PolarHBondContact O-N 3.12Å; F163-K165 VanDerWaalsContact O-N 3.08Å; F163-F166 AromaticContact CD1-CD2 3.98Å; F163-F166 HydrophobicContact CD1-CD2 3.98Å; F163-F166 HydrophobicContact CD1-CE2 4.14Å; F163-F166 HydrophobicContact CE1-CE2 4.49Å; F163-F166 WeakPolarHBondContact O-CD2 3.22Å; F163-F166 PolarHBondContact O-N 3.19Å; F163-V188 HydrophobicContact CB-CG1 4.44Å; F163-V188 HydrophobicContact CB-CG2 4.15Å; F163-V188 HydrophobicContact CG-CG2 4.27Å; F163-F190 HydrophobicContact CB-CZ 4.15Å; F163-F190 HydrophobicContact CD1-CZ 4.31Å; F163-F190 WeakPolarHBondContact O-CE1 3.32Å; F163-A199 HydrophobicContact CD1-CB 3.96Å; F163-A199 HydrophobicContact CE1-CB 4.22Å; F163-M203 HydrophobicContact CE1-CB 3.98Å; F163-M203 HydrophobicContact CE1-CG 3.83Å; F163-M203 HydrophobicContact CE2-CE 4.21Å; F163-M203 HydrophobicContact CZ-CB 4.04Å; F163-M203 HydrophobicContact CZ-CE 3.99Å; F163-M203 HydrophobicContact CZ-CG 4.09Å; F163-V215 HydrophobicContact CE1-CG1 4.08Å; F163-V215 HydrophobicContact CZ-CG1 4.4Å; F163-V215 HydrophobicContact CZ-CG2 4.18Å
164	G	90.6	Very high	91.4	Very high	39 Å²	39	65.8 Å²	65.8	40%	0.402	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.7	175.7	0	0	0	0	0	114.1	K160 F166 G167	K160-G164 WeakPolarHBondContact O-CA 3.24Å; K160-G164 PolarHBondContact O-N 2.95Å; G164-F166 PolarHBondContact O-N 2.86Å; G164-G167 PolarHBondContact O-N 3.35Å
165	K	93.1	Very high	91.6	Very high	167 Å²	167	68 Å²	68	73%	0.726	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-23.4	172	-62.6	175.9	-175.4	176.8	0	113.4	D161 F163	D161-K165 WeakPolarHBondContact O-CE 3.28Å; F163-K165 PolarHBondContact O-N 3.12Å; F163-K165 VanDerWaalsContact O-N 3.08Å
166	F	92.9	Very high	91.7	Very high	27 Å²	27	67.4 Å²	67.4	12%	0.118	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-22.4	179.3	-56.4	-67.4	0	0	0	113	F163 G164 F190 D195 K198 A199 E202 M203	F163-F166 AromaticContact CD1-CD2 3.98Å; F163-F166 HydrophobicContact CD1-CD2 3.98Å; F163-F166 HydrophobicContact CD1-CE2 4.14Å; F163-F166 HydrophobicContact CE1-CE2 4.49Å; F163-F166 WeakPolarHBondContact O-CD2 3.22Å; F163-F166 PolarHBondContact O-N 3.19Å; G164-F166 PolarHBondContact O-N 2.86Å; F166-F190 HydrophobicContact CB-CE1 4.19Å; F166-F190 HydrophobicContact CB-CZ 4.32Å; F166-D195 WeakPolarHBondContact O-CB 3.39Å; F166-K198 HydrophobicContact CD1-CB 4.5Å; F166-A199 HydrophobicContact CB-CB 4.01Å; F166-A199 HydrophobicContact CD2-CB 3.86Å; F166-A199 HydrophobicContact CG-CB 3.94Å; F166-E202 HydrophobicContact CE1-CB 4.11Å; F166-M203 HydrophobicContact CD2-CG 4.45Å; F166-M203 HydrophobicContact CE1-CG 4.43Å; F166-M203 HydrophobicContact CE2-CG 3.43Å; F166-M203 VanDerWaalsContact CE2-CG 3.43Å; F166-M203 HydrophobicContact CE2-SD 3.87Å; F166-M203 HydrophobicContact CZ-CG 3.42Å; F166-M203 VanDerWaalsContact CZ-CG 3.42Å; F166-M203 HydrophobicContact CZ-SD 3.59Å; F166-M203 VanDerWaalsContact CZ-SD 3.59Å
167	G	91.1	Very high	91.6	Very high	13 Å²	13	68.6 Å²	68.6	13%	0.134	36%	0.359	C	S	.	.	S	Bend	trans	161.6	174.4	177.2	0	0	0	0	0	112.6	G164 A169	G164-G167 PolarHBondContact O-N 3.35Å; G167-A169 PolarHBondContact O-N 2.81Å
168	P	91.3	Very high	91.5	Very high	68 Å²	68	70.9 Å²	70.9	44%	0.442	37%	0.37	S	S	.	.			trans	-63.8	123.6	-180	25.4	-33.2	0	0	0	111.8	F190 E191	P168-F190 WeakPolarHBondContact O-CA 3.3Å; P168-E191 HydrophobicContact CB-CB 4.46Å; P168-E191 HydrophobicContact CG-CB 3.91Å; P168-E191 WeakPolarHBondContact CG-OE2 3.34Å; P168-E191 PolarHBondContact O-N 3.11Å
169	A	90.9	Very high	91.2	Very high	28 Å²	28	68.4 Å²	68.4	23%	0.231	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	115	175.2	0	0	0	0	0	110.9	G167 S171 V172 V188 S189	G167-A169 PolarHBondContact O-N 2.81Å; A169-S171 VanDerWaalsContact C-N 3.32Å; A169-V172 HydrophobicContact CB-CG2 3.86Å; A169-V188 HydrophobicContact CB-CG1 3.94Å; A169-S189 CarbonylContact C-O 3.49Å; A169-S189 WeakPolarHBondContact CA-O 3.17Å
170	L	89.9	Confident	90.7	Very high	120 Å²	120	70.8 Å²	70.8	63%	0.628	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	-33.1	173.4	-64.3	176.6	0	0	0	112.4	S189 E191	L170-S189 PolarHBondContact N-O 3.44Å; L170-E191 HydrophobicContact CD2-CB 4.26Å; L170-E191 HydrophobicContact CD2-CG 4.28Å; L170-E191 HydrophobicContact CG-CB 4.18Å
171	S	90.4	Very high	90.3	Very high	70 Å²	70	71.3 Å²	71.3	49%	0.49	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	142.6	179.8	-175	0	0	0	0	110.9	A169 V188 S189	A169-S171 VanDerWaalsContact C-N 3.32Å; S171-V188 WeakPolarHBondContact O-CA 3.41Å; S171-S189 PolarHBondContact N-O 3.47Å; S171-S189 PolarHBondContact O-N 2.87Å
172	V	94.1	Very high	90.2	Very high	23 Å²	23	66.1 Å²	66.1	14%	0.139	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	130.2	174.9	-178.7	0	0	0	0	107.5	D156 L159 K160 A169 F187 V188	D156-V172 WeakPolarHBondContact O-CG1 3.47Å; L159-V172 HydrophobicContact CB-CG1 3.92Å; L159-V172 HydrophobicContact CD2-CG1 3.83Å; L159-V172 HydrophobicContact CG-CG1 3.94Å; K160-V172 HydrophobicContact CB-CB 4.27Å; K160-V172 HydrophobicContact CB-CG1 4.27Å; K160-V172 HydrophobicContact CB-CG2 3.9Å; K160-V172 HydrophobicContact CG-CG2 4.01Å; A169-V172 HydrophobicContact CB-CG2 3.86Å; V172-F187 WeakPolarHBondContact CA-O 3.09Å; V172-V188 HydrophobicContact CG1-CG2 4.09Å; V172-V188 HydrophobicContact CG2-CG1 4.29Å; V172-V188 HydrophobicContact CG2-CG2 4.16Å
173	K	93.6	Very high	90.1	Very high	96 Å²	96	69.1 Å²	69.1	42%	0.417	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	112.9	177.3	-166.8	69	-149	154.8	0	112.9	D156 G186 F187	D156-K173 WeakPolarHBondContact OD1-CA 3.42Å; D156-K173 IonicContact OD1-NZ 3.93Å; D156-K173 IonicContact OD2-NZ 2.74Å; D156-K173 PolarHBondContact OD2-NZ 2.85Å; K173-G186 CarbonylContact O-C 3.59Å; K173-G186 WeakPolarHBondContact O-CA 3.32Å; K173-F187 PolarHBondContact N-O 2.89Å; K173-F187 PolarHBondContact O-N 3.46Å
174	V	93.4	Very high	89.9	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.018	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	135.8	162.2	173.7	0	0	0	0	108.9	F150 M154 D156 L159 S182	F150-V174 HydrophobicContact CZ-CG1 4.29Å; F150-V174 HydrophobicContact CZ-CG2 4.11Å; M154-V174 WeakPolarHBondContact O-CG1 3.27Å; D156-V174 WeakPolarHBondContact OD1-CB 3.14Å; D156-V174 PolarHBondContact OD1-N 3.19Å; L159-V174 HydrophobicContact CB-CG2 4.26Å; L159-V174 HydrophobicContact CD2-CG2 3.82Å; V174-S182 WeakPolarHBondContact CG1-OG 3.34Å
175	M	91.7	Very high	90	Very high	75 Å²	75	70.1 Å²	70.1	37%	0.369	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	112.5	173.4	-68	-57.6	-57.4	0	0	109.6	K183 F185 F187	M175-K183 HydrophobicContact CB-CD 4.31Å; M175-K183 VanDerWaalsContact O-CB 3.25Å; M175-K183 WeakPolarHBondContact O-CB 3.43Å; M175-K183 VanDerWaalsContact O-CG 3.3Å; M175-K183 WeakPolarHBondContact O-CG 3.2Å; M175-K183 PolarHBondContact O-N 2.9Å; M175-F185 HydrophobicContact CB-CD2 4.03Å; M175-F185 HydrophobicContact CB-CE1 4.24Å; M175-F185 HydrophobicContact CB-CE2 3.63Å; M175-F185 HydrophobicContact CB-CZ 3.73Å; M175-F185 HydrophobicContact CG-CD2 3.93Å; M175-F185 HydrophobicContact CG-CE2 3.4Å; M175-F185 VanDerWaalsContact CG-CE2 3.4Å; M175-F185 HydrophobicContact CG-CZ 3.93Å; M175-F185 PolarHBondContact N-O 3.07Å; M175-F187 HydrophobicContact CG-CD2 4.28Å; M175-F187 HydrophobicContact CG-CE2 3.87Å; M175-F187 HydrophobicContact SD-CE2 4.36Å
176	T	91.9	Very high	90.1	Very high	70 Å²	70	62.2 Å²	62.2	43%	0.429	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	158.9	173.7	55.6	0	0	0	0	111.9	G180 K181 K183	T176-G180 VanDerWaalsContact CG2-O 3.26Å; T176-G180 WeakPolarHBondContact CG2-O 3.25Å; T176-K181 CarbonylContact C-O 3.45Å; T176-K181 WeakPolarHBondContact CA-O 3.46Å; T176-K181 WeakPolarHBondContact CB-O 3.4Å; T176-K183 WeakPolarHBondContact O-CD 3.23Å
177	D	89.1	Confident	90.1	Very high	75 Å²	75	64.6 Å²	64.6	40%	0.401	36%	0.357	S	S	.	.			trans	-86.4	174.1	172.3	-152.2	49.2	0	0	0	110.8	S179 G180 K181 K183	D177-S179 PolarHBondContact O-N 2.87Å; D177-S179 VanDerWaalsContact O-N 3.16Å; D177-G180 PolarHBondContact O-N 2.96Å; D177-K181 PolarHBondContact N-O 3.44Å; D177-K183 HydrophobicContact CB-CG 4Å; D177-K183 IonicContact OD1-NZ 3.92Å; D177-K183 PolarHBondContact OD1-NZ 2.89Å
178	E	88.4	Confident	90.3	Very high	204 Å²	204	64 Å²	64	95%	0.953	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.4	179	-65.5	175.2	-176.4	0	0	112.7	G180	E178-G180 VanDerWaalsContact C-N 3.25Å; E178-G180 PolarHBondContact O-N 3.12Å
179	S	82.8	Confident	90.4	Very high	82 Å²	82	62 Å²	62	57%	0.573	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	6	172.8	60.3	0	0	0	0	114.7	D177 K181	D177-S179 PolarHBondContact O-N 2.87Å; D177-S179 VanDerWaalsContact O-N 3.16Å; S179-K181 PolarHBondContact O-N 3.43Å; S179-K181 VanDerWaalsContact O-N 3.16Å
180	G	82.1	Confident	90.5	Very high	52 Å²	52	60.7 Å²	60.7	54%	0.536	33%	0.328	S	S	.	.	S	Bend	trans	76.7	-13.8	-176.8	0	0	0	0	0	115	T176 D177 E178	T176-G180 VanDerWaalsContact CG2-O 3.26Å; T176-G180 WeakPolarHBondContact CG2-O 3.25Å; D177-G180 PolarHBondContact O-N 2.96Å; E178-G180 VanDerWaalsContact C-N 3.25Å; E178-G180 PolarHBondContact O-N 3.12Å
181	K	84.8	Confident	90.6	Very high	127 Å²	127	60.7 Å²	60.7	55%	0.552	32%	0.324	S	S	*	.			trans	-66.1	144.7	177.6	-66.1	-172.1	170.1	-160.6	0	112.5	E152 T176 D177 S179 K183	E152-K181 IonicContact OE2-NZ 3.88Å; T176-K181 CarbonylContact C-O 3.45Å; T176-K181 WeakPolarHBondContact CA-O 3.46Å; T176-K181 WeakPolarHBondContact CB-O 3.4Å; D177-K181 PolarHBondContact N-O 3.44Å; S179-K181 PolarHBondContact O-N 3.43Å; S179-K181 VanDerWaalsContact O-N 3.16Å; K181-K183 PolarHBondContact O-N 3.38Å
182	S	88.8	Confident	90.5	Very high	9 Å²	9	62.9 Å²	62.9	6%	0.063	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	131.1	172.9	-176.3	0	0	0	0	111.9	E152 M154 V174 G184	E152-S182 VanDerWaalsContact O-CB 3.25Å; E152-S182 WeakPolarHBondContact O-CB 3.47Å; M154-S182 PolarHBondContact O-OG 3.01Å; V174-S182 WeakPolarHBondContact CG1-OG 3.34Å; S182-G184 PolarHBondContact O-N 2.72Å; S182-G184 VanDerWaalsContact O-N 3.12Å; S182-G184 PolarHBondContact OG-N 3.07Å
183	K	88.8	Confident	90.3	Very high	104 Å²	104	64.2 Å²	64.2	45%	0.452	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	10.4	173.2	-57	172.9	92.8	90.2	0	112.4	M175 T176 D177 K181 F185	M175-K183 HydrophobicContact CB-CD 4.31Å; M175-K183 VanDerWaalsContact O-CB 3.25Å; M175-K183 WeakPolarHBondContact O-CB 3.43Å; M175-K183 VanDerWaalsContact O-CG 3.3Å; M175-K183 WeakPolarHBondContact O-CG 3.2Å; M175-K183 PolarHBondContact O-N 2.9Å; T176-K183 WeakPolarHBondContact O-CD 3.23Å; D177-K183 HydrophobicContact CB-CG 4Å; D177-K183 IonicContact OD1-NZ 3.92Å; D177-K183 PolarHBondContact OD1-NZ 2.89Å; K181-K183 PolarHBondContact O-N 3.38Å; K183-F185 VanDerWaalsContact C-N 3.29Å; K183-F185 HydrophobicContact CB-CD1 3.81Å; K183-F185 HydrophobicContact CB-CE1 3.67Å; K183-F185 HydrophobicContact CD-CE1 4.06Å; K183-F185 HydrophobicContact CD-CZ 4.45Å; K183-F185 WeakPolarHBondContact O-CD1 3.36Å; K183-F185 PolarHBondContact O-N 3.02Å
184	G	88.6	Confident	90.2	Very high	11 Å²	11	64.4 Å²	64.4	11%	0.113	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	67.3	25.4	-177.8	0	0	0	0	0	114.3	K148 N149 G151 S182	K148-G184 CarbonylContact C-O 3.41Å; N149-G184 PolarHBondContact N-O 2.74Å; G151-G184 WeakPolarHBondContact O-CA 3.29Å; S182-G184 PolarHBondContact O-N 2.72Å; S182-G184 VanDerWaalsContact O-N 3.12Å; S182-G184 PolarHBondContact OG-N 3.07Å
185	F	92.8	Very high	90.2	Very high	49 Å²	49	64.7 Å²	64.7	22%	0.215	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	157.5	171.9	75.6	-93	0	0	0	112.5	Y146 I147 K148 F150 M175 K183 F187	Y146-F185 HydrophobicContact CD2-CD2 4.4Å; Y146-F185 HydrophobicContact CE2-CB 4.04Å; Y146-F185 AromaticContact CE2-CD2 3.55Å; Y146-F185 HydrophobicContact CE2-CD2 3.55Å; Y146-F185 HydrophobicContact CE2-CE2 4.25Å; Y146-F185 HydrophobicContact CE2-CG 4.07Å; I147-F185 CarbonylContact O-C 3.55Å; I147-F185 WeakPolarHBondContact O-CA 3.38Å; I147-F185 WeakPolarHBondContact O-CB 3.33Å; K148-F185 HydrophobicContact CB-CB 4.21Å; K148-F185 HydrophobicContact CG-CB 3.85Å; F150-F185 VanDerWaalsContact CZ-CA 3.47Å; M175-F185 HydrophobicContact CB-CD2 4.03Å; M175-F185 HydrophobicContact CB-CE1 4.24Å; M175-F185 HydrophobicContact CB-CE2 3.63Å; M175-F185 HydrophobicContact CB-CZ 3.73Å; M175-F185 HydrophobicContact CG-CD2 3.93Å; M175-F185 HydrophobicContact CG-CE2 3.4Å; M175-F185 VanDerWaalsContact CG-CE2 3.4Å; M175-F185 HydrophobicContact CG-CZ 3.93Å; M175-F185 PolarHBondContact N-O 3.07Å; K183-F185 VanDerWaalsContact C-N 3.29Å; K183-F185 HydrophobicContact CB-CD1 3.81Å; K183-F185 HydrophobicContact CB-CE1 3.67Å; K183-F185 HydrophobicContact CD-CE1 4.06Å; K183-F185 HydrophobicContact CD-CZ 4.45Å; K183-F185 WeakPolarHBondContact O-CD1 3.36Å; K183-F185 PolarHBondContact O-N 3.02Å; F185-F187 HydrophobicContact CD2-CE2 4.35Å; F185-F187 HydrophobicContact CE2-CE2 4.12Å; F185-F187 HydrophobicContact CE2-CZ 4.39Å
186	G	93.7	Very high	90.3	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	-177.7	-179.4	0	0	0	0	0	112.7	I147 K173	I147-G186 PolarHBondContact N-O 3.35Å; I147-G186 PolarHBondContact O-N 3.13Å; K173-G186 CarbonylContact O-C 3.59Å; K173-G186 WeakPolarHBondContact O-CA 3.32Å
187	F	94.8	Very high	90.3	Very high	78 Å²	78	60.6 Å²	60.6	34%	0.342	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.4	-179.1	-57.5	-87.8	0	0	0	110.2	V145 Y146 V172 K173 M175 F185 A218	V145-F187 VanDerWaalsContact O-CA 3.28Å; V145-F187 WeakPolarHBondContact O-CA 3.3Å; Y146-F187 HydrophobicContact CD2-CD1 4.04Å; Y146-F187 AromaticContact CD2-CE1 3.54Å; Y146-F187 HydrophobicContact CD2-CE1 3.54Å; Y146-F187 AromaticContact CD2-CZ 3.9Å; Y146-F187 HydrophobicContact CD2-CZ 3.9Å; Y146-F187 HydrophobicContact CE2-CE1 4.37Å; Y146-F187 HydrophobicContact CE2-CZ 4.32Å; Y146-F187 HydrophobicContact CG-CE1 4.3Å; V172-F187 WeakPolarHBondContact CA-O 3.09Å; K173-F187 PolarHBondContact N-O 2.89Å; K173-F187 PolarHBondContact O-N 3.46Å; M175-F187 HydrophobicContact CG-CD2 4.28Å; M175-F187 HydrophobicContact CG-CE2 3.87Å; M175-F187 HydrophobicContact SD-CE2 4.36Å; F185-F187 HydrophobicContact CD2-CE2 4.35Å; F185-F187 HydrophobicContact CE2-CE2 4.12Å; F185-F187 HydrophobicContact CE2-CZ 4.39Å; F187-A218 HydrophobicContact CD1-CB 4.06Å; F187-A218 HydrophobicContact CE1-CB 4.31Å
188	V	95.1	Very high	90.6	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.5	170.1	175.2	0	0	0	0	107.6	N144 V145 I147 L159 F163 A169 S171 V172 F190	N144-V188 WeakPolarHBondContact CA-O 3.22Å; V145-V188 PolarHBondContact N-O 2.89Å; V145-V188 PolarHBondContact O-N 3.3Å; I147-V188 HydrophobicContact CD1-CB 3.98Å; I147-V188 HydrophobicContact CD1-CG2 3.62Å; L159-V188 HydrophobicContact CD2-CG2 4.25Å; L159-V188 HydrophobicContact CG-CG2 4.2Å; F163-V188 HydrophobicContact CB-CG1 4.44Å; F163-V188 HydrophobicContact CB-CG2 4.15Å; F163-V188 HydrophobicContact CG-CG2 4.27Å; A169-V188 HydrophobicContact CB-CG1 3.94Å; S171-V188 WeakPolarHBondContact O-CA 3.41Å; V172-V188 HydrophobicContact CG1-CG2 4.09Å; V172-V188 HydrophobicContact CG2-CG1 4.29Å; V172-V188 HydrophobicContact CG2-CG2 4.16Å; V188-F190 HydrophobicContact CB-CE2 4.14Å; V188-F190 HydrophobicContact CG1-CD2 3.79Å; V188-F190 HydrophobicContact CG1-CE1 4.25Å; V188-F190 HydrophobicContact CG1-CE2 3.42Å; V188-F190 VanDerWaalsContact CG1-CE2 3.42Å; V188-F190 HydrophobicContact CG1-CG 4.37Å; V188-F190 HydrophobicContact CG1-CZ 3.69Å
189	S	92.6	Very high	90.9	Very high	26 Å²	26	51.9 Å²	51.9	18%	0.182	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	112.8	172.8	-169	0	0	0	0	108.1	N144 A169 L170 S171	N144-S189 VanDerWaalsContact OD1-CB 3.22Å; N144-S189 WeakPolarHBondContact OD1-CB 3.44Å; N144-S189 PolarHBondContact OD1-OG 3.34Å; A169-S189 CarbonylContact C-O 3.49Å; A169-S189 WeakPolarHBondContact CA-O 3.17Å; L170-S189 PolarHBondContact N-O 3.44Å; S171-S189 PolarHBondContact N-O 3.47Å; S171-S189 PolarHBondContact O-N 2.87Å
190	F	93.9	Very high	91.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	157.6	175.5	-70.4	-87.3	0	0	0	111.5	T143 V145 F163 F166 P168 V188 R192 D195 A196 A199	T143-F190 WeakPolarHBondContact CB-O 3.31Å; T143-F190 VanDerWaalsContact CG2-O 3.24Å; T143-F190 WeakPolarHBondContact CG2-O 3.37Å; T143-F190 PolarHBondContact O-N 3Å; V145-F190 HydrophobicContact CB-CE2 4.44Å; V145-F190 HydrophobicContact CG2-CD2 3.93Å; V145-F190 HydrophobicContact CG2-CE2 3.82Å; F163-F190 HydrophobicContact CB-CZ 4.15Å; F163-F190 HydrophobicContact CD1-CZ 4.31Å; F163-F190 WeakPolarHBondContact O-CE1 3.32Å; F166-F190 HydrophobicContact CB-CE1 4.19Å; F166-F190 HydrophobicContact CB-CZ 4.32Å; P168-F190 WeakPolarHBondContact O-CA 3.3Å; V188-F190 HydrophobicContact CB-CE2 4.14Å; V188-F190 HydrophobicContact CG1-CD2 3.79Å; V188-F190 HydrophobicContact CG1-CE1 4.25Å; V188-F190 HydrophobicContact CG1-CE2 3.42Å; V188-F190 VanDerWaalsContact CG1-CE2 3.42Å; V188-F190 HydrophobicContact CG1-CG 4.37Å; V188-F190 HydrophobicContact CG1-CZ 3.69Å; F190-R192 VanDerWaalsContact C-N 3.32Å; F190-D195 HydrophobicContact CB-CB 4.45Å; F190-D195 HydrophobicContact CD1-CB 3.97Å; F190-D195 HydrophobicContact CG-CB 4.35Å; F190-A196 HydrophobicContact CB-CB 4.18Å; F190-A196 VanDerWaalsContact CD2-CA 3.49Å; F190-A196 HydrophobicContact CD2-CB 3.67Å; F190-A196 HydrophobicContact CE2-CB 4.44Å; F190-A196 HydrophobicContact CG-CB 4.2Å; F190-A199 HydrophobicContact CE2-CB 3.72Å; F190-A199 HydrophobicContact CZ-CB 3.65Å
191	E	90.2	Very high	91.9	Very high	120 Å²	120	51.7 Å²	51.7	56%	0.561	24%	0.242	S	C	*	.	S	Bend	trans	-68.3	-33.5	172.8	-166.1	177.3	174.1	0	0	112.2	P168 L170	P168-E191 HydrophobicContact CB-CB 4.46Å; P168-E191 HydrophobicContact CG-CB 3.91Å; P168-E191 WeakPolarHBondContact CG-OE2 3.34Å; P168-E191 PolarHBondContact O-N 3.11Å; L170-E191 HydrophobicContact CD2-CB 4.26Å; L170-E191 HydrophobicContact CD2-CG 4.28Å; L170-E191 HydrophobicContact CG-CB 4.18Å
192	R	89.8	Confident	92.3	Very high	115 Å²	115	51.1 Å²	51.1	43%	0.434	24%	0.241	S	C	.	.	S	Bend	trans	-124.6	144.1	-176.1	-59.9	176.3	69.2	-140.8	2	111.7	F190 E194 D195 A196	F190-R192 VanDerWaalsContact C-N 3.32Å; R192-E194 VanDerWaalsContact C-N 3.34Å; R192-E194 IonicContact CZ-OE1 2.85Å; R192-E194 IonicContact CZ-OE2 3.17Å; R192-E194 IonicContact NH1-OE2 3.53Å; R192-E194 PolarHBondContact NH1-OE2 2.78Å; R192-E194 IonicContact NH2-OE1 2.75Å; R192-E194 PolarHBondContact NH2-OE1 3.24Å; R192-E194 IonicContact NH2-OE2 2.67Å; R192-E194 PolarHBondContact NH2-OE2 2.92Å; R192-E194 PolarHBondContact O-N 3.33Å; R192-D195 PolarHBondContact O-N 3.36Å; R192-A196 PolarHBondContact O-N 2.89Å
193	H	90.3	Very high	92.6	Very high	51 Å²	51	51 Å²	51	24%	0.236	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-38.5	176.1	168.7	45.2	0	0	0	112.7	E141 F142 D195 A196 Q197	E141-H193 HydrophobicContact CB-CB 4.06Å; E141-H193 HydrophobicContact CG-CB 4.41Å; F142-H193 AromaticContact CD1-CE1 3.62Å; F142-H193 AromaticContact CD1-ND1 3.84Å; F142-H193 AromaticContact CE1-CE1 3.6Å; F142-H193 PolarHBondContact N-ND1 3.32Å; F142-H193 WeakPolarHBondContact O-CA 3.38Å; F142-H193 PolarHBondContact O-ND1 2.89Å; H193-D195 PolarHBondContact O-N 3.3Å; H193-A196 WeakPolarHBondContact O-CB 3.36Å; H193-A196 PolarHBondContact O-N 2.85Å; H193-Q197 WeakPolarHBondContact O-CB 3.47Å; H193-Q197 PolarHBondContact O-N 3.14Å
194	E	91	Very high	92.8	Very high	100 Å²	100	49.7 Å²	49.7	47%	0.467	24%	0.238	S	C	.	.	H	α-helix	trans	-53.8	-38.4	177.6	-72.9	160.2	-126.4	0	0	112.7	R192 Q197 K198	R192-E194 VanDerWaalsContact C-N 3.34Å; R192-E194 IonicContact CZ-OE1 2.85Å; R192-E194 IonicContact CZ-OE2 3.17Å; R192-E194 IonicContact NH1-OE2 3.53Å; R192-E194 PolarHBondContact NH1-OE2 2.78Å; R192-E194 IonicContact NH2-OE1 2.75Å; R192-E194 PolarHBondContact NH2-OE1 3.24Å; R192-E194 IonicContact NH2-OE2 2.67Å; R192-E194 PolarHBondContact NH2-OE2 2.92Å; R192-E194 PolarHBondContact O-N 3.33Å; E194-Q197 PolarHBondContact O-N 3.23Å; E194-K198 VanDerWaalsContact O-CG 3.25Å; E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 2.89Å
195	D	93.9	Very high	92.9	Very high	9 Å²	9	51 Å²	51	5%	0.048	25%	0.251	C	S	.	.	H	α-helix	trans	-79.8	-36.9	-175.7	-57.6	-26.3	0	0	0	110.9	F166 F190 R192 H193 Q197 K198 A199	F166-D195 WeakPolarHBondContact O-CB 3.39Å; F190-D195 HydrophobicContact CB-CB 4.45Å; F190-D195 HydrophobicContact CD1-CB 3.97Å; F190-D195 HydrophobicContact CG-CB 4.35Å; R192-D195 PolarHBondContact O-N 3.36Å; H193-D195 PolarHBondContact O-N 3.3Å; D195-Q197 VanDerWaalsContact C-N 3.32Å; D195-Q197 PolarHBondContact O-N 3Å; D195-K198 IonicContact OD1-NZ 2.59Å; D195-K198 PolarHBondContact OD1-NZ 3.05Å; D195-A199 VanDerWaalsContact O-CB 3.3Å; D195-A199 WeakPolarHBondContact O-CB 3.4Å; D195-A199 PolarHBondContact O-N 2.78Å
196	A	92.8	Very high	92.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-37	167.5	0	0	0	0	0	112.8	F142 V145 F190 R192 H193 V200	F142-A196 HydrophobicContact CD2-CB 4.15Å; F142-A196 HydrophobicContact CE2-CB 4.07Å; F142-A196 VanDerWaalsContact O-CB 3.24Å; F142-A196 WeakPolarHBondContact O-CB 3.27Å; V145-A196 HydrophobicContact CG2-CB 3.66Å; F190-A196 HydrophobicContact CB-CB 4.18Å; F190-A196 VanDerWaalsContact CD2-CA 3.49Å; F190-A196 HydrophobicContact CD2-CB 3.67Å; F190-A196 HydrophobicContact CE2-CB 4.44Å; F190-A196 HydrophobicContact CG-CB 4.2Å; R192-A196 PolarHBondContact O-N 2.89Å; H193-A196 WeakPolarHBondContact O-CB 3.36Å; H193-A196 PolarHBondContact O-N 2.85Å; A196-V200 WeakPolarHBondContact O-CG2 3.26Å; A196-V200 PolarHBondContact O-N 2.84Å
197	Q	92.9	Very high	92.6	Very high	59 Å²	59	58.4 Å²	58.4	28%	0.276	29%	0.285	S	S	.	.	H	α-helix	trans	-70.4	-47.8	177.7	-173.5	60.2	47.8	0	0	111.2	F142 H193 E194 D195 A199 V200 D201	F142-Q197 VanDerWaalsContact CZ-OE1 3.26Å; H193-Q197 WeakPolarHBondContact O-CB 3.47Å; H193-Q197 PolarHBondContact O-N 3.14Å; E194-Q197 PolarHBondContact O-N 3.23Å; D195-Q197 VanDerWaalsContact C-N 3.32Å; D195-Q197 PolarHBondContact O-N 3Å; Q197-A199 VanDerWaalsContact C-N 3.29Å; Q197-A199 PolarHBondContact O-N 3.4Å; Q197-V200 WeakPolarHBondContact O-CB 3.49Å; Q197-V200 PolarHBondContact O-N 3.38Å; Q197-V200 VanDerWaalsContact O-N 3.08Å; Q197-D201 PolarHBondContact NE2-OD1 3.02Å; Q197-D201 PolarHBondContact NE2-OD2 3.39Å; Q197-D201 PolarHBondContact O-N 3.47Å
198	K	93.9	Very high	92.1	Very high	97 Å²	97	56.9 Å²	56.9	42%	0.422	28%	0.28	S	S	.	.	H	α-helix	trans	-54.3	-45.6	171.8	-68.3	163.1	-155.7	161.8	0	111.7	F166 E194 D195 V200 D201 E202	F166-K198 HydrophobicContact CD1-CB 4.5Å; E194-K198 VanDerWaalsContact O-CG 3.25Å; E194-K198 WeakPolarHBondContact O-CG 3.33Å; E194-K198 PolarHBondContact O-N 2.89Å; D195-K198 IonicContact OD1-NZ 2.59Å; D195-K198 PolarHBondContact OD1-NZ 3.05Å; K198-V200 VanDerWaalsContact C-N 3.31Å; K198-V200 PolarHBondContact O-N 2.73Å; K198-D201 PolarHBondContact O-N 3.36Å; K198-E202 WeakPolarHBondContact O-CB 3.49Å; K198-E202 PolarHBondContact O-N 2.86Å
199	A	94.4	Very high	91.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.1	-38	177.6	0	0	0	0	0	112.5	F163 F166 F190 D195 Q197 M203	F163-A199 HydrophobicContact CD1-CB 3.96Å; F163-A199 HydrophobicContact CE1-CB 4.22Å; F166-A199 HydrophobicContact CB-CB 4.01Å; F166-A199 HydrophobicContact CD2-CB 3.86Å; F166-A199 HydrophobicContact CG-CB 3.94Å; F190-A199 HydrophobicContact CE2-CB 3.72Å; F190-A199 HydrophobicContact CZ-CB 3.65Å; D195-A199 VanDerWaalsContact O-CB 3.3Å; D195-A199 WeakPolarHBondContact O-CB 3.4Å; D195-A199 PolarHBondContact O-N 2.78Å; Q197-A199 VanDerWaalsContact C-N 3.29Å; Q197-A199 PolarHBondContact O-N 3.4Å; A199-M203 WeakPolarHBondContact O-CB 3.24Å; A199-M203 PolarHBondContact O-N 2.91Å
200	V	94.3	Very high	90.7	Very high	17 Å²	17	62.8 Å²	62.8	10%	0.103	32%	0.324	C	S	.	.	H	α-helix	trans	-66.5	-54	172.8	168.1	0	0	0	0	110.9	F142 V145 A196 Q197 K198 E202 N204 V215	F142-V200 HydrophobicContact CE2-CG2 3.87Å; F142-V200 HydrophobicContact CZ-CG2 3.99Å; V145-V200 HydrophobicContact CG1-CG2 4.02Å; V145-V200 HydrophobicContact CG2-CG2 4.23Å; A196-V200 WeakPolarHBondContact O-CG2 3.26Å; A196-V200 PolarHBondContact O-N 2.84Å; Q197-V200 WeakPolarHBondContact O-CB 3.49Å; Q197-V200 PolarHBondContact O-N 3.38Å; Q197-V200 VanDerWaalsContact O-N 3.08Å; K198-V200 VanDerWaalsContact C-N 3.31Å; K198-V200 PolarHBondContact O-N 2.73Å; V200-E202 PolarHBondContact O-N 3.21Å; V200-N204 WeakPolarHBondContact O-CB 3.26Å; V200-N204 PolarHBondContact O-N 3.39Å; V200-V215 HydrophobicContact CG2-CG1 4.15Å
201	D	92.9	Very high	90.2	Very high	113 Å²	113	67 Å²	67	60%	0.604	34%	0.342	S	S	*	.	H	α-helix	trans	-68.6	-34	-170.7	-65.1	-30.5	0	0	0	113	Q197 K198	Q197-D201 PolarHBondContact NE2-OD1 3.02Å; Q197-D201 PolarHBondContact NE2-OD2 3.39Å; Q197-D201 PolarHBondContact O-N 3.47Å; K198-D201 PolarHBondContact O-N 3.36Å
202	E	93.8	Very high	90.3	Very high	114 Å²	114	67.5 Å²	67.5	53%	0.533	34%	0.344	S	S	.	.	H	α-helix	trans	-90.8	-24.1	-179	-147.1	-153	106	0	0	113.9	F166 K198 V200 K206	F166-E202 HydrophobicContact CE1-CB 4.11Å; K198-E202 WeakPolarHBondContact O-CB 3.49Å; K198-E202 PolarHBondContact O-N 2.86Å; V200-E202 PolarHBondContact O-N 3.21Å; E202-K206 WeakPolarHBondContact O-CD 3.21Å; E202-K206 WeakPolarHBondContact O-CE 3.3Å; E202-K206 PolarHBondContact O-NZ 3.22Å; E202-K206 IonicContact OE1-NZ 2.64Å; E202-K206 PolarHBondContact OE1-NZ 3.02Å
203	M	93.4	Very high	90.4	Very high	8 Å²	8	62.1 Å²	62.1	4%	0.039	32%	0.324	C	S	.	.	H	α-helix	trans	-103.1	-21.9	-176.9	-62.4	-70.4	-76.9	0	0	114.3	L162 F163 F166 A199 G205 K206 I213 V215	L162-M203 HydrophobicContact CD1-CE 3.78Å; L162-M203 HydrophobicContact CD2-CE 3.84Å; L162-M203 HydrophobicContact CG-CE 3.74Å; F163-M203 HydrophobicContact CE1-CB 3.98Å; F163-M203 HydrophobicContact CE1-CG 3.83Å; F163-M203 HydrophobicContact CE2-CE 4.21Å; F163-M203 HydrophobicContact CZ-CB 4.04Å; F163-M203 HydrophobicContact CZ-CE 3.99Å; F163-M203 HydrophobicContact CZ-CG 4.09Å; F166-M203 HydrophobicContact CD2-CG 4.45Å; F166-M203 HydrophobicContact CE1-CG 4.43Å; F166-M203 HydrophobicContact CE2-CG 3.43Å; F166-M203 VanDerWaalsContact CE2-CG 3.43Å; F166-M203 HydrophobicContact CE2-SD 3.87Å; F166-M203 HydrophobicContact CZ-CG 3.42Å; F166-M203 VanDerWaalsContact CZ-CG 3.42Å; F166-M203 HydrophobicContact CZ-SD 3.59Å; F166-M203 VanDerWaalsContact CZ-SD 3.59Å; A199-M203 WeakPolarHBondContact O-CB 3.24Å; A199-M203 PolarHBondContact O-N 2.91Å; M203-G205 PolarHBondContact O-N 3.43Å; M203-K206 PolarHBondContact O-N 2.87Å; M203-K206 HydrophobicContact SD-CD 3.74Å; M203-K206 PolarHBondContact SD-NZ 2.88Å; M203-K206 VanDerWaalsContact SD-NZ 3.43Å; M203-I213 HydrophobicContact CB-CD1 4.19Å; M203-I213 HydrophobicContact CE-CD1 3.96Å; M203-I213 WeakPolarHBondContact O-CD1 3.3Å; M203-I213 VanDerWaalsContact O-CG1 3.27Å; M203-I213 WeakPolarHBondContact O-CG1 3.46Å; M203-V215 HydrophobicContact CB-CB 4.41Å; M203-V215 HydrophobicContact CB-CG2 3.74Å
204	N	94.6	Very high	90.6	Very high	76 Å²	76	65.5 Å²	65.5	41%	0.406	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	120	179.9	-173.6	38.4	0	0	0	111.5	V200 Y214 V215	V200-N204 WeakPolarHBondContact O-CB 3.26Å; V200-N204 PolarHBondContact O-N 3.39Å; N204-Y214 WeakPolarHBondContact OD1-CD2 3.14Å; N204-V215 HydrophobicContact CB-CB 3.98Å; N204-V215 WeakPolarHBondContact CB-O 3.34Å; N204-V215 PolarHBondContact OD1-N 2.97Å; N204-V215 PolarHBondContact OD1-O 3.1Å
205	G	90.6	Very high	90.7	Very high	38 Å²	38	60.8 Å²	60.8	39%	0.392	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	-5.9	-178.5	0	0	0	0	0	115.5	M203 I213	M203-G205 PolarHBondContact O-N 3.43Å; G205-I213 WeakPolarHBondContact CA-O 3.47Å; G205-I213 PolarHBondContact N-O 2.9Å
206	K	91.4	Very high	90.7	Very high	78 Å²	78	60.5 Å²	60.5	34%	0.339	31%	0.313	S	S	.	.			trans	-63.6	153.2	170.4	-82.5	-175.4	179.1	142.4	0	111	E202 M203 Q212 I213	E202-K206 WeakPolarHBondContact O-CD 3.21Å; E202-K206 WeakPolarHBondContact O-CE 3.3Å; E202-K206 PolarHBondContact O-NZ 3.22Å; E202-K206 IonicContact OE1-NZ 2.64Å; E202-K206 PolarHBondContact OE1-NZ 3.02Å; M203-K206 PolarHBondContact O-N 2.87Å; M203-K206 HydrophobicContact SD-CD 3.74Å; M203-K206 PolarHBondContact SD-NZ 2.88Å; M203-K206 VanDerWaalsContact SD-NZ 3.43Å; K206-Q212 CarbonylContact O-C 3.4Å; K206-Q212 WeakPolarHBondContact O-CA 3.22Å; K206-I213 WeakPolarHBondContact O-CG1 3.14Å; K206-I213 PolarHBondContact O-N 3.14Å
207	E	89.1	Confident	90.6	Very high	127 Å²	127	65.4 Å²	65.4	59%	0.593	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	125.2	-179.8	-162.4	171.6	164.3	0	0	111.3	G210 K211	E207-G210 WeakPolarHBondContact OE1-CA 3.47Å; E207-K211 WeakPolarHBondContact CA-O 3.38Å
208	L	83.3	Confident	90.4	Very high	45 Å²	45	63.9 Å²	63.9	24%	0.236	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	135.9	171.9	-64.2	179.3	0	0	0	108.6	L162 G210 K211 I213	L162-L208 HydrophobicContact CD2-CD1 3.67Å; L208-G210 PolarHBondContact O-N 3.24Å; L208-G210 VanDerWaalsContact O-N 3.14Å; L208-K211 PolarHBondContact N-O 3.13Å; L208-K211 PolarHBondContact O-N 3.18Å; L208-I213 HydrophobicContact CB-CG2 4.06Å; L208-I213 HydrophobicContact CD1-CD1 3.97Å; L208-I213 HydrophobicContact CD1-CG2 4Å; L208-I213 HydrophobicContact CG-CG2 4.16Å
209	N	78	Confident	89.8	Confident	92 Å²	92	62.5 Å²	62.5	49%	0.492	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	38.3	178.8	-58.9	-4.5	0	0	0	113.7	K211	N209-K211 VanDerWaalsContact C-N 3.31Å; N209-K211 PolarHBondContact O-N 2.99Å
210	G	80.9	Confident	89.1	Confident	60 Å²	60	69.4 Å²	69.4	62%	0.619	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	19.6	-178	0	0	0	0	0	114.8	E207 L208	E207-G210 WeakPolarHBondContact OE1-CA 3.47Å; L208-G210 PolarHBondContact O-N 3.24Å; L208-G210 VanDerWaalsContact O-N 3.14Å
211	K	83.5	Confident	88.3	Confident	88 Å²	88	76.8 Å²	76.8	38%	0.383	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	130	-176.8	-66.4	174.9	-176.6	170	0	110.3	N149 E207 L208 N209 I213	N149-K211 VanDerWaalsContact O-CB 3.29Å; N149-K211 WeakPolarHBondContact O-CB 3.37Å; E207-K211 WeakPolarHBondContact CA-O 3.38Å; L208-K211 PolarHBondContact N-O 3.13Å; L208-K211 PolarHBondContact O-N 3.18Å; N209-K211 VanDerWaalsContact C-N 3.31Å; N209-K211 PolarHBondContact O-N 2.99Å; K211-I213 PolarHBondContact O-N 3.42Å
212	Q	90.6	Very high	87.4	Confident	131 Å²	131	76.6 Å²	76.6	61%	0.612	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	119.9	171.8	-72.4	-179	-14.2	0	0	110.1	N149 K206	N149-Q212 PolarHBondContact ND2-O 2.69Å; K206-Q212 CarbonylContact O-C 3.4Å; K206-Q212 WeakPolarHBondContact O-CA 3.22Å
213	I	93.6	Very high	86.6	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.01	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-78.2	143.7	176.5	69.9	175.7	0	0	0	110.4	K148 F150 M203 G205 K206 L208 K211 V215	K148-I213 CarbonylContact O-C 3.52Å; K148-I213 VanDerWaalsContact O-CA 3.28Å; K148-I213 WeakPolarHBondContact O-CA 2.82Å; F150-I213 HydrophobicContact CB-CG2 3.91Å; M203-I213 HydrophobicContact CB-CD1 4.19Å; M203-I213 HydrophobicContact CE-CD1 3.96Å; M203-I213 WeakPolarHBondContact O-CD1 3.3Å; M203-I213 VanDerWaalsContact O-CG1 3.27Å; M203-I213 WeakPolarHBondContact O-CG1 3.46Å; G205-I213 WeakPolarHBondContact CA-O 3.47Å; G205-I213 PolarHBondContact N-O 2.9Å; K206-I213 WeakPolarHBondContact O-CG1 3.14Å; K206-I213 PolarHBondContact O-N 3.14Å; L208-I213 HydrophobicContact CB-CG2 4.06Å; L208-I213 HydrophobicContact CD1-CD1 3.97Å; L208-I213 HydrophobicContact CD1-CG2 4Å; L208-I213 HydrophobicContact CG-CG2 4.16Å; K211-I213 PolarHBondContact O-N 3.42Å; I213-V215 HydrophobicContact CD1-CG2 3.87Å; I213-V215 HydrophobicContact CG1-CG2 4Å
214	Y	93.6	Very high	85.7	Confident	121 Å²	121	80 Å²	80	48%	0.475	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.9	168.9	173.5	-96.6	0	0	0	108.9	Y146 I147 K148 N204	Y146-Y214 HydrophobicContact CD1-CD1 4.06Å; Y146-Y214 AromaticContact CD1-CE1 3.99Å; Y146-Y214 HydrophobicContact CD1-CE1 3.99Å; Y146-Y214 HydrophobicContact CE1-CD1 4.09Å; Y146-Y214 HydrophobicContact CE1-CE1 4.26Å; I147-Y214 CarbonylContact C-O 3.45Å; I147-Y214 WeakPolarHBondContact CA-O 3.33Å; K148-Y214 PolarHBondContact N-O 2.87Å; K148-Y214 PolarHBondContact O-N 3.43Å; N204-Y214 WeakPolarHBondContact OD1-CD2 3.14Å
215	V	94.4	Very high	84.5	Confident	1 Å²	1	82.5 Å²	82.5	1%	0.006	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.8	178.2	-166.4	0	0	0	0	108.5	V145 Y146 I147 F163 V200 M203 N204 I213	V145-V215 HydrophobicContact CG1-CG1 3.36Å; Y146-V215 WeakPolarHBondContact O-CA 3.09Å; I147-V215 HydrophobicContact CG1-CG1 4.36Å; I147-V215 HydrophobicContact CG2-CG2 4.15Å; F163-V215 HydrophobicContact CE1-CG1 4.08Å; F163-V215 HydrophobicContact CZ-CG1 4.4Å; F163-V215 HydrophobicContact CZ-CG2 4.18Å; V200-V215 HydrophobicContact CG2-CG1 4.15Å; M203-V215 HydrophobicContact CB-CB 4.41Å; M203-V215 HydrophobicContact CB-CG2 3.74Å; N204-V215 HydrophobicContact CB-CB 3.98Å; N204-V215 WeakPolarHBondContact CB-O 3.34Å; N204-V215 PolarHBondContact OD1-N 2.97Å; N204-V215 PolarHBondContact OD1-O 3.1Å; I213-V215 HydrophobicContact CD1-CG2 3.87Å; I213-V215 HydrophobicContact CG1-CG2 4Å
216	G	92.4	Very high	83.7	Confident	4 Å²	4	85 Å²	85	4%	0.041	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	174.2	-177.2	0	0	0	0	0	112.8	V145 Y146 A218	V145-G216 WeakPolarHBondContact CA-O 3.31Å; Y146-G216 PolarHBondContact N-O 3.08Å; Y146-G216 PolarHBondContact O-N 3.1Å; Y146-G216 VanDerWaalsContact O-N 3.07Å; G216-A218 PolarHBondContact O-N 3.38Å
217	R	91.4	Very high	83	Confident	103 Å²	103	85.7 Å²	85.7	39%	0.389	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	130.7	175.1	-177	177.1	83	169.6	5.4	111	F142 Q219	F142-R217 HydrophobicContact CB-CG 3.72Å; F142-R217 HydrophobicContact CD1-CB 4.08Å; F142-R217 HydrophobicContact CD1-CG 3.91Å; F142-R217 HydrophobicContact CD2-CB 3.99Å; F142-R217 HydrophobicContact CD2-CG 3.88Å; F142-R217 HydrophobicContact CE1-CB 4.2Å; F142-R217 HydrophobicContact CE2-CB 4.13Å; F142-R217 HydrophobicContact CG-CB 3.98Å; F142-R217 HydrophobicContact CG-CG 3.55Å; F142-R217 HydrophobicContact CZ-CB 4.24Å; R217-Q219 PolarHBondContact O-N 2.71Å
218	A	87.6	Confident	82.4	Confident	26 Å²	26	84 Å²	84	22%	0.215	41%	0.414	C	S	.	.			trans	-66.1	114.3	171	0	0	0	0	0	110.4	N144 F187 G216	N144-A218 HydrophobicContact CB-CB 3.86Å; N144-A218 WeakPolarHBondContact O-CB 3.37Å; N144-A218 PolarHBondContact O-N 3.43Å; F187-A218 HydrophobicContact CD1-CB 4.06Å; F187-A218 HydrophobicContact CE1-CB 4.31Å; G216-A218 PolarHBondContact O-N 3.38Å
219	Q	82.1	Confident	82.2	Confident	68 Å²	68	88.1 Å²	88.1	32%	0.318	43%	0.43	S	S	.	.			trans	-96.4	144.9	172.5	-63.5	-178.6	-24.1	0	0	110.3	R217 R224 E227	R217-Q219 PolarHBondContact O-N 2.71Å; Q219-R224 HydrophobicContact CB-CB 4.08Å; Q219-E227 VanDerWaalsContact NE2-CD 3.33Å; Q219-E227 PolarHBondContact NE2-OE1 3.01Å; Q219-E227 PolarHBondContact NE2-OE2 2.96Å
220	K	79.9	Confident	82.4	Confident	145 Å²	145	92.5 Å²	92.5	63%	0.63	44%	0.44	S	S	*	.			trans	-69.2	153.1	170.1	-58.8	-179.7	-164.8	143.9	0	110.3	V222 E223 R224	K220-V222 VanDerWaalsContact C-N 3.27Å; K220-V222 PolarHBondContact O-N 3.04Å; K220-E223 HydrophobicContact CB-CB 4.45Å; K220-E223 HydrophobicContact CB-CG 4.08Å; K220-E223 WeakPolarHBondContact CB-OE2 3.47Å; K220-E223 VanDerWaalsContact CD-OE1 3.25Å; K220-E223 WeakPolarHBondContact CD-OE1 3.26Å; K220-E223 PolarHBondContact N-OE2 3.36Å; K220-E223 IonicContact NZ-OE1 2.6Å; K220-E223 PolarHBondContact NZ-OE1 3.24Å; K220-E223 PolarHBondContact O-N 3.45Å; K220-E223 VanDerWaalsContact O-N 3.16Å; K220-R224 WeakPolarHBondContact O-CB 3.49Å; K220-R224 PolarHBondContact O-N 2.89Å
221	K	76.7	Confident	82.2	Confident	172 Å²	172	96 Å²	96	75%	0.748	44%	0.438	S	S	*	.	H	α-helix	trans	-51.5	-43.7	-178.7	-171.7	-178.6	177.1	-173	0	112.6	Q225	K221-Q225 VanDerWaalsContact O-CB 3.27Å; K221-Q225 WeakPolarHBondContact O-CB 3.38Å; K221-Q225 PolarHBondContact O-N 3.13Å
222	V	75.4	Confident	81.9	Confident	109 Å²	109	98 Å²	98	66%	0.661	45%	0.447	S	S	*	.	H	α-helix	trans	-70.3	-42.7	-179.5	-177.5	0	0	0	0	112.7	K220 Q225 T226	K220-V222 VanDerWaalsContact C-N 3.27Å; K220-V222 PolarHBondContact O-N 3.04Å; V222-Q225 PolarHBondContact O-N 2.89Å; V222-T226 WeakPolarHBondContact O-CB 3.45Å; V222-T226 PolarHBondContact O-N 3.21Å; V222-T226 PolarHBondContact O-OG1 3.04Å
223	E	76.5	Confident	81.3	Confident	76 Å²	76	96.7 Å²	96.7	36%	0.355	44%	0.441	S	S	.	.	H	α-helix	trans	-59.9	-52.6	175.7	-64.9	160.7	-174.9	0	0	109.6	K220 Q225 T226 E227	K220-E223 HydrophobicContact CB-CB 4.45Å; K220-E223 HydrophobicContact CB-CG 4.08Å; K220-E223 WeakPolarHBondContact CB-OE2 3.47Å; K220-E223 VanDerWaalsContact CD-OE1 3.25Å; K220-E223 WeakPolarHBondContact CD-OE1 3.26Å; K220-E223 PolarHBondContact N-OE2 3.36Å; K220-E223 IonicContact NZ-OE1 2.6Å; K220-E223 PolarHBondContact NZ-OE1 3.24Å; K220-E223 PolarHBondContact O-N 3.45Å; K220-E223 VanDerWaalsContact O-N 3.16Å; E223-Q225 PolarHBondContact O-N 3.34Å; E223-T226 PolarHBondContact O-N 2.83Å; E223-E227 PolarHBondContact O-N 2.68Å
224	R	73.9	Confident	80.6	Confident	117 Å²	117	101.7 Å²	101.7	44%	0.442	46%	0.464	S	S	.	.	H	α-helix	trans	-58.6	-42.7	177.8	-179.2	175.7	173.4	170.3	0.2	112.7	Q219 K220 L228	Q219-R224 HydrophobicContact CB-CB 4.08Å; K220-R224 WeakPolarHBondContact O-CB 3.49Å; K220-R224 PolarHBondContact O-N 2.89Å; R224-L228 WeakPolarHBondContact O-CB 3.49Å; R224-L228 PolarHBondContact O-N 2.75Å
225	Q	69.4	Low	79.8	Confident	129 Å²	129	100.7 Å²	100.7	60%	0.603	47%	0.465	S	S	*	.	H	α-helix	trans	-69.3	-36.2	-179.8	-170.5	164.5	-5.5	0	0	111.6	K221 V222 E223 K229	K221-Q225 VanDerWaalsContact O-CB 3.27Å; K221-Q225 WeakPolarHBondContact O-CB 3.38Å; K221-Q225 PolarHBondContact O-N 3.13Å; V222-Q225 PolarHBondContact O-N 2.89Å; E223-Q225 PolarHBondContact O-N 3.34Å; Q225-K229 VanDerWaalsContact O-CB 3.23Å; Q225-K229 WeakPolarHBondContact O-CB 3.48Å; Q225-K229 PolarHBondContact O-N 2.86Å
226	T	74.7	Confident	79.1	Confident	90 Å²	90	105.8 Å²	105.8	55%	0.552	49%	0.487	S	S	*	.	H	α-helix	trans	-67.8	-47.1	173.4	-56.8	0	0	0	0	112	V222 E223 L228 K229 R230	V222-T226 WeakPolarHBondContact O-CB 3.45Å; V222-T226 PolarHBondContact O-N 3.21Å; V222-T226 PolarHBondContact O-OG1 3.04Å; E223-T226 PolarHBondContact O-N 2.83Å; T226-L228 PolarHBondContact O-N 3.33Å; T226-K229 PolarHBondContact O-N 2.82Å; T226-R230 WeakPolarHBondContact O-CB 3.36Å; T226-R230 PolarHBondContact O-N 2.89Å
227	E	76.5	Confident	78.3	Confident	94 Å²	94	110.3 Å²	110.3	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-60.6	-43.6	175.1	-77.5	-173.1	-164.5	0	0	111.9	Q219 E223 R230 K231	Q219-E227 VanDerWaalsContact NE2-CD 3.33Å; Q219-E227 PolarHBondContact NE2-OE1 3.01Å; Q219-E227 PolarHBondContact NE2-OE2 2.96Å; E223-E227 PolarHBondContact O-N 2.68Å; E227-R230 PolarHBondContact O-N 2.79Å; E227-K231 WeakPolarHBondContact O-CB 3.43Å; E227-K231 PolarHBondContact O-N 2.89Å
228	L	76	Confident	77.7	Confident	91 Å²	91	108.9 Å²	108.9	48%	0.476	51%	0.508	S	S	.	.	H	α-helix	trans	-67.6	-42.1	179.9	-168.9	66.5	0	0	0	111.5	R224 T226 K231 F232	R224-L228 WeakPolarHBondContact O-CB 3.49Å; R224-L228 PolarHBondContact O-N 2.75Å; T226-L228 PolarHBondContact O-N 3.33Å; L228-K231 PolarHBondContact O-N 3.47Å; L228-F232 HydrophobicContact CD1-CD2 4.19Å; L228-F232 HydrophobicContact CD1-CE2 3.85Å; L228-F232 HydrophobicContact CD2-CE2 4.29Å; L228-F232 HydrophobicContact CG-CD2 3.92Å; L228-F232 HydrophobicContact CG-CE2 3.81Å; L228-F232 VanDerWaalsContact O-CD2 3.3Å; L228-F232 WeakPolarHBondContact O-CD2 3.29Å; L228-F232 PolarHBondContact O-N 3.21Å
229	K	79.3	Confident	77.2	Confident	132 Å²	132	115 Å²	115	57%	0.574	53%	0.525	S	S	*	.	H	α-helix	trans	-57	-53.4	171.8	177.8	175.5	172.9	177.8	0	110.6	Q225 T226 K231 F232 E233	Q225-K229 VanDerWaalsContact O-CB 3.23Å; Q225-K229 WeakPolarHBondContact O-CB 3.48Å; Q225-K229 PolarHBondContact O-N 2.86Å; T226-K229 PolarHBondContact O-N 2.82Å; K229-K231 VanDerWaalsContact C-N 3.29Å; K229-K231 PolarHBondContact O-N 3.46Å; K229-F232 PolarHBondContact O-N 3.41Å; K229-F232 VanDerWaalsContact O-N 3.14Å; K229-E233 WeakPolarHBondContact CE-OE1 3.31Å; K229-E233 HydrophobicContact CG-CG 4.4Å; K229-E233 WeakPolarHBondContact CG-OE1 3.09Å; K229-E233 IonicContact NZ-OE1 2.63Å; K229-E233 WeakPolarHBondContact O-CB 3.26Å; K229-E233 WeakPolarHBondContact O-CG 3.24Å; K229-E233 PolarHBondContact O-N 2.84Å
230	R	81.1	Confident	76.9	Confident	183 Å²	183	114.1 Å²	114.1	69%	0.691	52%	0.522	S	S	*	.	H	α-helix	trans	-56.3	-40.4	177.1	-177.8	-178.7	176.2	-169.8	0.3	112.3	T226 E227 E233 Q234	T226-R230 WeakPolarHBondContact O-CB 3.36Å; T226-R230 PolarHBondContact O-N 2.89Å; E227-R230 PolarHBondContact O-N 2.79Å; R230-E233 PolarHBondContact O-N 3.45Å; R230-Q234 VanDerWaalsContact O-CB 3.29Å; R230-Q234 WeakPolarHBondContact O-CB 3.31Å; R230-Q234 PolarHBondContact O-N 2.83Å
231	K	77.9	Confident	76.9	Confident	135 Å²	135	111 Å²	111	59%	0.587	52%	0.515	S	S	*	.	H	α-helix	trans	-72.2	-33.7	179.5	-166	171.5	-177.1	173.6	0	112.8	E227 L228 K229 M235	E227-K231 WeakPolarHBondContact O-CB 3.43Å; E227-K231 PolarHBondContact O-N 2.89Å; L228-K231 PolarHBondContact O-N 3.47Å; K229-K231 VanDerWaalsContact C-N 3.29Å; K229-K231 PolarHBondContact O-N 3.46Å; K231-M235 HydrophobicContact CG-CE 4.37Å; K231-M235 PolarHBondContact O-N 3.33Å
232	F	76.8	Confident	77	Confident	129 Å²	129	110.4 Å²	110.4	57%	0.566	51%	0.508	S	S	*	.	H	α-helix	trans	-71.4	-40.5	170.5	-86.5	-64.7	0	0	0	112.5	L228 K229 M235 K236	L228-F232 HydrophobicContact CD1-CD2 4.19Å; L228-F232 HydrophobicContact CD1-CE2 3.85Å; L228-F232 HydrophobicContact CD2-CE2 4.29Å; L228-F232 HydrophobicContact CG-CD2 3.92Å; L228-F232 HydrophobicContact CG-CE2 3.81Å; L228-F232 VanDerWaalsContact O-CD2 3.3Å; L228-F232 WeakPolarHBondContact O-CD2 3.29Å; L228-F232 PolarHBondContact O-N 3.21Å; K229-F232 PolarHBondContact O-N 3.41Å; K229-F232 VanDerWaalsContact O-N 3.14Å; F232-M235 HydrophobicContact CD1-CE 4.1Å; F232-M235 HydrophobicContact CE1-CE 4.31Å; F232-M235 PolarHBondContact O-N 2.98Å; F232-K236 WeakPolarHBondContact O-CB 3.16Å; F232-K236 PolarHBondContact O-N 3.12Å
233	E	79.2	Confident	77.1	Confident	104 Å²	104	109.5 Å²	109.5	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-43.1	173.8	-73.7	169	166.2	0	0	110.9	K229 R230 K236 Q237	K229-E233 WeakPolarHBondContact CE-OE1 3.31Å; K229-E233 HydrophobicContact CG-CG 4.4Å; K229-E233 WeakPolarHBondContact CG-OE1 3.09Å; K229-E233 IonicContact NZ-OE1 2.63Å; K229-E233 WeakPolarHBondContact O-CB 3.26Å; K229-E233 WeakPolarHBondContact O-CG 3.24Å; K229-E233 PolarHBondContact O-N 2.84Å; R230-E233 PolarHBondContact O-N 3.45Å; E233-K236 PolarHBondContact O-N 3.43Å; E233-Q237 WeakPolarHBondContact O-CB 3.44Å; E233-Q237 PolarHBondContact O-N 3.28Å
234	Q	77.4	Confident	77.3	Confident	107 Å²	107	112.3 Å²	112.3	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-61.1	-48.8	172.9	-173.4	172.7	9.2	0	0	111.8	R230 K236 Q237 D238	R230-Q234 VanDerWaalsContact O-CB 3.29Å; R230-Q234 WeakPolarHBondContact O-CB 3.31Å; R230-Q234 PolarHBondContact O-N 2.83Å; Q234-K236 VanDerWaalsContact C-N 3.3Å; Q234-K236 PolarHBondContact O-N 2.92Å; Q234-Q237 CarbonylContact O-C 3.53Å; Q234-Q237 PolarHBondContact O-N 3.43Å; Q234-Q237 VanDerWaalsContact O-N 3.07Å; Q234-D238 VanDerWaalsContact O-CG 3.26Å; Q234-D238 PolarHBondContact O-N 2.92Å
235	M	76.8	Confident	77.7	Confident	100 Å²	100	108 Å²	108	49%	0.493	50%	0.499	S	S	.	.	H	α-helix	trans	-63.2	-33.2	175.1	-79.9	-171.7	-71.4	0	0	113.2	K231 F232 R239	K231-M235 HydrophobicContact CG-CE 4.37Å; K231-M235 PolarHBondContact O-N 3.33Å; F232-M235 HydrophobicContact CD1-CE 4.1Å; F232-M235 HydrophobicContact CE1-CE 4.31Å; F232-M235 PolarHBondContact O-N 2.98Å; M235-R239 WeakPolarHBondContact O-CB 3.38Å; M235-R239 PolarHBondContact O-N 3.3Å
236	K	80.5	Confident	78.7	Confident	107 Å²	107	102.5 Å²	102.5	47%	0.465	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-43.4	171.4	-173.1	177.1	178.5	178.4	0	110	F232 E233 Q234 R239 I240 E324	F232-K236 WeakPolarHBondContact O-CB 3.16Å; F232-K236 PolarHBondContact O-N 3.12Å; E233-K236 PolarHBondContact O-N 3.43Å; Q234-K236 VanDerWaalsContact C-N 3.3Å; Q234-K236 PolarHBondContact O-N 2.92Å; K236-R239 CarbonylContact O-C 3.56Å; K236-R239 PolarHBondContact O-N 3.47Å; K236-I240 HydrophobicContact CG-CD1 4.04Å; K236-I240 VanDerWaalsContact O-CG1 3.27Å; K236-I240 WeakPolarHBondContact O-CG1 3.29Å; K236-I240 PolarHBondContact O-N 2.83Å; K236-E324 IonicContact NZ-OE1 2.74Å; K236-E324 IonicContact NZ-OE2 3.34Å; K236-E324 PolarHBondContact NZ-OE2 3.14Å
237	Q	74.4	Confident	79.6	Confident	100 Å²	100	100.1 Å²	100.1	47%	0.467	46%	0.458	S	S	.	.	H	α-helix	trans	-70.4	-45.8	-178.6	-169.5	62.1	15.2	0	0	112.9	E233 Q234 R239 I240 T241	E233-Q237 WeakPolarHBondContact O-CB 3.44Å; E233-Q237 PolarHBondContact O-N 3.28Å; Q234-Q237 CarbonylContact O-C 3.53Å; Q234-Q237 PolarHBondContact O-N 3.43Å; Q234-Q237 VanDerWaalsContact O-N 3.07Å; Q237-R239 PolarHBondContact O-N 2.88Å; Q237-I240 CarbonylContact O-C 3.54Å; Q237-I240 WeakPolarHBondContact O-CA 3.31Å; Q237-I240 WeakPolarHBondContact O-CB 3.45Å; Q237-I240 PolarHBondContact O-N 3.31Å; Q237-T241 PolarHBondContact O-N 3.15Å; Q237-T241 PolarHBondContact O-OG1 3.27Å
238	D	80.3	Confident	80.4	Confident	73 Å²	73	95.6 Å²	95.6	39%	0.39	44%	0.437	S	S	.	.	H	α-helix	trans	-56.7	-39	173.3	-65.6	-19.7	0	0	0	110.7	Q234 R242	Q234-D238 VanDerWaalsContact O-CG 3.26Å; Q234-D238 PolarHBondContact O-N 2.92Å; D238-R242 WeakPolarHBondContact O-CB 3.22Å; D238-R242 PolarHBondContact O-N 3Å
239	R	76.6	Confident	81.3	Confident	154 Å²	154	93.8 Å²	93.8	58%	0.581	42%	0.424	S	S	*	.	H	α-helix	trans	-75.9	-18.6	174	-169.3	172.5	-179.6	-90.6	-4.8	113.3	M235 K236 Q237 Y243 R322	M235-R239 WeakPolarHBondContact O-CB 3.38Å; M235-R239 PolarHBondContact O-N 3.3Å; K236-R239 CarbonylContact O-C 3.56Å; K236-R239 PolarHBondContact O-N 3.47Å; Q237-R239 PolarHBondContact O-N 2.88Å; R239-Y243 HydrophobicContact CG-CD2 4.32Å; R239-Y243 HydrophobicContact CG-CE2 4Å; R239-Y243 WeakPolarHBondContact O-CD2 3.27Å; R239-R322 PolarHBondContact O-NH2 3.38Å
240	I	75.9	Confident	82	Confident	49 Å²	49	87.5 Å²	87.5	25%	0.251	40%	0.397	S	S	.	.	H	α-helix	trans	-74.8	-59.6	167.8	-73.5	160.2	0	0	0	108.6	K236 Q237 R242 Y243 Q244 R322	K236-I240 HydrophobicContact CG-CD1 4.04Å; K236-I240 VanDerWaalsContact O-CG1 3.27Å; K236-I240 WeakPolarHBondContact O-CG1 3.29Å; K236-I240 PolarHBondContact O-N 2.83Å; Q237-I240 CarbonylContact O-C 3.54Å; Q237-I240 WeakPolarHBondContact O-CA 3.31Å; Q237-I240 WeakPolarHBondContact O-CB 3.45Å; Q237-I240 PolarHBondContact O-N 3.31Å; I240-R242 PolarHBondContact O-N 3.01Å; I240-Y243 CarbonylContact O-C 3.56Å; I240-Y243 WeakPolarHBondContact O-CA 3.35Å; I240-Y243 PolarHBondContact O-N 3.28Å; I240-Q244 PolarHBondContact O-N 2.81Å; I240-Q244 VanDerWaalsContact O-N 3.16Å; I240-R322 VanDerWaalsContact CG1-NH1 3.28Å
241	T	79.8	Confident	82.7	Confident	79 Å²	79	83.2 Å²	83.2	49%	0.485	38%	0.383	S	S	.	.	H	α-helix	trans	-58.9	-46.6	-175.5	-54	0	0	0	0	112.5	Q237 Y243 Q244	Q237-T241 PolarHBondContact O-N 3.15Å; Q237-T241 PolarHBondContact O-OG1 3.27Å; T241-Y243 PolarHBondContact O-N 3.33Å; T241-Q244 WeakPolarHBondContact O-CB 3.25Å; T241-Q244 PolarHBondContact O-N 2.97Å
242	R	77.6	Confident	83.4	Confident	160 Å²	160	79.8 Å²	79.8	60%	0.604	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.5	174.7	-169.1	-175.8	-56.5	152.7	7	112.9	D238 I240 V246	D238-R242 WeakPolarHBondContact O-CB 3.22Å; D238-R242 PolarHBondContact O-N 3Å; I240-R242 PolarHBondContact O-N 3.01Å; R242-V246 WeakPolarHBondContact O-CG2 3.35Å
243	Y	77.9	Confident	84.1	Confident	91 Å²	91	73.9 Å²	73.9	36%	0.357	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-15.2	171.3	28.5	-119.1	0	0	0	116.9	R239 I240 T241 V246 C291	R239-Y243 HydrophobicContact CG-CD2 4.32Å; R239-Y243 HydrophobicContact CG-CE2 4Å; R239-Y243 WeakPolarHBondContact O-CD2 3.27Å; I240-Y243 CarbonylContact O-C 3.56Å; I240-Y243 WeakPolarHBondContact O-CA 3.35Å; I240-Y243 PolarHBondContact O-N 3.28Å; T241-Y243 PolarHBondContact O-N 3.33Å; Y243-V246 HydrophobicContact CD1-CG2 4.25Å; Y243-C291 VanDerWaalsContact CD1-SG 3.55Å
244	Q	81	Confident	84.7	Confident	134 Å²	134	70.5 Å²	70.5	63%	0.626	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	128.6	-162.9	-165.6	169.6	-0.3	0	0	111.4	I240 T241 V246	I240-Q244 PolarHBondContact O-N 2.81Å; I240-Q244 VanDerWaalsContact O-N 3.16Å; T241-Q244 WeakPolarHBondContact O-CB 3.25Å; T241-Q244 PolarHBondContact O-N 2.97Å; Q244-V246 PolarHBondContact O-N 3.13Å
245	G	82.4	Confident	85.2	Confident	28 Å²	28	69.8 Å²	69.8	29%	0.289	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	-25.7	-179.6	0	0	0	0	0	116.1	A298 L319	G245-A298 WeakPolarHBondContact O-CB 3.45Å; G245-L319 WeakPolarHBondContact O-CD2 3.45Å
246	V	90.8	Very high	85.6	Confident	13 Å²	13	67.1 Å²	67.1	8%	0.079	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-19.3	-175.7	-58.4	0	0	0	0	115.2	R242 Y243 Q244 C291 F292 P295	R242-V246 WeakPolarHBondContact O-CG2 3.35Å; Y243-V246 HydrophobicContact CD1-CG2 4.25Å; Q244-V246 PolarHBondContact O-N 3.13Å; V246-C291 WeakPolarHBondContact O-CA 3.49Å; V246-F292 PolarHBondContact O-N 3.41Å; V246-P295 HydrophobicContact CG1-CB 4.3Å
247	N	92.9	Very high	86.1	Confident	39 Å²	39	62.2 Å²	62.2	21%	0.209	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.6	-174.6	-173.1	46.5	0	0	0	111.4	C291 A320	N247-C291 HydrophobicContact CB-CB 4.44Å; N247-A320 HydrophobicContact CB-CB 4.29Å; N247-A320 VanDerWaalsContact ND2-CB 3.29Å; N247-A320 WeakPolarHBondContact ND2-CB 3.27Å; N247-A320 VanDerWaalsContact O-CB 3.24Å; N247-A320 WeakPolarHBondContact O-CB 3.47Å; N247-A320 PolarHBondContact O-N 2.95Å
248	L	93.9	Very high	87	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	146.2	-179.5	-55.6	-169.9	0	0	0	111.8	F266 F289 V290 F292 A298 A301 V302 V317 A318 L319	L248-F266 HydrophobicContact CD1-CE1 4.44Å; L248-F289 WeakPolarHBondContact O-CA 3.42Å; L248-V290 WeakPolarHBondContact CB-O 3.4Å; L248-V290 PolarHBondContact N-O 3.46Å; L248-V290 PolarHBondContact O-N 3.07Å; L248-F292 HydrophobicContact CD1-CD2 4.22Å; L248-F292 HydrophobicContact CD1-CE2 3.77Å; L248-F292 HydrophobicContact CG-CD2 4.4Å; L248-F292 HydrophobicContact CG-CE2 4.37Å; L248-A298 HydrophobicContact CD2-CB 3.91Å; L248-A298 HydrophobicContact CG-CB 4.3Å; L248-A301 HydrophobicContact CD1-CB 3.79Å; L248-V302 HydrophobicContact CD1-CG2 3.98Å; L248-V302 HydrophobicContact CD2-CG2 3.44Å; L248-V302 VanDerWaalsContact CD2-CG2 3.44Å; L248-V302 HydrophobicContact CG-CG2 4.33Å; L248-V317 HydrophobicContact CB-CG1 4.42Å; L248-V317 HydrophobicContact CD1-CG1 3.82Å; L248-A318 CarbonylContact C-O 3.55Å; L248-A318 WeakPolarHBondContact CA-O 3.2Å; L248-L319 HydrophobicContact CD2-CD2 3.77Å
249	Y	94.7	Very high	87.7	Confident	53 Å²	53	60.7 Å²	60.7	21%	0.208	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.9	167.4	173.5	-106	0	0	0	108.2	K251 F287 F289 Y316 V317 A318	Y249-K251 HydrophobicContact CD1-CB 4.43Å; Y249-K251 HydrophobicContact CE1-CB 3.7Å; Y249-K251 HydrophobicContact CE1-CD 4.3Å; Y249-K251 HydrophobicContact CE1-CG 4.11Å; Y249-K251 WeakPolarHBondContact OH-CG 3.38Å; Y249-F287 HydrophobicContact CD2-CD2 4.21Å; Y249-F287 HydrophobicContact CE2-CB 4.05Å; Y249-F287 AromaticContact CE2-CD2 3.45Å; Y249-F287 HydrophobicContact CE2-CD2 3.45Å; Y249-F287 VanDerWaalsContact CE2-CD2 3.45Å; Y249-F287 HydrophobicContact CE2-CE2 4.03Å; Y249-F287 AromaticContact CE2-CG 3.9Å; Y249-F287 HydrophobicContact CE2-CG 3.9Å; Y249-F289 HydrophobicContact CD2-CD1 4.33Å; Y249-F289 AromaticContact CD2-CE1 3.72Å; Y249-F289 HydrophobicContact CD2-CE1 3.72Å; Y249-F289 HydrophobicContact CD2-CZ 4.01Å; Y249-F289 HydrophobicContact CG-CE1 4.49Å; Y249-Y316 HydrophobicContact CD1-CD1 4.34Å; Y249-Y316 HydrophobicContact CD1-CE1 4.18Å; Y249-Y316 HydrophobicContact CE1-CD1 4.34Å; Y249-Y316 HydrophobicContact CE1-CE1 4.33Å; Y249-V317 WeakPolarHBondContact O-CA 3.43Å; Y249-A318 PolarHBondContact N-O 2.86Å; Y249-A318 PolarHBondContact O-N 2.89Å; Y249-A318 VanDerWaalsContact O-N 3.11Å
250	V	95	Very high	88.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.6	179.8	-174.7	0	0	0	0	108.2	L253 L262 F266 F287 G288 V290 L315 Y316 V317	V250-L253 HydrophobicContact CG1-CD2 3.64Å; V250-L253 HydrophobicContact CG1-CG 4.28Å; V250-L262 HydrophobicContact CG1-CD1 4.24Å; V250-F266 HydrophobicContact CB-CZ 4.44Å; V250-F266 HydrophobicContact CG1-CE2 4.15Å; V250-F266 HydrophobicContact CG1-CZ 3.93Å; V250-F266 HydrophobicContact CG2-CE1 3.97Å; V250-F266 HydrophobicContact CG2-CE2 4.16Å; V250-F266 HydrophobicContact CG2-CZ 3.58Å; V250-F287 CarbonylContact O-C 3.59Å; V250-F287 WeakPolarHBondContact O-CA 3.36Å; V250-F287 VanDerWaalsContact O-CB 3.31Å; V250-F287 WeakPolarHBondContact O-CB 3.37Å; V250-G288 PolarHBondContact N-O 3.07Å; V250-G288 PolarHBondContact O-N 3.1Å; V250-V290 HydrophobicContact CG2-CG2 3.99Å; V250-L315 HydrophobicContact CG1-CD1 4.2Å; V250-L315 HydrophobicContact CG1-CD2 4.47Å; V250-Y316 CarbonylContact C-O 3.6Å; V250-Y316 WeakPolarHBondContact CA-O 3.27Å; V250-V317 HydrophobicContact CG1-CG2 4.28Å; V250-V317 HydrophobicContact CG2-CG1 4.4Å; V250-V317 HydrophobicContact CG2-CG2 4.46Å
251	K	94.4	Very high	89.3	Confident	93 Å²	93	63.7 Å²	63.7	40%	0.404	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	166.3	-178.3	-158.7	-152.3	173.6	-159.4	0	110.5	Y249 G286 F287 Y316	Y249-K251 HydrophobicContact CD1-CB 4.43Å; Y249-K251 HydrophobicContact CE1-CB 3.7Å; Y249-K251 HydrophobicContact CE1-CD 4.3Å; Y249-K251 HydrophobicContact CE1-CG 4.11Å; Y249-K251 WeakPolarHBondContact OH-CG 3.38Å; K251-G286 CarbonylContact C-O 3.52Å; K251-F287 HydrophobicContact CB-CB 4.21Å; K251-F287 HydrophobicContact CG-CB 3.94Å; K251-Y316 HydrophobicContact CB-CD1 4.07Å; K251-Y316 PolarHBondContact N-O 3.19Å; K251-Y316 PolarHBondContact O-N 3.33Å
252	N	92.6	Very high	90	Very high	63 Å²	63	60 Å²	60	34%	0.337	30%	0.295	S	S	.	.	S	Bend	trans	64.6	28.7	-172.7	-49.9	-11.1	0	0	0	112.3	G286 K313 P314	N252-G286 PolarHBondContact N-O 3.25Å; N252-K313 VanDerWaalsContact O-CB 3.3Å; N252-K313 WeakPolarHBondContact O-CB 3.19Å; N252-P314 VanDerWaalsContact CB-O 3.24Å; N252-P314 WeakPolarHBondContact CB-O 3.41Å; N252-P314 PolarHBondContact ND2-O 3.25Å; N252-P314 VanDerWaalsContact ND2-O 3.13Å
253	L	92.9	Very high	90.8	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	29%	0.288	C	S	.	.			trans	-57.7	142.8	168.2	-63.9	178.6	0	0	0	109.5	V250 I257 L262 V277 G286 L315	V250-L253 HydrophobicContact CG1-CD2 3.64Å; V250-L253 HydrophobicContact CG1-CG 4.28Å; L253-I257 HydrophobicContact CB-CB 4.49Å; L253-I257 HydrophobicContact CD2-CG2 4.22Å; L253-L262 HydrophobicContact CD1-CD2 4.39Å; L253-L262 HydrophobicContact CD2-CD1 3.94Å; L253-V277 HydrophobicContact CD1-CG1 4.1Å; L253-V277 HydrophobicContact CD1-CG2 3.91Å; L253-G286 PolarHBondContact N-O 3.14Å; L253-L315 HydrophobicContact CD2-CD2 3.88Å
254	D	91.4	Very high	91.6	Very high	33 Å²	33	61.3 Å²	61.3	18%	0.176	30%	0.304	C	S	.	.			trans	-73.3	153.4	168.7	-169.9	-112.6	0	0	0	111.4	G256 I257 A311 T312 K313	D254-G256 PolarHBondContact O-N 3.34Å; D254-G256 PolarHBondContact OD1-N 2.79Å; D254-I257 HydrophobicContact CB-CG1 4.01Å; D254-I257 WeakPolarHBondContact O-CB 3.47Å; D254-I257 PolarHBondContact O-N 3.38Å; D254-A311 HydrophobicContact CB-CB 4.21Å; D254-T312 PolarHBondContact OD2-OG1 3.35Å; D254-T312 VanDerWaalsContact OD2-OG1 3.09Å; D254-K313 HydrophobicContact CB-CD 4.01Å; D254-K313 VanDerWaalsContact OD2-CE 3.31Å; D254-K313 WeakPolarHBondContact OD2-CE 3.35Å; D254-K313 IonicContact OD2-NZ 3.78Å; D254-K313 PolarHBondContact OD2-NZ 3.16Å
255	D	87.3	Confident	92.2	Very high	92 Å²	92	57.5 Å²	57.5	49%	0.492	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-23.6	-175.3	-63.8	57.2	0	0	0	111.6	K313	D255-K313 IonicContact OD1-NZ 2.75Å; D255-K313 PolarHBondContact OD1-NZ 2.87Å
256	G	86.4	Confident	92.8	Very high	45 Å²	45	56.2 Å²	56.2	46%	0.464	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	26	171	0	0	0	0	0	115.5	D254 R261	D254-G256 PolarHBondContact O-N 3.34Å; D254-G256 PolarHBondContact OD1-N 2.79Å; G256-R261 PolarHBondContact O-NH1 3.43Å; G256-R261 VanDerWaalsContact O-NH1 3.11Å
257	I	90.6	Very high	93.1	Very high	4 Å²	4	58.4 Å²	58.4	2%	0.021	29%	0.288	C	S	.	.			trans	-106.6	121.6	167.4	-52.2	-60.2	0	0	0	109.5	L253 D254 R261 L262 V310 A311	L253-I257 HydrophobicContact CB-CB 4.49Å; L253-I257 HydrophobicContact CD2-CG2 4.22Å; D254-I257 HydrophobicContact CB-CG1 4.01Å; D254-I257 WeakPolarHBondContact O-CB 3.47Å; D254-I257 PolarHBondContact O-N 3.38Å; I257-R261 HydrophobicContact CD1-CG 4.19Å; I257-R261 HydrophobicContact CG2-CB 4.43Å; I257-L262 HydrophobicContact CG2-CB 4.12Å; I257-V310 HydrophobicContact CD1-CG1 4.19Å; I257-A311 HydrophobicContact CD1-CB 4.5Å
258	D	92.8	Very high	93.2	Very high	79 Å²	79	61 Å²	61	42%	0.422	31%	0.307	S	S	.	.			trans	-106.9	-178.4	175.9	57	22.6	0	0	0	111.9	E260 R261 L262	D258-E260 VanDerWaalsContact C-N 3.32Å; D258-E260 PolarHBondContact O-N 2.66Å; D258-E260 PolarHBondContact OD1-N 2.8Å; D258-R261 WeakPolarHBondContact OD1-CB 3.37Å; D258-R261 PolarHBondContact OD1-N 3.09Å; D258-L262 WeakPolarHBondContact O-CB 3.47Å; D258-L262 PolarHBondContact O-N 3.32Å
259	D	94	Very high	93.2	Very high	61 Å²	61	61.9 Å²	61.9	33%	0.326	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-37.8	-178.4	-68.3	10.4	0	0	0	112.1	R263 V277	D259-R263 WeakPolarHBondContact O-CB 3.05Å; D259-R263 PolarHBondContact O-N 3.08Å; D259-V277 WeakPolarHBondContact OD1-CB 3.48Å; D259-V277 PolarHBondContact OD1-N 2.96Å
260	E	94	Very high	93.1	Very high	164 Å²	164	60.2 Å²	60.2	77%	0.766	31%	0.31	S	S	*	.	H	α-helix	trans	-72.4	-45.6	-179.3	-67	-167.2	-177.1	0	0	112.1	D258 R263 K264	D258-E260 VanDerWaalsContact C-N 3.32Å; D258-E260 PolarHBondContact O-N 2.66Å; D258-E260 PolarHBondContact OD1-N 2.8Å; E260-R263 WeakPolarHBondContact O-CB 3.41Å; E260-R263 PolarHBondContact O-N 3.08Å; E260-K264 WeakPolarHBondContact O-CB 3.49Å; E260-K264 PolarHBondContact O-N 2.72Å
261	R	92.4	Very high	93.1	Very high	102 Å²	102	64.7 Å²	64.7	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-68.1	-40.1	177.5	-168.9	170.8	-179	-171.5	6.1	111	G256 I257 D258 R263 K264 E265	G256-R261 PolarHBondContact O-NH1 3.43Å; G256-R261 VanDerWaalsContact O-NH1 3.11Å; I257-R261 HydrophobicContact CD1-CG 4.19Å; I257-R261 HydrophobicContact CG2-CB 4.43Å; D258-R261 WeakPolarHBondContact OD1-CB 3.37Å; D258-R261 PolarHBondContact OD1-N 3.09Å; R261-R263 VanDerWaalsContact C-N 3.31Å; R261-R263 PolarHBondContact O-N 3.36Å; R261-K264 PolarHBondContact O-N 3.33Å; R261-E265 WeakPolarHBondContact O-CG 3.19Å; R261-E265 PolarHBondContact O-N 3.15Å
262	L	94.4	Very high	93.1	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-44.1	170.6	-179.5	61	0	0	0	111.2	V250 L253 I257 D258 F266 A275 V277 V290	V250-L262 HydrophobicContact CG1-CD1 4.24Å; L253-L262 HydrophobicContact CD1-CD2 4.39Å; L253-L262 HydrophobicContact CD2-CD1 3.94Å; I257-L262 HydrophobicContact CG2-CB 4.12Å; D258-L262 WeakPolarHBondContact O-CB 3.47Å; D258-L262 PolarHBondContact O-N 3.32Å; L262-F266 HydrophobicContact CD1-CD2 3.75Å; L262-F266 HydrophobicContact CD1-CE2 3.65Å; L262-F266 WeakPolarHBondContact O-CD2 3.33Å; L262-F266 PolarHBondContact O-N 3.07Å; L262-A275 HydrophobicContact CG-CB 4.5Å; L262-V277 HydrophobicContact CB-CG2 4.35Å; L262-V277 HydrophobicContact CD2-CG2 3.89Å; L262-V290 HydrophobicContact CD1-CG2 3.92Å; L262-V290 HydrophobicContact CD2-CG2 3.86Å; L262-V290 HydrophobicContact CG-CG2 3.72Å
263	R	95.6	Very high	93.1	Very high	123 Å²	123	61.6 Å²	61.6	46%	0.464	33%	0.329	S	S	.	.	H	α-helix	trans	-62.9	-41.6	175.3	-167	170.2	-169	-90.6	-4.7	111.9	D259 E260 R261 F266 S267 I272 A275	D259-R263 WeakPolarHBondContact O-CB 3.05Å; D259-R263 PolarHBondContact O-N 3.08Å; E260-R263 WeakPolarHBondContact O-CB 3.41Å; E260-R263 PolarHBondContact O-N 3.08Å; R261-R263 VanDerWaalsContact C-N 3.31Å; R261-R263 PolarHBondContact O-N 3.36Å; R263-F266 PolarHBondContact O-N 3.36Å; R263-S267 WeakPolarHBondContact O-CB 3.19Å; R263-S267 PolarHBondContact O-N 3.2Å; R263-I272 HydrophobicContact CG-CB 4.21Å; R263-I272 HydrophobicContact CG-CD1 3.85Å; R263-I272 HydrophobicContact CG-CG2 4.06Å; R263-I272 PolarHBondContact NH2-O 3.35Å; R263-I272 VanDerWaalsContact O-CD1 3.24Å; R263-I272 WeakPolarHBondContact O-CD1 3.49Å; R263-A275 HydrophobicContact CB-CB 3.91Å; R263-A275 HydrophobicContact CG-CB 4.33Å
264	K	94.6	Very high	93.1	Very high	156 Å²	156	64.6 Å²	64.6	68%	0.678	35%	0.35	S	S	*	.	H	α-helix	trans	-64	-48.7	-179.9	-173.3	174.9	179.6	177.2	0	112	E260 R261 F266 S267	E260-K264 WeakPolarHBondContact O-CB 3.49Å; E260-K264 PolarHBondContact O-N 2.72Å; R261-K264 PolarHBondContact O-N 3.33Å; K264-F266 VanDerWaalsContact C-N 3.26Å; K264-F266 PolarHBondContact O-N 3Å; K264-S267 PolarHBondContact O-N 2.84Å; K264-S267 PolarHBondContact O-OG 2.9Å
265	E	93.6	Very high	93.3	Very high	54 Å²	54	63.8 Å²	63.8	25%	0.252	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-30.3	179.8	-65.2	-62.8	157.5	0	0	112.9	R261 M305 V310	R261-E265 WeakPolarHBondContact O-CG 3.19Å; R261-E265 PolarHBondContact O-N 3.15Å; E265-M305 HydrophobicContact CB-CE 4.06Å; E265-V310 HydrophobicContact CG-CG1 4.13Å
266	F	95.2	Very high	93.6	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-95.3	-14.9	-179.8	-80.1	-103.2	0	0	0	114.7	L248 V250 L262 R263 K264 F269 I272 V290 F292 A301 M305 L315 V317	L248-F266 HydrophobicContact CD1-CE1 4.44Å; V250-F266 HydrophobicContact CB-CZ 4.44Å; V250-F266 HydrophobicContact CG1-CE2 4.15Å; V250-F266 HydrophobicContact CG1-CZ 3.93Å; V250-F266 HydrophobicContact CG2-CE1 3.97Å; V250-F266 HydrophobicContact CG2-CE2 4.16Å; V250-F266 HydrophobicContact CG2-CZ 3.58Å; L262-F266 HydrophobicContact CD1-CD2 3.75Å; L262-F266 HydrophobicContact CD1-CE2 3.65Å; L262-F266 WeakPolarHBondContact O-CD2 3.33Å; L262-F266 PolarHBondContact O-N 3.07Å; R263-F266 PolarHBondContact O-N 3.36Å; K264-F266 VanDerWaalsContact C-N 3.26Å; K264-F266 PolarHBondContact O-N 3Å; F266-F269 WeakPolarHBondContact O-CD2 3.29Å; F266-F269 PolarHBondContact O-N 2.91Å; F266-I272 HydrophobicContact CB-CD1 3.61Å; F266-V290 HydrophobicContact CB-CG1 4.04Å; F266-V290 HydrophobicContact CD1-CG1 4.33Å; F266-V290 HydrophobicContact CD1-CG2 4.41Å; F266-V290 HydrophobicContact CD2-CG2 4.37Å; F266-V290 HydrophobicContact CG-CG1 4.3Å; F266-V290 HydrophobicContact CG-CG2 4.2Å; F266-F292 HydrophobicContact CB-CZ 4.18Å; F266-F292 HydrophobicContact CD1-CE2 4.36Å; F266-F292 HydrophobicContact CD1-CZ 4.23Å; F266-A301 HydrophobicContact CD1-CB 4.3Å; F266-M305 HydrophobicContact CD1-CG 4.27Å; F266-M305 HydrophobicContact CD2-CE 3.82Å; F266-M305 HydrophobicContact CE1-CB 3.86Å; F266-M305 HydrophobicContact CE1-CE 4.42Å; F266-M305 HydrophobicContact CE1-CG 3.89Å; F266-M305 HydrophobicContact CE2-CE 3.57Å; F266-M305 HydrophobicContact CG-CE 4.35Å; F266-M305 HydrophobicContact CZ-CB 3.88Å; F266-M305 HydrophobicContact CZ-CE 3.89Å; F266-M305 HydrophobicContact CZ-CG 4.11Å; F266-L315 HydrophobicContact CE2-CD1 4.03Å; F266-L315 HydrophobicContact CZ-CD1 4.24Å; F266-V317 HydrophobicContact CE1-CG1 4.09Å; F266-V317 HydrophobicContact CE1-CG2 4.26Å; F266-V317 HydrophobicContact CZ-CG1 4.45Å; F266-V317 HydrophobicContact CZ-CG2 3.86Å
267	S	95.8	Very high	94	Very high	60 Å²	60	63 Å²	63	42%	0.42	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-60	-25.9	-179.9	63.4	0	0	0	0	116.8	R263 K264 F269	R263-S267 WeakPolarHBondContact O-CB 3.19Å; R263-S267 PolarHBondContact O-N 3.2Å; K264-S267 PolarHBondContact O-N 2.84Å; K264-S267 PolarHBondContact O-OG 2.9Å; S267-F269 PolarHBondContact O-N 3.43Å; S267-F269 VanDerWaalsContact O-N 3.16Å
268	P	95.9	Very high	94.1	Very high	93 Å²	93	66 Å²	66	60%	0.604	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-65.7	-13	175.2	-23.8	35.9	0	0	0	115
269	F	93.3	Very high	94	Very high	19 Å²	19	66.8 Å²	66.8	8%	0.083	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-100.4	-9.1	-174.2	-52.3	-76.6	0	0	0	113.9	F266 S267 F292 E297 K300 A301 E304 M305	F266-F269 WeakPolarHBondContact O-CD2 3.29Å; F266-F269 PolarHBondContact O-N 2.91Å; S267-F269 PolarHBondContact O-N 3.43Å; S267-F269 VanDerWaalsContact O-N 3.16Å; F269-F292 HydrophobicContact CB-CE1 4.28Å; F269-F292 HydrophobicContact CB-CZ 4.19Å; F269-E297 WeakPolarHBondContact O-CB 3.43Å; F269-K300 HydrophobicContact CD1-CG 4.42Å; F269-A301 HydrophobicContact CB-CB 3.72Å; F269-A301 HydrophobicContact CD2-CB 4.4Å; F269-A301 HydrophobicContact CG-CB 4.05Å; F269-E304 HydrophobicContact CD1-CB 4.27Å; F269-E304 HydrophobicContact CE1-CB 3.59Å; F269-E304 HydrophobicContact CE1-CG 4.25Å; F269-E304 HydrophobicContact CZ-CB 4.21Å; F269-M305 HydrophobicContact CD2-CG 4.01Å; F269-M305 HydrophobicContact CD2-SD 4.43Å; F269-M305 HydrophobicContact CE2-CE 4.29Å; F269-M305 HydrophobicContact CE2-CG 3.46Å; F269-M305 VanDerWaalsContact CE2-CG 3.46Å; F269-M305 HydrophobicContact CE2-SD 3.38Å; F269-M305 WeakPolarHBondContact CE2-SD 3.35Å; F269-M305 HydrophobicContact CZ-CG 3.78Å; F269-M305 HydrophobicContact CZ-SD 3.6Å; F269-M305 VanDerWaalsContact CZ-SD 3.6Å
270	G	92.9	Very high	93.7	Very high	18 Å²	18	69.9 Å²	69.9	19%	0.186	36%	0.357	C	S	.	.	S	Bend	trans	157.1	178.3	179.5	0	0	0	0	0	114.5	I272 E297	G270-I272 PolarHBondContact O-N 3.3Å; G270-E297 VanDerWaalsContact CA-CD 3.45Å; G270-E297 WeakPolarHBondContact CA-OE1 3.47Å
271	T	94.7	Very high	93.1	Very high	93 Å²	93	66.5 Å²	66.5	57%	0.571	37%	0.366	S	S	*	.			trans	-79.7	103.5	-177.1	-52.7	0	0	0	0	111.3	T273 F292 S293 E297	T271-T273 PolarHBondContact O-N 3.23Å; T271-F292 CarbonylContact O-C 3.52Å; T271-S293 WeakPolarHBondContact CB-OG 3.35Å; T271-S293 PolarHBondContact O-N 2.8Å; T271-S293 PolarHBondContact O-OG 2.95Å; T271-E297 PolarHBondContact N-OE1 2.88Å
272	I	95.5	Very high	92.6	Very high	6 Å²	6	65.4 Å²	65.4	3%	0.031	39%	0.386	C	S	.	.			trans	-73.2	113.5	179.1	-62.5	170.7	0	0	0	110.8	R263 F266 G270 S274 A275 V290 C291 F292	R263-I272 HydrophobicContact CG-CB 4.21Å; R263-I272 HydrophobicContact CG-CD1 3.85Å; R263-I272 HydrophobicContact CG-CG2 4.06Å; R263-I272 PolarHBondContact NH2-O 3.35Å; R263-I272 VanDerWaalsContact O-CD1 3.24Å; R263-I272 WeakPolarHBondContact O-CD1 3.49Å; F266-I272 HydrophobicContact CB-CD1 3.61Å; G270-I272 PolarHBondContact O-N 3.3Å; I272-S274 VanDerWaalsContact CG2-C 3.48Å; I272-S274 WeakPolarHBondContact CG2-O 3.4Å; I272-A275 HydrophobicContact CG2-CB 4.04Å; I272-V290 HydrophobicContact CD1-CG1 3.87Å; I272-V290 HydrophobicContact CG1-CG1 3.9Å; I272-V290 HydrophobicContact CG2-CG1 4.06Å; I272-C291 CarbonylContact C-O 3.56Å; I272-C291 WeakPolarHBondContact CA-O 3.44Å; I272-F292 HydrophobicContact CD1-CE1 4.47Å; I272-F292 HydrophobicContact CG1-CD1 4.12Å; I272-F292 HydrophobicContact CG1-CE1 3.71Å; I272-F292 HydrophobicContact CG1-CZ 4.14Å
273	T	92.6	Very high	92.1	Very high	86 Å²	86	73.9 Å²	73.9	53%	0.528	42%	0.418	S	S	.	.	S	Bend	trans	-79.3	-28.3	174.2	58.8	0	0	0	0	112.3	T271 C291 F292	T271-T273 PolarHBondContact O-N 3.23Å; T273-C291 PolarHBondContact N-O 3.19Å; T273-C291 PolarHBondContact OG1-O 3.25Å; T273-C291 VanDerWaalsContact OG1-O 3.07Å; T273-C291 PolarHBondContact OG1-SG 3.41Å; T273-F292 PolarHBondContact OG1-O 3.28Å; T273-F292 VanDerWaalsContact OG1-O 3.14Å
274	S	91.7	Very high	91.9	Very high	67 Å²	67	68.6 Å²	68.6	47%	0.469	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	136.4	173.7	-176.8	0	0	0	0	111.1	I272 C291	I272-S274 VanDerWaalsContact CG2-C 3.48Å; I272-S274 WeakPolarHBondContact CG2-O 3.4Å; S274-C291 PolarHBondContact N-O 3.41Å; S274-C291 PolarHBondContact O-N 2.85Å
275	A	94.9	Very high	91.7	Very high	15 Å²	15	65.2 Å²	65.2	12%	0.124	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.3	165.8	0	0	0	0	0	108.4	L262 R263 I272 F289 V290	L262-A275 HydrophobicContact CG-CB 4.5Å; R263-A275 HydrophobicContact CB-CB 3.91Å; R263-A275 HydrophobicContact CG-CB 4.33Å; I272-A275 HydrophobicContact CG2-CB 4.04Å; A275-F289 CarbonylContact C-O 3.58Å; A275-F289 WeakPolarHBondContact CA-O 3.28Å; A275-V290 HydrophobicContact CB-CG2 4.32Å
276	K	94.9	Very high	91.5	Very high	118 Å²	118	63.6 Å²	63.6	51%	0.513	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	123.1	179.8	-176.5	160.3	-172	163.5	0	113.4	G288 F289	K276-G288 CarbonylContact O-C 3.55Å; K276-G288 WeakPolarHBondContact O-CA 3.48Å; K276-F289 PolarHBondContact N-O 3.37Å; K276-F289 PolarHBondContact O-N 2.82Å
277	V	94.6	Very high	91.4	Very high	2 Å²	2	65.6 Å²	65.6	1%	0.012	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	138.2	168	-176.8	0	0	0	0	109.3	L253 D259 L262 M279 S284	L253-V277 HydrophobicContact CD1-CG1 4.1Å; L253-V277 HydrophobicContact CD1-CG2 3.91Å; D259-V277 WeakPolarHBondContact OD1-CB 3.48Å; D259-V277 PolarHBondContact OD1-N 2.96Å; L262-V277 HydrophobicContact CB-CG2 4.35Å; L262-V277 HydrophobicContact CD2-CG2 3.89Å; V277-M279 HydrophobicContact CB-CE 4.2Å; V277-M279 HydrophobicContact CG1-CE 3.98Å; V277-M279 HydrophobicContact CG1-SD 4.2Å; V277-M279 PolarHBondContact O-N 2.84Å; V277-S284 WeakPolarHBondContact CG1-OG 3.18Å
278	M	92	Very high	91.4	Very high	68 Å²	68	62.7 Å²	62.7	34%	0.335	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	105.3	177.6	-68.4	-60.5	-61.3	0	0	109.7	K285 F287 F289	M278-K285 HydrophobicContact CB-CD 4.24Å; M278-K285 VanDerWaalsContact O-CB 3.25Å; M278-K285 WeakPolarHBondContact O-CB 3.34Å; M278-K285 VanDerWaalsContact O-CG 3.27Å; M278-K285 WeakPolarHBondContact O-CG 3.19Å; M278-K285 PolarHBondContact O-N 3.48Å; M278-F287 HydrophobicContact CB-CD2 4.12Å; M278-F287 HydrophobicContact CB-CE1 4.44Å; M278-F287 HydrophobicContact CB-CE2 3.75Å; M278-F287 HydrophobicContact CB-CZ 3.92Å; M278-F287 HydrophobicContact CG-CD2 3.97Å; M278-F287 HydrophobicContact CG-CE2 3.5Å; M278-F287 HydrophobicContact CG-CZ 4.09Å; M278-F287 PolarHBondContact N-O 3.14Å; M278-F289 HydrophobicContact CG-CD2 4.2Å; M278-F289 HydrophobicContact CG-CE2 3.92Å; M278-F289 HydrophobicContact SD-CD2 4.47Å; M278-F289 HydrophobicContact SD-CE2 4.31Å
279	M	91	Very high	91.3	Very high	96 Å²	96	61.3 Å²	61.3	47%	0.473	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	150.2	178.1	-59.5	-64.4	-173.7	0	0	112.2	V277 R283 S284	V277-M279 HydrophobicContact CB-CE 4.2Å; V277-M279 HydrophobicContact CG1-CE 3.98Å; V277-M279 HydrophobicContact CG1-SD 4.2Å; V277-M279 PolarHBondContact O-N 2.84Å; M279-R283 CarbonylContact C-O 3.56Å; M279-R283 WeakPolarHBondContact CA-O 3.49Å; M279-S284 VanDerWaalsContact SD-CA 3.51Å; M279-S284 PolarHBondContact SD-N 3.26Å
280	E	89	Confident	91.5	Very high	125 Å²	125	60.4 Å²	60.4	58%	0.584	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	123.2	174.7	-178.1	162.3	-99.6	0	0	109.4	G282 R283 K285	E280-G282 PolarHBondContact O-N 2.67Å; E280-G282 VanDerWaalsContact O-N 3.07Å; E280-R283 PolarHBondContact N-O 2.59Å; E280-R283 PolarHBondContact O-N 2.74Å; E280-K285 HydrophobicContact CB-CD 3.89Å; E280-K285 HydrophobicContact CB-CG 3.58Å; E280-K285 IonicContact OE1-NZ 3.12Å; E280-K285 PolarHBondContact OE1-NZ 2.82Å; E280-K285 IonicContact OE2-NZ 3.35Å; E280-K285 PolarHBondContact OE2-NZ 2.99Å
281	G	81.1	Confident	91.5	Very high	94 Å²	94	59.9 Å²	59.9	97%	0.969	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	20.8	-176.3	0	0	0	0	0	114.9
282	G	81.7	Confident	91.5	Very high	78 Å²	78	55.6 Å²	55.6	80%	0.804	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	2.7	-174.2	0	0	0	0	0	115.4	E280	E280-G282 PolarHBondContact O-N 2.67Å; E280-G282 VanDerWaalsContact O-N 3.07Å
283	R	84.4	Confident	91.4	Very high	180 Å²	180	58.5 Å²	58.5	68%	0.679	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	147.3	172.3	-171.8	178	-66.4	155.5	-0.3	110.7	M279 E280	M279-R283 CarbonylContact C-O 3.56Å; M279-R283 WeakPolarHBondContact CA-O 3.49Å; E280-R283 PolarHBondContact N-O 2.59Å; E280-R283 PolarHBondContact O-N 2.74Å
284	S	89.6	Confident	91.4	Very high	13 Å²	13	55.9 Å²	55.9	9%	0.091	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	135.7	170.4	178.5	0	0	0	0	111	V277 M279 G286	V277-S284 WeakPolarHBondContact CG1-OG 3.18Å; M279-S284 VanDerWaalsContact SD-CA 3.51Å; M279-S284 PolarHBondContact SD-N 3.26Å; S284-G286 PolarHBondContact O-N 2.8Å; S284-G286 PolarHBondContact OG-N 3.05Å; S284-G286 VanDerWaalsContact OG-N 3.09Å
285	K	90.9	Very high	91.5	Very high	85 Å²	85	55.8 Å²	55.8	37%	0.37	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	8.4	169	-62.3	176	74.5	75.6	0	112.4	M278 E280 F287	M278-K285 HydrophobicContact CB-CD 4.24Å; M278-K285 VanDerWaalsContact O-CB 3.25Å; M278-K285 WeakPolarHBondContact O-CB 3.34Å; M278-K285 VanDerWaalsContact O-CG 3.27Å; M278-K285 WeakPolarHBondContact O-CG 3.19Å; M278-K285 PolarHBondContact O-N 3.48Å; E280-K285 HydrophobicContact CB-CD 3.89Å; E280-K285 HydrophobicContact CB-CG 3.58Å; E280-K285 IonicContact OE1-NZ 3.12Å; E280-K285 PolarHBondContact OE1-NZ 2.82Å; E280-K285 IonicContact OE2-NZ 3.35Å; E280-K285 PolarHBondContact OE2-NZ 2.99Å; K285-F287 VanDerWaalsContact C-N 3.27Å; K285-F287 HydrophobicContact CB-CD1 3.77Å; K285-F287 HydrophobicContact CB-CE1 3.61Å; K285-F287 HydrophobicContact CD-CE1 4.06Å; K285-F287 HydrophobicContact CD-CZ 4.34Å; K285-F287 HydrophobicContact CG-CE1 4.47Å; K285-F287 WeakPolarHBondContact O-CD1 3.45Å; K285-F287 PolarHBondContact O-N 2.84Å
286	G	89.4	Confident	91.4	Very high	19 Å²	19	62.5 Å²	62.5	20%	0.196	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	72.5	16.3	-176.8	0	0	0	0	0	114	K251 N252 L253 S284	K251-G286 CarbonylContact C-O 3.52Å; N252-G286 PolarHBondContact N-O 3.25Å; L253-G286 PolarHBondContact N-O 3.14Å; S284-G286 PolarHBondContact O-N 2.8Å; S284-G286 PolarHBondContact OG-N 3.05Å; S284-G286 VanDerWaalsContact OG-N 3.09Å
287	F	94	Very high	91.4	Very high	42 Å²	42	58.7 Å²	58.7	18%	0.184	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159.8	176.6	76.6	-93.2	0	0	0	113.1	Y249 V250 K251 M278 K285 F289	Y249-F287 HydrophobicContact CD2-CD2 4.21Å; Y249-F287 HydrophobicContact CE2-CB 4.05Å; Y249-F287 AromaticContact CE2-CD2 3.45Å; Y249-F287 HydrophobicContact CE2-CD2 3.45Å; Y249-F287 VanDerWaalsContact CE2-CD2 3.45Å; Y249-F287 HydrophobicContact CE2-CE2 4.03Å; Y249-F287 AromaticContact CE2-CG 3.9Å; Y249-F287 HydrophobicContact CE2-CG 3.9Å; V250-F287 CarbonylContact O-C 3.59Å; V250-F287 WeakPolarHBondContact O-CA 3.36Å; V250-F287 VanDerWaalsContact O-CB 3.31Å; V250-F287 WeakPolarHBondContact O-CB 3.37Å; K251-F287 HydrophobicContact CB-CB 4.21Å; K251-F287 HydrophobicContact CG-CB 3.94Å; M278-F287 HydrophobicContact CB-CD2 4.12Å; M278-F287 HydrophobicContact CB-CE1 4.44Å; M278-F287 HydrophobicContact CB-CE2 3.75Å; M278-F287 HydrophobicContact CB-CZ 3.92Å; M278-F287 HydrophobicContact CG-CD2 3.97Å; M278-F287 HydrophobicContact CG-CE2 3.5Å; M278-F287 HydrophobicContact CG-CZ 4.09Å; M278-F287 PolarHBondContact N-O 3.14Å; K285-F287 VanDerWaalsContact C-N 3.27Å; K285-F287 HydrophobicContact CB-CD1 3.77Å; K285-F287 HydrophobicContact CB-CE1 3.61Å; K285-F287 HydrophobicContact CD-CE1 4.06Å; K285-F287 HydrophobicContact CD-CZ 4.34Å; K285-F287 HydrophobicContact CG-CE1 4.47Å; K285-F287 WeakPolarHBondContact O-CD1 3.45Å; K285-F287 PolarHBondContact O-N 2.84Å; F287-F289 HydrophobicContact CD2-CE2 4.41Å; F287-F289 HydrophobicContact CE2-CE2 4.07Å; F287-F289 HydrophobicContact CE2-CZ 4.35Å
288	G	94.5	Very high	91.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	-173.9	177.8	0	0	0	0	0	112	V250 K276	V250-G288 PolarHBondContact N-O 3.07Å; V250-G288 PolarHBondContact O-N 3.1Å; K276-G288 CarbonylContact O-C 3.55Å; K276-G288 WeakPolarHBondContact O-CA 3.48Å
289	F	95.6	Very high	91.4	Very high	64 Å²	64	58.9 Å²	58.9	28%	0.281	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	144.9	177.3	-61.1	-85.7	0	0	0	110.7	L248 Y249 A275 K276 M278 F287 A320	L248-F289 WeakPolarHBondContact O-CA 3.42Å; Y249-F289 HydrophobicContact CD2-CD1 4.33Å; Y249-F289 AromaticContact CD2-CE1 3.72Å; Y249-F289 HydrophobicContact CD2-CE1 3.72Å; Y249-F289 HydrophobicContact CD2-CZ 4.01Å; Y249-F289 HydrophobicContact CG-CE1 4.49Å; A275-F289 CarbonylContact C-O 3.58Å; A275-F289 WeakPolarHBondContact CA-O 3.28Å; K276-F289 PolarHBondContact N-O 3.37Å; K276-F289 PolarHBondContact O-N 2.82Å; M278-F289 HydrophobicContact CG-CD2 4.2Å; M278-F289 HydrophobicContact CG-CE2 3.92Å; M278-F289 HydrophobicContact SD-CD2 4.47Å; M278-F289 HydrophobicContact SD-CE2 4.31Å; F287-F289 HydrophobicContact CD2-CE2 4.41Å; F287-F289 HydrophobicContact CE2-CE2 4.07Å; F287-F289 HydrophobicContact CE2-CZ 4.35Å; F289-A320 HydrophobicContact CD1-CB 3.96Å; F289-A320 HydrophobicContact CE1-CB 4.07Å
290	V	95.8	Very high	91.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	117.5	174.5	-177.8	0	0	0	0	108.4	L248 V250 L262 F266 I272 A275 F292	L248-V290 WeakPolarHBondContact CB-O 3.4Å; L248-V290 PolarHBondContact N-O 3.46Å; L248-V290 PolarHBondContact O-N 3.07Å; V250-V290 HydrophobicContact CG2-CG2 3.99Å; L262-V290 HydrophobicContact CD1-CG2 3.92Å; L262-V290 HydrophobicContact CD2-CG2 3.86Å; L262-V290 HydrophobicContact CG-CG2 3.72Å; F266-V290 HydrophobicContact CB-CG1 4.04Å; F266-V290 HydrophobicContact CD1-CG1 4.33Å; F266-V290 HydrophobicContact CD1-CG2 4.41Å; F266-V290 HydrophobicContact CD2-CG2 4.37Å; F266-V290 HydrophobicContact CG-CG1 4.3Å; F266-V290 HydrophobicContact CG-CG2 4.2Å; I272-V290 HydrophobicContact CD1-CG1 3.87Å; I272-V290 HydrophobicContact CG1-CG1 3.9Å; I272-V290 HydrophobicContact CG2-CG1 4.06Å; A275-V290 HydrophobicContact CB-CG2 4.32Å; V290-F292 HydrophobicContact CG1-CD2 4.36Å; V290-F292 HydrophobicContact CG1-CE2 3.82Å; V290-F292 HydrophobicContact CG1-CZ 4.12Å
291	C	93.8	Very high	91.8	Very high	6 Å²	6	53.3 Å²	53.3	4%	0.041	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.8	177.7	-166.7	0	0	0	0	109.9	Y243 V246 N247 I272 T273 S274	Y243-C291 VanDerWaalsContact CD1-SG 3.55Å; V246-C291 WeakPolarHBondContact O-CA 3.49Å; N247-C291 HydrophobicContact CB-CB 4.44Å; I272-C291 CarbonylContact C-O 3.56Å; I272-C291 WeakPolarHBondContact CA-O 3.44Å; T273-C291 PolarHBondContact N-O 3.19Å; T273-C291 PolarHBondContact OG1-O 3.25Å; T273-C291 VanDerWaalsContact OG1-O 3.07Å; T273-C291 PolarHBondContact OG1-SG 3.41Å; S274-C291 PolarHBondContact N-O 3.41Å; S274-C291 PolarHBondContact O-N 2.85Å
292	F	95.4	Very high	92.5	Very high	3 Å²	3	50.5 Å²	50.5	1%	0.013	28%	0.276	C	S	.	.			trans	-86	-177.4	173.5	-75.2	-81.5	0	0	0	111.4	V246 L248 F266 F269 T271 I272 T273 V290 E297 A298 A301	V246-F292 PolarHBondContact O-N 3.41Å; L248-F292 HydrophobicContact CD1-CD2 4.22Å; L248-F292 HydrophobicContact CD1-CE2 3.77Å; L248-F292 HydrophobicContact CG-CD2 4.4Å; L248-F292 HydrophobicContact CG-CE2 4.37Å; F266-F292 HydrophobicContact CB-CZ 4.18Å; F266-F292 HydrophobicContact CD1-CE2 4.36Å; F266-F292 HydrophobicContact CD1-CZ 4.23Å; F269-F292 HydrophobicContact CB-CE1 4.28Å; F269-F292 HydrophobicContact CB-CZ 4.19Å; T271-F292 CarbonylContact O-C 3.52Å; I272-F292 HydrophobicContact CD1-CE1 4.47Å; I272-F292 HydrophobicContact CG1-CD1 4.12Å; I272-F292 HydrophobicContact CG1-CE1 3.71Å; I272-F292 HydrophobicContact CG1-CZ 4.14Å; T273-F292 PolarHBondContact OG1-O 3.28Å; T273-F292 VanDerWaalsContact OG1-O 3.14Å; V290-F292 HydrophobicContact CG1-CD2 4.36Å; V290-F292 HydrophobicContact CG1-CE2 3.82Å; V290-F292 HydrophobicContact CG1-CZ 4.12Å; F292-E297 HydrophobicContact CB-CB 3.93Å; F292-E297 HydrophobicContact CD1-CB 3.81Å; F292-E297 HydrophobicContact CG-CB 3.94Å; F292-A298 HydrophobicContact CB-CB 4.28Å; F292-A298 HydrophobicContact CD2-CB 3.93Å; F292-A298 HydrophobicContact CG-CB 4.41Å; F292-A301 HydrophobicContact CE2-CB 3.61Å; F292-A301 HydrophobicContact CZ-CB 3.71Å
293	S	92.7	Very high	93.1	Very high	67 Å²	67	52 Å²	52	47%	0.469	27%	0.27	S	S	.	.	S	Bend	trans	-88.6	-34	169.8	42.3	0	0	0	0	112.5	T271 E297	T271-S293 WeakPolarHBondContact CB-OG 3.35Å; T271-S293 PolarHBondContact O-N 2.8Å; T271-S293 PolarHBondContact O-OG 2.95Å; S293-E297 PolarHBondContact N-OE2 3.25Å; S293-E297 PolarHBondContact OG-OE1 3.35Å; S293-E297 PolarHBondContact OG-OE2 2.64Å
294	S	92.6	Very high	93.5	Very high	32 Å²	32	48.3 Å²	48.3	22%	0.224	26%	0.26	C	S	.	.	S	Bend	trans	-122.2	155.1	178.2	97.1	0	0	0	0	112.6	E296 E297 A298	S294-E296 PolarHBondContact O-N 2.86Å; S294-E296 PolarHBondContact OG-N 2.78Å; S294-E297 PolarHBondContact N-OE2 3.29Å; S294-E297 WeakPolarHBondContact OG-CG 3.49Å; S294-E297 PolarHBondContact OG-N 3.07Å; S294-E297 VanDerWaalsContact OG-N 3.14Å; S294-A298 PolarHBondContact O-N 2.91Å
295	P	92.9	Very high	93.7	Very high	64 Å²	64	47.7 Å²	47.7	42%	0.416	26%	0.256	S	S	.	.	H	α-helix	trans	-74	-18.5	176.7	30.5	-34.8	0	0	0	112	V246 T299	V246-P295 HydrophobicContact CG1-CB 4.3Å; P295-T299 WeakPolarHBondContact O-CB 3.42Å; P295-T299 PolarHBondContact O-N 2.91Å; P295-T299 PolarHBondContact O-OG1 2.82Å
296	E	93.1	Very high	93.9	Very high	157 Å²	157	47.3 Å²	47.3	73%	0.734	26%	0.258	S	S	*	.	H	α-helix	trans	-73	-46.6	176.6	-62.2	171.2	-172	0	0	110.5	S294 A298 T299 K300	S294-E296 PolarHBondContact O-N 2.86Å; S294-E296 PolarHBondContact OG-N 2.78Å; E296-A298 VanDerWaalsContact C-N 3.31Å; E296-A298 PolarHBondContact O-N 3.4Å; E296-T299 PolarHBondContact O-N 3.22Å; E296-K300 WeakPolarHBondContact O-CB 3.33Å; E296-K300 PolarHBondContact O-N 2.67Å
297	E	95.1	Very high	94	Very high	37 Å²	37	48.6 Å²	48.6	17%	0.173	27%	0.271	C	S	.	.	H	α-helix	trans	-54.4	-47.8	169.9	-68.9	174.1	139.6	0	0	110.9	F269 G270 T271 F292 S293 S294 T299 K300 A301	F269-E297 WeakPolarHBondContact O-CB 3.43Å; G270-E297 VanDerWaalsContact CA-CD 3.45Å; G270-E297 WeakPolarHBondContact CA-OE1 3.47Å; T271-E297 PolarHBondContact N-OE1 2.88Å; F292-E297 HydrophobicContact CB-CB 3.93Å; F292-E297 HydrophobicContact CD1-CB 3.81Å; F292-E297 HydrophobicContact CG-CB 3.94Å; S293-E297 PolarHBondContact N-OE2 3.25Å; S293-E297 PolarHBondContact OG-OE1 3.35Å; S293-E297 PolarHBondContact OG-OE2 2.64Å; S294-E297 PolarHBondContact N-OE2 3.29Å; S294-E297 WeakPolarHBondContact OG-CG 3.49Å; S294-E297 PolarHBondContact OG-N 3.07Å; S294-E297 VanDerWaalsContact OG-N 3.14Å; E297-T299 PolarHBondContact O-N 2.92Å; E297-K300 PolarHBondContact O-N 2.81Å; E297-A301 WeakPolarHBondContact O-CB 3.42Å; E297-A301 PolarHBondContact O-N 3.14Å
298	A	93.2	Very high	93.9	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-41.2	178.7	0	0	0	0	0	112.5	G245 L248 F292 S294 E296 A301 V302	G245-A298 WeakPolarHBondContact O-CB 3.45Å; L248-A298 HydrophobicContact CD2-CB 3.91Å; L248-A298 HydrophobicContact CG-CB 4.3Å; F292-A298 HydrophobicContact CB-CB 4.28Å; F292-A298 HydrophobicContact CD2-CB 3.93Å; F292-A298 HydrophobicContact CG-CB 4.41Å; S294-A298 PolarHBondContact O-N 2.91Å; E296-A298 VanDerWaalsContact C-N 3.31Å; E296-A298 PolarHBondContact O-N 3.4Å; A298-A301 PolarHBondContact O-N 3.41Å; A298-V302 WeakPolarHBondContact O-CG2 3.19Å; A298-V302 PolarHBondContact O-N 2.92Å
299	T	93.1	Very high	93.7	Very high	75 Å²	75	57.7 Å²	57.7	46%	0.46	31%	0.312	S	S	.	.	H	α-helix	trans	-69.6	-38.8	178.6	-58.1	0	0	0	0	111.8	P295 E296 E297 V302 T303	P295-T299 WeakPolarHBondContact O-CB 3.42Å; P295-T299 PolarHBondContact O-N 2.91Å; P295-T299 PolarHBondContact O-OG1 2.82Å; E296-T299 PolarHBondContact O-N 3.22Å; E297-T299 PolarHBondContact O-N 2.92Å; T299-V302 PolarHBondContact O-N 2.74Å; T299-T303 PolarHBondContact O-N 3.4Å; T299-T303 VanDerWaalsContact O-N 3.08Å; T299-T303 PolarHBondContact O-OG1 2.83Å
300	K	94.9	Very high	93.3	Very high	104 Å²	104	55.2 Å²	55.2	45%	0.452	30%	0.302	S	S	.	.	H	α-helix	trans	-60.3	-48.7	171.1	-174.8	-176.6	176.5	-174.5	0	111.2	F269 E296 E297 V302 T303 E304	F269-K300 HydrophobicContact CD1-CG 4.42Å; E296-K300 WeakPolarHBondContact O-CB 3.33Å; E296-K300 PolarHBondContact O-N 2.67Å; E297-K300 PolarHBondContact O-N 2.81Å; K300-V302 PolarHBondContact O-N 3.1Å; K300-T303 WeakPolarHBondContact O-CB 3.46Å; K300-T303 PolarHBondContact O-N 2.92Å; K300-E304 WeakPolarHBondContact CE-OE1 3.2Å; K300-E304 VanDerWaalsContact CG-OE1 3.25Å; K300-E304 WeakPolarHBondContact CG-OE1 3.5Å; K300-E304 IonicContact NZ-OE1 2.67Å; K300-E304 PolarHBondContact O-N 3.03Å
301	A	94.9	Very high	92.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.7	-39.6	177.1	0	0	0	0	0	112.9	L248 F266 F269 F292 E297 A298 T303 M305	L248-A301 HydrophobicContact CD1-CB 3.79Å; F266-A301 HydrophobicContact CD1-CB 4.3Å; F269-A301 HydrophobicContact CB-CB 3.72Å; F269-A301 HydrophobicContact CD2-CB 4.4Å; F269-A301 HydrophobicContact CG-CB 4.05Å; F292-A301 HydrophobicContact CE2-CB 3.61Å; F292-A301 HydrophobicContact CZ-CB 3.71Å; E297-A301 WeakPolarHBondContact O-CB 3.42Å; E297-A301 PolarHBondContact O-N 3.14Å; A298-A301 PolarHBondContact O-N 3.41Å; A301-T303 VanDerWaalsContact C-N 3.28Å; A301-T303 PolarHBondContact O-N 3.41Å; A301-M305 WeakPolarHBondContact O-CB 3.4Å; A301-M305 PolarHBondContact O-N 3.42Å
302	V	95.3	Very high	92.6	Very high	35 Å²	35	62.3 Å²	62.3	21%	0.212	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-41.8	171	168.5	0	0	0	0	111.2	L248 A298 T299 K300 N306 V317	L248-V302 HydrophobicContact CD1-CG2 3.98Å; L248-V302 HydrophobicContact CD2-CG2 3.44Å; L248-V302 VanDerWaalsContact CD2-CG2 3.44Å; L248-V302 HydrophobicContact CG-CG2 4.33Å; A298-V302 WeakPolarHBondContact O-CG2 3.19Å; A298-V302 PolarHBondContact O-N 2.92Å; T299-V302 PolarHBondContact O-N 2.74Å; K300-V302 PolarHBondContact O-N 3.1Å; V302-N306 WeakPolarHBondContact O-CB 3.49Å; V302-N306 PolarHBondContact O-N 2.81Å; V302-V317 HydrophobicContact CG2-CG1 4.07Å
303	T	93.5	Very high	92.4	Very high	109 Å²	109	65.1 Å²	65.1	67%	0.669	36%	0.363	S	S	*	.	H	α-helix	trans	-71.9	-39.3	-174.2	-53.4	0	0	0	0	112.2	T299 K300 A301	T299-T303 PolarHBondContact O-N 3.4Å; T299-T303 VanDerWaalsContact O-N 3.08Å; T299-T303 PolarHBondContact O-OG1 2.83Å; K300-T303 WeakPolarHBondContact O-CB 3.46Å; K300-T303 PolarHBondContact O-N 2.92Å; A301-T303 VanDerWaalsContact C-N 3.28Å; A301-T303 PolarHBondContact O-N 3.41Å
304	E	93.7	Very high	92.5	Very high	103 Å²	103	65.2 Å²	65.2	48%	0.481	36%	0.362	S	S	.	.	H	α-helix	trans	-94.9	-24.1	-175.5	-68.1	-177	-117.5	0	0	114.6	F269 K300	F269-E304 HydrophobicContact CD1-CB 4.27Å; F269-E304 HydrophobicContact CE1-CB 3.59Å; F269-E304 HydrophobicContact CE1-CG 4.25Å; F269-E304 HydrophobicContact CZ-CB 4.21Å; K300-E304 WeakPolarHBondContact CE-OE1 3.2Å; K300-E304 VanDerWaalsContact CG-OE1 3.25Å; K300-E304 WeakPolarHBondContact CG-OE1 3.5Å; K300-E304 IonicContact NZ-OE1 2.67Å; K300-E304 PolarHBondContact O-N 3.03Å
305	M	93.9	Very high	92.6	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-99.5	-18.3	-178.6	-62.9	-68.7	-81.1	0	0	114.2	E265 F266 F269 A301 G307 R308 L315 V317	E265-M305 HydrophobicContact CB-CE 4.06Å; F266-M305 HydrophobicContact CD1-CG 4.27Å; F266-M305 HydrophobicContact CD2-CE 3.82Å; F266-M305 HydrophobicContact CE1-CB 3.86Å; F266-M305 HydrophobicContact CE1-CE 4.42Å; F266-M305 HydrophobicContact CE1-CG 3.89Å; F266-M305 HydrophobicContact CE2-CE 3.57Å; F266-M305 HydrophobicContact CG-CE 4.35Å; F266-M305 HydrophobicContact CZ-CB 3.88Å; F266-M305 HydrophobicContact CZ-CE 3.89Å; F266-M305 HydrophobicContact CZ-CG 4.11Å; F269-M305 HydrophobicContact CD2-CG 4.01Å; F269-M305 HydrophobicContact CD2-SD 4.43Å; F269-M305 HydrophobicContact CE2-CE 4.29Å; F269-M305 HydrophobicContact CE2-CG 3.46Å; F269-M305 VanDerWaalsContact CE2-CG 3.46Å; F269-M305 HydrophobicContact CE2-SD 3.38Å; F269-M305 WeakPolarHBondContact CE2-SD 3.35Å; F269-M305 HydrophobicContact CZ-CG 3.78Å; F269-M305 HydrophobicContact CZ-SD 3.6Å; F269-M305 VanDerWaalsContact CZ-SD 3.6Å; A301-M305 WeakPolarHBondContact O-CB 3.4Å; A301-M305 PolarHBondContact O-N 3.42Å; M305-G307 PolarHBondContact O-N 2.89Å; M305-R308 WeakPolarHBondContact O-CB 3.42Å; M305-R308 PolarHBondContact O-N 2.95Å; M305-R308 WeakPolarHBondContact SD-CD 3.45Å; M305-R308 PolarHBondContact SD-NH1 2.99Å; M305-L315 HydrophobicContact CE-CD1 4.23Å; M305-V317 HydrophobicContact CB-CG2 3.88Å
306	N	94.6	Very high	92.7	Very high	76 Å²	76	66.1 Å²	66.1	41%	0.406	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	124.3	176.8	-171.1	36	0	0	0	110.8	V302 R308 Y316 V317	V302-N306 WeakPolarHBondContact O-CB 3.49Å; V302-N306 PolarHBondContact O-N 2.81Å; N306-R308 VanDerWaalsContact C-N 3.27Å; N306-R308 PolarHBondContact O-N 3.25Å; N306-Y316 WeakPolarHBondContact OD1-CA 3.33Å; N306-V317 HydrophobicContact CB-CB 4.03Å; N306-V317 PolarHBondContact OD1-N 2.96Å
307	G	91	Very high	92.8	Very high	47 Å²	47	58.7 Å²	58.7	49%	0.485	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	-10.7	-172.6	0	0	0	0	0	114.9	M305 I309 L315	M305-G307 PolarHBondContact O-N 2.89Å; G307-I309 PolarHBondContact O-N 3.43Å; G307-L315 VanDerWaalsContact CA-O 3.31Å; G307-L315 WeakPolarHBondContact CA-O 3.49Å; G307-L315 PolarHBondContact N-O 3.41Å
308	R	92.6	Very high	92.7	Very high	114 Å²	114	58 Å²	58	43%	0.43	32%	0.319	S	S	.	.			trans	-67.1	130	-179.7	-169.5	-178.9	179.5	-164.7	-4.4	110.5	M305 N306 V310 L315	M305-R308 WeakPolarHBondContact O-CB 3.42Å; M305-R308 PolarHBondContact O-N 2.95Å; M305-R308 WeakPolarHBondContact SD-CD 3.45Å; M305-R308 PolarHBondContact SD-NH1 2.99Å; N306-R308 VanDerWaalsContact C-N 3.27Å; N306-R308 PolarHBondContact O-N 3.25Å; R308-V310 PolarHBondContact O-N 3.09Å; R308-L315 PolarHBondContact O-N 2.83Å
309	I	91	Very high	92.7	Very high	119 Å²	119	62.5 Å²	62.5	61%	0.61	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.9	175.3	-58.3	174.6	0	0	0	109.1	G307 K313 P314	G307-I309 PolarHBondContact O-N 3.43Å; I309-K313 WeakPolarHBondContact CA-O 3.47Å; I309-P314 HydrophobicContact CG1-CB 4.15Å
310	V	87.1	Confident	92.5	Very high	11 Å²	11	60 Å²	60	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.4	173.9	176.7	0	0	0	0	108.1	I257 E265 R308 T312 K313 L315	I257-V310 HydrophobicContact CD1-CG1 4.19Å; E265-V310 HydrophobicContact CG-CG1 4.13Å; R308-V310 PolarHBondContact O-N 3.09Å; V310-T312 PolarHBondContact O-N 3.42Å; V310-K313 PolarHBondContact N-O 3.2Å; V310-K313 PolarHBondContact O-N 2.88Å; V310-L315 HydrophobicContact CB-CD1 4.09Å; V310-L315 HydrophobicContact CB-CD2 4.31Å; V310-L315 HydrophobicContact CB-CG 4.07Å; V310-L315 HydrophobicContact CG2-CD1 3.62Å; V310-L315 HydrophobicContact CG2-CG 3.94Å
311	A	86.4	Confident	92	Very high	56 Å²	56	60.6 Å²	60.6	46%	0.463	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	-93.3	-162.6	0	0	0	0	0	112.4	D254 I257	D254-A311 HydrophobicContact CB-CB 4.21Å; I257-A311 HydrophobicContact CD1-CB 4.5Å
312	T	88.3	Confident	91.3	Very high	99 Å²	99	64.2 Å²	64.2	61%	0.607	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	-11.5	-171.9	55.8	0	0	0	0	113.9	D254 V310	D254-T312 PolarHBondContact OD2-OG1 3.35Å; D254-T312 VanDerWaalsContact OD2-OG1 3.09Å; V310-T312 PolarHBondContact O-N 3.42Å
313	K	91.1	Very high	90.6	Very high	63 Å²	63	71 Å²	71	27%	0.274	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.4	-167.6	-72	155.7	178.8	158.7	0	111.1	N252 D254 D255 I309 V310 L315	N252-K313 VanDerWaalsContact O-CB 3.3Å; N252-K313 WeakPolarHBondContact O-CB 3.19Å; D254-K313 HydrophobicContact CB-CD 4.01Å; D254-K313 VanDerWaalsContact OD2-CE 3.31Å; D254-K313 WeakPolarHBondContact OD2-CE 3.35Å; D254-K313 IonicContact OD2-NZ 3.78Å; D254-K313 PolarHBondContact OD2-NZ 3.16Å; D255-K313 IonicContact OD1-NZ 2.75Å; D255-K313 PolarHBondContact OD1-NZ 2.87Å; I309-K313 WeakPolarHBondContact CA-O 3.47Å; V310-K313 PolarHBondContact N-O 3.2Å; V310-K313 PolarHBondContact O-N 2.88Å; K313-L315 PolarHBondContact O-N 2.74Å
314	P	93.7	Very high	90	Very high	68 Å²	68	71.8 Å²	71.8	44%	0.442	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	120.7	168.9	29.4	-32	0	0	0	110	N252 I309	N252-P314 VanDerWaalsContact CB-O 3.24Å; N252-P314 WeakPolarHBondContact CB-O 3.41Å; N252-P314 PolarHBondContact ND2-O 3.25Å; N252-P314 VanDerWaalsContact ND2-O 3.13Å; I309-P314 HydrophobicContact CG1-CB 4.15Å
315	L	95.3	Very high	89.4	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.026	37%	0.368	C	S	.	.			trans	-65.8	148.1	176.7	-61.9	-170.6	0	0	0	111.1	V250 L253 F266 M305 G307 R308 V310 K313 V317	V250-L315 HydrophobicContact CG1-CD1 4.2Å; V250-L315 HydrophobicContact CG1-CD2 4.47Å; L253-L315 HydrophobicContact CD2-CD2 3.88Å; F266-L315 HydrophobicContact CE2-CD1 4.03Å; F266-L315 HydrophobicContact CZ-CD1 4.24Å; M305-L315 HydrophobicContact CE-CD1 4.23Å; G307-L315 VanDerWaalsContact CA-O 3.31Å; G307-L315 WeakPolarHBondContact CA-O 3.49Å; G307-L315 PolarHBondContact N-O 3.41Å; R308-L315 PolarHBondContact O-N 2.83Å; V310-L315 HydrophobicContact CB-CD1 4.09Å; V310-L315 HydrophobicContact CB-CD2 4.31Å; V310-L315 HydrophobicContact CB-CG 4.07Å; V310-L315 HydrophobicContact CG2-CD1 3.62Å; V310-L315 HydrophobicContact CG2-CG 3.94Å; K313-L315 PolarHBondContact O-N 2.74Å; L315-V317 HydrophobicContact CB-CG2 4.23Å
316	Y	95	Very high	88.6	Confident	111 Å²	111	78.8 Å²	78.8	44%	0.435	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.3	164.4	171.2	-90.7	0	0	0	108.3	Y249 V250 K251 N306 A318	Y249-Y316 HydrophobicContact CD1-CD1 4.34Å; Y249-Y316 HydrophobicContact CD1-CE1 4.18Å; Y249-Y316 HydrophobicContact CE1-CD1 4.34Å; Y249-Y316 HydrophobicContact CE1-CE1 4.33Å; V250-Y316 CarbonylContact C-O 3.6Å; V250-Y316 WeakPolarHBondContact CA-O 3.27Å; K251-Y316 HydrophobicContact CB-CD1 4.07Å; K251-Y316 PolarHBondContact N-O 3.19Å; K251-Y316 PolarHBondContact O-N 3.33Å; N306-Y316 WeakPolarHBondContact OD1-CA 3.33Å; Y316-A318 HydrophobicContact CE1-CB 3.9Å
317	V	95.5	Very high	87.9	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.006	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.5	-175.1	-172.1	0	0	0	0	109.5	L248 Y249 V250 F266 V302 M305 N306 L315	L248-V317 HydrophobicContact CB-CG1 4.42Å; L248-V317 HydrophobicContact CD1-CG1 3.82Å; Y249-V317 WeakPolarHBondContact O-CA 3.43Å; V250-V317 HydrophobicContact CG1-CG2 4.28Å; V250-V317 HydrophobicContact CG2-CG1 4.4Å; V250-V317 HydrophobicContact CG2-CG2 4.46Å; F266-V317 HydrophobicContact CE1-CG1 4.09Å; F266-V317 HydrophobicContact CE1-CG2 4.26Å; F266-V317 HydrophobicContact CZ-CG1 4.45Å; F266-V317 HydrophobicContact CZ-CG2 3.86Å; V302-V317 HydrophobicContact CG2-CG1 4.07Å; M305-V317 HydrophobicContact CB-CG2 3.88Å; N306-V317 HydrophobicContact CB-CB 4.03Å; N306-V317 PolarHBondContact OD1-N 2.96Å; L315-V317 HydrophobicContact CB-CG2 4.23Å
318	A	93.8	Very high	87.4	Confident	22 Å²	22	81 Å²	81	18%	0.182	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	167	179.1	0	0	0	0	0	111.2	L248 Y249 Y316	L248-A318 CarbonylContact C-O 3.55Å; L248-A318 WeakPolarHBondContact CA-O 3.2Å; Y249-A318 PolarHBondContact N-O 2.86Å; Y249-A318 PolarHBondContact O-N 2.89Å; Y249-A318 VanDerWaalsContact O-N 3.11Å; Y316-A318 HydrophobicContact CE1-CB 3.9Å
319	L	92.1	Very high	86.7	Confident	95 Å²	95	81.1 Å²	81.1	50%	0.497	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	135.8	170.9	-62.7	178.2	0	0	0	110.9	G245 L248 Q321	G245-L319 WeakPolarHBondContact O-CD2 3.45Å; L248-L319 HydrophobicContact CD2-CD2 3.77Å; L319-Q321 PolarHBondContact O-N 2.85Å; L319-Q321 VanDerWaalsContact O-N 3.13Å
320	A	88.2	Confident	86.1	Confident	23 Å²	23	81 Å²	81	19%	0.19	41%	0.406	C	S	.	.			trans	-81.1	92.7	-174.1	0	0	0	0	0	113	N247 F289	N247-A320 HydrophobicContact CB-CB 4.29Å; N247-A320 VanDerWaalsContact ND2-CB 3.29Å; N247-A320 WeakPolarHBondContact ND2-CB 3.27Å; N247-A320 VanDerWaalsContact O-CB 3.24Å; N247-A320 WeakPolarHBondContact O-CB 3.47Å; N247-A320 PolarHBondContact O-N 2.95Å; F289-A320 HydrophobicContact CD1-CB 3.96Å; F289-A320 HydrophobicContact CE1-CB 4.07Å
321	Q	84.8	Confident	85.9	Confident	116 Å²	116	83.7 Å²	83.7	54%	0.542	42%	0.422	S	S	.	.			trans	-60.2	139.9	168.2	-66.5	178	-13.2	0	0	111.7	L319 R326	L319-Q321 PolarHBondContact O-N 2.85Å; L319-Q321 VanDerWaalsContact O-N 3.13Å; Q321-R326 HydrophobicContact CB-CB 4.47Å
322	R	80.6	Confident	85.7	Confident	76 Å²	76	85.2 Å²	85.2	29%	0.287	42%	0.423	S	S	.	.			trans	-77.1	154.6	176.1	-65.5	-170.9	177.9	-162.2	-1.8	111.6	R239 I240 E324 E325 R326	R239-R322 PolarHBondContact O-NH2 3.38Å; I240-R322 VanDerWaalsContact CG1-NH1 3.28Å; R322-E324 VanDerWaalsContact C-N 3.34Å; R322-E324 PolarHBondContact O-N 3.31Å; R322-E325 HydrophobicContact CB-CB 4.1Å; R322-E325 PolarHBondContact N-OE2 3.01Å; R322-E325 PolarHBondContact O-N 2.91Å; R322-R326 VanDerWaalsContact O-CB 3.28Å; R322-R326 WeakPolarHBondContact O-CB 3.18Å; R322-R326 PolarHBondContact O-N 3.47Å
323	K	80.4	Confident	85.3	Confident	176 Å²	176	85.2 Å²	85.2	77%	0.765	42%	0.416	S	S	*	.	H	α-helix	trans	-56.7	-47.1	176.4	-172.3	-173.3	174.8	-169.8	0	111.5	Q327	K323-Q327 WeakPolarHBondContact O-CB 3.09Å; K323-Q327 PolarHBondContact O-N 2.85Å
324	E	81.3	Confident	84.6	Confident	126 Å²	126	89.6 Å²	89.6	59%	0.589	43%	0.432	S	S	*	.	H	α-helix	trans	-56.5	-53.1	176.3	-69.9	164.5	-130.6	0	0	111.6	K236 R322 Q327 A328	K236-E324 IonicContact NZ-OE1 2.74Å; K236-E324 IonicContact NZ-OE2 3.34Å; K236-E324 PolarHBondContact NZ-OE2 3.14Å; R322-E324 VanDerWaalsContact C-N 3.34Å; R322-E324 PolarHBondContact O-N 3.31Å; E324-Q327 PolarHBondContact O-N 3.06Å; E324-A328 PolarHBondContact O-N 2.81Å
325	E	80.3	Confident	83.8	Confident	92 Å²	92	91.3 Å²	91.3	43%	0.43	44%	0.435	S	S	.	.	H	α-helix	trans	-62.1	-45.3	-179.6	175.3	-173.5	-153.2	0	0	112.9	R322 Q327 A328 H329	R322-E325 HydrophobicContact CB-CB 4.1Å; R322-E325 PolarHBondContact N-OE2 3.01Å; R322-E325 PolarHBondContact O-N 2.91Å; E325-Q327 VanDerWaalsContact C-N 3.34Å; E325-A328 PolarHBondContact O-N 3.48Å; E325-H329 PolarHBondContact O-N 2.92Å; E325-H329 PolarHBondContact O-ND1 3.24Å
326	R	77.6	Confident	82.9	Confident	158 Å²	158	97.7 Å²	97.7	60%	0.596	47%	0.465	S	S	*	.	H	α-helix	trans	-66	-37	176.7	180	174	173.9	160	1.6	111.7	Q321 R322 L330	Q321-R326 HydrophobicContact CB-CB 4.47Å; R322-R326 VanDerWaalsContact O-CB 3.28Å; R322-R326 WeakPolarHBondContact O-CB 3.18Å; R322-R326 PolarHBondContact O-N 3.47Å; R326-L330 WeakPolarHBondContact O-CB 3.4Å; R326-L330 PolarHBondContact O-N 2.78Å
327	Q	79.9	Confident	81.8	Confident	120 Å²	120	100.4 Å²	100.4	56%	0.561	47%	0.474	S	S	*	.	H	α-helix	trans	-66.9	-44.8	175.1	-174.6	169.2	-13	0	0	110.7	K323 E324 E325 H329 L330 T331	K323-Q327 WeakPolarHBondContact O-CB 3.09Å; K323-Q327 PolarHBondContact O-N 2.85Å; E324-Q327 PolarHBondContact O-N 3.06Å; E325-Q327 VanDerWaalsContact C-N 3.34Å; Q327-H329 PolarHBondContact O-N 3.43Å; Q327-L330 PolarHBondContact O-N 2.92Å; Q327-T331 WeakPolarHBondContact O-CB 3.37Å; Q327-T331 PolarHBondContact O-N 3.48Å; Q327-T331 PolarHBondContact O-OG1 2.89Å; Q327-T331 VanDerWaalsContact O-OG1 3.1Å
328	A	79.7	Confident	80.1	Confident	50 Å²	50	105.1 Å²	105.1	41%	0.413	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-44.7	174.5	0	0	0	0	0	112.6	E324 E325 L330 T331 N332	E324-A328 PolarHBondContact O-N 2.81Å; E325-A328 PolarHBondContact O-N 3.48Å; A328-L330 PolarHBondContact O-N 3Å; A328-T331 PolarHBondContact O-N 3.1Å; A328-N332 WeakPolarHBondContact O-CB 3.32Å; A328-N332 PolarHBondContact O-N 2.9Å
329	H	79.1	Confident	78.5	Confident	116 Å²	116	107.2 Å²	107.2	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-60.3	-43.5	174.3	-81	85.1	0	0	0	112.5	E325 Q327 N332 Q333	E325-H329 PolarHBondContact O-N 2.92Å; E325-H329 PolarHBondContact O-ND1 3.24Å; Q327-H329 PolarHBondContact O-N 3.43Å; H329-N332 PolarHBondContact O-N 3.21Å; H329-Q333 WeakPolarHBondContact O-CB 3.38Å; H329-Q333 PolarHBondContact O-N 2.9Å
330	L	78.4	Confident	76.9	Confident	116 Å²	116	106.5 Å²	106.5	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-68.1	-40.3	-179.7	-161.9	71.6	0	0	0	111.7	R326 Q327 A328 Q333 Y334	R326-L330 WeakPolarHBondContact O-CB 3.4Å; R326-L330 PolarHBondContact O-N 2.78Å; Q327-L330 PolarHBondContact O-N 2.92Å; A328-L330 PolarHBondContact O-N 3Å; L330-Q333 PolarHBondContact O-N 2.93Å; L330-Y334 WeakPolarHBondContact O-CB 3.48Å; L330-Y334 PolarHBondContact O-N 2.91Å
331	T	82.2	Confident	75.4	Confident	68 Å²	68	110.5 Å²	110.5	42%	0.417	54%	0.54	S	S	.	.	H	α-helix	trans	-65.7	-42.2	174.8	-61.8	0	0	0	0	111.7	Q327 A328 Y334 M335	Q327-T331 WeakPolarHBondContact O-CB 3.37Å; Q327-T331 PolarHBondContact O-N 3.48Å; Q327-T331 PolarHBondContact O-OG1 2.89Å; Q327-T331 VanDerWaalsContact O-OG1 3.1Å; A328-T331 PolarHBondContact O-N 3.1Å; T331-Y334 WeakPolarHBondContact O-CB 3.44Å; T331-Y334 PolarHBondContact O-N 3.39Å; T331-M335 HydrophobicContact CG2-CE 4.26Å; T331-M335 WeakPolarHBondContact O-CG 3.2Å; T331-M335 PolarHBondContact O-N 3.28Å
332	N	82.1	Confident	73.8	Confident	88 Å²	88	115.4 Å²	115.4	47%	0.471	55%	0.553	S	S	.	*	H	α-helix	trans	-63.4	-41.9	173.5	-81.3	-0.6	0	0	0	111.9	A328 H329 Y334 M335 Q336	A328-N332 WeakPolarHBondContact O-CB 3.32Å; A328-N332 PolarHBondContact O-N 2.9Å; H329-N332 PolarHBondContact O-N 3.21Å; N332-Y334 VanDerWaalsContact C-N 3.29Å; N332-Y334 PolarHBondContact O-N 2.88Å; N332-M335 PolarHBondContact O-N 2.93Å; N332-M335 WeakPolarHBondContact OD1-CE 3.48Å; N332-Q336 WeakPolarHBondContact O-CB 3.5Å; N332-Q336 WeakPolarHBondContact O-CG 3.15Å; N332-Q336 PolarHBondContact O-N 3.42Å
333	Q	80.6	Confident	72.1	Confident	99 Å²	99	115.4 Å²	115.4	46%	0.463	57%	0.569	S	S	.	*	H	α-helix	trans	-65.1	-33.6	176.4	-171.2	174.8	63.8	0	0	112.1	H329 L330 R337	H329-Q333 WeakPolarHBondContact O-CB 3.38Å; H329-Q333 PolarHBondContact O-N 2.9Å; L330-Q333 PolarHBondContact O-N 2.93Å; Q333-R337 WeakPolarHBondContact O-CG 3.31Å; Q333-R337 PolarHBondContact O-N 3.47Å
334	Y	75.5	Confident	70.4	Confident	156 Å²	156	112.9 Å²	112.9	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-67.2	-47.8	172	-176.7	-96	0	0	0	111.8	L330 T331 N332 Q336 R337 M338	L330-Y334 WeakPolarHBondContact O-CB 3.48Å; L330-Y334 PolarHBondContact O-N 2.91Å; T331-Y334 WeakPolarHBondContact O-CB 3.44Å; T331-Y334 PolarHBondContact O-N 3.39Å; N332-Y334 VanDerWaalsContact C-N 3.29Å; N332-Y334 PolarHBondContact O-N 2.88Å; Y334-Q336 PolarHBondContact O-N 3.3Å; Y334-R337 PolarHBondContact O-N 2.76Å; Y334-M338 HydrophobicContact CD1-CG 4.2Å; Y334-M338 HydrophobicContact CE1-CG 3.88Å; Y334-M338 HydrophobicContact CE1-SD 4.12Å; Y334-M338 WeakPolarHBondContact O-CG 3.49Å; Y334-M338 PolarHBondContact O-N 3.17Å
335	M	77.3	Confident	68.5	Low	104 Å²	104	112.8 Å²	112.8	51%	0.512	58%	0.579	S	S	.	*	H	α-helix	trans	-61.2	-39.9	176.2	-72.4	-168.7	-64.7	0	0	112.6	T331 N332 R337 M338 A339	T331-M335 HydrophobicContact CG2-CE 4.26Å; T331-M335 WeakPolarHBondContact O-CG 3.2Å; T331-M335 PolarHBondContact O-N 3.28Å; N332-M335 PolarHBondContact O-N 2.93Å; N332-M335 WeakPolarHBondContact OD1-CE 3.48Å; M335-R337 PolarHBondContact O-N 2.83Å; M335-M338 PolarHBondContact O-N 3.23Å; M335-A339 WeakPolarHBondContact O-CB 3.32Å; M335-A339 PolarHBondContact O-N 3.01Å
336	Q	76.1	Confident	66.4	Low	139 Å²	139	115.6 Å²	115.6	65%	0.65	60%	0.597	S	S	*	*	H	α-helix	trans	-62.8	-39.7	175.9	-75.9	174.5	-10.1	0	0	112.4	N332 Y334 A339 S340	N332-Q336 WeakPolarHBondContact O-CB 3.5Å; N332-Q336 WeakPolarHBondContact O-CG 3.15Å; N332-Q336 PolarHBondContact O-N 3.42Å; Y334-Q336 PolarHBondContact O-N 3.3Å; Q336-A339 PolarHBondContact O-N 3.43Å; Q336-S340 PolarHBondContact O-N 2.87Å; Q336-S340 VanDerWaalsContact O-N 3.08Å
337	R	71.4	Confident	64.8	Low	167 Å²	167	113.4 Å²	113.4	63%	0.63	60%	0.603	S	S	*	*	H	α-helix	trans	-64	-44.3	172.5	-71.5	-177.8	-171.8	-166.5	4.3	111.5	Q333 Y334 M335 A339 S340 V341	Q333-R337 WeakPolarHBondContact O-CG 3.31Å; Q333-R337 PolarHBondContact O-N 3.47Å; Y334-R337 PolarHBondContact O-N 2.76Å; M335-R337 PolarHBondContact O-N 2.83Å; R337-A339 VanDerWaalsContact C-N 3.33Å; R337-A339 PolarHBondContact O-N 3.08Å; R337-S340 PolarHBondContact O-N 3.22Å; R337-S340 PolarHBondContact O-OG 3.31Å; R337-V341 PolarHBondContact O-N 3.05Å
338	M	60.1	Low	62.9	Low	101 Å²	101	114.5 Å²	114.5	50%	0.498	62%	0.617	S	S	.	*	H	α-helix	trans	-61.1	-40.4	177	-68.2	-99.7	59.4	0	0	112.3	Y334 M335 V341	Y334-M338 HydrophobicContact CD1-CG 4.2Å; Y334-M338 HydrophobicContact CE1-CG 3.88Å; Y334-M338 HydrophobicContact CE1-SD 4.12Å; Y334-M338 WeakPolarHBondContact O-CG 3.49Å; Y334-M338 PolarHBondContact O-N 3.17Å; M335-M338 PolarHBondContact O-N 3.23Å; M338-V341 PolarHBondContact O-N 2.97Å
339	A	60.2	Low	60.8	Low	65 Å²	65	119.6 Å²	119.6	54%	0.537	64%	0.636	S	S	.	*	H	α-helix	trans	-62.3	-43.2	174.9	0	0	0	0	0	112.1	M335 Q336 R337 V341 R342	M335-A339 WeakPolarHBondContact O-CB 3.32Å; M335-A339 PolarHBondContact O-N 3.01Å; Q336-A339 PolarHBondContact O-N 3.43Å; R337-A339 VanDerWaalsContact C-N 3.33Å; R337-A339 PolarHBondContact O-N 3.08Å; A339-V341 PolarHBondContact O-N 2.93Å; A339-R342 PolarHBondContact O-N 2.98Å; A339-R342 VanDerWaalsContact O-N 3.16Å
340	S	60.2	Low	58.7	Low	80 Å²	80	121 Å²	121	56%	0.559	65%	0.648	S	S	*	*	H	α-helix	trans	-63.7	-22.1	-178.3	69.5	0	0	0	0	114.6	Q336 R337	Q336-S340 PolarHBondContact O-N 2.87Å; Q336-S340 VanDerWaalsContact O-N 3.08Å; R337-S340 PolarHBondContact O-N 3.22Å; R337-S340 PolarHBondContact O-OG 3.31Å
341	V	56.4	Low	56.8	Low	108 Å²	108	120.6 Å²	120.6	66%	0.655	65%	0.652	S	S	*	*	H	α-helix	trans	-81.1	-20.6	178.6	176.5	0	0	0	0	112.7	R337 M338 A339 A343	R337-V341 PolarHBondContact O-N 3.05Å; M338-V341 PolarHBondContact O-N 2.97Å; A339-V341 PolarHBondContact O-N 2.93Å; V341-A343 VanDerWaalsContact C-N 3.29Å; V341-A343 PolarHBondContact O-N 3.36Å
342	R	51	Low	54.6	Low	219 Å²	219	128.3 Å²	128.3	83%	0.826	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-0.6	174.5	-80.1	-174.6	171.5	166.2	-0.4	113.9	A339 V344	A339-R342 PolarHBondContact O-N 2.98Å; A339-R342 VanDerWaalsContact O-N 3.16Å; R342-V344 PolarHBondContact O-N 2.99Å
343	A	45.1	Very low	52.4	Low	76 Å²	76	133.2 Å²	133.2	63%	0.628	70%	0.695	S	S	*	*			trans	-100.1	50.9	-173.1	0	0	0	0	0	114	V341	V341-A343 VanDerWaalsContact C-N 3.29Å; V341-A343 PolarHBondContact O-N 3.36Å
344	V	43.3	Very low	50.3	Low	123 Å²	123	134.3 Å²	134.3	75%	0.745	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-93.8	116.4	163.2	-78.5	0	0	0	0	109.4	R342 N346	R342-V344 PolarHBondContact O-N 2.99Å; V344-N346 PolarHBondContact O-N 2.74Å
345	P	41.7	Very low	48.6	Very low	124 Å²	124	131.6 Å²	131.6	81%	0.805	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-77.1	120.1	-180	-10.6	26.7	0	0	0	110.8
346	N	37	Very low	46.9	Very low	151 Å²	151	132.3 Å²	132.3	81%	0.807	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-67.5	128.5	162.6	-94.8	7.1	0	0	0	109.1	V344	V344-N346 PolarHBondContact O-N 2.74Å
347	P	43.5	Very low	45.5	Very low	111 Å²	111	131.3 Å²	131.3	72%	0.721	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-68.6	141.4	169.1	29.2	-33	0	0	0	110.3
348	V	40	Very low	43.9	Very low	143 Å²	143	129.5 Å²	129.5	87%	0.867	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-71.5	129	-178.9	178.9	0	0	0	0	110.2
349	I	34.7	Very low	42.5	Very low	157 Å²	157	128.7 Å²	128.7	81%	0.805	77%	0.769	S	S	*	*			trans	-104.6	133.5	169.9	-66.2	178.3	0	0	0	108.8
350	N	35.2	Very low	41.2	Very low	147 Å²	147	135.8 Å²	135.8	79%	0.786	78%	0.783	S	S	*	*			trans	-81.8	144.4	-175.6	-139.4	23.4	0	0	0	111.1	Y352	N350-Y352 PolarHBondContact O-N 3.29Å
351	P	39.9	Very low	39.8	Very low	106 Å²	106	140.3 Å²	140.3	69%	0.688	79%	0.793	S	S	*	*			trans	-90.9	102.9	-170.1	33.5	-32.9	0	0	0	113.3
352	Y	36.3	Very low	39	Very low	231 Å²	231	143.3 Å²	143.3	91%	0.906	80%	0.802	S	S	*	*			trans	-170.7	99.9	154.5	-111.2	-68.9	0	0	0	112.6	N350	N350-Y352 PolarHBondContact O-N 3.29Å
353	Q	34.3	Very low	38	Very low	191 Å²	191	137.3 Å²	137.3	89%	0.893	80%	0.8	S	S	*	*			trans	-177.4	153.3	145.6	-105.7	174.8	-6.8	0	0	111
354	P	37.8	Very low	37.6	Very low	121 Å²	121	138.2 Å²	138.2	79%	0.786	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-85.5	160.2	-177.1	35.1	-34.8	0	0	0	113.3
355	A	38.5	Very low	37.3	Very low	99 Å²	99	140.2 Å²	140.2	82%	0.818	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-88.2	146.6	-174.6	0	0	0	0	0	114.5
356	P	43.1	Very low	37.2	Very low	119 Å²	119	139.7 Å²	139.7	77%	0.773	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-99.7	165.6	150.4	35.5	-27.7	0	0	0	111.8
357	P	45.2	Very low	36.9	Very low	119 Å²	119	140.6 Å²	140.6	77%	0.773	81%	0.808	S	S	*	*			trans	-104.9	163.8	-157.3	39.5	-36.8	0	0	0	116.9
358	S	38.6	Very low	36.6	Very low	129 Å²	129	142 Å²	142	90%	0.902	81%	0.814	S	S	*	*			trans	56.2	107.9	148.9	-59.2	0	0	0	0	120.2
359	G	30.4	Very low	36.3	Very low	84 Å²	84	143.7 Å²	143.7	87%	0.866	81%	0.813	S	S	*	*			trans	-152.7	143.4	164.3	0	0	0	0	0	111.6
360	Y	33.2	Very low	36.3	Very low	214 Å²	214	143.5 Å²	143.5	84%	0.839	81%	0.813	S	S	*	*			trans	-112.6	158.5	-167.5	-115.2	-79.9	0	0	0	113.5
361	F	30.8	Very low	35.9	Very low	175 Å²	175	148.3 Å²	148.3	77%	0.768	82%	0.821	S	S	*	*			trans	80.5	171.5	152.8	-88.7	-62.7	0	0	0	122.3
362	M	40.1	Very low	35.4	Very low	170 Å²	170	147.2 Å²	147.2	84%	0.837	82%	0.821	S	S	*	*			trans	-95.8	155.1	-155.6	-63.7	162.7	162.3	0	0	115.3
363	A	29.8	Very low	35.6	Very low	94 Å²	94	140.6 Å²	140.6	78%	0.777	81%	0.813	S	S	*	*			trans	-148.9	136.6	136.6	0	0	0	0	0	107.7
364	A	35.7	Very low	35.3	Very low	95 Å²	95	142.7 Å²	142.7	79%	0.785	82%	0.815	S	S	*	*			cis	84	137.8	40.7	0	0	0	0	0	113.7
365	I	38.6	Very low	35.2	Very low	165 Å²	165	147 Å²	147	85%	0.846	82%	0.817	S	S	*	*			trans	-98.3	141.6	-160.4	-54.9	162.6	0	0	0	111.9
366	P	38.7	Very low	35.5	Very low	113 Å²	113	147.8 Å²	147.8	73%	0.734	81%	0.814	S	S	*	*			trans	-127.8	117.2	135.1	31	-18.2	0	0	0	110.4
367	Q	31.7	Very low	35.8	Very low	170 Å²	170	147 Å²	147	79%	0.794	81%	0.809	S	S	*	*				70.9	116.1	77.7	-170.4	173.3	-2.9	0	0	113.1
368	T	36.4	Very low	35.2	Very low	139 Å²	139	146.3 Å²	146.3	85%	0.853	81%	0.806	S	S	*	*			trans	-100.6	139	-174.6	49	0	0	0	0	112.4
369	Q	33.9	Very low	35.1	Very low	179 Å²	179	149.6 Å²	149.6	84%	0.836	81%	0.807	S	S	*	*			trans	-145.8	94.6	169.1	-167	163.1	-6	0	0	114.3
370	N	33.5	Very low	35.1	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	81%	0.806	S	S	*	*			trans	17.2	111.9	140.6	-173.1	17.1	0	0	0	119.5
371	R	28.4	Very low	34.8	Very low	248 Å²	248	147.1 Å²	147.1	94%	0.936	80%	0.799	S	S	*	*			trans	-151.8	159.9	141.6	-150.2	177.4	173.4	112.8	1.3	111.6
372	A	29.2	Very low	34.8	Very low	83 Å²	83	147 Å²	147	69%	0.686	80%	0.8	S	S	*	*			trans	-112.1	154.6	-172.9	0	0	0	0	0	114.5
373	A	39.9	Very low	34.3	Very low	91 Å²	91	146 Å²	146	75%	0.752	80%	0.798	S	S	*	*			trans	49.8	119.8	150.2	0	0	0	0	0	121
374	Y	29	Very low	34.4	Very low	236 Å²	236	152 Å²	152	93%	0.925	80%	0.8	S	S	*	*			trans	-155.9	140.5	140.8	-112	-81	0	0	0	111.1
375	Y	35	Very low	34.7	Very low	210 Å²	210	153.4 Å²	153.4	82%	0.824	80%	0.801	S	S	*	*			trans	-87.7	160	161.9	-99.5	-84.2	0	0	0	108.4
376	P	44.5	Very low	34.6	Very low	117 Å²	117	149.9 Å²	149.9	76%	0.76	79%	0.791	S	S	*	*				-150.5	-146.9	67.3	37.4	-10.6	0	0	0	113.8
377	P	49.3	Very low	35.2	Very low	103 Å²	103	151.2 Å²	151.2	67%	0.669	80%	0.8	S	S	*	*				-132.8	165.4	-86.6	43	-27.3	0	0	0	116.9
378	S	33.3	Very low	35	Very low	103 Å²	103	152 Å²	152	72%	0.72	80%	0.796	S	S	*	*			trans	40.1	121.6	145.3	63.4	0	0	0	0	122.1
379	Q	35.3	Very low	34.7	Very low	198 Å²	198	154.1 Å²	154.1	93%	0.925	79%	0.788	S	S	*	*			trans	-149.5	179.6	133.7	-118.5	170.6	100.7	0	0	111.4
380	I	30.3	Very low	34.7	Very low	164 Å²	164	151.7 Å²	151.7	84%	0.841	79%	0.786	S	S	*	*			trans	-119.4	161.5	-148	-77.6	167.5	0	0	0	113.4
381	A	26.7	Very low	34.7	Very low	82 Å²	82	147.7 Å²	147.7	68%	0.678	77%	0.774	S	S	*	*			trans	94.4	117.1	154.2	0	0	0	0	0	122
382	Q	30.9	Very low	34.8	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.804	77%	0.774	S	S	*	*				93.1	149	122.8	-71.6	-72.2	9.2	0	0	122.9
383	L	30.8	Very low	34.9	Very low	149 Å²	149	145.6 Å²	145.6	78%	0.78	78%	0.783	S	S	*	*			trans	68.4	100.4	157.2	-69.5	156.3	0	0	0	121
384	R	32.5	Very low	34.4	Very low	221 Å²	221	145.5 Å²	145.5	83%	0.834	78%	0.783	S	S	*	*			trans	-66.9	158.5	136.2	-85.8	-176.9	169.1	178	-3.9	109.6
385	P	40.6	Very low	34.7	Very low	124 Å²	124	145.7 Å²	145.7	81%	0.805	78%	0.782	S	S	*	*				-137.7	165.8	103.5	36.5	-25.5	0	0	0	114.6
386	S	36.9	Very low	35.4	Very low	91 Å²	91	139.9 Å²	139.9	64%	0.636	77%	0.77	S	S	*	*			trans	-126.8	146.4	166.4	-53	0	0	0	0	108.8
387	P	50.4	Low	35.2	Very low	141 Å²	141	142.5 Å²	142.5	92%	0.916	77%	0.771	S	S	*	*			trans	-66.6	166.9	-178.5	-21.7	34.8	0	0	0	114.4
388	R	28	Very low	35.4	Very low	187 Å²	187	142.4 Å²	142.4	71%	0.706	77%	0.771	S	S	*	*			trans	-148	160.9	-167.7	-173.6	-177.8	174.7	-179.9	1.8	112.9
389	W	30.7	Very low	35.2	Very low	183 Å²	183	146.2 Å²	146.2	69%	0.693	78%	0.775	S	S	*	*			trans	101	148.9	163.6	-56	114.7	0	0	0	115.3	A391	W389-A391 HydrophobicContact CE3-CB 4.45Å
390	T	33	Very low	35.1	Very low	129 Å²	129	143.6 Å²	143.6	79%	0.791	76%	0.763	S	S	*	*			cis	-111.9	154.4	6.9	41.9	0	0	0	0	112
391	A	34.5	Very low	35.2	Very low	69 Å²	69	142.6 Å²	142.6	57%	0.57	76%	0.759	S	S	*	*				62.8	136	61.4	0	0	0	0	0	113.5	W389	W389-A391 HydrophobicContact CE3-CB 4.45Å
392	Q	30.8	Very low	35.4	Very low	203 Å²	203	147.1 Å²	147.1	95%	0.949	77%	0.768	S	S	*	*			cis	-162.2	157.4	15.3	-148.6	170.6	15	0	0	110.8
393	G	30.8	Very low	36.3	Very low	84 Å²	84	144 Å²	144	87%	0.866	76%	0.763	S	S	*	*			trans	168.2	121.6	173.3	0	0	0	0	0	116
394	A	30.2	Very low	36.4	Very low	90 Å²	90	140.6 Å²	140.6	74%	0.744	76%	0.764	S	S	*	*			trans	-108.7	144.8	-155	0	0	0	0	0	118
395	R	33.5	Very low	36.5	Very low	239 Å²	239	134.4 Å²	134.4	90%	0.902	76%	0.76	S	S	*	*			trans	76.8	166.9	132.4	-79.7	-168.3	173.3	-153.4	0.3	119.5
396	P	50.2	Low	36.1	Very low	89 Å²	89	136.5 Å²	136.5	58%	0.578	76%	0.763	S	S	*	*				-143.5	-166.6	-85.1	32.4	-5.8	0	0	0	116.9
397	H	40.9	Very low	35.9	Very low	171 Å²	171	142.4 Å²	142.4	79%	0.792	77%	0.771	S	S	*	*			trans	89.9	161.5	157.7	-61.5	-51	0	0	0	119.5
398	P	52.4	Low	35.9	Very low	102 Å²	102	141.5 Å²	141.5	66%	0.662	77%	0.765	S	S	*	*				-140.6	-155.7	-65	41.1	-20.9	0	0	0	114.7
399	F	29.3	Very low	36	Very low	183 Å²	183	136.4 Å²	136.4	80%	0.803	76%	0.763	S	S	*	*			trans	84.7	146.2	176.9	-76.9	-96.6	0	0	0	119.1
400	Q	34.1	Very low	36.3	Very low	143 Å²	143	132.6 Å²	132.6	67%	0.668	77%	0.77	S	S	*	*				-174.7	161.1	-51.9	158.4	168.1	-2.1	0	0	111.9
401	N	31.2	Very low	37	Very low	143 Å²	143	132.5 Å²	132.5	77%	0.765	77%	0.772	S	S	*	*			trans	92	164.4	164.3	-79.5	-1.2	0	0	0	120
402	M	31.3	Very low	37	Very low	176 Å²	176	140.4 Å²	140.4	87%	0.867	79%	0.787	S	S	*	*			trans	-160.9	-168	-149.7	-125.1	-165.1	171	0	0	107.6
403	P	49.3	Very low	38.4	Very low	107 Å²	107	136.4 Å²	136.4	70%	0.695	78%	0.778	S	S	*	*			cis	-134.8	170.2	-36.2	36.4	-20.1	0	0	0	114.9
404	G	33.5	Very low	39.9	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	77%	0.766	S	S	*	*			trans	82.3	164.9	145	0	0	0	0	0	119
405	A	33.8	Very low	40	Very low	92 Å²	92	141.8 Å²	141.8	76%	0.76	77%	0.771	S	S	*	*			cis	-163.1	-176.3	-7.6	0	0	0	0	0	112.1
406	I	33.7	Very low	39.8	Very low	167 Å²	167	135 Å²	135	86%	0.856	76%	0.76	S	S	*	*			trans	90.5	127	160.9	-57.3	163.9	0	0	0	118.4
407	R	31.5	Very low	39	Very low	216 Å²	216	136.4 Å²	136.4	82%	0.815	77%	0.768	S	S	*	*			trans	-118	165.2	165.8	-50.1	169.1	70.1	-150.9	6.6	106.7
408	P	50.1	Low	38.6	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	77%	0.773	S	S	*	*				-136.2	175.4	57.4	20.8	5.2	0	0	0	113.1
409	A	31.5	Very low	37.5	Very low	79 Å²	79	143.2 Å²	143.2	65%	0.653	78%	0.783	S	S	*	*			cis	89.5	94.5	18.4	0	0	0	0	0	117.2
410	A	36.9	Very low	38.4	Very low	103 Å²	103	140.1 Å²	140.1	85%	0.851	78%	0.781	S	S	*	*			trans	-158.8	168.5	171.9	0	0	0	0	0	111.6
411	P	46.7	Very low	38.2	Very low	128 Å²	128	137.6 Å²	137.6	83%	0.831	79%	0.785	S	S	*	*			trans	-127.4	-171.3	-142.2	44.9	-33.1	0	0	0	119.2
412	R	35.9	Very low	38.2	Very low	235 Å²	235	136.7 Å²	136.7	89%	0.887	79%	0.79	S	S	*	*			trans	-103.7	-171.8	163.1	-64.9	-176.7	170.5	-148.6	-0.2	109.7
413	P	59.4	Low	38.6	Very low	118 Å²	118	134.2 Å²	134.2	77%	0.766	79%	0.79	S	S	*	*			cis	-123.4	-123.8	-5.1	31.6	-5.2	0	0	0	110.3
414	P	63.2	Low	37.6	Very low	92 Å²	92	137.3 Å²	137.3	60%	0.597	80%	0.795	S	S	*	*			cis	-136	-172.6	-28.8	27.2	-1.3	0	0	0	116.5
415	F	31.7	Very low	37.4	Very low	195 Å²	195	139.8 Å²	139.8	86%	0.855	80%	0.795	S	S	*	*			trans	70	131	166.6	-63.8	-72.4	0	0	0	118.5
416	S	30.2	Very low	38	Very low	96 Å²	96	140.4 Å²	140.4	67%	0.671	79%	0.791	S	S	*	*				96	143	52.1	-162.2	0	0	0	0	111
417	T	32.3	Very low	38	Very low	120 Å²	120	143.5 Å²	143.5	74%	0.736	79%	0.792	S	S	*	*			cis	-163.4	177.8	37.2	-42.5	0	0	0	0	112.4
418	M	32.3	Very low	38	Very low	186 Å²	186	138.1 Å²	138.1	92%	0.916	78%	0.783	S	S	*	*			trans	100.1	153.7	152.6	-66.2	-159.1	173.9	0	0	122.2
419	R	29.6	Very low	36.9	Very low	229 Å²	229	140.5 Å²	140.5	86%	0.864	79%	0.785	S	S	*	*			trans	-158.6	140.6	-178.7	178.7	-154.6	172.3	-158.3	-1.1	106.8
420	P	47.9	Very low	36.9	Very low	118 Å²	118	140.9 Å²	140.9	77%	0.766	78%	0.783	S	S	*	*				-147.3	157.5	124.3	36.6	-20.9	0	0	0	116.5
421	A	30.4	Very low	36.6	Very low	91 Å²	91	141.8 Å²	141.8	75%	0.752	78%	0.779	S	S	*	*			trans	35.2	143	144.2	0	0	0	0	0	124.2
422	S	32	Very low	35.8	Very low	124 Å²	124	143.8 Å²	143.8	87%	0.867	78%	0.777	S	S	*	*			trans	-119.7	162.8	160.1	53.5	0	0	0	0	111.1
423	S	39.3	Very low	35.4	Very low	124 Å²	124	143.2 Å²	143.2	87%	0.867	78%	0.775	S	S	*	*			trans	-98.4	-174.8	-166.1	51.1	0	0	0	0	115.2
424	Q	27.9	Very low	33.9	Very low	171 Å²	171	144 Å²	144	80%	0.799	78%	0.777	S	S	*	*			trans	-123.6	161.1	-163.6	-61.8	-179.6	-10.3	0	0	114.4
425	V	29	Very low	32.3	Very low	129 Å²	129	144.5 Å²	144.5	78%	0.782	79%	0.788	S	S	*	*			trans	63.7	166.5	149.6	-70.8	0	0	0	0	120.9
426	P	46.6	Very low	32.2	Very low	105 Å²	105	142.8 Å²	142.8	68%	0.682	79%	0.788	S	S	*	*			cis	-145.3	172.8	-45.7	40.4	-23.8	0	0	0	118
427	R	33	Very low	32	Very low	233 Å²	233	145 Å²	145	88%	0.879	80%	0.798	S	S	*	*			trans	69.2	166.6	145.5	-91.9	174.5	164.9	-163.1	-0.7	119.3
428	V	31.3	Very low	31.7	Very low	102 Å²	102	143.9 Å²	143.9	62%	0.618	80%	0.795	S	S	*	*			cis	-150.8	158.3	11	-126.2	0	0	0	0	114.5
429	M	28.1	Very low	31.7	Very low	172 Å²	172	141 Å²	141	85%	0.847	79%	0.788	S	S	*	*			trans	66	156.5	143.1	-76.9	173.1	158.5	0	0	122.3
430	S	31.2	Very low	31.7	Very low	88 Å²	88	138.2 Å²	138.2	62%	0.615	79%	0.785	S	S	*	*			cis	-171.7	144.4	-12.6	47.4	0	0	0	0	115.8
431	T	29.8	Very low	30.8	Very low	122 Å²	122	138.4 Å²	138.4	75%	0.748	78%	0.784	S	S	*	*			trans	61.6	162.7	144.2	56.1	0	0	0	0	120.8
432	Q	29.8	Very low	30.6	Very low	170 Å²	170	143 Å²	143	79%	0.794	79%	0.792	S	S	*	*			cis	-150.8	163	4.6	-158.5	126	-64.9	0	0	115.2
433	R	29.1	Very low	30.4	Very low	223 Å²	223	140.7 Å²	140.7	84%	0.842	79%	0.787	S	S	*	*			trans	-43.7	166	158.4	-82.8	176.3	174.1	177.3	-0.9	116.5
434	V	27.9	Very low	31	Very low	135 Å²	135	141.1 Å²	141.1	82%	0.818	79%	0.787	S	S	*	*			cis	-171.4	154	-19.9	-100.2	0	0	0	0	109.1
435	A	28.1	Very low	31.1	Very low	101 Å²	101	143.6 Å²	143.6	84%	0.835	79%	0.79	S	S	*	*			trans	-177.2	156.9	146.9	0	0	0	0	0	115.7
436	N	29.9	Very low	32.1	Very low	159 Å²	159	143 Å²	143	85%	0.85	79%	0.788	S	S	*	*			trans	-97.3	167.1	168.5	-70.7	-22.5	0	0	0	111.7
437	T	26.6	Very low	31.5	Very low	143 Å²	143	142.1 Å²	142.1	88%	0.877	79%	0.789	S	S	*	*				-172.7	163.5	126.8	-75	0	0	0	0	110.6
438	S	26.4	Very low	31.5	Very low	96 Å²	96	135.7 Å²	135.7	67%	0.671	79%	0.787	S	S	*	*			trans	-106.1	-163.9	-168.7	58.3	0	0	0	0	114.2
439	T	31.7	Very low	31.5	Very low	125 Å²	125	135.2 Å²	135.2	77%	0.767	79%	0.793	S	S	*	*			trans	81.2	156.3	179.2	73.3	0	0	0	0	116
440	Q	30.1	Very low	31.8	Very low	171 Å²	171	132 Å²	132	80%	0.799	79%	0.794	S	S	*	*			cis	169.6	170.2	-40.8	-106.9	-161.2	76.1	0	0	106.9
441	T	29.3	Very low	31.8	Very low	122 Å²	122	132.4 Å²	132.4	75%	0.748	80%	0.803	S	S	*	*			trans	89.7	111.9	163.5	72.1	0	0	0	0	121.5
442	M	26.3	Very low	31.9	Very low	189 Å²	189	131.6 Å²	131.6	93%	0.931	81%	0.808	S	S	*	*				43.4	134.2	120.4	-53.5	-67.5	-91.3	0	0	122.2
443	G	27.9	Very low	32.1	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	81%	0.812	S	S	*	*			trans	154.8	147.9	145.4	0	0	0	0	0	116.7
444	P	50.2	Low	32.2	Very low	134 Å²	134	124.4 Å²	124.4	87%	0.87	81%	0.811	S	S	*	*			trans	-127.3	-177	-148.1	40.3	-23.3	0	0	0	118.5
445	R	31.7	Very low	32.9	Very low	223 Å²	223	123.6 Å²	123.6	84%	0.842	81%	0.809	S	S	*	*			trans	-50.1	159.7	173.3	-119.5	175.9	166.2	-175.2	-4.8	115.4
446	P	50.1	Low	32.9	Very low	117 Å²	117	123.1 Å²	123.1	76%	0.76	81%	0.805	S	S	*	*				-124.6	-169.8	62.7	20.7	2.7	0	0	0	113.1
447	A	33.3	Very low	32.9	Very low	85 Å²	85	121.7 Å²	121.7	70%	0.702	80%	0.802	S	S	*	*			cis	82.3	141.9	16.1	0	0	0	0	0	116.4
448	A	32.8	Very low	33	Very low	99 Å²	99	125.8 Å²	125.8	82%	0.818	80%	0.801	S	S	*	*			cis	-158	-166.1	-13.8	0	0	0	0	0	107.8
449	A	31.9	Very low	33.2	Very low	92 Å²	92	128.2 Å²	128.2	76%	0.76	81%	0.812	S	S	*	*			cis	-165.6	177.9	0.3	0	0	0	0	0	111
450	A	32.8	Very low	33.2	Very low	105 Å²	105	128.7 Å²	128.7	87%	0.868	82%	0.815	S	S	*	*			trans	65.1	151.3	160.2	0	0	0	0	0	120.3
451	A	32.3	Very low	33.4	Very low	96 Å²	96	125.8 Å²	125.8	79%	0.793	81%	0.81	S	S	*	*			cis	-162.4	159.3	-17.1	0	0	0	0	0	114.2
452	A	31.5	Very low	33.2	Very low	105 Å²	105	128.9 Å²	128.9	87%	0.868	82%	0.816	S	S	*	*			trans	55.5	109.5	150.7	0	0	0	0	0	124.1
453	A	33.5	Very low	33.4	Very low	104 Å²	104	130.5 Å²	130.5	86%	0.86	81%	0.814	S	S	*	*			trans	-165.6	161.7	130.8	0	0	0	0	0	110.7
454	T	31.5	Very low	33.4	Very low	137 Å²	137	136.6 Å²	136.6	84%	0.84	82%	0.819	S	S	*	*			trans	-131.1	173.5	-174.4	58.2	0	0	0	0	110.9
455	P	43	Very low	32.3	Very low	119 Å²	119	141.5 Å²	141.5	77%	0.773	82%	0.822	S	S	*	*			cis	-137.6	-179.1	7.6	41.3	-22.6	0	0	0	117.8
456	A	28.5	Very low	32.2	Very low	91 Å²	91	135.7 Å²	135.7	75%	0.752	82%	0.822	S	S	*	*			trans	114.2	136.9	136.5	0	0	0	0	0	121.4
457	V	29.4	Very low	31.1	Very low	128 Å²	128	135.4 Å²	135.4	78%	0.776	83%	0.83	S	S	*	*			trans	68	109.9	158.5	-174.8	0	0	0	0	121.2
458	R	28.3	Very low	31	Very low	230 Å²	230	134.9 Å²	134.9	87%	0.868	83%	0.833	S	S	*	*			trans	35.3	121.4	143.1	-59	174.7	177	173.4	-1.3	120.5
459	T	30.9	Very low	30.9	Very low	146 Å²	146	137.5 Å²	137.5	90%	0.896	84%	0.838	S	S	*	*				-171	163.7	112.8	17.4	0	0	0	0	112.1
460	V	32.3	Very low	30.8	Very low	135 Å²	135	144.5 Å²	144.5	82%	0.818	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-103.5	134.8	176.1	-178.3	0	0	0	0	108.8
461	P	33.4	Very low	30.7	Very low	110 Å²	110	146.1 Å²	146.1	71%	0.714	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-79.8	145.8	-166.3	30.3	-36.3	0	0	0	114.8
462	Q	26.4	Very low	30.9	Very low	187 Å²	187	146.9 Å²	146.9	87%	0.874	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-81.2	139.2	164.5	-63.4	176.7	-76.5	0	0	110.8
463	Y	28.8	Very low	30.7	Very low	224 Å²	224	149.5 Å²	149.5	88%	0.878	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-84	134.7	163.7	-84.2	-87.5	0	0	0	111.1
464	K	27.9	Very low	30.5	Very low	201 Å²	201	154.1 Å²	154.1	87%	0.874	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-88.9	141.5	172.8	-62.7	176.3	-179.3	176.3	0	109.8
465	Y	27.6	Very low	30.4	Very low	237 Å²	237	154.7 Å²	154.7	93%	0.929	83%	0.827	S	S	*	*			trans	-105.5	140	156.1	-103.2	-91.1	0	0	0	109.3
466	A	29.3	Very low	29.8	Very low	102 Å²	102	156.1 Å²	156.1	84%	0.843	83%	0.827	S	S	*	*			trans	-92.1	163.6	177.5	0	0	0	0	0	111.5
467	A	27.1	Very low	29.6	Very low	111 Å²	111	160 Å²	160	92%	0.917	84%	0.835	S	S	*	*			trans	-116.4	142.1	-178.7	0	0	0	0	0	112.5
468	G	31.5	Very low	30	Very low	74 Å²	74	158.3 Å²	158.3	76%	0.763	83%	0.834	S	S	*	*			trans	149.6	142.5	-175.5	0	0	0	0	0	108
469	V	31.2	Very low	29.9	Very low	154 Å²	154	156.5 Å²	156.5	93%	0.933	84%	0.836	S	S	*	*			cis	-122	165.1	18.6	176.2	0	0	0	0	111.2
470	R	28.9	Very low	29.9	Very low	238 Å²	238	155.3 Å²	155.3	90%	0.898	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-102.2	143.6	-175.2	-162.5	177.8	-170.7	175.5	2.3	111.9
471	N	31.8	Very low	29.7	Very low	139 Å²	139	158.5 Å²	158.5	74%	0.743	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-77.4	149.9	-178.7	-166.2	55.4	0	0	0	113.5
472	P	35.8	Very low	29.5	Very low	112 Å²	112	159.2 Å²	159.2	73%	0.727	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-103.6	147	155.6	35.6	-27.9	0	0	0	112.3
473	Q	27.5	Very low	29.6	Very low	161 Å²	161	156.1 Å²	156.1	75%	0.752	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-92.3	152.2	178.9	-67	169.1	-103.5	0	0	112.6
474	Q	29.8	Very low	29.7	Very low	200 Å²	200	154.9 Å²	154.9	94%	0.935	84%	0.837	S	S	*	*			trans	-130.3	172.1	144.6	-74	-164	-15.3	0	0	110
475	H	29.4	Very low	29.8	Very low	150 Å²	150	153.9 Å²	153.9	69%	0.694	84%	0.836	S	S	*	*			trans	-112.3	153.9	-153.5	-103.4	-159.9	0	0	0	115.3
476	L	29	Very low	30.1	Very low	149 Å²	149	151.1 Å²	151.1	78%	0.78	83%	0.831	S	S	*	*			trans	52.6	101.4	147.1	-69.9	161.4	0	0	0	119
477	N	25.4	Very low	30.3	Very low	172 Å²	172	152.5 Å²	152.5	92%	0.92	83%	0.832	S	S	*	*				-156.8	167.9	109.4	-113.9	-22.1	0	0	0	111.6
478	A	36.9	Very low	30.6	Very low	92 Å²	92	150.2 Å²	150.2	76%	0.76	81%	0.813	S	S	*	*			trans	-101.6	136.9	-167.8	0	0	0	0	0	114.3
479	Q	28	Very low	30.6	Very low	192 Å²	192	152 Å²	152	90%	0.897	81%	0.809	S	S	*	*			trans	-165.3	168.2	153.2	-110.6	177.6	17.8	0	0	110.1
480	P	30.1	Very low	30.8	Very low	121 Å²	121	152.9 Å²	152.9	79%	0.786	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-76.2	151.3	-161.7	30.6	-36.5	0	0	0	114.3
481	Q	28.3	Very low	31.5	Very low	202 Å²	202	146.3 Å²	146.3	94%	0.944	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-97.4	147	-176	-159.2	168.2	12.4	0	0	113.1
482	V	28.2	Very low	31.4	Very low	125 Å²	125	149.1 Å²	149.1	76%	0.758	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-102.5	147.1	-158.4	-165.5	0	0	0	0	112.6
483	T	30	Very low	31.9	Very low	123 Å²	123	147.5 Å²	147.5	76%	0.755	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-65.6	130.5	168	10.6	0	0	0	0	111.6	Q485	T483-Q485 PolarHBondContact O-N 2.84Å
484	M	29.5	Very low	32.6	Very low	197 Å²	197	145.9 Å²	145.9	97%	0.97	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.2	118.3	170.4	-85.1	-175.3	157.3	0	0	110.8
485	Q	30.9	Very low	33.2	Very low	181 Å²	181	143.7 Å²	143.7	85%	0.846	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-83.2	152.7	171.6	-66.6	176.9	-15	0	0	110.9	T483	T483-Q485 PolarHBondContact O-N 2.84Å
486	Q	32.7	Very low	34.3	Very low	178 Å²	178	140 Å²	140	83%	0.832	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-81.9	153	163.1	-68.8	176.9	0.7	0	0	109.2	A488	Q486-A488 PolarHBondContact O-N 3.43Å; Q486-A488 VanDerWaalsContact O-N 3.07Å
487	P	33.9	Very low	35.6	Very low	132 Å²	132	134.8 Å²	134.8	86%	0.857	75%	0.745	S	S	*	*			trans	-68.7	107.3	-174.6	27.4	-34.7	0	0	0	111.7
488	A	32.8	Very low	37.5	Very low	63 Å²	63	129.9 Å²	129.9	52%	0.521	72%	0.721	S	S	.	*	P	Polyproline II helix	trans	-83.1	124.9	171	0	0	0	0	0	110.5	Q486 H490 P496	Q486-A488 PolarHBondContact O-N 3.43Å; Q486-A488 VanDerWaalsContact O-N 3.07Å; A488-H490 PolarHBondContact O-N 3.43Å; A488-P496 HydrophobicContact CB-CB 4.36Å
489	V	33.1	Very low	38.5	Very low	112 Å²	112	128.8 Å²	128.8	68%	0.679	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-67.2	118	175.5	-177.3	0	0	0	0	109.1	V491	V489-V491 PolarHBondContact O-N 2.68Å
490	H	34.3	Very low	39.8	Very low	172 Å²	172	124.2 Å²	124.2	80%	0.796	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-77.7	119.8	177	-99.9	62.8	0	0	0	111.1	A488	A488-H490 PolarHBondContact O-N 3.43Å
491	V	43.7	Very low	41.4	Very low	100 Å²	100	122.6 Å²	122.6	61%	0.606	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-102.1	130	155.7	-178.8	0	0	0	0	106.7	V489 G493	V489-V491 PolarHBondContact O-N 2.68Å; V491-G493 PolarHBondContact O-N 2.67Å
492	Q	30.1	Very low	43.1	Very low	197 Å²	197	113.3 Å²	113.3	92%	0.921	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	121.5	-179.3	-75.8	-178.7	-34.5	0	0	110.9
493	G	45.3	Very low	44.8	Very low	78 Å²	78	111.2 Å²	111.2	80%	0.804	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	127.7	-15.4	162.2	0	0	0	0	0	117.6	V491	V491-G493 PolarHBondContact O-N 2.67Å
494	Q	42.8	Very low	46.9	Very low	128 Å²	128	109.4 Å²	109.4	60%	0.598	63%	0.629	S	S	*	*	S	Bend	trans	-145.2	155	177.7	-63.3	-168.7	-4	0	0	113.3	R517	Q494-R517 VanDerWaalsContact CB-NH2 3.35Å
495	E	42.9	Very low	48.9	Very low	153 Å²	153	100.8 Å²	100.8	72%	0.715	59%	0.589	S	S	*	*			trans	-60.2	146.8	179.2	-66.3	-167.4	126	0	0	113.2	L497 R517	E495-L497 PolarHBondContact O-N 2.82Å; E495-R517 VanDerWaalsContact O-CZ 3.29Å; E495-R517 PolarHBondContact O-NH1 2.93Å; E495-R517 PolarHBondContact O-NH2 2.8Å
496	P	53.1	Low	51	Low	72 Å²	72	95.1 Å²	95.1	47%	0.468	57%	0.568	S	S	.	*			trans	-67.3	121.9	179.9	27.8	-34.4	0	0	0	111.3	A488 T498	A488-P496 HydrophobicContact CB-CB 4.36Å; P496-T498 VanDerWaalsContact C-N 3.3Å; P496-T498 PolarHBondContact O-N 2.85Å
497	L	56.3	Low	52.9	Low	40 Å²	40	91.3 Å²	91.3	21%	0.209	56%	0.559	C	S	.	*			trans	-73.1	84.2	176.7	-113.8	155.9	0	0	0	109.6	E495 M501 L502 M513 R517	E495-L497 PolarHBondContact O-N 2.82Å; L497-M501 HydrophobicContact CD2-CB 4.5Å; L497-L502 HydrophobicContact CB-CD1 4.39Å; L497-L502 HydrophobicContact CD2-CD1 3.62Å; L497-L502 HydrophobicContact CD2-CG 3.79Å; L497-M513 HydrophobicContact CD1-CB 4.08Å; L497-M513 HydrophobicContact CD2-CB 4.34Å; L497-M513 HydrophobicContact CD2-SD 4.03Å; L497-R517 HydrophobicContact CD1-CG 3.69Å
498	T	63.4	Low	54.8	Low	69 Å²	69	93.3 Å²	93.3	42%	0.423	56%	0.557	S	S	.	*			trans	-65.8	145.3	179	68	0	0	0	0	110.7	P496 S500 M501	P496-T498 VanDerWaalsContact C-N 3.3Å; P496-T498 PolarHBondContact O-N 2.85Å; T498-S500 PolarHBondContact O-N 3.24Å; T498-M501 PolarHBondContact O-N 3.2Å; T498-M501 WeakPolarHBondContact OG1-CG 3.31Å
499	A	58.4	Low	56.9	Low	70 Å²	70	95.4 Å²	95.4	58%	0.579	56%	0.556	S	S	*	*	H	α-helix	trans	-54.8	-24.3	178	0	0	0	0	0	113.5	A503	A499-A503 WeakPolarHBondContact O-CB 3.13Å; A499-A503 PolarHBondContact O-N 2.84Å; A499-A503 VanDerWaalsContact O-N 3.13Å
500	S	56.2	Low	59.1	Low	95 Å²	95	91.9 Å²	91.9	66%	0.664	53%	0.532	S	S	*	.	H	α-helix	trans	-69.2	-29.6	174.6	-165.9	0	0	0	0	113.8	T498 S504	T498-S500 PolarHBondContact O-N 3.24Å; S500-S504 PolarHBondContact O-OG 2.79Å
501	M	64.1	Low	61.3	Low	88 Å²	88	86.9 Å²	86.9	43%	0.433	51%	0.508	S	S	.	.	H	α-helix	trans	-78.2	-41.5	179.4	-67.3	166.4	73.6	0	0	111.3	L497 T498 S504	L497-M501 HydrophobicContact CD2-CB 4.5Å; T498-M501 PolarHBondContact O-N 3.2Å; T498-M501 WeakPolarHBondContact OG1-CG 3.31Å; M501-S504 PolarHBondContact O-N 2.84Å; M501-S504 PolarHBondContact O-OG 3.11Å
502	L	63.4	Low	63.1	Low	6 Å²	6	87.7 Å²	87.7	3%	0.031	51%	0.506	C	S	.	.	H	α-helix	trans	-61.4	-44.5	172.1	-70.3	111.9	0	0	0	111.3	L497 S504 A505 Q510 L514 L546	L497-L502 HydrophobicContact CB-CD1 4.39Å; L497-L502 HydrophobicContact CD2-CD1 3.62Å; L497-L502 HydrophobicContact CD2-CG 3.79Å; L502-S504 PolarHBondContact O-N 2.91Å; L502-S504 VanDerWaalsContact O-N 3.14Å; L502-A505 PolarHBondContact O-N 2.97Å; L502-A505 VanDerWaalsContact O-N 3.1Å; L502-Q510 VanDerWaalsContact O-CD 3.3Å; L502-Q510 VanDerWaalsContact O-CG 3.26Å; L502-Q510 WeakPolarHBondContact O-CG 3.36Å; L502-Q510 PolarHBondContact O-NE2 3.14Å; L502-Q510 VanDerWaalsContact O-NE2 3.14Å; L502-L514 HydrophobicContact CD2-CD1 4.1Å; L502-L514 HydrophobicContact CD2-CD2 3.72Å; L502-L514 HydrophobicContact CD2-CG 3.67Å; L502-L546 HydrophobicContact CD1-CD2 3.85Å; L502-L546 HydrophobicContact CD2-CD2 4.44Å
503	A	64.7	Low	65.5	Low	81 Å²	81	80.5 Å²	80.5	67%	0.669	47%	0.472	S	S	*	.	H	α-helix	trans	-61.8	-21.7	-179	0	0	0	0	0	114.4	A499	A499-A503 WeakPolarHBondContact O-CB 3.13Å; A499-A503 PolarHBondContact O-N 2.84Å; A499-A503 VanDerWaalsContact O-N 3.13Å
504	S	72.4	Confident	67.3	Low	85 Å²	85	76.9 Å²	76.9	59%	0.594	44%	0.435	S	S	*	.	H	α-helix	trans	-86.7	-20.9	175.5	41.8	0	0	0	0	115.1	S500 M501 L502	S500-S504 PolarHBondContact O-OG 2.79Å; M501-S504 PolarHBondContact O-N 2.84Å; M501-S504 PolarHBondContact O-OG 3.11Å; L502-S504 PolarHBondContact O-N 2.91Å; L502-S504 VanDerWaalsContact O-N 3.14Å
505	A	71.5	Confident	69.2	Low	16 Å²	16	71.2 Å²	71.2	13%	0.132	41%	0.41	C	S	.	.	S	Bend	trans	-85.4	152.4	-174	0	0	0	0	0	112.8	L502 E509 Q510 M513	L502-A505 PolarHBondContact O-N 2.97Å; L502-A505 VanDerWaalsContact O-N 3.1Å; A505-E509 HydrophobicContact CB-CB 4.26Å; A505-Q510 HydrophobicContact CB-CG 4.09Å; A505-Q510 PolarHBondContact O-NE2 3.07Å; A505-M513 HydrophobicContact CB-CE 3.46Å; A505-M513 VanDerWaalsContact CB-CE 3.46Å
506	P	76.9	Confident	71.3	Confident	62 Å²	62	68.8 Å²	68.8	40%	0.403	40%	0.399	S	S	.	.			trans	-54	148.2	167.9	-26.5	36.4	0	0	0	112.9	Q508 E509 Q510	P506-Q508 PolarHBondContact O-N 2.78Å; P506-E509 WeakPolarHBondContact CD-OE2 3.24Å; P506-E509 WeakPolarHBondContact CG-OE1 3.4Å; P506-E509 PolarHBondContact O-N 3.45Å; P506-Q510 WeakPolarHBondContact O-CG 3.34Å; P506-Q510 PolarHBondContact O-N 3.36Å
507	P	71.8	Confident	72.7	Confident	99 Å²	99	68.4 Å²	68.4	64%	0.643	39%	0.388	S	S	*	.	H	α-helix	trans	-57.4	-29.2	-174.7	-27.5	35.6	0	0	0	115.2	K511	P507-K511 PolarHBondContact O-N 2.84Å
508	Q	73.1	Confident	74.1	Confident	174 Å²	174	66.5 Å²	66.5	81%	0.813	38%	0.378	S	S	*	.	H	α-helix	trans	-75.7	-40.1	178.7	-164.9	163.7	-7.7	0	0	111.8	P506 K511 Q512	P506-Q508 PolarHBondContact O-N 2.78Å; Q508-K511 PolarHBondContact O-N 3.44Å; Q508-Q512 PolarHBondContact O-N 3.35Å; Q508-Q512 VanDerWaalsContact O-N 3.13Å
509	E	77.6	Confident	75.3	Confident	107 Å²	107	66.8 Å²	66.8	50%	0.5	37%	0.374	S	S	.	.	H	α-helix	trans	-67.1	-35.3	171.7	-70.2	171.9	-142.8	0	0	111.8	A505 P506 K511 Q512 M513	A505-E509 HydrophobicContact CB-CB 4.26Å; P506-E509 WeakPolarHBondContact CD-OE2 3.24Å; P506-E509 WeakPolarHBondContact CG-OE1 3.4Å; P506-E509 PolarHBondContact O-N 3.45Å; E509-K511 VanDerWaalsContact C-N 3.34Å; E509-K511 PolarHBondContact O-N 3.24Å; E509-Q512 PolarHBondContact O-N 2.99Å; E509-M513 WeakPolarHBondContact O-CG 3.27Å; E509-M513 PolarHBondContact O-N 3.19Å
510	Q	78.4	Confident	76.6	Confident	37 Å²	37	66.8 Å²	66.8	17%	0.173	37%	0.368	C	S	.	.	H	α-helix	trans	-57.2	-46.4	173.2	-69	178.5	28	0	0	111.8	L502 A505 P506 M513 L514 N542	L502-Q510 VanDerWaalsContact O-CD 3.3Å; L502-Q510 VanDerWaalsContact O-CG 3.26Å; L502-Q510 WeakPolarHBondContact O-CG 3.36Å; L502-Q510 PolarHBondContact O-NE2 3.14Å; L502-Q510 VanDerWaalsContact O-NE2 3.14Å; A505-Q510 HydrophobicContact CB-CG 4.09Å; A505-Q510 PolarHBondContact O-NE2 3.07Å; P506-Q510 WeakPolarHBondContact O-CG 3.34Å; P506-Q510 PolarHBondContact O-N 3.36Å; Q510-M513 PolarHBondContact O-N 2.79Å; Q510-L514 WeakPolarHBondContact O-CG 3.47Å; Q510-L514 PolarHBondContact O-N 3.05Å; Q510-N542 PolarHBondContact OE1-ND2 3.22Å
511	K	81.4	Confident	78	Confident	68 Å²	68	65.3 Å²	65.3	30%	0.296	35%	0.352	S	S	.	.	H	α-helix	trans	-68.9	-33.8	178.2	-71.3	-165.2	165	-152.9	0	112.2	P507 Q508 E509 G515 L538 E539 I540 N542	P507-K511 PolarHBondContact O-N 2.84Å; Q508-K511 PolarHBondContact O-N 3.44Å; E509-K511 VanDerWaalsContact C-N 3.34Å; E509-K511 PolarHBondContact O-N 3.24Å; K511-G515 PolarHBondContact O-N 2.74Å; K511-L538 HydrophobicContact CB-CD2 4.5Å; K511-L538 VanDerWaalsContact CD-O 3.3Å; K511-L538 WeakPolarHBondContact CD-O 3.34Å; K511-L538 VanDerWaalsContact CE-O 3.32Å; K511-L538 WeakPolarHBondContact CE-O 3.41Å; K511-L538 PolarHBondContact NZ-O 2.98Å; K511-L538 VanDerWaalsContact O-CD2 3.22Å; K511-L538 WeakPolarHBondContact O-CD2 3.38Å; K511-E539 PolarHBondContact NZ-O 3.34Å; K511-I540 PolarHBondContact NZ-O 3.43Å; K511-N542 WeakPolarHBondContact CE-OD1 3.32Å
512	Q	82.3	Confident	79.1	Confident	117 Å²	117	61.1 Å²	61.1	55%	0.547	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-50.4	171.5	-177.2	174.6	-19.2	0	0	112.2	Q508 E509 L514 G515 E516	Q508-Q512 PolarHBondContact O-N 3.35Å; Q508-Q512 VanDerWaalsContact O-N 3.13Å; E509-Q512 PolarHBondContact O-N 2.99Å; Q512-L514 VanDerWaalsContact C-N 3.32Å; Q512-L514 PolarHBondContact O-N 2.95Å; Q512-G515 WeakPolarHBondContact O-CA 3.15Å; Q512-G515 PolarHBondContact O-N 2.75Å; Q512-E516 HydrophobicContact CG-CG 4.5Å; Q512-E516 VanDerWaalsContact CG-OE1 3.31Å; Q512-E516 WeakPolarHBondContact CG-OE1 3.47Å; Q512-E516 PolarHBondContact NE2-OE1 3.09Å; Q512-E516 PolarHBondContact O-N 2.71Å
513	M	78.7	Confident	80.3	Confident	46 Å²	46	65 Å²	65	23%	0.227	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-36.2	179.2	-72.3	-173	-68.6	0	0	113.2	L497 A505 E509 Q510	L497-M513 HydrophobicContact CD1-CB 4.08Å; L497-M513 HydrophobicContact CD2-CB 4.34Å; L497-M513 HydrophobicContact CD2-SD 4.03Å; A505-M513 HydrophobicContact CB-CE 3.46Å; A505-M513 VanDerWaalsContact CB-CE 3.46Å; E509-M513 WeakPolarHBondContact O-CG 3.27Å; E509-M513 PolarHBondContact O-N 3.19Å; Q510-M513 PolarHBondContact O-N 2.79Å
514	L	83.6	Confident	81.4	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-66.5	-41	171.3	-71	169.7	0	0	0	111.2	L502 Q510 Q512 R517 L518 L538 N542 L545 L546 L549	L502-L514 HydrophobicContact CD2-CD1 4.1Å; L502-L514 HydrophobicContact CD2-CD2 3.72Å; L502-L514 HydrophobicContact CD2-CG 3.67Å; Q510-L514 WeakPolarHBondContact O-CG 3.47Å; Q510-L514 PolarHBondContact O-N 3.05Å; Q512-L514 VanDerWaalsContact C-N 3.32Å; Q512-L514 PolarHBondContact O-N 2.95Å; L514-R517 PolarHBondContact O-N 3.05Å; L514-L518 HydrophobicContact CB-CD1 4.42Å; L514-L518 WeakPolarHBondContact O-CB 3.36Å; L514-L518 VanDerWaalsContact O-CG 3.31Å; L514-L518 WeakPolarHBondContact O-CG 3.17Å; L514-L518 PolarHBondContact O-N 2.81Å; L514-L538 HydrophobicContact CB-CD2 4.01Å; L514-N542 HydrophobicContact CD1-CB 3.96Å; L514-L545 HydrophobicContact CD1-CB 4.06Å; L514-L545 HydrophobicContact CD1-CD1 4.02Å; L514-L545 HydrophobicContact CD2-CB 4.45Å; L514-L546 HydrophobicContact CD2-CD2 3.89Å; L514-L546 HydrophobicContact CD2-CG 4.14Å; L514-L549 HydrophobicContact CD2-CD1 3.68Å
515	G	84.1	Confident	82	Confident	8 Å²	8	64.3 Å²	64.3	8%	0.082	34%	0.339	C	S	.	.	H	α-helix	trans	-60.8	-46.5	178.4	0	0	0	0	0	112.9	K511 Q512 R517 L518 F519	K511-G515 PolarHBondContact O-N 2.74Å; Q512-G515 WeakPolarHBondContact O-CA 3.15Å; Q512-G515 PolarHBondContact O-N 2.75Å; G515-R517 PolarHBondContact O-N 2.86Å; G515-L518 PolarHBondContact O-N 2.8Å; G515-F519 WeakPolarHBondContact O-CB 2.93Å; G515-F519 PolarHBondContact O-N 2.86Å
516	E	86.4	Confident	82.7	Confident	103 Å²	103	66 Å²	66	48%	0.481	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-22.5	178.5	-70.9	173.4	-166.6	0	0	113.2	Q512 P520	Q512-E516 HydrophobicContact CG-CG 4.5Å; Q512-E516 VanDerWaalsContact CG-OE1 3.31Å; Q512-E516 WeakPolarHBondContact CG-OE1 3.47Å; Q512-E516 PolarHBondContact NE2-OE1 3.09Å; Q512-E516 PolarHBondContact O-N 2.71Å; E516-P520 VanDerWaalsContact O-CD 3.27Å; E516-P520 WeakPolarHBondContact O-CD 3.36Å
517	R	82.2	Confident	83.1	Confident	63 Å²	63	67.5 Å²	67.5	24%	0.238	35%	0.354	C	S	.	.	H	α-helix	trans	-95.4	-31.3	174.9	-64.5	-60.9	174.7	87.8	3.3	114.4	Q494 E495 L497 L514 G515 L549	Q494-R517 VanDerWaalsContact CB-NH2 3.35Å; E495-R517 VanDerWaalsContact O-CZ 3.29Å; E495-R517 PolarHBondContact O-NH1 2.93Å; E495-R517 PolarHBondContact O-NH2 2.8Å; L497-R517 HydrophobicContact CD1-CG 3.69Å; L514-R517 PolarHBondContact O-N 3.05Å; G515-R517 PolarHBondContact O-N 2.86Å; R517-L549 HydrophobicContact CB-CD1 4.33Å; R517-L549 HydrophobicContact CB-CD2 4.01Å
518	L	85.3	Confident	83.8	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-76.1	-40.6	175.5	-72.5	165	0	0	0	111.7	L514 G515 L521 I522 T534 L538 L545 M548 L549 L555	L514-L518 HydrophobicContact CB-CD1 4.42Å; L514-L518 WeakPolarHBondContact O-CB 3.36Å; L514-L518 VanDerWaalsContact O-CG 3.31Å; L514-L518 WeakPolarHBondContact O-CG 3.17Å; L514-L518 PolarHBondContact O-N 2.81Å; G515-L518 PolarHBondContact O-N 2.8Å; L518-L521 PolarHBondContact O-N 3Å; L518-L521 VanDerWaalsContact O-N 3.16Å; L518-I522 HydrophobicContact CB-CD1 3.89Å; L518-I522 WeakPolarHBondContact O-CD1 3.18Å; L518-I522 VanDerWaalsContact O-CG1 3.24Å; L518-I522 WeakPolarHBondContact O-CG1 3.36Å; L518-I522 PolarHBondContact O-N 2.89Å; L518-T534 HydrophobicContact CB-CG2 4.35Å; L518-L538 HydrophobicContact CD1-CD2 4.45Å; L518-L545 HydrophobicContact CD1-CB 4.43Å; L518-L545 HydrophobicContact CD1-CD2 3.8Å; L518-M548 HydrophobicContact CD2-CE 4.36Å; L518-L549 HydrophobicContact CD2-CD2 3.71Å; L518-L549 HydrophobicContact CD2-CG 3.93Å; L518-L549 HydrophobicContact CG-CD2 3.99Å; L518-L549 HydrophobicContact CG-CG 4.27Å; L518-L555 HydrophobicContact CD2-CD1 3.78Å; L518-L555 HydrophobicContact CD2-CD2 4.46Å
519	F	87.8	Confident	84.4	Confident	76 Å²	76	62.4 Å²	62.4	33%	0.333	33%	0.332	S	S	.	.	H	α-helix	trans	-54.8	-47.8	-174.1	-179.8	-89	0	0	0	113.9	G515 L521 I522 Q523 A530 T534	G515-F519 WeakPolarHBondContact O-CB 2.93Å; G515-F519 PolarHBondContact O-N 2.86Å; F519-L521 VanDerWaalsContact C-N 3.34Å; F519-L521 PolarHBondContact O-N 2.82Å; F519-I522 PolarHBondContact O-N 2.67Å; F519-Q523 HydrophobicContact CE1-CB 4.45Å; F519-Q523 VanDerWaalsContact CE1-OE1 3.26Å; F519-Q523 VanDerWaalsContact O-CB 3.23Å; F519-Q523 WeakPolarHBondContact O-CB 3.36Å; F519-Q523 PolarHBondContact O-N 3.48Å; F519-A530 HydrophobicContact CD2-CB 4.42Å; F519-A530 HydrophobicContact CE2-CB 4.03Å; F519-A530 HydrophobicContact CZ-CB 4.43Å; F519-T534 HydrophobicContact CB-CG2 4.14Å
520	P	86.6	Confident	84.8	Confident	70 Å²	70	57.4 Å²	57.4	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-35.9	180	-21.2	34.5	0	0	0	113	E516 Q523 A524	E516-P520 VanDerWaalsContact O-CD 3.27Å; E516-P520 WeakPolarHBondContact O-CD 3.36Å; P520-Q523 PolarHBondContact O-N 2.92Å; P520-A524 PolarHBondContact O-N 2.88Å
521	L	86.4	Confident	85.1	Confident	63 Å²	63	57.8 Å²	57.8	33%	0.33	32%	0.322	S	S	.	.	H	α-helix	trans	-68.2	-40.6	177.9	-60.3	174.7	0	0	0	111.2	L518 F519 L549 L555	L518-L521 PolarHBondContact O-N 3Å; L518-L521 VanDerWaalsContact O-N 3.16Å; F519-L521 VanDerWaalsContact C-N 3.34Å; F519-L521 PolarHBondContact O-N 2.82Å; L521-L549 HydrophobicContact CD1-CD2 3.96Å; L521-L555 HydrophobicContact CB-CD2 3.74Å; L521-L555 HydrophobicContact CD1-CD2 3.9Å; L521-L555 HydrophobicContact CG-CD2 4.47Å
522	I	87.1	Confident	85.3	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-70.7	-38.2	175.8	-61.9	162.5	0	0	0	110.5	L518 F519 A524 M525 H526 A530 I533 T534 L537 L555 V559	L518-I522 HydrophobicContact CB-CD1 3.89Å; L518-I522 WeakPolarHBondContact O-CD1 3.18Å; L518-I522 VanDerWaalsContact O-CG1 3.24Å; L518-I522 WeakPolarHBondContact O-CG1 3.36Å; L518-I522 PolarHBondContact O-N 2.89Å; F519-I522 PolarHBondContact O-N 2.67Å; I522-A524 VanDerWaalsContact C-N 3.31Å; I522-A524 PolarHBondContact O-N 3.32Å; I522-M525 PolarHBondContact O-N 3.13Å; I522-H526 PolarHBondContact O-N 3.34Å; I522-A530 HydrophobicContact CG2-CB 4.17Å; I522-I533 HydrophobicContact CD1-CG2 4.36Å; I522-I533 HydrophobicContact CG2-CB 3.85Å; I522-I533 HydrophobicContact CG2-CD1 4.2Å; I522-I533 HydrophobicContact CG2-CG2 3.6Å; I522-T534 HydrophobicContact CD1-CG2 4.33Å; I522-T534 WeakPolarHBondContact CD1-OG1 3.3Å; I522-L537 HydrophobicContact CD1-CD1 3.72Å; I522-L537 HydrophobicContact CG1-CD1 4.47Å; I522-L555 HydrophobicContact CG1-CD1 4.27Å; I522-V559 HydrophobicContact CG1-CG2 3.86Å; I522-V559 HydrophobicContact CG2-CG2 4.36Å
523	Q	88.9	Confident	85.5	Confident	89 Å²	89	55 Å²	55	42%	0.416	31%	0.309	S	S	.	.	H	α-helix	trans	-64.8	-34	177.6	-168.8	179.9	17.1	0	0	112.3	F519 P520 M525 P527 A530	F519-Q523 HydrophobicContact CE1-CB 4.45Å; F519-Q523 VanDerWaalsContact CE1-OE1 3.26Å; F519-Q523 VanDerWaalsContact O-CB 3.23Å; F519-Q523 WeakPolarHBondContact O-CB 3.36Å; F519-Q523 PolarHBondContact O-N 3.48Å; P520-Q523 PolarHBondContact O-N 2.92Å; Q523-M525 PolarHBondContact O-N 3Å; Q523-P527 WeakPolarHBondContact O-CD 3.32Å; Q523-P527 WeakPolarHBondContact O-CG 3.48Å; Q523-A530 HydrophobicContact CB-CB 3.87Å; Q523-A530 HydrophobicContact CG-CB 4.23Å
524	A	86.2	Confident	86	Confident	91 Å²	91	53.1 Å²	53.1	75%	0.752	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-19.3	171.7	0	0	0	0	0	113.8	P520 I522	P520-A524 PolarHBondContact O-N 2.88Å; I522-A524 VanDerWaalsContact C-N 3.31Å; I522-A524 PolarHBondContact O-N 3.32Å
525	M	86	Confident	86.1	Confident	60 Å²	60	54.8 Å²	54.8	30%	0.296	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-49.8	174.8	-66.5	-179.6	55.1	0	0	113	I522 Q523 R556 V559	I522-M525 PolarHBondContact O-N 3.13Å; Q523-M525 PolarHBondContact O-N 3Å; M525-R556 HydrophobicContact CE-CB 4.2Å; M525-R556 HydrophobicContact CE-CG 3.74Å; M525-R556 HydrophobicContact SD-CG 3.67Å; M525-V559 HydrophobicContact CE-CB 4Å; M525-V559 HydrophobicContact CE-CG1 3.66Å; M525-V559 HydrophobicContact SD-CB 4.42Å; M525-V559 HydrophobicContact SD-CG1 4.25Å; M525-V559 HydrophobicContact SD-CG2 4.48Å
526	H	85.5	Confident	86.1	Confident	51 Å²	51	57.1 Å²	57.1	24%	0.236	33%	0.327	C	S	.	.			trans	-133.7	78.1	-175.2	-62.7	-79.7	0	0	0	111.6	I522 T528 L529 A530 I533 V559	I522-H526 PolarHBondContact O-N 3.34Å; H526-T528 PolarHBondContact O-N 3.4Å; H526-L529 PolarHBondContact O-N 3.11Å; H526-L529 VanDerWaalsContact O-N 3.12Å; H526-A530 PolarHBondContact O-N 3.36Å; H526-I533 HydrophobicContact CB-CD1 3.87Å; H526-V559 WeakPolarHBondContact CD2-CG1 3.34Å
527	P	86.4	Confident	86.1	Confident	93 Å²	93	52.4 Å²	52.4	60%	0.604	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.5	-174.3	-26.7	32.3	0	0	0	114.8	Q523	Q523-P527 WeakPolarHBondContact O-CD 3.32Å; Q523-P527 WeakPolarHBondContact O-CG 3.48Å
528	T	85.5	Confident	86.3	Confident	132 Å²	132	51.1 Å²	51.1	81%	0.81	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-18.8	-175.6	51.6	0	0	0	0	114.7	H526	H526-T528 PolarHBondContact O-N 3.4Å
529	L	86.8	Confident	86.4	Confident	34 Å²	34	58.7 Å²	58.7	18%	0.178	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-5.3	-175.5	-66	178.7	0	0	0	113.5	H526 G531 K532 I533	H526-L529 PolarHBondContact O-N 3.11Å; H526-L529 VanDerWaalsContact O-N 3.12Å; L529-G531 VanDerWaalsContact C-N 3.3Å; L529-G531 PolarHBondContact O-N 2.84Å; L529-G531 VanDerWaalsContact O-N 3.11Å; L529-K532 PolarHBondContact O-N 3.35Å; L529-I533 HydrophobicContact CB-CD1 3.58Å; L529-I533 HydrophobicContact CB-CG1 4.07Å; L529-I533 WeakPolarHBondContact O-CG1 3.45Å; L529-I533 PolarHBondContact O-N 3.18Å
530	A	84.4	Confident	86.2	Confident	2 Å²	2	56.9 Å²	56.9	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-48.9	-42.8	-171.3	0	0	0	0	0	114.9	F519 I522 Q523 H526 T534	F519-A530 HydrophobicContact CD2-CB 4.42Å; F519-A530 HydrophobicContact CE2-CB 4.03Å; F519-A530 HydrophobicContact CZ-CB 4.43Å; I522-A530 HydrophobicContact CG2-CB 4.17Å; Q523-A530 HydrophobicContact CB-CB 3.87Å; Q523-A530 HydrophobicContact CG-CB 4.23Å; H526-A530 PolarHBondContact O-N 3.36Å; A530-T534 VanDerWaalsContact O-CB 3.3Å; A530-T534 WeakPolarHBondContact O-CB 3.25Å; A530-T534 PolarHBondContact O-N 2.92Å; A530-T534 PolarHBondContact O-OG1 3.41Å
531	G	85.2	Confident	86.1	Confident	45 Å²	45	59.2 Å²	59.2	46%	0.464	34%	0.34	S	S	.	.	H	α-helix	trans	-64.2	-41.6	178.1	0	0	0	0	0	113.6	L529 G535	L529-G531 VanDerWaalsContact C-N 3.3Å; L529-G531 PolarHBondContact O-N 2.84Å; L529-G531 VanDerWaalsContact O-N 3.11Å; G531-G535 PolarHBondContact O-N 3.05Å
532	K	85.8	Confident	85.9	Confident	127 Å²	127	57.8 Å²	57.8	55%	0.552	33%	0.333	S	S	*	.	H	α-helix	trans	-71.5	-42.5	177.6	-66.6	-170.8	177.8	-174.1	0	111.6	L529 G535 M536 L566	L529-K532 PolarHBondContact O-N 3.35Å; K532-G535 PolarHBondContact O-N 2.86Å; K532-M536 WeakPolarHBondContact O-CG 3.45Å; K532-M536 PolarHBondContact O-N 3.18Å; K532-L566 HydrophobicContact CB-CD1 3.87Å; K532-L566 HydrophobicContact CB-CD2 4.08Å; K532-L566 HydrophobicContact CD-CD2 4.16Å
533	I	87.4	Confident	85.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-47.4	176.3	-63.6	163.3	0	0	0	110.2	I522 H526 L529 G535 M536 L537 V559 A562 V563 L566	I522-I533 HydrophobicContact CD1-CG2 4.36Å; I522-I533 HydrophobicContact CG2-CB 3.85Å; I522-I533 HydrophobicContact CG2-CD1 4.2Å; I522-I533 HydrophobicContact CG2-CG2 3.6Å; H526-I533 HydrophobicContact CB-CD1 3.87Å; L529-I533 HydrophobicContact CB-CD1 3.58Å; L529-I533 HydrophobicContact CB-CG1 4.07Å; L529-I533 WeakPolarHBondContact O-CG1 3.45Å; L529-I533 PolarHBondContact O-N 3.18Å; I533-G535 PolarHBondContact O-N 3.08Å; I533-M536 PolarHBondContact O-N 3.39Å; I533-L537 HydrophobicContact CG2-CD1 3.79Å; I533-L537 HydrophobicContact CG2-CG 4.29Å; I533-L537 WeakPolarHBondContact O-CB 3.25Å; I533-L537 VanDerWaalsContact O-CG 3.29Å; I533-L537 WeakPolarHBondContact O-CG 3.33Å; I533-L537 PolarHBondContact O-N 3.23Å; I533-V559 HydrophobicContact CD1-CG1 4.45Å; I533-V559 HydrophobicContact CG2-CG1 4.3Å; I533-V559 HydrophobicContact CG2-CG2 4.14Å; I533-A562 HydrophobicContact CG2-CB 4.04Å; I533-V563 HydrophobicContact CD1-CG2 3.57Å; I533-V563 HydrophobicContact CG1-CG2 4.25Å; I533-L566 HydrophobicContact CG1-CD1 3.66Å
534	T	87.3	Confident	85.2	Confident	7 Å²	7	61.5 Å²	61.5	4%	0.043	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-43.8	177.6	-50.2	0	0	0	0	110.8	L518 F519 I522 A530 M536 L537 L538	L518-T534 HydrophobicContact CB-CG2 4.35Å; F519-T534 HydrophobicContact CB-CG2 4.14Å; I522-T534 HydrophobicContact CD1-CG2 4.33Å; I522-T534 WeakPolarHBondContact CD1-OG1 3.3Å; A530-T534 VanDerWaalsContact O-CB 3.3Å; A530-T534 WeakPolarHBondContact O-CB 3.25Å; A530-T534 PolarHBondContact O-N 2.92Å; A530-T534 PolarHBondContact O-OG1 3.41Å; T534-M536 PolarHBondContact O-N 3.47Å; T534-L537 PolarHBondContact O-N 3.08Å; T534-L538 HydrophobicContact CG2-CD1 4.18Å; T534-L538 HydrophobicContact CG2-CG 4.31Å; T534-L538 WeakPolarHBondContact O-CB 3.36Å; T534-L538 VanDerWaalsContact O-CG 3.27Å; T534-L538 WeakPolarHBondContact O-CG 3.33Å; T534-L538 PolarHBondContact O-N 2.75Å
535	G	86.8	Confident	85.1	Confident	36 Å²	36	57.1 Å²	57.1	37%	0.371	32%	0.324	S	S	.	.	H	α-helix	trans	-55.8	-48.5	175.5	0	0	0	0	0	112.9	G531 K532 I533 L538	G531-G535 PolarHBondContact O-N 3.05Å; K532-G535 PolarHBondContact O-N 2.86Å; I533-G535 PolarHBondContact O-N 3.08Å; G535-L538 PolarHBondContact O-N 2.84Å
536	M	84	Confident	84.8	Confident	58 Å²	58	56.2 Å²	56.2	29%	0.286	32%	0.32	S	S	.	.	H	α-helix	trans	-65.9	-41.5	176.9	-70.6	174.4	63	0	0	112.9	K532 I533 T534 L538 E539 V565 L566	K532-M536 WeakPolarHBondContact O-CG 3.45Å; K532-M536 PolarHBondContact O-N 3.18Å; I533-M536 PolarHBondContact O-N 3.39Å; T534-M536 PolarHBondContact O-N 3.47Å; M536-L538 VanDerWaalsContact C-N 3.28Å; M536-L538 PolarHBondContact O-N 3.44Å; M536-E539 WeakPolarHBondContact O-CB 3.24Å; M536-E539 PolarHBondContact O-N 3.33Å; M536-E539 VanDerWaalsContact O-N 3.1Å; M536-V565 HydrophobicContact CE-CB 4.04Å; M536-V565 HydrophobicContact CE-CG1 3.72Å; M536-L566 HydrophobicContact SD-CD1 4.08Å; M536-L566 HydrophobicContact SD-CD2 3.65Å; M536-L566 HydrophobicContact SD-CG 3.63Å
537	L	85.6	Confident	84.6	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-64.9	-35.5	176.8	-68.1	175	0	0	0	110.7	I522 I533 T534 E539 I540 L545 M548 L555 K558 V559	I522-L537 HydrophobicContact CD1-CD1 3.72Å; I522-L537 HydrophobicContact CG1-CD1 4.47Å; I533-L537 HydrophobicContact CG2-CD1 3.79Å; I533-L537 HydrophobicContact CG2-CG 4.29Å; I533-L537 WeakPolarHBondContact O-CB 3.25Å; I533-L537 VanDerWaalsContact O-CG 3.29Å; I533-L537 WeakPolarHBondContact O-CG 3.33Å; I533-L537 PolarHBondContact O-N 3.23Å; T534-L537 PolarHBondContact O-N 3.08Å; L537-E539 PolarHBondContact O-N 3.33Å; L537-E539 VanDerWaalsContact O-N 3.1Å; L537-I540 HydrophobicContact CD2-CD1 3.65Å; L537-I540 WeakPolarHBondContact O-CB 3.39Å; L537-I540 WeakPolarHBondContact O-CG1 3.36Å; L537-I540 PolarHBondContact O-N 2.71Å; L537-L545 HydrophobicContact CB-CD2 4.33Å; L537-L545 WeakPolarHBondContact O-CD2 3.3Å; L537-M548 HydrophobicContact CB-CE 4.47Å; L537-M548 HydrophobicContact CD1-CE 3.95Å; L537-M548 HydrophobicContact CD2-CE 4.04Å; L537-M548 HydrophobicContact CG-CE 4.38Å; L537-L555 HydrophobicContact CD1-CD1 4.48Å; L537-K558 HydrophobicContact CD2-CB 4.02Å; L537-V559 HydrophobicContact CD1-CG2 4.01Å
538	L	87.7	Confident	84.3	Confident	35 Å²	35	54.4 Å²	54.4	18%	0.183	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-6.7	173.5	-71.6	178	0	0	0	114.6	K511 L514 L518 T534 G535 M536 L545	K511-L538 HydrophobicContact CB-CD2 4.5Å; K511-L538 VanDerWaalsContact CD-O 3.3Å; K511-L538 WeakPolarHBondContact CD-O 3.34Å; K511-L538 VanDerWaalsContact CE-O 3.32Å; K511-L538 WeakPolarHBondContact CE-O 3.41Å; K511-L538 PolarHBondContact NZ-O 2.98Å; K511-L538 VanDerWaalsContact O-CD2 3.22Å; K511-L538 WeakPolarHBondContact O-CD2 3.38Å; L514-L538 HydrophobicContact CB-CD2 4.01Å; L518-L538 HydrophobicContact CD1-CD2 4.45Å; T534-L538 HydrophobicContact CG2-CD1 4.18Å; T534-L538 HydrophobicContact CG2-CG 4.31Å; T534-L538 WeakPolarHBondContact O-CB 3.36Å; T534-L538 VanDerWaalsContact O-CG 3.27Å; T534-L538 WeakPolarHBondContact O-CG 3.33Å; T534-L538 PolarHBondContact O-N 2.75Å; G535-L538 PolarHBondContact O-N 2.84Å; M536-L538 VanDerWaalsContact C-N 3.28Å; M536-L538 PolarHBondContact O-N 3.44Å; L538-L545 HydrophobicContact CD2-CD1 4.15Å
539	E	85.9	Confident	84.1	Confident	159 Å²	159	50.4 Å²	50.4	74%	0.743	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-23.1	168.3	-60.7	-173.5	165.3	0	0	112.2	K511 M536 L537	K511-E539 PolarHBondContact NZ-O 3.34Å; M536-E539 WeakPolarHBondContact O-CB 3.24Å; M536-E539 PolarHBondContact O-N 3.33Å; M536-E539 VanDerWaalsContact O-N 3.1Å; L537-E539 PolarHBondContact O-N 3.33Å; L537-E539 VanDerWaalsContact O-N 3.1Å
540	I	84.9	Confident	83.8	Confident	39 Å²	39	55.6 Å²	55.6	20%	0.2	30%	0.3	C	S	.	.	S	Bend	trans	-66.8	160.8	179.1	-54.9	176.2	0	0	0	111.4	K511 L537 E544 L545 K558	K511-I540 PolarHBondContact NZ-O 3.43Å; L537-I540 HydrophobicContact CD2-CD1 3.65Å; L537-I540 WeakPolarHBondContact O-CB 3.39Å; L537-I540 WeakPolarHBondContact O-CG1 3.36Å; L537-I540 PolarHBondContact O-N 2.71Å; I540-E544 HydrophobicContact CG2-CB 3.88Å; I540-E544 HydrophobicContact CG2-CG 4.09Å; I540-L545 HydrophobicContact CB-CD2 4.3Å; I540-L545 HydrophobicContact CB-CG 4.34Å; I540-K558 HydrophobicContact CD1-CD 4.34Å
541	D	84.9	Confident	83.8	Confident	119 Å²	119	57 Å²	57	64%	0.636	31%	0.31	S	S	*	.			trans	-60.4	135.1	174.8	-81.5	-44.5	0	0	0	112.9	S543 E544 L545	D541-S543 PolarHBondContact O-N 3.16Å; D541-E544 PolarHBondContact O-N 3.18Å; D541-L545 PolarHBondContact O-N 3.48Å; D541-L545 VanDerWaalsContact O-N 3.14Å
542	N	81.3	Confident	83.5	Confident	33 Å²	33	59.2 Å²	59.2	18%	0.176	32%	0.316	C	S	.	.	H	α-helix	trans	-57.3	-24.7	-177.6	-65.4	4.7	0	0	0	113.4	Q510 K511 L514 L546	Q510-N542 PolarHBondContact OE1-ND2 3.22Å; K511-N542 WeakPolarHBondContact CE-OD1 3.32Å; L514-N542 HydrophobicContact CD1-CB 3.96Å; N542-L546 VanDerWaalsContact O-CG 3.3Å; N542-L546 WeakPolarHBondContact O-CG 3.1Å; N542-L546 PolarHBondContact O-N 3.45Å; N542-L546 VanDerWaalsContact O-N 3.13Å
543	S	79.6	Confident	83.4	Confident	90 Å²	90	60.6 Å²	60.6	63%	0.629	32%	0.324	S	S	*	.	H	α-helix	trans	-76.4	-33.6	176.5	53.2	0	0	0	0	113.8	D541 H547	D541-S543 PolarHBondContact O-N 3.16Å; S543-H547 PolarHBondContact O-N 2.82Å
544	E	81.8	Confident	83.3	Confident	76 Å²	76	62 Å²	62	36%	0.355	33%	0.334	S	S	.	.	H	α-helix	trans	-74.7	-37.3	173.7	-173.8	171.8	170.2	0	0	110.2	I540 D541 L546 H547 M548 K558	I540-E544 HydrophobicContact CG2-CB 3.88Å; I540-E544 HydrophobicContact CG2-CG 4.09Å; D541-E544 PolarHBondContact O-N 3.18Å; E544-L546 VanDerWaalsContact C-N 3.33Å; E544-L546 PolarHBondContact O-N 3.42Å; E544-H547 PolarHBondContact O-N 2.97Å; E544-M548 HydrophobicContact CG-SD 4.39Å; E544-M548 WeakPolarHBondContact O-CG 3.5Å; E544-M548 PolarHBondContact O-N 3.2Å; E544-K558 WeakPolarHBondContact OE1-CE 3.43Å; E544-K558 IonicContact OE1-NZ 2.62Å
545	L	83.1	Confident	83.3	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-62.1	-35.9	173.1	-66.7	176.7	0	0	0	113.4	L514 L518 L537 L538 I540 D541 M548 L549	L514-L545 HydrophobicContact CD1-CB 4.06Å; L514-L545 HydrophobicContact CD1-CD1 4.02Å; L514-L545 HydrophobicContact CD2-CB 4.45Å; L518-L545 HydrophobicContact CD1-CB 4.43Å; L518-L545 HydrophobicContact CD1-CD2 3.8Å; L537-L545 HydrophobicContact CB-CD2 4.33Å; L537-L545 WeakPolarHBondContact O-CD2 3.3Å; L538-L545 HydrophobicContact CD2-CD1 4.15Å; I540-L545 HydrophobicContact CB-CD2 4.3Å; I540-L545 HydrophobicContact CB-CG 4.34Å; D541-L545 PolarHBondContact O-N 3.48Å; D541-L545 VanDerWaalsContact O-N 3.14Å; L545-M548 HydrophobicContact CD2-CE 3.79Å; L545-M548 HydrophobicContact CD2-SD 3.94Å; L545-M548 PolarHBondContact O-N 3.37Å; L545-L549 PolarHBondContact O-N 3.31Å; L545-L549 VanDerWaalsContact O-N 3.13Å
546	L	81.1	Confident	83.3	Confident	41 Å²	41	67.7 Å²	67.7	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-68.4	-42.4	172.1	-75.5	166.9	0	0	0	111.9	L502 L514 N542 E544 M548 L549 E550	L502-L546 HydrophobicContact CD1-CD2 3.85Å; L502-L546 HydrophobicContact CD2-CD2 4.44Å; L514-L546 HydrophobicContact CD2-CD2 3.89Å; L514-L546 HydrophobicContact CD2-CG 4.14Å; N542-L546 VanDerWaalsContact O-CG 3.3Å; N542-L546 WeakPolarHBondContact O-CG 3.1Å; N542-L546 PolarHBondContact O-N 3.45Å; N542-L546 VanDerWaalsContact O-N 3.13Å; E544-L546 VanDerWaalsContact C-N 3.33Å; E544-L546 PolarHBondContact O-N 3.42Å; L546-M548 VanDerWaalsContact C-N 3.27Å; L546-M548 PolarHBondContact O-N 2.93Å; L546-L549 PolarHBondContact O-N 3.45Å; L546-E550 PolarHBondContact O-N 3.29Å
547	H	80.4	Confident	83.6	Confident	104 Å²	104	68.7 Å²	68.7	48%	0.481	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-32.8	174.3	-175.6	-92	0	0	0	112.6	S543 E544 E550 S551 S554	S543-H547 PolarHBondContact O-N 2.82Å; E544-H547 PolarHBondContact O-N 2.97Å; H547-E550 PolarHBondContact O-N 3.19Å; H547-S551 WeakPolarHBondContact O-CB 3.38Å; H547-S551 PolarHBondContact O-N 3.23Å; H547-S554 PolarHBondContact ND1-OG 3.47Å
548	M	81.3	Confident	83.6	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	37%	0.366	C	S	.	.	H	α-helix	trans	-68	-33.1	171.6	-72.7	161.3	48.6	0	0	113.1	L518 L537 E544 L545 L546 S551 L555 K558	L518-M548 HydrophobicContact CD2-CE 4.36Å; L537-M548 HydrophobicContact CB-CE 4.47Å; L537-M548 HydrophobicContact CD1-CE 3.95Å; L537-M548 HydrophobicContact CD2-CE 4.04Å; L537-M548 HydrophobicContact CG-CE 4.38Å; E544-M548 HydrophobicContact CG-SD 4.39Å; E544-M548 WeakPolarHBondContact O-CG 3.5Å; E544-M548 PolarHBondContact O-N 3.2Å; L545-M548 HydrophobicContact CD2-CE 3.79Å; L545-M548 HydrophobicContact CD2-SD 3.94Å; L545-M548 PolarHBondContact O-N 3.37Å; L546-M548 VanDerWaalsContact C-N 3.27Å; L546-M548 PolarHBondContact O-N 2.93Å; M548-S551 CarbonylContact O-C 3.45Å; M548-S551 VanDerWaalsContact O-O 3.08Å; M548-L555 HydrophobicContact CB-CB 4.3Å; M548-L555 HydrophobicContact CB-CD1 4.41Å; M548-L555 HydrophobicContact CE-CD1 3.66Å; M548-K558 HydrophobicContact CE-CB 4.09Å; M548-K558 HydrophobicContact SD-CB 4.15Å; M548-K558 HydrophobicContact SD-CG 3.98Å
549	L	79.9	Confident	83.7	Confident	49 Å²	49	69.2 Å²	69.2	26%	0.257	36%	0.358	S	S	.	.	H	α-helix	trans	-73.1	-29.3	173.1	-73	169.1	0	0	0	112.5	L514 R517 L518 L521 L545 L546	L514-L549 HydrophobicContact CD2-CD1 3.68Å; R517-L549 HydrophobicContact CB-CD1 4.33Å; R517-L549 HydrophobicContact CB-CD2 4.01Å; L518-L549 HydrophobicContact CD2-CD2 3.71Å; L518-L549 HydrophobicContact CD2-CG 3.93Å; L518-L549 HydrophobicContact CG-CD2 3.99Å; L518-L549 HydrophobicContact CG-CG 4.27Å; L521-L549 HydrophobicContact CD1-CD2 3.96Å; L545-L549 PolarHBondContact O-N 3.31Å; L545-L549 VanDerWaalsContact O-N 3.13Å; L546-L549 PolarHBondContact O-N 3.45Å
550	E	81.4	Confident	83.8	Confident	143 Å²	143	65.8 Å²	65.8	67%	0.668	35%	0.345	S	S	*	.	H	α-helix	trans	-79.3	-30.1	173.7	-68.9	177.9	178.2	0	0	113.1	L546 H547	L546-E550 PolarHBondContact O-N 3.29Å; H547-E550 PolarHBondContact O-N 3.19Å
551	S	83.9	Confident	84.1	Confident	31 Å²	31	69 Å²	69	22%	0.217	36%	0.359	C	S	.	.			trans	-121.8	104.7	-176.9	178.7	0	0	0	0	112.8	H547 M548 E553 S554 L555	H547-S551 WeakPolarHBondContact O-CB 3.38Å; H547-S551 PolarHBondContact O-N 3.23Å; M548-S551 CarbonylContact O-C 3.45Å; M548-S551 VanDerWaalsContact O-O 3.08Å; S551-E553 PolarHBondContact O-N 3.05Å; S551-S554 WeakPolarHBondContact O-CB 3.42Å; S551-S554 PolarHBondContact O-N 3.32Å; S551-S554 PolarHBondContact OG-N 2.8Å; S551-L555 PolarHBondContact O-N 3.02Å
552	P	79.8	Confident	84.3	Confident	91 Å²	91	63.7 Å²	63.7	59%	0.591	33%	0.331	S	S	*	.	H	α-helix	trans	-66.4	-22.8	179.9	27.2	-34.7	0	0	0	113.2	R556	P552-R556 WeakPolarHBondContact O-CB 3.37Å; P552-R556 VanDerWaalsContact O-CG 3.24Å; P552-R556 WeakPolarHBondContact O-CG 3.24Å; P552-R556 PolarHBondContact O-N 2.63Å
553	E	82.3	Confident	84.7	Confident	156 Å²	156	62.7 Å²	62.7	73%	0.729	33%	0.327	S	S	*	.	H	α-helix	trans	-71.7	-40.3	171.8	-62.6	-175.3	162.6	0	0	111.4	S551 L555 R556 S557	S551-E553 PolarHBondContact O-N 3.05Å; E553-L555 VanDerWaalsContact C-N 3.35Å; E553-R556 PolarHBondContact O-N 2.86Å; E553-S557 PolarHBondContact O-N 3.47Å
554	S	86.8	Confident	85	Confident	31 Å²	31	61.1 Å²	61.1	22%	0.217	32%	0.319	C	S	.	.	H	α-helix	trans	-64.1	-39.9	174.1	-165.8	0	0	0	0	111.5	H547 S551 K558	H547-S554 PolarHBondContact ND1-OG 3.47Å; S551-S554 WeakPolarHBondContact O-CB 3.42Å; S551-S554 PolarHBondContact O-N 3.32Å; S551-S554 PolarHBondContact OG-N 2.8Å; S554-K558 PolarHBondContact O-N 2.97Å
555	L	87.4	Confident	85.4	Confident	9 Å²	9	61.3 Å²	61.3	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-49.3	173.6	179.5	57.5	0	0	0	111.5	L518 L521 I522 L537 M548 S551 E553 S557 K558 V559	L518-L555 HydrophobicContact CD2-CD1 3.78Å; L518-L555 HydrophobicContact CD2-CD2 4.46Å; L521-L555 HydrophobicContact CB-CD2 3.74Å; L521-L555 HydrophobicContact CD1-CD2 3.9Å; L521-L555 HydrophobicContact CG-CD2 4.47Å; I522-L555 HydrophobicContact CG1-CD1 4.27Å; L537-L555 HydrophobicContact CD1-CD1 4.48Å; M548-L555 HydrophobicContact CB-CB 4.3Å; M548-L555 HydrophobicContact CB-CD1 4.41Å; M548-L555 HydrophobicContact CE-CD1 3.66Å; S551-L555 PolarHBondContact O-N 3.02Å; E553-L555 VanDerWaalsContact C-N 3.35Å; L555-S557 PolarHBondContact O-N 2.88Å; L555-K558 PolarHBondContact O-N 3.11Å; L555-K558 VanDerWaalsContact O-N 3.14Å; L555-V559 HydrophobicContact CD1-CG2 3.95Å; L555-V559 HydrophobicContact CG-CG2 4.3Å; L555-V559 WeakPolarHBondContact O-CG2 3.12Å; L555-V559 PolarHBondContact O-N 2.91Å
556	R	86.6	Confident	85.5	Confident	152 Å²	152	62.1 Å²	62.1	57%	0.574	33%	0.329	S	S	*	.	H	α-helix	trans	-54.9	-53.5	179.1	-79.3	169.1	175.3	-167.3	-2.2	112	M525 P552 E553 K558 V559 D560	M525-R556 HydrophobicContact CE-CB 4.2Å; M525-R556 HydrophobicContact CE-CG 3.74Å; M525-R556 HydrophobicContact SD-CG 3.67Å; P552-R556 WeakPolarHBondContact O-CB 3.37Å; P552-R556 VanDerWaalsContact O-CG 3.24Å; P552-R556 WeakPolarHBondContact O-CG 3.24Å; P552-R556 PolarHBondContact O-N 2.63Å; E553-R556 PolarHBondContact O-N 2.86Å; R556-K558 PolarHBondContact O-N 3.29Å; R556-K558 VanDerWaalsContact O-N 3.13Å; R556-V559 PolarHBondContact O-N 3.31Å; R556-V559 VanDerWaalsContact O-N 3.08Å; R556-D560 PolarHBondContact O-N 3.43Å
557	S	89.9	Confident	85.7	Confident	80 Å²	80	65.9 Å²	65.9	56%	0.559	35%	0.346	S	S	*	.	H	α-helix	trans	-60	-27.7	-179.9	-175.7	0	0	0	0	113.7	E553 L555 E561	E553-S557 PolarHBondContact O-N 3.47Å; L555-S557 PolarHBondContact O-N 2.88Å; S557-E561 PolarHBondContact O-N 3.19Å
558	K	86.2	Confident	86	Confident	49 Å²	49	64 Å²	64	21%	0.213	35%	0.348	C	S	.	.	H	α-helix	trans	-83.8	-32.6	176.8	-80.9	-76.8	165.3	-170	0	113	L537 I540 E544 M548 S554 L555 R556 E561 A562	L537-K558 HydrophobicContact CD2-CB 4.02Å; I540-K558 HydrophobicContact CD1-CD 4.34Å; E544-K558 WeakPolarHBondContact OE1-CE 3.43Å; E544-K558 IonicContact OE1-NZ 2.62Å; M548-K558 HydrophobicContact CE-CB 4.09Å; M548-K558 HydrophobicContact SD-CB 4.15Å; M548-K558 HydrophobicContact SD-CG 3.98Å; S554-K558 PolarHBondContact O-N 2.97Å; L555-K558 PolarHBondContact O-N 3.11Å; L555-K558 VanDerWaalsContact O-N 3.14Å; R556-K558 PolarHBondContact O-N 3.29Å; R556-K558 VanDerWaalsContact O-N 3.13Å; K558-E561 WeakPolarHBondContact CD-OE2 3.12Å; K558-E561 WeakPolarHBondContact CE-OE2 3.46Å; K558-E561 IonicContact NZ-OE2 2.71Å; K558-E561 PolarHBondContact NZ-OE2 3.11Å; K558-A562 PolarHBondContact O-N 3.13Å
559	V	89.5	Confident	86.1	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-65.3	-44.3	171.3	168.3	0	0	0	0	110.6	I522 M525 H526 I533 L537 L555 R556 E561 A562 V563	I522-V559 HydrophobicContact CG1-CG2 3.86Å; I522-V559 HydrophobicContact CG2-CG2 4.36Å; M525-V559 HydrophobicContact CE-CB 4Å; M525-V559 HydrophobicContact CE-CG1 3.66Å; M525-V559 HydrophobicContact SD-CB 4.42Å; M525-V559 HydrophobicContact SD-CG1 4.25Å; M525-V559 HydrophobicContact SD-CG2 4.48Å; H526-V559 WeakPolarHBondContact CD2-CG1 3.34Å; I533-V559 HydrophobicContact CD1-CG1 4.45Å; I533-V559 HydrophobicContact CG2-CG1 4.3Å; I533-V559 HydrophobicContact CG2-CG2 4.14Å; L537-V559 HydrophobicContact CD1-CG2 4.01Å; L555-V559 HydrophobicContact CD1-CG2 3.95Å; L555-V559 HydrophobicContact CG-CG2 4.3Å; L555-V559 WeakPolarHBondContact O-CG2 3.12Å; L555-V559 PolarHBondContact O-N 2.91Å; R556-V559 PolarHBondContact O-N 3.31Å; R556-V559 VanDerWaalsContact O-N 3.08Å; V559-E561 PolarHBondContact O-N 2.95Å; V559-A562 PolarHBondContact O-N 3.06Å; V559-V563 HydrophobicContact CG1-CG2 4.44Å; V559-V563 VanDerWaalsContact O-CG2 3.32Å; V559-V563 WeakPolarHBondContact O-CG2 3.47Å; V559-V563 PolarHBondContact O-N 3.46Å
560	D	87.8	Confident	86.2	Confident	88 Å²	88	70.9 Å²	70.9	47%	0.471	38%	0.379	S	S	.	.	H	α-helix	trans	-61.6	-41.3	176.6	-63.7	-35.1	0	0	0	112.1	R556 V563 A564	R556-D560 PolarHBondContact O-N 3.43Å; D560-V563 PolarHBondContact O-N 3.37Å; D560-A564 PolarHBondContact O-N 3.06Å
561	E	90.3	Very high	86.3	Confident	106 Å²	106	67.1 Å²	67.1	50%	0.495	37%	0.372	S	S	.	.	H	α-helix	trans	-60.6	-46.4	174.3	-174.4	174.8	-155.1	0	0	111.5	S557 K558 V559 A564 V565	S557-E561 PolarHBondContact O-N 3.19Å; K558-E561 WeakPolarHBondContact CD-OE2 3.12Å; K558-E561 WeakPolarHBondContact CE-OE2 3.46Å; K558-E561 IonicContact NZ-OE2 2.71Å; K558-E561 PolarHBondContact NZ-OE2 3.11Å; V559-E561 PolarHBondContact O-N 2.95Å; E561-A564 PolarHBondContact O-N 3.02Å; E561-V565 WeakPolarHBondContact O-CG2 3.42Å; E561-V565 PolarHBondContact O-N 2.76Å
562	A	89	Confident	86.2	Confident	7 Å²	7	72.3 Å²	72.3	6%	0.058	39%	0.391	C	S	.	.	H	α-helix	trans	-66	-37.5	176.9	0	0	0	0	0	113	I533 K558 V559 V565 L566	I533-A562 HydrophobicContact CG2-CB 4.04Å; K558-A562 PolarHBondContact O-N 3.13Å; V559-A562 PolarHBondContact O-N 3.06Å; A562-V565 PolarHBondContact O-N 2.88Å; A562-L566 WeakPolarHBondContact O-CB 3.4Å; A562-L566 WeakPolarHBondContact O-CG 3.38Å; A562-L566 PolarHBondContact O-N 3.49Å
563	V	89.7	Confident	86.3	Confident	13 Å²	13	71.7 Å²	71.7	8%	0.079	38%	0.38	C	S	.	.	H	α-helix	trans	-62.1	-44.7	174.7	167.7	0	0	0	0	110.9	I533 V559 D560 V565 L566 Q567	I533-V563 HydrophobicContact CD1-CG2 3.57Å; I533-V563 HydrophobicContact CG1-CG2 4.25Å; V559-V563 HydrophobicContact CG1-CG2 4.44Å; V559-V563 VanDerWaalsContact O-CG2 3.32Å; V559-V563 WeakPolarHBondContact O-CG2 3.47Å; V559-V563 PolarHBondContact O-N 3.46Å; D560-V563 PolarHBondContact O-N 3.37Å; V563-V565 VanDerWaalsContact C-N 3.35Å; V563-V565 PolarHBondContact O-N 3.14Å; V563-L566 PolarHBondContact O-N 3.46Å; V563-Q567 HydrophobicContact CG1-CG 4.44Å; V563-Q567 WeakPolarHBondContact O-CG 3.37Å; V563-Q567 PolarHBondContact O-N 3.48Å
564	A	87.8	Confident	86.1	Confident	56 Å²	56	67 Å²	67	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-41.7	177.7	0	0	0	0	0	112.2	D560 E561 Q567 A568	D560-A564 PolarHBondContact O-N 3.06Å; E561-A564 PolarHBondContact O-N 3.02Å; A564-Q567 PolarHBondContact O-N 3.12Å; A564-A568 WeakPolarHBondContact O-CB 3.47Å; A564-A568 PolarHBondContact O-N 3.3Å
565	V	88.7	Confident	85.7	Confident	80 Å²	80	68.3 Å²	68.3	49%	0.485	38%	0.38	S	S	.	.	H	α-helix	trans	-65.4	-42.6	175.6	175.6	0	0	0	0	111.6	M536 E561 A562 V563 Q567 A568 H569	M536-V565 HydrophobicContact CE-CB 4.04Å; M536-V565 HydrophobicContact CE-CG1 3.72Å; E561-V565 WeakPolarHBondContact O-CG2 3.42Å; E561-V565 PolarHBondContact O-N 2.76Å; A562-V565 PolarHBondContact O-N 2.88Å; V563-V565 VanDerWaalsContact C-N 3.35Å; V563-V565 PolarHBondContact O-N 3.14Å; V565-Q567 VanDerWaalsContact C-N 3.35Å; V565-Q567 PolarHBondContact O-N 2.63Å; V565-A568 PolarHBondContact O-N 3.07Å; V565-H569 PolarHBondContact O-N 3.22Å
566	L	85.6	Confident	85.1	Confident	17 Å²	17	73.4 Å²	73.4	9%	0.089	40%	0.404	C	S	.	.	H	α-helix	trans	-65	-35.3	177	-76.8	170.3	0	0	0	113.1	K532 I533 M536 A562 V563 Q570	K532-L566 HydrophobicContact CB-CD1 3.87Å; K532-L566 HydrophobicContact CB-CD2 4.08Å; K532-L566 HydrophobicContact CD-CD2 4.16Å; I533-L566 HydrophobicContact CG1-CD1 3.66Å; M536-L566 HydrophobicContact SD-CD1 4.08Å; M536-L566 HydrophobicContact SD-CD2 3.65Å; M536-L566 HydrophobicContact SD-CG 3.63Å; A562-L566 WeakPolarHBondContact O-CB 3.4Å; A562-L566 WeakPolarHBondContact O-CG 3.38Å; A562-L566 PolarHBondContact O-N 3.49Å; V563-L566 PolarHBondContact O-N 3.46Å; L566-Q570 WeakPolarHBondContact O-CG 3.46Å; L566-Q570 PolarHBondContact O-N 2.96Å; L566-Q570 VanDerWaalsContact O-N 3.1Å; L566-Q570 PolarHBondContact O-NE2 2.76Å
567	Q	86.1	Confident	84.4	Confident	120 Å²	120	72.8 Å²	72.8	56%	0.561	41%	0.405	S	S	*	.	H	α-helix	trans	-68.5	-43.7	173.6	-72.7	176.9	4.9	0	0	111.3	V563 A564 V565 H569 Q570 A571	V563-Q567 HydrophobicContact CG1-CG 4.44Å; V563-Q567 WeakPolarHBondContact O-CG 3.37Å; V563-Q567 PolarHBondContact O-N 3.48Å; A564-Q567 PolarHBondContact O-N 3.12Å; V565-Q567 VanDerWaalsContact C-N 3.35Å; V565-Q567 PolarHBondContact O-N 2.63Å; Q567-H569 VanDerWaalsContact C-N 3.32Å; Q567-H569 PolarHBondContact O-N 2.86Å; Q567-Q570 PolarHBondContact O-N 3.46Å; Q567-A571 WeakPolarHBondContact O-CB 3.49Å; Q567-A571 PolarHBondContact O-N 2.9Å
568	A	85.4	Confident	83.5	Confident	64 Å²	64	71.5 Å²	71.5	53%	0.529	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-38.8	175.6	0	0	0	0	0	112.4	A564 V565 K572	A564-A568 WeakPolarHBondContact O-CB 3.47Å; A564-A568 PolarHBondContact O-N 3.3Å; V565-A568 PolarHBondContact O-N 3.07Å; A568-K572 WeakPolarHBondContact O-CB 3.21Å; A568-K572 PolarHBondContact O-N 3.31Å; A568-K572 VanDerWaalsContact O-N 3.09Å
569	H	83.3	Confident	82.7	Confident	109 Å²	109	73.6 Å²	73.6	51%	0.505	42%	0.416	S	S	.	.	H	α-helix	trans	-65.3	-46.4	174.6	-161.5	-80.9	0	0	0	112	V565 Q567 A571 K572 E573	V565-H569 PolarHBondContact O-N 3.22Å; Q567-H569 VanDerWaalsContact C-N 3.32Å; Q567-H569 PolarHBondContact O-N 2.86Å; H569-A571 PolarHBondContact O-N 3.19Å; H569-K572 WeakPolarHBondContact O-CB 3.36Å; H569-K572 PolarHBondContact O-N 3.14Å; H569-K572 VanDerWaalsContact O-N 3.15Å; H569-E573 IonicContact CE1-OE2 3.77Å; H569-E573 PolarHBondContact CE1-OE2 2.92Å; H569-E573 VanDerWaalsContact CE1-OE2 3.32Å; H569-E573 IonicContact ND1-OE2 2.64Å; H569-E573 PolarHBondContact ND1-OE2 3.4Å; H569-E573 PolarHBondContact O-N 3.16Å
570	Q	83.1	Confident	81.5	Confident	86 Å²	86	78.5 Å²	78.5	40%	0.402	44%	0.443	S	S	.	.	H	α-helix	trans	-63.1	-39.9	178.3	-76.4	169.7	70.7	0	0	112.5	L566 Q567 K572 E573 A574	L566-Q570 WeakPolarHBondContact O-CG 3.46Å; L566-Q570 PolarHBondContact O-N 2.96Å; L566-Q570 VanDerWaalsContact O-N 3.1Å; L566-Q570 PolarHBondContact O-NE2 2.76Å; Q567-Q570 PolarHBondContact O-N 3.46Å; Q570-K572 VanDerWaalsContact C-N 3.32Å; Q570-K572 PolarHBondContact O-N 3.01Å; Q570-E573 PolarHBondContact O-N 3.42Å; Q570-A574 VanDerWaalsContact O-CB 3.28Å; Q570-A574 WeakPolarHBondContact O-CB 3.41Å; Q570-A574 PolarHBondContact O-N 2.9Å
571	A	83.1	Confident	80.3	Confident	64 Å²	64	78.6 Å²	78.6	53%	0.529	45%	0.451	S	S	.	.	H	α-helix	trans	-62.3	-39.6	173.8	0	0	0	0	0	111.9	Q567 H569 A574 A575	Q567-A571 WeakPolarHBondContact O-CB 3.49Å; Q567-A571 PolarHBondContact O-N 2.9Å; H569-A571 PolarHBondContact O-N 3.19Å; A571-A574 PolarHBondContact O-N 3.42Å; A571-A575 WeakPolarHBondContact O-CB 3.39Å; A571-A575 PolarHBondContact O-N 3.16Å
572	K	82.1	Confident	78.7	Confident	141 Å²	141	77.7 Å²	77.7	61%	0.613	46%	0.461	S	S	*	.	H	α-helix	trans	-68.2	-44.2	176.3	-168.1	179.8	179.3	-173.5	0	112.2	A568 H569 Q570 A575 Q576	A568-K572 WeakPolarHBondContact O-CB 3.21Å; A568-K572 PolarHBondContact O-N 3.31Å; A568-K572 VanDerWaalsContact O-N 3.09Å; H569-K572 WeakPolarHBondContact O-CB 3.36Å; H569-K572 PolarHBondContact O-N 3.14Å; H569-K572 VanDerWaalsContact O-N 3.15Å; Q570-K572 VanDerWaalsContact C-N 3.32Å; Q570-K572 PolarHBondContact O-N 3.01Å; K572-A575 PolarHBondContact O-N 3.39Å; K572-Q576 VanDerWaalsContact O-CB 3.3Å; K572-Q576 WeakPolarHBondContact O-CB 3.34Å; K572-Q576 PolarHBondContact O-N 3.45Å
573	E	82.5	Confident	77.3	Confident	77 Å²	77	82.1 Å²	82.1	36%	0.36	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-40.5	173.2	-77.9	-176.9	77.9	0	0	112.3	H569 Q570 Q576 K577	H569-E573 IonicContact CE1-OE2 3.77Å; H569-E573 PolarHBondContact CE1-OE2 2.92Å; H569-E573 VanDerWaalsContact CE1-OE2 3.32Å; H569-E573 IonicContact ND1-OE2 2.64Å; H569-E573 PolarHBondContact ND1-OE2 3.4Å; H569-E573 PolarHBondContact O-N 3.16Å; Q570-E573 PolarHBondContact O-N 3.42Å; E573-Q576 PolarHBondContact O-N 3.43Å; E573-K577 WeakPolarHBondContact O-CB 3.46Å; E573-K577 WeakPolarHBondContact O-CG 3.31Å; E573-K577 PolarHBondContact O-N 2.95Å
574	A	78.4	Confident	75.2	Confident	59 Å²	59	84.1 Å²	84.1	49%	0.488	51%	0.511	S	S	.	.	H	α-helix	trans	-64.8	-45.8	177.1	0	0	0	0	0	111.4	Q570 A571 Q576 K577 A578	Q570-A574 VanDerWaalsContact O-CB 3.28Å; Q570-A574 WeakPolarHBondContact O-CB 3.41Å; Q570-A574 PolarHBondContact O-N 2.9Å; A571-A574 PolarHBondContact O-N 3.42Å; A574-Q576 VanDerWaalsContact C-N 3.34Å; A574-Q576 PolarHBondContact O-N 3Å; A574-K577 PolarHBondContact O-N 3.01Å; A574-A578 WeakPolarHBondContact O-CB 3.43Å; A574-A578 PolarHBondContact O-N 3.41Å
575	A	77.9	Confident	73.4	Confident	57 Å²	57	87.5 Å²	87.5	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-42	173.9	0	0	0	0	0	112.1	A571 K572 A578 V579	A571-A575 WeakPolarHBondContact O-CB 3.39Å; A571-A575 PolarHBondContact O-N 3.16Å; K572-A575 PolarHBondContact O-N 3.39Å; A575-A578 PolarHBondContact O-N 2.93Å; A575-V579 WeakPolarHBondContact O-CG2 2.81Å; A575-V579 PolarHBondContact O-N 2.78Å
576	Q	73.4	Confident	71.3	Confident	117 Å²	117	89 Å²	89	55%	0.547	54%	0.537	S	S	.	.	H	α-helix	trans	-72	-32.6	-179.3	-162.1	158.3	-1.9	0	0	112.4	K572 E573 A574 N580	K572-Q576 VanDerWaalsContact O-CB 3.3Å; K572-Q576 WeakPolarHBondContact O-CB 3.34Å; K572-Q576 PolarHBondContact O-N 3.45Å; E573-Q576 PolarHBondContact O-N 3.43Å; A574-Q576 VanDerWaalsContact C-N 3.34Å; A574-Q576 PolarHBondContact O-N 3Å; Q576-N580 PolarHBondContact O-N 2.92Å; Q576-N580 VanDerWaalsContact O-N 3.12Å; Q576-N580 PolarHBondContact O-OD1 3.47Å
577	K	72.9	Confident	69.3	Low	138 Å²	138	95 Å²	95	60%	0.6	57%	0.574	S	S	*	*	H	α-helix	trans	-67.3	-41.3	168	-76.5	174.1	-179.2	170.2	0	112.1	E573 A574 V579 N580 S581	E573-K577 WeakPolarHBondContact O-CB 3.46Å; E573-K577 WeakPolarHBondContact O-CG 3.31Å; E573-K577 PolarHBondContact O-N 2.95Å; A574-K577 PolarHBondContact O-N 3.01Å; K577-V579 PolarHBondContact O-N 2.88Å; K577-N580 PolarHBondContact O-N 3.32Å; K577-S581 PolarHBondContact O-N 3.23Å; K577-S581 PolarHBondContact O-OG 2.8Å
578	A	71.1	Confident	67.6	Low	54 Å²	54	99.1 Å²	99.1	45%	0.446	61%	0.607	S	S	.	*	H	α-helix	trans	-61	-44	177.1	0	0	0	0	0	112	A574 A575 S581 A582	A574-A578 WeakPolarHBondContact O-CB 3.43Å; A574-A578 PolarHBondContact O-N 3.41Å; A575-A578 PolarHBondContact O-N 2.93Å; A578-S581 WeakPolarHBondContact CA-OG 3.06Å; A578-S581 PolarHBondContact O-N 2.94Å; A578-S581 PolarHBondContact O-OG 2.71Å; A578-A582 WeakPolarHBondContact O-CB 3.25Å; A578-A582 PolarHBondContact O-N 3.43Å
579	V	69.9	Low	66.7	Low	92 Å²	92	100.9 Å²	100.9	56%	0.558	61%	0.611	S	S	*	*	H	α-helix	trans	-58.7	-49.3	172.5	170.2	0	0	0	0	111	A575 K577 S581 A582 T583	A575-V579 WeakPolarHBondContact O-CG2 2.81Å; A575-V579 PolarHBondContact O-N 2.78Å; K577-V579 PolarHBondContact O-N 2.88Å; V579-S581 VanDerWaalsContact C-N 3.3Å; V579-S581 PolarHBondContact O-N 3.44Å; V579-A582 PolarHBondContact O-N 3.47Å; V579-A582 VanDerWaalsContact O-N 3.11Å; V579-T583 PolarHBondContact O-N 3.18Å; V579-T583 PolarHBondContact O-OG1 3.37Å
580	N	64.1	Low	65.8	Low	104 Å²	104	100.4 Å²	100.4	56%	0.556	62%	0.617	S	S	*	*	H	α-helix	trans	-63.7	-32.9	-180	-69.2	2.6	0	0	0	113	Q576 K577 T583	Q576-N580 PolarHBondContact O-N 2.92Å; Q576-N580 VanDerWaalsContact O-N 3.12Å; Q576-N580 PolarHBondContact O-OD1 3.47Å; K577-N580 PolarHBondContact O-N 3.32Å; N580-T583 PolarHBondContact O-OG1 3.12Å
581	S	60.9	Low	64.9	Low	90 Å²	90	101.2 Å²	101.2	63%	0.629	63%	0.629	S	S	*	*	H	α-helix	trans	-73.3	-31.5	173.3	54.9	0	0	0	0	113.4	K577 A578 V579 T583 G584	K577-S581 PolarHBondContact O-N 3.23Å; K577-S581 PolarHBondContact O-OG 2.8Å; A578-S581 WeakPolarHBondContact CA-OG 3.06Å; A578-S581 PolarHBondContact O-N 2.94Å; A578-S581 PolarHBondContact O-OG 2.71Å; V579-S581 VanDerWaalsContact C-N 3.3Å; V579-S581 PolarHBondContact O-N 3.44Å; S581-T583 VanDerWaalsContact C-N 3.25Å; S581-T583 PolarHBondContact O-N 3.08Å; S581-G584 PolarHBondContact O-N 3.41Å
582	A	58.6	Low	63.8	Low	87 Å²	87	103.4 Å²	103.4	72%	0.719	63%	0.634	S	S	*	*	H	α-helix	trans	-71.7	-19.6	176	0	0	0	0	0	113.1	A578 V579	A578-A582 WeakPolarHBondContact O-CB 3.25Å; A578-A582 PolarHBondContact O-N 3.43Å; V579-A582 PolarHBondContact O-N 3.47Å; V579-A582 VanDerWaalsContact O-N 3.11Å
583	T	58	Low	62.7	Low	100 Å²	100	101.1 Å²	101.1	61%	0.613	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	6.1	172.6	49.9	0	0	0	0	114.1	V579 N580 S581 V585	V579-T583 PolarHBondContact O-N 3.18Å; V579-T583 PolarHBondContact O-OG1 3.37Å; N580-T583 PolarHBondContact O-OG1 3.12Å; S581-T583 VanDerWaalsContact C-N 3.25Å; S581-T583 PolarHBondContact O-N 3.08Å; T583-V585 PolarHBondContact O-N 3.36Å; T583-V585 VanDerWaalsContact O-N 3.1Å
584	G	45.8	Very low	61.4	Low	55 Å²	55	102.7 Å²	102.7	57%	0.567	65%	0.654	S	S	*	*			trans	-71.4	99.1	177.3	0	0	0	0	0	112.3	S581	S581-G584 PolarHBondContact O-N 3.41Å
585	V	49.7	Very low	60.1	Low	126 Å²	126	105.8 Å²	105.8	76%	0.764	67%	0.666	S	S	*	*			trans	-62.8	129.6	170.3	180	0	0	0	0	109	T583 T587	T583-V585 PolarHBondContact O-N 3.36Å; T583-V585 VanDerWaalsContact O-N 3.1Å; V585-T587 PolarHBondContact O-N 2.77Å
586	P	45.6	Very low	58.8	Low	113 Å²	113	109.5 Å²	109.5	73%	0.734	68%	0.681	S	S	*	*			trans	-70.5	112.5	173.2	28.6	-32.9	0	0	0	109.6
587	T	43.7	Very low	57.5	Low	142 Å²	142	108.9 Å²	108.9	87%	0.871	69%	0.692	S	S	*	*			trans	-67.1	130	168.5	-23.9	0	0	0	0	109.2	V585	V585-T587 PolarHBondContact O-N 2.77Å
588	V	50.1	Low	56.1	Low	206 Å²	206	106.3 Å²	106.3	100%	1.248	70%	0.701	S	S	*	*			trans	-85.3	0	173.3	-177.5	0	0	0	0	109.8

Retrieved 588 of 588 residues in 423.8 ms (Link to these results)

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