A0A077YV23_TRITR Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A077YV23, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 323 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	47.6	Very low	52.7	Low	208 Å²	208	108.2 Å²	108.2	100%	1.025	61%	0.61	S	S	*	*				0	118.9	0	-86.7	162.4	62.5	0	0	108
2	S	48.2	Very low	52.9	Low	68 Å²	68	105.2 Å²	105.2	48%	0.476	60%	0.596	S	S	.	*			trans	-70.3	132.4	-171	171.1	0	0	0	0	112.2	S4 K5	S2-S4 PolarHBondContact O-N 3.29Å; S2-S4 WeakPolarHBondContact OG-CB 3.4Å; S2-S4 PolarHBondContact OG-N 2.75Å; S2-S4 VanDerWaalsContact OG-N 3.13Å; S2-S4 PolarHBondContact OG-OG 3.13Å; S2-K5 PolarHBondContact O-N 3.3Å; S2-K5 VanDerWaalsContact O-N 3.14Å
3	L	54.2	Low	52.4	Low	158 Å²	158	108.8 Å²	108.8	83%	0.827	60%	0.601	S	S	*	*	H	α-helix	trans	-50.2	-25.2	170.1	-95.4	103.8	0	0	0	113	K5 Y6 A7	L3-K5 VanDerWaalsContact C-N 3.26Å; L3-K5 PolarHBondContact O-N 3.29Å; L3-Y6 PolarHBondContact O-N 3.27Å; L3-A7 PolarHBondContact O-N 3.14Å
4	S	56.8	Low	52	Low	70 Å²	70	106.6 Å²	106.6	49%	0.49	60%	0.596	S	S	.	*	H	α-helix	trans	-62.8	-27.9	180	69.6	0	0	0	0	114.1	S2 L8	S2-S4 PolarHBondContact O-N 3.29Å; S2-S4 WeakPolarHBondContact OG-CB 3.4Å; S2-S4 PolarHBondContact OG-N 2.75Å; S2-S4 VanDerWaalsContact OG-N 3.13Å; S2-S4 PolarHBondContact OG-OG 3.13Å; S4-L8 PolarHBondContact O-N 3.02Å
5	K	49.8	Very low	51.7	Low	159 Å²	159	105.5 Å²	105.5	69%	0.691	59%	0.593	S	S	*	*	H	α-helix	trans	-73.8	-34	179.1	-69.9	-169.3	176.8	-173	0	112.5	S2 L3 C9	S2-K5 PolarHBondContact O-N 3.3Å; S2-K5 VanDerWaalsContact O-N 3.14Å; L3-K5 VanDerWaalsContact C-N 3.26Å; L3-K5 PolarHBondContact O-N 3.29Å; K5-C9 PolarHBondContact O-N 3.43Å
6	Y	55.2	Low	51.2	Low	154 Å²	154	104.4 Å²	104.4	60%	0.604	59%	0.585	S	S	*	*	H	α-helix	trans	-74.1	-35.9	176.7	-69.6	-78.7	0	0	0	112.1	L3 L8 C9 A10	L3-Y6 PolarHBondContact O-N 3.27Å; Y6-L8 VanDerWaalsContact C-N 3.34Å; Y6-L8 PolarHBondContact O-N 2.91Å; Y6-C9 PolarHBondContact O-N 3.33Å; Y6-A10 WeakPolarHBondContact O-CB 3.44Å; Y6-A10 PolarHBondContact O-N 3.48Å
7	A	58.7	Low	50.6	Low	64 Å²	64	101.8 Å²	101.8	53%	0.529	58%	0.579	S	S	.	*	H	α-helix	trans	-62.9	-40	175.3	0	0	0	0	0	112.2	L3 A10 A11	L3-A7 PolarHBondContact O-N 3.14Å; A7-A10 PolarHBondContact O-N 2.93Å; A7-A11 WeakPolarHBondContact O-CB 3.27Å; A7-A11 PolarHBondContact O-N 2.95Å
8	L	55.1	Low	49.9	Very low	121 Å²	121	105.8 Å²	105.8	63%	0.634	59%	0.59	S	S	*	*	H	α-helix	trans	-66.4	-41.5	175.6	-111.4	145.8	0	0	0	112.2	S4 Y6 A11 V12	S4-L8 PolarHBondContact O-N 3.02Å; Y6-L8 VanDerWaalsContact C-N 3.34Å; Y6-L8 PolarHBondContact O-N 2.91Å; L8-A11 PolarHBondContact O-N 2.91Å; L8-V12 VanDerWaalsContact O-CG2 3.27Å; L8-V12 WeakPolarHBondContact O-CG2 3.37Å; L8-V12 PolarHBondContact O-N 3.46Å
9	C	48	Very low	49.6	Very low	77 Å²	77	105.4 Å²	105.4	52%	0.52	59%	0.59	S	S	.	*	H	α-helix	trans	-65.2	-41.1	174.3	-75.1	0	0	0	0	112.4	K5 Y6 V12 F13	K5-C9 PolarHBondContact O-N 3.43Å; Y6-C9 PolarHBondContact O-N 3.33Å; C9-V12 PolarHBondContact O-N 2.89Å; C9-F13 WeakPolarHBondContact O-CB 3.46Å; C9-F13 WeakPolarHBondContact O-CD2 3.48Å; C9-F13 PolarHBondContact O-N 3.39Å
10	A	52.3	Low	48.8	Very low	54 Å²	54	106.8 Å²	106.8	45%	0.446	60%	0.595	S	S	.	*	H	α-helix	trans	-65.7	-40.6	176.7	0	0	0	0	0	111.8	Y6 A7 V12 F13 C14	Y6-A10 WeakPolarHBondContact O-CB 3.44Å; Y6-A10 PolarHBondContact O-N 3.48Å; A7-A10 PolarHBondContact O-N 2.93Å; A10-V12 PolarHBondContact O-N 3.23Å; A10-F13 PolarHBondContact O-N 3.02Å; A10-C14 WeakPolarHBondContact O-CB 3.44Å; A10-C14 PolarHBondContact O-N 3.12Å; A10-C14 PolarHBondContact O-SG 2.84Å; A10-C14 VanDerWaalsContact O-SG 3.37Å
11	A	53.4	Low	48.1	Very low	57 Å²	57	104.9 Å²	104.9	47%	0.471	59%	0.589	S	S	.	*	H	α-helix	trans	-63.6	-40.3	175.6	0	0	0	0	0	112.1	A7 L8 C14 T15	A7-A11 WeakPolarHBondContact O-CB 3.27Å; A7-A11 PolarHBondContact O-N 2.95Å; L8-A11 PolarHBondContact O-N 2.91Å; A11-C14 PolarHBondContact O-N 3.41Å; A11-T15 PolarHBondContact O-N 2.94Å; A11-T15 PolarHBondContact O-OG1 3.49Å
12	V	55.4	Low	48	Very low	72 Å²	72	98.8 Å²	98.8	44%	0.436	56%	0.564	S	S	.	*	H	α-helix	trans	-67.5	-38.7	174.6	171.8	0	0	0	0	111.6	L8 C9 A10 T15 L16	L8-V12 VanDerWaalsContact O-CG2 3.27Å; L8-V12 WeakPolarHBondContact O-CG2 3.37Å; L8-V12 PolarHBondContact O-N 3.46Å; C9-V12 PolarHBondContact O-N 2.89Å; A10-V12 PolarHBondContact O-N 3.23Å; V12-T15 WeakPolarHBondContact CA-OG1 3.44Å; V12-T15 PolarHBondContact O-OG1 3.43Å; V12-T15 VanDerWaalsContact O-OG1 3.12Å; V12-L16 HydrophobicContact CG1-CD1 3.75Å; V12-L16 VanDerWaalsContact O-CB 3.27Å; V12-L16 WeakPolarHBondContact O-CB 3.42Å; V12-L16 WeakPolarHBondContact O-CD1 3.27Å; V12-L16 WeakPolarHBondContact O-CG 3.42Å; V12-L16 PolarHBondContact O-N 3.37Å
13	F	46.3	Very low	48.3	Very low	152 Å²	152	99.3 Å²	99.3	67%	0.667	57%	0.567	S	S	*	*	H	α-helix	trans	-68.2	-36.7	174	-99	-85.3	0	0	0	112.4	C9 A10 A17	C9-F13 WeakPolarHBondContact O-CB 3.46Å; C9-F13 WeakPolarHBondContact O-CD2 3.48Å; C9-F13 PolarHBondContact O-N 3.39Å; A10-F13 PolarHBondContact O-N 3.02Å; F13-A17 WeakPolarHBondContact O-CB 3.46Å; F13-A17 PolarHBondContact O-N 2.87Å
14	C	46.9	Very low	49	Very low	79 Å²	79	95.5 Å²	95.5	53%	0.534	55%	0.545	S	S	.	.	H	α-helix	trans	-70.4	-39.2	176	-74.9	0	0	0	0	112.2	A10 A11 A17 F18	A10-C14 WeakPolarHBondContact O-CB 3.44Å; A10-C14 PolarHBondContact O-N 3.12Å; A10-C14 PolarHBondContact O-SG 2.84Å; A10-C14 VanDerWaalsContact O-SG 3.37Å; A11-C14 PolarHBondContact O-N 3.41Å; C14-A17 PolarHBondContact O-N 3.42Å; C14-F18 WeakPolarHBondContact O-CB 3.24Å; C14-F18 PolarHBondContact O-N 3.33Å
15	T	48	Very low	50.1	Low	90 Å²	90	93 Å²	93	55%	0.552	53%	0.526	S	S	*	.	H	α-helix	trans	-69.4	-39	173.7	46.1	0	0	0	0	111.8	A11 V12 F18 T19	A11-T15 PolarHBondContact O-N 2.94Å; A11-T15 PolarHBondContact O-OG1 3.49Å; V12-T15 WeakPolarHBondContact CA-OG1 3.44Å; V12-T15 PolarHBondContact O-OG1 3.43Å; V12-T15 VanDerWaalsContact O-OG1 3.12Å; T15-F18 PolarHBondContact O-N 3.43Å; T15-T19 WeakPolarHBondContact O-CG2 3.26Å; T15-T19 PolarHBondContact O-N 2.91Å; T15-T19 PolarHBondContact O-OG1 2.87Å; T15-T19 VanDerWaalsContact O-OG1 3.13Å
16	L	43.2	Very low	51.8	Low	88 Å²	88	85.4 Å²	85.4	46%	0.461	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-40.9	172.4	-83.2	159.2	0	0	0	112.2	V12 T19 L20	V12-L16 HydrophobicContact CG1-CD1 3.75Å; V12-L16 VanDerWaalsContact O-CB 3.27Å; V12-L16 WeakPolarHBondContact O-CB 3.42Å; V12-L16 WeakPolarHBondContact O-CD1 3.27Å; V12-L16 WeakPolarHBondContact O-CG 3.42Å; V12-L16 PolarHBondContact O-N 3.37Å; L16-T19 WeakPolarHBondContact CA-OG1 3.31Å; L16-T19 CarbonylContact O-C 3.43Å; L16-T19 PolarHBondContact O-N 3.01Å; L16-T19 PolarHBondContact O-OG1 3.06Å; L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 WeakPolarHBondContact O-CD1 3.49Å; L16-L20 WeakPolarHBondContact O-CG 3.21Å; L16-L20 PolarHBondContact O-N 2.79Å
17	A	40.3	Very low	53.3	Low	59 Å²	59	78.1 Å²	78.1	49%	0.488	47%	0.465	S	S	.	.	H	α-helix	trans	-66.6	-36.5	176.6	0	0	0	0	0	112.3	F13 C14 T19 L20 S21	F13-A17 WeakPolarHBondContact O-CB 3.46Å; F13-A17 PolarHBondContact O-N 2.87Å; C14-A17 PolarHBondContact O-N 3.42Å; A17-T19 VanDerWaalsContact C-N 3.34Å; A17-L20 PolarHBondContact O-N 3.29Å; A17-S21 PolarHBondContact O-N 3.5Å
18	F	39.5	Very low	54.5	Low	175 Å²	175	76.6 Å²	76.6	77%	0.768	45%	0.445	S	S	*	.	H	α-helix	trans	-71.4	-26.9	173.3	-100.5	-86.8	0	0	0	113.2	C14 T15 S21	C14-F18 WeakPolarHBondContact O-CB 3.24Å; C14-F18 PolarHBondContact O-N 3.33Å; T15-F18 PolarHBondContact O-N 3.43Å; F18-S21 PolarHBondContact O-OG 3.19Å
19	T	42.9	Very low	55.9	Low	97 Å²	97	74.5 Å²	74.5	60%	0.595	43%	0.432	S	S	*	.	H	α-helix	trans	-82.6	-16.6	170.3	53.6	0	0	0	0	113.7	T15 L16 A17	T15-T19 WeakPolarHBondContact O-CG2 3.26Å; T15-T19 PolarHBondContact O-N 2.91Å; T15-T19 PolarHBondContact O-OG1 2.87Å; T15-T19 VanDerWaalsContact O-OG1 3.13Å; L16-T19 WeakPolarHBondContact CA-OG1 3.31Å; L16-T19 CarbonylContact O-C 3.43Å; L16-T19 PolarHBondContact O-N 3.01Å; L16-T19 PolarHBondContact O-OG1 3.06Å; A17-T19 VanDerWaalsContact C-N 3.34Å
20	L	34.1	Very low	57.6	Low	133 Å²	133	71 Å²	71	70%	0.696	41%	0.408	S	S	*	.	H	α-helix	trans	-89.8	-4.3	178.8	-84.2	161.8	0	0	0	113.7	L16 A17 V22	L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 WeakPolarHBondContact O-CD1 3.49Å; L16-L20 WeakPolarHBondContact O-CG 3.21Å; L16-L20 PolarHBondContact O-N 2.79Å; A17-L20 PolarHBondContact O-N 3.29Å; L20-V22 PolarHBondContact O-N 3.33Å
21	S	34.4	Very low	59.1	Low	67 Å²	67	70.2 Å²	70.2	47%	0.469	40%	0.395	S	S	.	.			trans	-76.6	71	156.2	82.3	0	0	0	0	108.1	A17 F18 C23	A17-S21 PolarHBondContact O-N 3.5Å; F18-S21 PolarHBondContact O-OG 3.19Å; S21-C23 WeakPolarHBondContact CB-SG 3.4Å; S21-C23 PolarHBondContact O-N 2.78Å
22	V	45.7	Very low	60.2	Low	81 Å²	81	73.4 Å²	73.4	49%	0.491	41%	0.409	S	S	.	.			trans	-68.4	71.5	159.2	-175.8	0	0	0	0	105.3	L20 E24 K211	L20-V22 PolarHBondContact O-N 3.33Å; V22-E24 PolarHBondContact O-N 3.35Å; V22-E24 VanDerWaalsContact O-N 3.15Å; V22-K211 HydrophobicContact CG1-CB 4.45Å
23	C	53.6	Low	61.3	Low	79 Å²	79	74.6 Å²	74.6	53%	0.534	41%	0.412	S	S	.	.			trans	-67.4	109.3	-176.4	-78.5	0	0	0	0	107	S21 T25	S21-C23 WeakPolarHBondContact CB-SG 3.4Å; S21-C23 PolarHBondContact O-N 2.78Å; C23-T25 WeakPolarHBondContact O-CA 3.48Å; C23-T25 PolarHBondContact O-N 3.34Å; C23-T25 PolarHBondContact O-OG1 2.9Å
24	E	68.9	Low	62.9	Low	78 Å²	78	68.4 Å²	68.4	36%	0.364	39%	0.386	S	S	.	.			trans	20.8	62.2	147.4	-55.5	176.8	177.2	0	0	112.7	V22 C26 H29 Y38	V22-E24 PolarHBondContact O-N 3.35Å; V22-E24 VanDerWaalsContact O-N 3.15Å; E24-C26 PolarHBondContact O-N 3.33Å; E24-H29 PolarHBondContact O-CE1 3.49Å; E24-H29 PolarHBondContact O-ND1 3.13Å; E24-H29 VanDerWaalsContact O-ND1 3.13Å; E24-Y38 HydrophobicContact CB-CD1 4.36Å; E24-Y38 HydrophobicContact CB-CE1 4.24Å; E24-Y38 HydrophobicContact CG-CD1 4.21Å; E24-Y38 HydrophobicContact CG-CE1 3.69Å; E24-Y38 WeakPolarHBondContact OE1-CE1 3.36Å; E24-Y38 VanDerWaalsContact OE2-CD1 3.3Å; E24-Y38 WeakPolarHBondContact OE2-CD1 3.26Å; E24-Y38 WeakPolarHBondContact OE2-CE1 3.3Å
25	T	80.8	Confident	64.6	Low	16 Å²	16	68.3 Å²	68.3	10%	0.098	38%	0.378	C	S	.	.			trans	-90.2	103.2	-174	-71	0	0	0	0	108.2	C23 L30 L210	C23-T25 WeakPolarHBondContact O-CA 3.48Å; C23-T25 PolarHBondContact O-N 3.34Å; C23-T25 PolarHBondContact O-OG1 2.9Å; T25-L30 HydrophobicContact CG2-CD2 4.45Å; T25-L210 HydrophobicContact CG2-CB 4.15Å; T25-L210 HydrophobicContact CG2-CD1 4.43Å; T25-L210 VanDerWaalsContact O-CB 3.26Å; T25-L210 WeakPolarHBondContact O-CB 3.43Å; T25-L210 WeakPolarHBondContact O-CG 3.14Å; T25-L210 PolarHBondContact O-N 3.22Å
26	C	86	Confident	66.4	Low	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.358	C	S	.	.			trans	-100.4	160.3	176.8	-62.3	0	0	0	0	112.1	E24 W28 H29 C45	E24-C26 PolarHBondContact O-N 3.33Å; C26-W28 VanDerWaalsContact C-N 3.32Å; C26-W28 HydrophobicContact CB-CD2 3.73Å; C26-W28 HydrophobicContact CB-CE3 3.57Å; C26-W28 HydrophobicContact CB-CH2 3.13Å; C26-W28 HydrophobicContact CB-CZ2 3.3Å; C26-W28 HydrophobicContact CB-CZ3 3.28Å; C26-W28 PolarHBondContact O-N 3.07Å; C26-W28 WeakPolarHBondContact SG-CH2 3.48Å; C26-W28 WeakPolarHBondContact SG-CZ2 3.34Å; C26-H29 PolarHBondContact N-ND1 3.29Å; C26-H29 VanDerWaalsContact O-CB 3.28Å; C26-H29 WeakPolarHBondContact O-CB 3.34Å; C26-H29 PolarHBondContact O-N 3.37Å; C26-C45 WeakPolarHBondContact CA-SG 3.33Å; C26-C45 HydrophobicContact CB-CB 3.53Å; C26-C45 WeakPolarHBondContact CB-SG 2.99Å; C26-C45 WeakPolarHBondContact SG-CB 3.47Å; C26-C45 CovalentContact SG-SG 2.03Å; C26-C45 PolarHBondContact SG-SG 2.84Å
27	P	85	Confident	68.4	Low	1 Å²	1	61.2 Å²	61.2	1%	0.006	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-59.2	-35.4	-175.5	-23.4	31	0	0	0	114.6	H29 L30 K31 T47 Y70 T207 L210 W224	P27-H29 PolarHBondContact O-N 2.82Å; P27-L30 WeakPolarHBondContact O-CA 3.4Å; P27-L30 WeakPolarHBondContact O-CB 3.01Å; P27-L30 PolarHBondContact O-N 2.92Å; P27-K31 PolarHBondContact O-N 3.46Å; P27-T47 HydrophobicContact CB-CG2 3.91Å; P27-T47 HydrophobicContact CG-CG2 4.11Å; P27-Y70 HydrophobicContact CB-CD1 3.93Å; P27-Y70 HydrophobicContact CB-CE1 4.31Å; P27-Y70 HydrophobicContact CB-CG 4.46Å; P27-Y70 HydrophobicContact CG-CD1 4.17Å; P27-Y70 HydrophobicContact CG-CG 4.32Å; P27-T207 HydrophobicContact CG-CG2 3.5Å; P27-L210 HydrophobicContact CG-CD1 4.36Å; P27-W224 HydrophobicContact CB-CH2 4.44Å; P27-W224 HydrophobicContact CB-CZ3 4.21Å; P27-W224 WeakPolarHBondContact O-CZ3 3.23Å
28	W	83.7	Confident	70.7	Confident	33 Å²	33	60.3 Å²	60.3	13%	0.125	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-68	-14.3	176.6	65.5	88.3	0	0	0	113.5	C26 L30 K31 L34 W37 C45 F46 T47	C26-W28 VanDerWaalsContact C-N 3.32Å; C26-W28 HydrophobicContact CB-CD2 3.73Å; C26-W28 HydrophobicContact CB-CE3 3.57Å; C26-W28 HydrophobicContact CB-CH2 3.13Å; C26-W28 HydrophobicContact CB-CZ2 3.3Å; C26-W28 HydrophobicContact CB-CZ3 3.28Å; C26-W28 PolarHBondContact O-N 3.07Å; C26-W28 WeakPolarHBondContact SG-CH2 3.48Å; C26-W28 WeakPolarHBondContact SG-CZ2 3.34Å; W28-L30 PolarHBondContact O-N 3.38Å; W28-K31 CarbonylContact O-C 3.58Å; W28-L34 HydrophobicContact CB-CB 3.87Å; W28-L34 WeakPolarHBondContact CB-O 3.47Å; W28-W37 WeakPolarHBondContact CH2-O 3.49Å; W28-C45 HydrophobicContact CH2-CB 3.67Å; W28-C45 HydrophobicContact CZ3-CB 3.55Å; W28-F46 VanDerWaalsContact CE3-O 3.24Å; W28-F46 VanDerWaalsContact CZ3-C 3.48Å; W28-F46 VanDerWaalsContact CZ3-N 3.28Å; W28-F46 WeakPolarHBondContact CZ3-O 3.36Å; W28-T47 HydrophobicContact CE3-CG2 3.63Å; W28-T47 HydrophobicContact CZ3-CG2 4.21Å
29	H	85.4	Confident	72.7	Confident	77 Å²	77	53.8 Å²	53.8	36%	0.356	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-74.9	-13.5	168.1	-59.1	153.1	0	0	0	113	E24 C26 P27	E24-H29 PolarHBondContact O-CE1 3.49Å; E24-H29 PolarHBondContact O-ND1 3.13Å; E24-H29 VanDerWaalsContact O-ND1 3.13Å; C26-H29 PolarHBondContact N-ND1 3.29Å; C26-H29 VanDerWaalsContact O-CB 3.28Å; C26-H29 WeakPolarHBondContact O-CB 3.34Å; C26-H29 PolarHBondContact O-N 3.37Å; P27-H29 PolarHBondContact O-N 2.82Å
30	L	84.1	Confident	74.6	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-20.2	178.2	-55.1	179.9	0	0	0	112.3	T25 P27 W28 L210 K215 W224 L225 C227 F237	T25-L30 HydrophobicContact CG2-CD2 4.45Å; P27-L30 WeakPolarHBondContact O-CA 3.4Å; P27-L30 WeakPolarHBondContact O-CB 3.01Å; P27-L30 PolarHBondContact O-N 2.92Å; W28-L30 PolarHBondContact O-N 3.38Å; L30-L210 HydrophobicContact CD1-CD1 3.57Å; L30-L210 HydrophobicContact CG-CD1 4.46Å; L30-K215 HydrophobicContact CD2-CD 4.03Å; L30-K215 HydrophobicContact CD2-CG 3.69Å; L30-W224 HydrophobicContact CB-CE3 3.64Å; L30-W224 HydrophobicContact CB-CZ3 3.99Å; L30-W224 CarbonylContact O-C 3.46Å; L30-W224 WeakPolarHBondContact O-CA 3.38Å; L30-L225 HydrophobicContact CD2-CB 4.35Å; L30-L225 PolarHBondContact O-N 3.4Å; L30-C227 VanDerWaalsContact CD1-SG 3.57Å; L30-F237 HydrophobicContact CD1-CB 4.18Å; L30-F237 HydrophobicContact CD1-CD1 3.59Å; L30-F237 HydrophobicContact CD1-CE1 4.25Å; L30-F237 HydrophobicContact CD1-CG 4.08Å
31	K	84.1	Confident	76.7	Confident	39 Å²	39	54 Å²	54	17%	0.17	31%	0.305	C	S	.	.			trans	-136.5	113.4	177.5	-141.1	-156.6	173.1	-160.2	0	109.9	P27 W28 D33 L34 D222 W224	P27-K31 PolarHBondContact O-N 3.46Å; W28-K31 CarbonylContact O-C 3.58Å; K31-D33 VanDerWaalsContact C-N 3.27Å; K31-D33 WeakPolarHBondContact CD-OD1 3.01Å; K31-D33 WeakPolarHBondContact CE-OD1 3.13Å; K31-D33 WeakPolarHBondContact CE-OD2 3.04Å; K31-D33 WeakPolarHBondContact CG-OD1 3.1Å; K31-D33 IonicContact NZ-OD1 2.61Å; K31-D33 IonicContact NZ-OD2 2.74Å; K31-D33 PolarHBondContact NZ-OD2 3.25Å; K31-D33 PolarHBondContact O-N 3Å; K31-L34 HydrophobicContact CB-CB 4.4Å; K31-L34 HydrophobicContact CB-CD1 3.83Å; K31-L34 HydrophobicContact CB-CG 3.93Å; K31-L34 HydrophobicContact CD-CD1 4.19Å; K31-L34 HydrophobicContact CD-CG 3.98Å; K31-L34 WeakPolarHBondContact O-CB 3.41Å; K31-L34 PolarHBondContact O-N 2.8Å; K31-L34 VanDerWaalsContact O-N 3.09Å; K31-D222 WeakPolarHBondContact CE-O 3.48Å; K31-W224 HydrophobicContact CB-CD2 3.81Å; K31-W224 HydrophobicContact CB-CE3 3.67Å; K31-W224 HydrophobicContact CB-CG 4.48Å; K31-W224 HydrophobicContact CB-CH2 3.96Å; K31-W224 HydrophobicContact CB-CZ2 4.12Å; K31-W224 HydrophobicContact CB-CZ3 3.75Å; K31-W224 HydrophobicContact CD-CD2 4.05Å; K31-W224 HydrophobicContact CD-CG 4.46Å; K31-W224 HydrophobicContact CD-CH2 4.34Å; K31-W224 HydrophobicContact CD-CZ2 3.69Å; K31-W224 HydrophobicContact CG-CD2 3.8Å; K31-W224 HydrophobicContact CG-CE3 4.21Å; K31-W224 HydrophobicContact CG-CG 4.09Å; K31-W224 HydrophobicContact CG-CZ2 4.24Å
32	T	75.2	Confident	78.7	Confident	124 Å²	124	56.3 Å²	56.3	76%	0.761	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-20.3	-169	50	0	0	0	0	114.5
33	D	78.6	Confident	80.4	Confident	96 Å²	96	53.7 Å²	53.7	51%	0.513	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-13	174.6	60.7	-39.7	0	0	0	112.6	K31	K31-D33 VanDerWaalsContact C-N 3.27Å; K31-D33 WeakPolarHBondContact CD-OD1 3.01Å; K31-D33 WeakPolarHBondContact CE-OD1 3.13Å; K31-D33 WeakPolarHBondContact CE-OD2 3.04Å; K31-D33 WeakPolarHBondContact CG-OD1 3.1Å; K31-D33 IonicContact NZ-OD1 2.61Å; K31-D33 IonicContact NZ-OD2 2.74Å; K31-D33 PolarHBondContact NZ-OD2 3.25Å; K31-D33 PolarHBondContact O-N 3Å
34	L	79.9	Confident	81.9	Confident	22 Å²	22	51.8 Å²	51.8	12%	0.115	28%	0.28	C	S	.	.			trans	-77.4	132.6	171.6	-70.6	179.9	0	0	0	110.6	W28 K31 W224	W28-L34 HydrophobicContact CB-CB 3.87Å; W28-L34 WeakPolarHBondContact CB-O 3.47Å; K31-L34 HydrophobicContact CB-CB 4.4Å; K31-L34 HydrophobicContact CB-CD1 3.83Å; K31-L34 HydrophobicContact CB-CG 3.93Å; K31-L34 HydrophobicContact CD-CD1 4.19Å; K31-L34 HydrophobicContact CD-CG 3.98Å; K31-L34 WeakPolarHBondContact O-CB 3.41Å; K31-L34 PolarHBondContact O-N 2.8Å; K31-L34 VanDerWaalsContact O-N 3.09Å; L34-W224 HydrophobicContact CD1-CH2 3.03Å; L34-W224 HydrophobicContact CD1-CZ2 3.59Å; L34-W224 HydrophobicContact CD1-CZ3 3.83Å; L34-W224 HydrophobicContact CG-CH2 4.33Å
35	Q	83.9	Confident	82.8	Confident	78 Å²	78	48 Å²	48	36%	0.364	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	142.7	172.5	-64.2	171.6	3.3	0	0	108.6	T47 W48 I100	Q35-T47 WeakPolarHBondContact O-CA 3.49Å; Q35-W48 HydrophobicContact CB-CB 4.22Å; Q35-W48 PolarHBondContact O-N 3.21Å; Q35-I100 HydrophobicContact CG-CD1 4.13Å; Q35-I100 VanDerWaalsContact OE1-CG1 3.26Å
36	G	84.1	Confident	83.1	Confident	13 Å²	13	47.3 Å²	47.3	13%	0.134	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	168.7	-178.7	0	0	0	0	0	112.3	F46	G36-F46 CarbonylContact C-O 3.6Å; G36-F46 WeakPolarHBondContact CA-O 3.36Å
37	W	87.1	Confident	83.1	Confident	15 Å²	15	47.3 Å²	47.3	6%	0.057	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	154.6	176.7	79.8	95.9	0	0	0	110.1	W28 F46 W48 F91 P94 E96 I97 L204	W28-W37 WeakPolarHBondContact CH2-O 3.49Å; W37-F46 HydrophobicContact CD2-CB 3.6Å; W37-F46 HydrophobicContact CD2-CD2 4.28Å; W37-F46 HydrophobicContact CD2-CG 4.14Å; W37-F46 AromaticContact CE2-CD2 3.55Å; W37-F46 AromaticContact CE2-CG 3.56Å; W37-F46 HydrophobicContact CE3-CB 3.45Å; W37-F46 VanDerWaalsContact CE3-CB 3.45Å; W37-F46 HydrophobicContact CE3-CG 4.33Å; W37-F46 HydrophobicContact CG-CB 4.47Å; W37-F46 HydrophobicContact CH2-CB 3.43Å; W37-F46 VanDerWaalsContact CH2-CB 3.43Å; W37-F46 AromaticContact CH2-CD1 3.76Å; W37-F46 HydrophobicContact CH2-CD1 3.76Å; W37-F46 HydrophobicContact CH2-CD2 4.39Å; W37-F46 AromaticContact CH2-CG 3.61Å; W37-F46 HydrophobicContact CH2-CG 3.61Å; W37-F46 HydrophobicContact CZ2-CB 3.53Å; W37-F46 AromaticContact CZ2-CD1 3.66Å; W37-F46 HydrophobicContact CZ2-CD1 3.66Å; W37-F46 AromaticContact CZ2-CD2 3.66Å; W37-F46 HydrophobicContact CZ2-CD2 3.66Å; W37-F46 HydrophobicContact CZ2-CE1 4.26Å; W37-F46 HydrophobicContact CZ2-CE2 4.29Å; W37-F46 AromaticContact CZ2-CG 3.31Å; W37-F46 HydrophobicContact CZ2-CG 3.31Å; W37-F46 HydrophobicContact CZ3-CB 3.31Å; W37-F46 HydrophobicContact CZ3-CD1 4.47Å; W37-F46 HydrophobicContact CZ3-CG 4.04Å; W37-F46 PolarHBondContact N-O 3.48Å; W37-F46 AromaticContact NE1-CD2 3.6Å; W37-F46 PolarHBondContact O-N 3.13Å; W37-W48 AromaticContact CE3-CD1 3.98Å; W37-W48 AromaticContact CH2-NE1 3.8Å; W37-W48 AromaticContact CZ3-CD1 3.33Å; W37-W48 AromaticContact CZ3-NE1 3.18Å; W37-F91 HydrophobicContact CH2-CE1 4.42Å; W37-F91 AromaticContact CZ2-CE1 3.96Å; W37-F91 HydrophobicContact CZ2-CE1 3.96Å; W37-F91 AromaticContact CZ2-CZ 3.81Å; W37-F91 HydrophobicContact CZ2-CZ 3.81Å; W37-P94 HydrophobicContact CB-CB 4.44Å; W37-P94 HydrophobicContact CD2-CB 4Å; W37-P94 HydrophobicContact CD2-CG 3.55Å; W37-P94 HydrophobicContact CE3-CG 4.09Å; W37-P94 HydrophobicContact CG-CB 3.89Å; W37-P94 HydrophobicContact CG-CG 3.93Å; W37-P94 HydrophobicContact CH2-CG 4.16Å; W37-P94 HydrophobicContact CZ2-CG 3.68Å; W37-P94 HydrophobicContact CZ3-CG 4.39Å; W37-E96 HydrophobicContact CB-CB 4.07Å; W37-E96 HydrophobicContact CB-CG 4.05Å; W37-I97 HydrophobicContact CE3-CG2 4.27Å; W37-I97 HydrophobicContact CZ3-CD1 4.26Å; W37-L204 HydrophobicContact CH2-CD1 3.46Å; W37-L204 VanDerWaalsContact CH2-CD1 3.46Å; W37-L204 HydrophobicContact CH2-CD2 3.81Å; W37-L204 HydrophobicContact CH2-CG 4.26Å; W37-L204 HydrophobicContact CZ3-CD1 3.51Å
38	Y	86.7	Confident	82.9	Confident	41 Å²	41	47.6 Å²	47.6	16%	0.161	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.6	179.4	178.1	-113	0	0	0	110.2	E24 K40 G43 L44 E209	E24-Y38 HydrophobicContact CB-CD1 4.36Å; E24-Y38 HydrophobicContact CB-CE1 4.24Å; E24-Y38 HydrophobicContact CG-CD1 4.21Å; E24-Y38 HydrophobicContact CG-CE1 3.69Å; E24-Y38 WeakPolarHBondContact OE1-CE1 3.36Å; E24-Y38 VanDerWaalsContact OE2-CD1 3.3Å; E24-Y38 WeakPolarHBondContact OE2-CD1 3.26Å; E24-Y38 WeakPolarHBondContact OE2-CE1 3.3Å; Y38-K40 HydrophobicContact CD1-CB 4.41Å; Y38-K40 HydrophobicContact CD1-CG 3.54Å; Y38-K40 HydrophobicContact CE1-CB 4.1Å; Y38-K40 HydrophobicContact CE1-CG 3.52Å; Y38-K40 PolarHBondContact O-N 2.84Å; Y38-G43 WeakPolarHBondContact OH-CA 3.28Å; Y38-L44 VanDerWaalsContact CD2-O 3.27Å; Y38-L44 WeakPolarHBondContact CD2-O 3.18Å; Y38-E209 HydrophobicContact CE2-CG 3.78Å; Y38-E209 WeakPolarHBondContact CE2-OE1 3.47Å; Y38-E209 PolarHBondContact OH-OE1 2.92Å
39	D	83.1	Confident	82.4	Confident	37 Å²	37	46.2 Å²	46.2	20%	0.198	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	96.8	170.8	-174.9	-24.3	0	0	0	108.9	G41 K42 G43 L44 F46	D39-G41 PolarHBondContact O-N 2.85Å; D39-G41 WeakPolarHBondContact OD1-CA 3.47Å; D39-G41 PolarHBondContact OD1-N 2.03Å; D39-K42 HydrophobicContact CB-CB 4.3Å; D39-K42 PolarHBondContact O-N 2.81Å; D39-K42 PolarHBondContact OD1-N 2.9Å; D39-K42 VanDerWaalsContact OD2-CD 3.26Å; D39-K42 WeakPolarHBondContact OD2-CD 3.49Å; D39-K42 WeakPolarHBondContact OD2-CG 3.5Å; D39-K42 IonicContact OD2-NZ 3.75Å; D39-G43 PolarHBondContact O-N 3.04Å; D39-L44 PolarHBondContact N-O 3.03Å; D39-L44 PolarHBondContact O-N 2.03Å; D39-F46 HydrophobicContact CB-CD2 4.2Å; D39-F46 HydrophobicContact CB-CE2 3.63Å
40	K	81.9	Confident	81.3	Confident	158 Å²	158	44.6 Å²	44.6	69%	0.687	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.1	177.1	-67.7	-171.9	171.5	-174.9	0	113.4	Y38	Y38-K40 HydrophobicContact CD1-CB 4.41Å; Y38-K40 HydrophobicContact CD1-CG 3.54Å; Y38-K40 HydrophobicContact CE1-CB 4.1Å; Y38-K40 HydrophobicContact CE1-CG 3.52Å; Y38-K40 PolarHBondContact O-N 2.84Å
41	G	79	Confident	79.7	Confident	76 Å²	76	47.5 Å²	47.5	78%	0.784	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-34.2	-179	0	0	0	0	0	112.3	D39	D39-G41 PolarHBondContact O-N 2.85Å; D39-G41 WeakPolarHBondContact OD1-CA 3.47Å; D39-G41 PolarHBondContact OD1-N 2.03Å
42	K	76.1	Confident	77.8	Confident	116 Å²	116	52.3 Å²	52.3	50%	0.504	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-15.2	179.8	-62.8	-177.4	-172	168.1	0	114.1	D39 L44	D39-K42 HydrophobicContact CB-CB 4.3Å; D39-K42 PolarHBondContact O-N 2.81Å; D39-K42 PolarHBondContact OD1-N 2.9Å; D39-K42 VanDerWaalsContact OD2-CD 3.26Å; D39-K42 WeakPolarHBondContact OD2-CD 3.49Å; D39-K42 WeakPolarHBondContact OD2-CG 3.5Å; D39-K42 IonicContact OD2-NZ 3.75Å; K42-L44 VanDerWaalsContact C-N 3.3Å; K42-L44 HydrophobicContact CB-CB 4.23Å; K42-L44 HydrophobicContact CB-CD1 3.88Å; K42-L44 HydrophobicContact CB-CG 3.93Å; K42-L44 HydrophobicContact CD-CD1 4.2Å
43	G	81.9	Confident	76.3	Confident	26 Å²	26	53.6 Å²	53.6	27%	0.268	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	34.5	-172.1	0	0	0	0	0	112.6	Y38 D39	Y38-G43 WeakPolarHBondContact OH-CA 3.28Å; D39-G43 PolarHBondContact O-N 3.04Å
44	L	84.8	Confident	75.1	Confident	39 Å²	39	51.6 Å²	51.6	20%	0.204	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	139.7	-173.6	-68.7	176.9	0	0	0	111.6	Y38 D39 K42 F46	Y38-L44 VanDerWaalsContact CD2-O 3.27Å; Y38-L44 WeakPolarHBondContact CD2-O 3.18Å; D39-L44 PolarHBondContact N-O 3.03Å; D39-L44 PolarHBondContact O-N 2.03Å; K42-L44 VanDerWaalsContact C-N 3.3Å; K42-L44 HydrophobicContact CB-CB 4.23Å; K42-L44 HydrophobicContact CB-CD1 3.88Å; K42-L44 HydrophobicContact CB-CG 3.93Å; K42-L44 HydrophobicContact CD-CD1 4.2Å; L44-F46 HydrophobicContact CB-CE2 3.82Å; L44-F46 HydrophobicContact CB-CZ 4.25Å; L44-F46 HydrophobicContact CD1-CZ 4.39Å
45	C	87.4	Confident	74.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.4	174.3	-63.7	0	0	0	0	109.6	C26 W28 E206 T207	C26-C45 WeakPolarHBondContact CA-SG 3.33Å; C26-C45 HydrophobicContact CB-CB 3.53Å; C26-C45 WeakPolarHBondContact CB-SG 2.99Å; C26-C45 WeakPolarHBondContact SG-CB 3.47Å; C26-C45 CovalentContact SG-SG 2.03Å; C26-C45 PolarHBondContact SG-SG 2.84Å; W28-C45 HydrophobicContact CH2-CB 3.67Å; W28-C45 HydrophobicContact CZ3-CB 3.55Å; C45-E206 CarbonylContact O-C 3.6Å; C45-E206 WeakPolarHBondContact O-CA 3.5Å; C45-T207 HydrophobicContact CB-CG2 3.86Å; C45-T207 WeakPolarHBondContact CB-O 3.46Å; C45-T207 PolarHBondContact N-O 3.4Å; C45-T207 PolarHBondContact O-N 3Å
46	F	87.8	Confident	73.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.9	175.5	-68.2	-90.3	0	0	0	112.1	W28 G36 W37 D39 L44 H75 L204 C205 E206	W28-F46 VanDerWaalsContact CE3-O 3.24Å; W28-F46 VanDerWaalsContact CZ3-C 3.48Å; W28-F46 VanDerWaalsContact CZ3-N 3.28Å; W28-F46 WeakPolarHBondContact CZ3-O 3.36Å; G36-F46 CarbonylContact C-O 3.6Å; G36-F46 WeakPolarHBondContact CA-O 3.36Å; W37-F46 HydrophobicContact CD2-CB 3.6Å; W37-F46 HydrophobicContact CD2-CD2 4.28Å; W37-F46 HydrophobicContact CD2-CG 4.14Å; W37-F46 AromaticContact CE2-CD2 3.55Å; W37-F46 AromaticContact CE2-CG 3.56Å; W37-F46 HydrophobicContact CE3-CB 3.45Å; W37-F46 VanDerWaalsContact CE3-CB 3.45Å; W37-F46 HydrophobicContact CE3-CG 4.33Å; W37-F46 HydrophobicContact CG-CB 4.47Å; W37-F46 HydrophobicContact CH2-CB 3.43Å; W37-F46 VanDerWaalsContact CH2-CB 3.43Å; W37-F46 AromaticContact CH2-CD1 3.76Å; W37-F46 HydrophobicContact CH2-CD1 3.76Å; W37-F46 HydrophobicContact CH2-CD2 4.39Å; W37-F46 AromaticContact CH2-CG 3.61Å; W37-F46 HydrophobicContact CH2-CG 3.61Å; W37-F46 HydrophobicContact CZ2-CB 3.53Å; W37-F46 AromaticContact CZ2-CD1 3.66Å; W37-F46 HydrophobicContact CZ2-CD1 3.66Å; W37-F46 AromaticContact CZ2-CD2 3.66Å; W37-F46 HydrophobicContact CZ2-CD2 3.66Å; W37-F46 HydrophobicContact CZ2-CE1 4.26Å; W37-F46 HydrophobicContact CZ2-CE2 4.29Å; W37-F46 AromaticContact CZ2-CG 3.31Å; W37-F46 HydrophobicContact CZ2-CG 3.31Å; W37-F46 HydrophobicContact CZ3-CB 3.31Å; W37-F46 HydrophobicContact CZ3-CD1 4.47Å; W37-F46 HydrophobicContact CZ3-CG 4.04Å; W37-F46 PolarHBondContact N-O 3.48Å; W37-F46 AromaticContact NE1-CD2 3.6Å; W37-F46 PolarHBondContact O-N 3.13Å; D39-F46 HydrophobicContact CB-CD2 4.2Å; D39-F46 HydrophobicContact CB-CE2 3.63Å; L44-F46 HydrophobicContact CB-CE2 3.82Å; L44-F46 HydrophobicContact CB-CZ 4.25Å; L44-F46 HydrophobicContact CD1-CZ 4.39Å; F46-H75 HydrophobicContact CE1-CB 4.21Å; F46-H75 AromaticContact CE1-CE1 3.8Å; F46-H75 AromaticContact CE1-CG 3.69Å; F46-H75 AromaticContact CE1-ND1 3.52Å; F46-L204 HydrophobicContact CB-CD1 4.12Å; F46-L204 HydrophobicContact CD1-CD1 4.04Å; F46-L204 HydrophobicContact CD1-CD2 4.34Å; F46-L204 HydrophobicContact CD1-CG 4.27Å; F46-C205 CarbonylContact C-O 3.45Å; F46-C205 WeakPolarHBondContact CA-O 3.09Å; F46-E206 HydrophobicContact CD1-CB 3.78Å; F46-E206 HydrophobicContact CE1-CB 3.6Å; F46-E206 WeakPolarHBondContact CE1-OE2 3.46Å; F46-E206 HydrophobicContact CZ-CB 4.22Å
47	T	84.6	Confident	73.1	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.006	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.5	173.5	49.1	0	0	0	0	110.8	P27 W28 Q35 H49 C205	P27-T47 HydrophobicContact CB-CG2 3.91Å; P27-T47 HydrophobicContact CG-CG2 4.11Å; W28-T47 HydrophobicContact CE3-CG2 3.63Å; W28-T47 HydrophobicContact CZ3-CG2 4.21Å; Q35-T47 WeakPolarHBondContact O-CA 3.49Å; T47-H49 WeakPolarHBondContact CB-NE2 3.45Å; T47-H49 PolarHBondContact OG1-CD2 2.66Å; T47-H49 PolarHBondContact OG1-NE2 3.21Å; T47-C205 PolarHBondContact N-O 3.32Å; T47-C205 PolarHBondContact O-N 3.33Å
48	W	81.4	Confident	73.1	Confident	7 Å²	7	63.9 Å²	63.9	3%	0.027	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.4	168.4	-89.1	90.7	0	0	0	109.9	Q35 W37 I97 P106 F108 F188 Q202 L204	Q35-W48 HydrophobicContact CB-CB 4.22Å; Q35-W48 PolarHBondContact O-N 3.21Å; W37-W48 AromaticContact CE3-CD1 3.98Å; W37-W48 AromaticContact CH2-NE1 3.8Å; W37-W48 AromaticContact CZ3-CD1 3.33Å; W37-W48 AromaticContact CZ3-NE1 3.18Å; W48-I97 HydrophobicContact CZ2-CD1 3.99Å; W48-P106 HydrophobicContact CH2-CG 4.04Å; W48-P106 HydrophobicContact CZ3-CB 4.18Å; W48-P106 HydrophobicContact CZ3-CG 3.87Å; W48-F108 AromaticContact CH2-CD1 3.5Å; W48-F108 HydrophobicContact CH2-CD1 3.5Å; W48-F108 VanDerWaalsContact CH2-CD1 3.5Å; W48-F108 HydrophobicContact CH2-CD2 4.31Å; W48-F108 AromaticContact CH2-CE1 3.48Å; W48-F108 HydrophobicContact CH2-CE1 3.48Å; W48-F108 VanDerWaalsContact CH2-CE1 3.48Å; W48-F108 HydrophobicContact CH2-CE2 4.25Å; W48-F108 AromaticContact CH2-CG 3.94Å; W48-F108 HydrophobicContact CH2-CG 3.94Å; W48-F108 AromaticContact CH2-CZ 3.86Å; W48-F108 HydrophobicContact CH2-CZ 3.86Å; W48-F108 HydrophobicContact CZ2-CE1 4.19Å; W48-F108 HydrophobicContact CZ2-CZ 4.15Å; W48-F108 HydrophobicContact CZ3-CD1 4.02Å; W48-F108 HydrophobicContact CZ3-CE1 4.43Å; W48-F108 HydrophobicContact CZ3-CG 4.25Å; W48-F188 HydrophobicContact CH2-CE1 4.14Å; W48-F188 HydrophobicContact CH2-CE2 4.38Å; W48-F188 AromaticContact CH2-CZ 3.73Å; W48-F188 HydrophobicContact CH2-CZ 3.73Å; W48-F188 HydrophobicContact CZ2-CE1 4.18Å; W48-F188 AromaticContact CZ2-CE2 3.65Å; W48-F188 HydrophobicContact CZ2-CE2 3.65Å; W48-F188 AromaticContact CZ2-CZ 3.33Å; W48-F188 HydrophobicContact CZ2-CZ 3.33Å; W48-Q202 HydrophobicContact CE3-CB 3.71Å; W48-Q202 HydrophobicContact CE3-CG 4.35Å; W48-Q202 HydrophobicContact CZ3-CB 3.59Å; W48-Q202 HydrophobicContact CZ3-CG 4.32Å; W48-L204 HydrophobicContact CD2-CD1 4.45Å; W48-L204 HydrophobicContact CG-CD1 4.33Å
49	H	74.4	Confident	73.1	Confident	3 Å²	3	62 Å²	62	1%	0.014	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	96.6	178.8	-68.6	-72.4	0	0	0	109.9	T47 F51 Y70 Q202 V203 C205	T47-H49 WeakPolarHBondContact CB-NE2 3.45Å; T47-H49 PolarHBondContact OG1-CD2 2.66Å; T47-H49 PolarHBondContact OG1-NE2 3.21Å; H49-F51 HydrophobicContact CB-CD2 3.73Å; H49-F51 HydrophobicContact CB-CE2 3.69Å; H49-F51 AromaticContact CG-CE2 3.65Å; H49-F51 AromaticContact ND1-CE2 3.35Å; H49-F51 VanDerWaalsContact ND1-CE2 3.35Å; H49-F51 WeakPolarHBondContact ND1-CE2 3.35Å; H49-F51 AromaticContact ND1-CZ 3.8Å; H49-Y70 AromaticContact CE1-CE2 3.19Å; H49-Y70 WeakPolarHBondContact CE1-CE2 3.49Å; H49-Y70 AromaticContact CE1-CZ 3.47Å; H49-Y70 VanDerWaalsContact CE1-CZ 3.47Å; H49-Y70 PolarHBondContact CE1-OH 3.39Å; H49-Y70 AromaticContact NE2-CD2 3.83Å; H49-Y70 AromaticContact NE2-CE2 3.11Å; H49-Y70 WeakPolarHBondContact NE2-CE2 3.4Å; H49-Y70 AromaticContact NE2-CZ 3.86Å; H49-Q202 CarbonylContact O-C 3.6Å; H49-Q202 VanDerWaalsContact O-CA 3.24Å; H49-Q202 WeakPolarHBondContact O-CA 3.36Å; H49-V203 HydrophobicContact CB-CG1 3.67Å; H49-V203 PolarHBondContact N-O 3.43Å; H49-V203 PolarHBondContact O-N 2.96Å; H49-C205 PolarHBondContact CD2-SG 3.44Å
50	G	61.6	Low	73.3	Confident	43 Å²	43	64 Å²	64	44%	0.443	34%	0.344	S	S	.	.			trans	-92.6	95.5	153.4	0	0	0	0	0	107.3	V52	G50-V52 PolarHBondContact O-N 2.72Å
51	F	50.6	Low	73.5	Confident	64 Å²	64	59.6 Å²	59.6	28%	0.281	33%	0.328	S	S	.	.			trans	-80.1	117.7	-178.3	-91.6	-86.3	0	0	0	110	H49 D53 T54 F56 V65	H49-F51 HydrophobicContact CB-CD2 3.73Å; H49-F51 HydrophobicContact CB-CE2 3.69Å; H49-F51 AromaticContact CG-CE2 3.65Å; H49-F51 AromaticContact ND1-CE2 3.35Å; H49-F51 VanDerWaalsContact ND1-CE2 3.35Å; H49-F51 WeakPolarHBondContact ND1-CE2 3.35Å; H49-F51 AromaticContact ND1-CZ 3.8Å; F51-D53 PolarHBondContact O-N 2.99Å; F51-T54 WeakPolarHBondContact CB-OG1 3.25Å; F51-T54 VanDerWaalsContact CG-OG1 3.31Å; F51-T54 WeakPolarHBondContact CG-OG1 3.41Å; F51-T54 PolarHBondContact O-N 3.15Å; F51-F56 HydrophobicContact CD2-CE2 4.38Å; F51-F56 AromaticContact CD2-CZ 3.71Å; F51-F56 HydrophobicContact CD2-CZ 3.71Å; F51-F56 HydrophobicContact CE2-CZ 4.41Å; F51-V65 HydrophobicContact CE2-CG1 3.79Å; F51-V65 HydrophobicContact CZ-CG1 4.37Å
52	V	43.2	Very low	73.8	Confident	139 Å²	139	56 Å²	56	84%	0.842	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-10.4	168.4	179.6	0	0	0	0	112.6	G50	G50-V52 PolarHBondContact O-N 2.72Å
53	D	45.1	Very low	74.4	Confident	152 Å²	152	51.3 Å²	51.3	81%	0.813	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.3	5.8	-179.9	-88.5	-41.6	0	0	0	116.8	F51	F51-D53 PolarHBondContact O-N 2.99Å
54	T	52.1	Low	74.5	Confident	54 Å²	54	54.6 Å²	54.6	33%	0.331	28%	0.284	S	S	.	.			trans	-129.7	89	174.1	65.2	0	0	0	0	109.6	F51 F56	F51-T54 WeakPolarHBondContact CB-OG1 3.25Å; F51-T54 VanDerWaalsContact CG-OG1 3.31Å; F51-T54 WeakPolarHBondContact CG-OG1 3.41Å; F51-T54 PolarHBondContact O-N 3.15Å; T54-F56 PolarHBondContact O-N 3.16Å
55	R	58.6	Low	74.3	Confident	206 Å²	206	54 Å²	54	78%	0.777	28%	0.282	S	S	*	.			trans	-55.9	105.8	159.3	-63.5	-175.5	-163.6	-175.9	3.4	106.5	K57	R55-K57 WeakPolarHBondContact O-CG 3.31Å; R55-K57 PolarHBondContact O-N 3.16Å
56	F	69.3	Low	74.2	Confident	4 Å²	4	54 Å²	54	2%	0.018	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-65.6	108.8	178.4	-64.8	-73.9	0	0	0	107.5	F51 T54 S58 V65 V200 V203	F51-F56 HydrophobicContact CD2-CE2 4.38Å; F51-F56 AromaticContact CD2-CZ 3.71Å; F51-F56 HydrophobicContact CD2-CZ 3.71Å; F51-F56 HydrophobicContact CE2-CZ 4.41Å; T54-F56 PolarHBondContact O-N 3.16Å; F56-S58 VanDerWaalsContact C-N 3.32Å; F56-V65 HydrophobicContact CE1-CB 4.1Å; F56-V65 HydrophobicContact CE1-CG1 4.2Å; F56-V65 HydrophobicContact CE1-CG2 3.99Å; F56-V200 HydrophobicContact CB-CG2 3.87Å; F56-V200 HydrophobicContact CD2-CG2 4.36Å; F56-V200 HydrophobicContact CG-CG2 4.41Å; F56-V203 HydrophobicContact CE1-CG1 3.92Å; F56-V203 HydrophobicContact CE2-CB 4.24Å; F56-V203 HydrophobicContact CE2-CG1 3.8Å; F56-V203 HydrophobicContact CZ-CB 4.18Å; F56-V203 HydrophobicContact CZ-CG1 3.35Å
57	K	77.7	Confident	74.1	Confident	153 Å²	153	57.9 Å²	57.9	67%	0.665	30%	0.303	S	S	*	.			trans	-85	-12.7	-177.5	-62.5	-175	-178.7	178.3	0	112.2	R55 D197	R55-K57 WeakPolarHBondContact O-CG 3.31Å; R55-K57 PolarHBondContact O-N 3.16Å; K57-D197 CarbonylContact O-C 3.45Å; K57-D197 WeakPolarHBondContact O-CA 3.16Å
58	S	87	Confident	73.7	Confident	22 Å²	22	61.6 Å²	61.6	15%	0.154	33%	0.329	C	S	.	.	S	Bend	trans	-159.2	163.7	179	69.5	0	0	0	0	112.5	F56 I60 D61 S62 C196	F56-S58 VanDerWaalsContact C-N 3.32Å; S58-I60 PolarHBondContact O-N 3.29Å; S58-I60 PolarHBondContact OG-N 2.86Å; S58-D61 PolarHBondContact N-OD2 3.05Å; S58-D61 PolarHBondContact O-N 3.07Å; S58-D61 PolarHBondContact OG-N 2.94Å; S58-D61 PolarHBondContact OG-OD2 3.04Å; S58-S62 PolarHBondContact O-N 2.91Å; S58-S62 VanDerWaalsContact O-N 3.11Å; S58-S62 PolarHBondContact O-OG 2.72Å; S58-C196 WeakPolarHBondContact CA-O 2.92Å
59	Y	88.2	Confident	73.3	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.008	34%	0.34	C	S	.	.	H	α-helix	trans	-55.6	-39.6	168.3	-179.6	-80.2	0	0	0	111.8	S62 A63 M74 Y109 G111 A136 C178 C196	Y59-S62 WeakPolarHBondContact O-CB 3.3Å; Y59-S62 PolarHBondContact O-N 3.17Å; Y59-A63 WeakPolarHBondContact O-CB 3.23Å; Y59-A63 PolarHBondContact O-N 3.46Å; Y59-M74 HydrophobicContact CD1-CE 4.01Å; Y59-M74 HydrophobicContact CD2-CE 3.36Å; Y59-M74 HydrophobicContact CE1-CE 3.67Å; Y59-M74 HydrophobicContact CE2-CE 3.02Å; Y59-M74 HydrophobicContact CG-CE 3.85Å; Y59-Y109 AromaticContact CD2-CD1 3.9Å; Y59-Y109 HydrophobicContact CD2-CD1 3.9Å; Y59-Y109 HydrophobicContact CD2-CD2 4.39Å; Y59-Y109 HydrophobicContact CD2-CE1 4.34Å; Y59-Y109 AromaticContact CD2-CG 3.92Å; Y59-Y109 HydrophobicContact CD2-CG 3.92Å; Y59-Y109 PolarHBondContact N-OH 3.1Å; Y59-Y109 VanDerWaalsContact N-OH 3.09Å; Y59-G111 PolarHBondContact OH-O 3.45Å; Y59-A136 HydrophobicContact CE1-CB 4.33Å; Y59-A136 PolarHBondContact OH-N 3.14Å; Y59-C178 HydrophobicContact CD2-CB 4.39Å; Y59-C178 WeakPolarHBondContact CD2-SG 3.19Å; Y59-C178 VanDerWaalsContact CG-SG 3.6Å; Y59-C196 WeakPolarHBondContact CB-O 3.41Å; Y59-C196 PolarHBondContact N-O 2.9Å
60	I	87.3	Confident	73.2	Confident	78 Å²	78	63.7 Å²	63.7	40%	0.4	34%	0.34	S	S	.	.	H	α-helix	trans	-69.9	-42.4	-178.2	-61.8	-63	0	0	0	110.6	S58 S62 A63 I64	S58-I60 PolarHBondContact O-N 3.29Å; S58-I60 PolarHBondContact OG-N 2.86Å; I60-S62 VanDerWaalsContact C-N 3.27Å; I60-S62 PolarHBondContact O-N 2.89Å; I60-A63 PolarHBondContact O-N 2.92Å; I60-I64 HydrophobicContact CG2-CD1 3.77Å; I60-I64 HydrophobicContact CG2-CG1 4.32Å; I60-I64 VanDerWaalsContact O-CG1 3.28Å; I60-I64 WeakPolarHBondContact O-CG1 3.46Å; I60-I64 PolarHBondContact O-N 3.46Å
61	D	85.3	Confident	73.9	Confident	67 Å²	67	64.7 Å²	64.7	36%	0.358	34%	0.335	S	S	.	.	H	α-helix	trans	-59.3	-43.6	175	-61	-36.5	0	0	0	110.8	S58 A63 I64 V65	S58-D61 PolarHBondContact N-OD2 3.05Å; S58-D61 PolarHBondContact O-N 3.07Å; S58-D61 PolarHBondContact OG-N 2.94Å; S58-D61 PolarHBondContact OG-OD2 3.04Å; D61-A63 PolarHBondContact O-N 3.32Å; D61-I64 PolarHBondContact O-N 2.96Å; D61-V65 WeakPolarHBondContact O-CG2 3.39Å; D61-V65 PolarHBondContact O-N 3.44Å
62	S	85.8	Confident	75.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.3	-45.1	177.2	-53.6	0	0	0	0	111.7	S58 Y59 I60 V65 C66	S58-S62 PolarHBondContact O-N 2.91Å; S58-S62 VanDerWaalsContact O-N 3.11Å; S58-S62 PolarHBondContact O-OG 2.72Å; Y59-S62 WeakPolarHBondContact O-CB 3.3Å; Y59-S62 PolarHBondContact O-N 3.17Å; I60-S62 VanDerWaalsContact C-N 3.27Å; I60-S62 PolarHBondContact O-N 2.89Å; S62-V65 PolarHBondContact O-N 3.46Å; S62-C66 PolarHBondContact O-N 2.85Å; S62-C66 PolarHBondContact O-SG 2.94Å
63	A	87.7	Confident	77.4	Confident	17 Å²	17	60 Å²	60	14%	0.14	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-41.7	176.9	0	0	0	0	0	112.5	Y59 I60 D61 V65 C66 N67 A136	Y59-A63 WeakPolarHBondContact O-CB 3.23Å; Y59-A63 PolarHBondContact O-N 3.46Å; I60-A63 PolarHBondContact O-N 2.92Å; D61-A63 PolarHBondContact O-N 3.32Å; A63-V65 VanDerWaalsContact C-N 3.31Å; A63-V65 PolarHBondContact O-N 2.83Å; A63-C66 PolarHBondContact O-N 3.42Å; A63-N67 WeakPolarHBondContact O-CB 3.44Å; A63-N67 PolarHBondContact O-N 3.45Å; A63-N67 VanDerWaalsContact O-N 3.08Å; A63-A136 HydrophobicContact CB-CB 3.93Å
64	I	84.7	Confident	79.5	Confident	95 Å²	95	53 Å²	53	49%	0.487	26%	0.263	S	S	.	.	H	α-helix	trans	-61.5	-41.9	176.8	-71.3	167.4	0	0	0	110.3	I60 D61 N67 S68	I60-I64 HydrophobicContact CG2-CD1 3.77Å; I60-I64 HydrophobicContact CG2-CG1 4.32Å; I60-I64 VanDerWaalsContact O-CG1 3.28Å; I60-I64 WeakPolarHBondContact O-CG1 3.46Å; I60-I64 PolarHBondContact O-N 3.46Å; D61-I64 PolarHBondContact O-N 2.96Å; I64-N67 PolarHBondContact O-N 3.36Å; I64-S68 WeakPolarHBondContact O-CB 3.46Å; I64-S68 PolarHBondContact O-N 3.35Å; I64-S68 PolarHBondContact O-OG 3.31Å
65	V	81.4	Confident	81.1	Confident	26 Å²	26	50.9 Å²	50.9	16%	0.158	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-48.9	178.3	168.7	0	0	0	0	111.3	F51 F56 D61 S62 A63 N67 S68 M69	F51-V65 HydrophobicContact CE2-CG1 3.79Å; F51-V65 HydrophobicContact CZ-CG1 4.37Å; F56-V65 HydrophobicContact CE1-CB 4.1Å; F56-V65 HydrophobicContact CE1-CG1 4.2Å; F56-V65 HydrophobicContact CE1-CG2 3.99Å; D61-V65 WeakPolarHBondContact O-CG2 3.39Å; D61-V65 PolarHBondContact O-N 3.44Å; S62-V65 PolarHBondContact O-N 3.46Å; A63-V65 VanDerWaalsContact C-N 3.31Å; A63-V65 PolarHBondContact O-N 2.83Å; V65-N67 VanDerWaalsContact C-N 3.28Å; V65-N67 PolarHBondContact O-N 3.35Å; V65-S68 PolarHBondContact O-OG 3.48Å; V65-M69 HydrophobicContact CG1-CG 4.31Å; V65-M69 VanDerWaalsContact O-CB 3.3Å; V65-M69 WeakPolarHBondContact O-CB 3.44Å; V65-M69 WeakPolarHBondContact O-CG 3.39Å; V65-M69 PolarHBondContact O-N 3.41Å; V65-M69 VanDerWaalsContact O-N 3.07Å
66	C	85.3	Confident	82.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-42.1	177.6	-65.2	0	0	0	0	112.4	S62 A63 Y70 G72 C205	S62-C66 PolarHBondContact O-N 2.85Å; S62-C66 PolarHBondContact O-SG 2.94Å; A63-C66 PolarHBondContact O-N 3.42Å; C66-Y70 PolarHBondContact O-N 2.89Å; C66-G72 CarbonylContact C-O 3.32Å; C66-G72 CarbonylContact O-C 3.38Å; C66-G72 WeakPolarHBondContact O-CA 3.5Å; C66-G72 PolarHBondContact O-N 2.89Å; C66-G72 VanDerWaalsContact O-N 3.07Å; C66-C205 WeakPolarHBondContact CA-SG 3.26Å; C66-C205 HydrophobicContact CB-CB 3.71Å; C66-C205 WeakPolarHBondContact CB-SG 3.12Å; C66-C205 WeakPolarHBondContact SG-CB 3.41Å; C66-C205 CovalentContact SG-SG 2.03Å; C66-C205 PolarHBondContact SG-SG 2.8Å
67	N	84.7	Confident	82.6	Confident	82 Å²	82	42.4 Å²	42.4	44%	0.439	22%	0.221	S	C	.	.	H	α-helix	trans	-72	-51.6	-178.5	-173.5	32.7	0	0	0	112.3	A63 I64 V65 M69 N71 G72	A63-N67 WeakPolarHBondContact O-CB 3.44Å; A63-N67 PolarHBondContact O-N 3.45Å; A63-N67 VanDerWaalsContact O-N 3.08Å; I64-N67 PolarHBondContact O-N 3.36Å; V65-N67 VanDerWaalsContact C-N 3.28Å; V65-N67 PolarHBondContact O-N 3.35Å; N67-M69 PolarHBondContact O-N 2.89Å; N67-N71 VanDerWaalsContact O-CA 3.25Å; N67-N71 WeakPolarHBondContact O-CA 3.28Å; N67-N71 PolarHBondContact O-N 3.27Å; N67-G72 VanDerWaalsContact CA-O 3.26Å; N67-G72 WeakPolarHBondContact CA-O 3.48Å; N67-G72 PolarHBondContact N-O 3.44Å
68	S	76.5	Confident	81.9	Confident	79 Å²	79	39.9 Å²	39.9	55%	0.552	21%	0.208	S	C	*	.	H	α-helix	trans	-67.3	-35.8	-174.5	59.4	0	0	0	0	113.1	I64 V65	I64-S68 WeakPolarHBondContact O-CB 3.46Å; I64-S68 PolarHBondContact O-N 3.35Å; I64-S68 PolarHBondContact O-OG 3.31Å; V65-S68 PolarHBondContact O-OG 3.48Å
69	M	72.5	Confident	80.3	Confident	53 Å²	53	41 Å²	41	26%	0.261	21%	0.214	S	C	.	.	H	α-helix	trans	-82	-40.8	-175.8	-67.8	-70.2	-75.6	0	0	112.4	V65 N67 W224 F237	V65-M69 HydrophobicContact CG1-CG 4.31Å; V65-M69 VanDerWaalsContact O-CB 3.3Å; V65-M69 WeakPolarHBondContact O-CB 3.44Å; V65-M69 WeakPolarHBondContact O-CG 3.39Å; V65-M69 PolarHBondContact O-N 3.41Å; V65-M69 VanDerWaalsContact O-N 3.07Å; N67-M69 PolarHBondContact O-N 2.89Å; M69-W224 HydrophobicContact CE-CZ2 4.41Å; M69-F237 VanDerWaalsContact O-CE2 3.29Å; M69-F237 WeakPolarHBondContact O-CE2 3.35Å
70	Y	72.3	Confident	78	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-128.5	5.6	-166.9	-48.3	-57.2	0	0	0	114.8	P27 H49 C66 G72 T207 W224 F237	P27-Y70 HydrophobicContact CB-CD1 3.93Å; P27-Y70 HydrophobicContact CB-CE1 4.31Å; P27-Y70 HydrophobicContact CB-CG 4.46Å; P27-Y70 HydrophobicContact CG-CD1 4.17Å; P27-Y70 HydrophobicContact CG-CG 4.32Å; H49-Y70 AromaticContact CE1-CE2 3.19Å; H49-Y70 WeakPolarHBondContact CE1-CE2 3.49Å; H49-Y70 AromaticContact CE1-CZ 3.47Å; H49-Y70 VanDerWaalsContact CE1-CZ 3.47Å; H49-Y70 PolarHBondContact CE1-OH 3.39Å; H49-Y70 AromaticContact NE2-CD2 3.83Å; H49-Y70 AromaticContact NE2-CE2 3.11Å; H49-Y70 WeakPolarHBondContact NE2-CE2 3.4Å; H49-Y70 AromaticContact NE2-CZ 3.86Å; C66-Y70 PolarHBondContact O-N 2.89Å; Y70-G72 PolarHBondContact O-N 3.49Å; Y70-G72 VanDerWaalsContact O-N 3.11Å; Y70-T207 PolarHBondContact O-OG1 2.9Å; Y70-W224 HydrophobicContact CD1-CH2 4.14Å; Y70-W224 AromaticContact CE1-CH2 3.13Å; Y70-W224 HydrophobicContact CE1-CH2 3.13Å; Y70-W224 AromaticContact CE1-CZ2 3.59Å; Y70-W224 HydrophobicContact CE1-CZ2 3.59Å; Y70-W224 HydrophobicContact CE1-CZ3 4.01Å; Y70-W224 AromaticContact CZ-CH2 3.69Å; Y70-W224 AromaticContact CZ-CZ2 3.9Å; Y70-W224 VanDerWaalsContact OH-CZ2 3.32Å; Y70-W224 WeakPolarHBondContact OH-CZ2 3.32Å; Y70-F237 HydrophobicContact CD1-CD2 4.31Å; Y70-F237 HydrophobicContact CD1-CE2 4.02Å; Y70-F237 HydrophobicContact CE1-CE2 4.06Å
71	N	77	Confident	75.6	Confident	64 Å²	64	53.2 Å²	53.2	34%	0.342	27%	0.269	S	S	.	.	S	Bend	trans	48.9	33.5	-164	-171.5	38.9	0	0	0	110.9	N67 Q239 F240	N67-N71 VanDerWaalsContact O-CA 3.25Å; N67-N71 WeakPolarHBondContact O-CA 3.28Å; N67-N71 PolarHBondContact O-N 3.27Å; N71-Q239 HydrophobicContact CB-CB 4.1Å; N71-Q239 HydrophobicContact CB-CG 3.49Å; N71-Q239 VanDerWaalsContact CB-CG 3.49Å; N71-Q239 PolarHBondContact ND2-O 2.68Å; N71-F240 HydrophobicContact CB-CD1 4.49Å; N71-F240 HydrophobicContact CB-CE1 3.83Å; N71-F240 HydrophobicContact CB-CZ 4.24Å; N71-F240 VanDerWaalsContact CG-CE1 3.48Å
72	G	81.1	Confident	73.1	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.021	28%	0.279	C	S	.	.			trans	-101.3	-168.4	-179.1	0	0	0	0	0	110.2	C66 N67 Y70 Y137 E206	C66-G72 CarbonylContact C-O 3.32Å; C66-G72 CarbonylContact O-C 3.38Å; C66-G72 WeakPolarHBondContact O-CA 3.5Å; C66-G72 PolarHBondContact O-N 2.89Å; C66-G72 VanDerWaalsContact O-N 3.07Å; N67-G72 VanDerWaalsContact CA-O 3.26Å; N67-G72 WeakPolarHBondContact CA-O 3.48Å; N67-G72 PolarHBondContact N-O 3.44Å; Y70-G72 PolarHBondContact O-N 3.49Å; Y70-G72 VanDerWaalsContact O-N 3.11Å; G72-Y137 PolarHBondContact O-OH 3.45Å; G72-E206 CarbonylContact C-O 3.57Å; G72-E206 WeakPolarHBondContact CA-O 3.47Å
73	R	86	Confident	70.5	Confident	102 Å²	102	66 Å²	66	39%	0.385	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	154.8	177.3	61.4	-171.8	-176.8	172.7	10.1	111.8	H75 Y137 C205 E206	R73-H75 PolarHBondContact O-N 3.22Å; R73-Y137 HydrophobicContact CB-CD2 4.42Å; R73-Y137 HydrophobicContact CB-CE2 3.36Å; R73-Y137 HydrophobicContact CG-CE2 4Å; R73-C205 CarbonylContact O-C 3.55Å; R73-C205 VanDerWaalsContact O-CA 3.26Å; R73-C205 WeakPolarHBondContact O-CA 3.05Å; R73-E206 HydrophobicContact CG-CG 3.47Å; R73-E206 VanDerWaalsContact CG-CG 3.47Å; R73-E206 IonicContact CZ-OE1 3.81Å; R73-E206 PolarHBondContact N-O 3.08Å; R73-E206 IonicContact NE-OE1 3.75Å; R73-E206 PolarHBondContact NE-OE1 3.37Å; R73-E206 IonicContact NH2-OE1 3.98Å; R73-E206 PolarHBondContact NH2-OE1 2.97Å; R73-E206 PolarHBondContact O-N 3.46Å
74	M	88.2	Confident	68	Low	4 Å²	4	73.5 Å²	73.5	2%	0.02	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	127.2	168.4	-167.2	157.2	65.4	0	0	108.5	Y59 A76 Y109 V203 L204	Y59-M74 HydrophobicContact CD1-CE 4.01Å; Y59-M74 HydrophobicContact CD2-CE 3.36Å; Y59-M74 HydrophobicContact CE1-CE 3.67Å; Y59-M74 HydrophobicContact CE2-CE 3.02Å; Y59-M74 HydrophobicContact CG-CE 3.85Å; M74-A76 PolarHBondContact O-N 3.16Å; M74-Y109 HydrophobicContact SD-CD2 4.2Å; M74-Y109 HydrophobicContact SD-CG 4.39Å; M74-V203 HydrophobicContact CG-CG2 3.8Å; M74-V203 HydrophobicContact SD-CG2 3.65Å; M74-L204 WeakPolarHBondContact CA-O 3.24Å
75	H	86.5	Confident	66	Low	10 Å²	10	75.6 Å²	75.6	5%	0.046	37%	0.372	C	S	.	.			trans	-64.3	113.4	-177.1	179.7	54.9	0	0	0	109.3	F46 R73 F77 S110 G111 L204 E206	F46-H75 HydrophobicContact CE1-CB 4.21Å; F46-H75 AromaticContact CE1-CE1 3.8Å; F46-H75 AromaticContact CE1-CG 3.69Å; F46-H75 AromaticContact CE1-ND1 3.52Å; R73-H75 PolarHBondContact O-N 3.22Å; H75-F77 AromaticContact CD2-CD2 3.7Å; H75-F77 AromaticContact CD2-CE1 3.86Å; H75-F77 AromaticContact CD2-CE2 3.47Å; H75-F77 VanDerWaalsContact CD2-CE2 3.47Å; H75-F77 WeakPolarHBondContact CD2-CE2 3.3Å; H75-F77 AromaticContact CD2-CG 3.99Å; H75-F77 AromaticContact CD2-CZ 3.58Å; H75-F77 PolarHBondContact O-N 2.85Å; H75-S110 CarbonylContact O-C 3.52Å; H75-G111 WeakPolarHBondContact O-CA 3.45Å; H75-G111 PolarHBondContact O-N 3.39Å; H75-L204 HydrophobicContact CB-CB 4.43Å; H75-L204 HydrophobicContact CB-CD2 3.84Å; H75-L204 HydrophobicContact CB-CG 3.8Å; H75-L204 PolarHBondContact N-O 3.07Å; H75-E206 HydrophobicContact CB-CB 4.43Å; H75-E206 HydrophobicContact CB-CG 4.38Å; H75-E206 IonicContact CE1-OE2 3.97Å; H75-E206 PolarHBondContact CE1-OE2 2.48Å; H75-E206 IonicContact CG-OE2 2.66Å; H75-E206 VanDerWaalsContact ND1-CD 3.34Å; H75-E206 IonicContact ND1-OE1 3.56Å; H75-E206 IonicContact ND1-OE2 3.45Å; H75-E206 PolarHBondContact ND1-OE2 2.7Å
76	A	82.5	Confident	64.4	Low	15 Å²	15	82.1 Å²	82.1	12%	0.124	40%	0.398	C	S	.	.			trans	-82	109.9	172.8	0	0	0	0	0	108.6	M74 R78 S110 M112 D135	M74-A76 PolarHBondContact O-N 3.16Å; A76-R78 HydrophobicContact CB-CG 4.27Å; A76-R78 PolarHBondContact O-N 2.88Å; A76-S110 CarbonylContact C-O 3.5Å; A76-S110 VanDerWaalsContact CA-O 3.32Å; A76-S110 WeakPolarHBondContact CA-O 3.43Å; A76-M112 HydrophobicContact CB-CG 4.09Å; A76-M112 HydrophobicContact CB-SD 3.88Å; A76-D135 HydrophobicContact CB-CB 4.22Å
77	F	76.2	Confident	62.8	Low	17 Å²	17	84.4 Å²	84.4	8%	0.075	41%	0.411	C	S	.	.			trans	-69.8	70.9	175.8	-73.5	-99	0	0	0	110.1	H75 T79 F91 F108 S110 F158 M181 L204	H75-F77 AromaticContact CD2-CD2 3.7Å; H75-F77 AromaticContact CD2-CE1 3.86Å; H75-F77 AromaticContact CD2-CE2 3.47Å; H75-F77 VanDerWaalsContact CD2-CE2 3.47Å; H75-F77 WeakPolarHBondContact CD2-CE2 3.3Å; H75-F77 AromaticContact CD2-CG 3.99Å; H75-F77 AromaticContact CD2-CZ 3.58Å; H75-F77 PolarHBondContact O-N 2.85Å; F77-T79 PolarHBondContact O-N 3.46Å; F77-F91 HydrophobicContact CD1-CB 3.75Å; F77-F91 HydrophobicContact CD1-CD2 4.12Å; F77-F91 HydrophobicContact CD1-CG 4.01Å; F77-F91 HydrophobicContact CE1-CB 3.48Å; F77-F91 VanDerWaalsContact CE1-CB 3.48Å; F77-F91 AromaticContact CE1-CD1 3.88Å; F77-F91 HydrophobicContact CE1-CD1 3.88Å; F77-F91 AromaticContact CE1-CD2 3.85Å; F77-F91 HydrophobicContact CE1-CD2 3.85Å; F77-F91 AromaticContact CE1-CG 3.46Å; F77-F91 HydrophobicContact CE1-CG 3.46Å; F77-F91 VanDerWaalsContact CE1-CG 3.46Å; F77-F108 HydrophobicContact CE2-CD2 4.35Å; F77-F108 AromaticContact CE2-CE2 3.49Å; F77-F108 HydrophobicContact CE2-CE2 3.49Å; F77-F108 VanDerWaalsContact CE2-CE2 3.49Å; F77-F108 HydrophobicContact CE2-CZ 4.35Å; F77-F108 AromaticContact CZ-CE2 3.53Å; F77-F108 HydrophobicContact CZ-CE2 3.53Å; F77-F108 AromaticContact CZ-CZ 3.99Å; F77-F108 HydrophobicContact CZ-CZ 3.99Å; F77-S110 WeakPolarHBondContact CD2-O 3.43Å; F77-S110 PolarHBondContact N-O 3.19Å; F77-F158 WeakPolarHBondContact O-CE2 3.37Å; F77-F158 WeakPolarHBondContact O-CZ 3.44Å; F77-M181 HydrophobicContact CD1-CE 4.12Å; F77-M181 HydrophobicContact CD2-CG 4.26Å; F77-M181 HydrophobicContact CE1-CE 4.39Å; F77-M181 HydrophobicContact CE2-CG 4.37Å; F77-M181 HydrophobicContact CG-CE 4.34Å; F77-L204 HydrophobicContact CE2-CD2 3.98Å; F77-L204 HydrophobicContact CZ-CD2 3.65Å
78	R	64	Low	61.4	Low	101 Å²	101	86.9 Å²	86.9	38%	0.381	42%	0.418	S	S	.	.			trans	-82.3	111.4	174.6	-67.3	-177.1	173.9	167.2	-0.4	108.4	A76 Q80 M112 D135	A76-R78 HydrophobicContact CB-CG 4.27Å; A76-R78 PolarHBondContact O-N 2.88Å; R78-Q80 PolarHBondContact O-N 2.84Å; R78-M112 HydrophobicContact CG-CE 4.43Å; R78-M112 HydrophobicContact CG-SD 4.14Å; R78-D135 IonicContact CZ-OD2 3.82Å; R78-D135 IonicContact NH1-OD2 3.21Å; R78-D135 IonicContact NH2-OD1 3.8Å; R78-D135 IonicContact NH2-OD2 3.39Å; R78-D135 PolarHBondContact NH2-OD2 3.25Å
79	T	52.4	Low	60.7	Low	46 Å²	46	84.3 Å²	84.3	28%	0.282	40%	0.397	S	S	.	.			trans	-63.4	107.2	161.4	46.6	0	0	0	0	108.8	F77 E81 K88 H89	F77-T79 PolarHBondContact O-N 3.46Å; T79-E81 PolarHBondContact O-N 2.98Å; T79-K88 WeakPolarHBondContact CG2-O 3.47Å; T79-H89 HydrophobicContact CG2-CB 3.96Å; T79-H89 WeakPolarHBondContact CG2-ND1 3.46Å; T79-H89 PolarHBondContact OG1-CE1 3.16Å; T79-H89 VanDerWaalsContact OG1-CE1 3.25Å; T79-H89 PolarHBondContact OG1-ND1 2.86Å
80	Q	41.4	Very low	60.5	Low	165 Å²	165	85.7 Å²	85.7	77%	0.771	40%	0.403	S	S	*	.			trans	-66	113.8	166.2	-78.9	-179.6	-17.6	0	0	107.8	R78 T82	R78-Q80 PolarHBondContact O-N 2.84Å; Q80-T82 VanDerWaalsContact C-N 3.34Å; Q80-T82 PolarHBondContact O-N 3.29Å
81	E	36	Very low	60.5	Low	170 Å²	170	87.4 Å²	87.4	79%	0.794	41%	0.41	S	S	*	.			trans	-52.8	103.3	157.5	-88.3	-172	146.3	0	0	107.6	T79	T79-E81 PolarHBondContact O-N 2.98Å
82	T	32.8	Very low	60.6	Low	95 Å²	95	89.5 Å²	89.5	58%	0.583	42%	0.422	S	S	*	.			trans	-87.7	113.9	162.1	-36.1	0	0	0	0	105.4	Q80 Q84	Q80-T82 VanDerWaalsContact C-N 3.34Å; Q80-T82 PolarHBondContact O-N 3.29Å; T82-Q84 PolarHBondContact O-N 3.47Å
83	R	31.6	Very low	60.7	Low	240 Å²	240	90.2 Å²	90.2	91%	0.906	42%	0.424	S	S	*	.	S	Bend	trans	-42.4	119.9	168	-77.8	179.6	171.1	-179.2	-2.8	108.1
84	Q	34	Very low	60.5	Low	176 Å²	176	86.1 Å²	86.1	82%	0.822	41%	0.411	S	S	*	.	S	Bend	trans	78.5	95.2	174.6	-53.2	177.1	-3.8	0	0	115.7	T82	T82-Q84 PolarHBondContact O-N 3.47Å
85	T	42.9	Very low	60.3	Low	138 Å²	138	90.6 Å²	90.6	85%	0.847	44%	0.443	S	S	*	.	S	Bend	trans	106.1	-10.2	140.8	68.2	0	0	0	0	123.1
86	K	49.1	Very low	60	Low	163 Å²	163	95.4 Å²	95.4	71%	0.709	47%	0.465	S	S	*	.			trans	-149.8	94.7	171.2	-67.7	-172.9	-177.8	172.9	0	113.8	K88	K86-K88 PolarHBondContact O-N 3.47Å
87	N	50.8	Low	60.1	Low	48 Å²	48	94.8 Å²	94.8	26%	0.257	46%	0.46	S	S	.	.			trans	-82.4	95.8	166.6	-72.6	-15.6	0	0	0	109.4
88	K	56.6	Low	60.5	Low	135 Å²	135	98.1 Å²	98.1	59%	0.587	47%	0.473	S	S	*	.			trans	-98.4	116.1	170.2	-69.8	-169	174.4	-165.6	0	109.3	T79 K86 E90	T79-K88 WeakPolarHBondContact CG2-O 3.47Å; K86-K88 PolarHBondContact O-N 3.47Å; K88-E90 PolarHBondContact O-N 3.48Å
89	H	61.1	Low	61.4	Low	25 Å²	25	101.1 Å²	101.1	12%	0.116	49%	0.489	C	S	.	.			trans	-93	20.5	174.5	-59.7	-92.5	0	0	0	112.3	T79 Q155 F158	T79-H89 HydrophobicContact CG2-CB 3.96Å; T79-H89 WeakPolarHBondContact CG2-ND1 3.46Å; T79-H89 PolarHBondContact OG1-CE1 3.16Å; T79-H89 VanDerWaalsContact OG1-CE1 3.25Å; T79-H89 PolarHBondContact OG1-ND1 2.86Å; H89-Q155 VanDerWaalsContact CD2-CA 3.4Å; H89-Q155 WeakPolarHBondContact CD2-CA 3.49Å; H89-Q155 PolarHBondContact CD2-O 3.35Å; H89-Q155 VanDerWaalsContact NE2-C 3.33Å; H89-Q155 PolarHBondContact NE2-O 3.06Å; H89-F158 WeakPolarHBondContact ND1-CA 3.35Å
90	E	67.8	Low	62.7	Low	82 Å²	82	100.5 Å²	100.5	38%	0.383	48%	0.483	S	S	.	.			trans	-111.9	129.9	-178.1	-50.6	-179.3	159.1	0	0	106.2	K88 T187 F188 K189	K88-E90 PolarHBondContact O-N 3.48Å; E90-T187 HydrophobicContact CB-CG2 3.98Å; E90-F188 WeakPolarHBondContact CA-O 3.42Å; E90-K189 HydrophobicContact CB-CG 4.47Å; E90-K189 HydrophobicContact CG-CD 4.16Å; E90-K189 HydrophobicContact CG-CG 4.09Å; E90-K189 WeakPolarHBondContact OE1-CE 3.38Å; E90-K189 IonicContact OE1-NZ 3.75Å; E90-K189 PolarHBondContact OE1-NZ 3.15Å
91	F	72.3	Confident	64.8	Low	38 Å²	38	92.8 Å²	92.8	17%	0.167	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.5	173.8	-176.4	-90.4	0	0	0	108.7	W37 F77 I93 P94 T187 F188	W37-F91 HydrophobicContact CH2-CE1 4.42Å; W37-F91 AromaticContact CZ2-CE1 3.96Å; W37-F91 HydrophobicContact CZ2-CE1 3.96Å; W37-F91 AromaticContact CZ2-CZ 3.81Å; W37-F91 HydrophobicContact CZ2-CZ 3.81Å; F77-F91 HydrophobicContact CD1-CB 3.75Å; F77-F91 HydrophobicContact CD1-CD2 4.12Å; F77-F91 HydrophobicContact CD1-CG 4.01Å; F77-F91 HydrophobicContact CE1-CB 3.48Å; F77-F91 VanDerWaalsContact CE1-CB 3.48Å; F77-F91 AromaticContact CE1-CD1 3.88Å; F77-F91 HydrophobicContact CE1-CD1 3.88Å; F77-F91 AromaticContact CE1-CD2 3.85Å; F77-F91 HydrophobicContact CE1-CD2 3.85Å; F77-F91 AromaticContact CE1-CG 3.46Å; F77-F91 HydrophobicContact CE1-CG 3.46Å; F77-F91 VanDerWaalsContact CE1-CG 3.46Å; F91-I93 PolarHBondContact O-N 3.31Å; F91-P94 HydrophobicContact CE1-CG 4.26Å; F91-T187 CarbonylContact O-C 3.43Å; F91-T187 WeakPolarHBondContact O-CA 3.3Å; F91-F188 HydrophobicContact CB-CB 4.4Å; F91-F188 AromaticContact CD1-CD2 3.83Å; F91-F188 HydrophobicContact CD1-CD2 3.83Å; F91-F188 HydrophobicContact CD1-CE2 4.45Å; F91-F188 PolarHBondContact N-O 3.13Å; F91-F188 PolarHBondContact O-N 3.46Å
92	N	78.4	Confident	67.1	Low	108 Å²	108	90.2 Å²	90.2	58%	0.578	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	132.3	178.2	-67	-22.9	0	0	0	110.3	P94	N92-P94 VanDerWaalsContact O-CD 3.23Å; N92-P94 WeakPolarHBondContact O-CD 3.45Å
93	I	83.3	Confident	69.6	Low	16 Å²	16	90.8 Å²	90.8	8%	0.082	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-68.5	119.6	174	-63.9	164.2	0	0	0	107.6	F91 I97 Y98 V101 P183 N186 T187 F188	F91-I93 PolarHBondContact O-N 3.31Å; I93-I97 HydrophobicContact CG2-CD1 4.2Å; I93-I97 HydrophobicContact CG2-CG1 3.84Å; I93-Y98 HydrophobicContact CB-CD2 4.38Å; I93-Y98 HydrophobicContact CG2-CD2 4.04Å; I93-V101 HydrophobicContact CD1-CB 4.38Å; I93-V101 HydrophobicContact CD1-CG1 3.51Å; I93-V101 HydrophobicContact CG1-CG1 4.18Å; I93-V101 HydrophobicContact CG2-CB 4.08Å; I93-V101 HydrophobicContact CG2-CG1 4.3Å; I93-V101 HydrophobicContact CG2-CG2 3.93Å; I93-P183 HydrophobicContact CD1-CB 4.47Å; I93-N186 PolarHBondContact N-O 2.92Å; I93-T187 WeakPolarHBondContact CD1-O 3.42Å; I93-F188 HydrophobicContact CD1-CE1 4.36Å; I93-F188 HydrophobicContact CG1-CD1 4.21Å; I93-F188 HydrophobicContact CG1-CD2 4.06Å; I93-F188 HydrophobicContact CG1-CE1 4.08Å; I93-F188 HydrophobicContact CG1-CE2 3.88Å; I93-F188 HydrophobicContact CG1-CG 4.21Å; I93-F188 HydrophobicContact CG1-CZ 3.91Å; I93-F188 HydrophobicContact CG2-CZ 4.5Å
94	P	82	Confident	72	Confident	17 Å²	17	84 Å²	84	11%	0.11	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-58.6	140.7	173.9	-20.6	30.8	0	0	0	111	W37 F91 N92 E96 I97 Y98	W37-P94 HydrophobicContact CB-CB 4.44Å; W37-P94 HydrophobicContact CD2-CB 4Å; W37-P94 HydrophobicContact CD2-CG 3.55Å; W37-P94 HydrophobicContact CE3-CG 4.09Å; W37-P94 HydrophobicContact CG-CB 3.89Å; W37-P94 HydrophobicContact CG-CG 3.93Å; W37-P94 HydrophobicContact CH2-CG 4.16Å; W37-P94 HydrophobicContact CZ2-CG 3.68Å; W37-P94 HydrophobicContact CZ3-CG 4.39Å; F91-P94 HydrophobicContact CE1-CG 4.26Å; N92-P94 VanDerWaalsContact O-CD 3.23Å; N92-P94 WeakPolarHBondContact O-CD 3.45Å; P94-E96 WeakPolarHBondContact CB-OE2 3.45Å; P94-E96 PolarHBondContact O-N 3.4Å; P94-E96 VanDerWaalsContact O-N 3.11Å; P94-I97 HydrophobicContact CB-CG1 4.23Å; P94-I97 HydrophobicContact CG-CD1 4.25Å; P94-I97 HydrophobicContact CG-CG1 4.31Å; P94-I97 VanDerWaalsContact O-CG1 3.32Å; P94-I97 WeakPolarHBondContact O-CG1 3.21Å; P94-I97 PolarHBondContact O-N 3.11Å; P94-I97 VanDerWaalsContact O-N 3.1Å; P94-Y98 PolarHBondContact O-N 3.18Å; P94-Y98 VanDerWaalsContact O-N 3.11Å
95	S	83.9	Confident	74.4	Confident	97 Å²	97	84.5 Å²	84.5	68%	0.678	42%	0.415	S	S	*	.	H	α-helix	trans	-56.2	-30.8	-179.3	58	0	0	0	0	113.3	I97 Y98	S95-I97 VanDerWaalsContact C-N 3.26Å; S95-I97 PolarHBondContact O-N 2.87Å; S95-Y98 PolarHBondContact O-N 2.87Å
96	E	81.8	Confident	76.4	Confident	111 Å²	111	78 Å²	78	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-30.4	-178	-64.7	86.6	158.4	0	0	112.4	W37 P94	W37-E96 HydrophobicContact CB-CB 4.07Å; W37-E96 HydrophobicContact CB-CG 4.05Å; P94-E96 WeakPolarHBondContact CB-OE2 3.45Å; P94-E96 PolarHBondContact O-N 3.4Å; P94-E96 VanDerWaalsContact O-N 3.11Å
97	I	82.9	Confident	78.2	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-111.2	-3.9	-179.8	67.1	168.4	0	0	0	112.5	W37 W48 I93 P94 S95 K99 I100 V101 F188	W37-I97 HydrophobicContact CE3-CG2 4.27Å; W37-I97 HydrophobicContact CZ3-CD1 4.26Å; W48-I97 HydrophobicContact CZ2-CD1 3.99Å; I93-I97 HydrophobicContact CG2-CD1 4.2Å; I93-I97 HydrophobicContact CG2-CG1 3.84Å; P94-I97 HydrophobicContact CB-CG1 4.23Å; P94-I97 HydrophobicContact CG-CD1 4.25Å; P94-I97 HydrophobicContact CG-CG1 4.31Å; P94-I97 VanDerWaalsContact O-CG1 3.32Å; P94-I97 WeakPolarHBondContact O-CG1 3.21Å; P94-I97 PolarHBondContact O-N 3.11Å; P94-I97 VanDerWaalsContact O-N 3.1Å; S95-I97 VanDerWaalsContact C-N 3.26Å; S95-I97 PolarHBondContact O-N 2.87Å; I97-K99 VanDerWaalsContact C-N 3.26Å; I97-K99 PolarHBondContact O-N 3.3Å; I97-K99 VanDerWaalsContact O-N 3.17Å; I97-I100 HydrophobicContact CB-CD1 4.46Å; I97-I100 WeakPolarHBondContact O-CB 2.94Å; I97-I100 PolarHBondContact O-N 2.95Å; I97-V101 HydrophobicContact CB-CG2 4.3Å; I97-V101 HydrophobicContact CD1-CG2 3.78Å; I97-V101 HydrophobicContact CG1-CG2 3.93Å; I97-V101 WeakPolarHBondContact O-CG2 3.28Å; I97-V101 PolarHBondContact O-N 2.97Å; I97-F188 HydrophobicContact CD1-CE2 4.07Å; I97-F188 HydrophobicContact CD1-CZ 4.06Å
98	Y	84.4	Confident	80	Confident	87 Å²	87	72.6 Å²	72.6	34%	0.341	35%	0.349	S	S	.	.	H	α-helix	trans	-52.9	-44.4	-171.6	-175.3	-96.4	0	0	0	112.4	I93 P94 S95 I100 V101 E102 N186	I93-Y98 HydrophobicContact CB-CD2 4.38Å; I93-Y98 HydrophobicContact CG2-CD2 4.04Å; P94-Y98 PolarHBondContact O-N 3.18Å; P94-Y98 VanDerWaalsContact O-N 3.11Å; S95-Y98 PolarHBondContact O-N 2.87Å; Y98-I100 VanDerWaalsContact C-N 3.34Å; Y98-I100 PolarHBondContact O-N 3.41Å; Y98-V101 PolarHBondContact O-N 3.09Å; Y98-E102 HydrophobicContact CE1-CB 4.45Å; Y98-E102 VanDerWaalsContact CE1-OE2 3.31Å; Y98-E102 WeakPolarHBondContact CE1-OE2 3.01Å; Y98-E102 WeakPolarHBondContact O-CB 3.12Å; Y98-E102 PolarHBondContact O-N 3.21Å; Y98-N186 HydrophobicContact CE2-CB 4.4Å
99	K	83.8	Confident	81.5	Confident	165 Å²	165	66.2 Å²	66.2	72%	0.717	32%	0.321	S	S	*	.	H	α-helix	trans	-61.1	-40.3	177.9	-67.9	-175.7	178.3	-178.7	0	113.1	I97 T103	I97-K99 VanDerWaalsContact C-N 3.26Å; I97-K99 PolarHBondContact O-N 3.3Å; I97-K99 VanDerWaalsContact O-N 3.17Å; K99-T103 VanDerWaalsContact O-CB 3.26Å; K99-T103 WeakPolarHBondContact O-CB 3.39Å; K99-T103 PolarHBondContact O-N 3.24Å; K99-T103 PolarHBondContact O-OG1 3.25Å
100	I	80.7	Confident	82.8	Confident	32 Å²	32	65 Å²	65	16%	0.164	32%	0.316	C	S	.	.	H	α-helix	trans	-67.4	-46.6	178.3	-65.2	122.1	0	0	0	109.5	Q35 I97 Y98 E102 T103 D104	Q35-I100 HydrophobicContact CG-CD1 4.13Å; Q35-I100 VanDerWaalsContact OE1-CG1 3.26Å; I97-I100 HydrophobicContact CB-CD1 4.46Å; I97-I100 WeakPolarHBondContact O-CB 2.94Å; I97-I100 PolarHBondContact O-N 2.95Å; Y98-I100 VanDerWaalsContact C-N 3.34Å; Y98-I100 PolarHBondContact O-N 3.41Å; I100-E102 VanDerWaalsContact C-N 3.33Å; I100-E102 PolarHBondContact O-N 3.31Å; I100-T103 PolarHBondContact O-N 3.07Å; I100-D104 WeakPolarHBondContact O-CB 3.38Å; I100-D104 PolarHBondContact O-N 3.05Å
101	V	84.2	Confident	83.8	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.024	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-39	-179.4	179.6	0	0	0	0	111.7	I93 I97 Y98 R105 P183 F188	I93-V101 HydrophobicContact CD1-CB 4.38Å; I93-V101 HydrophobicContact CD1-CG1 3.51Å; I93-V101 HydrophobicContact CG1-CG1 4.18Å; I93-V101 HydrophobicContact CG2-CB 4.08Å; I93-V101 HydrophobicContact CG2-CG1 4.3Å; I93-V101 HydrophobicContact CG2-CG2 3.93Å; I97-V101 HydrophobicContact CB-CG2 4.3Å; I97-V101 HydrophobicContact CD1-CG2 3.78Å; I97-V101 HydrophobicContact CG1-CG2 3.93Å; I97-V101 WeakPolarHBondContact O-CG2 3.28Å; I97-V101 PolarHBondContact O-N 2.97Å; Y98-V101 PolarHBondContact O-N 3.09Å; V101-R105 VanDerWaalsContact O-CA 3.27Å; V101-R105 WeakPolarHBondContact O-CA 3.33Å; V101-R105 PolarHBondContact O-N 3.26Å; V101-R105 VanDerWaalsContact O-N 3.11Å; V101-P183 HydrophobicContact CG1-CB 3.62Å; V101-P183 HydrophobicContact CG1-CG 4.39Å; V101-F188 HydrophobicContact CB-CE1 4.46Å; V101-F188 HydrophobicContact CB-CZ 4.4Å; V101-F188 HydrophobicContact CG1-CE1 3.53Å; V101-F188 HydrophobicContact CG1-CZ 3.89Å; V101-F188 HydrophobicContact CG2-CE1 4.02Å; V101-F188 HydrophobicContact CG2-CZ 3.55Å
102	E	85	Confident	84.5	Confident	115 Å²	115	59.4 Å²	59.4	54%	0.537	29%	0.29	S	S	.	.	H	α-helix	trans	-65.8	-40.6	176	-174.8	177.7	-164.5	0	0	111.8	Y98 I100	Y98-E102 HydrophobicContact CE1-CB 4.45Å; Y98-E102 VanDerWaalsContact CE1-OE2 3.31Å; Y98-E102 WeakPolarHBondContact CE1-OE2 3.01Å; Y98-E102 WeakPolarHBondContact O-CB 3.12Å; Y98-E102 PolarHBondContact O-N 3.21Å; I100-E102 VanDerWaalsContact C-N 3.33Å; I100-E102 PolarHBondContact O-N 3.31Å
103	T	84.3	Confident	85.1	Confident	108 Å²	108	55.8 Å²	55.8	66%	0.663	27%	0.268	S	S	*	.	H	α-helix	trans	-77.6	-54.1	-177	-55.2	0	0	0	0	112.1	K99 I100	K99-T103 VanDerWaalsContact O-CB 3.26Å; K99-T103 WeakPolarHBondContact O-CB 3.39Å; K99-T103 PolarHBondContact O-N 3.24Å; K99-T103 PolarHBondContact O-OG1 3.25Å; I100-T103 PolarHBondContact O-N 3.07Å
104	D	82.8	Confident	85.5	Confident	96 Å²	96	55 Å²	55	51%	0.513	26%	0.264	S	S	.	.	H	α-helix	trans	-89.8	-20.2	-168.9	-62.5	-18.1	0	0	0	112.7	I100	I100-D104 WeakPolarHBondContact O-CB 3.38Å; I100-D104 PolarHBondContact O-N 3.05Å
105	R	84.8	Confident	86	Confident	188 Å²	188	56 Å²	56	71%	0.709	27%	0.27	S	S	*	.			trans	44.6	57.2	-174.5	-63.3	-171.2	169.8	-165.9	-3.8	114.2	V101 P183	V101-R105 VanDerWaalsContact O-CA 3.27Å; V101-R105 WeakPolarHBondContact O-CA 3.33Å; V101-R105 PolarHBondContact O-N 3.26Å; V101-R105 VanDerWaalsContact O-N 3.11Å; R105-P183 HydrophobicContact CB-CG 3.9Å; R105-P183 HydrophobicContact CG-CG 4.27Å
106	P	84.5	Confident	86.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	25%	0.247	C	C	.	.			trans	-68.3	143.2	-167.3	29	-36.1	0	0	0	113.1	W48 P183 Q202	W48-P106 HydrophobicContact CH2-CG 4.04Å; W48-P106 HydrophobicContact CZ3-CB 4.18Å; W48-P106 HydrophobicContact CZ3-CG 3.87Å; P106-P183 WeakPolarHBondContact O-CD 3.26Å; P106-Q202 HydrophobicContact CB-CB 4.26Å; P106-Q202 VanDerWaalsContact CB-CD 3.45Å; P106-Q202 HydrophobicContact CB-CG 3.88Å
107	K	86.9	Confident	86.7	Confident	97 Å²	97	48.8 Å²	48.8	42%	0.422	23%	0.232	S	C	.	.			trans	-98.1	138.6	162.4	-70	-174.5	179	-174	0	110.5	M181 D201	K107-M181 WeakPolarHBondContact CA-O 3.3Å; K107-D201 PolarHBondContact N-OD2 3.34Å; K107-D201 PolarHBondContact O-N 3.44Å; K107-D201 VanDerWaalsContact O-N 3.15Å
108	F	87.8	Confident	87	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	158.7	-176.8	61.5	-78	0	0	0	111.8	W48 F77 L180 M181 F188 Q202 L204	W48-F108 AromaticContact CH2-CD1 3.5Å; W48-F108 HydrophobicContact CH2-CD1 3.5Å; W48-F108 VanDerWaalsContact CH2-CD1 3.5Å; W48-F108 HydrophobicContact CH2-CD2 4.31Å; W48-F108 AromaticContact CH2-CE1 3.48Å; W48-F108 HydrophobicContact CH2-CE1 3.48Å; W48-F108 VanDerWaalsContact CH2-CE1 3.48Å; W48-F108 HydrophobicContact CH2-CE2 4.25Å; W48-F108 AromaticContact CH2-CG 3.94Å; W48-F108 HydrophobicContact CH2-CG 3.94Å; W48-F108 AromaticContact CH2-CZ 3.86Å; W48-F108 HydrophobicContact CH2-CZ 3.86Å; W48-F108 HydrophobicContact CZ2-CE1 4.19Å; W48-F108 HydrophobicContact CZ2-CZ 4.15Å; W48-F108 HydrophobicContact CZ3-CD1 4.02Å; W48-F108 HydrophobicContact CZ3-CE1 4.43Å; W48-F108 HydrophobicContact CZ3-CG 4.25Å; F77-F108 HydrophobicContact CE2-CD2 4.35Å; F77-F108 AromaticContact CE2-CE2 3.49Å; F77-F108 HydrophobicContact CE2-CE2 3.49Å; F77-F108 VanDerWaalsContact CE2-CE2 3.49Å; F77-F108 HydrophobicContact CE2-CZ 4.35Å; F77-F108 AromaticContact CZ-CE2 3.53Å; F77-F108 HydrophobicContact CZ-CE2 3.53Å; F77-F108 AromaticContact CZ-CZ 3.99Å; F77-F108 HydrophobicContact CZ-CZ 3.99Å; F108-L180 CarbonylContact O-C 3.6Å; F108-L180 WeakPolarHBondContact O-CA 3.3Å; F108-M181 HydrophobicContact CD1-CB 4.18Å; F108-M181 HydrophobicContact CD2-CB 4.09Å; F108-M181 HydrophobicContact CE1-CB 3.7Å; F108-M181 HydrophobicContact CE2-CB 3.63Å; F108-M181 HydrophobicContact CE2-CG 4.07Å; F108-M181 HydrophobicContact CG-CB 4.36Å; F108-M181 HydrophobicContact CZ-CB 3.42Å; F108-M181 VanDerWaalsContact CZ-CB 3.42Å; F108-M181 HydrophobicContact CZ-CG 4.23Å; F108-M181 PolarHBondContact N-O 2.97Å; F108-M181 VanDerWaalsContact N-O 3.13Å; F108-M181 PolarHBondContact O-N 3.48Å; F108-F188 AromaticContact CE1-CD1 3.53Å; F108-F188 HydrophobicContact CE1-CD1 3.53Å; F108-F188 HydrophobicContact CE1-CD2 4.47Å; F108-F188 AromaticContact CE1-CE1 3.62Å; F108-F188 HydrophobicContact CE1-CE1 3.62Å; F108-F188 AromaticContact CE1-CG 3.98Å; F108-F188 HydrophobicContact CE1-CG 3.98Å; F108-F188 HydrophobicContact CE1-CZ 4.16Å; F108-F188 HydrophobicContact CZ-CB 4.08Å; F108-F188 AromaticContact CZ-CD1 3.7Å; F108-F188 HydrophobicContact CZ-CD1 3.7Å; F108-F188 AromaticContact CZ-CD2 3.87Å; F108-F188 HydrophobicContact CZ-CD2 3.87Å; F108-F188 AromaticContact CZ-CE1 3.99Å; F108-F188 HydrophobicContact CZ-CE1 3.99Å; F108-F188 HydrophobicContact CZ-CE2 4.18Å; F108-F188 AromaticContact CZ-CG 3.63Å; F108-F188 HydrophobicContact CZ-CG 3.63Å; F108-F188 HydrophobicContact CZ-CZ 4.22Å; F108-Q202 WeakPolarHBondContact CA-O 3.46Å; F108-Q202 WeakPolarHBondContact CB-O 3.48Å; F108-L204 HydrophobicContact CD2-CB 4.33Å; F108-L204 HydrophobicContact CE2-CB 4.47Å
109	Y	89.6	Confident	87	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	141.1	176.7	-66.1	-66.3	0	0	0	111.8	Y59 M74 G111 C178 L180 C196 S198 V200	Y59-Y109 AromaticContact CD2-CD1 3.9Å; Y59-Y109 HydrophobicContact CD2-CD1 3.9Å; Y59-Y109 HydrophobicContact CD2-CD2 4.39Å; Y59-Y109 HydrophobicContact CD2-CE1 4.34Å; Y59-Y109 AromaticContact CD2-CG 3.92Å; Y59-Y109 HydrophobicContact CD2-CG 3.92Å; Y59-Y109 PolarHBondContact N-OH 3.1Å; Y59-Y109 VanDerWaalsContact N-OH 3.09Å; M74-Y109 HydrophobicContact SD-CD2 4.2Å; M74-Y109 HydrophobicContact SD-CG 4.39Å; Y109-G111 PolarHBondContact O-N 3Å; Y109-G111 VanDerWaalsContact O-N 3.15Å; Y109-C178 HydrophobicContact CD1-CB 3.86Å; Y109-C178 HydrophobicContact CE1-CB 3.71Å; Y109-L180 HydrophobicContact CD1-CD2 3.45Å; Y109-L180 VanDerWaalsContact CD1-CD2 3.45Å; Y109-L180 HydrophobicContact CE1-CD2 3.65Å; Y109-L180 HydrophobicContact CG-CD2 4.31Å; Y109-C196 PolarHBondContact OH-O 2.93Å; Y109-S198 PolarHBondContact OH-O 3.43Å; Y109-V200 HydrophobicContact CD1-CG1 4.13Å; Y109-V200 HydrophobicContact CD2-CB 4.33Å; Y109-V200 HydrophobicContact CD2-CG1 3.81Å; Y109-V200 HydrophobicContact CD2-CG2 3.59Å; Y109-V200 HydrophobicContact CE1-CG1 3.99Å; Y109-V200 HydrophobicContact CE2-CB 4.2Å; Y109-V200 HydrophobicContact CE2-CG1 3.66Å; Y109-V200 HydrophobicContact CE2-CG2 3.44Å; Y109-V200 VanDerWaalsContact CE2-CG2 3.44Å; Y109-V200 HydrophobicContact CG-CG1 4.06Å
110	S	87.4	Confident	87	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	2.2	174.7	79.7	0	0	0	0	114.2	H75 A76 F77 M112 L179	H75-S110 CarbonylContact O-C 3.52Å; A76-S110 CarbonylContact C-O 3.5Å; A76-S110 VanDerWaalsContact CA-O 3.32Å; A76-S110 WeakPolarHBondContact CA-O 3.43Å; F77-S110 WeakPolarHBondContact CD2-O 3.43Å; F77-S110 PolarHBondContact N-O 3.19Å; S110-M112 PolarHBondContact O-N 3.18Å; S110-M112 PolarHBondContact OG-N 3.23Å; S110-M112 PolarHBondContact OG-O 2.84Å; S110-L179 PolarHBondContact N-O 3.07Å; S110-L179 VanDerWaalsContact OG-CB 3.27Å; S110-L179 WeakPolarHBondContact OG-CB 3.32Å; S110-L179 PolarHBondContact OG-O 3.45Å
111	G	88.3	Confident	87.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	68.6	7.3	-171.2	0	0	0	0	0	114.9	Y59 H75 Y109 D135	Y59-G111 PolarHBondContact OH-O 3.45Å; H75-G111 WeakPolarHBondContact O-CA 3.45Å; H75-G111 PolarHBondContact O-N 3.39Å; Y109-G111 PolarHBondContact O-N 3Å; Y109-G111 VanDerWaalsContact O-N 3.15Å; G111-D135 WeakPolarHBondContact O-CA 3.29Å
112	M	88.6	Confident	87.2	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.2	176.5	-63.4	-69.8	-74.2	0	0	110.6	A76 R78 S110 L133 D135 F158 L179	A76-M112 HydrophobicContact CB-CG 4.09Å; A76-M112 HydrophobicContact CB-SD 3.88Å; R78-M112 HydrophobicContact CG-CE 4.43Å; R78-M112 HydrophobicContact CG-SD 4.14Å; S110-M112 PolarHBondContact O-N 3.18Å; S110-M112 PolarHBondContact OG-N 3.23Å; S110-M112 PolarHBondContact OG-O 2.84Å; M112-L133 HydrophobicContact CE-CB 3.46Å; M112-L133 VanDerWaalsContact CE-CB 3.46Å; M112-L133 HydrophobicContact CE-CD1 4.23Å; M112-L133 HydrophobicContact CE-CG 4.47Å; M112-D135 HydrophobicContact SD-CB 3.72Å; M112-F158 HydrophobicContact CB-CZ 4.42Å; M112-F158 HydrophobicContact CG-CZ 4.15Å; M112-L179 HydrophobicContact CB-CD1 4.32Å; M112-L179 PolarHBondContact O-N 3.37Å
113	R	90.5	Very high	87	Confident	32 Å²	32	56.4 Å²	56.4	12%	0.121	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.6	173.2	57.2	174.4	-179.1	169.8	-2.8	111.4	V115 L133 R134 A177	R113-V115 HydrophobicContact CG-CG2 4.43Å; R113-L133 CarbonylContact O-C 3.53Å; R113-L133 VanDerWaalsContact O-CA 3.27Å; R113-L133 WeakPolarHBondContact O-CA 3.4Å; R113-R134 HydrophobicContact CG-CB 4.16Å; R113-R134 VanDerWaalsContact CG-O 3.28Å; R113-R134 WeakPolarHBondContact CG-O 3.34Å; R113-R134 PolarHBondContact N-O 3.19Å; R113-R134 VanDerWaalsContact NH2-CD 3.32Å; R113-R134 PolarHBondContact O-N 2.86Å; R113-A177 CarbonylContact C-O 3.55Å; R113-A177 VanDerWaalsContact CA-O 3.29Å; R113-A177 WeakPolarHBondContact CA-O 3.35Å; R113-A177 WeakPolarHBondContact CB-O 3.21Å
114	V	91.1	Very high	86.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	118.1	168.9	-173.6	0	0	0	0	108	L131 L133 L168 L175 P176 A177 L179	V114-L131 HydrophobicContact CG1-CD2 4.1Å; V114-L133 HydrophobicContact CB-CD2 4.41Å; V114-L133 HydrophobicContact CG2-CD2 3.74Å; V114-L168 HydrophobicContact CG1-CD2 4.41Å; V114-L175 HydrophobicContact CB-CD2 4.25Å; V114-L175 HydrophobicContact CG1-CD2 3.94Å; V114-P176 CarbonylContact O-C 3.54Å; V114-P176 WeakPolarHBondContact O-CA 2.98Å; V114-A177 PolarHBondContact N-O 3.45Å; V114-A177 PolarHBondContact O-N 2.96Å; V114-L179 HydrophobicContact CG2-CD2 3.99Å; V114-L179 HydrophobicContact CG2-CG 4.37Å
115	V	93	Very high	86.5	Confident	36 Å²	36	57.5 Å²	57.5	22%	0.218	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-30.8	-177	-145.9	0	0	0	0	112.2	R113 L132 R134 P176	R113-V115 HydrophobicContact CG-CG2 4.43Å; V115-L132 HydrophobicContact CB-CD2 4.48Å; V115-L132 PolarHBondContact N-O 3.09Å; V115-R134 HydrophobicContact CG2-CB 3.28Å; V115-R134 HydrophobicContact CG2-CG 4.37Å; V115-P176 HydrophobicContact CG1-CB 4.45Å
116	A	91.3	Very high	86.2	Confident	24 Å²	24	52.8 Å²	52.8	20%	0.198	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	149.4	178.6	0	0	0	0	0	110.6	L118 L132	A116-L118 HydrophobicContact CB-CD2 4Å; A116-L118 HydrophobicContact CB-CG 4.33Å; A116-L132 HydrophobicContact CB-CB 3.95Å; A116-L132 HydrophobicContact CB-CD2 4.18Å; A116-L132 PolarHBondContact O-N 3.3Å
117	V	89.2	Confident	86.1	Confident	33 Å²	33	55.4 Å²	55.4	20%	0.2	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.3	163.7	-176.2	0	0	0	0	107.2	I120 M129 L131 L175	V117-I120 HydrophobicContact CG1-CD1 3.79Å; V117-I120 HydrophobicContact CG1-CG1 3.76Å; V117-M129 HydrophobicContact CG1-CB 3.89Å; V117-M129 HydrophobicContact CG1-CG 4.38Å; V117-M129 HydrophobicContact CG1-SD 3.83Å; V117-L131 HydrophobicContact CB-CD2 4.49Å; V117-L131 HydrophobicContact CG1-CD2 4.37Å; V117-L131 HydrophobicContact CG2-CD2 3.85Å; V117-L175 HydrophobicContact CG2-CD1 4.24Å
118	L	88.1	Confident	85.9	Confident	60 Å²	60	51.9 Å²	51.9	31%	0.314	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	160.3	-175.2	-53	176.5	0	0	0	109.7	A116 I120 T130 L132	A116-L118 HydrophobicContact CB-CD2 4Å; A116-L118 HydrophobicContact CB-CG 4.33Å; L118-I120 VanDerWaalsContact C-N 3.34Å; L118-I120 PolarHBondContact O-N 2.98Å; L118-T130 WeakPolarHBondContact CA-O 3.39Å; L118-T130 HydrophobicContact CB-CG2 4.49Å; L118-T130 WeakPolarHBondContact CB-O 3.47Å; L118-T130 PolarHBondContact N-O 2.72Å; L118-T130 PolarHBondContact O-N 2.8Å; L118-L132 HydrophobicContact CD1-CB 4.2Å
119	D	84.6	Confident	85.9	Confident	109 Å²	109	51.9 Å²	51.9	58%	0.583	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.9	45.3	168.7	-58.2	-41.4	0	0	0	115.9	K121	D119-K121 PolarHBondContact O-N 3.05Å
120	I	84.6	Confident	85.8	Confident	82 Å²	82	52.5 Å²	52.5	42%	0.421	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	119.1	176.9	-57.4	177.6	0	0	0	109.2	V117 L118 T128 M129 F169	V117-I120 HydrophobicContact CG1-CD1 3.79Å; V117-I120 HydrophobicContact CG1-CG1 3.76Å; L118-I120 VanDerWaalsContact C-N 3.34Å; L118-I120 PolarHBondContact O-N 2.98Å; I120-T128 CarbonylContact C-O 3.53Å; I120-T128 WeakPolarHBondContact CA-O 3.39Å; I120-M129 HydrophobicContact CG1-CB 4.3Å; I120-F169 HydrophobicContact CG2-CD2 4.19Å; I120-F169 HydrophobicContact CG2-CE1 4.2Å; I120-F169 HydrophobicContact CG2-CE2 3.5Å; I120-F169 HydrophobicContact CG2-CZ 3.51Å
121	K	84.5	Confident	85.8	Confident	135 Å²	135	52.6 Å²	52.6	59%	0.587	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	128	170.3	-54.1	178.5	179.5	176.4	0	109.1	D119 K127 T128	D119-K121 PolarHBondContact O-N 3.05Å; K121-K127 CarbonylContact O-C 3.59Å; K121-K127 WeakPolarHBondContact O-CA 3.26Å; K121-T128 WeakPolarHBondContact CB-OG1 3.35Å; K121-T128 PolarHBondContact N-O 2.72Å; K121-T128 PolarHBondContact O-N 3.26Å
122	N	83.7	Confident	85.9	Confident	106 Å²	106	54 Å²	54	57%	0.567	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	107.8	178.6	-166.3	4.5	0	0	0	108.5	K127 F169	N122-K127 WeakPolarHBondContact OD1-CE 3.36Å; N122-K127 WeakPolarHBondContact OD1-CG 3.38Å; N122-F169 HydrophobicContact CB-CZ 3.96Å
123	T	81.6	Confident	85.9	Confident	73 Å²	73	54.2 Å²	54.2	45%	0.448	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	166.4	168	70.7	0	0	0	0	109.2	T125 K126	T123-T125 PolarHBondContact O-N 3.06Å; T123-K126 PolarHBondContact N-O 3.38Å; T123-K126 PolarHBondContact O-N 2.81Å; T123-K126 WeakPolarHBondContact OG1-CB 3.39Å; T123-K126 PolarHBondContact OG1-N 3.4Å; T123-K126 VanDerWaalsContact OG1-N 3.12Å; T123-K126 PolarHBondContact OG1-O 2.94Å
124	T	76.7	Confident	85.9	Confident	134 Å²	134	55.4 Å²	55.4	82%	0.822	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-12	177.1	46.4	0	0	0	0	114.9
125	T	78.8	Confident	85.7	Confident	94 Å²	94	55.6 Å²	55.6	58%	0.577	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	-10.7	-176.2	54.8	0	0	0	0	113.7	T123 D149	T123-T125 PolarHBondContact O-N 3.06Å; T125-D149 VanDerWaalsContact CA-OD2 3.32Å; T125-D149 WeakPolarHBondContact CA-OD2 3.33Å
126	K	79.6	Confident	85.3	Confident	89 Å²	89	55.3 Å²	55.3	39%	0.387	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	124.3	-167.6	-166	-172.7	-172.3	-172.8	0	111.3	T123 T128 I146	T123-K126 PolarHBondContact N-O 3.38Å; T123-K126 PolarHBondContact O-N 2.81Å; T123-K126 WeakPolarHBondContact OG1-CB 3.39Å; T123-K126 PolarHBondContact OG1-N 3.4Å; T123-K126 VanDerWaalsContact OG1-N 3.12Å; T123-K126 PolarHBondContact OG1-O 2.94Å; K126-T128 HydrophobicContact CD-CG2 3.84Å; K126-T128 HydrophobicContact CG-CG2 3.88Å; K126-I146 HydrophobicContact CG-CG2 4.15Å
127	K	82.1	Confident	84.7	Confident	55 Å²	55	59.2 Å²	59.2	24%	0.239	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.2	166.2	-67.2	-174.8	179.4	-170.1	0	109.1	K121 N122 S147 F165 F169	K121-K127 CarbonylContact O-C 3.59Å; K121-K127 WeakPolarHBondContact O-CA 3.26Å; N122-K127 WeakPolarHBondContact OD1-CE 3.36Å; N122-K127 WeakPolarHBondContact OD1-CG 3.38Å; K127-S147 PolarHBondContact N-O 3.43Å; K127-S147 PolarHBondContact O-N 3.17Å; K127-F165 HydrophobicContact CB-CE1 4.18Å; K127-F165 HydrophobicContact CB-CZ 4.15Å; K127-F169 HydrophobicContact CB-CD2 4.32Å; K127-F169 HydrophobicContact CB-CE2 3.76Å; K127-F169 HydrophobicContact CB-CZ 4.02Å; K127-F169 HydrophobicContact CD-CD1 4.29Å; K127-F169 HydrophobicContact CD-CE1 3.94Å; K127-F169 HydrophobicContact CD-CE2 4.34Å; K127-F169 HydrophobicContact CD-CZ 3.95Å; K127-F169 HydrophobicContact CG-CE1 4.42Å; K127-F169 HydrophobicContact CG-CE2 4.21Å; K127-F169 HydrophobicContact CG-CZ 3.95Å
128	T	83.2	Confident	84.5	Confident	23 Å²	23	64.8 Å²	64.8	14%	0.141	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	143	173.3	66.4	0	0	0	0	110.7	I120 K121 K126 V145 I146	I120-T128 CarbonylContact C-O 3.53Å; I120-T128 WeakPolarHBondContact CA-O 3.39Å; K121-T128 WeakPolarHBondContact CB-OG1 3.35Å; K121-T128 PolarHBondContact N-O 2.72Å; K121-T128 PolarHBondContact O-N 3.26Å; K126-T128 HydrophobicContact CD-CG2 3.84Å; K126-T128 HydrophobicContact CG-CG2 3.88Å; T128-V145 WeakPolarHBondContact CA-O 3.36Å; T128-I146 HydrophobicContact CG2-CB 4.39Å; T128-I146 HydrophobicContact CG2-CG1 3.94Å; T128-I146 HydrophobicContact CG2-CG2 4.13Å
129	M	87.2	Confident	84.3	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	151.9	166.7	63.7	176.5	179.9	0	0	109.5	V117 I120 L131 V145 F165 L168 F169	V117-M129 HydrophobicContact CG1-CB 3.89Å; V117-M129 HydrophobicContact CG1-CG 4.38Å; V117-M129 HydrophobicContact CG1-SD 3.83Å; I120-M129 HydrophobicContact CG1-CB 4.3Å; M129-L131 HydrophobicContact CE-CD1 4.21Å; M129-L131 HydrophobicContact CE-CD2 3.81Å; M129-L131 HydrophobicContact CE-CG 4.24Å; M129-L131 HydrophobicContact CG-CD2 4.3Å; M129-L131 HydrophobicContact SD-CD2 3.81Å; M129-V145 HydrophobicContact CG-CB 4.43Å; M129-V145 PolarHBondContact N-O 3.34Å; M129-V145 PolarHBondContact O-N 2.9Å; M129-F165 HydrophobicContact CE-CD2 3.26Å; M129-F165 HydrophobicContact CE-CE2 3.56Å; M129-F165 HydrophobicContact CE-CG 4.09Å; M129-F165 HydrophobicContact CG-CE2 3.83Å; M129-F165 HydrophobicContact CG-CZ 4.5Å; M129-F165 HydrophobicContact SD-CD2 4.44Å; M129-F165 HydrophobicContact SD-CE2 4.21Å; M129-L168 HydrophobicContact CE-CB 3.66Å; M129-L168 HydrophobicContact CE-CD1 4.19Å; M129-L168 HydrophobicContact SD-CB 4.18Å; M129-F169 HydrophobicContact CB-CD2 4.34Å; M129-F169 HydrophobicContact CG-CD2 4.49Å; M129-F169 HydrophobicContact SD-CB 4.2Å; M129-F169 HydrophobicContact SD-CD2 4.34Å
130	T	87.4	Confident	84.5	Confident	14 Å²	14	64.1 Å²	64.1	9%	0.086	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.4	172.7	-59.2	0	0	0	0	108.3	L118 Q142 L143	L118-T130 WeakPolarHBondContact CA-O 3.39Å; L118-T130 HydrophobicContact CB-CG2 4.49Å; L118-T130 WeakPolarHBondContact CB-O 3.47Å; L118-T130 PolarHBondContact N-O 2.72Å; L118-T130 PolarHBondContact O-N 2.8Å; T130-Q142 HydrophobicContact CG2-CB 3.98Å; T130-Q142 HydrophobicContact CG2-CG 4.36Å; T130-L143 CarbonylContact C-O 3.54Å; T130-L143 WeakPolarHBondContact CA-O 3.4Å
131	L	87.7	Confident	84.5	Confident	2 Å²	2	63 Å²	63	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	127.8	175.6	-59.2	-179	0	0	0	109.6	V114 V117 M129 L133 Q142 L143 V145 L160 L168	V114-L131 HydrophobicContact CG1-CD2 4.1Å; V117-L131 HydrophobicContact CB-CD2 4.49Å; V117-L131 HydrophobicContact CG1-CD2 4.37Å; V117-L131 HydrophobicContact CG2-CD2 3.85Å; M129-L131 HydrophobicContact CE-CD1 4.21Å; M129-L131 HydrophobicContact CE-CD2 3.81Å; M129-L131 HydrophobicContact CE-CG 4.24Å; M129-L131 HydrophobicContact CG-CD2 4.3Å; M129-L131 HydrophobicContact SD-CD2 3.81Å; L131-L133 HydrophobicContact CB-CD2 4.25Å; L131-L133 HydrophobicContact CB-CG 4.47Å; L131-Q142 CarbonylContact O-C 3.58Å; L131-Q142 WeakPolarHBondContact O-CA 3.31Å; L131-L143 HydrophobicContact CB-CB 4.48Å; L131-L143 PolarHBondContact N-O 2.9Å; L131-L143 PolarHBondContact O-N 2.86Å; L131-V145 HydrophobicContact CD1-CG2 3.92Å; L131-V145 HydrophobicContact CG-CG2 4.16Å; L131-L160 HydrophobicContact CD1-CD1 3.75Å; L131-L168 HydrophobicContact CD1-CD1 4.16Å
132	L	90.3	Very high	84.5	Confident	31 Å²	31	62.9 Å²	62.9	16%	0.162	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	108.1	165.7	-175.5	65.5	0	0	0	108.3	V115 A116 L118 D140 Q142	V115-L132 HydrophobicContact CB-CD2 4.48Å; V115-L132 PolarHBondContact N-O 3.09Å; A116-L132 HydrophobicContact CB-CB 3.95Å; A116-L132 HydrophobicContact CB-CD2 4.18Å; A116-L132 PolarHBondContact O-N 3.3Å; L118-L132 HydrophobicContact CD1-CB 4.2Å; L132-D140 HydrophobicContact CD1-CB 3.92Å; L132-Q142 HydrophobicContact CD1-CG 4.14Å
133	L	89.5	Confident	84.3	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	143.2	177	-55.1	174.2	0	0	0	110.1	M112 R113 V114 L131 D140 T141 L143 F158 L179	M112-L133 HydrophobicContact CE-CB 3.46Å; M112-L133 VanDerWaalsContact CE-CB 3.46Å; M112-L133 HydrophobicContact CE-CD1 4.23Å; M112-L133 HydrophobicContact CE-CG 4.47Å; R113-L133 CarbonylContact O-C 3.53Å; R113-L133 VanDerWaalsContact O-CA 3.27Å; R113-L133 WeakPolarHBondContact O-CA 3.4Å; V114-L133 HydrophobicContact CB-CD2 4.41Å; V114-L133 HydrophobicContact CG2-CD2 3.74Å; L131-L133 HydrophobicContact CB-CD2 4.25Å; L131-L133 HydrophobicContact CB-CG 4.47Å; L133-D140 CarbonylContact O-C 3.59Å; L133-D140 VanDerWaalsContact O-CA 3.31Å; L133-D140 WeakPolarHBondContact O-CA 3.41Å; L133-T141 WeakPolarHBondContact CB-O 3.25Å; L133-T141 PolarHBondContact N-O 3.45Å; L133-T141 PolarHBondContact O-N 3.48Å; L133-L143 HydrophobicContact CD1-CB 4.01Å; L133-L143 HydrophobicContact CD1-CD2 4.22Å; L133-F158 HydrophobicContact CD1-CD2 4.49Å; L133-L179 HydrophobicContact CD2-CD1 4.39Å
134	R	89.8	Confident	84.3	Confident	57 Å²	57	59.9 Å²	59.9	22%	0.215	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	136.9	177.6	178.2	173.9	-71.7	171.3	1.8	110.9	R113 V115 N139 D140	R113-R134 HydrophobicContact CG-CB 4.16Å; R113-R134 VanDerWaalsContact CG-O 3.28Å; R113-R134 WeakPolarHBondContact CG-O 3.34Å; R113-R134 PolarHBondContact N-O 3.19Å; R113-R134 VanDerWaalsContact NH2-CD 3.32Å; R113-R134 PolarHBondContact O-N 2.86Å; V115-R134 HydrophobicContact CG2-CB 3.28Å; V115-R134 HydrophobicContact CG2-CG 4.37Å; R134-N139 WeakPolarHBondContact CA-O 3.44Å; R134-D140 WeakPolarHBondContact CB-OD1 3.36Å; R134-D140 WeakPolarHBondContact CG-OD1 3.38Å; R134-D140 IonicContact CZ-OD1 2.67Å; R134-D140 IonicContact CZ-OD2 3.94Å; R134-D140 IonicContact NE-OD1 3.91Å; R134-D140 PolarHBondContact NE-OD1 3.34Å; R134-D140 IonicContact NE-OD2 2.69Å; R134-D140 IonicContact NH2-OD1 2.74Å; R134-D140 PolarHBondContact NH2-OD1 2.85Å; R134-D140 IonicContact NH2-OD2 3.41Å; R134-D140 PolarHBondContact NH2-OD2 2.95Å
135	D	87.6	Confident	84.3	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.027	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-179.2	172	72.6	5.7	0	0	0	112.5	A76 R78 G111 M112 Y137 Y138 N139	A76-D135 HydrophobicContact CB-CB 4.22Å; R78-D135 IonicContact CZ-OD2 3.82Å; R78-D135 IonicContact NH1-OD2 3.21Å; R78-D135 IonicContact NH2-OD1 3.8Å; R78-D135 IonicContact NH2-OD2 3.39Å; R78-D135 PolarHBondContact NH2-OD2 3.25Å; G111-D135 WeakPolarHBondContact O-CA 3.29Å; M112-D135 HydrophobicContact SD-CB 3.72Å; D135-Y137 PolarHBondContact O-N 2.88Å; D135-Y137 VanDerWaalsContact OD1-C 3.27Å; D135-Y137 VanDerWaalsContact OD1-CA 3.29Å; D135-Y137 WeakPolarHBondContact OD1-CA 3.5Å; D135-Y137 PolarHBondContact OD1-N 2.7Å; D135-Y138 PolarHBondContact O-N 3.25Å; D135-Y138 PolarHBondContact OD1-N 3.4Å; D135-N139 PolarHBondContact N-O 3.16Å; D135-N139 WeakPolarHBondContact OD1-CB 3.38Å; D135-N139 PolarHBondContact OD1-N 3.17Å; D135-N139 WeakPolarHBondContact OD2-CB 3.48Å; D135-N139 PolarHBondContact OD2-ND2 3.08Å
136	A	82.9	Confident	84.2	Confident	30 Å²	30	51.9 Å²	51.9	25%	0.248	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.7	175.3	0	0	0	0	0	114.8	Y59 A63	Y59-A136 HydrophobicContact CE1-CB 4.33Å; Y59-A136 PolarHBondContact OH-N 3.14Å; A63-A136 HydrophobicContact CB-CB 3.93Å
137	Y	80.1	Confident	84	Confident	105 Å²	105	48 Å²	48	41%	0.412	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	11.9	177.1	-74.1	-88.3	0	0	0	113.6	G72 R73 D135 N139	G72-Y137 PolarHBondContact O-OH 3.45Å; R73-Y137 HydrophobicContact CB-CD2 4.42Å; R73-Y137 HydrophobicContact CB-CE2 3.36Å; R73-Y137 HydrophobicContact CG-CE2 4Å; D135-Y137 PolarHBondContact O-N 2.88Å; D135-Y137 VanDerWaalsContact OD1-C 3.27Å; D135-Y137 VanDerWaalsContact OD1-CA 3.29Å; D135-Y137 WeakPolarHBondContact OD1-CA 3.5Å; D135-Y137 PolarHBondContact OD1-N 2.7Å; Y137-N139 PolarHBondContact O-N 3.33Å
138	Y	83.7	Confident	83.3	Confident	150 Å²	150	50.2 Å²	50.2	59%	0.588	25%	0.254	S	S	*	.			trans	63.9	22.9	-177.8	-55.8	-98.6	0	0	0	113.8	D135 D140	D135-Y138 PolarHBondContact O-N 3.25Å; D135-Y138 PolarHBondContact OD1-N 3.4Å; Y138-D140 PolarHBondContact O-N 3.33Å
139	N	85.8	Confident	82.4	Confident	78 Å²	78	53.5 Å²	53.5	42%	0.417	27%	0.271	S	S	.	.			trans	-79.9	120.3	168.5	-60.6	-52.6	0	0	0	109.2	R134 D135 Y137	R134-N139 WeakPolarHBondContact CA-O 3.44Å; D135-N139 PolarHBondContact N-O 3.16Å; D135-N139 WeakPolarHBondContact OD1-CB 3.38Å; D135-N139 PolarHBondContact OD1-N 3.17Å; D135-N139 WeakPolarHBondContact OD2-CB 3.48Å; D135-N139 PolarHBondContact OD2-ND2 3.08Å; Y137-N139 PolarHBondContact O-N 3.33Å
140	D	88.4	Confident	81.2	Confident	77 Å²	77	62.1 Å²	62.1	41%	0.412	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	141.8	-178.9	-71.2	-14	0	0	0	111.4	L132 L133 R134 Y138	L132-D140 HydrophobicContact CD1-CB 3.92Å; L133-D140 CarbonylContact O-C 3.59Å; L133-D140 VanDerWaalsContact O-CA 3.31Å; L133-D140 WeakPolarHBondContact O-CA 3.41Å; R134-D140 WeakPolarHBondContact CB-OD1 3.36Å; R134-D140 WeakPolarHBondContact CG-OD1 3.38Å; R134-D140 IonicContact CZ-OD1 2.67Å; R134-D140 IonicContact CZ-OD2 3.94Å; R134-D140 IonicContact NE-OD1 3.91Å; R134-D140 PolarHBondContact NE-OD1 3.34Å; R134-D140 IonicContact NE-OD2 2.69Å; R134-D140 IonicContact NH2-OD1 2.74Å; R134-D140 PolarHBondContact NH2-OD1 2.85Å; R134-D140 IonicContact NH2-OD2 3.41Å; R134-D140 PolarHBondContact NH2-OD2 2.95Å; Y138-D140 PolarHBondContact O-N 3.33Å
141	T	83.8	Confident	80.1	Confident	59 Å²	59	66.8 Å²	66.8	36%	0.362	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	132.4	176	-58.4	0	0	0	0	108.5	L133	L133-T141 WeakPolarHBondContact CB-O 3.25Å; L133-T141 PolarHBondContact N-O 3.45Å; L133-T141 PolarHBondContact O-N 3.48Å
142	Q	84.5	Confident	79.3	Confident	133 Å²	133	69 Å²	69	62%	0.621	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.2	175.4	-66.9	-176.6	5	0	0	110.2	T130 L131 L132	T130-Q142 HydrophobicContact CG2-CB 3.98Å; T130-Q142 HydrophobicContact CG2-CG 4.36Å; L131-Q142 CarbonylContact O-C 3.58Å; L131-Q142 WeakPolarHBondContact O-CA 3.31Å; L132-Q142 HydrophobicContact CD1-CG 4.14Å
143	L	80.7	Confident	78.2	Confident	35 Å²	35	70.3 Å²	70.3	18%	0.183	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	114.7	175.7	177.7	73.4	0	0	0	110.2	T130 L131 L133 V145 F158	T130-L143 CarbonylContact C-O 3.54Å; T130-L143 WeakPolarHBondContact CA-O 3.4Å; L131-L143 HydrophobicContact CB-CB 4.48Å; L131-L143 PolarHBondContact N-O 2.9Å; L131-L143 PolarHBondContact O-N 2.86Å; L133-L143 HydrophobicContact CD1-CB 4.01Å; L133-L143 HydrophobicContact CD1-CD2 4.22Å; L143-V145 HydrophobicContact CD2-CG2 3.82Å; L143-V145 HydrophobicContact CG-CG2 3.93Å; L143-V145 PolarHBondContact O-N 3.49Å; L143-F158 HydrophobicContact CD2-CB 3.58Å; L143-F158 HydrophobicContact CD2-CG 4.4Å
144	S	79.7	Confident	76.9	Confident	80 Å²	80	72.8 Å²	72.8	56%	0.559	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	115.9	172.8	-62.1	0	0	0	0	110.2
145	V	78.4	Confident	75.6	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	132.4	177.5	-167.6	0	0	0	0	109.8	T128 M129 L131 L143 W152 A157 F165	T128-V145 WeakPolarHBondContact CA-O 3.36Å; M129-V145 HydrophobicContact CG-CB 4.43Å; M129-V145 PolarHBondContact N-O 3.34Å; M129-V145 PolarHBondContact O-N 2.9Å; L131-V145 HydrophobicContact CD1-CG2 3.92Å; L131-V145 HydrophobicContact CG-CG2 4.16Å; L143-V145 HydrophobicContact CD2-CG2 3.82Å; L143-V145 HydrophobicContact CG-CG2 3.93Å; L143-V145 PolarHBondContact O-N 3.49Å; V145-W152 HydrophobicContact CG1-CH2 3.81Å; V145-W152 HydrophobicContact CG1-CZ3 4.32Å; V145-A157 HydrophobicContact CG1-CB 3.42Å; V145-A157 VanDerWaalsContact CG1-CB 3.42Å; V145-F165 HydrophobicContact CB-CD2 4.02Å; V145-F165 HydrophobicContact CB-CE2 3.85Å; V145-F165 HydrophobicContact CG1-CD2 3.35Å; V145-F165 HydrophobicContact CG1-CE2 3.52Å; V145-F165 HydrophobicContact CG1-CG 4.49Å
146	I	76.6	Confident	74.3	Confident	61 Å²	61	79.2 Å²	79.2	31%	0.313	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.5	-175.1	-55.4	176.3	0	0	0	108.7	K126 T128 M148	K126-I146 HydrophobicContact CG-CG2 4.15Å; T128-I146 HydrophobicContact CG2-CB 4.39Å; T128-I146 HydrophobicContact CG2-CG1 3.94Å; T128-I146 HydrophobicContact CG2-CG2 4.13Å; I146-M148 HydrophobicContact CG2-CE 4.2Å; I146-M148 HydrophobicContact CG2-CG 4.17Å
147	S	74.7	Confident	73.5	Confident	6 Å²	6	77.9 Å²	77.9	4%	0.042	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.9	164.6	-176.1	0	0	0	0	108.7	K127	K127-S147 PolarHBondContact N-O 3.43Å; K127-S147 PolarHBondContact O-N 3.17Å
148	M	68.6	Low	73	Confident	102 Å²	102	73.7 Å²	73.7	50%	0.502	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	143.3	164.4	-56.2	-169.7	-162.4	0	0	107.6	I146 Q150 D151	I146-M148 HydrophobicContact CG2-CE 4.2Å; I146-M148 HydrophobicContact CG2-CG 4.17Å; M148-Q150 PolarHBondContact O-N 2.95Å; M148-D151 PolarHBondContact O-N 2.88Å
149	D	63.2	Low	72.5	Confident	92 Å²	92	67.5 Å²	67.5	49%	0.492	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.1	-170.4	-74.8	-39.4	0	0	0	114.5	T125	T125-D149 VanDerWaalsContact CA-OD2 3.32Å; T125-D149 WeakPolarHBondContact CA-OD2 3.33Å
150	Q	61.8	Low	72.2	Confident	183 Å²	183	63.9 Å²	63.9	86%	0.855	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-17.9	-178.5	-64.4	-172.9	-17.4	0	0	114.7	M148	M148-Q150 PolarHBondContact O-N 2.95Å
151	D	64.8	Low	71.8	Confident	112 Å²	112	62.3 Å²	62.3	60%	0.599	33%	0.334	S	S	*	.	B	Isolated β-bridge	trans	-137.7	97.3	-173.9	-68.4	-46.3	0	0	0	111.5	M148	M148-D151 PolarHBondContact O-N 2.88Å
152	W	70.4	Confident	71.7	Confident	49 Å²	49	63.6 Å²	63.6	19%	0.186	34%	0.335	C	S	.	.			trans	-82.3	117.1	163.5	179.5	-103.9	0	0	0	108.8	V145 P154 A157 L160 K162 F165	V145-W152 HydrophobicContact CG1-CH2 3.81Å; V145-W152 HydrophobicContact CG1-CZ3 4.32Å; W152-P154 WeakPolarHBondContact O-CD 3.49Å; W152-A157 HydrophobicContact CH2-CB 3.56Å; W152-A157 HydrophobicContact CZ2-CB 3.48Å; W152-A157 VanDerWaalsContact CZ2-CB 3.48Å; W152-L160 HydrophobicContact CZ2-CB 4.15Å; W152-L160 WeakPolarHBondContact CZ2-O 3.49Å; W152-L160 PolarHBondContact NE1-O 3.26Å; W152-K162 HydrophobicContact CB-CB 4.24Å; W152-K162 HydrophobicContact CB-CD 4.2Å; W152-K162 HydrophobicContact CB-CG 4.35Å; W152-K162 HydrophobicContact CD2-CB 3.84Å; W152-K162 HydrophobicContact CD2-CG 4.21Å; W152-K162 HydrophobicContact CE3-CB 4.39Å; W152-K162 HydrophobicContact CE3-CG 4.31Å; W152-K162 HydrophobicContact CG-CB 3.72Å; W152-K162 HydrophobicContact CG-CG 4.21Å; W152-K162 VanDerWaalsContact NE1-N 3.19Å; W152-F165 HydrophobicContact CE3-CG 4.45Å; W152-F165 HydrophobicContact CH2-CB 3.18Å; W152-F165 HydrophobicContact CH2-CD1 4.15Å; W152-F165 AromaticContact CH2-CD2 3.53Å; W152-F165 HydrophobicContact CH2-CD2 3.53Å; W152-F165 HydrophobicContact CH2-CE2 4.44Å; W152-F165 AromaticContact CH2-CG 3.34Å; W152-F165 HydrophobicContact CH2-CG 3.34Å; W152-F165 HydrophobicContact CZ2-CB 3.83Å; W152-F165 HydrophobicContact CZ2-CG 4.42Å; W152-F165 HydrophobicContact CZ3-CB 3.61Å; W152-F165 AromaticContact CZ3-CD1 3.67Å; W152-F165 HydrophobicContact CZ3-CD1 3.67Å; W152-F165 AromaticContact CZ3-CD2 3.66Å; W152-F165 HydrophobicContact CZ3-CD2 3.66Å; W152-F165 HydrophobicContact CZ3-CE1 4.28Å; W152-F165 HydrophobicContact CZ3-CE2 4.24Å; W152-F165 AromaticContact CZ3-CG 3.34Å; W152-F165 HydrophobicContact CZ3-CG 3.34Å
153	V	67.6	Low	71.8	Confident	57 Å²	57	61.2 Å²	61.2	35%	0.345	33%	0.33	S	S	.	.			trans	-113.5	96.2	176.5	-175.2	0	0	0	0	107.8	Q155 N156	V153-Q155 HydrophobicContact CG1-CB 3.91Å; V153-Q155 HydrophobicContact CG1-CG 4.47Å; V153-Q155 PolarHBondContact O-N 2.79Å; V153-N156 PolarHBondContact O-N 2.94Å
154	P	62.3	Low	72.1	Confident	58 Å²	58	60.8 Å²	60.8	38%	0.377	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-52.9	-26	178.4	-22.4	28.5	0	0	0	112.9	W152 N156 A157 G159	W152-P154 WeakPolarHBondContact O-CD 3.49Å; P154-N156 PolarHBondContact O-N 3.34Å; P154-A157 PolarHBondContact O-N 3.41Å; P154-G159 PolarHBondContact O-N 2.95Å
155	Q	62.2	Low	72.3	Confident	111 Å²	111	57 Å²	57	52%	0.519	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-67.2	-9.8	177.5	-57	175.9	1	0	0	114.7	H89 V153	H89-Q155 VanDerWaalsContact CD2-CA 3.4Å; H89-Q155 WeakPolarHBondContact CD2-CA 3.49Å; H89-Q155 PolarHBondContact CD2-O 3.35Å; H89-Q155 VanDerWaalsContact NE2-C 3.33Å; H89-Q155 PolarHBondContact NE2-O 3.06Å; V153-Q155 HydrophobicContact CG1-CB 3.91Å; V153-Q155 HydrophobicContact CG1-CG 4.47Å; V153-Q155 PolarHBondContact O-N 2.79Å
156	N	61.4	Low	72.6	Confident	86 Å²	86	60.5 Å²	60.5	46%	0.46	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-105.7	7.8	172.4	-65.2	-23.2	0	0	0	111.8	V153 P154	V153-N156 PolarHBondContact O-N 2.94Å; P154-N156 PolarHBondContact O-N 3.34Å
157	A	64.7	Low	73.1	Confident	1 Å²	1	60 Å²	60	1%	0.008	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.5	26.7	-166.5	0	0	0	0	0	112.8	V145 W152 P154 G159 L160	V145-A157 HydrophobicContact CG1-CB 3.42Å; V145-A157 VanDerWaalsContact CG1-CB 3.42Å; W152-A157 HydrophobicContact CH2-CB 3.56Å; W152-A157 HydrophobicContact CZ2-CB 3.48Å; W152-A157 VanDerWaalsContact CZ2-CB 3.48Å; P154-A157 PolarHBondContact O-N 3.41Å; A157-G159 PolarHBondContact O-N 3.39Å; A157-G159 VanDerWaalsContact O-N 3.12Å; A157-L160 HydrophobicContact CB-CB 3.99Å; A157-L160 WeakPolarHBondContact O-CB 3.4Å; A157-L160 VanDerWaalsContact O-CD1 3.3Å; A157-L160 WeakPolarHBondContact O-CD1 3.47Å; A157-L160 WeakPolarHBondContact O-CG 3.34Å; A157-L160 PolarHBondContact O-N 2.85Å
158	F	70.9	Confident	73.7	Confident	17 Å²	17	59.9 Å²	59.9	8%	0.075	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	24.7	-176.4	-154.4	-104.7	0	0	0	114.1	F77 H89 M112 L133 L143 L160 L179	F77-F158 WeakPolarHBondContact O-CE2 3.37Å; F77-F158 WeakPolarHBondContact O-CZ 3.44Å; H89-F158 WeakPolarHBondContact ND1-CA 3.35Å; M112-F158 HydrophobicContact CB-CZ 4.42Å; M112-F158 HydrophobicContact CG-CZ 4.15Å; L133-F158 HydrophobicContact CD1-CD2 4.49Å; L143-F158 HydrophobicContact CD2-CB 3.58Å; L143-F158 HydrophobicContact CD2-CG 4.4Å; F158-L160 VanDerWaalsContact C-N 3.29Å; F158-L160 PolarHBondContact O-N 3.5Å; F158-L179 HydrophobicContact CD1-CD1 3.6Å; F158-L179 HydrophobicContact CE1-CD1 3.47Å; F158-L179 VanDerWaalsContact CE1-CD1 3.47Å; F158-L179 HydrophobicContact CZ-CD1 4.49Å
159	G	72.2	Confident	74.5	Confident	20 Å²	20	55.7 Å²	55.7	21%	0.206	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	6.9	-171.9	0	0	0	0	0	114.9	P154 A157 S161	P154-G159 PolarHBondContact O-N 2.95Å; A157-G159 PolarHBondContact O-N 3.39Å; A157-G159 VanDerWaalsContact O-N 3.12Å; G159-S161 PolarHBondContact O-N 2.84Å
160	L	78.8	Confident	75.5	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	29%	0.292	C	S	.	.			trans	-53.9	139	171.7	-71.5	162	0	0	0	110.4	L131 W152 A157 F158 H164 L168 L190 V193	L131-L160 HydrophobicContact CD1-CD1 3.75Å; W152-L160 HydrophobicContact CZ2-CB 4.15Å; W152-L160 WeakPolarHBondContact CZ2-O 3.49Å; W152-L160 PolarHBondContact NE1-O 3.26Å; A157-L160 HydrophobicContact CB-CB 3.99Å; A157-L160 WeakPolarHBondContact O-CB 3.4Å; A157-L160 VanDerWaalsContact O-CD1 3.3Å; A157-L160 WeakPolarHBondContact O-CD1 3.47Å; A157-L160 WeakPolarHBondContact O-CG 3.34Å; A157-L160 PolarHBondContact O-N 2.85Å; F158-L160 VanDerWaalsContact C-N 3.29Å; F158-L160 PolarHBondContact O-N 3.5Å; L160-H164 HydrophobicContact CD2-CB 3.64Å; L160-L168 HydrophobicContact CD1-CD1 4Å; L160-L168 HydrophobicContact CD2-CD1 4Å; L160-L190 HydrophobicContact CB-CD2 4.32Å; L160-L190 HydrophobicContact CD2-CD2 3.37Å; L160-L190 HydrophobicContact CG-CD2 3.82Å; L160-V193 HydrophobicContact CD2-CG2 3.57Å
161	S	80.7	Confident	76.4	Confident	44 Å²	44	51 Å²	51	31%	0.308	28%	0.28	S	S	.	.			trans	-74.6	159.7	166.3	75.8	0	0	0	0	109.5	G159 T163 H164 F165	G159-S161 PolarHBondContact O-N 2.84Å; S161-T163 PolarHBondContact O-N 3.34Å; S161-T163 PolarHBondContact OG-N 3.01Å; S161-H164 PolarHBondContact O-N 2.93Å; S161-H164 PolarHBondContact OG-CD2 3.33Å; S161-H164 PolarHBondContact OG-N 2.9Å; S161-H164 VanDerWaalsContact OG-N 3.07Å; S161-F165 PolarHBondContact O-N 2.82Å
162	K	82.3	Confident	77.3	Confident	86 Å²	86	50.6 Å²	50.6	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-55	-37.1	173.6	-171.2	176.5	-178.4	173.5	0	111	W152 F165 Q166	W152-K162 HydrophobicContact CB-CB 4.24Å; W152-K162 HydrophobicContact CB-CD 4.2Å; W152-K162 HydrophobicContact CB-CG 4.35Å; W152-K162 HydrophobicContact CD2-CB 3.84Å; W152-K162 HydrophobicContact CD2-CG 4.21Å; W152-K162 HydrophobicContact CE3-CB 4.39Å; W152-K162 HydrophobicContact CE3-CG 4.31Å; W152-K162 HydrophobicContact CG-CB 3.72Å; W152-K162 HydrophobicContact CG-CG 4.21Å; W152-K162 VanDerWaalsContact NE1-N 3.19Å; K162-F165 PolarHBondContact O-N 3.28Å; K162-Q166 WeakPolarHBondContact O-CB 3.41Å; K162-Q166 VanDerWaalsContact O-CG 3.28Å; K162-Q166 WeakPolarHBondContact O-CG 3.45Å; K162-Q166 PolarHBondContact O-N 2.88Å
163	T	85.5	Confident	77.8	Confident	83 Å²	83	50.4 Å²	50.4	51%	0.509	28%	0.277	S	S	.	.	H	α-helix	trans	-65.5	-48.5	177.8	-51.8	0	0	0	0	112.2	S161 F165 Q166 N167	S161-T163 PolarHBondContact O-N 3.34Å; S161-T163 PolarHBondContact OG-N 3.01Å; T163-F165 VanDerWaalsContact C-N 3.3Å; T163-F165 PolarHBondContact O-N 3.46Å; T163-Q166 PolarHBondContact O-N 2.94Å; T163-N167 WeakPolarHBondContact O-CB 3.19Å; T163-N167 PolarHBondContact O-N 3.3Å
164	H	86.5	Confident	78.7	Confident	26 Å²	26	54.8 Å²	54.8	12%	0.12	30%	0.299	C	S	.	.	H	α-helix	trans	-65	-37.1	177.5	-67	-54.2	0	0	0	111.9	L160 S161 N167 L168 Y173 D192 V193	L160-H164 HydrophobicContact CD2-CB 3.64Å; S161-H164 PolarHBondContact O-N 2.93Å; S161-H164 PolarHBondContact OG-CD2 3.33Å; S161-H164 PolarHBondContact OG-N 2.9Å; S161-H164 VanDerWaalsContact OG-N 3.07Å; H164-N167 PolarHBondContact O-N 3.04Å; H164-L168 WeakPolarHBondContact O-CB 3.38Å; H164-L168 WeakPolarHBondContact O-CG 3.46Å; H164-L168 PolarHBondContact O-N 2.87Å; H164-Y173 PolarHBondContact ND1-OH 2.84Å; H164-D192 IonicContact CE1-OD1 3.08Å; H164-D192 PolarHBondContact CE1-OD1 2.95Å; H164-D192 IonicContact ND1-OD1 2.69Å; H164-D192 IonicContact NE2-OD1 3.81Å; H164-V193 HydrophobicContact CB-CG2 4.04Å
165	F	84.3	Confident	80	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.8	-49.4	172.2	171.7	-91.4	0	0	0	112	K127 M129 V145 W152 S161 K162 T163 N167 L168 F169	K127-F165 HydrophobicContact CB-CE1 4.18Å; K127-F165 HydrophobicContact CB-CZ 4.15Å; M129-F165 HydrophobicContact CE-CD2 3.26Å; M129-F165 HydrophobicContact CE-CE2 3.56Å; M129-F165 HydrophobicContact CE-CG 4.09Å; M129-F165 HydrophobicContact CG-CE2 3.83Å; M129-F165 HydrophobicContact CG-CZ 4.5Å; M129-F165 HydrophobicContact SD-CD2 4.44Å; M129-F165 HydrophobicContact SD-CE2 4.21Å; V145-F165 HydrophobicContact CB-CD2 4.02Å; V145-F165 HydrophobicContact CB-CE2 3.85Å; V145-F165 HydrophobicContact CG1-CD2 3.35Å; V145-F165 HydrophobicContact CG1-CE2 3.52Å; V145-F165 HydrophobicContact CG1-CG 4.49Å; W152-F165 HydrophobicContact CE3-CG 4.45Å; W152-F165 HydrophobicContact CH2-CB 3.18Å; W152-F165 HydrophobicContact CH2-CD1 4.15Å; W152-F165 AromaticContact CH2-CD2 3.53Å; W152-F165 HydrophobicContact CH2-CD2 3.53Å; W152-F165 HydrophobicContact CH2-CE2 4.44Å; W152-F165 AromaticContact CH2-CG 3.34Å; W152-F165 HydrophobicContact CH2-CG 3.34Å; W152-F165 HydrophobicContact CZ2-CB 3.83Å; W152-F165 HydrophobicContact CZ2-CG 4.42Å; W152-F165 HydrophobicContact CZ3-CB 3.61Å; W152-F165 AromaticContact CZ3-CD1 3.67Å; W152-F165 HydrophobicContact CZ3-CD1 3.67Å; W152-F165 AromaticContact CZ3-CD2 3.66Å; W152-F165 HydrophobicContact CZ3-CD2 3.66Å; W152-F165 HydrophobicContact CZ3-CE1 4.28Å; W152-F165 HydrophobicContact CZ3-CE2 4.24Å; W152-F165 AromaticContact CZ3-CG 3.34Å; W152-F165 HydrophobicContact CZ3-CG 3.34Å; S161-F165 PolarHBondContact O-N 2.82Å; K162-F165 PolarHBondContact O-N 3.28Å; T163-F165 VanDerWaalsContact C-N 3.3Å; T163-F165 PolarHBondContact O-N 3.46Å; F165-N167 VanDerWaalsContact C-N 3.35Å; F165-N167 PolarHBondContact O-N 3.43Å; F165-L168 PolarHBondContact O-N 2.89Å; F165-F169 HydrophobicContact CE1-CB 4.49Å; F165-F169 HydrophobicContact CE1-CD2 4.36Å; F165-F169 HydrophobicContact CZ-CD2 4.07Å; F165-F169 VanDerWaalsContact O-CB 3.25Å; F165-F169 WeakPolarHBondContact O-CB 3.03Å; F165-F169 PolarHBondContact O-N 3.35Å
166	Q	84.5	Confident	81.4	Confident	74 Å²	74	52.7 Å²	52.7	35%	0.346	29%	0.291	S	S	.	.	H	α-helix	trans	-60.5	-45.1	178.3	-76	172.2	-18.3	0	0	111.2	K162 T163 L168 F169 D170	K162-Q166 WeakPolarHBondContact O-CB 3.41Å; K162-Q166 VanDerWaalsContact O-CG 3.28Å; K162-Q166 WeakPolarHBondContact O-CG 3.45Å; K162-Q166 PolarHBondContact O-N 2.88Å; T163-Q166 PolarHBondContact O-N 2.94Å; Q166-L168 PolarHBondContact O-N 3.5Å; Q166-F169 WeakPolarHBondContact O-CB 3.15Å; Q166-F169 PolarHBondContact O-N 3.21Å; Q166-D170 WeakPolarHBondContact O-CB 3.06Å; Q166-D170 PolarHBondContact O-N 3.03Å
167	N	87.7	Confident	82.9	Confident	51 Å²	51	48.6 Å²	48.6	27%	0.273	27%	0.269	S	S	.	.	H	α-helix	trans	-62.3	-40.7	177.3	-72.5	-13.7	0	0	0	112.9	T163 H164 F165 S171 N172 Y173	T163-N167 WeakPolarHBondContact O-CB 3.19Å; T163-N167 PolarHBondContact O-N 3.3Å; H164-N167 PolarHBondContact O-N 3.04Å; F165-N167 VanDerWaalsContact C-N 3.35Å; F165-N167 PolarHBondContact O-N 3.43Å; N167-S171 PolarHBondContact O-N 2.97Å; N167-N172 HydrophobicContact CB-CB 4.24Å; N167-N172 WeakPolarHBondContact O-CB 3.26Å; N167-N172 PolarHBondContact O-N 3.5Å; N167-Y173 HydrophobicContact CB-CD2 3.95Å; N167-Y173 HydrophobicContact CB-CE2 3.35Å
168	L	86.8	Confident	84.1	Confident	3 Å²	3	48.6 Å²	48.6	2%	0.016	27%	0.269	C	S	.	.	H	α-helix	trans	-65.5	-42.5	173.4	-78.3	167.8	0	0	0	111.6	V114 M129 L131 L160 H164 F165 Q166 S171 Y173 V193	V114-L168 HydrophobicContact CG1-CD2 4.41Å; M129-L168 HydrophobicContact CE-CB 3.66Å; M129-L168 HydrophobicContact CE-CD1 4.19Å; M129-L168 HydrophobicContact SD-CB 4.18Å; L131-L168 HydrophobicContact CD1-CD1 4.16Å; L160-L168 HydrophobicContact CD1-CD1 4Å; L160-L168 HydrophobicContact CD2-CD1 4Å; H164-L168 WeakPolarHBondContact O-CB 3.38Å; H164-L168 WeakPolarHBondContact O-CG 3.46Å; H164-L168 PolarHBondContact O-N 2.87Å; F165-L168 PolarHBondContact O-N 2.89Å; Q166-L168 PolarHBondContact O-N 3.5Å; L168-S171 PolarHBondContact O-N 3.15Å; L168-Y173 HydrophobicContact CB-CD2 4.44Å; L168-Y173 HydrophobicContact CD2-CD2 3.63Å; L168-Y173 HydrophobicContact CD2-CE2 4.37Å; L168-Y173 HydrophobicContact CD2-CG 4.32Å; L168-Y173 HydrophobicContact CG-CD2 3.71Å; L168-Y173 HydrophobicContact CG-CE2 4.02Å; L168-V193 HydrophobicContact CD2-CG1 4.47Å
169	F	85.4	Confident	85	Confident	15 Å²	15	47.9 Å²	47.9	7%	0.066	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-44.1	-179.6	-172.2	-84.4	0	0	0	111.9	I120 N122 K127 M129 F165 Q166 S171	I120-F169 HydrophobicContact CG2-CD2 4.19Å; I120-F169 HydrophobicContact CG2-CE1 4.2Å; I120-F169 HydrophobicContact CG2-CE2 3.5Å; I120-F169 HydrophobicContact CG2-CZ 3.51Å; N122-F169 HydrophobicContact CB-CZ 3.96Å; K127-F169 HydrophobicContact CB-CD2 4.32Å; K127-F169 HydrophobicContact CB-CE2 3.76Å; K127-F169 HydrophobicContact CB-CZ 4.02Å; K127-F169 HydrophobicContact CD-CD1 4.29Å; K127-F169 HydrophobicContact CD-CE1 3.94Å; K127-F169 HydrophobicContact CD-CE2 4.34Å; K127-F169 HydrophobicContact CD-CZ 3.95Å; K127-F169 HydrophobicContact CG-CE1 4.42Å; K127-F169 HydrophobicContact CG-CE2 4.21Å; K127-F169 HydrophobicContact CG-CZ 3.95Å; M129-F169 HydrophobicContact CB-CD2 4.34Å; M129-F169 HydrophobicContact CG-CD2 4.49Å; M129-F169 HydrophobicContact SD-CB 4.2Å; M129-F169 HydrophobicContact SD-CD2 4.34Å; F165-F169 HydrophobicContact CE1-CB 4.49Å; F165-F169 HydrophobicContact CE1-CD2 4.36Å; F165-F169 HydrophobicContact CZ-CD2 4.07Å; F165-F169 VanDerWaalsContact O-CB 3.25Å; F165-F169 WeakPolarHBondContact O-CB 3.03Å; F165-F169 PolarHBondContact O-N 3.35Å; Q166-F169 WeakPolarHBondContact O-CB 3.15Å; Q166-F169 PolarHBondContact O-N 3.21Å; F169-S171 PolarHBondContact O-N 3.49Å
170	D	85.6	Confident	85.9	Confident	88 Å²	88	47.3 Å²	47.3	47%	0.471	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	5.8	178.9	-61.6	-28.9	0	0	0	112.2	Q166 N172	Q166-D170 WeakPolarHBondContact O-CB 3.06Å; Q166-D170 PolarHBondContact O-N 3.03Å; D170-N172 VanDerWaalsContact C-N 3.29Å; D170-N172 PolarHBondContact O-N 2.83Å
171	S	80.7	Confident	86.3	Confident	87 Å²	87	47.5 Å²	47.5	61%	0.608	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	34.2	179.7	-55.9	0	0	0	0	114.3	N167 L168 F169 Y173	N167-S171 PolarHBondContact O-N 2.97Å; L168-S171 PolarHBondContact O-N 3.15Å; F169-S171 PolarHBondContact O-N 3.49Å; S171-Y173 PolarHBondContact O-N 2.85Å
172	N	82.8	Confident	86.7	Confident	104 Å²	104	45.7 Å²	45.7	56%	0.556	25%	0.247	S	C	*	.			trans	-77.6	-3.7	177.8	-66.1	-27.3	0	0	0	113.4	N167 D170	N167-N172 HydrophobicContact CB-CB 4.24Å; N167-N172 WeakPolarHBondContact O-CB 3.26Å; N167-N172 PolarHBondContact O-N 3.5Å; D170-N172 VanDerWaalsContact C-N 3.29Å; D170-N172 PolarHBondContact O-N 2.83Å
173	Y	82	Confident	86.9	Confident	45 Å²	45	43.7 Å²	43.7	18%	0.176	24%	0.243	C	C	.	.	S	Bend	trans	-108.9	135.5	177.6	-71.2	-67.3	0	0	0	111.7	H164 N167 L168 S171 L175 V193	H164-Y173 PolarHBondContact ND1-OH 2.84Å; N167-Y173 HydrophobicContact CB-CD2 3.95Å; N167-Y173 HydrophobicContact CB-CE2 3.35Å; L168-Y173 HydrophobicContact CB-CD2 4.44Å; L168-Y173 HydrophobicContact CD2-CD2 3.63Å; L168-Y173 HydrophobicContact CD2-CE2 4.37Å; L168-Y173 HydrophobicContact CD2-CG 4.32Å; L168-Y173 HydrophobicContact CG-CD2 3.71Å; L168-Y173 HydrophobicContact CG-CE2 4.02Å; S171-Y173 PolarHBondContact O-N 2.85Å; Y173-L175 PolarHBondContact O-N 3.34Å; Y173-V193 HydrophobicContact CD1-CG1 4.44Å; Y173-V193 HydrophobicContact CD2-CG1 4.33Å; Y173-V193 HydrophobicContact CE1-CB 4.25Å; Y173-V193 HydrophobicContact CE1-CG1 4.34Å; Y173-V193 WeakPolarHBondContact CE1-O 3.27Å; Y173-V193 HydrophobicContact CE2-CB 4.12Å; Y173-V193 HydrophobicContact CE2-CG1 4.18Å; Y173-V193 HydrophobicContact CG-CG1 4.44Å; Y173-V193 PolarHBondContact OH-O 3.31Å
174	N	85.3	Confident	86.9	Confident	149 Å²	149	43.3 Å²	43.3	80%	0.797	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-73	124.6	166.9	-69.9	-34.3	0	0	0	109.3	P176	N174-P176 CarbonylContact O-C 3.44Å
175	L	89.8	Confident	86.9	Confident	71 Å²	71	46 Å²	46	37%	0.372	26%	0.264	S	S	.	.	S	Bend	trans	-91.6	143.5	176.2	-60.4	179.4	0	0	0	110.7	V114 V117 Y173 A177	V114-L175 HydrophobicContact CB-CD2 4.25Å; V114-L175 HydrophobicContact CG1-CD2 3.94Å; V117-L175 HydrophobicContact CG2-CD1 4.24Å; Y173-L175 PolarHBondContact O-N 3.34Å; L175-A177 HydrophobicContact CD2-CB 4.01Å
176	P	91.8	Very high	86.8	Confident	54 Å²	54	50.6 Å²	50.6	35%	0.351	29%	0.289	S	S	.	.	S	Bend	cis	-74.4	137.5	1	31	-34.5	0	0	0	112.9	V114 V115 N174 C196	V114-P176 CarbonylContact O-C 3.54Å; V114-P176 WeakPolarHBondContact O-CA 2.98Å; V115-P176 HydrophobicContact CG1-CB 4.45Å; N174-P176 CarbonylContact O-C 3.44Å; P176-C196 PolarHBondContact O-SG 3.07Å
177	A	92	Very high	86.7	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.008	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	139.6	175.3	0	0	0	0	0	110.4	R113 V114 L175 V193 D194 C196	R113-A177 CarbonylContact C-O 3.55Å; R113-A177 VanDerWaalsContact CA-O 3.29Å; R113-A177 WeakPolarHBondContact CA-O 3.35Å; R113-A177 WeakPolarHBondContact CB-O 3.21Å; V114-A177 PolarHBondContact N-O 3.45Å; V114-A177 PolarHBondContact O-N 2.96Å; L175-A177 HydrophobicContact CD2-CB 4.01Å; A177-V193 HydrophobicContact CB-CG1 3.8Å; A177-D194 CarbonylContact C-O 3.54Å; A177-D194 WeakPolarHBondContact CA-O 2.89Å; A177-C196 VanDerWaalsContact C-SG 3.6Å
178	C	91.4	Very high	86.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	140.4	-177.9	-83.2	0	0	0	0	111	Y59 Y109 V193 D194 C196	Y59-C178 HydrophobicContact CD2-CB 4.39Å; Y59-C178 WeakPolarHBondContact CD2-SG 3.19Å; Y59-C178 VanDerWaalsContact CG-SG 3.6Å; Y109-C178 HydrophobicContact CD1-CB 3.86Å; Y109-C178 HydrophobicContact CE1-CB 3.71Å; C178-V193 WeakPolarHBondContact O-CA 2.9Å; C178-D194 PolarHBondContact N-O 3.27Å; C178-D194 PolarHBondContact O-N 3.16Å; C178-C196 HydrophobicContact CB-CB 4.04Å; C178-C196 WeakPolarHBondContact CB-SG 3.11Å; C178-C196 PolarHBondContact N-SG 3.04Å; C178-C196 WeakPolarHBondContact SG-CA 2.98Å; C178-C196 WeakPolarHBondContact SG-CB 3.31Å; C178-C196 CovalentContact SG-SG 2.04Å; C178-C196 PolarHBondContact SG-SG 2.86Å
179	L	89.4	Confident	86.3	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.2	-179.9	-63	-178.4	0	0	0	108.9	S110 M112 V114 L133 F158 L190 V193	S110-L179 PolarHBondContact N-O 3.07Å; S110-L179 VanDerWaalsContact OG-CB 3.27Å; S110-L179 WeakPolarHBondContact OG-CB 3.32Å; S110-L179 PolarHBondContact OG-O 3.45Å; M112-L179 HydrophobicContact CB-CD1 4.32Å; M112-L179 PolarHBondContact O-N 3.37Å; V114-L179 HydrophobicContact CG2-CD2 3.99Å; V114-L179 HydrophobicContact CG2-CG 4.37Å; L133-L179 HydrophobicContact CD2-CD1 4.39Å; F158-L179 HydrophobicContact CD1-CD1 3.6Å; F158-L179 HydrophobicContact CE1-CD1 3.47Å; F158-L179 VanDerWaalsContact CE1-CD1 3.47Å; F158-L179 HydrophobicContact CZ-CD1 4.49Å; L179-L190 HydrophobicContact CB-CD1 3.61Å; L179-L190 HydrophobicContact CD2-CD1 4Å; L179-L190 HydrophobicContact CD2-CD2 4.48Å; L179-L190 HydrophobicContact CG-CD1 4.25Å; L179-V193 HydrophobicContact CD2-CB 4.44Å; L179-V193 HydrophobicContact CD2-CG1 4.22Å; L179-V193 HydrophobicContact CD2-CG2 3.67Å
180	L	89.7	Confident	86.3	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.037	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.7	-179.3	-60.1	-176.6	0	0	0	110.1	F108 Y109 L190 A191 D192 D194 V200	F108-L180 CarbonylContact O-C 3.6Å; F108-L180 WeakPolarHBondContact O-CA 3.3Å; Y109-L180 HydrophobicContact CD1-CD2 3.45Å; Y109-L180 VanDerWaalsContact CD1-CD2 3.45Å; Y109-L180 HydrophobicContact CE1-CD2 3.65Å; Y109-L180 HydrophobicContact CG-CD2 4.31Å; L180-L190 WeakPolarHBondContact O-CD1 3.43Å; L180-A191 PolarHBondContact O-N 2.03Å; L180-D192 HydrophobicContact CB-CB 4.16Å; L180-D192 HydrophobicContact CD1-CB 4.24Å; L180-D192 PolarHBondContact N-O 3.49Å; L180-D192 PolarHBondContact O-N 2.8Å; L180-D194 HydrophobicContact CD1-CB 3.94Å; L180-V200 HydrophobicContact CD2-CG1 3.71Å
181	M	88.2	Confident	86.4	Confident	7 Å²	7	45.7 Å²	45.7	3%	0.034	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	145.7	173.6	-60.4	-63.4	-70.9	0	0	109.8	F77 K107 F108 F188 K189 L190	F77-M181 HydrophobicContact CD1-CE 4.12Å; F77-M181 HydrophobicContact CD2-CG 4.26Å; F77-M181 HydrophobicContact CE1-CE 4.39Å; F77-M181 HydrophobicContact CE2-CG 4.37Å; F77-M181 HydrophobicContact CG-CE 4.34Å; K107-M181 WeakPolarHBondContact CA-O 3.3Å; F108-M181 HydrophobicContact CD1-CB 4.18Å; F108-M181 HydrophobicContact CD2-CB 4.09Å; F108-M181 HydrophobicContact CE1-CB 3.7Å; F108-M181 HydrophobicContact CE2-CB 3.63Å; F108-M181 HydrophobicContact CE2-CG 4.07Å; F108-M181 HydrophobicContact CG-CB 4.36Å; F108-M181 HydrophobicContact CZ-CB 3.42Å; F108-M181 VanDerWaalsContact CZ-CB 3.42Å; F108-M181 HydrophobicContact CZ-CG 4.23Å; F108-M181 PolarHBondContact N-O 2.97Å; F108-M181 VanDerWaalsContact N-O 3.13Å; F108-M181 PolarHBondContact O-N 3.48Å; M181-F188 HydrophobicContact CE-CB 3.89Å; M181-K189 CarbonylContact C-O 3.52Å; M181-K189 VanDerWaalsContact CA-O 3.29Å; M181-K189 WeakPolarHBondContact CA-O 3.25Å; M181-K189 VanDerWaalsContact CE-C 3.47Å; M181-L190 HydrophobicContact SD-CD1 4.47Å
182	G	88	Confident	86.7	Confident	6 Å²	6	43.8 Å²	43.8	6%	0.062	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	165	171.8	0	0	0	0	0	111.3	F188 K189	G182-F188 WeakPolarHBondContact O-CA 3.45Å; G182-K189 PolarHBondContact N-O 3.28Å; G182-K189 PolarHBondContact O-N 2.89Å
183	P	87.7	Confident	87	Confident	43 Å²	43	38.9 Å²	38.9	28%	0.279	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	134.7	178.6	29.8	-35.1	0	0	0	111.8	I93 V101 R105 P106 F188	I93-P183 HydrophobicContact CD1-CB 4.47Å; V101-P183 HydrophobicContact CG1-CB 3.62Å; V101-P183 HydrophobicContact CG1-CG 4.39Å; R105-P183 HydrophobicContact CB-CG 3.9Å; R105-P183 HydrophobicContact CG-CG 4.27Å; P106-P183 WeakPolarHBondContact O-CD 3.26Å; P183-F188 HydrophobicContact CB-CD1 4.44Å; P183-F188 HydrophobicContact CB-CE1 4.44Å
184	D	86.1	Confident	87.4	Confident	76 Å²	76	39.7 Å²	39.7	41%	0.406	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	110.8	168.2	-177.6	30.1	0	0	0	109.7	N186 T187 K189	D184-N186 PolarHBondContact O-N 3.14Å; D184-T187 CarbonylContact C-O 3.5Å; D184-T187 PolarHBondContact N-O 3.28Å; D184-T187 PolarHBondContact O-N 2.98Å; D184-T187 PolarHBondContact O-OG1 3.27Å; D184-K189 HydrophobicContact CB-CB 4.43Å; D184-K189 HydrophobicContact CB-CD 3.83Å; D184-K189 HydrophobicContact CB-CG 4.04Å; D184-K189 VanDerWaalsContact OD2-CD 3.23Å; D184-K189 WeakPolarHBondContact OD2-CD 3.37Å; D184-K189 WeakPolarHBondContact OD2-CE 3.21Å; D184-K189 IonicContact OD2-NZ 3.07Å; D184-K189 PolarHBondContact OD2-NZ 2.94Å
185	A	84.8	Confident	87.6	Confident	82 Å²	82	34.2 Å²	34.2	68%	0.678	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	-103.5	-172.2	0	0	0	0	0	112.9
186	N	82.5	Confident	87.7	Confident	96 Å²	96	31.9 Å²	31.9	51%	0.513	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	17.2	179.2	65.4	-22.7	0	0	0	112.9	I93 Y98 D184	I93-N186 PolarHBondContact N-O 2.92Å; Y98-N186 HydrophobicContact CE2-CB 4.4Å; D184-N186 PolarHBondContact O-N 3.14Å
187	T	83.7	Confident	87.6	Confident	4 Å²	4	35 Å²	35	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160	-178.8	65	0	0	0	0	111.5	E90 F91 I93 D184 K189	E90-T187 HydrophobicContact CB-CG2 3.98Å; F91-T187 CarbonylContact O-C 3.43Å; F91-T187 WeakPolarHBondContact O-CA 3.3Å; I93-T187 WeakPolarHBondContact CD1-O 3.42Å; D184-T187 CarbonylContact C-O 3.5Å; D184-T187 PolarHBondContact N-O 3.28Å; D184-T187 PolarHBondContact O-N 2.98Å; D184-T187 PolarHBondContact O-OG1 3.27Å; T187-K189 WeakPolarHBondContact OG1-CE 3.46Å
188	F	82.4	Confident	87.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	136.4	158.6	-62.2	-61.4	0	0	0	109.4	W48 E90 F91 I93 I97 V101 F108 M181 G182 P183	W48-F188 HydrophobicContact CH2-CE1 4.14Å; W48-F188 HydrophobicContact CH2-CE2 4.38Å; W48-F188 AromaticContact CH2-CZ 3.73Å; W48-F188 HydrophobicContact CH2-CZ 3.73Å; W48-F188 HydrophobicContact CZ2-CE1 4.18Å; W48-F188 AromaticContact CZ2-CE2 3.65Å; W48-F188 HydrophobicContact CZ2-CE2 3.65Å; W48-F188 AromaticContact CZ2-CZ 3.33Å; W48-F188 HydrophobicContact CZ2-CZ 3.33Å; E90-F188 WeakPolarHBondContact CA-O 3.42Å; F91-F188 HydrophobicContact CB-CB 4.4Å; F91-F188 AromaticContact CD1-CD2 3.83Å; F91-F188 HydrophobicContact CD1-CD2 3.83Å; F91-F188 HydrophobicContact CD1-CE2 4.45Å; F91-F188 PolarHBondContact N-O 3.13Å; F91-F188 PolarHBondContact O-N 3.46Å; I93-F188 HydrophobicContact CD1-CE1 4.36Å; I93-F188 HydrophobicContact CG1-CD1 4.21Å; I93-F188 HydrophobicContact CG1-CD2 4.06Å; I93-F188 HydrophobicContact CG1-CE1 4.08Å; I93-F188 HydrophobicContact CG1-CE2 3.88Å; I93-F188 HydrophobicContact CG1-CG 4.21Å; I93-F188 HydrophobicContact CG1-CZ 3.91Å; I93-F188 HydrophobicContact CG2-CZ 4.5Å; I97-F188 HydrophobicContact CD1-CE2 4.07Å; I97-F188 HydrophobicContact CD1-CZ 4.06Å; V101-F188 HydrophobicContact CB-CE1 4.46Å; V101-F188 HydrophobicContact CB-CZ 4.4Å; V101-F188 HydrophobicContact CG1-CE1 3.53Å; V101-F188 HydrophobicContact CG1-CZ 3.89Å; V101-F188 HydrophobicContact CG2-CE1 4.02Å; V101-F188 HydrophobicContact CG2-CZ 3.55Å; F108-F188 AromaticContact CE1-CD1 3.53Å; F108-F188 HydrophobicContact CE1-CD1 3.53Å; F108-F188 HydrophobicContact CE1-CD2 4.47Å; F108-F188 AromaticContact CE1-CE1 3.62Å; F108-F188 HydrophobicContact CE1-CE1 3.62Å; F108-F188 AromaticContact CE1-CG 3.98Å; F108-F188 HydrophobicContact CE1-CG 3.98Å; F108-F188 HydrophobicContact CE1-CZ 4.16Å; F108-F188 HydrophobicContact CZ-CB 4.08Å; F108-F188 AromaticContact CZ-CD1 3.7Å; F108-F188 HydrophobicContact CZ-CD1 3.7Å; F108-F188 AromaticContact CZ-CD2 3.87Å; F108-F188 HydrophobicContact CZ-CD2 3.87Å; F108-F188 AromaticContact CZ-CE1 3.99Å; F108-F188 HydrophobicContact CZ-CE1 3.99Å; F108-F188 HydrophobicContact CZ-CE2 4.18Å; F108-F188 AromaticContact CZ-CG 3.63Å; F108-F188 HydrophobicContact CZ-CG 3.63Å; F108-F188 HydrophobicContact CZ-CZ 4.22Å; M181-F188 HydrophobicContact CE-CB 3.89Å; G182-F188 WeakPolarHBondContact O-CA 3.45Å; P183-F188 HydrophobicContact CB-CD1 4.44Å; P183-F188 HydrophobicContact CB-CE1 4.44Å
189	K	83.9	Confident	86.8	Confident	59 Å²	59	40.6 Å²	40.6	26%	0.257	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	163.7	175.6	-62.4	-171.6	-169	-178.2	0	110.1	E90 M181 G182 D184 T187 A191	E90-K189 HydrophobicContact CB-CG 4.47Å; E90-K189 HydrophobicContact CG-CD 4.16Å; E90-K189 HydrophobicContact CG-CG 4.09Å; E90-K189 WeakPolarHBondContact OE1-CE 3.38Å; E90-K189 IonicContact OE1-NZ 3.75Å; E90-K189 PolarHBondContact OE1-NZ 3.15Å; M181-K189 CarbonylContact C-O 3.52Å; M181-K189 VanDerWaalsContact CA-O 3.29Å; M181-K189 WeakPolarHBondContact CA-O 3.25Å; M181-K189 VanDerWaalsContact CE-C 3.47Å; G182-K189 PolarHBondContact N-O 3.28Å; G182-K189 PolarHBondContact O-N 2.89Å; D184-K189 HydrophobicContact CB-CB 4.43Å; D184-K189 HydrophobicContact CB-CD 3.83Å; D184-K189 HydrophobicContact CB-CG 4.04Å; D184-K189 VanDerWaalsContact OD2-CD 3.23Å; D184-K189 WeakPolarHBondContact OD2-CD 3.37Å; D184-K189 WeakPolarHBondContact OD2-CE 3.21Å; D184-K189 IonicContact OD2-NZ 3.07Å; D184-K189 PolarHBondContact OD2-NZ 2.94Å; T187-K189 WeakPolarHBondContact OG1-CE 3.46Å; K189-A191 PolarHBondContact O-N 3.3Å; K189-A191 VanDerWaalsContact O-N 3.14Å
190	L	85.6	Confident	86.4	Confident	21 Å²	21	40.5 Å²	40.5	11%	0.11	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	118.8	168.9	-169.3	78.5	0	0	0	109	L160 L179 L180 M181 V193	L160-L190 HydrophobicContact CB-CD2 4.32Å; L160-L190 HydrophobicContact CD2-CD2 3.37Å; L160-L190 HydrophobicContact CG-CD2 3.82Å; L179-L190 HydrophobicContact CB-CD1 3.61Å; L179-L190 HydrophobicContact CD2-CD1 4Å; L179-L190 HydrophobicContact CD2-CD2 4.48Å; L179-L190 HydrophobicContact CG-CD1 4.25Å; L180-L190 WeakPolarHBondContact O-CD1 3.43Å; M181-L190 HydrophobicContact SD-CD1 4.47Å; L190-V193 HydrophobicContact CD2-CG2 4.23Å
191	A	86	Confident	85.9	Confident	45 Å²	45	44.2 Å²	44.2	37%	0.372	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-34.9	178.6	0	0	0	0	0	111.7	L180 K189	L180-A191 PolarHBondContact O-N 2.03Å; K189-A191 PolarHBondContact O-N 3.3Å; K189-A191 VanDerWaalsContact O-N 3.14Å
192	D	88.2	Confident	85.6	Confident	47 Å²	47	44.8 Å²	44.8	25%	0.251	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	166.6	-177.7	-148.2	-16.2	0	0	0	112.8	H164 L180	H164-D192 IonicContact CE1-OD1 3.08Å; H164-D192 PolarHBondContact CE1-OD1 2.95Å; H164-D192 IonicContact ND1-OD1 2.69Å; H164-D192 IonicContact NE2-OD1 3.81Å; L180-D192 HydrophobicContact CB-CB 4.16Å; L180-D192 HydrophobicContact CD1-CB 4.24Å; L180-D192 PolarHBondContact N-O 3.49Å; L180-D192 PolarHBondContact O-N 2.8Å
193	V	89.2	Confident	85.5	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	120.5	165.7	-177.1	0	0	0	0	106.9	L160 H164 L168 Y173 A177 C178 L179 L190	L160-V193 HydrophobicContact CD2-CG2 3.57Å; H164-V193 HydrophobicContact CB-CG2 4.04Å; L168-V193 HydrophobicContact CD2-CG1 4.47Å; Y173-V193 HydrophobicContact CD1-CG1 4.44Å; Y173-V193 HydrophobicContact CD2-CG1 4.33Å; Y173-V193 HydrophobicContact CE1-CB 4.25Å; Y173-V193 HydrophobicContact CE1-CG1 4.34Å; Y173-V193 WeakPolarHBondContact CE1-O 3.27Å; Y173-V193 HydrophobicContact CE2-CB 4.12Å; Y173-V193 HydrophobicContact CE2-CG1 4.18Å; Y173-V193 HydrophobicContact CG-CG1 4.44Å; Y173-V193 PolarHBondContact OH-O 3.31Å; A177-V193 HydrophobicContact CB-CG1 3.8Å; C178-V193 WeakPolarHBondContact O-CA 2.9Å; L179-V193 HydrophobicContact CD2-CB 4.44Å; L179-V193 HydrophobicContact CD2-CG1 4.22Å; L179-V193 HydrophobicContact CD2-CG2 3.67Å; L190-V193 HydrophobicContact CD2-CG2 4.23Å
194	D	89.1	Confident	85.5	Confident	62 Å²	62	42.6 Å²	42.6	33%	0.332	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	175.9	-172.6	-158.4	2	0	0	0	111.7	A177 C178 L180 S198	A177-D194 CarbonylContact C-O 3.54Å; A177-D194 WeakPolarHBondContact CA-O 2.89Å; C178-D194 PolarHBondContact N-O 3.27Å; C178-D194 PolarHBondContact O-N 3.16Å; L180-D194 HydrophobicContact CD1-CB 3.94Å; D194-S198 PolarHBondContact OD1-OG 3Å; D194-S198 WeakPolarHBondContact OD2-CB 3.34Å; D194-S198 PolarHBondContact OD2-OG 2.79Å
195	A	90.8	Very high	85.6	Confident	33 Å²	33	39 Å²	39	27%	0.273	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	148.2	174.8	0	0	0	0	0	111.4	D197 S198	A195-D197 WeakPolarHBondContact CB-OD1 3.45Å; A195-D197 PolarHBondContact O-N 3.11Å; A195-S198 VanDerWaalsContact O-CB 3.24Å; A195-S198 WeakPolarHBondContact O-CB 3.2Å; A195-S198 PolarHBondContact O-N 2.96Å; A195-S198 PolarHBondContact O-OG 2.93Å; A195-S198 VanDerWaalsContact O-OG 3.1Å
196	C	91.3	Very high	85.7	Confident	23 Å²	23	35.4 Å²	35.4	16%	0.155	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-1.2	-176.9	-74.7	0	0	0	0	114.7	S58 Y59 Y109 P176 A177 C178	S58-C196 WeakPolarHBondContact CA-O 2.92Å; Y59-C196 WeakPolarHBondContact CB-O 3.41Å; Y59-C196 PolarHBondContact N-O 2.9Å; Y109-C196 PolarHBondContact OH-O 2.93Å; P176-C196 PolarHBondContact O-SG 3.07Å; A177-C196 VanDerWaalsContact C-SG 3.6Å; C178-C196 HydrophobicContact CB-CB 4.04Å; C178-C196 WeakPolarHBondContact CB-SG 3.11Å; C178-C196 PolarHBondContact N-SG 3.04Å; C178-C196 WeakPolarHBondContact SG-CA 2.98Å; C178-C196 WeakPolarHBondContact SG-CB 3.31Å; C178-C196 CovalentContact SG-SG 2.04Å; C178-C196 PolarHBondContact SG-SG 2.86Å
197	D	89.5	Confident	85.9	Confident	118 Å²	118	31.3 Å²	31.3	63%	0.631	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.4	7.5	169	59.4	-22.3	0	0	0	112.5	K57 A195	K57-D197 CarbonylContact O-C 3.45Å; K57-D197 WeakPolarHBondContact O-CA 3.16Å; A195-D197 WeakPolarHBondContact CB-OD1 3.45Å; A195-D197 PolarHBondContact O-N 3.11Å
198	S	84.2	Confident	86	Confident	20 Å²	20	34 Å²	34	14%	0.14	20%	0.198	C	C	.	.			trans	-69.2	138.6	174.3	-67.1	0	0	0	0	111.9	Y109 D194 A195	Y109-S198 PolarHBondContact OH-O 3.43Å; D194-S198 PolarHBondContact OD1-OG 3Å; D194-S198 WeakPolarHBondContact OD2-CB 3.34Å; D194-S198 PolarHBondContact OD2-OG 2.79Å; A195-S198 VanDerWaalsContact O-CB 3.24Å; A195-S198 WeakPolarHBondContact O-CB 3.2Å; A195-S198 PolarHBondContact O-N 2.96Å; A195-S198 PolarHBondContact O-OG 2.93Å; A195-S198 VanDerWaalsContact O-OG 3.1Å
199	H	83.1	Confident	86.1	Confident	99 Å²	99	35.7 Å²	35.7	46%	0.458	21%	0.206	S	C	.	.			trans	-64.7	139.5	178.1	179.9	-85.9	0	0	0	111.8	D201	H199-D201 IonicContact CE1-OD1 2.82Å; H199-D201 IonicContact ND1-OD1 3.81Å
200	V	81.6	Confident	86.2	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.006	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-126.1	145.3	169.1	-64.6	0	0	0	0	110.7	F56 Y109 L180	F56-V200 HydrophobicContact CB-CG2 3.87Å; F56-V200 HydrophobicContact CD2-CG2 4.36Å; F56-V200 HydrophobicContact CG-CG2 4.41Å; Y109-V200 HydrophobicContact CD1-CG1 4.13Å; Y109-V200 HydrophobicContact CD2-CB 4.33Å; Y109-V200 HydrophobicContact CD2-CG1 3.81Å; Y109-V200 HydrophobicContact CD2-CG2 3.59Å; Y109-V200 HydrophobicContact CE1-CG1 3.99Å; Y109-V200 HydrophobicContact CE2-CB 4.2Å; Y109-V200 HydrophobicContact CE2-CG1 3.66Å; Y109-V200 HydrophobicContact CE2-CG2 3.44Å; Y109-V200 VanDerWaalsContact CE2-CG2 3.44Å; Y109-V200 HydrophobicContact CG-CG1 4.06Å; L180-V200 HydrophobicContact CD2-CG1 3.71Å
201	D	77.4	Confident	86.1	Confident	86 Å²	86	37.4 Å²	37.4	46%	0.46	21%	0.212	S	C	.	.	S	Bend	trans	-73.9	-34.4	-176	-55.4	-50.7	0	0	0	111.4	K107 H199	K107-D201 PolarHBondContact N-OD2 3.34Å; K107-D201 PolarHBondContact O-N 3.44Å; K107-D201 VanDerWaalsContact O-N 3.15Å; H199-D201 IonicContact CE1-OD1 2.82Å; H199-D201 IonicContact ND1-OD1 3.81Å
202	Q	81.9	Confident	86.1	Confident	19 Å²	19	35.2 Å²	35.2	9%	0.089	20%	0.195	C	C	.	.			trans	-143.4	155.6	-172.4	-58.5	-173.1	3.9	0	0	110.5	W48 H49 P106 F108	W48-Q202 HydrophobicContact CE3-CB 3.71Å; W48-Q202 HydrophobicContact CE3-CG 4.35Å; W48-Q202 HydrophobicContact CZ3-CB 3.59Å; W48-Q202 HydrophobicContact CZ3-CG 4.32Å; H49-Q202 CarbonylContact O-C 3.6Å; H49-Q202 VanDerWaalsContact O-CA 3.24Å; H49-Q202 WeakPolarHBondContact O-CA 3.36Å; P106-Q202 HydrophobicContact CB-CB 4.26Å; P106-Q202 VanDerWaalsContact CB-CD 3.45Å; P106-Q202 HydrophobicContact CB-CG 3.88Å; F108-Q202 WeakPolarHBondContact CA-O 3.46Å; F108-Q202 WeakPolarHBondContact CB-O 3.48Å
203	V	86.1	Confident	86.1	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	138.3	168.3	65.7	0	0	0	0	109.6	H49 F56 M74	H49-V203 HydrophobicContact CB-CG1 3.67Å; H49-V203 PolarHBondContact N-O 3.43Å; H49-V203 PolarHBondContact O-N 2.96Å; F56-V203 HydrophobicContact CE1-CG1 3.92Å; F56-V203 HydrophobicContact CE2-CB 4.24Å; F56-V203 HydrophobicContact CE2-CG1 3.8Å; F56-V203 HydrophobicContact CZ-CB 4.18Å; F56-V203 HydrophobicContact CZ-CG1 3.35Å; M74-V203 HydrophobicContact CG-CG2 3.8Å; M74-V203 HydrophobicContact SD-CG2 3.65Å
204	L	87.8	Confident	86	Confident	1 Å²	1	38 Å²	38	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	111.7	171.1	178.8	58.3	0	0	0	109.4	W37 F46 W48 M74 H75 F77 F108	W37-L204 HydrophobicContact CH2-CD1 3.46Å; W37-L204 VanDerWaalsContact CH2-CD1 3.46Å; W37-L204 HydrophobicContact CH2-CD2 3.81Å; W37-L204 HydrophobicContact CH2-CG 4.26Å; W37-L204 HydrophobicContact CZ3-CD1 3.51Å; F46-L204 HydrophobicContact CB-CD1 4.12Å; F46-L204 HydrophobicContact CD1-CD1 4.04Å; F46-L204 HydrophobicContact CD1-CD2 4.34Å; F46-L204 HydrophobicContact CD1-CG 4.27Å; W48-L204 HydrophobicContact CD2-CD1 4.45Å; W48-L204 HydrophobicContact CG-CD1 4.33Å; M74-L204 WeakPolarHBondContact CA-O 3.24Å; H75-L204 HydrophobicContact CB-CB 4.43Å; H75-L204 HydrophobicContact CB-CD2 3.84Å; H75-L204 HydrophobicContact CB-CG 3.8Å; H75-L204 PolarHBondContact N-O 3.07Å; F77-L204 HydrophobicContact CE2-CD2 3.98Å; F77-L204 HydrophobicContact CZ-CD2 3.65Å; F108-L204 HydrophobicContact CD2-CB 4.33Å; F108-L204 HydrophobicContact CE2-CB 4.47Å
205	C	87.8	Confident	85.9	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	139	173.5	-54.7	0	0	0	0	110	F46 T47 H49 C66 R73	F46-C205 CarbonylContact C-O 3.45Å; F46-C205 WeakPolarHBondContact CA-O 3.09Å; T47-C205 PolarHBondContact N-O 3.32Å; T47-C205 PolarHBondContact O-N 3.33Å; H49-C205 PolarHBondContact CD2-SG 3.44Å; C66-C205 WeakPolarHBondContact CA-SG 3.26Å; C66-C205 HydrophobicContact CB-CB 3.71Å; C66-C205 WeakPolarHBondContact CB-SG 3.12Å; C66-C205 WeakPolarHBondContact SG-CB 3.41Å; C66-C205 CovalentContact SG-SG 2.03Å; C66-C205 PolarHBondContact SG-SG 2.8Å; R73-C205 CarbonylContact O-C 3.55Å; R73-C205 VanDerWaalsContact O-CA 3.26Å; R73-C205 WeakPolarHBondContact O-CA 3.05Å
206	E	87.5	Confident	85.6	Confident	7 Å²	7	38.9 Å²	38.9	3%	0.033	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	140.1	167.1	68.7	180	-174.7	0	0	109.9	C45 F46 G72 R73 H75	C45-E206 CarbonylContact O-C 3.6Å; C45-E206 WeakPolarHBondContact O-CA 3.5Å; F46-E206 HydrophobicContact CD1-CB 3.78Å; F46-E206 HydrophobicContact CE1-CB 3.6Å; F46-E206 WeakPolarHBondContact CE1-OE2 3.46Å; F46-E206 HydrophobicContact CZ-CB 4.22Å; G72-E206 CarbonylContact C-O 3.57Å; G72-E206 WeakPolarHBondContact CA-O 3.47Å; R73-E206 HydrophobicContact CG-CG 3.47Å; R73-E206 VanDerWaalsContact CG-CG 3.47Å; R73-E206 IonicContact CZ-OE1 3.81Å; R73-E206 PolarHBondContact N-O 3.08Å; R73-E206 IonicContact NE-OE1 3.75Å; R73-E206 PolarHBondContact NE-OE1 3.37Å; R73-E206 IonicContact NH2-OE1 3.98Å; R73-E206 PolarHBondContact NH2-OE1 2.97Å; R73-E206 PolarHBondContact O-N 3.46Å; H75-E206 HydrophobicContact CB-CB 4.43Å; H75-E206 HydrophobicContact CB-CG 4.38Å; H75-E206 IonicContact CE1-OE2 3.97Å; H75-E206 PolarHBondContact CE1-OE2 2.48Å; H75-E206 IonicContact CG-OE2 2.66Å; H75-E206 VanDerWaalsContact ND1-CD 3.34Å; H75-E206 IonicContact ND1-OE1 3.56Å; H75-E206 IonicContact ND1-OE2 3.45Å; H75-E206 PolarHBondContact ND1-OE2 2.7Å
207	T	87.2	Confident	85.3	Confident	9 Å²	9	41.6 Å²	41.6	6%	0.055	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	158.7	175.7	-172.4	0	0	0	0	110.1	P27 C45 Y70	P27-T207 HydrophobicContact CG-CG2 3.5Å; C45-T207 HydrophobicContact CB-CG2 3.86Å; C45-T207 WeakPolarHBondContact CB-O 3.46Å; C45-T207 PolarHBondContact N-O 3.4Å; C45-T207 PolarHBondContact O-N 3Å; Y70-T207 PolarHBondContact O-OG1 2.9Å
208	A	84.9	Confident	85.3	Confident	62 Å²	62	40 Å²	40	51%	0.512	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	160.3	170.3	0	0	0	0	0	110.3	L210	A208-L210 PolarHBondContact O-N 2.92Å
209	E	85.4	Confident	85.5	Confident	34 Å²	34	45 Å²	45	16%	0.159	25%	0.252	C	S	.	.			trans	-57.7	139.5	169.9	-58.6	173.7	152.5	0	0	111.5	Y38 K211	Y38-E209 HydrophobicContact CE2-CG 3.78Å; Y38-E209 WeakPolarHBondContact CE2-OE1 3.47Å; Y38-E209 PolarHBondContact OH-OE1 2.92Å; E209-K211 HydrophobicContact CB-CG 4.08Å; E209-K211 PolarHBondContact O-N 2.82Å; E209-K211 WeakPolarHBondContact OE2-CE 3.28Å; E209-K211 IonicContact OE2-NZ 2.7Å
210	L	86.4	Confident	85.6	Confident	5 Å²	5	42 Å²	42	3%	0.026	24%	0.239	C	C	.	.			trans	-79.7	65.2	175.9	-54.9	173.5	0	0	0	110.3	T25 P27 L30 A208 G212 C213 F237 Q239	T25-L210 HydrophobicContact CG2-CB 4.15Å; T25-L210 HydrophobicContact CG2-CD1 4.43Å; T25-L210 VanDerWaalsContact O-CB 3.26Å; T25-L210 WeakPolarHBondContact O-CB 3.43Å; T25-L210 WeakPolarHBondContact O-CG 3.14Å; T25-L210 PolarHBondContact O-N 3.22Å; P27-L210 HydrophobicContact CG-CD1 4.36Å; L30-L210 HydrophobicContact CD1-CD1 3.57Å; L30-L210 HydrophobicContact CG-CD1 4.46Å; A208-L210 PolarHBondContact O-N 2.92Å; L210-G212 PolarHBondContact O-N 3.31Å; L210-G212 VanDerWaalsContact O-N 3.14Å; L210-C213 HydrophobicContact CB-CB 4.07Å; L210-C213 PolarHBondContact O-N 2.82Å; L210-C213 VanDerWaalsContact O-N 3.08Å; L210-F237 HydrophobicContact CD1-CB 4Å; L210-F237 HydrophobicContact CD2-CB 4.19Å; L210-Q239 HydrophobicContact CD2-CB 3.77Å
211	K	83.9	Confident	85.8	Confident	111 Å²	111	51.2 Å²	51.2	48%	0.483	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.7	-177.3	-64.7	-178.3	-179.9	-177.9	0	113.4	V22 E209 L230	V22-K211 HydrophobicContact CG1-CB 4.45Å; E209-K211 HydrophobicContact CB-CG 4.08Å; E209-K211 PolarHBondContact O-N 2.82Å; E209-K211 WeakPolarHBondContact OE2-CE 3.28Å; E209-K211 IonicContact OE2-NZ 2.7Å; K211-L230 WeakPolarHBondContact O-CD1 3.47Å
212	G	84.7	Confident	86	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.6	179.4	0	0	0	0	0	115.1	L210 C229 L230 Y233 C238	L210-G212 PolarHBondContact O-N 3.31Å; L210-G212 VanDerWaalsContact O-N 3.14Å; G212-C229 CarbonylContact O-C 3.53Å; G212-C229 WeakPolarHBondContact O-CA 2.99Å; G212-L230 PolarHBondContact O-N 3.3Å; G212-Y233 VanDerWaalsContact CA-CG 3.5Å; G212-C238 VanDerWaalsContact C-CB 3.48Å; G212-C238 WeakPolarHBondContact O-CB 3.47Å
213	C	87.6	Confident	86.1	Confident	13 Å²	13	51.2 Å²	51.2	9%	0.088	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.9	-171.9	170	0	0	0	0	112.2	L210 C227 C238	L210-C213 HydrophobicContact CB-CB 4.07Å; L210-C213 PolarHBondContact O-N 2.82Å; L210-C213 VanDerWaalsContact O-N 3.08Å; C213-C227 HydrophobicContact CB-CB 3.73Å; C213-C227 WeakPolarHBondContact CB-SG 3.41Å; C213-C227 WeakPolarHBondContact SG-CB 3.49Å; C213-C227 CovalentContact SG-SG 2.03Å; C213-C227 PolarHBondContact SG-SG 2.96Å; C213-C238 HydrophobicContact CB-CB 4.26Å
214	I	87.7	Confident	86.1	Confident	94 Å²	94	51.4 Å²	51.4	48%	0.482	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	109.8	160.2	-58.1	172.6	0	0	0	107.7	T216 N228 L230	I214-T216 PolarHBondContact O-N 2.84Å; I214-N228 HydrophobicContact CB-CB 4.28Å; I214-N228 WeakPolarHBondContact CB-O 3.49Å; I214-N228 PolarHBondContact N-O 3.02Å; I214-N228 PolarHBondContact O-N 2.81Å; I214-L230 HydrophobicContact CD1-CD2 3.65Å; I214-L230 HydrophobicContact CD1-CG 4.41Å; I214-L230 HydrophobicContact CG1-CD2 4.09Å; I214-L230 HydrophobicContact CG1-CG 4.37Å
215	K	86.4	Confident	86.1	Confident	87 Å²	87	53.2 Å²	53.2	38%	0.378	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	133.2	-179.5	-59.8	-179.9	-172.1	160.7	0	110.8	L30	L30-K215 HydrophobicContact CD2-CD 4.03Å; L30-K215 HydrophobicContact CD2-CG 3.69Å
216	T	84.5	Confident	86.2	Confident	26 Å²	26	57.2 Å²	57.2	16%	0.16	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	162.6	169.3	73.4	0	0	0	0	110	I214 V218 Q226 N228	I214-T216 PolarHBondContact O-N 2.84Å; T216-V218 PolarHBondContact O-N 3Å; T216-V218 PolarHBondContact OG1-N 3.48Å; T216-V218 PolarHBondContact OG1-O 2.97Å; T216-Q226 WeakPolarHBondContact CB-O 3.26Å; T216-Q226 WeakPolarHBondContact CG2-O 3.4Å; T216-Q226 PolarHBondContact N-O 3.45Å; T216-Q226 WeakPolarHBondContact OG1-CB 3.38Å; T216-Q226 PolarHBondContact OG1-O 3.46Å; T216-N228 HydrophobicContact CG2-CB 4.35Å
217	G	85	Confident	86.2	Confident	80 Å²	80	57.7 Å²	57.7	83%	0.825	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	1.8	171.9	0	0	0	0	0	114.2
218	V	89.4	Confident	86.3	Confident	84 Å²	84	62 Å²	62	51%	0.509	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.7	-174	-177.3	0	0	0	0	109.5	T216 L225 Q226	T216-V218 PolarHBondContact O-N 3Å; T216-V218 PolarHBondContact OG1-N 3.48Å; T216-V218 PolarHBondContact OG1-O 2.97Å; V218-L225 WeakPolarHBondContact O-CA 3.42Å; V218-Q226 PolarHBondContact O-N 2.03Å
219	K	88.9	Confident	86.4	Confident	125 Å²	125	61.6 Å²	61.6	54%	0.543	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	143.2	173.3	-68.9	-175.9	177.4	-172.6	0	111.2	W224 L225	K219-W224 CarbonylContact C-O 3.6Å; K219-W224 WeakPolarHBondContact CA-O 3.26Å; K219-L225 HydrophobicContact CG-CD2 3.94Å
220	D	85.9	Confident	86.6	Confident	35 Å²	35	62.9 Å²	62.9	19%	0.187	34%	0.342	C	S	.	.			trans	-82	180	168.1	72.8	22.8	0	0	0	112.4	D222 G223 W224 Q226 R236	D220-D222 PolarHBondContact O-N 2.75Å; D220-D222 WeakPolarHBondContact OD1-CA 3.22Å; D220-D222 PolarHBondContact OD1-N 3.24Å; D220-G223 PolarHBondContact O-N 2.78Å; D220-G223 PolarHBondContact OD1-N 3.5Å; D220-W224 PolarHBondContact N-O 3.47Å; D220-W224 PolarHBondContact OD1-N 3.18Å; D220-Q226 HydrophobicContact CB-CG 4.08Å; D220-R236 VanDerWaalsContact CG-NH2 3.25Å; D220-R236 IonicContact OD1-NH2 3.21Å; D220-R236 PolarHBondContact OD1-NH2 2.76Å; D220-R236 IonicContact OD2-CZ 3.29Å; D220-R236 VanDerWaalsContact OD2-CZ 3.29Å; D220-R236 IonicContact OD2-NE 3.15Å; D220-R236 PolarHBondContact OD2-NE 3.36Å; D220-R236 VanDerWaalsContact OD2-NE 3.15Å; D220-R236 IonicContact OD2-NH2 2.66Å; D220-R236 PolarHBondContact OD2-NH2 3.11Å
221	K	86.1	Confident	86.6	Confident	195 Å²	195	67.6 Å²	67.6	85%	0.848	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.7	-177.8	61	170.7	-171.5	177.1	0	114.5
222	D	80.2	Confident	86.8	Confident	76 Å²	76	65.7 Å²	65.7	41%	0.406	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	11.1	179.5	-44	-42.8	0	0	0	111.1	K31 D220 R236	K31-D222 WeakPolarHBondContact CE-O 3.48Å; D220-D222 PolarHBondContact O-N 2.75Å; D220-D222 WeakPolarHBondContact OD1-CA 3.22Å; D220-D222 PolarHBondContact OD1-N 3.24Å; D222-R236 IonicContact OD2-CZ 3.29Å; D222-R236 VanDerWaalsContact OD2-CZ 3.29Å; D222-R236 IonicContact OD2-NH1 2.99Å; D222-R236 PolarHBondContact OD2-NH1 3.04Å; D222-R236 IonicContact OD2-NH2 2.72Å; D222-R236 PolarHBondContact OD2-NH2 3.36Å
223	G	84.3	Confident	86.9	Confident	30 Å²	30	68.9 Å²	68.9	31%	0.309	38%	0.381	S	S	.	.	S	Bend	trans	85.1	7.1	175.1	0	0	0	0	0	115.5	D220	D220-G223 PolarHBondContact O-N 2.78Å; D220-G223 PolarHBondContact OD1-N 3.5Å
224	W	86.6	Confident	86.9	Confident	5 Å²	5	73 Å²	73	2%	0.019	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-82.5	139.8	179.5	-66.2	76.4	0	0	0	111.7	P27 L30 K31 L34 M69 Y70 K219 D220 Q226 F237	P27-W224 HydrophobicContact CB-CH2 4.44Å; P27-W224 HydrophobicContact CB-CZ3 4.21Å; P27-W224 WeakPolarHBondContact O-CZ3 3.23Å; L30-W224 HydrophobicContact CB-CE3 3.64Å; L30-W224 HydrophobicContact CB-CZ3 3.99Å; L30-W224 CarbonylContact O-C 3.46Å; L30-W224 WeakPolarHBondContact O-CA 3.38Å; K31-W224 HydrophobicContact CB-CD2 3.81Å; K31-W224 HydrophobicContact CB-CE3 3.67Å; K31-W224 HydrophobicContact CB-CG 4.48Å; K31-W224 HydrophobicContact CB-CH2 3.96Å; K31-W224 HydrophobicContact CB-CZ2 4.12Å; K31-W224 HydrophobicContact CB-CZ3 3.75Å; K31-W224 HydrophobicContact CD-CD2 4.05Å; K31-W224 HydrophobicContact CD-CG 4.46Å; K31-W224 HydrophobicContact CD-CH2 4.34Å; K31-W224 HydrophobicContact CD-CZ2 3.69Å; K31-W224 HydrophobicContact CG-CD2 3.8Å; K31-W224 HydrophobicContact CG-CE3 4.21Å; K31-W224 HydrophobicContact CG-CG 4.09Å; K31-W224 HydrophobicContact CG-CZ2 4.24Å; L34-W224 HydrophobicContact CD1-CH2 3.03Å; L34-W224 HydrophobicContact CD1-CZ2 3.59Å; L34-W224 HydrophobicContact CD1-CZ3 3.83Å; L34-W224 HydrophobicContact CG-CH2 4.33Å; M69-W224 HydrophobicContact CE-CZ2 4.41Å; Y70-W224 HydrophobicContact CD1-CH2 4.14Å; Y70-W224 AromaticContact CE1-CH2 3.13Å; Y70-W224 HydrophobicContact CE1-CH2 3.13Å; Y70-W224 AromaticContact CE1-CZ2 3.59Å; Y70-W224 HydrophobicContact CE1-CZ2 3.59Å; Y70-W224 HydrophobicContact CE1-CZ3 4.01Å; Y70-W224 AromaticContact CZ-CH2 3.69Å; Y70-W224 AromaticContact CZ-CZ2 3.9Å; Y70-W224 VanDerWaalsContact OH-CZ2 3.32Å; Y70-W224 WeakPolarHBondContact OH-CZ2 3.32Å; K219-W224 CarbonylContact C-O 3.6Å; K219-W224 WeakPolarHBondContact CA-O 3.26Å; D220-W224 PolarHBondContact N-O 3.47Å; D220-W224 PolarHBondContact OD1-N 3.18Å; W224-Q226 PolarHBondContact O-N 3.39Å; W224-F237 HydrophobicContact CB-CE1 4.07Å; W224-F237 AromaticContact CD2-CE1 3.7Å; W224-F237 HydrophobicContact CD2-CE1 3.7Å; W224-F237 AromaticContact CD2-CZ 3.45Å; W224-F237 HydrophobicContact CD2-CZ 3.45Å; W224-F237 VanDerWaalsContact CD2-CZ 3.45Å; W224-F237 AromaticContact CE2-CZ 3.86Å; W224-F237 HydrophobicContact CE3-CD1 4.36Å; W224-F237 AromaticContact CE3-CE1 3.41Å; W224-F237 HydrophobicContact CE3-CE1 3.41Å; W224-F237 VanDerWaalsContact CE3-CE1 3.41Å; W224-F237 HydrophobicContact CE3-CE2 4.3Å; W224-F237 AromaticContact CE3-CZ 3.37Å; W224-F237 HydrophobicContact CE3-CZ 3.37Å; W224-F237 HydrophobicContact CG-CE1 4.01Å; W224-F237 AromaticContact CG-CZ 3.98Å; W224-F237 HydrophobicContact CG-CZ 3.98Å; W224-F237 HydrophobicContact CH2-CE2 4.46Å; W224-F237 HydrophobicContact CH2-CZ 4.15Å; W224-F237 HydrophobicContact CZ2-CZ 4.2Å; W224-F237 HydrophobicContact CZ3-CE1 4.07Å; W224-F237 HydrophobicContact CZ3-CE2 4.26Å; W224-F237 AromaticContact CZ3-CZ 3.75Å; W224-F237 HydrophobicContact CZ3-CZ 3.75Å
225	L	88.3	Confident	86.7	Confident	39 Å²	39	70.2 Å²	70.2	20%	0.204	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	126	166	-65.3	174.5	0	0	0	109.5	L30 V218 K219	L30-L225 HydrophobicContact CD2-CB 4.35Å; L30-L225 PolarHBondContact O-N 3.4Å; V218-L225 WeakPolarHBondContact O-CA 3.42Å; K219-L225 HydrophobicContact CG-CD2 3.94Å
226	Q	89.2	Confident	86.5	Confident	85 Å²	85	70.6 Å²	70.6	40%	0.397	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	145.3	178.6	-65	179	-9.7	0	0	110.4	T216 V218 D220 W224	T216-Q226 WeakPolarHBondContact CB-O 3.26Å; T216-Q226 WeakPolarHBondContact CG2-O 3.4Å; T216-Q226 PolarHBondContact N-O 3.45Å; T216-Q226 WeakPolarHBondContact OG1-CB 3.38Å; T216-Q226 PolarHBondContact OG1-O 3.46Å; V218-Q226 PolarHBondContact O-N 2.03Å; D220-Q226 HydrophobicContact CB-CG 4.08Å; W224-Q226 PolarHBondContact O-N 3.39Å
227	C	87.1	Confident	86.5	Confident	16 Å²	16	69.5 Å²	69.5	11%	0.108	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.2	174.5	-71.8	0	0	0	0	110.4	L30 C213 C238	L30-C227 VanDerWaalsContact CD1-SG 3.57Å; C213-C227 HydrophobicContact CB-CB 3.73Å; C213-C227 WeakPolarHBondContact CB-SG 3.41Å; C213-C227 WeakPolarHBondContact SG-CB 3.49Å; C213-C227 CovalentContact SG-SG 2.03Å; C213-C227 PolarHBondContact SG-SG 2.96Å; C227-C238 VanDerWaalsContact CB-SG 3.55Å
228	N	89.7	Confident	86.6	Confident	99 Å²	99	65.8 Å²	65.8	53%	0.529	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	119.2	161.3	-74.2	-15.9	0	0	0	108.3	I214 T216	I214-N228 HydrophobicContact CB-CB 4.28Å; I214-N228 WeakPolarHBondContact CB-O 3.49Å; I214-N228 PolarHBondContact N-O 3.02Å; I214-N228 PolarHBondContact O-N 2.81Å; T216-N228 HydrophobicContact CG2-CB 4.35Å
229	C	88.1	Confident	86.2	Confident	54 Å²	54	63.2 Å²	63.2	37%	0.365	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	134.7	-175.8	-57.6	0	0	0	0	112.5	G212 Y233 C238	G212-C229 CarbonylContact O-C 3.53Å; G212-C229 WeakPolarHBondContact O-CA 2.99Å; C229-Y233 VanDerWaalsContact CB-O 3.26Å; C229-Y233 WeakPolarHBondContact CB-O 3.48Å; C229-C238 WeakPolarHBondContact CA-SG 3.42Å; C229-C238 HydrophobicContact CB-CB 3.75Å; C229-C238 WeakPolarHBondContact CB-SG 3.49Å; C229-C238 PolarHBondContact N-SG 2.88Å; C229-C238 VanDerWaalsContact N-SG 3.43Å; C229-C238 WeakPolarHBondContact SG-CA 3.45Å; C229-C238 WeakPolarHBondContact SG-CB 3.38Å; C229-C238 CovalentContact SG-SG 2.03Å; C229-C238 PolarHBondContact SG-SG 2.92Å
230	L	88.8	Confident	85.9	Confident	62 Å²	62	60.8 Å²	60.8	33%	0.325	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-58.5	154.6	163.3	-70.3	179.4	0	0	0	110.1	K211 G212 I214 N232 Y233	K211-L230 WeakPolarHBondContact O-CD1 3.47Å; G212-L230 PolarHBondContact O-N 3.3Å; I214-L230 HydrophobicContact CD1-CD2 3.65Å; I214-L230 HydrophobicContact CD1-CG 4.41Å; I214-L230 HydrophobicContact CG1-CD2 4.09Å; I214-L230 HydrophobicContact CG1-CG 4.37Å; L230-N232 PolarHBondContact O-N 2.87Å; L230-Y233 HydrophobicContact CB-CD2 3.97Å; L230-Y233 WeakPolarHBondContact O-CB 3.38Å; L230-Y233 PolarHBondContact O-N 3.47Å
231	P	87.1	Confident	85.8	Confident	104 Å²	104	64.6 Å²	64.6	68%	0.675	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	139.2	175.1	-26.3	34.4	0	0	0	111.4	Y233	P231-Y233 PolarHBondContact O-N 2.97Å
232	N	86.4	Confident	85.6	Confident	70 Å²	70	60.6 Å²	60.6	37%	0.374	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	-5.2	-177.2	-50.6	-51.2	0	0	0	116.1	L230 Y241 E242 P244	L230-N232 PolarHBondContact O-N 2.87Å; N232-Y241 HydrophobicContact CB-CD2 4.08Å; N232-Y241 HydrophobicContact CB-CE2 3.72Å; N232-Y241 WeakPolarHBondContact O-CA 3.29Å; N232-E242 VanDerWaalsContact CB-O 3.3Å; N232-E242 WeakPolarHBondContact CB-O 3.48Å; N232-E242 PolarHBondContact O-N 3.22Å; N232-P244 WeakPolarHBondContact OD1-CB 3.27Å
233	Y	87.8	Confident	85.5	Confident	67 Å²	67	62.4 Å²	62.4	26%	0.263	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	144	171.6	-69.5	-94.3	0	0	0	111.3	G212 C229 L230 P231 C238 F240 Y241	G212-Y233 VanDerWaalsContact CA-CG 3.5Å; C229-Y233 VanDerWaalsContact CB-O 3.26Å; C229-Y233 WeakPolarHBondContact CB-O 3.48Å; L230-Y233 HydrophobicContact CB-CD2 3.97Å; L230-Y233 WeakPolarHBondContact O-CB 3.38Å; L230-Y233 PolarHBondContact O-N 3.47Å; P231-Y233 PolarHBondContact O-N 2.97Å; Y233-C238 VanDerWaalsContact CD1-O 3.3Å; Y233-C238 WeakPolarHBondContact CD1-O 3.32Å; Y233-F240 CarbonylContact C-O 3.36Å; Y233-F240 WeakPolarHBondContact CA-O 3.42Å; Y233-F240 WeakPolarHBondContact CD1-O 3.31Å; Y233-Y241 HydrophobicContact CD1-CD2 4.19Å; Y233-Y241 AromaticContact CD2-CD2 3.97Å; Y233-Y241 HydrophobicContact CD2-CD2 3.97Å; Y233-Y241 AromaticContact CE1-CD2 3.84Å; Y233-Y241 HydrophobicContact CE1-CD2 3.84Å; Y233-Y241 HydrophobicContact CE1-CG 4.22Å; Y233-Y241 AromaticContact CE2-CD2 3.59Å; Y233-Y241 HydrophobicContact CE2-CD2 3.59Å; Y233-Y241 HydrophobicContact CE2-CE2 4.04Å; Y233-Y241 HydrophobicContact CG-CD2 4.26Å; Y233-Y241 AromaticContact CZ-CD2 3.53Å
234	F	87.2	Confident	84.7	Confident	100 Å²	100	62.6 Å²	62.6	44%	0.439	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	173.7	-179.8	67.4	-80.9	0	0	0	111.8	C238 Q239 F240 E242	F234-C238 CarbonylContact O-C 3.55Å; F234-C238 WeakPolarHBondContact O-CA 3.29Å; F234-Q239 PolarHBondContact O-N 3.4Å; F234-F240 HydrophobicContact CD1-CB 3.76Å; F234-F240 HydrophobicContact CD2-CB 3.83Å; F234-F240 AromaticContact CD2-CD2 3.93Å; F234-F240 HydrophobicContact CD2-CD2 3.93Å; F234-F240 HydrophobicContact CD2-CG 4.26Å; F234-F240 HydrophobicContact CE1-CB 3.41Å; F234-F240 VanDerWaalsContact CE1-CB 3.41Å; F234-F240 HydrophobicContact CE2-CB 3.52Å; F234-F240 AromaticContact CE2-CD2 3.81Å; F234-F240 HydrophobicContact CE2-CD2 3.81Å; F234-F240 AromaticContact CE2-CG 3.85Å; F234-F240 HydrophobicContact CE2-CG 3.85Å; F234-F240 HydrophobicContact CG-CB 3.96Å; F234-F240 HydrophobicContact CZ-CB 3.3Å; F234-F240 HydrophobicContact CZ-CD2 4.45Å; F234-F240 HydrophobicContact CZ-CG 4.02Å; F234-F240 PolarHBondContact N-O 3.39Å; F234-F240 WeakPolarHBondContact O-CB 3.5Å; F234-F240 WeakPolarHBondContact O-CD2 3.27Å; F234-F240 PolarHBondContact O-N 3.11Å; F234-E242 HydrophobicContact CD1-CB 4.2Å; F234-E242 HydrophobicContact CE1-CB 3.75Å
235	G	82.8	Confident	83.5	Confident	36 Å²	36	69.3 Å²	69.3	37%	0.371	34%	0.343	S	S	.	.	S	Bend	trans	96.4	168.9	-171.6	0	0	0	0	0	112.7	F237 C238	G235-F237 PolarHBondContact O-N 3.34Å; G235-F237 VanDerWaalsContact O-N 3.16Å; G235-C238 PolarHBondContact O-N 3.25Å; G235-C238 VanDerWaalsContact O-N 3.16Å
236	R	82.9	Confident	82.1	Confident	95 Å²	95	73.7 Å²	73.7	36%	0.358	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-36.6	-176	-175.5	-178.6	179.5	166.2	2.7	113.2	D220 D222	D220-R236 VanDerWaalsContact CG-NH2 3.25Å; D220-R236 IonicContact OD1-NH2 3.21Å; D220-R236 PolarHBondContact OD1-NH2 2.76Å; D220-R236 IonicContact OD2-CZ 3.29Å; D220-R236 VanDerWaalsContact OD2-CZ 3.29Å; D220-R236 IonicContact OD2-NE 3.15Å; D220-R236 PolarHBondContact OD2-NE 3.36Å; D220-R236 VanDerWaalsContact OD2-NE 3.15Å; D220-R236 IonicContact OD2-NH2 2.66Å; D220-R236 PolarHBondContact OD2-NH2 3.11Å; D222-R236 IonicContact OD2-CZ 3.29Å; D222-R236 VanDerWaalsContact OD2-CZ 3.29Å; D222-R236 IonicContact OD2-NH1 2.99Å; D222-R236 PolarHBondContact OD2-NH1 3.04Å; D222-R236 IonicContact OD2-NH2 2.72Å; D222-R236 PolarHBondContact OD2-NH2 3.36Å
237	F	85.6	Confident	80.4	Confident	3 Å²	3	75.5 Å²	75.5	1%	0.013	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	17.9	-177	-53	-53.8	0	0	0	112.2	L30 M69 Y70 L210 W224 G235 Q239	L30-F237 HydrophobicContact CD1-CB 4.18Å; L30-F237 HydrophobicContact CD1-CD1 3.59Å; L30-F237 HydrophobicContact CD1-CE1 4.25Å; L30-F237 HydrophobicContact CD1-CG 4.08Å; M69-F237 VanDerWaalsContact O-CE2 3.29Å; M69-F237 WeakPolarHBondContact O-CE2 3.35Å; Y70-F237 HydrophobicContact CD1-CD2 4.31Å; Y70-F237 HydrophobicContact CD1-CE2 4.02Å; Y70-F237 HydrophobicContact CE1-CE2 4.06Å; L210-F237 HydrophobicContact CD1-CB 4Å; L210-F237 HydrophobicContact CD2-CB 4.19Å; W224-F237 HydrophobicContact CB-CE1 4.07Å; W224-F237 AromaticContact CD2-CE1 3.7Å; W224-F237 HydrophobicContact CD2-CE1 3.7Å; W224-F237 AromaticContact CD2-CZ 3.45Å; W224-F237 HydrophobicContact CD2-CZ 3.45Å; W224-F237 VanDerWaalsContact CD2-CZ 3.45Å; W224-F237 AromaticContact CE2-CZ 3.86Å; W224-F237 HydrophobicContact CE3-CD1 4.36Å; W224-F237 AromaticContact CE3-CE1 3.41Å; W224-F237 HydrophobicContact CE3-CE1 3.41Å; W224-F237 VanDerWaalsContact CE3-CE1 3.41Å; W224-F237 HydrophobicContact CE3-CE2 4.3Å; W224-F237 AromaticContact CE3-CZ 3.37Å; W224-F237 HydrophobicContact CE3-CZ 3.37Å; W224-F237 HydrophobicContact CG-CE1 4.01Å; W224-F237 AromaticContact CG-CZ 3.98Å; W224-F237 HydrophobicContact CG-CZ 3.98Å; W224-F237 HydrophobicContact CH2-CE2 4.46Å; W224-F237 HydrophobicContact CH2-CZ 4.15Å; W224-F237 HydrophobicContact CZ2-CZ 4.2Å; W224-F237 HydrophobicContact CZ3-CE1 4.07Å; W224-F237 HydrophobicContact CZ3-CE2 4.26Å; W224-F237 AromaticContact CZ3-CZ 3.75Å; W224-F237 HydrophobicContact CZ3-CZ 3.75Å; G235-F237 PolarHBondContact O-N 3.34Å; G235-F237 VanDerWaalsContact O-N 3.16Å; F237-Q239 PolarHBondContact O-N 3.33Å
238	C	86	Confident	78.8	Confident	1 Å²	1	80 Å²	80	1%	0.007	39%	0.389	C	S	.	.	S	Bend	trans	57.1	34.1	-177.2	-44.6	0	0	0	0	112.6	G212 C213 C227 C229 Y233 F234 G235	G212-C238 VanDerWaalsContact C-CB 3.48Å; G212-C238 WeakPolarHBondContact O-CB 3.47Å; C213-C238 HydrophobicContact CB-CB 4.26Å; C227-C238 VanDerWaalsContact CB-SG 3.55Å; C229-C238 WeakPolarHBondContact CA-SG 3.42Å; C229-C238 HydrophobicContact CB-CB 3.75Å; C229-C238 WeakPolarHBondContact CB-SG 3.49Å; C229-C238 PolarHBondContact N-SG 2.88Å; C229-C238 VanDerWaalsContact N-SG 3.43Å; C229-C238 WeakPolarHBondContact SG-CA 3.45Å; C229-C238 WeakPolarHBondContact SG-CB 3.38Å; C229-C238 CovalentContact SG-SG 2.03Å; C229-C238 PolarHBondContact SG-SG 2.92Å; Y233-C238 VanDerWaalsContact CD1-O 3.3Å; Y233-C238 WeakPolarHBondContact CD1-O 3.32Å; F234-C238 CarbonylContact O-C 3.55Å; F234-C238 WeakPolarHBondContact O-CA 3.29Å; G235-C238 PolarHBondContact O-N 3.25Å; G235-C238 VanDerWaalsContact O-N 3.16Å
239	Q	81	Confident	77.3	Confident	30 Å²	30	79.6 Å²	79.6	14%	0.14	39%	0.387	C	S	.	.			trans	-83.7	-14.1	-173.7	71.3	-85.6	26.9	0	0	113.4	N71 L210 F234 F237	N71-Q239 HydrophobicContact CB-CB 4.1Å; N71-Q239 HydrophobicContact CB-CG 3.49Å; N71-Q239 VanDerWaalsContact CB-CG 3.49Å; N71-Q239 PolarHBondContact ND2-O 2.68Å; L210-Q239 HydrophobicContact CD2-CB 3.77Å; F234-Q239 PolarHBondContact O-N 3.4Å; F237-Q239 PolarHBondContact O-N 3.33Å
240	F	83.3	Confident	75.9	Confident	74 Å²	74	83.5 Å²	83.5	33%	0.325	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	140.4	176.1	-53.2	-65.7	0	0	0	109.9	N71 Y233 F234	N71-F240 HydrophobicContact CB-CD1 4.49Å; N71-F240 HydrophobicContact CB-CE1 3.83Å; N71-F240 HydrophobicContact CB-CZ 4.24Å; N71-F240 VanDerWaalsContact CG-CE1 3.48Å; Y233-F240 CarbonylContact C-O 3.36Å; Y233-F240 WeakPolarHBondContact CA-O 3.42Å; Y233-F240 WeakPolarHBondContact CD1-O 3.31Å; F234-F240 HydrophobicContact CD1-CB 3.76Å; F234-F240 HydrophobicContact CD2-CB 3.83Å; F234-F240 AromaticContact CD2-CD2 3.93Å; F234-F240 HydrophobicContact CD2-CD2 3.93Å; F234-F240 HydrophobicContact CD2-CG 4.26Å; F234-F240 HydrophobicContact CE1-CB 3.41Å; F234-F240 VanDerWaalsContact CE1-CB 3.41Å; F234-F240 HydrophobicContact CE2-CB 3.52Å; F234-F240 AromaticContact CE2-CD2 3.81Å; F234-F240 HydrophobicContact CE2-CD2 3.81Å; F234-F240 AromaticContact CE2-CG 3.85Å; F234-F240 HydrophobicContact CE2-CG 3.85Å; F234-F240 HydrophobicContact CG-CB 3.96Å; F234-F240 HydrophobicContact CZ-CB 3.3Å; F234-F240 HydrophobicContact CZ-CD2 4.45Å; F234-F240 HydrophobicContact CZ-CG 4.02Å; F234-F240 PolarHBondContact N-O 3.39Å; F234-F240 WeakPolarHBondContact O-CB 3.5Å; F234-F240 WeakPolarHBondContact O-CD2 3.27Å; F234-F240 PolarHBondContact O-N 3.11Å
241	Y	83.3	Confident	74.7	Confident	115 Å²	115	87.1 Å²	87.1	45%	0.451	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.8	175.5	175.5	-101.2	0	0	0	109.1	N232 Y233 K243	N232-Y241 HydrophobicContact CB-CD2 4.08Å; N232-Y241 HydrophobicContact CB-CE2 3.72Å; N232-Y241 WeakPolarHBondContact O-CA 3.29Å; Y233-Y241 HydrophobicContact CD1-CD2 4.19Å; Y233-Y241 AromaticContact CD2-CD2 3.97Å; Y233-Y241 HydrophobicContact CD2-CD2 3.97Å; Y233-Y241 AromaticContact CE1-CD2 3.84Å; Y233-Y241 HydrophobicContact CE1-CD2 3.84Å; Y233-Y241 HydrophobicContact CE1-CG 4.22Å; Y233-Y241 AromaticContact CE2-CD2 3.59Å; Y233-Y241 HydrophobicContact CE2-CD2 3.59Å; Y233-Y241 HydrophobicContact CE2-CE2 4.04Å; Y233-Y241 HydrophobicContact CG-CD2 4.26Å; Y233-Y241 AromaticContact CZ-CD2 3.53Å; Y241-K243 HydrophobicContact CE1-CB 3.96Å; Y241-K243 HydrophobicContact CE1-CG 4.42Å
242	E	81.5	Confident	73.6	Confident	112 Å²	112	88.1 Å²	88.1	52%	0.523	41%	0.408	S	S	.	.			trans	-99.2	113.1	170.7	-171.4	170.1	-171.5	0	0	108.1	N232 F234	N232-E242 VanDerWaalsContact CB-O 3.3Å; N232-E242 WeakPolarHBondContact CB-O 3.48Å; N232-E242 PolarHBondContact O-N 3.22Å; F234-E242 HydrophobicContact CD1-CB 4.2Å; F234-E242 HydrophobicContact CE1-CB 3.75Å
243	K	78.4	Confident	72.6	Confident	114 Å²	114	90.7 Å²	90.7	50%	0.496	42%	0.418	S	S	.	.			trans	-59	126.3	177.2	-170.9	-178.1	177.3	-167.9	0	108.1	Y241 K245	Y241-K243 HydrophobicContact CE1-CB 3.96Å; Y241-K243 HydrophobicContact CE1-CG 4.42Å; K243-K245 PolarHBondContact O-N 3.01Å
244	P	67.2	Low	72	Confident	33 Å²	33	93.5 Å²	93.5	21%	0.214	44%	0.435	C	S	.	.			trans	-58.9	126.2	-178.9	19.7	-29.7	0	0	0	109.6	N232 E246 K247	N232-P244 WeakPolarHBondContact OD1-CB 3.27Å; P244-E246 PolarHBondContact O-N 3.28Å; P244-K247 PolarHBondContact O-N 2.95Å
245	K	62.2	Low	71.3	Confident	146 Å²	146	93.7 Å²	93.7	64%	0.635	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.9	178.9	-69.2	-175.9	179.7	177.6	0	112.7	K243 K247 E248 D249	K243-K245 PolarHBondContact O-N 3.01Å; K245-K247 PolarHBondContact O-N 3.27Å; K245-E248 PolarHBondContact O-N 2.8Å; K245-D249 PolarHBondContact O-N 3.44Å
246	E	58.5	Low	70.8	Confident	131 Å²	131	95.8 Å²	95.8	61%	0.612	45%	0.446	S	S	*	.	H	α-helix	trans	-54.3	-27.4	177.1	-73.5	-167.3	175.4	0	0	114.7	P244 K250	P244-E246 PolarHBondContact O-N 3.28Å; E246-K250 WeakPolarHBondContact O-CB 3.21Å; E246-K250 VanDerWaalsContact O-CG 3.28Å; E246-K250 WeakPolarHBondContact O-CG 3.24Å; E246-K250 PolarHBondContact O-N 3.17Å
247	K	54.2	Low	70.4	Confident	124 Å²	124	95.4 Å²	95.4	54%	0.539	45%	0.451	S	S	.	.	H	α-helix	trans	-73	-38.1	175.4	-77.6	-171.3	177.1	-178.5	0	112.1	P244 K245 E251	P244-K247 PolarHBondContact O-N 2.95Å; K245-K247 PolarHBondContact O-N 3.27Å; K247-E251 PolarHBondContact O-N 3.1Å; K247-E251 VanDerWaalsContact O-N 3.16Å
248	E	54	Low	70	Confident	111 Å²	111	100.3 Å²	100.3	52%	0.519	48%	0.476	S	S	.	.	H	α-helix	trans	-70.4	-40	173.3	-74.3	-178.8	170.9	0	0	110.7	K245 K250 E251 Q252	K245-E248 PolarHBondContact O-N 2.8Å; E248-K250 PolarHBondContact O-N 3.11Å; E248-E251 PolarHBondContact O-N 3.05Å; E248-Q252 WeakPolarHBondContact O-CB 3.46Å; E248-Q252 WeakPolarHBondContact O-CG 3.27Å; E248-Q252 PolarHBondContact O-N 3.19Å
249	D	57.9	Low	69.2	Low	90 Å²	90	106.3 Å²	106.3	48%	0.481	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-38.9	174.7	-80.9	-26.8	0	0	0	111.9	K245 Q252 Q253	K245-D249 PolarHBondContact O-N 3.44Å; D249-Q252 PolarHBondContact O-N 3.4Å; D249-Q253 WeakPolarHBondContact O-CA 3.41Å; D249-Q253 WeakPolarHBondContact O-CB 3.48Å; D249-Q253 PolarHBondContact O-N 2.95Å
250	K	58	Low	69	Low	135 Å²	135	110 Å²	110	59%	0.587	53%	0.525	S	S	*	.	H	α-helix	trans	-66.7	-40.6	176.2	-80.9	178	-176.1	173.3	0	112.5	E246 E248 M254	E246-K250 WeakPolarHBondContact O-CB 3.21Å; E246-K250 VanDerWaalsContact O-CG 3.28Å; E246-K250 WeakPolarHBondContact O-CG 3.24Å; E246-K250 PolarHBondContact O-N 3.17Å; E248-K250 PolarHBondContact O-N 3.11Å; K250-M254 WeakPolarHBondContact O-CB 3.01Å; K250-M254 PolarHBondContact O-N 2.82Å
251	E	63.8	Low	68.4	Low	138 Å²	138	112.3 Å²	112.3	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-65.8	-45.2	175.1	-76	-179.2	-178	0	0	111	K247 E248 M254 L255	K247-E251 PolarHBondContact O-N 3.1Å; K247-E251 VanDerWaalsContact O-N 3.16Å; E248-E251 PolarHBondContact O-N 3.05Å; E251-M254 PolarHBondContact O-N 3.41Å; E251-L255 WeakPolarHBondContact O-CB 3.14Å; E251-L255 PolarHBondContact O-N 2.82Å
252	Q	64.1	Low	67.8	Low	125 Å²	125	108.7 Å²	108.7	58%	0.584	54%	0.537	S	S	*	.	H	α-helix	trans	-63.2	-43.5	175.2	-73.9	-173.5	-4.1	0	0	112.1	E248 D249 M254 L255 V256	E248-Q252 WeakPolarHBondContact O-CB 3.46Å; E248-Q252 WeakPolarHBondContact O-CG 3.27Å; E248-Q252 PolarHBondContact O-N 3.19Å; D249-Q252 PolarHBondContact O-N 3.4Å; Q252-M254 VanDerWaalsContact C-N 3.33Å; Q252-M254 PolarHBondContact O-N 2.69Å; Q252-L255 WeakPolarHBondContact O-CB 3.4Å; Q252-L255 PolarHBondContact O-N 2.87Å; Q252-L255 VanDerWaalsContact O-N 3.17Å; Q252-V256 VanDerWaalsContact O-CG2 3.31Å; Q252-V256 WeakPolarHBondContact O-CG2 3.28Å; Q252-V256 PolarHBondContact O-N 3.11Å
253	Q	66	Low	67.4	Low	124 Å²	124	109.4 Å²	109.4	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-65.6	-37.3	177.7	-168.4	175.6	30.9	0	0	111.2	D249 N257	D249-Q253 WeakPolarHBondContact O-CA 3.41Å; D249-Q253 WeakPolarHBondContact O-CB 3.48Å; D249-Q253 PolarHBondContact O-N 2.95Å; Q253-N257 WeakPolarHBondContact O-CB 3.46Å; Q253-N257 PolarHBondContact O-N 2.57Å
254	M	73.8	Confident	67.1	Low	127 Å²	127	105.8 Å²	105.8	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-64.3	-42.4	171.8	-167.5	178.6	-161.6	0	0	111.1	K250 E251 Q252 N257 I258	K250-M254 WeakPolarHBondContact O-CB 3.01Å; K250-M254 PolarHBondContact O-N 2.82Å; E251-M254 PolarHBondContact O-N 3.41Å; Q252-M254 VanDerWaalsContact C-N 3.33Å; Q252-M254 PolarHBondContact O-N 2.69Å; M254-N257 PolarHBondContact O-N 3.09Å; M254-I258 HydrophobicContact CG-CD1 4.18Å; M254-I258 VanDerWaalsContact O-CG1 3.26Å; M254-I258 WeakPolarHBondContact O-CG1 3.44Å; M254-I258 PolarHBondContact O-N 2.86Å
255	L	72.2	Confident	67.4	Low	103 Å²	103	107 Å²	107	54%	0.539	54%	0.544	S	S	.	.	H	α-helix	trans	-65.7	-41.9	178.8	-148.7	130.7	0	0	0	111.8	E251 Q252 I258 M259	E251-L255 WeakPolarHBondContact O-CB 3.14Å; E251-L255 PolarHBondContact O-N 2.82Å; Q252-L255 WeakPolarHBondContact O-CB 3.4Å; Q252-L255 PolarHBondContact O-N 2.87Å; Q252-L255 VanDerWaalsContact O-N 3.17Å; L255-I258 PolarHBondContact O-N 3.38Å; L255-M259 HydrophobicContact CD2-CE 3.8Å; L255-M259 HydrophobicContact CD2-SD 4.37Å; L255-M259 WeakPolarHBondContact O-CG 3.4Å; L255-M259 PolarHBondContact O-N 2.74Å
256	V	73.9	Confident	68	Low	80 Å²	80	106.1 Å²	106.1	49%	0.485	54%	0.54	S	S	.	.	H	α-helix	trans	-63.7	-42.8	173.4	171.2	0	0	0	0	111.1	Q252 I258 M259 L260	Q252-V256 VanDerWaalsContact O-CG2 3.31Å; Q252-V256 WeakPolarHBondContact O-CG2 3.28Å; Q252-V256 PolarHBondContact O-N 3.11Å; V256-I258 PolarHBondContact O-N 3.27Å; V256-M259 PolarHBondContact O-N 2.61Å; V256-L260 HydrophobicContact CG1-CD1 3.92Å; V256-L260 HydrophobicContact CG1-CG 4.45Å; V256-L260 WeakPolarHBondContact O-CB 3.02Å; V256-L260 WeakPolarHBondContact O-CG 3.19Å; V256-L260 PolarHBondContact O-N 3.15Å
257	N	73.8	Confident	68.8	Low	87 Å²	87	103.7 Å²	103.7	47%	0.465	53%	0.531	S	S	.	.	H	α-helix	trans	-62.7	-41.7	175.4	-81.6	-15.5	0	0	0	112	Q253 M254 M259 L260 I261	Q253-N257 WeakPolarHBondContact O-CB 3.46Å; Q253-N257 PolarHBondContact O-N 2.57Å; M254-N257 PolarHBondContact O-N 3.09Å; N257-M259 VanDerWaalsContact C-N 3.35Å; N257-L260 PolarHBondContact O-N 3.23Å; N257-I261 VanDerWaalsContact O-CG1 3.25Å; N257-I261 WeakPolarHBondContact O-CG1 3.36Å; N257-I261 PolarHBondContact O-N 3.29Å
258	I	76.2	Confident	69.8	Low	107 Å²	107	104.7 Å²	104.7	55%	0.549	54%	0.535	S	S	.	.	H	α-helix	trans	-62.1	-44.1	174.9	-69.6	164.9	0	0	0	110.4	M254 L255 V256 I261 G262	M254-I258 HydrophobicContact CG-CD1 4.18Å; M254-I258 VanDerWaalsContact O-CG1 3.26Å; M254-I258 WeakPolarHBondContact O-CG1 3.44Å; M254-I258 PolarHBondContact O-N 2.86Å; L255-I258 PolarHBondContact O-N 3.38Å; V256-I258 PolarHBondContact O-N 3.27Å; I258-I261 PolarHBondContact O-N 2.82Å; I258-G262 PolarHBondContact O-N 3.42Å
259	M	70.7	Confident	70.8	Confident	126 Å²	126	105 Å²	105	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-63	-41.5	176.2	-74.9	-173.1	171.8	0	0	112.3	L255 V256 N257 G262 F263	L255-M259 HydrophobicContact CD2-CE 3.8Å; L255-M259 HydrophobicContact CD2-SD 4.37Å; L255-M259 WeakPolarHBondContact O-CG 3.4Å; L255-M259 PolarHBondContact O-N 2.74Å; V256-M259 PolarHBondContact O-N 2.61Å; N257-M259 VanDerWaalsContact C-N 3.35Å; M259-G262 PolarHBondContact O-N 3.32Å; M259-F263 VanDerWaalsContact O-CB 3.25Å; M259-F263 WeakPolarHBondContact O-CB 3.41Å; M259-F263 PolarHBondContact O-N 3.22Å
260	L	75.3	Confident	71.8	Confident	107 Å²	107	106.8 Å²	106.8	56%	0.56	54%	0.544	S	S	*	.	H	α-helix	trans	-64.9	-42.7	177.1	-79.1	166	0	0	0	112.2	V256 N257 F263 G264	V256-L260 HydrophobicContact CG1-CD1 3.92Å; V256-L260 HydrophobicContact CG1-CG 4.45Å; V256-L260 WeakPolarHBondContact O-CB 3.02Å; V256-L260 WeakPolarHBondContact O-CG 3.19Å; V256-L260 PolarHBondContact O-N 3.15Å; N257-L260 PolarHBondContact O-N 3.23Å; L260-F263 PolarHBondContact O-N 3.05Å; L260-G264 PolarHBondContact O-N 3.24Å
261	I	72.1	Confident	72.7	Confident	124 Å²	124	103.7 Å²	103.7	64%	0.636	54%	0.538	S	S	*	.	H	α-helix	trans	-66.5	-42.4	176.4	-66.4	165.8	0	0	0	110.3	N257 I258 G264 S265	N257-I261 VanDerWaalsContact O-CG1 3.25Å; N257-I261 WeakPolarHBondContact O-CG1 3.36Å; N257-I261 PolarHBondContact O-N 3.29Å; I258-I261 PolarHBondContact O-N 2.82Å; I261-G264 PolarHBondContact O-N 3.21Å; I261-S265 WeakPolarHBondContact O-CB 3.18Å; I261-S265 PolarHBondContact O-N 2.88Å; I261-S265 PolarHBondContact O-OG 3.05Å
262	G	69.7	Low	73.3	Confident	38 Å²	38	99.4 Å²	99.4	39%	0.392	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-44.5	175.4	0	0	0	0	0	112.4	I258 M259 S265 F266	I258-G262 PolarHBondContact O-N 3.42Å; M259-G262 PolarHBondContact O-N 3.32Å; G262-S265 PolarHBondContact O-OG 3.46Å; G262-F266 WeakPolarHBondContact O-CB 3.48Å; G262-F266 PolarHBondContact O-N 3.38Å
263	F	73.1	Confident	74	Confident	127 Å²	127	99.6 Å²	99.6	56%	0.557	52%	0.522	S	S	*	.	H	α-helix	trans	-69.7	-41.4	178.2	-168.9	-106.2	0	0	0	112.3	M259 L260 F266 L267	M259-F263 VanDerWaalsContact O-CB 3.25Å; M259-F263 WeakPolarHBondContact O-CB 3.41Å; M259-F263 PolarHBondContact O-N 3.22Å; L260-F263 PolarHBondContact O-N 3.05Å; F263-F266 PolarHBondContact O-N 3.13Å; F263-L267 HydrophobicContact CD1-CD1 3.78Å; F263-L267 HydrophobicContact CD1-CG 4.25Å; F263-L267 HydrophobicContact CE1-CD1 3.4Å; F263-L267 HydrophobicContact CE1-CG 3.97Å; F263-L267 HydrophobicContact CZ-CD1 4.05Å; F263-L267 HydrophobicContact CZ-CD2 4.37Å; F263-L267 HydrophobicContact CZ-CG 4.23Å; F263-L267 WeakPolarHBondContact O-CG 3.18Å; F263-L267 PolarHBondContact O-N 3.43Å
264	G	71.7	Confident	74.7	Confident	38 Å²	38	95.8 Å²	95.8	39%	0.392	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176.4	0	0	0	0	0	112.7	L260 I261 L267 F268	L260-G264 PolarHBondContact O-N 3.24Å; I261-G264 PolarHBondContact O-N 3.21Å; G264-L267 PolarHBondContact O-N 2.85Å; G264-F268 WeakPolarHBondContact O-CB 3.48Å; G264-F268 PolarHBondContact O-N 3.38Å
265	S	73.3	Confident	75	Confident	59 Å²	59	94 Å²	94	41%	0.413	50%	0.504	S	S	.	.	H	α-helix	trans	-67.7	-38.7	175.5	53.7	0	0	0	0	112.2	I261 G262 F268 L269	I261-S265 WeakPolarHBondContact O-CB 3.18Å; I261-S265 PolarHBondContact O-N 2.88Å; I261-S265 PolarHBondContact O-OG 3.05Å; G262-S265 PolarHBondContact O-OG 3.46Å; S265-F268 PolarHBondContact O-N 3.24Å; S265-L269 WeakPolarHBondContact O-CG 3.49Å; S265-L269 PolarHBondContact O-N 2.74Å
266	F	75.2	Confident	75.4	Confident	128 Å²	128	94.1 Å²	94.1	56%	0.561	50%	0.504	S	S	*	.	H	α-helix	trans	-62.1	-46.9	173.5	-176.6	-96.8	0	0	0	112.2	G262 F263 F268 L269 F270	G262-F266 WeakPolarHBondContact O-CB 3.48Å; G262-F266 PolarHBondContact O-N 3.38Å; F263-F266 PolarHBondContact O-N 3.13Å; F266-F268 VanDerWaalsContact C-N 3.32Å; F266-F268 PolarHBondContact O-N 3.2Å; F266-L269 PolarHBondContact O-N 2.77Å; F266-F270 WeakPolarHBondContact O-CB 2.86Å; F266-F270 PolarHBondContact O-N 3.45Å
267	L	75.5	Confident	75.8	Confident	80 Å²	80	94 Å²	94	42%	0.419	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175.7	-75.9	179.8	0	0	0	112.1	F263 G264 F270 C271	F263-L267 HydrophobicContact CD1-CD1 3.78Å; F263-L267 HydrophobicContact CD1-CG 4.25Å; F263-L267 HydrophobicContact CE1-CD1 3.4Å; F263-L267 HydrophobicContact CE1-CG 3.97Å; F263-L267 HydrophobicContact CZ-CD1 4.05Å; F263-L267 HydrophobicContact CZ-CD2 4.37Å; F263-L267 HydrophobicContact CZ-CG 4.23Å; F263-L267 WeakPolarHBondContact O-CG 3.18Å; F263-L267 PolarHBondContact O-N 3.43Å; G264-L267 PolarHBondContact O-N 2.85Å; L267-F270 PolarHBondContact O-N 2.88Å; L267-C271 VanDerWaalsContact O-CB 3.3Å; L267-C271 WeakPolarHBondContact O-CB 3.49Å; L267-C271 PolarHBondContact O-N 3.15Å; L267-C271 PolarHBondContact O-SG 3.21Å; L267-C271 VanDerWaalsContact O-SG 3.41Å
268	F	74.8	Confident	76.1	Confident	144 Å²	144	98.8 Å²	98.8	63%	0.632	51%	0.512	S	S	*	.	H	α-helix	trans	-62.6	-48.1	176.2	-177	-98.2	0	0	0	111.6	G264 S265 F266 F270 C271 C272	G264-F268 WeakPolarHBondContact O-CB 3.48Å; G264-F268 PolarHBondContact O-N 3.38Å; S265-F268 PolarHBondContact O-N 3.24Å; F266-F268 VanDerWaalsContact C-N 3.32Å; F266-F268 PolarHBondContact O-N 3.2Å; F268-F270 VanDerWaalsContact C-N 3.35Å; F268-F270 PolarHBondContact O-N 2.6Å; F268-C271 PolarHBondContact O-N 3.41Å; F268-C272 PolarHBondContact O-N 2.9Å; F268-C272 PolarHBondContact O-SG 3.3Å; F268-C272 VanDerWaalsContact O-SG 3.39Å
269	L	76.3	Confident	76.3	Confident	118 Å²	118	101.1 Å²	101.1	62%	0.618	51%	0.514	S	S	*	.	H	α-helix	trans	-61.6	-42.4	176.3	-72.2	173.7	0	0	0	111.8	S265 F266 C272 F273	S265-L269 WeakPolarHBondContact O-CG 3.49Å; S265-L269 PolarHBondContact O-N 2.74Å; F266-L269 PolarHBondContact O-N 2.77Å; L269-C272 PolarHBondContact O-N 2.66Å; L269-F273 WeakPolarHBondContact O-CB 2.96Å; L269-F273 PolarHBondContact O-N 2.9Å
270	F	78.8	Confident	77	Confident	127 Å²	127	104.3 Å²	104.3	56%	0.557	52%	0.519	S	S	*	.	H	α-helix	trans	-62.6	-43.9	176.1	-172.3	-96	0	0	0	111.7	F266 L267 F268 F273 A274	F266-F270 WeakPolarHBondContact O-CB 2.86Å; F266-F270 PolarHBondContact O-N 3.45Å; L267-F270 PolarHBondContact O-N 2.88Å; F268-F270 VanDerWaalsContact C-N 3.35Å; F268-F270 PolarHBondContact O-N 2.6Å; F270-F273 PolarHBondContact O-N 3.1Å; F270-A274 VanDerWaalsContact O-CB 3.31Å; F270-A274 WeakPolarHBondContact O-CB 3.29Å; F270-A274 PolarHBondContact O-N 2.04Å
271	C	76.7	Confident	77.2	Confident	70 Å²	70	103.8 Å²	103.8	47%	0.473	52%	0.516	S	S	.	.	H	α-helix	trans	-61.4	-45.8	174.5	-82.5	0	0	0	0	112	L267 F268 F273 A274 I275	L267-C271 VanDerWaalsContact O-CB 3.3Å; L267-C271 WeakPolarHBondContact O-CB 3.49Å; L267-C271 PolarHBondContact O-N 3.15Å; L267-C271 PolarHBondContact O-SG 3.21Å; L267-C271 VanDerWaalsContact O-SG 3.41Å; F268-C271 PolarHBondContact O-N 3.41Å; C271-F273 VanDerWaalsContact C-N 3.33Å; C271-F273 PolarHBondContact O-N 2.91Å; C271-A274 PolarHBondContact O-N 3.48Å; C271-I275 VanDerWaalsContact O-CG1 3.23Å; C271-I275 WeakPolarHBondContact O-CG1 3.23Å; C271-I275 PolarHBondContact O-N 3.47Å
272	C	75.8	Confident	77.7	Confident	48 Å²	48	102.5 Å²	102.5	32%	0.324	51%	0.51	S	S	.	.	H	α-helix	trans	-58.9	-45	174.8	-73.7	0	0	0	0	111.5	F268 L269 I275 L276	F268-C272 PolarHBondContact O-N 2.9Å; F268-C272 PolarHBondContact O-SG 3.3Å; F268-C272 VanDerWaalsContact O-SG 3.39Å; L269-C272 PolarHBondContact O-N 2.66Å; C272-I275 PolarHBondContact O-N 2.82Å; C272-L276 WeakPolarHBondContact O-CG 3.27Å; C272-L276 PolarHBondContact O-N 2.86Å
273	F	80	Confident	78.3	Confident	130 Å²	130	108.7 Å²	108.7	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-64.9	-42.9	178.4	-164.3	-104.1	0	0	0	112.1	L269 F270 C271 I275 L276 I277	L269-F273 WeakPolarHBondContact O-CB 2.96Å; L269-F273 PolarHBondContact O-N 2.9Å; F270-F273 PolarHBondContact O-N 3.1Å; C271-F273 VanDerWaalsContact C-N 3.33Å; C271-F273 PolarHBondContact O-N 2.91Å; F273-I275 PolarHBondContact O-N 3.01Å; F273-L276 WeakPolarHBondContact O-CB 3.31Å; F273-L276 PolarHBondContact O-N 3.06Å; F273-I277 HydrophobicContact CD1-CD1 3.66Å; F273-I277 HydrophobicContact CD1-CG1 4.33Å; F273-I277 HydrophobicContact CE1-CD1 3.38Å; F273-I277 HydrophobicContact CE1-CG1 4.19Å; F273-I277 HydrophobicContact CZ-CD1 4.2Å; F273-I277 WeakPolarHBondContact O-CG1 3.45Å; F273-I277 PolarHBondContact O-N 3.21Å
274	A	79.7	Confident	78.6	Confident	44 Å²	44	109.9 Å²	109.9	36%	0.364	53%	0.526	S	S	.	.	H	α-helix	trans	-61.4	-42.1	175.8	0	0	0	0	0	111.8	F270 C271 L276 I277 R278	F270-A274 VanDerWaalsContact O-CB 3.31Å; F270-A274 WeakPolarHBondContact O-CB 3.29Å; F270-A274 PolarHBondContact O-N 2.04Å; C271-A274 PolarHBondContact O-N 3.48Å; A274-L276 PolarHBondContact O-N 2.72Å; A274-I277 PolarHBondContact O-N 3.03Å; A274-R278 WeakPolarHBondContact O-CB 3.4Å; A274-R278 PolarHBondContact O-N 3.14Å
275	I	79.6	Confident	78.9	Confident	88 Å²	88	117.4 Å²	117.4	45%	0.451	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-42.7	175.3	-68.4	164.7	0	0	0	110.8	C271 C272 F273 R278 R279	C271-I275 VanDerWaalsContact O-CG1 3.23Å; C271-I275 WeakPolarHBondContact O-CG1 3.23Å; C271-I275 PolarHBondContact O-N 3.47Å; C272-I275 PolarHBondContact O-N 2.82Å; F273-I275 PolarHBondContact O-N 3.01Å; I275-R278 PolarHBondContact O-N 2.89Å; I275-R279 HydrophobicContact CG2-CG 4.49Å; I275-R279 WeakPolarHBondContact O-CB 3.22Å; I275-R279 WeakPolarHBondContact O-CG 2.95Å; I275-R279 PolarHBondContact O-N 2.88Å
276	L	80.7	Confident	79.2	Confident	106 Å²	106	121.4 Å²	121.4	56%	0.555	55%	0.553	S	S	*	*	H	α-helix	trans	-62.6	-43.1	176.7	-72.1	174.1	0	0	0	112	C272 F273 A274 R279 R280	C272-L276 WeakPolarHBondContact O-CG 3.27Å; C272-L276 PolarHBondContact O-N 2.86Å; F273-L276 WeakPolarHBondContact O-CB 3.31Å; F273-L276 PolarHBondContact O-N 3.06Å; A274-L276 PolarHBondContact O-N 2.72Å; L276-R279 PolarHBondContact O-N 2.78Å; L276-R280 PolarHBondContact O-N 2.96Å
277	I	82	Confident	79.4	Confident	78 Å²	78	123.5 Å²	123.5	40%	0.4	56%	0.557	S	S	.	*	H	α-helix	trans	-62.5	-46.8	174.3	-70.4	178.8	0	0	0	110.5	F273 A274 R279 R280 L281	F273-I277 HydrophobicContact CD1-CD1 3.66Å; F273-I277 HydrophobicContact CD1-CG1 4.33Å; F273-I277 HydrophobicContact CE1-CD1 3.38Å; F273-I277 HydrophobicContact CE1-CG1 4.19Å; F273-I277 HydrophobicContact CZ-CD1 4.2Å; F273-I277 WeakPolarHBondContact O-CG1 3.45Å; F273-I277 PolarHBondContact O-N 3.21Å; A274-I277 PolarHBondContact O-N 3.03Å; I277-R279 VanDerWaalsContact C-N 3.33Å; I277-R279 PolarHBondContact O-N 2.89Å; I277-R280 PolarHBondContact O-N 2.89Å; I277-R280 VanDerWaalsContact O-N 3.15Å; I277-L281 HydrophobicContact CG2-CD1 3.8Å; I277-L281 HydrophobicContact CG2-CG 4.24Å; I277-L281 WeakPolarHBondContact O-CG 2.94Å; I277-L281 PolarHBondContact O-N 3.01Å
278	R	80.6	Confident	79.5	Confident	187 Å²	187	129.1 Å²	129.1	71%	0.706	57%	0.572	S	S	*	*	H	α-helix	trans	-58.6	-44.7	178.2	-127.1	179.1	-177	178.7	1.1	111.3	A274 I275 R280 L281 I282	A274-R278 WeakPolarHBondContact O-CB 3.4Å; A274-R278 PolarHBondContact O-N 3.14Å; I275-R278 PolarHBondContact O-N 2.89Å; R278-R280 PolarHBondContact O-N 2.96Å; R278-L281 PolarHBondContact O-N 2.78Å; R278-I282 VanDerWaalsContact O-CG1 3.28Å; R278-I282 WeakPolarHBondContact O-CG1 3.06Å; R278-I282 PolarHBondContact O-N 2.74Å
279	R	81.7	Confident	79.8	Confident	157 Å²	157	129.1 Å²	129.1	59%	0.592	57%	0.574	S	S	*	*	H	α-helix	trans	-61.6	-42.9	175.4	-75.3	180	176.1	-174.2	-0	111.9	I275 L276 I277 I282 R283	I275-R279 HydrophobicContact CG2-CG 4.49Å; I275-R279 WeakPolarHBondContact O-CB 3.22Å; I275-R279 WeakPolarHBondContact O-CG 2.95Å; I275-R279 PolarHBondContact O-N 2.88Å; L276-R279 PolarHBondContact O-N 2.78Å; I277-R279 VanDerWaalsContact C-N 3.33Å; I277-R279 PolarHBondContact O-N 2.89Å; R279-I282 PolarHBondContact O-N 3.38Å; R279-R283 WeakPolarHBondContact O-CG 3.38Å; R279-R283 PolarHBondContact O-N 3.24Å
280	R	83.5	Confident	80	Confident	192 Å²	192	129.2 Å²	129.2	73%	0.725	57%	0.572	S	S	*	*	H	α-helix	trans	-62.3	-42.9	174.2	-90.4	-175.9	171.1	176.7	-1.2	112	L276 I277 R278 R283 K284	L276-R280 PolarHBondContact O-N 2.96Å; I277-R280 PolarHBondContact O-N 2.89Å; I277-R280 VanDerWaalsContact O-N 3.15Å; R278-R280 PolarHBondContact O-N 2.96Å; R280-R283 PolarHBondContact O-N 3.32Å; R280-K284 PolarHBondContact O-N 3.34Å
281	L	81	Confident	80	Confident	97 Å²	97	132 Å²	132	51%	0.508	58%	0.578	S	S	.	*	H	α-helix	trans	-65.7	-42.2	178.2	-73.2	172	0	0	0	112.1	I277 R278 K284 R285	I277-L281 HydrophobicContact CG2-CD1 3.8Å; I277-L281 HydrophobicContact CG2-CG 4.24Å; I277-L281 WeakPolarHBondContact O-CG 2.94Å; I277-L281 PolarHBondContact O-N 3.01Å; R278-L281 PolarHBondContact O-N 2.78Å; L281-K284 PolarHBondContact O-N 2.8Å; L281-R285 PolarHBondContact O-N 2.73Å
282	I	81.1	Confident	80	Confident	96 Å²	96	134.6 Å²	134.6	49%	0.492	59%	0.585	S	S	.	*	H	α-helix	trans	-63.2	-44.5	175.9	-68.4	165.5	0	0	0	110.8	R278 R279 K284 R285 K286	R278-I282 VanDerWaalsContact O-CG1 3.28Å; R278-I282 WeakPolarHBondContact O-CG1 3.06Å; R278-I282 PolarHBondContact O-N 2.74Å; R279-I282 PolarHBondContact O-N 3.38Å; I282-K284 VanDerWaalsContact C-N 3.34Å; I282-K284 PolarHBondContact O-N 2.84Å; I282-R285 PolarHBondContact O-N 2.79Å; I282-K286 PolarHBondContact O-N 2.91Å
283	R	82.3	Confident	80.2	Confident	168 Å²	168	138.5 Å²	138.5	63%	0.634	60%	0.596	S	S	*	*	H	α-helix	trans	-61.1	-41.4	174.9	-73	-178.8	-171.4	175	2.7	111.7	R279 R280 K286 R287	R279-R283 WeakPolarHBondContact O-CG 3.38Å; R279-R283 PolarHBondContact O-N 3.24Å; R280-R283 PolarHBondContact O-N 3.32Å; R283-K286 PolarHBondContact O-N 3.46Å; R283-R287 WeakPolarHBondContact O-CG 3.24Å; R283-R287 PolarHBondContact O-N 2.81Å
284	K	80.3	Confident	80.1	Confident	152 Å²	152	139 Å²	139	66%	0.661	60%	0.598	S	S	*	*	H	α-helix	trans	-63.3	-41.1	174.3	-85	-174.1	174.2	-177.1	0	112.1	R280 L281 I282 R287 R288	R280-K284 PolarHBondContact O-N 3.34Å; L281-K284 PolarHBondContact O-N 2.8Å; I282-K284 VanDerWaalsContact C-N 3.34Å; I282-K284 PolarHBondContact O-N 2.84Å; K284-R287 PolarHBondContact O-N 3.5Å; K284-R288 PolarHBondContact O-N 3.21Å
285	R	77.5	Confident	80	Confident	197 Å²	197	142.2 Å²	142.2	74%	0.743	61%	0.609	S	S	*	*	H	α-helix	trans	-64.6	-46	175.7	-78	-172.1	-174.9	-177	1.2	112	L281 I282 R287 R288 H289	L281-R285 PolarHBondContact O-N 2.73Å; I282-R285 PolarHBondContact O-N 2.79Å; R285-R287 PolarHBondContact O-N 3.32Å; R285-R288 PolarHBondContact O-N 2.69Å; R285-H289 WeakPolarHBondContact O-CB 3.39Å; R285-H289 PolarHBondContact O-N 3.07Å
286	K	79.4	Confident	79.6	Confident	143 Å²	143	140.5 Å²	140.5	62%	0.622	61%	0.608	S	S	*	*	H	α-helix	trans	-57.1	-47.6	174.9	-77.9	-169.1	174.6	-170.5	0	111.7	I282 R283 R288 H289 E290	I282-K286 PolarHBondContact O-N 2.91Å; R283-K286 PolarHBondContact O-N 3.46Å; K286-R288 PolarHBondContact O-N 3.28Å; K286-H289 PolarHBondContact O-N 2.67Å; K286-H289 VanDerWaalsContact O-N 3.16Å; K286-E290 WeakPolarHBondContact O-CG 3.3Å; K286-E290 PolarHBondContact O-N 2.74Å
287	R	80.5	Confident	79.2	Confident	172 Å²	172	140.5 Å²	140.5	65%	0.649	61%	0.605	S	S	*	*	H	α-helix	trans	-61.6	-38.5	176.3	-71.3	179.5	-174.6	-172.7	0.7	113.2	R283 K284 R285 R291	R283-R287 WeakPolarHBondContact O-CG 3.24Å; R283-R287 PolarHBondContact O-N 2.81Å; K284-R287 PolarHBondContact O-N 3.5Å; R285-R287 PolarHBondContact O-N 3.32Å; R287-R291 WeakPolarHBondContact O-CB 3.13Å; R287-R291 WeakPolarHBondContact O-CG 3.14Å; R287-R291 PolarHBondContact O-N 2.91Å; R287-R291 VanDerWaalsContact O-N 3.07Å
288	R	78.3	Confident	78.6	Confident	197 Å²	197	143.4 Å²	143.4	74%	0.743	61%	0.614	S	S	*	*	H	α-helix	trans	-66.6	-42.4	173.7	-90.2	-170.2	179.2	179.7	0.1	111.6	K284 R285 K286 R291 M292	K284-R288 PolarHBondContact O-N 3.21Å; R285-R288 PolarHBondContact O-N 2.69Å; K286-R288 PolarHBondContact O-N 3.28Å; R288-R291 PolarHBondContact O-N 3.2Å; R288-M292 WeakPolarHBondContact O-CG 3.39Å; R288-M292 PolarHBondContact O-N 3.46Å
289	H	79.5	Confident	77.8	Confident	145 Å²	145	141.9 Å²	141.9	67%	0.671	61%	0.613	S	S	*	*	H	α-helix	trans	-66.2	-42	-179.6	-157.3	58.4	0	0	0	111.5	R285 K286 R291 M292 K293	R285-H289 WeakPolarHBondContact O-CB 3.39Å; R285-H289 PolarHBondContact O-N 3.07Å; K286-H289 PolarHBondContact O-N 2.67Å; K286-H289 VanDerWaalsContact O-N 3.16Å; H289-R291 PolarHBondContact O-N 3.12Å; H289-M292 PolarHBondContact O-N 3.47Å; H289-K293 WeakPolarHBondContact O-CB 3.41Å; H289-K293 PolarHBondContact O-N 3.32Å
290	E	81.6	Confident	76.7	Confident	120 Å²	120	141.2 Å²	141.2	56%	0.561	62%	0.616	S	S	*	*	H	α-helix	trans	-61.3	-41	171.9	-75	170.2	-175.3	0	0	112.4	K286 K293 K294	K286-E290 WeakPolarHBondContact O-CG 3.3Å; K286-E290 PolarHBondContact O-N 2.74Å; E290-K293 PolarHBondContact O-N 3.07Å; E290-K294 WeakPolarHBondContact O-CB 3.11Å; E290-K294 WeakPolarHBondContact O-CG 3.41Å; E290-K294 PolarHBondContact O-N 2.64Å
291	R	78.8	Confident	75.5	Confident	186 Å²	186	134.9 Å²	134.9	70%	0.702	61%	0.605	S	S	*	*	H	α-helix	trans	-64.3	-43	174.6	-77.6	-179.9	-177.8	-167	-0.6	112.1	R287 R288 H289 K294 L295	R287-R291 WeakPolarHBondContact O-CB 3.13Å; R287-R291 WeakPolarHBondContact O-CG 3.14Å; R287-R291 PolarHBondContact O-N 2.91Å; R287-R291 VanDerWaalsContact O-N 3.07Å; R288-R291 PolarHBondContact O-N 3.2Å; H289-R291 PolarHBondContact O-N 3.12Å; R291-K294 PolarHBondContact O-N 2.87Å; R291-L295 WeakPolarHBondContact O-CB 3.39Å; R291-L295 WeakPolarHBondContact O-CG 3.25Å; R291-L295 PolarHBondContact O-N 3.25Å
292	M	76.9	Confident	74.4	Confident	124 Å²	124	138 Å²	138	61%	0.611	61%	0.611	S	S	*	*	H	α-helix	trans	-66.6	-39.4	177.3	-71.8	-62.3	-68.9	0	0	111.8	R288 H289 L295 A296	R288-M292 WeakPolarHBondContact O-CG 3.39Å; R288-M292 PolarHBondContact O-N 3.46Å; H289-M292 PolarHBondContact O-N 3.47Å; M292-L295 PolarHBondContact O-N 2.88Å; M292-L295 HydrophobicContact SD-CD1 4.38Å; M292-A296 WeakPolarHBondContact O-CB 3.48Å; M292-A296 PolarHBondContact O-N 3.04Å
293	K	80.2	Confident	73.2	Confident	130 Å²	130	139.8 Å²	139.8	57%	0.565	62%	0.615	S	S	*	*	H	α-helix	trans	-62.2	-47.4	175	-166.5	-177.6	179.9	-171	0	111.2	H289 E290 L295 A296 E297	H289-K293 WeakPolarHBondContact O-CB 3.41Å; H289-K293 PolarHBondContact O-N 3.32Å; E290-K293 PolarHBondContact O-N 3.07Å; K293-L295 VanDerWaalsContact C-N 3.29Å; K293-L295 PolarHBondContact O-N 2.99Å; K293-A296 PolarHBondContact O-N 2.84Å; K293-A296 VanDerWaalsContact O-N 3.16Å; K293-E297 VanDerWaalsContact CE-OE1 3.24Å; K293-E297 WeakPolarHBondContact CE-OE1 3.46Å; K293-E297 WeakPolarHBondContact O-CB 3.48Å; K293-E297 WeakPolarHBondContact O-CG 3.47Å; K293-E297 PolarHBondContact O-N 3Å
294	K	77.5	Confident	71.9	Confident	141 Å²	141	133.5 Å²	133.5	61%	0.613	60%	0.602	S	S	*	*	H	α-helix	trans	-60.6	-36.1	174.5	-75.1	-175.8	177.2	-172.8	0	112.9	E290 R291 K298	E290-K294 WeakPolarHBondContact O-CB 3.11Å; E290-K294 WeakPolarHBondContact O-CG 3.41Å; E290-K294 PolarHBondContact O-N 2.64Å; R291-K294 PolarHBondContact O-N 2.87Å; K294-K298 WeakPolarHBondContact O-CB 3.4Å; K294-K298 WeakPolarHBondContact O-CG 3.41Å; K294-K298 PolarHBondContact O-N 2.91Å
295	L	76.1	Confident	70.7	Confident	110 Å²	110	131.3 Å²	131.3	58%	0.576	60%	0.598	S	S	*	*	H	α-helix	trans	-69.7	-39.6	174.9	-77.8	165.5	0	0	0	112.1	R291 M292 K293 K298 K299	R291-L295 WeakPolarHBondContact O-CB 3.39Å; R291-L295 WeakPolarHBondContact O-CG 3.25Å; R291-L295 PolarHBondContact O-N 3.25Å; M292-L295 PolarHBondContact O-N 2.88Å; M292-L295 HydrophobicContact SD-CD1 4.38Å; K293-L295 VanDerWaalsContact C-N 3.29Å; K293-L295 PolarHBondContact O-N 2.99Å; L295-K298 PolarHBondContact O-N 3.45Å; L295-K299 WeakPolarHBondContact O-CB 3.47Å; L295-K299 PolarHBondContact O-N 3.35Å
296	A	71.9	Confident	69.6	Low	52 Å²	52	126.9 Å²	126.9	43%	0.43	59%	0.589	S	S	.	*	H	α-helix	trans	-67.6	-42	176.3	0	0	0	0	0	112.1	M292 K293 K299 H300	M292-A296 WeakPolarHBondContact O-CB 3.48Å; M292-A296 PolarHBondContact O-N 3.04Å; K293-A296 PolarHBondContact O-N 2.84Å; K293-A296 VanDerWaalsContact O-N 3.16Å; A296-K299 PolarHBondContact O-N 3.07Å; A296-H300 PolarHBondContact O-N 3.07Å
297	E	73	Confident	68.5	Low	107 Å²	107	124 Å²	124	50%	0.5	58%	0.583	S	S	.	*	H	α-helix	trans	-61	-44.3	173.7	-74.4	168.1	-178.8	0	0	111.2	K293 K299 H300 A301	K293-E297 VanDerWaalsContact CE-OE1 3.24Å; K293-E297 WeakPolarHBondContact CE-OE1 3.46Å; K293-E297 WeakPolarHBondContact O-CB 3.48Å; K293-E297 WeakPolarHBondContact O-CG 3.47Å; K293-E297 PolarHBondContact O-N 3Å; E297-K299 PolarHBondContact O-N 2.99Å; E297-H300 PolarHBondContact O-N 2.96Å; E297-A301 PolarHBondContact O-N 3.19Å
298	K	69.4	Low	67.3	Low	138 Å²	138	121.3 Å²	121.3	60%	0.6	58%	0.581	S	S	*	*	H	α-helix	trans	-59.1	-45.5	171.8	-77.8	-175.7	176.3	-165.3	0	111.5	K294 L295 H300 A301 Y302	K294-K298 WeakPolarHBondContact O-CB 3.4Å; K294-K298 WeakPolarHBondContact O-CG 3.41Å; K294-K298 PolarHBondContact O-N 2.91Å; L295-K298 PolarHBondContact O-N 3.45Å; K298-H300 VanDerWaalsContact C-N 3.31Å; K298-H300 PolarHBondContact O-N 2.96Å; K298-A301 PolarHBondContact O-N 3.46Å; K298-Y302 WeakPolarHBondContact O-CD2 3.28Å; K298-Y302 PolarHBondContact O-N 3.48Å
299	K	62.4	Low	66.2	Low	155 Å²	155	118.3 Å²	118.3	67%	0.674	58%	0.575	S	S	*	*	H	α-helix	trans	-65.3	-33.4	-179.8	-153.1	176.6	-173.9	-178.9	0	112.6	L295 A296 E297 K303	L295-K299 WeakPolarHBondContact O-CB 3.47Å; L295-K299 PolarHBondContact O-N 3.35Å; A296-K299 PolarHBondContact O-N 3.07Å; E297-K299 PolarHBondContact O-N 2.99Å; K299-K303 PolarHBondContact O-N 3.21Å; K299-K303 VanDerWaalsContact O-N 3.11Å
300	H	59.3	Low	65.2	Low	144 Å²	144	114.1 Å²	114.1	67%	0.667	56%	0.562	S	S	*	*	H	α-helix	trans	-71.2	-39.2	172.2	-98.8	-76.9	0	0	0	112.7	A296 E297 K298 Y302 K303 G304	A296-H300 PolarHBondContact O-N 3.07Å; E297-H300 PolarHBondContact O-N 2.96Å; K298-H300 VanDerWaalsContact C-N 3.31Å; K298-H300 PolarHBondContact O-N 2.96Å; H300-Y302 VanDerWaalsContact C-N 3.34Å; H300-K303 PolarHBondContact O-N 3.2Å; H300-G304 PolarHBondContact O-N 3.24Å
301	A	59.4	Low	64.1	Low	58 Å²	58	112.1 Å²	112.1	48%	0.479	55%	0.554	S	S	.	*	H	α-helix	trans	-62.4	-41.1	174.3	0	0	0	0	0	111.7	E297 K298 G304 L305	E297-A301 PolarHBondContact O-N 3.19Å; K298-A301 PolarHBondContact O-N 3.46Å; A301-G304 PolarHBondContact O-N 2.93Å; A301-L305 PolarHBondContact O-N 2.81Å; A301-L305 VanDerWaalsContact O-N 3.09Å
302	Y	57.3	Low	63.1	Low	162 Å²	162	107.4 Å²	107.4	64%	0.635	55%	0.547	S	S	*	.	H	α-helix	trans	-64.5	-41.6	173.9	-83.4	-75	0	0	0	112.6	K298 H300 G304 L305 D306	K298-Y302 WeakPolarHBondContact O-CD2 3.28Å; K298-Y302 PolarHBondContact O-N 3.48Å; H300-Y302 VanDerWaalsContact C-N 3.34Å; Y302-G304 VanDerWaalsContact C-N 3.31Å; Y302-G304 PolarHBondContact O-N 3.31Å; Y302-L305 PolarHBondContact O-N 3.42Å; Y302-D306 PolarHBondContact O-N 3.46Å
303	K	55.2	Low	62.2	Low	135 Å²	135	104.9 Å²	104.9	59%	0.587	54%	0.541	S	S	*	.	H	α-helix	trans	-64.1	-33.6	173.7	-83.6	-170.5	172.4	-169.3	0	113.5	K299 H300 L305 V307	K299-K303 PolarHBondContact O-N 3.21Å; K299-K303 VanDerWaalsContact O-N 3.11Å; H300-K303 PolarHBondContact O-N 3.2Å; K303-L305 VanDerWaalsContact C-N 3.35Å; K303-V307 VanDerWaalsContact O-CG2 3.26Å; K303-V307 WeakPolarHBondContact O-CG2 3.38Å; K303-V307 PolarHBondContact O-N 2.9Å
304	G	55.5	Low	61.1	Low	35 Å²	35	104.8 Å²	104.8	36%	0.361	54%	0.542	S	S	.	.	H	α-helix	trans	-68	-36.2	175.3	0	0	0	0	0	112.5	H300 A301 Y302 L308	H300-G304 PolarHBondContact O-N 3.24Å; A301-G304 PolarHBondContact O-N 2.93Å; Y302-G304 VanDerWaalsContact C-N 3.31Å; Y302-G304 PolarHBondContact O-N 3.31Å; G304-L308 WeakPolarHBondContact O-CB 3.37Å; G304-L308 PolarHBondContact O-N 2.85Å; G304-L308 VanDerWaalsContact O-N 3.07Å
305	L	54.3	Low	60.1	Low	107 Å²	107	103.6 Å²	103.6	56%	0.56	54%	0.54	S	S	*	.	H	α-helix	trans	-67.2	-45.6	174.8	-93.2	145.2	0	0	0	112.2	A301 Y302 K303 V307 L308 E309	A301-L305 PolarHBondContact O-N 2.81Å; A301-L305 VanDerWaalsContact O-N 3.09Å; Y302-L305 PolarHBondContact O-N 3.42Å; K303-L305 VanDerWaalsContact C-N 3.35Å; L305-V307 VanDerWaalsContact C-N 3.29Å; L305-V307 PolarHBondContact O-N 2.79Å; L305-L308 PolarHBondContact O-N 2.85Å; L305-E309 WeakPolarHBondContact O-CB 3.36Å; L305-E309 PolarHBondContact O-N 3.49Å
306	D	54.6	Low	59.2	Low	104 Å²	104	102.5 Å²	102.5	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-61.6	-37	177.6	-72.8	-21.8	0	0	0	112.3	Y302 S310	Y302-D306 PolarHBondContact O-N 3.46Å; D306-S310 PolarHBondContact O-N 2.92Å; D306-S310 VanDerWaalsContact O-N 3.1Å
307	V	56.5	Low	58.5	Low	82 Å²	82	104.8 Å²	104.8	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-71.9	-41.8	178.5	174	0	0	0	0	110.9	K303 L305 E309 S310 I311	K303-V307 VanDerWaalsContact O-CG2 3.26Å; K303-V307 WeakPolarHBondContact O-CG2 3.38Å; K303-V307 PolarHBondContact O-N 2.9Å; L305-V307 VanDerWaalsContact C-N 3.29Å; L305-V307 PolarHBondContact O-N 2.79Å; V307-E309 VanDerWaalsContact C-N 3.35Å; V307-E309 PolarHBondContact O-N 2.8Å; V307-S310 PolarHBondContact O-N 2.84Å; V307-S310 PolarHBondContact O-OG 3.43Å; V307-I311 HydrophobicContact CG1-CD1 3.8Å; V307-I311 VanDerWaalsContact O-CG1 3.31Å; V307-I311 WeakPolarHBondContact O-CG1 3.38Å; V307-I311 PolarHBondContact O-N 3.38Å
308	L	55.2	Low	57.8	Low	115 Å²	115	107 Å²	107	60%	0.602	56%	0.563	S	S	*	*	H	α-helix	trans	-62.8	-41.1	175.7	-98.3	151.6	0	0	0	111.9	G304 L305 S310 I311 T312	G304-L308 WeakPolarHBondContact O-CB 3.37Å; G304-L308 PolarHBondContact O-N 2.85Å; G304-L308 VanDerWaalsContact O-N 3.07Å; L305-L308 PolarHBondContact O-N 2.85Å; L308-S310 VanDerWaalsContact C-N 3.35Å; L308-I311 PolarHBondContact O-N 2.85Å; L308-T312 PolarHBondContact O-N 3.32Å; L308-T312 PolarHBondContact O-OG1 3.18Å
309	E	56.4	Low	57.3	Low	135 Å²	135	108.7 Å²	108.7	63%	0.631	57%	0.571	S	S	*	*	H	α-helix	trans	-67.2	-34.7	177.8	-158.6	169.2	-161.8	0	0	112.2	L305 V307 T312 S313	L305-E309 WeakPolarHBondContact O-CB 3.36Å; L305-E309 PolarHBondContact O-N 3.49Å; V307-E309 VanDerWaalsContact C-N 3.35Å; V307-E309 PolarHBondContact O-N 2.8Å; E309-T312 WeakPolarHBondContact CA-OG1 3.47Å; E309-T312 PolarHBondContact O-OG1 3.19Å; E309-S313 VanDerWaalsContact O-CB 3.3Å; E309-S313 WeakPolarHBondContact O-CB 3.39Å; E309-S313 PolarHBondContact O-N 2.73Å
310	S	57	Low	56.9	Low	57 Å²	57	104.4 Å²	104.4	40%	0.399	57%	0.571	S	S	.	*	H	α-helix	trans	-68.9	-35.2	172.8	79.7	0	0	0	0	113.5	D306 V307 L308 Q314	D306-S310 PolarHBondContact O-N 2.92Å; D306-S310 VanDerWaalsContact O-N 3.1Å; V307-S310 PolarHBondContact O-N 2.84Å; V307-S310 PolarHBondContact O-OG 3.43Å; L308-S310 VanDerWaalsContact C-N 3.35Å; S310-Q314 PolarHBondContact O-N 3.17Å
311	I	59.8	Low	56.4	Low	77 Å²	77	106.3 Å²	106.3	40%	0.395	58%	0.577	S	S	.	*	H	α-helix	trans	-76.9	-39.2	-178.5	-69.4	168.4	0	0	0	110.8	V307 L308 S313 Q314 M315	V307-I311 HydrophobicContact CG1-CD1 3.8Å; V307-I311 VanDerWaalsContact O-CG1 3.31Å; V307-I311 WeakPolarHBondContact O-CG1 3.38Å; V307-I311 PolarHBondContact O-N 3.38Å; L308-I311 PolarHBondContact O-N 2.85Å; I311-S313 VanDerWaalsContact C-N 3.34Å; I311-Q314 PolarHBondContact O-N 3.04Å; I311-M315 HydrophobicContact CG2-CE 4.27Å; I311-M315 PolarHBondContact O-N 2.87Å
312	T	58.3	Low	55.8	Low	88 Å²	88	112.7 Å²	112.7	54%	0.54	60%	0.597	S	S	.	*	H	α-helix	trans	-65.9	-37.3	173.7	35.3	0	0	0	0	112.1	L308 E309 M315 S316	L308-T312 PolarHBondContact O-N 3.32Å; L308-T312 PolarHBondContact O-OG1 3.18Å; E309-T312 WeakPolarHBondContact CA-OG1 3.47Å; E309-T312 PolarHBondContact O-OG1 3.19Å; T312-M315 PolarHBondContact O-N 3.26Å; T312-S316 WeakPolarHBondContact O-CB 3.48Å; T312-S316 PolarHBondContact O-N 2.86Å; T312-S316 PolarHBondContact O-OG 3.21Å
313	S	56.6	Low	54.9	Low	71 Å²	71	118.5 Å²	118.5	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-62.8	-40.9	172.4	152.5	0	0	0	0	113	E309 I311 S316 T317	E309-S313 VanDerWaalsContact O-CB 3.3Å; E309-S313 WeakPolarHBondContact O-CB 3.39Å; E309-S313 PolarHBondContact O-N 2.73Å; I311-S313 VanDerWaalsContact C-N 3.34Å; S313-S316 PolarHBondContact O-OG 3.12Å; S313-S316 VanDerWaalsContact O-OG 3.05Å; S313-T317 PolarHBondContact O-N 3.19Å; S313-T317 PolarHBondContact O-OG1 2.96Å
314	Q	57.9	Low	54.9	Low	127 Å²	127	117.7 Å²	117.7	59%	0.593	63%	0.627	S	S	*	*	H	α-helix	trans	-72.1	-36	175.8	-82.9	-173.3	-24.4	0	0	113.2	S310 I311 T317 M318	S310-Q314 PolarHBondContact O-N 3.17Å; I311-Q314 PolarHBondContact O-N 3.04Å; Q314-T317 WeakPolarHBondContact CA-OG1 3.32Å; Q314-T317 PolarHBondContact O-OG1 2.94Å; Q314-T317 VanDerWaalsContact O-OG1 3.07Å; Q314-M318 PolarHBondContact O-N 2.96Å
315	M	57	Low	54.8	Low	116 Å²	116	122 Å²	122	57%	0.571	64%	0.641	S	S	*	*	H	α-helix	trans	-71	-36.7	176.1	-79.2	-168.5	-177.6	0	0	112.4	I311 T312 T317 M318 F319	I311-M315 HydrophobicContact CG2-CE 4.27Å; I311-M315 PolarHBondContact O-N 2.87Å; T312-M315 PolarHBondContact O-N 3.26Å; M315-T317 PolarHBondContact O-N 3.21Å; M315-M318 PolarHBondContact O-N 2.86Å; M315-F319 PolarHBondContact O-N 3.33Å; M315-F319 VanDerWaalsContact O-N 3.13Å
316	S	56.2	Low	54.8	Low	87 Å²	87	122.8 Å²	122.8	61%	0.608	65%	0.645	S	S	*	*	H	α-helix	trans	-67.3	-27.1	177.8	69.2	0	0	0	0	112.8	T312 S313	T312-S316 WeakPolarHBondContact O-CB 3.48Å; T312-S316 PolarHBondContact O-N 2.86Å; T312-S316 PolarHBondContact O-OG 3.21Å; S313-S316 PolarHBondContact O-OG 3.12Å; S313-S316 VanDerWaalsContact O-OG 3.05Å
317	T	58	Low	54.9	Low	101 Å²	101	123.9 Å²	123.9	62%	0.62	65%	0.651	S	S	*	*	H	α-helix	trans	-82.5	-29.2	175.9	33	0	0	0	0	113.3	S313 Q314 M315	S313-T317 PolarHBondContact O-N 3.19Å; S313-T317 PolarHBondContact O-OG1 2.96Å; Q314-T317 WeakPolarHBondContact CA-OG1 3.32Å; Q314-T317 PolarHBondContact O-OG1 2.94Å; Q314-T317 VanDerWaalsContact O-OG1 3.07Å; M315-T317 PolarHBondContact O-N 3.21Å
318	M	56.6	Low	54.8	Low	153 Å²	153	126.6 Å²	126.6	75%	0.754	66%	0.66	S	S	*	*	H	α-helix	trans	-78.5	-35.8	176	-81	-168.4	-168.1	0	0	114	Q314 M315	Q314-M318 PolarHBondContact O-N 2.96Å; M315-M318 PolarHBondContact O-N 2.86Å
319	F	59.7	Low	54.7	Low	174 Å²	174	127.3 Å²	127.3	76%	0.763	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-0.6	-176.3	-78.2	-80.9	0	0	0	114.8	M315	M315-F319 PolarHBondContact O-N 3.33Å; M315-F319 VanDerWaalsContact O-N 3.13Å
320	G	53.3	Low	54.6	Low	65 Å²	65	126.8 Å²	126.8	67%	0.67	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	5.4	179	0	0	0	0	0	116.3
321	K	50.8	Low	54.4	Low	184 Å²	184	132.2 Å²	132.2	80%	0.8	69%	0.687	S	S	*	*	S	Bend	trans	-119.5	15.2	-171	-92.8	-170.5	179.1	-178	0	117.3
322	H	45.4	Very low	54	Low	192 Å²	192	136.8 Å²	136.8	89%	0.889	71%	0.711	S	S	*	*			trans	-138	90.6	167.6	-89.1	-72	0	0	0	111.3
323	K	38	Very low	53.6	Low	283 Å²	283	141.2 Å²	141.2	100%	1.23	73%	0.727	S	S	*	*			trans	-132.4	0	144.2	-122.2	-171.1	-175.1	-176	0	107.9

Retrieved 323 of 323 residues in 280.3 ms (Link to these results)

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