A0A087X5S2_POEFO Loading...

Probable RNA-binding protein 46

AlphaFold DB , UniProt , Accession A0A087X5S2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 547 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	V	37	Very low	46.1	Very low	172 Å²	172	130.1 Å²	130.1	100%	1.042	67%	0.674	S	S	*	*				0	87.7	0	176.1	0	0	0	0	106
2	D	35	Very low	47.1	Very low	159 Å²	159	125.9 Å²	125.9	85%	0.85	66%	0.658	S	S	*	*			trans	-118.8	105.2	-147.6	-50	-69.6	0	0	0	108.8
3	L	37.3	Very low	47.8	Very low	142 Å²	142	121.9 Å²	121.9	74%	0.743	65%	0.647	S	S	*	*			trans	-73.1	140.9	-179.4	-73.5	165.2	0	0	0	109.8	A5	L3-A5 PolarHBondContact O-N 3.42Å
4	P	45.3	Very low	48.6	Very low	82 Å²	82	116.9 Å²	116.9	53%	0.532	63%	0.626	S	S	.	*			trans	-72.8	126.6	-177.3	28.9	-34.2	0	0	0	111.1	N6 R7	P4-N6 PolarHBondContact O-N 2.9Å; P4-R7 PolarHBondContact O-N 2.72Å
5	A	47.8	Very low	49.5	Very low	75 Å²	75	113 Å²	113	62%	0.62	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.7	-30.8	178.1	0	0	0	0	0	113.7	L3 R7 D8 D9	L3-A5 PolarHBondContact O-N 3.42Å; A5-R7 PolarHBondContact O-N 3.46Å; A5-D8 PolarHBondContact O-N 2.68Å; A5-D9 PolarHBondContact O-N 3.03Å
6	N	49.2	Very low	50.4	Low	123 Å²	123	110.6 Å²	110.6	66%	0.658	60%	0.598	S	S	*	*	H	α-helix	trans	-52.1	-20.7	175.8	-160.7	13.1	0	0	0	114.4	P4 F10	P4-N6 PolarHBondContact O-N 2.9Å; N6-F10 WeakPolarHBondContact O-CB 3.46Å; N6-F10 PolarHBondContact O-N 3.44Å
7	R	45.6	Very low	51.3	Low	164 Å²	164	111.2 Å²	111.2	62%	0.619	60%	0.596	S	S	*	*	H	α-helix	trans	-71.4	-35.3	173.1	-90.7	-172.1	167.5	-173.7	-3.1	113.7	P4 A5 R11	P4-R7 PolarHBondContact O-N 2.72Å; A5-R7 PolarHBondContact O-N 3.46Å; R7-R11 WeakPolarHBondContact O-CD 3.26Å; R7-R11 VanDerWaalsContact O-CG 3.3Å; R7-R11 WeakPolarHBondContact O-CG 3.44Å; R7-R11 PolarHBondContact O-N 2.73Å
8	D	53.2	Low	52.3	Low	88 Å²	88	112.1 Å²	112.1	47%	0.471	60%	0.598	S	S	.	*	H	α-helix	trans	-89.6	-30.9	-175.4	-65.2	-42.3	0	0	0	111.5	A5 F10 R11 V12	A5-D8 PolarHBondContact O-N 2.68Å; D8-F10 VanDerWaalsContact C-N 3.35Å; D8-F10 PolarHBondContact O-N 3.3Å; D8-R11 WeakPolarHBondContact O-CB 3.44Å; D8-R11 PolarHBondContact O-N 3.23Å; D8-R11 VanDerWaalsContact OD1-CD 3.28Å; D8-R11 WeakPolarHBondContact OD1-CD 3.26Å; D8-R11 IonicContact OD1-CZ 3.95Å; D8-R11 IonicContact OD1-NE 3.55Å; D8-R11 IonicContact OD1-NH1 2.69Å; D8-R11 PolarHBondContact OD1-NH1 3.19Å; D8-V12 WeakPolarHBondContact O-CG2 3.35Å; D8-V12 PolarHBondContact O-N 3.02Å
9	D	52.9	Low	53.2	Low	111 Å²	111	108.6 Å²	108.6	59%	0.594	59%	0.586	S	S	*	*	H	α-helix	trans	-58.9	-44.5	166.7	-69.3	-43	0	0	0	111.8	A5 R11 V12 S13	A5-D9 PolarHBondContact O-N 3.03Å; D9-R11 VanDerWaalsContact C-N 3.34Å; D9-R11 PolarHBondContact O-N 3.48Å; D9-V12 PolarHBondContact O-N 3.2Å; D9-S13 PolarHBondContact O-N 3.49Å
10	F	50.5	Low	54	Low	152 Å²	152	104.3 Å²	104.3	67%	0.667	56%	0.563	S	S	*	*	H	α-helix	trans	-62.9	-39.6	176.1	-171.2	-92.5	0	0	0	112.2	N6 D8 S13 C14	N6-F10 WeakPolarHBondContact O-CB 3.46Å; N6-F10 PolarHBondContact O-N 3.44Å; D8-F10 VanDerWaalsContact C-N 3.35Å; D8-F10 PolarHBondContact O-N 3.3Å; F10-S13 PolarHBondContact O-N 3.22Å; F10-C14 WeakPolarHBondContact O-CB 3.36Å; F10-C14 PolarHBondContact O-N 3.04Å
11	R	52.9	Low	54.7	Low	163 Å²	163	104.2 Å²	104.2	62%	0.615	56%	0.562	S	S	*	*	H	α-helix	trans	-65.3	-42.3	174.4	-76.5	163.2	160.6	178.7	-9.9	112.3	R7 D8 D9 C14 A15	R7-R11 WeakPolarHBondContact O-CD 3.26Å; R7-R11 VanDerWaalsContact O-CG 3.3Å; R7-R11 WeakPolarHBondContact O-CG 3.44Å; R7-R11 PolarHBondContact O-N 2.73Å; D8-R11 WeakPolarHBondContact O-CB 3.44Å; D8-R11 PolarHBondContact O-N 3.23Å; D8-R11 VanDerWaalsContact OD1-CD 3.28Å; D8-R11 WeakPolarHBondContact OD1-CD 3.26Å; D8-R11 IonicContact OD1-CZ 3.95Å; D8-R11 IonicContact OD1-NE 3.55Å; D8-R11 IonicContact OD1-NH1 2.69Å; D8-R11 PolarHBondContact OD1-NH1 3.19Å; D9-R11 VanDerWaalsContact C-N 3.34Å; D9-R11 PolarHBondContact O-N 3.48Å; R11-C14 PolarHBondContact O-N 3.37Å; R11-A15 WeakPolarHBondContact O-CB 3.31Å; R11-A15 PolarHBondContact O-N 3.08Å
12	V	58	Low	56.3	Low	80 Å²	80	98.6 Å²	98.6	49%	0.485	53%	0.533	S	S	.	.	H	α-helix	trans	-65.5	-41.3	177.2	169.3	0	0	0	0	110.8	D8 D9 A15 K16	D8-V12 WeakPolarHBondContact O-CG2 3.35Å; D8-V12 PolarHBondContact O-N 3.02Å; D9-V12 PolarHBondContact O-N 3.2Å; V12-A15 PolarHBondContact O-N 3.46Å; V12-K16 HydrophobicContact CG1-CD 4.38Å; V12-K16 WeakPolarHBondContact O-CG 3.1Å; V12-K16 PolarHBondContact O-N 3.08Å
13	S	56.9	Low	58.1	Low	74 Å²	74	91.6 Å²	91.6	52%	0.517	50%	0.496	S	S	.	.	H	α-helix	trans	-61.7	-49.3	174.5	-167.2	0	0	0	0	111.7	D9 F10 A15 K16 E17	D9-S13 PolarHBondContact O-N 3.49Å; F10-S13 PolarHBondContact O-N 3.22Å; S13-A15 PolarHBondContact O-N 2.94Å; S13-K16 PolarHBondContact O-N 3.23Å; S13-E17 PolarHBondContact O-N 3.15Å
14	C	58.1	Low	59.7	Low	51 Å²	51	87.5 Å²	87.5	35%	0.345	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-38.7	179.6	-172.8	0	0	0	0	112.1	F10 R11 E17 M18	F10-C14 WeakPolarHBondContact O-CB 3.36Å; F10-C14 PolarHBondContact O-N 3.04Å; R11-C14 PolarHBondContact O-N 3.37Å; C14-E17 PolarHBondContact O-N 2.95Å; C14-M18 WeakPolarHBondContact O-CG 3.43Å; C14-M18 PolarHBondContact O-N 3.1Å
15	A	62.5	Low	60.9	Low	59 Å²	59	91.7 Å²	91.7	49%	0.488	49%	0.486	S	S	.	.	H	α-helix	trans	-63.9	-39.9	175.5	0	0	0	0	0	112.7	R11 V12 S13 M18 A19	R11-A15 WeakPolarHBondContact O-CB 3.31Å; R11-A15 PolarHBondContact O-N 3.08Å; V12-A15 PolarHBondContact O-N 3.46Å; S13-A15 PolarHBondContact O-N 2.94Å; A15-M18 PolarHBondContact O-N 3.46Å; A15-A19 WeakPolarHBondContact O-CB 3.33Å; A15-A19 PolarHBondContact O-N 2.9Å
16	K	64.4	Low	62	Low	74 Å²	74	95.1 Å²	95.1	32%	0.322	49%	0.487	S	S	.	.	H	α-helix	trans	-65.8	-41.6	174.2	-73.2	-179.3	178.1	-158.8	0	112.1	V12 S13 A19 L20 D66	V12-K16 HydrophobicContact CG1-CD 4.38Å; V12-K16 WeakPolarHBondContact O-CG 3.1Å; V12-K16 PolarHBondContact O-N 3.08Å; S13-K16 PolarHBondContact O-N 3.23Å; K16-A19 PolarHBondContact O-N 3.39Å; K16-L20 WeakPolarHBondContact O-CB 3.36Å; K16-L20 PolarHBondContact O-N 3.41Å; K16-D66 PolarHBondContact NZ-O 2.69Å
17	E	66	Low	62.8	Low	122 Å²	122	90.5 Å²	90.5	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-64.1	-41.2	176.1	-169.5	166.7	-149.8	0	0	111.7	S13 C14 L20 L21	S13-E17 PolarHBondContact O-N 3.15Å; C14-E17 PolarHBondContact O-N 2.95Å; E17-L20 PolarHBondContact O-N 3.39Å; E17-L21 HydrophobicContact CG-CD1 4.49Å; E17-L21 VanDerWaalsContact O-CG 3.3Å; E17-L21 WeakPolarHBondContact O-CG 3.37Å; E17-L21 PolarHBondContact O-N 2.9Å
18	M	68.4	Low	63.6	Low	127 Å²	127	85.2 Å²	85.2	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-67.1	-39.3	172.9	-71.3	-171.2	74.5	0	0	113.3	C14 A15 L20 L21 A22	C14-M18 WeakPolarHBondContact O-CG 3.43Å; C14-M18 PolarHBondContact O-N 3.1Å; A15-M18 PolarHBondContact O-N 3.46Å; M18-L20 VanDerWaalsContact C-N 3.35Å; M18-L21 PolarHBondContact O-N 3.2Å; M18-A22 WeakPolarHBondContact O-CB 3.5Å; M18-A22 PolarHBondContact O-N 3.27Å
19	A	70.6	Confident	64.5	Low	45 Å²	45	82.2 Å²	82.2	37%	0.372	44%	0.442	S	S	.	.	H	α-helix	trans	-64.3	-40.3	176.5	0	0	0	0	0	111.9	A15 K16 A22 L23 D70	A15-A19 WeakPolarHBondContact O-CB 3.33Å; A15-A19 PolarHBondContact O-N 2.9Å; K16-A19 PolarHBondContact O-N 3.39Å; A19-A22 PolarHBondContact O-N 2.99Å; A19-L23 PolarHBondContact O-N 3.46Å; A19-D70 HydrophobicContact CB-CB 4.48Å
20	L	67.6	Low	65.4	Low	23 Å²	23	82.2 Å²	82.2	12%	0.12	44%	0.442	C	S	.	.	H	α-helix	trans	-62.6	-48.1	172.9	170.4	63.1	0	0	0	112.1	K16 E17 M18 A22 L23 M24 M31 E69	K16-L20 WeakPolarHBondContact O-CB 3.36Å; K16-L20 PolarHBondContact O-N 3.41Å; E17-L20 PolarHBondContact O-N 3.39Å; M18-L20 VanDerWaalsContact C-N 3.35Å; L20-A22 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 3.26Å; L20-L23 WeakPolarHBondContact O-CB 3.35Å; L20-L23 PolarHBondContact O-N 3.02Å; L20-M24 HydrophobicContact CD1-CG 4.34Å; L20-M24 HydrophobicContact CD1-SD 4.18Å; L20-M24 HydrophobicContact CG-SD 4.27Å; L20-M24 WeakPolarHBondContact O-CG 3.4Å; L20-M24 PolarHBondContact O-N 2.93Å; L20-M31 HydrophobicContact CD1-CE 3.64Å; L20-M31 HydrophobicContact CD1-SD 3.8Å; L20-M31 HydrophobicContact CD2-CE 3.58Å; L20-M31 HydrophobicContact CG-CE 4.19Å; L20-E69 HydrophobicContact CD1-CG 3.99Å
21	L	69.9	Low	66.6	Low	103 Å²	103	76.6 Å²	76.6	54%	0.539	42%	0.418	S	S	.	.	H	α-helix	trans	-61.1	-42.7	177.3	-73.4	168.3	0	0	0	111.5	E17 M18 L23 M24 E25	E17-L21 HydrophobicContact CG-CD1 4.49Å; E17-L21 VanDerWaalsContact O-CG 3.3Å; E17-L21 WeakPolarHBondContact O-CG 3.37Å; E17-L21 PolarHBondContact O-N 2.9Å; M18-L21 PolarHBondContact O-N 3.2Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 3.42Å; L21-M24 PolarHBondContact O-N 2.97Å; L21-E25 WeakPolarHBondContact O-CB 2.99Å; L21-E25 PolarHBondContact O-N 3.28Å
22	A	71.2	Confident	67.8	Low	53 Å²	53	71.6 Å²	71.6	44%	0.438	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-33.5	175.2	0	0	0	0	0	112.8	M18 A19 L20 K26	M18-A22 WeakPolarHBondContact O-CB 3.5Å; M18-A22 PolarHBondContact O-N 3.27Å; A19-A22 PolarHBondContact O-N 2.99Å; L20-A22 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 3.26Å; A22-K26 WeakPolarHBondContact O-CB 3.47Å; A22-K26 PolarHBondContact O-N 3.48Å
23	L	71.2	Confident	68.9	Low	13 Å²	13	73.4 Å²	73.4	7%	0.068	41%	0.409	C	S	.	.	H	α-helix	trans	-65.4	-48.3	171.4	-177.7	68.1	0	0	0	110.8	A19 L20 L21 E25 K26 T27 Y40 V73 P74	A19-L23 PolarHBondContact O-N 3.46Å; L20-L23 WeakPolarHBondContact O-CB 3.35Å; L20-L23 PolarHBondContact O-N 3.02Å; L21-L23 VanDerWaalsContact C-N 3.33Å; L21-L23 PolarHBondContact O-N 3.42Å; L23-E25 PolarHBondContact O-N 2.64Å; L23-K26 PolarHBondContact O-N 3.29Å; L23-T27 HydrophobicContact CD1-CG2 3.89Å; L23-T27 WeakPolarHBondContact O-CG2 3.18Å; L23-T27 PolarHBondContact O-N 2.69Å; L23-T27 PolarHBondContact O-OG1 2.78Å; L23-Y40 HydrophobicContact CD2-CD2 4.37Å; L23-Y40 HydrophobicContact CD2-CE2 3.91Å; L23-Y40 HydrophobicContact CG-CE2 4.09Å; L23-V73 HydrophobicContact CD2-CB 4.2Å; L23-V73 HydrophobicContact CD2-CG1 4.45Å; L23-P74 HydrophobicContact CD1-CG 4.35Å
24	M	71.4	Confident	69.8	Low	55 Å²	55	73.8 Å²	73.8	27%	0.271	40%	0.402	S	S	.	.	H	α-helix	trans	-60.6	-43.4	179.3	-69.6	175.4	64.7	0	0	112.2	L20 L21 G28 M31	L20-M24 HydrophobicContact CD1-CG 4.34Å; L20-M24 HydrophobicContact CD1-SD 4.18Å; L20-M24 HydrophobicContact CG-SD 4.27Å; L20-M24 WeakPolarHBondContact O-CG 3.4Å; L20-M24 PolarHBondContact O-N 2.93Å; L21-M24 PolarHBondContact O-N 2.97Å; M24-G28 WeakPolarHBondContact O-CA 3.42Å; M24-G28 PolarHBondContact O-N 3.48Å; M24-M31 HydrophobicContact CE-CB 4.39Å; M24-M31 HydrophobicContact SD-CB 4.19Å
25	E	69.8	Low	70.6	Confident	171 Å²	171	78 Å²	78	80%	0.799	42%	0.421	S	S	*	.	H	α-helix	trans	-65.6	-44.5	175.9	-175.8	175.8	-151.4	0	0	112	L21 L23 T27	L21-E25 WeakPolarHBondContact O-CB 2.99Å; L21-E25 PolarHBondContact O-N 3.28Å; L23-E25 PolarHBondContact O-N 2.64Å; E25-T27 VanDerWaalsContact C-N 3.34Å; E25-T27 PolarHBondContact O-N 2.78Å
26	K	71	Confident	71.3	Confident	147 Å²	147	75.9 Å²	75.9	64%	0.639	41%	0.406	S	S	*	.	H	α-helix	trans	-62.5	-37.8	179.5	179.7	-165.7	171.3	-148.8	0	112.8	A22 L23	A22-K26 WeakPolarHBondContact O-CB 3.47Å; A22-K26 PolarHBondContact O-N 3.48Å; L23-K26 PolarHBondContact O-N 3.29Å
27	T	66.1	Low	72.2	Confident	26 Å²	26	74.6 Å²	74.6	16%	0.16	40%	0.401	C	S	.	.	H	α-helix	trans	-108.3	-18.4	-168.3	70.1	0	0	0	0	114.2	L23 E25 Y29 Y40	L23-T27 HydrophobicContact CD1-CG2 3.89Å; L23-T27 WeakPolarHBondContact O-CG2 3.18Å; L23-T27 PolarHBondContact O-N 2.69Å; L23-T27 PolarHBondContact O-OG1 2.78Å; E25-T27 VanDerWaalsContact C-N 3.34Å; E25-T27 PolarHBondContact O-N 2.78Å; T27-Y29 VanDerWaalsContact O-CD2 3.27Å; T27-Y29 WeakPolarHBondContact O-CD2 3.17Å; T27-Y29 PolarHBondContact O-N 2.8Å; T27-Y40 VanDerWaalsContact CB-OH 3.23Å; T27-Y40 WeakPolarHBondContact CB-OH 3.09Å; T27-Y40 WeakPolarHBondContact CG2-OH 3.22Å; T27-Y40 PolarHBondContact OG1-OH 3.38Å
28	G	63.4	Low	73.1	Confident	53 Å²	53	71.1 Å²	71.1	55%	0.546	38%	0.382	S	S	.	.			trans	71.4	8.7	179.9	0	0	0	0	0	115.1	M24	M24-G28 WeakPolarHBondContact O-CA 3.42Å; M24-G28 PolarHBondContact O-N 3.48Å
29	Y	71.8	Confident	73.9	Confident	25 Å²	25	65.8 Å²	65.8	10%	0.098	36%	0.356	C	S	.	.			trans	-84.2	133.9	175.7	-69.9	-105.4	0	0	0	110.5	T27 Y40 P44 I82	T27-Y29 VanDerWaalsContact O-CD2 3.27Å; T27-Y29 WeakPolarHBondContact O-CD2 3.17Å; T27-Y29 PolarHBondContact O-N 2.8Å; Y29-Y40 HydrophobicContact CD1-CE1 4.26Å; Y29-Y40 HydrophobicContact CD2-CE1 4.26Å; Y29-Y40 AromaticContact CD2-CZ 3.97Å; Y29-Y40 WeakPolarHBondContact CD2-OH 3.19Å; Y29-Y40 AromaticContact CG-CE1 3.98Å; Y29-Y40 HydrophobicContact CG-CE1 3.98Å; Y29-Y40 AromaticContact CG-CZ 3.89Å; Y29-P44 HydrophobicContact CE1-CB 3.93Å; Y29-P44 HydrophobicContact CE1-CG 4.09Å; Y29-I82 PolarHBondContact OH-O 2.7Å
30	N	71	Confident	74.5	Confident	110 Å²	110	63.9 Å²	63.9	59%	0.588	34%	0.339	S	S	*	.			trans	-69	150.5	171	-168.2	6.6	0	0	0	110.6	G41	N30-G41 PolarHBondContact O-N 2.84Å
31	M	75.8	Confident	74.9	Confident	34 Å²	34	63.8 Å²	63.8	17%	0.167	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.8	170	-164.9	-177.4	69.1	0	0	111.4	L20 M24 K39 E69	L20-M31 HydrophobicContact CD1-CE 3.64Å; L20-M31 HydrophobicContact CD1-SD 3.8Å; L20-M31 HydrophobicContact CD2-CE 3.58Å; L20-M31 HydrophobicContact CG-CE 4.19Å; M24-M31 HydrophobicContact CE-CB 4.39Å; M24-M31 HydrophobicContact SD-CB 4.19Å; M31-K39 CarbonylContact C-O 3.47Å; M31-K39 VanDerWaalsContact CA-O 3.26Å; M31-K39 WeakPolarHBondContact CA-O 3.34Å; M31-K39 VanDerWaalsContact CG-O 3.24Å; M31-K39 WeakPolarHBondContact CG-O 3.03Å; M31-E69 HydrophobicContact SD-CG 3.69Å
32	V	79.9	Confident	75	Confident	59 Å²	59	59.5 Å²	59.5	36%	0.358	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.6	-174.4	-170.2	0	0	0	0	110.1	E34 K39	V32-E34 HydrophobicContact CG1-CG 4.05Å; V32-K39 PolarHBondContact N-O 2.91Å; V32-K39 PolarHBondContact O-N 2.94Å
33	Q	79.1	Confident	75.1	Confident	118 Å²	118	61 Å²	61	55%	0.551	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	105.9	175.5	-173.6	164.6	-33.4	0	0	111.2	Q37 R38	Q33-Q37 CarbonylContact C-O 3.55Å; Q33-Q37 VanDerWaalsContact CA-O 3.3Å; Q33-Q37 WeakPolarHBondContact CA-O 3.39Å; Q33-R38 HydrophobicContact CB-CG 4.45Å; Q33-R38 HydrophobicContact CG-CG 4.18Å
34	E	77.8	Confident	75.1	Confident	82 Å²	82	60.5 Å²	60.5	38%	0.383	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129	-178.3	-77.6	175.9	-173.4	0	0	110.8	V32 G36 Q37 K39	V32-E34 HydrophobicContact CG1-CG 4.05Å; E34-G36 PolarHBondContact O-N 2.9Å; E34-Q37 PolarHBondContact N-O 2.8Å; E34-Q37 WeakPolarHBondContact O-CB 3.31Å; E34-Q37 PolarHBondContact O-N 3.39Å; E34-K39 IonicContact OE2-NZ 2.61Å; E34-K39 PolarHBondContact OE2-NZ 3.4Å
35	N	73.9	Confident	74.9	Confident	138 Å²	138	61.3 Å²	61.3	74%	0.738	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	32	164.8	-62.3	-36.5	0	0	0	116
36	G	76.8	Confident	74.8	Confident	16 Å²	16	57.1 Å²	57.1	17%	0.165	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	22.4	-175.8	0	0	0	0	0	114.9	E34 M89	E34-G36 PolarHBondContact O-N 2.9Å; G36-M89 PolarHBondContact O-N 3.16Å
37	Q	82.6	Confident	75	Confident	47 Å²	47	54.1 Å²	54.1	22%	0.22	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.8	171.4	-48.9	-172.1	-30.1	0	0	108.8	Q33 E34 K39 L87 M88	Q33-Q37 CarbonylContact C-O 3.55Å; Q33-Q37 VanDerWaalsContact CA-O 3.3Å; Q33-Q37 WeakPolarHBondContact CA-O 3.39Å; E34-Q37 PolarHBondContact N-O 2.8Å; E34-Q37 WeakPolarHBondContact O-CB 3.31Å; E34-Q37 PolarHBondContact O-N 3.39Å; Q37-K39 HydrophobicContact CB-CG 4.35Å; Q37-L87 WeakPolarHBondContact CA-O 3.28Å; Q37-M88 HydrophobicContact CB-SD 4.44Å; Q37-M88 HydrophobicContact CG-CE 3.98Å; Q37-M88 HydrophobicContact CG-SD 3.73Å
38	R	85.8	Confident	75.2	Confident	48 Å²	48	62.4 Å²	62.4	18%	0.181	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	118.9	161.8	-75.1	165.4	85.7	92	-16	107.1	Q33 E69 R86 L87 M89	Q33-R38 HydrophobicContact CB-CG 4.45Å; Q33-R38 HydrophobicContact CG-CG 4.18Å; R38-E69 IonicContact CZ-OE1 3.28Å; R38-E69 VanDerWaalsContact CZ-OE1 3.26Å; R38-E69 IonicContact NE-OE1 3.67Å; R38-E69 PolarHBondContact NE-OE1 3.16Å; R38-E69 IonicContact NE-OE2 3.28Å; R38-E69 PolarHBondContact NE-OE2 3.34Å; R38-E69 VanDerWaalsContact NE-OE2 3.08Å; R38-E69 IonicContact NH2-OE1 2.66Å; R38-E69 PolarHBondContact NH2-OE1 3.45Å; R38-R86 WeakPolarHBondContact O-CA 3.43Å; R38-L87 HydrophobicContact CB-CB 4.37Å; R38-L87 PolarHBondContact N-O 2.82Å; R38-L87 PolarHBondContact O-N 2.6Å; R38-M89 HydrophobicContact CB-CG 4.3Å; R38-M89 HydrophobicContact CG-CG 3.76Å; R38-M89 HydrophobicContact CG-SD 4.35Å
39	K	86.3	Confident	75.5	Confident	16 Å²	16	61.7 Å²	61.7	7%	0.07	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.2	-179.6	-59.5	179	-176.2	173.9	0	108.7	M31 V32 E34 Q37 F85 R86	M31-K39 CarbonylContact C-O 3.47Å; M31-K39 VanDerWaalsContact CA-O 3.26Å; M31-K39 WeakPolarHBondContact CA-O 3.34Å; M31-K39 VanDerWaalsContact CG-O 3.24Å; M31-K39 WeakPolarHBondContact CG-O 3.03Å; V32-K39 PolarHBondContact N-O 2.91Å; V32-K39 PolarHBondContact O-N 2.94Å; E34-K39 IonicContact OE2-NZ 2.61Å; E34-K39 PolarHBondContact OE2-NZ 3.4Å; Q37-K39 HydrophobicContact CB-CG 4.35Å; K39-F85 CarbonylContact C-O 3.58Å; K39-F85 WeakPolarHBondContact CA-O 3.31Å; K39-R86 HydrophobicContact CG-CG 4.32Å
40	Y	82.4	Confident	75.8	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.016	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.3	169.4	168.6	-83.9	0	0	0	107.8	L23 T27 Y29 V73 F85	L23-Y40 HydrophobicContact CD2-CD2 4.37Å; L23-Y40 HydrophobicContact CD2-CE2 3.91Å; L23-Y40 HydrophobicContact CG-CE2 4.09Å; T27-Y40 VanDerWaalsContact CB-OH 3.23Å; T27-Y40 WeakPolarHBondContact CB-OH 3.09Å; T27-Y40 WeakPolarHBondContact CG2-OH 3.22Å; T27-Y40 PolarHBondContact OG1-OH 3.38Å; Y29-Y40 HydrophobicContact CD1-CE1 4.26Å; Y29-Y40 HydrophobicContact CD2-CE1 4.26Å; Y29-Y40 AromaticContact CD2-CZ 3.97Å; Y29-Y40 WeakPolarHBondContact CD2-OH 3.19Å; Y29-Y40 AromaticContact CG-CE1 3.98Å; Y29-Y40 HydrophobicContact CG-CE1 3.98Å; Y29-Y40 AromaticContact CG-CZ 3.89Å; Y40-V73 HydrophobicContact CD1-CG1 4.24Å; Y40-V73 HydrophobicContact CD1-CG2 3.85Å; Y40-V73 HydrophobicContact CE1-CG1 3.62Å; Y40-V73 HydrophobicContact CE1-CG2 4.09Å; Y40-V73 HydrophobicContact CG-CG2 4.08Å; Y40-F85 HydrophobicContact CD1-CB 4.13Å; Y40-F85 PolarHBondContact N-O 2.9Å; Y40-F85 PolarHBondContact O-N 3.36Å
41	G	76.4	Confident	76.1	Confident	22 Å²	22	63.8 Å²	63.8	23%	0.227	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87.6	-144.5	178.9	0	0	0	0	0	116.2	N30	N30-G41 PolarHBondContact O-N 2.84Å
42	G	72.1	Confident	76.3	Confident	12 Å²	12	62.9 Å²	62.9	12%	0.124	38%	0.378	C	S	.	.	S	Bend	trans	143.3	-128.9	-157.3	0	0	0	0	0	108.6	P44 Y83	G42-P44 WeakPolarHBondContact O-CD 3.44Å; G42-Y83 PolarHBondContact N-O 3.39Å; G42-Y83 VanDerWaalsContact N-O 3.11Å; G42-Y83 CarbonylContact O-C 3.55Å; G42-Y83 VanDerWaalsContact O-C 3.29Å; G42-Y83 VanDerWaalsContact O-CD1 3.26Å; G42-Y83 WeakPolarHBondContact O-CD1 3.47Å; G42-Y83 VanDerWaalsContact O-CE1 3.29Å; G42-Y83 WeakPolarHBondContact O-CE1 3.42Å
43	P	71.6	Confident	76.1	Confident	85 Å²	85	64.1 Å²	64.1	55%	0.552	39%	0.387	S	S	*	.	S	Bend	trans	-65	130.5	157.8	-8.3	24.9	0	0	0	108.8	W47	P43-W47 HydrophobicContact CB-CB 4.04Å; P43-W47 HydrophobicContact CB-CG 4.44Å
44	P	72.6	Confident	76	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.013	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-56.2	153.6	166.3	-27.3	34.8	0	0	0	112	Y29 G42 G46 W47 K81 Y83 T104	Y29-P44 HydrophobicContact CE1-CB 3.93Å; Y29-P44 HydrophobicContact CE1-CG 4.09Å; G42-P44 WeakPolarHBondContact O-CD 3.44Å; P44-G46 PolarHBondContact O-N 2.97Å; P44-G46 VanDerWaalsContact O-N 3.13Å; P44-W47 HydrophobicContact CB-CB 4.31Å; P44-W47 HydrophobicContact CG-CB 4.46Å; P44-W47 WeakPolarHBondContact O-CB 3.26Å; P44-W47 PolarHBondContact O-N 3.47Å; P44-K81 VanDerWaalsContact CB-CE 3.43Å; P44-Y83 VanDerWaalsContact CD-CD2 3.43Å; P44-Y83 HydrophobicContact CG-CD2 4.2Å; P44-T104 HydrophobicContact CG-CG2 4.4Å
45	P	67.6	Low	75.9	Confident	73 Å²	73	60.7 Å²	60.7	47%	0.474	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	122.9	173.1	-28.2	36.1	0	0	0	111.5
46	G	67.9	Low	76.5	Confident	83 Å²	83	54.2 Å²	54.2	86%	0.856	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	16.8	-175.4	0	0	0	0	0	116.3	P44	P44-G46 PolarHBondContact O-N 2.97Å; P44-G46 VanDerWaalsContact O-N 3.13Å
47	W	74.9	Confident	77.1	Confident	83 Å²	83	53.8 Å²	53.8	31%	0.314	33%	0.333	S	S	.	.			trans	-90.5	107.4	176.1	-174.5	-83.5	0	0	0	112.4	P43 P44 G49 P50 Y83 T104	P43-W47 HydrophobicContact CB-CB 4.04Å; P43-W47 HydrophobicContact CB-CG 4.44Å; P44-W47 HydrophobicContact CB-CB 4.31Å; P44-W47 HydrophobicContact CG-CB 4.46Å; P44-W47 WeakPolarHBondContact O-CB 3.26Å; P44-W47 PolarHBondContact O-N 3.47Å; W47-G49 VanDerWaalsContact CD1-O 3.24Å; W47-G49 VanDerWaalsContact NE1-C 3.34Å; W47-G49 PolarHBondContact NE1-O 3.39Å; W47-P50 PolarHBondContact NE1-O 3.37Å; W47-P50 VanDerWaalsContact NE1-O 3.08Å; W47-Y83 AromaticContact CD1-CE2 3.89Å; W47-Y83 HydrophobicContact CD2-CE2 4.39Å; W47-Y83 AromaticContact CE2-CE2 4Å; W47-Y83 HydrophobicContact CG-CE2 4.32Å; W47-Y83 AromaticContact NE1-CE2 3.66Å; W47-T104 HydrophobicContact CE3-CG2 4.32Å; W47-T104 HydrophobicContact CH2-CG2 4.04Å; W47-T104 HydrophobicContact CZ3-CG2 3.73Å
48	E	70.4	Confident	77.5	Confident	201 Å²	201	51.5 Å²	51.5	94%	0.939	32%	0.323	S	S	*	.			trans	-98	2.6	176.1	-59.8	-175.7	155.3	0	0	113.4
49	G	69.5	Low	77.7	Confident	37 Å²	37	52 Å²	52	38%	0.381	33%	0.327	S	S	.	.	S	Bend	trans	-82.6	167.7	-179.4	0	0	0	0	0	114.1	W47	W47-G49 VanDerWaalsContact CD1-O 3.24Å; W47-G49 VanDerWaalsContact NE1-C 3.34Å; W47-G49 PolarHBondContact NE1-O 3.39Å
50	P	76.9	Confident	78	Confident	113 Å²	113	51.3 Å²	51.3	73%	0.734	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-62	167.8	167.3	29.7	-35.8	0	0	0	111.5	W47	W47-P50 PolarHBondContact NE1-O 3.37Å; W47-P50 VanDerWaalsContact NE1-O 3.08Å
51	A	77.4	Confident	78.5	Confident	66 Å²	66	51.4 Å²	51.4	55%	0.545	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-63.4	150.2	172.8	0	0	0	0	0	111.3	Y83	A51-Y83 HydrophobicContact CB-CE1 4.39Å
52	P	80.8	Confident	79.2	Confident	16 Å²	16	55.9 Å²	55.9	10%	0.104	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-58.5	143.9	179.3	-25.3	35	0	0	0	112.6	C56 Y83 M102 Y103	P52-C56 HydrophobicContact CB-CB 3.8Å; P52-Y83 HydrophobicContact CG-CD1 4.03Å; P52-Y83 HydrophobicContact CG-CD2 3.72Å; P52-Y83 HydrophobicContact CG-CE1 4.48Å; P52-Y83 HydrophobicContact CG-CE2 4.21Å; P52-Y83 HydrophobicContact CG-CG 3.64Å; P52-M102 HydrophobicContact CB-CG 4.24Å; P52-M102 HydrophobicContact CB-SD 3.95Å; P52-M102 HydrophobicContact CG-CG 4.02Å; P52-M102 HydrophobicContact CG-SD 4.4Å; P52-Y103 WeakPolarHBondContact CB-O 3.35Å; P52-Y103 VanDerWaalsContact CG-O 3.28Å; P52-Y103 WeakPolarHBondContact CG-O 3.38Å
53	P	75.2	Confident	80.1	Confident	84 Å²	84	55.7 Å²	55.7	55%	0.545	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-69.3	165.4	179.9	29.6	-35.9	0	0	0	112.4	C56	P53-C56 VanDerWaalsContact O-CB 3.31Å; P53-C56 WeakPolarHBondContact O-CB 3.48Å; P53-C56 PolarHBondContact O-N 3.48Å; P53-C56 PolarHBondContact O-SG 2.6Å; P53-C56 VanDerWaalsContact O-SG 3.37Å
54	R	76.1	Confident	81	Confident	102 Å²	102	52.2 Å²	52.2	39%	0.385	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	145	175.2	-62.7	-172.1	-171.6	160.7	3	111.5	E185 Y186	R54-E185 IonicContact CZ-OE1 3.74Å; R54-E185 VanDerWaalsContact CZ-OE1 3.23Å; R54-E185 IonicContact NH1-OE1 2.78Å; R54-E185 PolarHBondContact NH1-OE1 3.36Å; R54-E185 IonicContact NH2-OE1 2.67Å; R54-E185 PolarHBondContact NH2-OE1 2.84Å; R54-Y186 PolarHBondContact NH2-O 3.41Å
55	G	77.4	Confident	81.7	Confident	27 Å²	27	58.7 Å²	58.7	28%	0.278	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-3.2	-172.8	0	0	0	0	0	115.1
56	C	86.5	Confident	82.5	Confident	2 Å²	2	58.3 Å²	58.3	1%	0.014	33%	0.331	C	S	.	.			trans	-85.5	-5.1	169.4	-66.9	0	0	0	0	113.9	P52 P53 M102 Y103 R106	P52-C56 HydrophobicContact CB-CB 3.8Å; P53-C56 VanDerWaalsContact O-CB 3.31Å; P53-C56 WeakPolarHBondContact O-CB 3.48Å; P53-C56 PolarHBondContact O-N 3.48Å; P53-C56 PolarHBondContact O-SG 2.6Å; P53-C56 VanDerWaalsContact O-SG 3.37Å; C56-M102 VanDerWaalsContact C-SD 3.58Å; C56-M102 HydrophobicContact CB-SD 3.64Å; C56-Y103 WeakPolarHBondContact CB-O 3.47Å; C56-Y103 PolarHBondContact O-N 2.65Å; C56-R106 PolarHBondContact SG-N 2.82Å; C56-R106 VanDerWaalsContact SG-N 3.37Å
57	E	88.3	Confident	83.4	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.028	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	135.7	178.5	-163.6	172.1	112.4	0	0	112.5	R86 F100 V101 M102 S132	E57-R86 IonicContact OE1-CZ 3.67Å; E57-R86 IonicContact OE1-NH1 2.68Å; E57-R86 IonicContact OE1-NH2 3.04Å; E57-R86 PolarHBondContact OE1-NH2 2.88Å; E57-R86 IonicContact OE2-CZ 2.65Å; E57-R86 VanDerWaalsContact OE2-CZ 3.22Å; E57-R86 IonicContact OE2-NH1 3.56Å; E57-R86 PolarHBondContact OE2-NH1 3.1Å; E57-R86 IonicContact OE2-NH2 3.14Å; E57-R86 PolarHBondContact OE2-NH2 3.46Å; E57-F100 HydrophobicContact CG-CB 4.25Å; E57-F100 WeakPolarHBondContact OE1-CB 3.35Å; E57-F100 WeakPolarHBondContact OE1-CD1 3.29Å; E57-V101 WeakPolarHBondContact CA-O 3.2Å; E57-M102 HydrophobicContact CB-CE 3.79Å; E57-M102 HydrophobicContact CB-SD 3.89Å; E57-M102 HydrophobicContact CG-CE 4.35Å; E57-S132 VanDerWaalsContact O-CB 3.29Å; E57-S132 WeakPolarHBondContact O-CB 3.32Å; E57-S132 PolarHBondContact O-N 3.38Å; E57-S132 PolarHBondContact OE1-OG 3.45Å
58	V	91	Very high	84	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	139.5	170.9	-55	0	0	0	0	111.1	V60 F100 V101 Y103 A109 I113 V129 C130	V58-V60 HydrophobicContact CG2-CG2 4.27Å; V58-F100 WeakPolarHBondContact O-CA 3.24Å; V58-V101 HydrophobicContact CG2-CB 3.88Å; V58-V101 HydrophobicContact CG2-CG2 4.32Å; V58-V101 PolarHBondContact N-O 3.08Å; V58-V101 PolarHBondContact O-N 2.96Å; V58-Y103 HydrophobicContact CG1-CE2 4.42Å; V58-Y103 HydrophobicContact CG2-CE2 3.94Å; V58-A109 HydrophobicContact CG1-CB 3.69Å; V58-A109 WeakPolarHBondContact CG1-O 3.46Å; V58-I113 HydrophobicContact CG1-CD1 4Å; V58-I113 HydrophobicContact CG1-CG1 3.9Å; V58-V129 HydrophobicContact CB-CG1 4.11Å; V58-V129 HydrophobicContact CG2-CG1 4.08Å; V58-C130 CarbonylContact C-O 3.58Å; V58-C130 WeakPolarHBondContact CA-O 3.49Å; V58-C130 WeakPolarHBondContact CB-O 3.45Å
59	F	91.4	Very high	84.7	Confident	59 Å²	59	42.8 Å²	42.8	26%	0.259	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	131.9	167.2	172.7	-90.5	0	0	0	109.5	Y98 F100 V129 C130	F59-Y98 HydrophobicContact CD2-CD2 4.49Å; F59-Y98 AromaticContact CE2-CD2 3.66Å; F59-Y98 HydrophobicContact CE2-CD2 3.66Å; F59-Y98 HydrophobicContact CE2-CG 4.08Å; F59-Y98 HydrophobicContact CZ-CD2 4.4Å; F59-Y98 HydrophobicContact CZ-CG 4.38Å; F59-F100 HydrophobicContact CD2-CD1 4.32Å; F59-F100 AromaticContact CD2-CE1 3.81Å; F59-F100 HydrophobicContact CD2-CE1 3.81Å; F59-F100 HydrophobicContact CD2-CZ 4.09Å; F59-V129 WeakPolarHBondContact O-CA 3.03Å; F59-C130 PolarHBondContact N-O 2.64Å; F59-C130 PolarHBondContact O-N 3.31Å
60	V	92.5	Very high	85.3	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	118.8	175.8	-176.3	0	0	0	0	108.2	V58 I63 F76 Y98 A99 V101 G128 V129	V58-V60 HydrophobicContact CG2-CG2 4.27Å; V60-I63 HydrophobicContact CB-CD1 4.24Å; V60-I63 HydrophobicContact CG1-CD1 3.77Å; V60-I63 HydrophobicContact CG1-CG1 3.85Å; V60-F76 HydrophobicContact CB-CZ 4.12Å; V60-F76 HydrophobicContact CG1-CE2 4.05Å; V60-F76 HydrophobicContact CG1-CZ 3.57Å; V60-F76 HydrophobicContact CG2-CE1 3.73Å; V60-F76 HydrophobicContact CG2-CE2 3.98Å; V60-F76 HydrophobicContact CG2-CZ 3.38Å; V60-Y98 CarbonylContact O-C 3.47Å; V60-Y98 WeakPolarHBondContact O-CA 3.34Å; V60-Y98 VanDerWaalsContact O-CB 3.31Å; V60-Y98 WeakPolarHBondContact O-CB 3.43Å; V60-A99 HydrophobicContact CB-CB 4.46Å; V60-A99 PolarHBondContact N-O 2.84Å; V60-A99 PolarHBondContact O-N 3.22Å; V60-V101 HydrophobicContact CG2-CG2 3.83Å; V60-G128 WeakPolarHBondContact CA-O 3.2Å; V60-V129 HydrophobicContact CG1-CG2 4.47Å; V60-V129 HydrophobicContact CG2-CG2 4.45Å
61	G	92.1	Very high	85.8	Confident	7 Å²	7	40.7 Å²	40.7	7%	0.072	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	174.4	179.1	0	0	0	0	0	113.2	I63 G97 G128	G61-I63 PolarHBondContact O-N 3.22Å; G61-G97 CarbonylContact C-O 3.55Å; G61-G128 PolarHBondContact N-O 3.1Å; G61-G128 PolarHBondContact O-N 2.98Å
62	K	90.6	Very high	86.4	Confident	116 Å²	116	37.5 Å²	37.5	50%	0.504	18%	0.184	S	C	.	.	S	Bend	trans	62.3	22.3	-174.9	-45.8	169	-171.9	164.1	0	113.7	G97 N118 F126	K62-G97 PolarHBondContact N-O 2.83Å; K62-G97 VanDerWaalsContact N-O 3.08Å; K62-N118 PolarHBondContact NZ-OD1 2.7Å; K62-F126 WeakPolarHBondContact CB-O 3.43Å; K62-F126 VanDerWaalsContact CD-O 3.26Å; K62-F126 WeakPolarHBondContact CD-O 3.3Å
63	I	92.3	Very high	86.8	Confident	8 Å²	8	36.9 Å²	36.9	4%	0.041	18%	0.18	C	C	.	.			trans	-62.8	131.4	178.5	-52.2	-178.2	0	0	0	108.8	V60 G61 M67 L72 L87 G97 A99	V60-I63 HydrophobicContact CB-CD1 4.24Å; V60-I63 HydrophobicContact CG1-CD1 3.77Å; V60-I63 HydrophobicContact CG1-CG1 3.85Å; G61-I63 PolarHBondContact O-N 3.22Å; I63-M67 HydrophobicContact CG2-CB 4.35Å; I63-L72 HydrophobicContact CD1-CD1 4.24Å; I63-L72 HydrophobicContact CG2-CD1 3.84Å; I63-L72 HydrophobicContact CG2-CD2 4.26Å; I63-L87 HydrophobicContact CD1-CD1 4.33Å; I63-G97 PolarHBondContact N-O 3.07Å; I63-G97 WeakPolarHBondContact O-CA 3.4Å; I63-A99 HydrophobicContact CD1-CB 3.58Å
64	P	90	Very high	87.4	Confident	11 Å²	11	35 Å²	35	7%	0.071	17%	0.168	C	C	.	.			trans	-60.7	139.5	170.5	-23.9	35.7	0	0	0	111.7	D66 M67 N95 V121 K125	P64-D66 WeakPolarHBondContact CB-OD1 3.32Å; P64-D66 PolarHBondContact O-N 2.87Å; P64-D66 VanDerWaalsContact O-N 3.09Å; P64-M67 HydrophobicContact CB-CG 4.12Å; P64-M67 HydrophobicContact CB-SD 4.2Å; P64-M67 HydrophobicContact CG-CG 4.27Å; P64-M67 HydrophobicContact CG-SD 3.68Å; P64-M67 PolarHBondContact O-N 3.15Å; P64-N95 PolarHBondContact O-ND2 3.22Å; P64-V121 HydrophobicContact CG-CG2 4Å; P64-K125 HydrophobicContact CG-CB 4Å; P64-K125 HydrophobicContact CG-CG 4.24Å
65	R	87.3	Confident	88.1	Confident	138 Å²	138	31.2 Å²	31.2	52%	0.521	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18.7	-176.3	-69.7	-164.9	179	-167.8	-5.8	114.3	F68 E94 N95	R65-F68 WeakPolarHBondContact O-CZ 3.46Å; R65-E94 WeakPolarHBondContact CD-OE1 3.25Å; R65-E94 WeakPolarHBondContact CD-OE2 3.47Å; R65-E94 IonicContact CZ-OE2 3.84Å; R65-E94 IonicContact NE-OE2 3.76Å; R65-E94 IonicContact NH1-OE2 2.78Å; R65-E94 PolarHBondContact NH1-OE2 3.42Å; R65-N95 WeakPolarHBondContact CA-ND2 3.38Å; R65-N95 PolarHBondContact O-ND2 2.83Å
66	D	84.5	Confident	88.7	Confident	66 Å²	66	29.9 Å²	29.9	35%	0.353	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-9.2	-175.9	51.6	-26	0	0	0	114.6	K16 P64 F68 R122	K16-D66 PolarHBondContact NZ-O 2.69Å; P64-D66 WeakPolarHBondContact CB-OD1 3.32Å; P64-D66 PolarHBondContact O-N 2.87Å; P64-D66 VanDerWaalsContact O-N 3.09Å; D66-F68 WeakPolarHBondContact O-CD2 3.41Å; D66-F68 VanDerWaalsContact O-CE2 3.22Å; D66-F68 WeakPolarHBondContact O-CE2 3.27Å; D66-R122 IonicContact OD2-CZ 2.71Å; D66-R122 VanDerWaalsContact OD2-CZ 3.28Å; D66-R122 IonicContact OD2-NE 2.81Å; D66-R122 IonicContact OD2-NH1 3.23Å; D66-R122 PolarHBondContact OD2-NH1 2.82Å
67	M	85.3	Confident	88.9	Confident	4 Å²	4	34 Å²	34	2%	0.02	16%	0.161	C	C	.	.			trans	-93.8	141.2	174.2	-66.1	-178.5	72.9	0	0	112	I63 P64 E71 L72 N95 V121	I63-M67 HydrophobicContact CG2-CB 4.35Å; P64-M67 HydrophobicContact CB-CG 4.12Å; P64-M67 HydrophobicContact CB-SD 4.2Å; P64-M67 HydrophobicContact CG-CG 4.27Å; P64-M67 HydrophobicContact CG-SD 3.68Å; P64-M67 PolarHBondContact O-N 3.15Å; M67-E71 HydrophobicContact CE-CB 3.76Å; M67-E71 WeakPolarHBondContact CE-OE2 3.14Å; M67-E71 WeakPolarHBondContact CG-OE2 3.4Å; M67-L72 HydrophobicContact CE-CD2 3.81Å; M67-L72 HydrophobicContact CE-CG 4.38Å; M67-N95 PolarHBondContact O-ND2 3.26Å; M67-V121 HydrophobicContact CE-CB 3.91Å; M67-V121 HydrophobicContact CE-CG1 4.35Å; M67-V121 HydrophobicContact CE-CG2 4.25Å; M67-V121 HydrophobicContact SD-CB 3.9Å; M67-V121 HydrophobicContact SD-CG2 3.59Å; M67-V121 VanDerWaalsContact SD-CG2 3.59Å
68	F	88	Confident	88.9	Confident	33 Å²	33	40.2 Å²	40.2	15%	0.145	19%	0.188	C	C	.	.			trans	-131.6	-171.2	179.9	-59.6	-86.2	0	0	0	111	R65 D66 D70 E71 L72 L87 M89 N95	R65-F68 WeakPolarHBondContact O-CZ 3.46Å; D66-F68 WeakPolarHBondContact O-CD2 3.41Å; D66-F68 VanDerWaalsContact O-CE2 3.22Å; D66-F68 WeakPolarHBondContact O-CE2 3.27Å; F68-D70 VanDerWaalsContact C-OD1 3.28Å; F68-D70 WeakPolarHBondContact CB-OD1 3.23Å; F68-D70 PolarHBondContact N-OD1 3.4Å; F68-D70 PolarHBondContact O-N 3.02Å; F68-D70 VanDerWaalsContact O-N 3.14Å; F68-E71 PolarHBondContact O-N 3.42Å; F68-L72 WeakPolarHBondContact O-CB 3.42Å; F68-L72 WeakPolarHBondContact O-CD1 3.23Å; F68-L72 WeakPolarHBondContact O-CG 3.3Å; F68-L72 PolarHBondContact O-N 2.83Å; F68-L87 HydrophobicContact CB-CD2 4.36Å; F68-L87 HydrophobicContact CD1-CD2 4Å; F68-M89 HydrophobicContact CD1-CE 4.43Å; F68-M89 HydrophobicContact CE1-CE 4.02Å; F68-N95 HydrophobicContact CE1-CB 4.33Å
69	E	85.3	Confident	88.8	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.019	19%	0.19	C	C	.	.	H	α-helix	trans	-55.3	-25.6	179.3	57.2	-78.8	164.8	0	0	114.4	L20 M31 R38 V73 F85	L20-E69 HydrophobicContact CD1-CG 3.99Å; M31-E69 HydrophobicContact SD-CG 3.69Å; R38-E69 IonicContact CZ-OE1 3.28Å; R38-E69 VanDerWaalsContact CZ-OE1 3.26Å; R38-E69 IonicContact NE-OE1 3.67Å; R38-E69 PolarHBondContact NE-OE1 3.16Å; R38-E69 IonicContact NE-OE2 3.28Å; R38-E69 PolarHBondContact NE-OE2 3.34Å; R38-E69 VanDerWaalsContact NE-OE2 3.08Å; R38-E69 IonicContact NH2-OE1 2.66Å; R38-E69 PolarHBondContact NH2-OE1 3.45Å; E69-V73 HydrophobicContact CB-CG2 4.11Å; E69-V73 VanDerWaalsContact O-CB 3.23Å; E69-V73 WeakPolarHBondContact O-CB 3.46Å; E69-V73 VanDerWaalsContact O-CG2 3.32Å; E69-V73 WeakPolarHBondContact O-CG2 3.21Å; E69-V73 PolarHBondContact O-N 2.98Å; E69-F85 HydrophobicContact CB-CD1 4.21Å; E69-F85 HydrophobicContact CB-CE1 3.8Å
70	D	83.1	Confident	88.6	Confident	34 Å²	34	38.5 Å²	38.5	18%	0.182	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-45.5	176.3	63.4	-27.9	0	0	0	113.4	A19 F68 P74	A19-D70 HydrophobicContact CB-CB 4.48Å; F68-D70 VanDerWaalsContact C-OD1 3.28Å; F68-D70 WeakPolarHBondContact CB-OD1 3.23Å; F68-D70 PolarHBondContact N-OD1 3.4Å; F68-D70 PolarHBondContact O-N 3.02Å; F68-D70 VanDerWaalsContact O-N 3.14Å; D70-P74 WeakPolarHBondContact O-CD 3.07Å; D70-P74 WeakPolarHBondContact O-CG 3.07Å
71	E	87.4	Confident	88.4	Confident	71 Å²	71	43.5 Å²	43.5	33%	0.332	21%	0.208	S	C	.	.	H	α-helix	trans	-80.5	-34.6	173.8	-68.4	-173.2	-133.2	0	0	111.7	M67 F68 R122	M67-E71 HydrophobicContact CE-CB 3.76Å; M67-E71 WeakPolarHBondContact CE-OE2 3.14Å; M67-E71 WeakPolarHBondContact CG-OE2 3.4Å; F68-E71 PolarHBondContact O-N 3.42Å; E71-R122 IonicContact OE1-NH2 2.69Å; E71-R122 PolarHBondContact OE1-NH2 2.83Å; E71-R122 VanDerWaalsContact OE1-NH2 3.14Å; E71-R122 IonicContact OE2-NH2 2.96Å; E71-R122 PolarHBondContact OE2-NH2 3.05Å
72	L	89.1	Confident	88.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-84.4	-42	-169.1	-65.5	167.3	0	0	0	113.8	I63 M67 F68 L75 F76 F85 L87	I63-L72 HydrophobicContact CD1-CD1 4.24Å; I63-L72 HydrophobicContact CG2-CD1 3.84Å; I63-L72 HydrophobicContact CG2-CD2 4.26Å; M67-L72 HydrophobicContact CE-CD2 3.81Å; M67-L72 HydrophobicContact CE-CG 4.38Å; F68-L72 WeakPolarHBondContact O-CB 3.42Å; F68-L72 WeakPolarHBondContact O-CD1 3.23Å; F68-L72 WeakPolarHBondContact O-CG 3.3Å; F68-L72 PolarHBondContact O-N 2.83Å; L72-L75 WeakPolarHBondContact O-CB 3.47Å; L72-L75 PolarHBondContact O-N 3.32Å; L72-L75 VanDerWaalsContact O-N 3.1Å; L72-F76 HydrophobicContact CD2-CE2 4.32Å; L72-F76 VanDerWaalsContact O-CD2 3.22Å; L72-F76 WeakPolarHBondContact O-CD2 3.5Å; L72-F76 PolarHBondContact O-N 3.23Å; L72-F76 VanDerWaalsContact O-N 3.08Å; L72-F85 HydrophobicContact CB-CE2 4.02Å; L72-F85 HydrophobicContact CB-CZ 3.68Å; L72-F85 HydrophobicContact CD1-CZ 3.95Å; L72-F85 HydrophobicContact CG-CZ 4.47Å; L72-L87 HydrophobicContact CD1-CD1 4.32Å
73	V	88.9	Confident	88.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-60.7	-47.4	-178.6	169.6	0	0	0	0	111.5	L23 Y40 E69 L75 F76 E77 I82 F85	L23-V73 HydrophobicContact CD2-CB 4.2Å; L23-V73 HydrophobicContact CD2-CG1 4.45Å; Y40-V73 HydrophobicContact CD1-CG1 4.24Å; Y40-V73 HydrophobicContact CD1-CG2 3.85Å; Y40-V73 HydrophobicContact CE1-CG1 3.62Å; Y40-V73 HydrophobicContact CE1-CG2 4.09Å; Y40-V73 HydrophobicContact CG-CG2 4.08Å; E69-V73 HydrophobicContact CB-CG2 4.11Å; E69-V73 VanDerWaalsContact O-CB 3.23Å; E69-V73 WeakPolarHBondContact O-CB 3.46Å; E69-V73 VanDerWaalsContact O-CG2 3.32Å; E69-V73 WeakPolarHBondContact O-CG2 3.21Å; E69-V73 PolarHBondContact O-N 2.98Å; V73-L75 PolarHBondContact O-N 3.21Å; V73-F76 PolarHBondContact O-N 2.84Å; V73-E77 WeakPolarHBondContact O-CB 3.43Å; V73-E77 PolarHBondContact O-N 2.93Å; V73-I82 HydrophobicContact CG1-CD1 4.07Å; V73-F85 HydrophobicContact CG2-CB 4.31Å; V73-F85 HydrophobicContact CG2-CD1 3.95Å; V73-F85 HydrophobicContact CG2-CD2 4.2Å; V73-F85 HydrophobicContact CG2-CE1 4.3Å; V73-F85 HydrophobicContact CG2-CG 3.9Å
74	P	89.2	Confident	88.1	Confident	45 Å²	45	40.8 Å²	40.8	29%	0.292	19%	0.194	S	C	.	.	H	α-helix	trans	-67.7	-13.8	176.2	-20.7	35	0	0	0	114.5	L23 D70 K78	L23-P74 HydrophobicContact CD1-CG 4.35Å; D70-P74 WeakPolarHBondContact O-CD 3.07Å; D70-P74 WeakPolarHBondContact O-CG 3.07Å; P74-K78 WeakPolarHBondContact O-CE 3.38Å
75	L	89.8	Confident	88	Confident	22 Å²	22	40.3 Å²	40.3	12%	0.115	19%	0.191	C	C	.	.	H	α-helix	trans	-79.7	-45.9	171.2	-177.5	62.4	0	0	0	111	L72 V73 K78 L116 V121 I127	L72-L75 WeakPolarHBondContact O-CB 3.47Å; L72-L75 PolarHBondContact O-N 3.32Å; L72-L75 VanDerWaalsContact O-N 3.1Å; V73-L75 PolarHBondContact O-N 3.21Å; L75-K78 HydrophobicContact CD1-CD 4.48Å; L75-K78 WeakPolarHBondContact O-CB 3.49Å; L75-L116 HydrophobicContact CD1-CD2 3.86Å; L75-L116 HydrophobicContact CG-CD2 4.09Å; L75-V121 HydrophobicContact CD2-CG1 3.72Å; L75-I127 HydrophobicContact CD2-CD1 3.92Å
76	F	90.3	Very high	88.2	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-76.6	-29.6	-179.5	-73.8	-67.1	0	0	0	113.4	V60 L72 V73 K78 A79 I82 F85 V101 Y103 L116 I127 V129	V60-F76 HydrophobicContact CB-CZ 4.12Å; V60-F76 HydrophobicContact CG1-CE2 4.05Å; V60-F76 HydrophobicContact CG1-CZ 3.57Å; V60-F76 HydrophobicContact CG2-CE1 3.73Å; V60-F76 HydrophobicContact CG2-CE2 3.98Å; V60-F76 HydrophobicContact CG2-CZ 3.38Å; L72-F76 HydrophobicContact CD2-CE2 4.32Å; L72-F76 VanDerWaalsContact O-CD2 3.22Å; L72-F76 WeakPolarHBondContact O-CD2 3.5Å; L72-F76 PolarHBondContact O-N 3.23Å; L72-F76 VanDerWaalsContact O-N 3.08Å; V73-F76 PolarHBondContact O-N 2.84Å; F76-K78 PolarHBondContact O-N 2.91Å; F76-K78 VanDerWaalsContact O-N 3.1Å; F76-A79 PolarHBondContact O-N 3.19Å; F76-I82 HydrophobicContact CB-CD1 3.89Å; F76-F85 HydrophobicContact CD2-CE2 4.17Å; F76-V101 HydrophobicContact CB-CG1 4.33Å; F76-V101 HydrophobicContact CD1-CG2 4.41Å; F76-V101 HydrophobicContact CD2-CG2 4.16Å; F76-V101 HydrophobicContact CE2-CG2 4.5Å; F76-V101 HydrophobicContact CG-CG2 4.15Å; F76-Y103 WeakPolarHBondContact CB-OH 3.25Å; F76-Y103 WeakPolarHBondContact CD1-OH 3.43Å; F76-Y103 PolarHBondContact O-OH 2.73Å; F76-L116 HydrophobicContact CD1-CD1 3.34Å; F76-L116 HydrophobicContact CE1-CB 4.31Å; F76-L116 HydrophobicContact CE1-CD1 3.47Å; F76-L116 VanDerWaalsContact CE1-CD1 3.47Å; F76-L116 HydrophobicContact CG-CD1 4.23Å; F76-L116 HydrophobicContact CZ-CD1 4.43Å; F76-I127 HydrophobicContact CZ-CD1 4.01Å; F76-V129 HydrophobicContact CE1-CG2 4.09Å; F76-V129 HydrophobicContact CZ-CG2 4.3Å
77	E	89.9	Confident	88.4	Confident	87 Å²	87	32.1 Å²	32.1	41%	0.407	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-29	173.9	-176.3	172.9	-135	0	0	112.7	V73 A79 G80 I82	V73-E77 WeakPolarHBondContact O-CB 3.43Å; V73-E77 PolarHBondContact O-N 2.93Å; E77-A79 PolarHBondContact O-N 2.86Å; E77-G80 PolarHBondContact O-N 2.82Å; E77-I82 HydrophobicContact CB-CD1 4.47Å
78	K	88.9	Confident	88.6	Confident	138 Å²	138	32.9 Å²	32.9	60%	0.6	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.9	177.2	-64.5	168.1	-176.4	167.3	0	113.9	P74 L75 F76 M115	P74-K78 WeakPolarHBondContact O-CE 3.38Å; L75-K78 HydrophobicContact CD1-CD 4.48Å; L75-K78 WeakPolarHBondContact O-CB 3.49Å; F76-K78 PolarHBondContact O-N 2.91Å; F76-K78 VanDerWaalsContact O-N 3.1Å; K78-M115 HydrophobicContact CB-CE 4.33Å
79	A	88.9	Confident	88.5	Confident	5 Å²	5	31.7 Å²	31.7	4%	0.041	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-26.7	179	0	0	0	0	0	112.9	F76 E77 Y103 R111 A112	F76-A79 PolarHBondContact O-N 3.19Å; E77-A79 PolarHBondContact O-N 2.86Å; A79-Y103 HydrophobicContact CB-CE1 4.3Å; A79-R111 PolarHBondContact O-NE 3.11Å; A79-R111 VanDerWaalsContact O-NE 3.11Å; A79-R111 PolarHBondContact O-NH2 3.36Å; A79-A112 HydrophobicContact CB-CB 3.67Å
80	G	87.9	Confident	88.5	Confident	17 Å²	17	35.6 Å²	35.6	18%	0.175	17%	0.172	C	C	.	.	S	Bend	trans	162.2	177.3	178.4	0	0	0	0	0	113.1	E77 I82 Y103	E77-G80 PolarHBondContact O-N 2.82Å; G80-I82 PolarHBondContact O-N 3.16Å; G80-Y103 WeakPolarHBondContact O-CE1 3.32Å
81	K	88.2	Confident	88.1	Confident	105 Å²	105	43.3 Å²	43.3	46%	0.457	20%	0.204	S	C	.	.			trans	-65.7	119.7	-179.3	-170.1	171.9	-177.7	179.8	0	111	P44 T104	P44-K81 VanDerWaalsContact CB-CE 3.43Å; K81-T104 HydrophobicContact CB-CG2 4.32Å; K81-T104 HydrophobicContact CD-CG2 4.43Å; K81-T104 HydrophobicContact CG-CG2 4.24Å; K81-T104 PolarHBondContact O-N 2.9Å
82	I	90.2	Very high	87.7	Confident	7 Å²	7	43.4 Å²	43.4	4%	0.036	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	138.9	173.8	-62.2	167.4	0	0	0	109	Y29 V73 F76 E77 G80 F85 V101 Y103	Y29-I82 PolarHBondContact OH-O 2.7Å; V73-I82 HydrophobicContact CG1-CD1 4.07Å; F76-I82 HydrophobicContact CB-CD1 3.89Å; E77-I82 HydrophobicContact CB-CD1 4.47Å; G80-I82 PolarHBondContact O-N 3.16Å; I82-F85 HydrophobicContact CG2-CB 4.17Å; I82-V101 HydrophobicContact CD1-CG1 4.28Å; I82-V101 HydrophobicContact CG1-CG1 4.02Å; I82-V101 HydrophobicContact CG2-CG1 4.11Å; I82-Y103 HydrophobicContact CG1-CD1 4.43Å; I82-Y103 HydrophobicContact CG1-CE1 4.05Å
83	Y	88.8	Confident	87.1	Confident	29 Å²	29	45.6 Å²	45.6	11%	0.114	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-66.6	169.9	-176	-91.9	0	0	0	109.1	G42 P44 W47 A51 P52 M102	G42-Y83 PolarHBondContact N-O 3.39Å; G42-Y83 VanDerWaalsContact N-O 3.11Å; G42-Y83 CarbonylContact O-C 3.55Å; G42-Y83 VanDerWaalsContact O-C 3.29Å; G42-Y83 VanDerWaalsContact O-CD1 3.26Å; G42-Y83 WeakPolarHBondContact O-CD1 3.47Å; G42-Y83 VanDerWaalsContact O-CE1 3.29Å; G42-Y83 WeakPolarHBondContact O-CE1 3.42Å; P44-Y83 VanDerWaalsContact CD-CD2 3.43Å; P44-Y83 HydrophobicContact CG-CD2 4.2Å; W47-Y83 AromaticContact CD1-CE2 3.89Å; W47-Y83 HydrophobicContact CD2-CE2 4.39Å; W47-Y83 AromaticContact CE2-CE2 4Å; W47-Y83 HydrophobicContact CG-CE2 4.32Å; W47-Y83 AromaticContact NE1-CE2 3.66Å; A51-Y83 HydrophobicContact CB-CE1 4.39Å; P52-Y83 HydrophobicContact CG-CD1 4.03Å; P52-Y83 HydrophobicContact CG-CD2 3.72Å; P52-Y83 HydrophobicContact CG-CE1 4.48Å; P52-Y83 HydrophobicContact CG-CE2 4.21Å; P52-Y83 HydrophobicContact CG-CG 3.64Å; Y83-M102 WeakPolarHBondContact CB-O 3.21Å; Y83-M102 HydrophobicContact CD1-CG 3.98Å; Y83-M102 HydrophobicContact CG-CG 4.37Å; Y83-M102 PolarHBondContact N-O 3.41Å
84	E	88.4	Confident	86.8	Confident	38 Å²	38	49.1 Å²	49.1	18%	0.178	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.6	177	-171.1	-168.8	58.7	0	0	110.1	R86 M102	E84-R86 HydrophobicContact CG-CG 3.92Å; E84-R86 WeakPolarHBondContact OE1-CD 3.49Å; E84-R86 WeakPolarHBondContact OE1-CG 3.47Å; E84-R86 IonicContact OE1-CZ 3.11Å; E84-R86 IonicContact OE1-NE 3.91Å; E84-R86 IonicContact OE1-NH1 2.76Å; E84-R86 PolarHBondContact OE1-NH1 3.31Å; E84-M102 HydrophobicContact CB-CB 4.23Å; E84-M102 PolarHBondContact N-O 3.34Å; E84-M102 PolarHBondContact O-N 2.71Å
85	F	89.9	Confident	86.8	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.9	170.5	174.7	-88.1	0	0	0	109.1	K39 Y40 E69 L72 V73 F76 I82 L87 A99 V101	K39-F85 CarbonylContact C-O 3.58Å; K39-F85 WeakPolarHBondContact CA-O 3.31Å; Y40-F85 HydrophobicContact CD1-CB 4.13Å; Y40-F85 PolarHBondContact N-O 2.9Å; Y40-F85 PolarHBondContact O-N 3.36Å; E69-F85 HydrophobicContact CB-CD1 4.21Å; E69-F85 HydrophobicContact CB-CE1 3.8Å; L72-F85 HydrophobicContact CB-CE2 4.02Å; L72-F85 HydrophobicContact CB-CZ 3.68Å; L72-F85 HydrophobicContact CD1-CZ 3.95Å; L72-F85 HydrophobicContact CG-CZ 4.47Å; V73-F85 HydrophobicContact CG2-CB 4.31Å; V73-F85 HydrophobicContact CG2-CD1 3.95Å; V73-F85 HydrophobicContact CG2-CD2 4.2Å; V73-F85 HydrophobicContact CG2-CE1 4.3Å; V73-F85 HydrophobicContact CG2-CG 3.9Å; F76-F85 HydrophobicContact CD2-CE2 4.17Å; I82-F85 HydrophobicContact CG2-CB 4.17Å; F85-L87 HydrophobicContact CE1-CB 3.87Å; F85-L87 HydrophobicContact CZ-CB 4.47Å; F85-A99 HydrophobicContact CE2-CB 4.38Å; F85-A99 HydrophobicContact CZ-CB 4.22Å; F85-V101 HydrophobicContact CD2-CB 4.42Å; F85-V101 HydrophobicContact CD2-CG1 4.2Å; F85-V101 HydrophobicContact CD2-CG2 3.61Å; F85-V101 HydrophobicContact CE2-CG2 3.88Å
86	R	89.7	Confident	86.7	Confident	33 Å²	33	51 Å²	51	13%	0.125	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	103	-177.8	-55.2	-166.1	-61	-90.2	-1.9	111.2	R38 K39 E57 E84 A99 F100	R38-R86 WeakPolarHBondContact O-CA 3.43Å; K39-R86 HydrophobicContact CG-CG 4.32Å; E57-R86 IonicContact OE1-CZ 3.67Å; E57-R86 IonicContact OE1-NH1 2.68Å; E57-R86 IonicContact OE1-NH2 3.04Å; E57-R86 PolarHBondContact OE1-NH2 2.88Å; E57-R86 IonicContact OE2-CZ 2.65Å; E57-R86 VanDerWaalsContact OE2-CZ 3.22Å; E57-R86 IonicContact OE2-NH1 3.56Å; E57-R86 PolarHBondContact OE2-NH1 3.1Å; E57-R86 IonicContact OE2-NH2 3.14Å; E57-R86 PolarHBondContact OE2-NH2 3.46Å; E84-R86 HydrophobicContact CG-CG 3.92Å; E84-R86 WeakPolarHBondContact OE1-CD 3.49Å; E84-R86 WeakPolarHBondContact OE1-CG 3.47Å; E84-R86 IonicContact OE1-CZ 3.11Å; E84-R86 IonicContact OE1-NE 3.91Å; E84-R86 IonicContact OE1-NH1 2.76Å; E84-R86 PolarHBondContact OE1-NH1 3.31Å; R86-A99 CarbonylContact O-C 3.58Å; R86-A99 VanDerWaalsContact O-CA 3.23Å; R86-A99 WeakPolarHBondContact O-CA 3.39Å; R86-A99 WeakPolarHBondContact O-CB 3.44Å; R86-F100 HydrophobicContact CB-CB 4.41Å; R86-F100 PolarHBondContact N-O 2.85Å; R86-F100 PolarHBondContact O-N 2.98Å
87	L	90.2	Very high	86.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	127.2	171.1	-174.4	61.6	0	0	0	110.1	Q37 R38 I63 F68 L72 F85 M89 N95 A99	Q37-L87 WeakPolarHBondContact CA-O 3.28Å; R38-L87 HydrophobicContact CB-CB 4.37Å; R38-L87 PolarHBondContact N-O 2.82Å; R38-L87 PolarHBondContact O-N 2.6Å; I63-L87 HydrophobicContact CD1-CD1 4.33Å; F68-L87 HydrophobicContact CB-CD2 4.36Å; F68-L87 HydrophobicContact CD1-CD2 4Å; L72-L87 HydrophobicContact CD1-CD1 4.32Å; F85-L87 HydrophobicContact CE1-CB 3.87Å; F85-L87 HydrophobicContact CZ-CB 4.47Å; L87-M89 HydrophobicContact CD2-SD 3.94Å; L87-M89 HydrophobicContact CG-SD 3.96Å; L87-N95 HydrophobicContact CD1-CB 3.94Å; L87-N95 HydrophobicContact CD2-CB 4.14Å; L87-N95 HydrophobicContact CG-CB 4.1Å; L87-A99 HydrophobicContact CD1-CB 3.94Å
88	M	88.6	Confident	86.7	Confident	19 Å²	19	50.9 Å²	50.9	9%	0.094	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	124.2	-179.1	-64.9	-62.9	-53.4	0	0	110.2	Q37 R96 Y98 F100	Q37-M88 HydrophobicContact CB-SD 4.44Å; Q37-M88 HydrophobicContact CG-CE 3.98Å; Q37-M88 HydrophobicContact CG-SD 3.73Å; M88-R96 HydrophobicContact CB-CB 4.31Å; M88-R96 HydrophobicContact CB-CG 4.39Å; M88-R96 WeakPolarHBondContact O-CG 3.25Å; M88-R96 PolarHBondContact O-N 3.23Å; M88-Y98 HydrophobicContact CB-CD2 4.4Å; M88-Y98 HydrophobicContact CB-CE1 4.14Å; M88-Y98 HydrophobicContact CB-CE2 4.03Å; M88-Y98 HydrophobicContact CG-CD2 4Å; M88-Y98 HydrophobicContact CG-CE2 3.52Å; M88-Y98 PolarHBondContact N-O 2.89Å; M88-F100 HydrophobicContact CG-CE2 4.31Å
89	M	86.3	Confident	86.9	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.039	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	143.3	-170.7	-61.5	-59.5	-65.7	0	0	112.2	G36 R38 F68 L87 G93 N95 R96	G36-M89 PolarHBondContact O-N 3.16Å; R38-M89 HydrophobicContact CB-CG 4.3Å; R38-M89 HydrophobicContact CG-CG 3.76Å; R38-M89 HydrophobicContact CG-SD 4.35Å; F68-M89 HydrophobicContact CD1-CE 4.43Å; F68-M89 HydrophobicContact CE1-CE 4.02Å; L87-M89 HydrophobicContact CD2-SD 3.94Å; L87-M89 HydrophobicContact CG-SD 3.96Å; M89-G93 WeakPolarHBondContact CE-O 3.12Å; M89-N95 HydrophobicContact SD-CB 3.99Å; M89-R96 VanDerWaalsContact O-CZ 3.26Å; M89-R96 PolarHBondContact O-NE 2.84Å; M89-R96 PolarHBondContact O-NH2 2.9Å
90	E	84.1	Confident	87	Confident	86 Å²	86	45.8 Å²	45.8	40%	0.402	23%	0.23	S	C	.	.			trans	-88.4	159.9	168.9	-171.7	171.2	-98.8	0	0	110.7	S92 G93 E94 R96	E90-S92 WeakPolarHBondContact CB-OG 3.33Å; E90-S92 WeakPolarHBondContact CG-OG 3.19Å; E90-S92 PolarHBondContact O-N 3.36Å; E90-S92 PolarHBondContact OE2-OG 2.82Å; E90-G93 PolarHBondContact O-N 3.33Å; E90-E94 PolarHBondContact N-O 2.87Å; E90-R96 HydrophobicContact CB-CG 4.32Å
91	F	76.4	Confident	87.1	Confident	196 Å²	196	45 Å²	45	86%	0.86	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.3	177.1	-57.5	-74.2	0	0	0	113.5	G93	F91-G93 VanDerWaalsContact C-N 3.26Å; F91-G93 PolarHBondContact O-N 2.87Å
92	S	78.5	Confident	87.2	Confident	74 Å²	74	41 Å²	41	52%	0.517	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-16.8	171.4	52.5	0	0	0	0	113.9	E90	E90-S92 WeakPolarHBondContact CB-OG 3.33Å; E90-S92 WeakPolarHBondContact CG-OG 3.19Å; E90-S92 PolarHBondContact O-N 3.36Å; E90-S92 PolarHBondContact OE2-OG 2.82Å
93	G	75.4	Confident	87.3	Confident	46 Å²	46	40.7 Å²	40.7	47%	0.474	20%	0.203	S	C	.	.	S	Bend	trans	89.9	-7	-172.4	0	0	0	0	0	114.3	M89 E90 F91	M89-G93 WeakPolarHBondContact CE-O 3.12Å; E90-G93 PolarHBondContact O-N 3.33Å; F91-G93 VanDerWaalsContact C-N 3.26Å; F91-G93 PolarHBondContact O-N 2.87Å
94	E	83.5	Confident	87.3	Confident	76 Å²	76	40.3 Å²	40.3	36%	0.355	20%	0.204	S	C	.	.	S	Bend	trans	-77.1	156.1	169.5	-64.1	-166.8	115.6	0	0	111.7	R65 E90	R65-E94 WeakPolarHBondContact CD-OE1 3.25Å; R65-E94 WeakPolarHBondContact CD-OE2 3.47Å; R65-E94 IonicContact CZ-OE2 3.84Å; R65-E94 IonicContact NE-OE2 3.76Å; R65-E94 IonicContact NH1-OE2 2.78Å; R65-E94 PolarHBondContact NH1-OE2 3.42Å; E90-E94 PolarHBondContact N-O 2.87Å
95	N	88.3	Confident	87.3	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.011	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	152.6	167.9	82.9	58.4	0	0	0	111.1	P64 R65 M67 F68 L87 M89 G97	P64-N95 PolarHBondContact O-ND2 3.22Å; R65-N95 WeakPolarHBondContact CA-ND2 3.38Å; R65-N95 PolarHBondContact O-ND2 2.83Å; M67-N95 PolarHBondContact O-ND2 3.26Å; F68-N95 HydrophobicContact CE1-CB 4.33Å; L87-N95 HydrophobicContact CD1-CB 3.94Å; L87-N95 HydrophobicContact CD2-CB 4.14Å; L87-N95 HydrophobicContact CG-CB 4.1Å; M89-N95 HydrophobicContact SD-CB 3.99Å; N95-G97 PolarHBondContact O-N 2.88Å; N95-G97 VanDerWaalsContact OD1-CA 3.29Å; N95-G97 WeakPolarHBondContact OD1-CA 3.09Å; N95-G97 PolarHBondContact OD1-N 3.41Å
96	R	88.1	Confident	87.2	Confident	103 Å²	103	47.1 Å²	47.1	39%	0.389	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	7.7	-178.2	-61.1	-172.8	-165.8	-154.4	-2.1	114.4	M88 M89 E90 Y98	M88-R96 HydrophobicContact CB-CB 4.31Å; M88-R96 HydrophobicContact CB-CG 4.39Å; M88-R96 WeakPolarHBondContact O-CG 3.25Å; M88-R96 PolarHBondContact O-N 3.23Å; M89-R96 VanDerWaalsContact O-CZ 3.26Å; M89-R96 PolarHBondContact O-NE 2.84Å; M89-R96 PolarHBondContact O-NH2 2.9Å; E90-R96 HydrophobicContact CB-CG 4.32Å; R96-Y98 VanDerWaalsContact C-N 3.34Å; R96-Y98 HydrophobicContact CB-CD1 3.8Å; R96-Y98 HydrophobicContact CB-CE1 3.54Å; R96-Y98 HydrophobicContact CG-CE1 4.45Å; R96-Y98 WeakPolarHBondContact O-CD1 3.25Å
97	G	89.1	Confident	87.2	Confident	16 Å²	16	50.1 Å²	50.1	17%	0.165	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	78.2	11.8	-175.8	0	0	0	0	0	115.3	G61 K62 I63 N95	G61-G97 CarbonylContact C-O 3.55Å; K62-G97 PolarHBondContact N-O 2.83Å; K62-G97 VanDerWaalsContact N-O 3.08Å; I63-G97 PolarHBondContact N-O 3.07Å; I63-G97 WeakPolarHBondContact O-CA 3.4Å; N95-G97 PolarHBondContact O-N 2.88Å; N95-G97 VanDerWaalsContact OD1-CA 3.29Å; N95-G97 WeakPolarHBondContact OD1-CA 3.09Å; N95-G97 PolarHBondContact OD1-N 3.41Å
98	Y	92	Very high	87.2	Confident	70 Å²	70	50.2 Å²	50.2	28%	0.275	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	154.3	175.9	72.8	-78.5	0	0	0	113.9	F59 V60 M88 R96 F100	F59-Y98 HydrophobicContact CD2-CD2 4.49Å; F59-Y98 AromaticContact CE2-CD2 3.66Å; F59-Y98 HydrophobicContact CE2-CD2 3.66Å; F59-Y98 HydrophobicContact CE2-CG 4.08Å; F59-Y98 HydrophobicContact CZ-CD2 4.4Å; F59-Y98 HydrophobicContact CZ-CG 4.38Å; V60-Y98 CarbonylContact O-C 3.47Å; V60-Y98 WeakPolarHBondContact O-CA 3.34Å; V60-Y98 VanDerWaalsContact O-CB 3.31Å; V60-Y98 WeakPolarHBondContact O-CB 3.43Å; M88-Y98 HydrophobicContact CB-CD2 4.4Å; M88-Y98 HydrophobicContact CB-CE1 4.14Å; M88-Y98 HydrophobicContact CB-CE2 4.03Å; M88-Y98 HydrophobicContact CG-CD2 4Å; M88-Y98 HydrophobicContact CG-CE2 3.52Å; M88-Y98 PolarHBondContact N-O 2.89Å; R96-Y98 VanDerWaalsContact C-N 3.34Å; R96-Y98 HydrophobicContact CB-CD1 3.8Å; R96-Y98 HydrophobicContact CB-CE1 3.54Å; R96-Y98 HydrophobicContact CG-CE1 4.45Å; R96-Y98 WeakPolarHBondContact O-CD1 3.25Å; Y98-F100 HydrophobicContact CD2-CE2 4.03Å; Y98-F100 HydrophobicContact CD2-CZ 4.43Å; Y98-F100 AromaticContact CE2-CE2 3.83Å; Y98-F100 HydrophobicContact CE2-CE2 3.83Å; Y98-F100 HydrophobicContact CE2-CZ 4.28Å
99	A	92	Very high	87.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	167.1	178.9	0	0	0	0	0	110.7	V60 I63 F85 R86 L87	V60-A99 HydrophobicContact CB-CB 4.46Å; V60-A99 PolarHBondContact N-O 2.84Å; V60-A99 PolarHBondContact O-N 3.22Å; I63-A99 HydrophobicContact CD1-CB 3.58Å; F85-A99 HydrophobicContact CE2-CB 4.38Å; F85-A99 HydrophobicContact CZ-CB 4.22Å; R86-A99 CarbonylContact O-C 3.58Å; R86-A99 VanDerWaalsContact O-CA 3.23Å; R86-A99 WeakPolarHBondContact O-CA 3.39Å; R86-A99 WeakPolarHBondContact O-CB 3.44Å; L87-A99 HydrophobicContact CD1-CB 3.94Å
100	F	91.3	Very high	87.5	Confident	35 Å²	35	53.7 Å²	53.7	15%	0.154	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141	170.4	-60.3	-93.6	0	0	0	109.5	E57 V58 F59 R86 M88 Y98	E57-F100 HydrophobicContact CG-CB 4.25Å; E57-F100 WeakPolarHBondContact OE1-CB 3.35Å; E57-F100 WeakPolarHBondContact OE1-CD1 3.29Å; V58-F100 WeakPolarHBondContact O-CA 3.24Å; F59-F100 HydrophobicContact CD2-CD1 4.32Å; F59-F100 AromaticContact CD2-CE1 3.81Å; F59-F100 HydrophobicContact CD2-CE1 3.81Å; F59-F100 HydrophobicContact CD2-CZ 4.09Å; R86-F100 HydrophobicContact CB-CB 4.41Å; R86-F100 PolarHBondContact N-O 2.85Å; R86-F100 PolarHBondContact O-N 2.98Å; M88-F100 HydrophobicContact CG-CE2 4.31Å; Y98-F100 HydrophobicContact CD2-CE2 4.03Å; Y98-F100 HydrophobicContact CD2-CZ 4.43Å; Y98-F100 AromaticContact CE2-CE2 3.83Å; Y98-F100 HydrophobicContact CE2-CE2 3.83Å; Y98-F100 HydrophobicContact CE2-CZ 4.28Å
101	V	91.3	Very high	87.8	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	110.6	178.9	-164	0	0	0	0	109.4	E57 V58 V60 F76 I82 F85 Y103	E57-V101 WeakPolarHBondContact CA-O 3.2Å; V58-V101 HydrophobicContact CG2-CB 3.88Å; V58-V101 HydrophobicContact CG2-CG2 4.32Å; V58-V101 PolarHBondContact N-O 3.08Å; V58-V101 PolarHBondContact O-N 2.96Å; V60-V101 HydrophobicContact CG2-CG2 3.83Å; F76-V101 HydrophobicContact CB-CG1 4.33Å; F76-V101 HydrophobicContact CD1-CG2 4.41Å; F76-V101 HydrophobicContact CD2-CG2 4.16Å; F76-V101 HydrophobicContact CE2-CG2 4.5Å; F76-V101 HydrophobicContact CG-CG2 4.15Å; I82-V101 HydrophobicContact CD1-CG1 4.28Å; I82-V101 HydrophobicContact CG1-CG1 4.02Å; I82-V101 HydrophobicContact CG2-CG1 4.11Å; F85-V101 HydrophobicContact CD2-CB 4.42Å; F85-V101 HydrophobicContact CD2-CG1 4.2Å; F85-V101 HydrophobicContact CD2-CG2 3.61Å; F85-V101 HydrophobicContact CE2-CG2 3.88Å; V101-Y103 HydrophobicContact CB-CE2 4.33Å; V101-Y103 HydrophobicContact CG1-CE2 4.04Å
102	M	90.2	Very high	88.6	Confident	23 Å²	23	45.7 Å²	45.7	11%	0.113	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.3	172.2	-176	68	79.3	0	0	108.9	P52 C56 E57 Y83 E84	P52-M102 HydrophobicContact CB-CG 4.24Å; P52-M102 HydrophobicContact CB-SD 3.95Å; P52-M102 HydrophobicContact CG-CG 4.02Å; P52-M102 HydrophobicContact CG-SD 4.4Å; C56-M102 VanDerWaalsContact C-SD 3.58Å; C56-M102 HydrophobicContact CB-SD 3.64Å; E57-M102 HydrophobicContact CB-CE 3.79Å; E57-M102 HydrophobicContact CB-SD 3.89Å; E57-M102 HydrophobicContact CG-CE 4.35Å; Y83-M102 WeakPolarHBondContact CB-O 3.21Å; Y83-M102 HydrophobicContact CD1-CG 3.98Å; Y83-M102 HydrophobicContact CG-CG 4.37Å; Y83-M102 PolarHBondContact N-O 3.41Å; E84-M102 HydrophobicContact CB-CB 4.23Å; E84-M102 PolarHBondContact N-O 3.34Å; E84-M102 PolarHBondContact O-N 2.71Å
103	Y	91.3	Very high	89.2	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	161.6	171.1	-69.9	-85.3	0	0	0	111.1	P52 C56 V58 F76 A79 G80 I82 V101 N105 A108 A109 A112	P52-Y103 WeakPolarHBondContact CB-O 3.35Å; P52-Y103 VanDerWaalsContact CG-O 3.28Å; P52-Y103 WeakPolarHBondContact CG-O 3.38Å; C56-Y103 WeakPolarHBondContact CB-O 3.47Å; C56-Y103 PolarHBondContact O-N 2.65Å; V58-Y103 HydrophobicContact CG1-CE2 4.42Å; V58-Y103 HydrophobicContact CG2-CE2 3.94Å; F76-Y103 WeakPolarHBondContact CB-OH 3.25Å; F76-Y103 WeakPolarHBondContact CD1-OH 3.43Å; F76-Y103 PolarHBondContact O-OH 2.73Å; A79-Y103 HydrophobicContact CB-CE1 4.3Å; G80-Y103 WeakPolarHBondContact O-CE1 3.32Å; I82-Y103 HydrophobicContact CG1-CD1 4.43Å; I82-Y103 HydrophobicContact CG1-CE1 4.05Å; V101-Y103 HydrophobicContact CB-CE2 4.33Å; V101-Y103 HydrophobicContact CG1-CE2 4.04Å; Y103-N105 PolarHBondContact O-N 2.76Å; Y103-A108 HydrophobicContact CD1-CB 3.78Å; Y103-A108 HydrophobicContact CG-CB 3.86Å; Y103-A109 HydrophobicContact CD2-CB 3.99Å; Y103-A112 HydrophobicContact CE2-CB 3.63Å; Y103-A112 VanDerWaalsContact OH-CB 3.3Å; Y103-A112 WeakPolarHBondContact OH-CB 3.48Å
104	T	88.8	Confident	89.9	Confident	21 Å²	21	49.4 Å²	49.4	13%	0.129	23%	0.225	C	C	.	.	S	Bend	trans	-66.2	-25.4	171.7	61.3	0	0	0	0	112.8	P44 W47 K81	P44-T104 HydrophobicContact CG-CG2 4.4Å; W47-T104 HydrophobicContact CE3-CG2 4.32Å; W47-T104 HydrophobicContact CH2-CG2 4.04Å; W47-T104 HydrophobicContact CZ3-CG2 3.73Å; K81-T104 HydrophobicContact CB-CG2 4.32Å; K81-T104 HydrophobicContact CD-CG2 4.43Å; K81-T104 HydrophobicContact CG-CG2 4.24Å; K81-T104 PolarHBondContact O-N 2.9Å
105	N	88.9	Confident	90.2	Very high	78 Å²	78	51.2 Å²	51.2	42%	0.417	23%	0.234	S	C	.	.	S	Bend	trans	-134.7	142.5	-167.7	-66.5	34.4	0	0	0	111.8	Y103 E107 A108 A109	Y103-N105 PolarHBondContact O-N 2.76Å; N105-E107 VanDerWaalsContact C-N 3.3Å; N105-E107 WeakPolarHBondContact CB-OE2 3.4Å; N105-E107 PolarHBondContact O-N 2.73Å; N105-A108 HydrophobicContact CB-CB 4.3Å; N105-A108 WeakPolarHBondContact O-CB 3.3Å; N105-A108 PolarHBondContact O-N 3.22Å; N105-A108 VanDerWaalsContact O-N 3.13Å; N105-A109 PolarHBondContact O-N 3.28Å
106	R	87.4	Confident	90.2	Very high	103 Å²	103	51.3 Å²	51.3	39%	0.389	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-36.4	-179.7	-165.3	-167.3	-66.4	178.4	-0.1	112	C56 A108 A109 Q110 E224	C56-R106 PolarHBondContact SG-N 2.82Å; C56-R106 VanDerWaalsContact SG-N 3.37Å; R106-A108 VanDerWaalsContact C-N 3.27Å; R106-A108 PolarHBondContact O-N 3.24Å; R106-A109 WeakPolarHBondContact O-CB 3.48Å; R106-A109 PolarHBondContact O-N 3.37Å; R106-Q110 PolarHBondContact O-N 2.98Å; R106-E224 IonicContact CZ-OE1 2.9Å; R106-E224 IonicContact NH1-OE1 3.2Å; R106-E224 PolarHBondContact NH1-OE1 3.25Å
107	E	88.9	Confident	90.3	Very high	96 Å²	96	47.9 Å²	47.9	45%	0.449	22%	0.224	S	C	.	.	H	α-helix	trans	-70.4	-26.5	-179.8	-49.7	69.1	-143.4	0	0	111.3	N105 R111	N105-E107 VanDerWaalsContact C-N 3.3Å; N105-E107 WeakPolarHBondContact CB-OE2 3.4Å; N105-E107 PolarHBondContact O-N 2.73Å; E107-R111 WeakPolarHBondContact O-CB 3.42Å; E107-R111 VanDerWaalsContact O-CG 3.32Å; E107-R111 WeakPolarHBondContact O-CG 3.44Å; E107-R111 PolarHBondContact O-N 2.98Å; E107-R111 PolarHBondContact O-NH1 3.29Å
108	A	91.1	Very high	90.3	Very high	2 Å²	2	50.5 Å²	50.5	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-72.5	-40.5	173.9	0	0	0	0	0	111.4	Y103 N105 R106 R111 A112	Y103-A108 HydrophobicContact CD1-CB 3.78Å; Y103-A108 HydrophobicContact CG-CB 3.86Å; N105-A108 HydrophobicContact CB-CB 4.3Å; N105-A108 WeakPolarHBondContact O-CB 3.3Å; N105-A108 PolarHBondContact O-N 3.22Å; N105-A108 VanDerWaalsContact O-N 3.13Å; R106-A108 VanDerWaalsContact C-N 3.27Å; R106-A108 PolarHBondContact O-N 3.24Å; A108-R111 PolarHBondContact O-N 2.84Å; A108-A112 WeakPolarHBondContact O-CB 3.47Å; A108-A112 PolarHBondContact O-N 3.28Å
109	A	90.3	Very high	90	Very high	3 Å²	3	49.1 Å²	49.1	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-45	171.6	0	0	0	0	0	111.8	V58 Y103 N105 R106 A112 I113	V58-A109 HydrophobicContact CG1-CB 3.69Å; V58-A109 WeakPolarHBondContact CG1-O 3.46Å; Y103-A109 HydrophobicContact CD2-CB 3.99Å; N105-A109 PolarHBondContact O-N 3.28Å; R106-A109 WeakPolarHBondContact O-CB 3.48Å; R106-A109 PolarHBondContact O-N 3.37Å; A109-A112 WeakPolarHBondContact O-CB 3.29Å; A109-A112 PolarHBondContact O-N 3.13Å; A109-I113 WeakPolarHBondContact O-CG1 3.42Å; A109-I113 PolarHBondContact O-N 3.35Å; A109-I113 VanDerWaalsContact O-N 3.11Å
110	Q	90.3	Very high	89.9	Confident	98 Å²	98	54.1 Å²	54.1	46%	0.458	26%	0.258	S	S	.	.	H	α-helix	trans	-62.2	-44.7	175.2	-72.2	179.8	-25.1	0	0	112.7	R106 A112 I113 Q114	R106-Q110 PolarHBondContact O-N 2.98Å; Q110-A112 VanDerWaalsContact C-N 3.33Å; Q110-A112 PolarHBondContact O-N 3.39Å; Q110-I113 PolarHBondContact O-N 3.42Å; Q110-Q114 WeakPolarHBondContact O-CG 3.41Å; Q110-Q114 PolarHBondContact O-N 3.37Å
111	R	91.5	Very high	89.7	Confident	113 Å²	113	54 Å²	54	43%	0.426	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-37.9	173.9	-75.3	-171.3	-49.8	-88.9	1.9	112.5	A79 E107 A108 I113 Q114 M115	A79-R111 PolarHBondContact O-NE 3.11Å; A79-R111 VanDerWaalsContact O-NE 3.11Å; A79-R111 PolarHBondContact O-NH2 3.36Å; E107-R111 WeakPolarHBondContact O-CB 3.42Å; E107-R111 VanDerWaalsContact O-CG 3.32Å; E107-R111 WeakPolarHBondContact O-CG 3.44Å; E107-R111 PolarHBondContact O-N 2.98Å; E107-R111 PolarHBondContact O-NH1 3.29Å; A108-R111 PolarHBondContact O-N 2.84Å; R111-I113 VanDerWaalsContact C-N 3.33Å; R111-I113 PolarHBondContact O-N 3.13Å; R111-Q114 PolarHBondContact O-N 3.37Å; R111-M115 WeakPolarHBondContact O-CB 3.44Å; R111-M115 PolarHBondContact O-N 3.26Å
112	A	92.3	Very high	89.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-42.7	177	0	0	0	0	0	111.6	A79 Y103 A108 A109 Q110 L116	A79-A112 HydrophobicContact CB-CB 3.67Å; Y103-A112 HydrophobicContact CE2-CB 3.63Å; Y103-A112 VanDerWaalsContact OH-CB 3.3Å; Y103-A112 WeakPolarHBondContact OH-CB 3.48Å; A108-A112 WeakPolarHBondContact O-CB 3.47Å; A108-A112 PolarHBondContact O-N 3.28Å; A109-A112 WeakPolarHBondContact O-CB 3.29Å; A109-A112 PolarHBondContact O-N 3.13Å; Q110-A112 VanDerWaalsContact C-N 3.33Å; Q110-A112 PolarHBondContact O-N 3.39Å; A112-L116 VanDerWaalsContact O-CB 3.25Å; A112-L116 WeakPolarHBondContact O-CB 3.41Å; A112-L116 PolarHBondContact O-N 3.03Å
113	I	91.8	Very high	89.3	Confident	38 Å²	38	62.8 Å²	62.8	20%	0.195	31%	0.308	C	S	.	.	H	α-helix	trans	-62.2	-48.2	174.1	-64.5	159.8	0	0	0	110.6	V58 A109 Q110 R111 M115 D117 V129 V131	V58-I113 HydrophobicContact CG1-CD1 4Å; V58-I113 HydrophobicContact CG1-CG1 3.9Å; A109-I113 WeakPolarHBondContact O-CG1 3.42Å; A109-I113 PolarHBondContact O-N 3.35Å; A109-I113 VanDerWaalsContact O-N 3.11Å; Q110-I113 PolarHBondContact O-N 3.42Å; R111-I113 VanDerWaalsContact C-N 3.33Å; R111-I113 PolarHBondContact O-N 3.13Å; I113-M115 VanDerWaalsContact C-N 3.34Å; I113-M115 PolarHBondContact O-N 2.61Å; I113-D117 WeakPolarHBondContact O-CB 3.29Å; I113-D117 PolarHBondContact O-N 3.36Å; I113-V129 HydrophobicContact CG1-CG1 4Å; I113-V131 HydrophobicContact CD1-CB 4.37Å; I113-V131 HydrophobicContact CD1-CG2 3.57Å
114	Q	89.9	Confident	89	Confident	161 Å²	161	65.5 Å²	65.5	75%	0.752	34%	0.335	S	S	*	.	H	α-helix	trans	-65.3	-33.3	-178.5	-70	173.2	0.2	0	0	113.8	Q110 R111	Q110-Q114 WeakPolarHBondContact O-CG 3.41Å; Q110-Q114 PolarHBondContact O-N 3.37Å; R111-Q114 PolarHBondContact O-N 3.37Å
115	M	88.8	Confident	89.1	Confident	113 Å²	113	69.8 Å²	69.8	56%	0.557	35%	0.352	S	S	*	.	H	α-helix	trans	-92.9	-29.7	-174.8	-174.7	178.1	-179.5	0	0	113.5	K78 R111 I113	K78-M115 HydrophobicContact CB-CE 4.33Å; R111-M115 WeakPolarHBondContact O-CB 3.44Å; R111-M115 PolarHBondContact O-N 3.26Å; I113-M115 VanDerWaalsContact C-N 3.34Å; I113-M115 PolarHBondContact O-N 2.61Å
116	L	89.3	Confident	89.2	Confident	4 Å²	4	70.6 Å²	70.6	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-118.1	-9.7	-167.6	-55.9	172.5	0	0	0	114.3	L75 F76 A112 N118 C119 I127 V129	L75-L116 HydrophobicContact CD1-CD2 3.86Å; L75-L116 HydrophobicContact CG-CD2 4.09Å; F76-L116 HydrophobicContact CD1-CD1 3.34Å; F76-L116 HydrophobicContact CE1-CB 4.31Å; F76-L116 HydrophobicContact CE1-CD1 3.47Å; F76-L116 VanDerWaalsContact CE1-CD1 3.47Å; F76-L116 HydrophobicContact CG-CD1 4.23Å; F76-L116 HydrophobicContact CZ-CD1 4.43Å; A112-L116 VanDerWaalsContact O-CB 3.25Å; A112-L116 WeakPolarHBondContact O-CB 3.41Å; A112-L116 PolarHBondContact O-N 3.03Å; L116-N118 PolarHBondContact O-N 2.81Å; L116-C119 VanDerWaalsContact O-CB 3.29Å; L116-C119 WeakPolarHBondContact O-CB 3.26Å; L116-C119 PolarHBondContact O-N 3.32Å; L116-C119 VanDerWaalsContact O-N 3.13Å; L116-I127 HydrophobicContact CB-CD1 4.31Å; L116-V129 HydrophobicContact CB-CG2 3.96Å
117	D	90.6	Very high	89.4	Confident	32 Å²	32	65.7 Å²	65.7	17%	0.171	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	120.2	174.4	-176	41.7	0	0	0	112	I113 C119 G128 V129 R314	I113-D117 WeakPolarHBondContact O-CB 3.29Å; I113-D117 PolarHBondContact O-N 3.36Å; D117-C119 PolarHBondContact O-N 2.69Å; D117-G128 WeakPolarHBondContact OD1-CA 3.22Å; D117-V129 HydrophobicContact CB-CB 4.19Å; D117-V129 WeakPolarHBondContact CB-O 3.26Å; D117-V129 PolarHBondContact OD1-N 2.96Å; D117-R314 IonicContact OD2-CZ 3.26Å; D117-R314 IonicContact OD2-NH1 2.66Å; D117-R314 PolarHBondContact OD2-NH1 2.71Å; D117-R314 IonicContact OD2-NH2 2.83Å
118	N	88.5	Confident	89.5	Confident	71 Å²	71	61.2 Å²	61.2	38%	0.38	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	24.7	-171.2	-41.1	-81.8	0	0	0	114	K62 L116 F126 I127	K62-N118 PolarHBondContact NZ-OD1 2.7Å; L116-N118 PolarHBondContact O-N 2.81Å; N118-F126 WeakPolarHBondContact O-CD1 3.49Å; N118-I127 WeakPolarHBondContact CA-O 3.39Å; N118-I127 PolarHBondContact N-O 2.69Å
119	C	85.9	Confident	89.6	Confident	41 Å²	41	61.2 Å²	61.2	28%	0.277	31%	0.313	S	S	.	.			trans	-65.5	134.5	165.9	-174.3	0	0	0	0	110.4	L116 D117 F126 I127	L116-C119 VanDerWaalsContact O-CB 3.29Å; L116-C119 WeakPolarHBondContact O-CB 3.26Å; L116-C119 PolarHBondContact O-N 3.32Å; L116-C119 VanDerWaalsContact O-N 3.13Å; D117-C119 PolarHBondContact O-N 2.69Å; C119-F126 WeakPolarHBondContact O-CA 3.46Å; C119-I127 HydrophobicContact CB-CD1 4.41Å; C119-I127 HydrophobicContact CB-CG1 4.19Å; C119-I127 PolarHBondContact O-N 2.77Å; C119-I127 VanDerWaalsContact O-N 3.1Å
120	E	89.6	Confident	89.5	Confident	104 Å²	104	63 Å²	63	49%	0.486	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	123.1	171.8	-164.4	166.4	-166.3	0	0	109.6	R122 P123 G124 K125 F126	E120-R122 WeakPolarHBondContact CG-O 3.34Å; E120-P123 WeakPolarHBondContact OE1-CA 3.22Å; E120-G124 PolarHBondContact OE1-N 2.9Å; E120-K125 WeakPolarHBondContact CA-O 3.49Å; E120-F126 HydrophobicContact CB-CD1 3.77Å; E120-F126 HydrophobicContact CB-CE1 3.62Å; E120-F126 HydrophobicContact CB-CZ 4.48Å; E120-F126 HydrophobicContact CG-CD1 4.18Å; E120-F126 HydrophobicContact CG-CE1 3.84Å; E120-F126 HydrophobicContact CG-CZ 4.23Å
121	V	87.7	Confident	89.3	Confident	34 Å²	34	62.2 Å²	62.2	21%	0.206	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	-20.7	179.7	-66.8	0	0	0	0	112.7	P64 M67 L75 K125 I127	P64-V121 HydrophobicContact CG-CG2 4Å; M67-V121 HydrophobicContact CE-CB 3.91Å; M67-V121 HydrophobicContact CE-CG1 4.35Å; M67-V121 HydrophobicContact CE-CG2 4.25Å; M67-V121 HydrophobicContact SD-CB 3.9Å; M67-V121 HydrophobicContact SD-CG2 3.59Å; M67-V121 VanDerWaalsContact SD-CG2 3.59Å; L75-V121 HydrophobicContact CD2-CG1 3.72Å; V121-K125 HydrophobicContact CG2-CB 4.39Å; V121-K125 WeakPolarHBondContact CG2-O 3.31Å; V121-K125 PolarHBondContact N-O 3.08Å; V121-I127 HydrophobicContact CG1-CD1 4.04Å; V121-I127 HydrophobicContact CG1-CG1 4Å; V121-I127 HydrophobicContact CG1-CG2 3.9Å; V121-I127 HydrophobicContact CG2-CG2 3.95Å
122	R	86.8	Confident	88.8	Confident	85 Å²	85	57.5 Å²	57.5	32%	0.321	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	148.3	-178.4	-174.3	169.4	-63.3	-124.5	-9	107.1	D66 E71 E120 G124 K125	D66-R122 IonicContact OD2-CZ 2.71Å; D66-R122 VanDerWaalsContact OD2-CZ 3.28Å; D66-R122 IonicContact OD2-NE 2.81Å; D66-R122 IonicContact OD2-NH1 3.23Å; D66-R122 PolarHBondContact OD2-NH1 2.82Å; E71-R122 IonicContact OE1-NH2 2.69Å; E71-R122 PolarHBondContact OE1-NH2 2.83Å; E71-R122 VanDerWaalsContact OE1-NH2 3.14Å; E71-R122 IonicContact OE2-NH2 2.96Å; E71-R122 PolarHBondContact OE2-NH2 3.05Å; E120-R122 WeakPolarHBondContact CG-O 3.34Å; R122-G124 PolarHBondContact O-N 3.49Å; R122-G124 VanDerWaalsContact O-N 3.11Å; R122-K125 HydrophobicContact CB-CB 4.04Å; R122-K125 HydrophobicContact CB-CG 4.14Å; R122-K125 HydrophobicContact CG-CG 4.47Å; R122-K125 WeakPolarHBondContact O-CA 3.28Å; R122-K125 WeakPolarHBondContact O-CB 3.42Å; R122-K125 PolarHBondContact O-N 2.98Å
123	P	85.3	Confident	88	Confident	122 Å²	122	63.6 Å²	63.6	79%	0.792	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	119	-174.3	-32.1	37.4	0	0	0	113.9	E120 K125	E120-P123 WeakPolarHBondContact OE1-CA 3.22Å; P123-K125 VanDerWaalsContact C-N 3.32Å; P123-K125 PolarHBondContact O-N 3.32Å
124	G	86.3	Confident	87.1	Confident	56 Å²	56	63.7 Å²	63.7	58%	0.577	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	14.8	-176.3	0	0	0	0	0	115.4	E120 R122	E120-G124 PolarHBondContact OE1-N 2.9Å; R122-G124 PolarHBondContact O-N 3.49Å; R122-G124 VanDerWaalsContact O-N 3.11Å
125	K	89.3	Confident	86.8	Confident	111 Å²	111	57 Å²	57	48%	0.483	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	111.3	179.7	-56.5	-64.2	-176.5	-179.6	0	110.8	P64 E120 V121 R122 P123	P64-K125 HydrophobicContact CG-CB 4Å; P64-K125 HydrophobicContact CG-CG 4.24Å; E120-K125 WeakPolarHBondContact CA-O 3.49Å; V121-K125 HydrophobicContact CG2-CB 4.39Å; V121-K125 WeakPolarHBondContact CG2-O 3.31Å; V121-K125 PolarHBondContact N-O 3.08Å; R122-K125 HydrophobicContact CB-CB 4.04Å; R122-K125 HydrophobicContact CB-CG 4.14Å; R122-K125 HydrophobicContact CG-CG 4.47Å; R122-K125 WeakPolarHBondContact O-CA 3.28Å; R122-K125 WeakPolarHBondContact O-CB 3.42Å; R122-K125 PolarHBondContact O-N 2.98Å; P123-K125 VanDerWaalsContact C-N 3.32Å; P123-K125 PolarHBondContact O-N 3.32Å
126	F	91	Very high	86.7	Confident	96 Å²	96	51.8 Å²	51.8	42%	0.421	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122.5	-179.6	-53.2	-89.6	0	0	0	110	K62 N118 C119 E120	K62-F126 WeakPolarHBondContact CB-O 3.43Å; K62-F126 VanDerWaalsContact CD-O 3.26Å; K62-F126 WeakPolarHBondContact CD-O 3.3Å; N118-F126 WeakPolarHBondContact O-CD1 3.49Å; C119-F126 WeakPolarHBondContact O-CA 3.46Å; E120-F126 HydrophobicContact CB-CD1 3.77Å; E120-F126 HydrophobicContact CB-CE1 3.62Å; E120-F126 HydrophobicContact CB-CZ 4.48Å; E120-F126 HydrophobicContact CG-CD1 4.18Å; E120-F126 HydrophobicContact CG-CE1 3.84Å; E120-F126 HydrophobicContact CG-CZ 4.23Å
127	I	92.4	Very high	86.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.294	C	S	.	.			trans	-70.5	150.1	170.4	54.7	168.9	0	0	0	110	L75 F76 L116 N118 C119 V121 V129	L75-I127 HydrophobicContact CD2-CD1 3.92Å; F76-I127 HydrophobicContact CZ-CD1 4.01Å; L116-I127 HydrophobicContact CB-CD1 4.31Å; N118-I127 WeakPolarHBondContact CA-O 3.39Å; N118-I127 PolarHBondContact N-O 2.69Å; C119-I127 HydrophobicContact CB-CD1 4.41Å; C119-I127 HydrophobicContact CB-CG1 4.19Å; C119-I127 PolarHBondContact O-N 2.77Å; C119-I127 VanDerWaalsContact O-N 3.1Å; V121-I127 HydrophobicContact CG1-CD1 4.04Å; V121-I127 HydrophobicContact CG1-CG1 4Å; V121-I127 HydrophobicContact CG1-CG2 3.9Å; V121-I127 HydrophobicContact CG2-CG2 3.95Å; I127-V129 HydrophobicContact CD1-CG2 4.14Å
128	G	91.4	Very high	86.8	Confident	2 Å²	2	52 Å²	52	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.1	168.8	0	0	0	0	0	109.5	V60 G61 D117	V60-G128 WeakPolarHBondContact CA-O 3.2Å; G61-G128 PolarHBondContact N-O 3.1Å; G61-G128 PolarHBondContact O-N 2.98Å; D117-G128 WeakPolarHBondContact OD1-CA 3.22Å
129	V	92.1	Very high	87	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.3	-178.5	-173.3	0	0	0	0	108.9	V58 F59 V60 F76 I113 L116 D117 I127	V58-V129 HydrophobicContact CB-CG1 4.11Å; V58-V129 HydrophobicContact CG2-CG1 4.08Å; F59-V129 WeakPolarHBondContact O-CA 3.03Å; V60-V129 HydrophobicContact CG1-CG2 4.47Å; V60-V129 HydrophobicContact CG2-CG2 4.45Å; F76-V129 HydrophobicContact CE1-CG2 4.09Å; F76-V129 HydrophobicContact CZ-CG2 4.3Å; I113-V129 HydrophobicContact CG1-CG1 4Å; L116-V129 HydrophobicContact CB-CG2 3.96Å; D117-V129 HydrophobicContact CB-CB 4.19Å; D117-V129 WeakPolarHBondContact CB-O 3.26Å; D117-V129 PolarHBondContact OD1-N 2.96Å; I127-V129 HydrophobicContact CD1-CG2 4.14Å
130	C	88.6	Confident	87.3	Confident	42 Å²	42	49.3 Å²	49.3	28%	0.284	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	168.4	177.6	66.4	0	0	0	0	111.7	V58 F59 S132	V58-C130 CarbonylContact C-O 3.58Å; V58-C130 WeakPolarHBondContact CA-O 3.49Å; V58-C130 WeakPolarHBondContact CB-O 3.45Å; F59-C130 PolarHBondContact N-O 2.64Å; F59-C130 PolarHBondContact O-N 3.31Å; C130-S132 PolarHBondContact O-N 3.34Å
131	V	85.6	Confident	87.3	Confident	81 Å²	81	44.5 Å²	44.5	49%	0.491	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	133.8	173	-174	0	0	0	0	109.1	I113	I113-V131 HydrophobicContact CD1-CB 4.37Å; I113-V131 HydrophobicContact CD1-CG2 3.57Å
132	S	81.7	Confident	87.3	Confident	13 Å²	13	45.4 Å²	45.4	9%	0.091	25%	0.253	C	S	.	.			trans	-71.3	134.2	170.4	-168	0	0	0	0	110	E57 C130 D134	E57-S132 VanDerWaalsContact O-CB 3.29Å; E57-S132 WeakPolarHBondContact O-CB 3.32Å; E57-S132 PolarHBondContact O-N 3.38Å; E57-S132 PolarHBondContact OE1-OG 3.45Å; C130-S132 PolarHBondContact O-N 3.34Å; S132-D134 VanDerWaalsContact CB-OD1 3.29Å; S132-D134 WeakPolarHBondContact CB-OD1 3.41Å; S132-D134 PolarHBondContact OG-OD1 2.93Å
133	L	75.7	Confident	87.5	Confident	129 Å²	129	41.7 Å²	41.7	68%	0.675	24%	0.239	S	C	*	.			trans	-101.6	79.3	173.1	-65.9	-179.8	0	0	0	108.6	N135	L133-N135 PolarHBondContact O-N 3.24Å
134	D	73.5	Confident	87.7	Confident	39 Å²	39	36.8 Å²	36.8	21%	0.209	21%	0.207	C	C	.	.			trans	-66.2	98	-175.5	-61.4	-17.2	0	0	0	110.3	S132 C136 H189	S132-D134 VanDerWaalsContact CB-OD1 3.29Å; S132-D134 WeakPolarHBondContact CB-OD1 3.41Å; S132-D134 PolarHBondContact OG-OD1 2.93Å; D134-C136 VanDerWaalsContact C-N 3.33Å; D134-C136 PolarHBondContact O-N 3.45Å; D134-C136 PolarHBondContact O-SG 2.86Å; D134-H189 HydrophobicContact CB-CB 4.33Å
135	N	82.6	Confident	87.8	Confident	21 Å²	21	39.3 Å²	39.3	11%	0.112	20%	0.202	C	C	.	.			trans	-74.3	90.4	176.1	-165	-9.5	0	0	0	110.1	L133 R137 H189 W215 A216 P218	L133-N135 PolarHBondContact O-N 3.24Å; N135-R137 PolarHBondContact OD1-N 2.76Å; N135-R137 PolarHBondContact OD1-O 3.04Å; N135-R137 VanDerWaalsContact OD1-O 3.14Å; N135-H189 PolarHBondContact O-ND1 3.08Å; N135-W215 HydrophobicContact CB-CE3 4.18Å; N135-W215 HydrophobicContact CB-CZ3 4.37Å; N135-W215 WeakPolarHBondContact O-CZ3 3.47Å; N135-A216 PolarHBondContact ND2-O 3.24Å; N135-P218 HydrophobicContact CB-CG 4.3Å
136	C	86.9	Confident	87.7	Confident	4 Å²	4	38.7 Å²	38.7	3%	0.027	20%	0.204	C	C	.	.			trans	-91.4	6.6	178.4	-58.5	0	0	0	0	113.5	D134 Y186 H189	D134-C136 VanDerWaalsContact C-N 3.33Å; D134-C136 PolarHBondContact O-N 3.45Å; D134-C136 PolarHBondContact O-SG 2.86Å; C136-Y186 WeakPolarHBondContact CB-O 3.17Å; C136-Y186 PolarHBondContact O-N 2.67Å; C136-H189 PolarHBondContact SG-N 3.12Å; C136-H189 VanDerWaalsContact SG-N 3.35Å
137	R	90.5	Very high	87.6	Confident	40 Å²	40	35.9 Å²	35.9	15%	0.151	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.3	-172.1	-165.8	-177.3	-73.6	164.6	-2.2	112	N135 F183 V184 E185 A216 E219	N135-R137 PolarHBondContact OD1-N 2.76Å; N135-R137 PolarHBondContact OD1-O 3.04Å; N135-R137 VanDerWaalsContact OD1-O 3.14Å; R137-F183 HydrophobicContact CG-CB 4.04Å; R137-F183 HydrophobicContact CG-CD1 4.49Å; R137-V184 CarbonylContact C-O 3.6Å; R137-V184 WeakPolarHBondContact CA-O 3.32Å; R137-E185 HydrophobicContact CG-CB 4.45Å; R137-E185 IonicContact CZ-OE2 2.74Å; R137-E185 IonicContact NE-OE2 2.73Å; R137-E185 PolarHBondContact NE-OE2 3.48Å; R137-E185 IonicContact NH2-OE2 3.48Å; R137-E185 PolarHBondContact NH2-OE2 3.41Å; R137-A216 HydrophobicContact CB-CB 3.99Å; R137-A216 HydrophobicContact CG-CB 3.9Å; R137-A216 VanDerWaalsContact O-CB 3.26Å; R137-A216 WeakPolarHBondContact O-CB 3.45Å; R137-A216 PolarHBondContact O-N 2.86Å; R137-E219 IonicContact CZ-OE2 2.7Å; R137-E219 VanDerWaalsContact CZ-OE2 3.28Å; R137-E219 IonicContact NH1-OE2 2.78Å; R137-E219 PolarHBondContact NH1-OE2 3.04Å; R137-E219 IonicContact NH2-OE2 3.95Å; R137-E219 PolarHBondContact NH2-OE2 2.78Å
138	L	92	Very high	87.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	141.9	173.2	-59.8	-174.8	0	0	0	110.4	F183 V184 Y186 A192 A195 R196 V213 D214 W215	L138-F183 CarbonylContact O-C 3.59Å; L138-F183 VanDerWaalsContact O-CA 3.26Å; L138-F183 WeakPolarHBondContact O-CA 3.49Å; L138-V184 PolarHBondContact N-O 3.22Å; L138-V184 PolarHBondContact O-N 2.7Å; L138-Y186 HydrophobicContact CB-CE2 4.33Å; L138-Y186 HydrophobicContact CD1-CE2 3.72Å; L138-Y186 HydrophobicContact CG-CD2 4.35Å; L138-Y186 HydrophobicContact CG-CE2 3.84Å; L138-A192 HydrophobicContact CD2-CB 4.46Å; L138-A192 HydrophobicContact CG-CB 4.47Å; L138-A195 HydrophobicContact CD1-CB 3.89Å; L138-R196 HydrophobicContact CD1-CB 4Å; L138-R196 HydrophobicContact CD2-CB 3.99Å; L138-R196 HydrophobicContact CD2-CG 4.45Å; L138-V213 HydrophobicContact CB-CG1 4.47Å; L138-V213 HydrophobicContact CD1-CG1 3.95Å; L138-D214 CarbonylContact C-O 3.57Å; L138-D214 WeakPolarHBondContact CA-O 3.26Å; L138-W215 HydrophobicContact CD2-CD2 4.2Å; L138-W215 HydrophobicContact CD2-CE3 3.51Å; L138-W215 HydrophobicContact CD2-CH2 4.36Å; L138-W215 HydrophobicContact CD2-CZ3 3.59Å
139	F	92.9	Very high	87.4	Confident	56 Å²	56	45.9 Å²	45.9	25%	0.246	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	130.8	162	171	-94.4	0	0	0	108.5	F181 F183 V213 D214	F139-F181 HydrophobicContact CD2-CB 4.5Å; F139-F181 HydrophobicContact CD2-CD2 4.34Å; F139-F181 HydrophobicContact CE2-CB 3.57Å; F139-F181 HydrophobicContact CE2-CD1 4.44Å; F139-F181 AromaticContact CE2-CD2 3.71Å; F139-F181 HydrophobicContact CE2-CD2 3.71Å; F139-F181 AromaticContact CE2-CG 3.67Å; F139-F181 HydrophobicContact CE2-CG 3.67Å; F139-F181 HydrophobicContact CZ-CB 3.74Å; F139-F181 HydrophobicContact CZ-CG 4.19Å; F139-F183 HydrophobicContact CB-CD1 4.15Å; F139-F183 HydrophobicContact CB-CE1 4.04Å; F139-F183 HydrophobicContact CD2-CD1 4.27Å; F139-F183 AromaticContact CD2-CE1 3.74Å; F139-F183 HydrophobicContact CD2-CE1 3.74Å; F139-F183 AromaticContact CD2-CZ 3.99Å; F139-F183 HydrophobicContact CD2-CZ 3.99Å; F139-F183 HydrophobicContact CG-CE1 4.39Å; F139-V213 WeakPolarHBondContact O-CA 3.48Å; F139-D214 PolarHBondContact N-O 2.87Å; F139-D214 PolarHBondContact O-N 3.19Å
140	I	91.2	Very high	87.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	106.2	174.4	-53.1	-170.3	0	0	0	109	I143 M156 F181 A182 V184 L199 I211 Q212 V213	I140-I143 HydrophobicContact CB-CD1 4.17Å; I140-I143 HydrophobicContact CG2-CD1 3.89Å; I140-I143 HydrophobicContact CG2-CG1 4.09Å; I140-M156 HydrophobicContact CD1-CE 3.4Å; I140-M156 HydrophobicContact CD1-SD 3.47Å; I140-M156 WeakPolarHBondContact CD1-SD 3.34Å; I140-F181 CarbonylContact O-C 3.55Å; I140-F181 WeakPolarHBondContact O-CA 3.38Å; I140-F181 WeakPolarHBondContact O-CB 3.32Å; I140-A182 PolarHBondContact N-O 3.08Å; I140-A182 PolarHBondContact O-N 3.01Å; I140-V184 HydrophobicContact CD1-CB 4.29Å; I140-V184 HydrophobicContact CD1-CG2 3.5Å; I140-V184 HydrophobicContact CG1-CG2 4.12Å; I140-L199 HydrophobicContact CD1-CD1 4.39Å; I140-I211 HydrophobicContact CG2-CB 4.03Å; I140-I211 HydrophobicContact CG2-CD1 4.05Å; I140-I211 HydrophobicContact CG2-CG2 4.19Å; I140-Q212 CarbonylContact C-O 3.51Å; I140-Q212 VanDerWaalsContact CA-O 3.31Å; I140-Q212 WeakPolarHBondContact CA-O 3.48Å; I140-V213 HydrophobicContact CG1-CG2 4.25Å; I140-V213 HydrophobicContact CG2-CG2 4.3Å
141	G	90	Very high	87.6	Confident	2 Å²	2	52.8 Å²	52.8	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	173.1	175.3	0	0	0	0	0	113.3	I143 I211 Q212	G141-I143 VanDerWaalsContact C-N 3.31Å; G141-I143 PolarHBondContact O-N 3.26Å; G141-I211 WeakPolarHBondContact O-CA 3.42Å; G141-Q212 PolarHBondContact N-O 3.08Å; G141-Q212 PolarHBondContact O-N 3.11Å
142	S	88	Confident	87.8	Confident	54 Å²	54	49 Å²	49	38%	0.378	24%	0.239	S	C	.	.	S	Bend	trans	63.4	28.5	-176.2	-56.9	0	0	0	0	114.9	G180 S210	S142-G180 PolarHBondContact N-O 3.09Å; S142-G180 VanDerWaalsContact N-O 3.07Å; S142-S210 WeakPolarHBondContact CB-O 3.45Å
143	I	89.8	Confident	88.3	Confident	6 Å²	6	50.2 Å²	50.2	3%	0.031	24%	0.244	C	C	.	.			trans	-76.6	138.4	174.8	-70.4	178.2	0	0	0	110.3	I140 G141 K147 I152 G180 A182 W207	I140-I143 HydrophobicContact CB-CD1 4.17Å; I140-I143 HydrophobicContact CG2-CD1 3.89Å; I140-I143 HydrophobicContact CG2-CG1 4.09Å; G141-I143 VanDerWaalsContact C-N 3.31Å; G141-I143 PolarHBondContact O-N 3.26Å; I143-K147 HydrophobicContact CG2-CB 4.37Å; I143-I152 HydrophobicContact CD1-CD1 4.49Å; I143-I152 HydrophobicContact CD1-CG2 4.31Å; I143-I152 HydrophobicContact CG2-CD1 4.02Å; I143-I152 HydrophobicContact CG2-CG1 4.33Å; I143-G180 PolarHBondContact N-O 3.08Å; I143-G180 WeakPolarHBondContact O-CA 3.12Å; I143-A182 HydrophobicContact CD1-CB 3.64Å; I143-W207 HydrophobicContact CG2-CZ3 4.1Å
144	P	89.3	Confident	89.1	Confident	19 Å²	19	49.6 Å²	49.6	12%	0.123	24%	0.238	C	C	.	.			trans	-59.2	134.4	173.4	-24.7	35.7	0	0	0	112.5	D146 K147 N178 W207	P144-D146 VanDerWaalsContact C-N 3.26Å; P144-D146 WeakPolarHBondContact CB-OD1 3.29Å; P144-D146 PolarHBondContact O-N 3.05Å; P144-K147 HydrophobicContact CB-CG 4.08Å; P144-K147 PolarHBondContact O-N 3.46Å; P144-N178 PolarHBondContact O-ND2 2.81Å; P144-W207 VanDerWaalsContact CD-CE3 3.5Å; P144-W207 HydrophobicContact CG-CB 4.47Å; P144-W207 HydrophobicContact CG-CE3 3.89Å
145	K	88.9	Confident	89.8	Confident	110 Å²	110	50.3 Å²	50.3	48%	0.478	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-11.2	-167	-66	-172.9	179.5	-180	0	114.9	R177 N178	K145-R177 HydrophobicContact CB-CB 4.49Å; K145-R177 CarbonylContact O-C 3.55Å; K145-R177 VanDerWaalsContact O-CA 3.25Å; K145-R177 WeakPolarHBondContact O-CA 3.26Å; K145-R177 WeakPolarHBondContact O-CB 3.47Å; K145-N178 PolarHBondContact O-N 3.41Å
146	D	88.3	Confident	90.1	Very high	97 Å²	97	49.3 Å²	49.3	52%	0.519	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-23.9	172.3	57.2	-67.5	0	0	0	113.4	P144	P144-D146 VanDerWaalsContact C-N 3.26Å; P144-D146 WeakPolarHBondContact CB-OD1 3.29Å; P144-D146 PolarHBondContact O-N 3.05Å
147	K	88.6	Confident	90.4	Very high	38 Å²	38	54.3 Å²	54.3	17%	0.165	26%	0.256	C	S	.	.			trans	-74.1	135.9	-168.8	-65	-72.3	160.3	-122.7	0	113.6	I143 P144 E151 I152 N178 W207	I143-K147 HydrophobicContact CG2-CB 4.37Å; P144-K147 HydrophobicContact CB-CG 4.08Å; P144-K147 PolarHBondContact O-N 3.46Å; K147-E151 HydrophobicContact CD-CB 4.18Å; K147-E151 WeakPolarHBondContact CD-OE2 3.1Å; K147-E151 WeakPolarHBondContact CE-OE2 3.12Å; K147-E151 IonicContact NZ-OE2 3.08Å; K147-E151 PolarHBondContact NZ-OE2 3.23Å; K147-I152 HydrophobicContact CB-CD1 4.19Å; K147-I152 HydrophobicContact CB-CG1 4.06Å; K147-N178 PolarHBondContact O-ND2 2.82Å; K147-W207 HydrophobicContact CB-CH2 4.47Å; K147-W207 HydrophobicContact CD-CD2 4.17Å; K147-W207 HydrophobicContact CD-CH2 4.37Å; K147-W207 HydrophobicContact CD-CZ2 3.99Å; K147-W207 HydrophobicContact CG-CD2 4.28Å; K147-W207 HydrophobicContact CG-CE3 4.14Å; K147-W207 HydrophobicContact CG-CH2 4.18Å; K147-W207 HydrophobicContact CG-CZ2 4.31Å; K147-W207 HydrophobicContact CG-CZ3 4.08Å
148	K	90.1	Very high	90.3	Very high	140 Å²	140	58.2 Å²	58.2	61%	0.609	27%	0.274	S	S	*	.			trans	-91.1	166.5	176	-63.5	-178.1	-179.9	176.6	0	112.6	E150 E151 I152	K148-E150 WeakPolarHBondContact CB-OE2 3.45Å; K148-E150 PolarHBondContact O-N 2.93Å; K148-E151 PolarHBondContact N-OE1 3.1Å; K148-E151 VanDerWaalsContact N-OE1 3.12Å; K148-E151 PolarHBondContact O-N 3.19Å; K148-I152 WeakPolarHBondContact O-CD1 3.23Å; K148-I152 VanDerWaalsContact O-CG1 3.28Å; K148-I152 WeakPolarHBondContact O-CG1 3.42Å; K148-I152 PolarHBondContact O-N 3.25Å; K148-I152 VanDerWaalsContact O-N 3.08Å
149	K	90.3	Very high	90.1	Very high	71 Å²	71	60.4 Å²	60.4	31%	0.309	29%	0.287	S	S	.	.	H	α-helix	trans	-52.9	-40.7	178.1	166.2	175.3	174.6	137.6	0	112	I152 M153 D165 V166 V168	K149-I152 PolarHBondContact O-N 3.11Å; K149-M153 WeakPolarHBondContact O-CB 3.27Å; K149-M153 PolarHBondContact O-N 3.32Å; K149-D165 VanDerWaalsContact CE-OD1 3.25Å; K149-D165 WeakPolarHBondContact CE-OD1 3.41Å; K149-D165 IonicContact NZ-OD1 3.22Å; K149-D165 PolarHBondContact NZ-OD1 3.13Å; K149-D165 IonicContact NZ-OD2 3.63Å; K149-D165 PolarHBondContact NZ-OD2 3.37Å; K149-V166 VanDerWaalsContact CD-O 3.25Å; K149-V166 WeakPolarHBondContact CD-O 3.32Å; K149-V166 WeakPolarHBondContact CE-O 3.36Å; K149-V166 HydrophobicContact CG-CB 4.4Å; K149-V166 PolarHBondContact NZ-O 2.89Å; K149-V168 HydrophobicContact CB-CG2 3.92Å
150	E	91.8	Very high	89.9	Confident	117 Å²	117	58 Å²	58	55%	0.547	28%	0.278	S	S	.	.	H	α-helix	trans	-70	-47.6	-173.9	-61.1	64.4	-137	0	0	110.7	K148 I152 M153 E154	K148-E150 WeakPolarHBondContact CB-OE2 3.45Å; K148-E150 PolarHBondContact O-N 2.93Å; E150-I152 VanDerWaalsContact C-N 3.34Å; E150-I152 PolarHBondContact O-N 2.88Å; E150-M153 PolarHBondContact O-N 3.26Å; E150-E154 PolarHBondContact O-N 3.46Å
151	E	91.6	Very high	89.8	Confident	72 Å²	72	64.9 Å²	64.9	34%	0.336	31%	0.314	S	S	.	.	H	α-helix	trans	-60.1	-42.1	173.9	-68.3	172	-88.1	0	0	111.7	K147 K148 E155	K147-E151 HydrophobicContact CD-CB 4.18Å; K147-E151 WeakPolarHBondContact CD-OE2 3.1Å; K147-E151 WeakPolarHBondContact CE-OE2 3.12Å; K147-E151 IonicContact NZ-OE2 3.08Å; K147-E151 PolarHBondContact NZ-OE2 3.23Å; K148-E151 PolarHBondContact N-OE1 3.1Å; K148-E151 VanDerWaalsContact N-OE1 3.12Å; K148-E151 PolarHBondContact O-N 3.19Å; E151-E155 WeakPolarHBondContact O-CB 3.4Å; E151-E155 PolarHBondContact O-N 3.17Å; E151-E155 VanDerWaalsContact O-N 3.08Å
152	I	90.9	Very high	89.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-66.4	-42.3	177.3	-61.8	157	0	0	0	110.2	I143 K147 K148 K149 E150 M156 V166 V168 A182 W207	I143-I152 HydrophobicContact CD1-CD1 4.49Å; I143-I152 HydrophobicContact CD1-CG2 4.31Å; I143-I152 HydrophobicContact CG2-CD1 4.02Å; I143-I152 HydrophobicContact CG2-CG1 4.33Å; K147-I152 HydrophobicContact CB-CD1 4.19Å; K147-I152 HydrophobicContact CB-CG1 4.06Å; K148-I152 WeakPolarHBondContact O-CD1 3.23Å; K148-I152 VanDerWaalsContact O-CG1 3.28Å; K148-I152 WeakPolarHBondContact O-CG1 3.42Å; K148-I152 PolarHBondContact O-N 3.25Å; K148-I152 VanDerWaalsContact O-N 3.08Å; K149-I152 PolarHBondContact O-N 3.11Å; E150-I152 VanDerWaalsContact C-N 3.34Å; E150-I152 PolarHBondContact O-N 2.88Å; I152-M156 HydrophobicContact CG2-CG 4.2Å; I152-M156 VanDerWaalsContact O-CB 3.3Å; I152-M156 WeakPolarHBondContact O-CB 3.45Å; I152-M156 WeakPolarHBondContact O-CG 3.17Å; I152-M156 PolarHBondContact O-N 3.04Å; I152-V166 HydrophobicContact CB-CG1 4.28Å; I152-V166 HydrophobicContact CG2-CG1 3.76Å; I152-V168 HydrophobicContact CD1-CG1 4.41Å; I152-V168 HydrophobicContact CD1-CG2 3.72Å; I152-A182 HydrophobicContact CD1-CB 4.47Å; I152-A182 HydrophobicContact CG2-CB 4.32Å; I152-W207 HydrophobicContact CB-CH2 4.3Å; I152-W207 HydrophobicContact CG1-CH2 3.71Å; I152-W207 HydrophobicContact CG1-CZ3 4.46Å
153	M	92.2	Very high	89.9	Confident	39 Å²	39	63.8 Å²	63.8	19%	0.192	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-42	177.8	-169.5	-166.2	-130.5	0	0	112.2	K149 E150 K157 V163 V164 V166	K149-M153 WeakPolarHBondContact O-CB 3.27Å; K149-M153 PolarHBondContact O-N 3.32Å; E150-M153 PolarHBondContact O-N 3.26Å; M153-K157 HydrophobicContact CG-CD 4.14Å; M153-K157 WeakPolarHBondContact O-CB 3.2Å; M153-K157 VanDerWaalsContact O-CG 3.31Å; M153-K157 WeakPolarHBondContact O-CG 3.26Å; M153-K157 PolarHBondContact O-N 2.93Å; M153-K157 VanDerWaalsContact O-N 3.09Å; M153-K157 PolarHBondContact SD-NZ 2.82Å; M153-V163 HydrophobicContact CG-CG1 4.34Å; M153-V164 WeakPolarHBondContact CE-O 3.31Å; M153-V166 HydrophobicContact CB-CB 4.45Å; M153-V166 HydrophobicContact CB-CG2 3.81Å; M153-V166 HydrophobicContact CG-CG2 4.04Å
154	E	91.6	Very high	90	Very high	117 Å²	117	67.6 Å²	67.6	55%	0.547	33%	0.332	S	S	.	.	H	α-helix	trans	-64.2	-47.8	178.9	-162.3	-160.4	118.9	0	0	111.2	E150 M156 K157 K158	E150-E154 PolarHBondContact O-N 3.46Å; E154-M156 PolarHBondContact O-N 3.18Å; E154-K157 PolarHBondContact O-N 3.26Å; E154-K158 WeakPolarHBondContact O-CG 3.41Å; E154-K158 PolarHBondContact O-N 3.16Å; E154-K158 WeakPolarHBondContact OE1-CE 3.43Å; E154-K158 IonicContact OE1-NZ 3.15Å; E154-K158 PolarHBondContact OE1-NZ 3.31Å
155	E	88.9	Confident	90	Very high	53 Å²	53	69.1 Å²	69.1	25%	0.248	34%	0.339	C	S	.	.	H	α-helix	trans	-66.7	-38.8	-178.8	-154.9	66.8	-168.4	0	0	112	E151 K157 K158 L206 W207	E151-E155 WeakPolarHBondContact O-CB 3.4Å; E151-E155 PolarHBondContact O-N 3.17Å; E151-E155 VanDerWaalsContact O-N 3.08Å; E155-K157 VanDerWaalsContact C-N 3.3Å; E155-K157 PolarHBondContact O-N 2.92Å; E155-K158 PolarHBondContact O-N 3.25Å; E155-K158 WeakPolarHBondContact OE2-CD 3.38Å; E155-K158 IonicContact OE2-NZ 3.89Å; E155-K158 PolarHBondContact OE2-NZ 3.35Å; E155-L206 HydrophobicContact CB-CD1 4.19Å; E155-L206 HydrophobicContact CG-CD1 3.51Å; E155-L206 HydrophobicContact CG-CG 4.35Å; E155-W207 HydrophobicContact CB-CH2 4.45Å; E155-W207 HydrophobicContact CB-CZ2 3.74Å; E155-W207 HydrophobicContact CG-CZ2 4.05Å
156	M	89.4	Confident	90.1	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-64.3	-33.3	174.4	-70.8	-60.3	-50.2	0	0	112.8	I140 I152 E154 V159 T160 V163 V184 Y186 L199 L206	I140-M156 HydrophobicContact CD1-CE 3.4Å; I140-M156 HydrophobicContact CD1-SD 3.47Å; I140-M156 WeakPolarHBondContact CD1-SD 3.34Å; I152-M156 HydrophobicContact CG2-CG 4.2Å; I152-M156 VanDerWaalsContact O-CB 3.3Å; I152-M156 WeakPolarHBondContact O-CB 3.45Å; I152-M156 WeakPolarHBondContact O-CG 3.17Å; I152-M156 PolarHBondContact O-N 3.04Å; E154-M156 PolarHBondContact O-N 3.18Å; M156-V159 PolarHBondContact O-N 3.48Å; M156-T160 HydrophobicContact CE-CG2 4.4Å; M156-T160 PolarHBondContact O-N 2.91Å; M156-T160 PolarHBondContact O-OG1 2.9Å; M156-V163 HydrophobicContact CB-CG2 4.33Å; M156-V184 HydrophobicContact CE-CG1 4.38Å; M156-V184 HydrophobicContact CE-CG2 4.2Å; M156-V184 HydrophobicContact CG-CG2 4.03Å; M156-V184 HydrophobicContact SD-CG2 4.43Å; M156-Y186 VanDerWaalsContact CE-OH 3.26Å; M156-Y186 WeakPolarHBondContact CE-OH 3.32Å; M156-L199 HydrophobicContact CE-CD1 3.71Å; M156-L206 HydrophobicContact SD-CD2 4.47Å
157	K	91.4	Very high	90.2	Very high	108 Å²	108	60.7 Å²	60.7	47%	0.47	30%	0.299	S	S	.	.	H	α-helix	trans	-73.6	-20.9	175.8	-78.9	174.7	175	176.9	0	114	M153 E154 E155 V159 V163	M153-K157 HydrophobicContact CG-CD 4.14Å; M153-K157 WeakPolarHBondContact O-CB 3.2Å; M153-K157 VanDerWaalsContact O-CG 3.31Å; M153-K157 WeakPolarHBondContact O-CG 3.26Å; M153-K157 PolarHBondContact O-N 2.93Å; M153-K157 VanDerWaalsContact O-N 3.09Å; M153-K157 PolarHBondContact SD-NZ 2.82Å; E154-K157 PolarHBondContact O-N 3.26Å; E155-K157 VanDerWaalsContact C-N 3.3Å; E155-K157 PolarHBondContact O-N 2.92Å; K157-V159 VanDerWaalsContact C-N 3.3Å; K157-V163 WeakPolarHBondContact CE-O 3.44Å; K157-V163 HydrophobicContact CG-CB 3.87Å; K157-V163 HydrophobicContact CG-CG1 4.27Å; K157-V163 HydrophobicContact CG-CG2 4.39Å
158	K	89.6	Confident	90.2	Very high	122 Å²	122	60.3 Å²	60.3	53%	0.53	30%	0.3	S	S	.	.	H	α-helix	trans	-74.1	-22.5	172.8	-65.7	167.2	-161.5	167.4	0	112.9	E154 E155	E154-K158 WeakPolarHBondContact O-CG 3.41Å; E154-K158 PolarHBondContact O-N 3.16Å; E154-K158 WeakPolarHBondContact OE1-CE 3.43Å; E154-K158 IonicContact OE1-NZ 3.15Å; E154-K158 PolarHBondContact OE1-NZ 3.31Å; E155-K158 PolarHBondContact O-N 3.25Å; E155-K158 WeakPolarHBondContact OE2-CD 3.38Å; E155-K158 IonicContact OE2-NZ 3.89Å; E155-K158 PolarHBondContact OE2-NZ 3.35Å
159	V	86.6	Confident	90	Very high	46 Å²	46	56.9 Å²	56.9	28%	0.279	28%	0.284	S	S	.	.	H	α-helix	trans	-116.5	-24.8	-169.4	-177.6	0	0	0	0	112.5	M156 K157 T198 L199 F204	M156-V159 PolarHBondContact O-N 3.48Å; K157-V159 VanDerWaalsContact C-N 3.3Å; V159-T198 HydrophobicContact CG1-CG2 4.17Å; V159-L199 HydrophobicContact CG1-CD2 3.77Å; V159-F204 HydrophobicContact CB-CE2 4.36Å; V159-F204 HydrophobicContact CB-CZ 4.34Å; V159-F204 HydrophobicContact CG1-CD2 4.27Å; V159-F204 HydrophobicContact CG1-CE2 3.63Å; V159-F204 HydrophobicContact CG1-CZ 3.86Å; V159-F204 HydrophobicContact CG2-CE2 3.8Å; V159-F204 HydrophobicContact CG2-CZ 3.85Å
160	T	89.4	Confident	89.7	Confident	7 Å²	7	55.7 Å²	55.7	4%	0.043	28%	0.283	C	S	.	.			trans	-140.2	129.8	-176.3	63.6	0	0	0	0	112.7	M156 V163 Y186 A195 L199	M156-T160 HydrophobicContact CE-CG2 4.4Å; M156-T160 PolarHBondContact O-N 2.91Å; M156-T160 PolarHBondContact O-OG1 2.9Å; T160-V163 WeakPolarHBondContact OG1-CG2 3.19Å; T160-Y186 PolarHBondContact OG1-OH 2.97Å; T160-A195 HydrophobicContact CG2-CB 3.63Å; T160-L199 HydrophobicContact CG2-CD1 3.93Å; T160-L199 HydrophobicContact CG2-CD2 4.16Å; T160-L199 HydrophobicContact CG2-CG 4.02Å
161	D	88.8	Confident	89.2	Confident	144 Å²	144	51.2 Å²	51.2	77%	0.77	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	157.9	177.4	-55	-67.2	0	0	0	112.8	V163 Y186	D161-V163 PolarHBondContact O-N 2.91Å; D161-Y186 WeakPolarHBondContact O-CD1 3.47Å; D161-Y186 WeakPolarHBondContact O-CE1 3.16Å
162	G	88.8	Confident	88.1	Confident	21 Å²	21	50.4 Å²	50.4	22%	0.216	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	17.2	170.3	0	0	0	0	0	115.7	V164 Y186 E187	G162-V164 PolarHBondContact O-N 2.76Å; G162-Y186 CarbonylContact O-C 3.58Å; G162-Y186 WeakPolarHBondContact O-CA 3.48Å; G162-E187 PolarHBondContact O-N 3Å
163	V	92.8	Very high	87.3	Confident	11 Å²	11	58 Å²	58	7%	0.067	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	113.2	175	176.5	0	0	0	0	110.7	M153 M156 K157 T160 D161 V166 V184 Y186	M153-V163 HydrophobicContact CG-CG1 4.34Å; M156-V163 HydrophobicContact CB-CG2 4.33Å; K157-V163 WeakPolarHBondContact CE-O 3.44Å; K157-V163 HydrophobicContact CG-CB 3.87Å; K157-V163 HydrophobicContact CG-CG1 4.27Å; K157-V163 HydrophobicContact CG-CG2 4.39Å; T160-V163 WeakPolarHBondContact OG1-CG2 3.19Å; D161-V163 PolarHBondContact O-N 2.91Å; V163-V166 HydrophobicContact CG1-CG2 4.35Å; V163-V184 HydrophobicContact CG1-CG1 3.82Å; V163-V184 HydrophobicContact CG2-CG1 4.04Å; V163-Y186 HydrophobicContact CG2-CD1 4.06Å; V163-Y186 HydrophobicContact CG2-CE1 3.43Å; V163-Y186 VanDerWaalsContact CG2-CE1 3.43Å
164	V	90.6	Very high	86.6	Confident	86 Å²	86	58.9 Å²	58.9	52%	0.521	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-51.9	-179.9	172.7	0	0	0	0	111.5	M153 G162 E185 E187	M153-V164 WeakPolarHBondContact CE-O 3.31Å; G162-V164 PolarHBondContact O-N 2.76Å; V164-E185 PolarHBondContact N-O 3Å; V164-E187 HydrophobicContact CG2-CB 3.87Å
165	D	89.2	Confident	85.8	Confident	52 Å²	52	56.6 Å²	56.6	28%	0.278	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	160.8	178.7	-163.9	35.8	0	0	0	113.5	K149 E185	K149-D165 VanDerWaalsContact CE-OD1 3.25Å; K149-D165 WeakPolarHBondContact CE-OD1 3.41Å; K149-D165 IonicContact NZ-OD1 3.22Å; K149-D165 PolarHBondContact NZ-OD1 3.13Å; K149-D165 IonicContact NZ-OD2 3.63Å; K149-D165 PolarHBondContact NZ-OD2 3.37Å; D165-E185 PolarHBondContact N-O 3.29Å; D165-E185 VanDerWaalsContact N-O 3.16Å; D165-E185 PolarHBondContact O-N 2.78Å
166	V	91.3	Very high	85.3	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.1	169.1	-177.6	0	0	0	0	109.9	K149 I152 M153 V163 V168 A182 F183 V184	K149-V166 VanDerWaalsContact CD-O 3.25Å; K149-V166 WeakPolarHBondContact CD-O 3.32Å; K149-V166 WeakPolarHBondContact CE-O 3.36Å; K149-V166 HydrophobicContact CG-CB 4.4Å; K149-V166 PolarHBondContact NZ-O 2.89Å; I152-V166 HydrophobicContact CB-CG1 4.28Å; I152-V166 HydrophobicContact CG2-CG1 3.76Å; M153-V166 HydrophobicContact CB-CB 4.45Å; M153-V166 HydrophobicContact CB-CG2 3.81Å; M153-V166 HydrophobicContact CG-CG2 4.04Å; V163-V166 HydrophobicContact CG1-CG2 4.35Å; V166-V168 HydrophobicContact CG1-CG2 3.83Å; V166-A182 HydrophobicContact CG1-CB 4Å; V166-F183 CarbonylContact C-O 3.55Å; V166-F183 WeakPolarHBondContact CA-O 3.43Å; V166-V184 HydrophobicContact CG1-CG2 4.47Å; V166-V184 HydrophobicContact CG2-CG1 4.32Å; V166-V184 HydrophobicContact CG2-CG2 4.21Å
167	I	90.1	Very high	85.1	Confident	29 Å²	29	64.6 Å²	64.6	15%	0.149	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	108.3	177.9	-52.9	173.5	0	0	0	108.4	Y169 F183	I167-Y169 HydrophobicContact CG2-CD2 4.44Å; I167-Y169 HydrophobicContact CG2-CE2 3.72Å; I167-F183 HydrophobicContact CB-CB 4.35Å; I167-F183 PolarHBondContact N-O 2.86Å; I167-F183 PolarHBondContact O-N 2.69Å
168	V	89.9	Confident	84.9	Confident	31 Å²	31	59.8 Å²	59.8	19%	0.188	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.8	177.1	-170.8	0	0	0	0	109	K149 I152 V166 N178 A182	K149-V168 HydrophobicContact CB-CG2 3.92Å; I152-V168 HydrophobicContact CD1-CG1 4.41Å; I152-V168 HydrophobicContact CD1-CG2 3.72Å; V166-V168 HydrophobicContact CG1-CG2 3.83Å; V168-N178 HydrophobicContact CG1-CB 3.5Å; V168-N178 VanDerWaalsContact CG1-CB 3.5Å; V168-A182 HydrophobicContact CG2-CB 4.03Å
169	Y	84.6	Confident	84.8	Confident	67 Å²	67	57.8 Å²	57.8	26%	0.263	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.2	176.1	-70.2	-87.8	0	0	0	110.4	I167 R179 F181 F183	I167-Y169 HydrophobicContact CG2-CD2 4.44Å; I167-Y169 HydrophobicContact CG2-CE2 3.72Å; Y169-R179 WeakPolarHBondContact O-CG 3.49Å; Y169-R179 PolarHBondContact O-N 2.82Å; Y169-R179 VanDerWaalsContact O-N 3.1Å; Y169-F181 AromaticContact CD2-CE2 3.97Å; Y169-F181 HydrophobicContact CD2-CE2 3.97Å; Y169-F183 HydrophobicContact CD2-CD2 4.37Å; Y169-F183 HydrophobicContact CD2-CE2 4.27Å; Y169-F183 AromaticContact CE2-CD2 3.84Å; Y169-F183 HydrophobicContact CE2-CD2 3.84Å; Y169-F183 AromaticContact CE2-CE2 3.78Å; Y169-F183 HydrophobicContact CE2-CE2 3.78Å
170	P	83.3	Confident	84.8	Confident	47 Å²	47	56.1 Å²	56.1	31%	0.305	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	145.5	170.9	-23.6	33.9	0	0	0	111.7	R177 R179	P170-R177 CarbonylContact C-O 3.49Å; P170-R177 WeakPolarHBondContact CA-O 3.36Å; P170-R179 VanDerWaalsContact O-CZ 3.28Å; P170-R179 PolarHBondContact O-NE 2.93Å; P170-R179 PolarHBondContact O-NH2 3.4Å
171	S	81.3	Confident	84.9	Confident	23 Å²	23	58.4 Å²	58.4	16%	0.161	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-61	138	173.1	178	0	0	0	0	110.1	M173 D174 R177	S171-M173 PolarHBondContact O-N 2.84Å; S171-M173 PolarHBondContact OG-N 2.9Å; S171-D174 WeakPolarHBondContact CB-O 3.35Å; S171-D174 CarbonylContact O-C 3.56Å; S171-D174 PolarHBondContact O-N 2.86Å; S171-R177 PolarHBondContact N-O 3.16Å
172	S	70.1	Confident	85	Confident	54 Å²	54	51.5 Å²	51.5	38%	0.378	28%	0.276	S	S	.	.	S	Bend	trans	-66.4	-21	174.6	47.9	0	0	0	0	112.9
173	M	73.3	Confident	85.3	Confident	159 Å²	159	52.7 Å²	52.7	78%	0.783	28%	0.275	S	S	*	.	S	Bend	trans	-91	-35.9	177.4	-58.8	-179.2	73.5	0	0	112.7	S171	S171-M173 PolarHBondContact O-N 2.84Å; S171-M173 PolarHBondContact OG-N 2.9Å
174	D	77.1	Confident	85.3	Confident	58 Å²	58	52.2 Å²	52.2	31%	0.31	27%	0.272	S	S	.	.			trans	-137.7	105.8	-178.2	-57.3	-76.9	0	0	0	110.4	S171 S176 R177	S171-D174 WeakPolarHBondContact CB-O 3.35Å; S171-D174 CarbonylContact O-C 3.56Å; S171-D174 PolarHBondContact O-N 2.86Å; D174-S176 PolarHBondContact O-N 2.9Å; D174-S176 VanDerWaalsContact O-N 3.1Å; D174-R177 HydrophobicContact CB-CB 4.16Å; D174-R177 HydrophobicContact CB-CG 3.98Å; D174-R177 PolarHBondContact O-N 3.1Å; D174-R177 IonicContact OD2-CZ 3.78Å; D174-R177 IonicContact OD2-NE 2.62Å; D174-R177 PolarHBondContact OD2-NE 3.3Å; D174-R177 IonicContact OD2-NH2 2.89Å; D174-R177 PolarHBondContact OD2-NH2 2.65Å
175	K	75.8	Confident	85.3	Confident	69 Å²	69	49.5 Å²	49.5	30%	0.3	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-11.1	-179.5	-65.7	-170.7	173.5	-178.5	0	114.4	N237 L238 M239 A294	K175-N237 WeakPolarHBondContact CE-OD1 3.4Å; K175-N237 PolarHBondContact NZ-O 3Å; K175-L238 WeakPolarHBondContact CE-O 3.26Å; K175-L238 PolarHBondContact NZ-O 3.47Å; K175-M239 HydrophobicContact CD-SD 3.84Å; K175-M239 VanDerWaalsContact CE-SD 3.5Å; K175-M239 PolarHBondContact NZ-SD 2.96Å; K175-A294 HydrophobicContact CD-CB 4.22Å
176	S	78.8	Confident	85.4	Confident	103 Å²	103	47 Å²	47	72%	0.72	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-12.9	170.7	54.3	0	0	0	0	114.1	D174	D174-S176 PolarHBondContact O-N 2.9Å; D174-S176 VanDerWaalsContact O-N 3.1Å
177	R	84.6	Confident	85.1	Confident	120 Å²	120	52.9 Å²	52.9	45%	0.453	27%	0.268	S	S	.	.	S	Bend	trans	-117.2	148.5	-176.2	-57.5	-160	-70.5	172	-6.1	111.4	K145 P170 S171 D174	K145-R177 HydrophobicContact CB-CB 4.49Å; K145-R177 CarbonylContact O-C 3.55Å; K145-R177 VanDerWaalsContact O-CA 3.25Å; K145-R177 WeakPolarHBondContact O-CA 3.26Å; K145-R177 WeakPolarHBondContact O-CB 3.47Å; P170-R177 CarbonylContact C-O 3.49Å; P170-R177 WeakPolarHBondContact CA-O 3.36Å; S171-R177 PolarHBondContact N-O 3.16Å; D174-R177 HydrophobicContact CB-CB 4.16Å; D174-R177 HydrophobicContact CB-CG 3.98Å; D174-R177 PolarHBondContact O-N 3.1Å; D174-R177 IonicContact OD2-CZ 3.78Å; D174-R177 IonicContact OD2-NE 2.62Å; D174-R177 PolarHBondContact OD2-NE 3.3Å; D174-R177 IonicContact OD2-NH2 2.89Å; D174-R177 PolarHBondContact OD2-NH2 2.65Å
178	N	87.9	Confident	84.8	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.032	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	167	170.8	74	60.1	0	0	0	112.1	P144 K145 K147 V168 G180	P144-N178 PolarHBondContact O-ND2 2.81Å; K145-N178 PolarHBondContact O-N 3.41Å; K147-N178 PolarHBondContact O-ND2 2.82Å; V168-N178 HydrophobicContact CG1-CB 3.5Å; V168-N178 VanDerWaalsContact CG1-CB 3.5Å; N178-G180 PolarHBondContact O-N 3.3Å; N178-G180 VanDerWaalsContact OD1-CA 3.32Å; N178-G180 WeakPolarHBondContact OD1-CA 3.13Å; N178-G180 PolarHBondContact OD1-N 3.2Å
179	R	85.9	Confident	84.5	Confident	80 Å²	80	54.8 Å²	54.8	30%	0.302	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-1.6	-179.6	-71.9	-179.4	-164.2	-167.8	4.3	115.3	Y169 P170 F181 D267	Y169-R179 WeakPolarHBondContact O-CG 3.49Å; Y169-R179 PolarHBondContact O-N 2.82Å; Y169-R179 VanDerWaalsContact O-N 3.1Å; P170-R179 VanDerWaalsContact O-CZ 3.28Å; P170-R179 PolarHBondContact O-NE 2.93Å; P170-R179 PolarHBondContact O-NH2 3.4Å; R179-F181 HydrophobicContact CB-CD1 3.82Å; R179-F181 HydrophobicContact CB-CE1 3.43Å; R179-F181 VanDerWaalsContact CB-CE1 3.43Å; R179-F181 HydrophobicContact CB-CZ 4.02Å; R179-F181 HydrophobicContact CG-CE1 4.37Å; R179-D267 IonicContact CZ-OD2 2.68Å; R179-D267 IonicContact NH1-OD2 3.97Å; R179-D267 PolarHBondContact NH1-OD2 3.4Å; R179-D267 IonicContact NH2-OD2 3.71Å; R179-D267 PolarHBondContact NH2-OD2 2.98Å
180	G	86.9	Confident	84.4	Confident	12 Å²	12	58.1 Å²	58.1	12%	0.124	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	90.8	10.5	-173.3	0	0	0	0	0	114.1	S142 I143 N178	S142-G180 PolarHBondContact N-O 3.09Å; S142-G180 VanDerWaalsContact N-O 3.07Å; I143-G180 PolarHBondContact N-O 3.08Å; I143-G180 WeakPolarHBondContact O-CA 3.12Å; N178-G180 PolarHBondContact O-N 3.3Å; N178-G180 VanDerWaalsContact OD1-CA 3.32Å; N178-G180 WeakPolarHBondContact OD1-CA 3.13Å; N178-G180 PolarHBondContact OD1-N 3.2Å
181	F	91.5	Very high	84.6	Confident	54 Å²	54	56.5 Å²	56.5	24%	0.237	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	158.8	177	66.8	-95.8	0	0	0	111.6	F139 I140 Y169 R179 F183	F139-F181 HydrophobicContact CD2-CB 4.5Å; F139-F181 HydrophobicContact CD2-CD2 4.34Å; F139-F181 HydrophobicContact CE2-CB 3.57Å; F139-F181 HydrophobicContact CE2-CD1 4.44Å; F139-F181 AromaticContact CE2-CD2 3.71Å; F139-F181 HydrophobicContact CE2-CD2 3.71Å; F139-F181 AromaticContact CE2-CG 3.67Å; F139-F181 HydrophobicContact CE2-CG 3.67Å; F139-F181 HydrophobicContact CZ-CB 3.74Å; F139-F181 HydrophobicContact CZ-CG 4.19Å; I140-F181 CarbonylContact O-C 3.55Å; I140-F181 WeakPolarHBondContact O-CA 3.38Å; I140-F181 WeakPolarHBondContact O-CB 3.32Å; Y169-F181 AromaticContact CD2-CE2 3.97Å; Y169-F181 HydrophobicContact CD2-CE2 3.97Å; R179-F181 HydrophobicContact CB-CD1 3.82Å; R179-F181 HydrophobicContact CB-CE1 3.43Å; R179-F181 VanDerWaalsContact CB-CE1 3.43Å; R179-F181 HydrophobicContact CB-CZ 4.02Å; R179-F181 HydrophobicContact CG-CE1 4.37Å; F181-F183 HydrophobicContact CD2-CE2 4.19Å; F181-F183 AromaticContact CE2-CE2 3.86Å; F181-F183 HydrophobicContact CE2-CE2 3.86Å; F181-F183 HydrophobicContact CE2-CZ 4.49Å
182	A	92.3	Very high	85.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	161.1	171.1	0	0	0	0	0	110	I140 I143 I152 V166 V168	I140-A182 PolarHBondContact N-O 3.08Å; I140-A182 PolarHBondContact O-N 3.01Å; I143-A182 HydrophobicContact CD1-CB 3.64Å; I152-A182 HydrophobicContact CD1-CB 4.47Å; I152-A182 HydrophobicContact CG2-CB 4.32Å; V166-A182 HydrophobicContact CG1-CB 4Å; V168-A182 HydrophobicContact CG2-CB 4.03Å
183	F	93.3	Very high	85.9	Confident	46 Å²	46	53.7 Å²	53.7	20%	0.202	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.3	162.7	-61.7	-87.8	0	0	0	109.3	R137 L138 F139 V166 I167 Y169 F181 A216	R137-F183 HydrophobicContact CG-CB 4.04Å; R137-F183 HydrophobicContact CG-CD1 4.49Å; L138-F183 CarbonylContact O-C 3.59Å; L138-F183 VanDerWaalsContact O-CA 3.26Å; L138-F183 WeakPolarHBondContact O-CA 3.49Å; F139-F183 HydrophobicContact CB-CD1 4.15Å; F139-F183 HydrophobicContact CB-CE1 4.04Å; F139-F183 HydrophobicContact CD2-CD1 4.27Å; F139-F183 AromaticContact CD2-CE1 3.74Å; F139-F183 HydrophobicContact CD2-CE1 3.74Å; F139-F183 AromaticContact CD2-CZ 3.99Å; F139-F183 HydrophobicContact CD2-CZ 3.99Å; F139-F183 HydrophobicContact CG-CE1 4.39Å; V166-F183 CarbonylContact C-O 3.55Å; V166-F183 WeakPolarHBondContact CA-O 3.43Å; I167-F183 HydrophobicContact CB-CB 4.35Å; I167-F183 PolarHBondContact N-O 2.86Å; I167-F183 PolarHBondContact O-N 2.69Å; Y169-F183 HydrophobicContact CD2-CD2 4.37Å; Y169-F183 HydrophobicContact CD2-CE2 4.27Å; Y169-F183 AromaticContact CE2-CD2 3.84Å; Y169-F183 HydrophobicContact CE2-CD2 3.84Å; Y169-F183 AromaticContact CE2-CE2 3.78Å; Y169-F183 HydrophobicContact CE2-CE2 3.78Å; F181-F183 HydrophobicContact CD2-CE2 4.19Å; F181-F183 AromaticContact CE2-CE2 3.86Å; F181-F183 HydrophobicContact CE2-CE2 3.86Å; F181-F183 HydrophobicContact CE2-CZ 4.49Å; F183-A216 HydrophobicContact CD1-CB 3.74Å; F183-A216 HydrophobicContact CE1-CB 3.93Å
184	V	92.6	Very high	86.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.9	175.8	-175.6	0	0	0	0	108.3	R137 L138 I140 M156 V163 V166 Y186	R137-V184 CarbonylContact C-O 3.6Å; R137-V184 WeakPolarHBondContact CA-O 3.32Å; L138-V184 PolarHBondContact N-O 3.22Å; L138-V184 PolarHBondContact O-N 2.7Å; I140-V184 HydrophobicContact CD1-CB 4.29Å; I140-V184 HydrophobicContact CD1-CG2 3.5Å; I140-V184 HydrophobicContact CG1-CG2 4.12Å; M156-V184 HydrophobicContact CE-CG1 4.38Å; M156-V184 HydrophobicContact CE-CG2 4.2Å; M156-V184 HydrophobicContact CG-CG2 4.03Å; M156-V184 HydrophobicContact SD-CG2 4.43Å; V163-V184 HydrophobicContact CG1-CG1 3.82Å; V163-V184 HydrophobicContact CG2-CG1 4.04Å; V166-V184 HydrophobicContact CG1-CG2 4.47Å; V166-V184 HydrophobicContact CG2-CG1 4.32Å; V166-V184 HydrophobicContact CG2-CG2 4.21Å; V184-Y186 HydrophobicContact CB-CE2 3.97Å; V184-Y186 HydrophobicContact CG1-CD2 4.28Å; V184-Y186 HydrophobicContact CG1-CE2 3.55Å
185	E	91.1	Very high	87.2	Confident	29 Å²	29	47.5 Å²	47.5	14%	0.136	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.7	-179.5	-176.1	152.7	171.1	0	0	111.1	R54 R137 V164 D165	R54-E185 IonicContact CZ-OE1 3.74Å; R54-E185 VanDerWaalsContact CZ-OE1 3.23Å; R54-E185 IonicContact NH1-OE1 2.78Å; R54-E185 PolarHBondContact NH1-OE1 3.36Å; R54-E185 IonicContact NH2-OE1 2.67Å; R54-E185 PolarHBondContact NH2-OE1 2.84Å; R137-E185 HydrophobicContact CG-CB 4.45Å; R137-E185 IonicContact CZ-OE2 2.74Å; R137-E185 IonicContact NE-OE2 2.73Å; R137-E185 PolarHBondContact NE-OE2 3.48Å; R137-E185 IonicContact NH2-OE2 3.48Å; R137-E185 PolarHBondContact NH2-OE2 3.41Å; V164-E185 PolarHBondContact N-O 3Å; D165-E185 PolarHBondContact N-O 3.29Å; D165-E185 VanDerWaalsContact N-O 3.16Å; D165-E185 PolarHBondContact O-N 2.78Å
186	Y	91	Very high	87.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	159.9	-176.8	-65.5	-95.5	0	0	0	111.4	R54 C136 L138 M156 T160 D161 G162 V163 V184 S188 A191 A192 A195	R54-Y186 PolarHBondContact NH2-O 3.41Å; C136-Y186 WeakPolarHBondContact CB-O 3.17Å; C136-Y186 PolarHBondContact O-N 2.67Å; L138-Y186 HydrophobicContact CB-CE2 4.33Å; L138-Y186 HydrophobicContact CD1-CE2 3.72Å; L138-Y186 HydrophobicContact CG-CD2 4.35Å; L138-Y186 HydrophobicContact CG-CE2 3.84Å; M156-Y186 VanDerWaalsContact CE-OH 3.26Å; M156-Y186 WeakPolarHBondContact CE-OH 3.32Å; T160-Y186 PolarHBondContact OG1-OH 2.97Å; D161-Y186 WeakPolarHBondContact O-CD1 3.47Å; D161-Y186 WeakPolarHBondContact O-CE1 3.16Å; G162-Y186 CarbonylContact O-C 3.58Å; G162-Y186 WeakPolarHBondContact O-CA 3.48Å; V163-Y186 HydrophobicContact CG2-CD1 4.06Å; V163-Y186 HydrophobicContact CG2-CE1 3.43Å; V163-Y186 VanDerWaalsContact CG2-CE1 3.43Å; V184-Y186 HydrophobicContact CB-CE2 3.97Å; V184-Y186 HydrophobicContact CG1-CD2 4.28Å; V184-Y186 HydrophobicContact CG1-CE2 3.55Å; Y186-S188 VanDerWaalsContact C-N 3.27Å; Y186-S188 PolarHBondContact O-N 3.1Å; Y186-A191 HydrophobicContact CD1-CB 4.03Å; Y186-A191 HydrophobicContact CG-CB 4.41Å; Y186-A192 HydrophobicContact CD2-CB 3.78Å; Y186-A192 HydrophobicContact CG-CB 4.01Å; Y186-A195 HydrophobicContact CD1-CB 4.41Å; Y186-A195 HydrophobicContact CE1-CB 3.57Å; Y186-A195 HydrophobicContact CE2-CB 4.11Å; Y186-A195 VanDerWaalsContact CZ-CB 3.4Å; Y186-A195 WeakPolarHBondContact OH-CB 3.29Å
187	E	85.8	Confident	88.3	Confident	124 Å²	124	49.5 Å²	49.5	58%	0.579	22%	0.224	S	C	*	.	S	Bend	trans	-58.8	-37.8	175	59.1	178	-151.9	0	0	112.6	G162 V164 A191	G162-E187 PolarHBondContact O-N 3Å; V164-E187 HydrophobicContact CG2-CB 3.87Å; E187-A191 HydrophobicContact CG-CB 4.06Å
188	S	83.1	Confident	88.4	Confident	36 Å²	36	47.1 Å²	47.1	25%	0.252	22%	0.223	S	C	.	.	S	Bend	trans	-145.8	155.3	-168.9	68.2	0	0	0	0	112.1	Y186 K190 A191 A192	Y186-S188 VanDerWaalsContact C-N 3.27Å; Y186-S188 PolarHBondContact O-N 3.1Å; S188-K190 PolarHBondContact O-N 3.21Å; S188-A191 PolarHBondContact O-N 2.84Å; S188-A191 WeakPolarHBondContact OG-CB 3.09Å; S188-A191 PolarHBondContact OG-N 3.19Å; S188-A191 VanDerWaalsContact OG-N 3.11Å; S188-A192 PolarHBondContact O-N 3.03Å; S188-A192 VanDerWaalsContact O-N 3.08Å
189	H	83.8	Confident	88.3	Confident	63 Å²	63	47.1 Å²	47.1	29%	0.292	22%	0.223	S	C	.	.	H	α-helix	trans	-62	-30.1	173.2	-177.6	61.3	0	0	0	111.8	D134 N135 C136 A193 W215	D134-H189 HydrophobicContact CB-CB 4.33Å; N135-H189 PolarHBondContact O-ND1 3.08Å; C136-H189 PolarHBondContact SG-N 3.12Å; C136-H189 VanDerWaalsContact SG-N 3.35Å; H189-A193 WeakPolarHBondContact O-CB 3.46Å; H189-A193 PolarHBondContact O-N 2.88Å; H189-W215 AromaticContact CE1-CH2 3.4Å; H189-W215 VanDerWaalsContact CE1-CH2 3.4Å; H189-W215 WeakPolarHBondContact CE1-CH2 3.39Å; H189-W215 AromaticContact CE1-CZ2 3.8Å; H189-W215 AromaticContact CE1-CZ3 3.99Å; H189-W215 AromaticContact ND1-CH2 3.73Å
190	K	82.3	Confident	88.1	Confident	137 Å²	137	47.5 Å²	47.5	60%	0.596	23%	0.23	S	C	*	.	H	α-helix	trans	-59.5	-50.5	171.9	-178.2	-170.5	174.8	-167.6	0	111.2	S188 A193 M194	S188-K190 PolarHBondContact O-N 3.21Å; K190-A193 PolarHBondContact O-N 2.83Å; K190-M194 WeakPolarHBondContact O-CG 3.22Å; K190-M194 PolarHBondContact O-N 2.64Å
191	A	88.6	Confident	87.5	Confident	13 Å²	13	50 Å²	50	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-61.4	-49.5	178.8	0	0	0	0	0	111.3	Y186 E187 S188 A193 M194 A195	Y186-A191 HydrophobicContact CD1-CB 4.03Å; Y186-A191 HydrophobicContact CG-CB 4.41Å; E187-A191 HydrophobicContact CG-CB 4.06Å; S188-A191 PolarHBondContact O-N 2.84Å; S188-A191 WeakPolarHBondContact OG-CB 3.09Å; S188-A191 PolarHBondContact OG-N 3.19Å; S188-A191 VanDerWaalsContact OG-N 3.11Å; A191-A193 VanDerWaalsContact C-N 3.34Å; A191-A193 PolarHBondContact O-N 2.91Å; A191-M194 PolarHBondContact O-N 3.42Å; A191-A195 WeakPolarHBondContact O-CB 3.32Å; A191-A195 PolarHBondContact O-N 3.42Å
192	A	90.8	Very high	85.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-39.5	176.8	0	0	0	0	0	113.2	L138 Y186 S188 R196 W215	L138-A192 HydrophobicContact CD2-CB 4.46Å; L138-A192 HydrophobicContact CG-CB 4.47Å; Y186-A192 HydrophobicContact CD2-CB 3.78Å; Y186-A192 HydrophobicContact CG-CB 4.01Å; S188-A192 PolarHBondContact O-N 3.03Å; S188-A192 VanDerWaalsContact O-N 3.08Å; A192-R196 WeakPolarHBondContact O-CB 3.39Å; A192-R196 PolarHBondContact O-N 2.99Å; A192-W215 HydrophobicContact CB-CH2 4.18Å; A192-W215 HydrophobicContact CB-CZ3 3.8Å
193	A	88.2	Confident	84.3	Confident	18 Å²	18	57.7 Å²	57.7	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-70.5	-31.8	178	0	0	0	0	0	112.9	H189 K190 A191 R197 W215	H189-A193 WeakPolarHBondContact O-CB 3.46Å; H189-A193 PolarHBondContact O-N 2.88Å; K190-A193 PolarHBondContact O-N 2.83Å; A191-A193 VanDerWaalsContact C-N 3.34Å; A191-A193 PolarHBondContact O-N 2.91Å; A193-R197 WeakPolarHBondContact O-CG 3.31Å; A193-R197 PolarHBondContact O-N 2.96Å; A193-W215 HydrophobicContact CB-CH2 3.95Å; A193-W215 HydrophobicContact CB-CZ2 4.24Å
194	M	86.9	Confident	83.3	Confident	85 Å²	85	57.8 Å²	57.8	42%	0.419	31%	0.313	S	S	.	.	H	α-helix	trans	-73.5	-47.3	172.4	-70.6	-56.7	-63.1	0	0	111	K190 A191 R196 R197 T198	K190-M194 WeakPolarHBondContact O-CG 3.22Å; K190-M194 PolarHBondContact O-N 2.64Å; A191-M194 PolarHBondContact O-N 3.42Å; M194-R196 VanDerWaalsContact C-N 3.33Å; M194-R196 PolarHBondContact O-N 2.9Å; M194-R197 CarbonylContact O-C 3.56Å; M194-R197 WeakPolarHBondContact O-CA 3.13Å; M194-R197 WeakPolarHBondContact O-CB 3.17Å; M194-R197 PolarHBondContact O-N 2.68Å; M194-R197 PolarHBondContact SD-NH1 2.73Å; M194-T198 PolarHBondContact O-N 2.97Å; M194-T198 PolarHBondContact O-OG1 2.87Å
195	A	91	Very high	82.5	Confident	3 Å²	3	63.3 Å²	63.3	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-51.7	-49	173.2	0	0	0	0	0	112.2	L138 T160 Y186 A191 R197 T198 L199	L138-A195 HydrophobicContact CD1-CB 3.89Å; T160-A195 HydrophobicContact CG2-CB 3.63Å; Y186-A195 HydrophobicContact CD1-CB 4.41Å; Y186-A195 HydrophobicContact CE1-CB 3.57Å; Y186-A195 HydrophobicContact CE2-CB 4.11Å; Y186-A195 VanDerWaalsContact CZ-CB 3.4Å; Y186-A195 WeakPolarHBondContact OH-CB 3.29Å; A191-A195 WeakPolarHBondContact O-CB 3.32Å; A191-A195 PolarHBondContact O-N 3.42Å; A195-R197 VanDerWaalsContact C-N 3.27Å; A195-R197 PolarHBondContact O-N 3.03Å; A195-T198 PolarHBondContact O-N 3.41Å; A195-T198 VanDerWaalsContact O-N 3.09Å; A195-L199 HydrophobicContact CB-CD1 4.47Å; A195-L199 WeakPolarHBondContact O-CB 3.37Å; A195-L199 WeakPolarHBondContact O-CD1 3.23Å; A195-L199 WeakPolarHBondContact O-CG 3.32Å; A195-L199 PolarHBondContact O-N 2.74Å
196	R	89.8	Confident	81.8	Confident	63 Å²	63	62 Å²	62	24%	0.238	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-31	176.5	-171.8	165.3	-174.9	-102	4.5	113	L138 A192 M194 I200 V213 D214	L138-R196 HydrophobicContact CD1-CB 4Å; L138-R196 HydrophobicContact CD2-CB 3.99Å; L138-R196 HydrophobicContact CD2-CG 4.45Å; A192-R196 WeakPolarHBondContact O-CB 3.39Å; A192-R196 PolarHBondContact O-N 2.99Å; M194-R196 VanDerWaalsContact C-N 3.33Å; M194-R196 PolarHBondContact O-N 2.9Å; R196-I200 HydrophobicContact CG-CD1 3.48Å; R196-I200 VanDerWaalsContact CG-CD1 3.48Å; R196-I200 HydrophobicContact CG-CG1 4.12Å; R196-I200 WeakPolarHBondContact O-CB 3.23Å; R196-I200 VanDerWaalsContact O-CG1 3.25Å; R196-I200 WeakPolarHBondContact O-CG1 3.46Å; R196-I200 PolarHBondContact O-N 3.11Å; R196-V213 HydrophobicContact CG-CG1 4.22Å; R196-V213 PolarHBondContact NE-O 2.74Å; R196-D214 IonicContact CZ-OD1 3.28Å; R196-D214 IonicContact NE-OD1 3.55Å; R196-D214 IonicContact NH2-OD1 3.72Å; R196-D214 PolarHBondContact NH2-OD1 2.87Å
197	R	87.1	Confident	81.4	Confident	151 Å²	151	65.7 Å²	65.7	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-73.9	-32.2	172.9	-74.2	175.6	-177.5	132.1	-1.2	113.4	A193 M194 A195 P201	A193-R197 WeakPolarHBondContact O-CG 3.31Å; A193-R197 PolarHBondContact O-N 2.96Å; M194-R197 CarbonylContact O-C 3.56Å; M194-R197 WeakPolarHBondContact O-CA 3.13Å; M194-R197 WeakPolarHBondContact O-CB 3.17Å; M194-R197 PolarHBondContact O-N 2.68Å; M194-R197 PolarHBondContact SD-NH1 2.73Å; A195-R197 VanDerWaalsContact C-N 3.27Å; A195-R197 PolarHBondContact O-N 3.03Å; R197-P201 WeakPolarHBondContact O-CD 3.37Å; R197-P201 WeakPolarHBondContact O-CG 3.48Å
198	T	86.8	Confident	80.9	Confident	69 Å²	69	62.2 Å²	62.2	42%	0.423	35%	0.345	S	S	.	.	H	α-helix	trans	-74.1	-35.9	177	-54.7	0	0	0	0	112	V159 M194 A195	V159-T198 HydrophobicContact CG1-CG2 4.17Å; M194-T198 PolarHBondContact O-N 2.97Å; M194-T198 PolarHBondContact O-OG1 2.87Å; A195-T198 PolarHBondContact O-N 3.41Å; A195-T198 VanDerWaalsContact O-N 3.09Å
199	L	85.1	Confident	80.7	Confident	6 Å²	6	65.4 Å²	65.4	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-93.7	-20.2	-170.7	-59.2	163.7	0	0	0	115.1	I140 M156 V159 T160 A195 F204 I211 V213	I140-L199 HydrophobicContact CD1-CD1 4.39Å; M156-L199 HydrophobicContact CE-CD1 3.71Å; V159-L199 HydrophobicContact CG1-CD2 3.77Å; T160-L199 HydrophobicContact CG2-CD1 3.93Å; T160-L199 HydrophobicContact CG2-CD2 4.16Å; T160-L199 HydrophobicContact CG2-CG 4.02Å; A195-L199 HydrophobicContact CB-CD1 4.47Å; A195-L199 WeakPolarHBondContact O-CB 3.37Å; A195-L199 WeakPolarHBondContact O-CD1 3.23Å; A195-L199 WeakPolarHBondContact O-CG 3.32Å; A195-L199 PolarHBondContact O-N 2.74Å; L199-F204 HydrophobicContact CD2-CD1 3.76Å; L199-F204 HydrophobicContact CD2-CE1 3.58Å; L199-F204 HydrophobicContact CD2-CG 4.39Å; L199-F204 HydrophobicContact CD2-CZ 4.08Å; L199-I211 HydrophobicContact CB-CD1 4.36Å; L199-I211 HydrophobicContact CD2-CD1 4.14Å; L199-V213 HydrophobicContact CB-CB 4.29Å; L199-V213 HydrophobicContact CB-CG1 4.3Å; L199-V213 HydrophobicContact CB-CG2 3.8Å; L199-V213 HydrophobicContact CD1-CG1 4.22Å; L199-V213 HydrophobicContact CD1-CG2 4.28Å
200	I	82.5	Confident	80.6	Confident	88 Å²	88	66.6 Å²	66.6	45%	0.451	37%	0.37	S	S	.	.	S	Bend	trans	-74.3	-36.1	178.5	-79	180	0	0	0	114.9	R196 G202 V213	R196-I200 HydrophobicContact CG-CD1 3.48Å; R196-I200 VanDerWaalsContact CG-CD1 3.48Å; R196-I200 HydrophobicContact CG-CG1 4.12Å; R196-I200 WeakPolarHBondContact O-CB 3.23Å; R196-I200 VanDerWaalsContact O-CG1 3.25Å; R196-I200 WeakPolarHBondContact O-CG1 3.46Å; R196-I200 PolarHBondContact O-N 3.11Å; I200-G202 PolarHBondContact O-N 2.83Å; I200-G202 VanDerWaalsContact O-N 3.11Å; I200-V213 HydrophobicContact CG1-CB 4.33Å
201	P	74.9	Confident	80.9	Confident	65 Å²	65	61 Å²	61	42%	0.422	35%	0.347	S	S	.	.	S	Bend	trans	-54.8	119.5	176.8	-28.4	36.6	0	0	0	111.1	R197 T203 F204	R197-P201 WeakPolarHBondContact O-CD 3.37Å; R197-P201 WeakPolarHBondContact O-CG 3.48Å; P201-T203 PolarHBondContact O-N 2.89Å; P201-F204 PolarHBondContact O-N 2.87Å; P201-F204 VanDerWaalsContact O-N 3.1Å
202	G	57.9	Low	80.9	Confident	86 Å²	86	66.2 Å²	66.2	89%	0.887	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	17.2	-164.7	0	0	0	0	0	117.2	I200	I200-G202 PolarHBondContact O-N 2.83Å; I200-G202 VanDerWaalsContact O-N 3.11Å
203	T	58.7	Low	80.8	Confident	129 Å²	129	66.7 Å²	66.7	79%	0.791	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-18.7	168.4	49.4	0	0	0	0	112.7	P201	P201-T203 PolarHBondContact O-N 2.89Å
204	F	71.1	Confident	81	Confident	48 Å²	48	70 Å²	70	21%	0.211	39%	0.387	C	S	.	.			trans	-75.8	131.1	-179.9	-173.7	-99.4	0	0	0	112.1	V159 L199 P201 L206 I211	V159-F204 HydrophobicContact CB-CE2 4.36Å; V159-F204 HydrophobicContact CB-CZ 4.34Å; V159-F204 HydrophobicContact CG1-CD2 4.27Å; V159-F204 HydrophobicContact CG1-CE2 3.63Å; V159-F204 HydrophobicContact CG1-CZ 3.86Å; V159-F204 HydrophobicContact CG2-CE2 3.8Å; V159-F204 HydrophobicContact CG2-CZ 3.85Å; L199-F204 HydrophobicContact CD2-CD1 3.76Å; L199-F204 HydrophobicContact CD2-CE1 3.58Å; L199-F204 HydrophobicContact CD2-CG 4.39Å; L199-F204 HydrophobicContact CD2-CZ 4.08Å; P201-F204 PolarHBondContact O-N 2.87Å; P201-F204 VanDerWaalsContact O-N 3.1Å; F204-L206 HydrophobicContact CE1-CB 4.18Å; F204-L206 HydrophobicContact CE1-CD1 3.91Å; F204-L206 HydrophobicContact CZ-CD1 3.79Å; F204-I211 HydrophobicContact CD1-CD1 3.73Å; F204-I211 HydrophobicContact CD1-CG1 4.06Å; F204-I211 HydrophobicContact CE1-CD1 3.66Å; F204-I211 HydrophobicContact CE1-CG1 4.33Å
205	Q	77.3	Confident	81.1	Confident	117 Å²	117	70 Å²	70	55%	0.547	38%	0.383	S	S	.	.			trans	-132.3	130.2	177.5	-66.9	-177	-4.3	0	0	110.3	G208 H209	Q205-G208 PolarHBondContact OE1-O 3.22Å; Q205-H209 CarbonylContact C-O 3.56Å; Q205-H209 VanDerWaalsContact CA-O 3.27Å; Q205-H209 WeakPolarHBondContact CA-O 3.4Å
206	L	76	Confident	81	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.01	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-98.6	116	176.6	-155.6	69.1	0	0	0	107.9	E155 M156 F204 G208 H209 I211	E155-L206 HydrophobicContact CB-CD1 4.19Å; E155-L206 HydrophobicContact CG-CD1 3.51Å; E155-L206 HydrophobicContact CG-CG 4.35Å; M156-L206 HydrophobicContact SD-CD2 4.47Å; F204-L206 HydrophobicContact CE1-CB 4.18Å; F204-L206 HydrophobicContact CE1-CD1 3.91Å; F204-L206 HydrophobicContact CZ-CD1 3.79Å; L206-G208 PolarHBondContact O-N 3.02Å; L206-H209 PolarHBondContact N-O 3.14Å; L206-H209 PolarHBondContact O-N 3.44Å; L206-I211 HydrophobicContact CB-CG2 3.51Å; L206-I211 HydrophobicContact CD2-CG2 4Å; L206-I211 HydrophobicContact CG-CG2 4.42Å
207	W	81.6	Confident	80.7	Confident	77 Å²	77	75.6 Å²	75.6	29%	0.292	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	33.5	-170.3	-48	-71.2	0	0	0	114.7	I143 P144 K147 I152 E155 H209	I143-W207 HydrophobicContact CG2-CZ3 4.1Å; P144-W207 VanDerWaalsContact CD-CE3 3.5Å; P144-W207 HydrophobicContact CG-CB 4.47Å; P144-W207 HydrophobicContact CG-CE3 3.89Å; K147-W207 HydrophobicContact CB-CH2 4.47Å; K147-W207 HydrophobicContact CD-CD2 4.17Å; K147-W207 HydrophobicContact CD-CH2 4.37Å; K147-W207 HydrophobicContact CD-CZ2 3.99Å; K147-W207 HydrophobicContact CG-CD2 4.28Å; K147-W207 HydrophobicContact CG-CE3 4.14Å; K147-W207 HydrophobicContact CG-CH2 4.18Å; K147-W207 HydrophobicContact CG-CZ2 4.31Å; K147-W207 HydrophobicContact CG-CZ3 4.08Å; I152-W207 HydrophobicContact CB-CH2 4.3Å; I152-W207 HydrophobicContact CG1-CH2 3.71Å; I152-W207 HydrophobicContact CG1-CZ3 4.46Å; E155-W207 HydrophobicContact CB-CH2 4.45Å; E155-W207 HydrophobicContact CB-CZ2 3.74Å; E155-W207 HydrophobicContact CG-CZ2 4.05Å; W207-H209 VanDerWaalsContact C-N 3.3Å; W207-H209 PolarHBondContact O-CD2 2.91Å; W207-H209 PolarHBondContact O-N 3.31Å
208	G	75.6	Confident	80	Confident	51 Å²	51	71.4 Å²	71.4	53%	0.526	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	4.2	-177.5	0	0	0	0	0	115.1	Q205 L206	Q205-G208 PolarHBondContact OE1-O 3.22Å; L206-G208 PolarHBondContact O-N 3.02Å
209	H	78.3	Confident	79.2	Confident	103 Å²	103	72.5 Å²	72.5	48%	0.477	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-103.9	140.3	174.1	-67.6	-89	0	0	0	111.3	Q205 L206 W207 I211	Q205-H209 CarbonylContact C-O 3.56Å; Q205-H209 VanDerWaalsContact CA-O 3.27Å; Q205-H209 WeakPolarHBondContact CA-O 3.4Å; L206-H209 PolarHBondContact N-O 3.14Å; L206-H209 PolarHBondContact O-N 3.44Å; W207-H209 VanDerWaalsContact C-N 3.3Å; W207-H209 PolarHBondContact O-CD2 2.91Å; W207-H209 PolarHBondContact O-N 3.31Å; H209-I211 PolarHBondContact O-N 3.32Å
210	S	82.7	Confident	78.3	Confident	87 Å²	87	80.4 Å²	80.4	61%	0.608	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-73.6	117.9	170.7	43.6	0	0	0	0	110.5	S142	S142-S210 WeakPolarHBondContact CB-O 3.45Å
211	I	87.9	Confident	77.5	Confident	21 Å²	21	82.8 Å²	82.8	11%	0.108	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-85.6	154.6	178.5	57.1	169.4	0	0	0	112.1	I140 G141 L199 F204 L206 H209 V213	I140-I211 HydrophobicContact CG2-CB 4.03Å; I140-I211 HydrophobicContact CG2-CD1 4.05Å; I140-I211 HydrophobicContact CG2-CG2 4.19Å; G141-I211 WeakPolarHBondContact O-CA 3.42Å; L199-I211 HydrophobicContact CB-CD1 4.36Å; L199-I211 HydrophobicContact CD2-CD1 4.14Å; F204-I211 HydrophobicContact CD1-CD1 3.73Å; F204-I211 HydrophobicContact CD1-CG1 4.06Å; F204-I211 HydrophobicContact CE1-CD1 3.66Å; F204-I211 HydrophobicContact CE1-CG1 4.33Å; L206-I211 HydrophobicContact CB-CG2 3.51Å; L206-I211 HydrophobicContact CD2-CG2 4Å; L206-I211 HydrophobicContact CG-CG2 4.42Å; H209-I211 PolarHBondContact O-N 3.32Å; I211-V213 HydrophobicContact CB-CG2 4.5Å; I211-V213 HydrophobicContact CD1-CG2 3.55Å; I211-V213 HydrophobicContact CG1-CG2 3.95Å
212	Q	88	Confident	77.2	Confident	121 Å²	121	82.2 Å²	82.2	57%	0.565	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.5	171.3	-67.4	-179.8	-22.2	0	0	108.8	I140 G141	I140-Q212 CarbonylContact C-O 3.51Å; I140-Q212 VanDerWaalsContact CA-O 3.31Å; I140-Q212 WeakPolarHBondContact CA-O 3.48Å; G141-Q212 PolarHBondContact N-O 3.08Å; G141-Q212 PolarHBondContact O-N 3.11Å
213	V	90.4	Very high	77.8	Confident	11 Å²	11	83.9 Å²	83.9	7%	0.067	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	109.4	-175.5	-176.1	0	0	0	0	112.2	L138 F139 I140 R196 L199 I200 I211	L138-V213 HydrophobicContact CB-CG1 4.47Å; L138-V213 HydrophobicContact CD1-CG1 3.95Å; F139-V213 WeakPolarHBondContact O-CA 3.48Å; I140-V213 HydrophobicContact CG1-CG2 4.25Å; I140-V213 HydrophobicContact CG2-CG2 4.3Å; R196-V213 HydrophobicContact CG-CG1 4.22Å; R196-V213 PolarHBondContact NE-O 2.74Å; L199-V213 HydrophobicContact CB-CB 4.29Å; L199-V213 HydrophobicContact CB-CG1 4.3Å; L199-V213 HydrophobicContact CB-CG2 3.8Å; L199-V213 HydrophobicContact CD1-CG1 4.22Å; L199-V213 HydrophobicContact CD1-CG2 4.28Å; I200-V213 HydrophobicContact CG1-CB 4.33Å; I211-V213 HydrophobicContact CB-CG2 4.5Å; I211-V213 HydrophobicContact CD1-CG2 3.55Å; I211-V213 HydrophobicContact CG1-CG2 3.95Å
214	D	91.1	Very high	78.7	Confident	86 Å²	86	83.4 Å²	83.4	46%	0.46	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	165.5	179.6	-95.2	-46.4	0	0	0	112.8	L138 F139 R196 A216	L138-D214 CarbonylContact C-O 3.57Å; L138-D214 WeakPolarHBondContact CA-O 3.26Å; F139-D214 PolarHBondContact N-O 2.87Å; F139-D214 PolarHBondContact O-N 3.19Å; R196-D214 IonicContact CZ-OD1 3.28Å; R196-D214 IonicContact NE-OD1 3.55Å; R196-D214 IonicContact NH2-OD1 3.72Å; R196-D214 PolarHBondContact NH2-OD1 2.87Å; D214-A216 PolarHBondContact O-N 2.91Å
215	W	90.4	Very high	79.1	Confident	87 Å²	87	87 Å²	87	33%	0.33	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	128.5	168.9	-72.1	119.9	0	0	0	109.3	N135 L138 H189 A192 A193	N135-W215 HydrophobicContact CB-CE3 4.18Å; N135-W215 HydrophobicContact CB-CZ3 4.37Å; N135-W215 WeakPolarHBondContact O-CZ3 3.47Å; L138-W215 HydrophobicContact CD2-CD2 4.2Å; L138-W215 HydrophobicContact CD2-CE3 3.51Å; L138-W215 HydrophobicContact CD2-CH2 4.36Å; L138-W215 HydrophobicContact CD2-CZ3 3.59Å; H189-W215 AromaticContact CE1-CH2 3.4Å; H189-W215 VanDerWaalsContact CE1-CH2 3.4Å; H189-W215 WeakPolarHBondContact CE1-CH2 3.39Å; H189-W215 AromaticContact CE1-CZ2 3.8Å; H189-W215 AromaticContact CE1-CZ3 3.99Å; H189-W215 AromaticContact ND1-CH2 3.73Å; A192-W215 HydrophobicContact CB-CH2 4.18Å; A192-W215 HydrophobicContact CB-CZ3 3.8Å; A193-W215 HydrophobicContact CB-CH2 3.95Å; A193-W215 HydrophobicContact CB-CZ2 4.24Å
216	A	88.6	Confident	79.3	Confident	6 Å²	6	84.4 Å²	84.4	5%	0.05	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-66.8	156.1	167.7	0	0	0	0	0	109.7	N135 R137 F183 D214 P218	N135-A216 PolarHBondContact ND2-O 3.24Å; R137-A216 HydrophobicContact CB-CB 3.99Å; R137-A216 HydrophobicContact CG-CB 3.9Å; R137-A216 VanDerWaalsContact O-CB 3.26Å; R137-A216 WeakPolarHBondContact O-CB 3.45Å; R137-A216 PolarHBondContact O-N 2.86Å; F183-A216 HydrophobicContact CD1-CB 3.74Å; F183-A216 HydrophobicContact CE1-CB 3.93Å; D214-A216 PolarHBondContact O-N 2.91Å; A216-P218 WeakPolarHBondContact O-CD 3.24Å
217	E	82.8	Confident	79.6	Confident	176 Å²	176	86.8 Å²	86.8	82%	0.822	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-62	124.3	166.9	-173.2	171.9	-163.5	0	0	108.5	E219	E217-E219 PolarHBondContact O-N 3.07Å
218	P	71.4	Confident	79.7	Confident	63 Å²	63	89.2 Å²	89.2	41%	0.409	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-57.8	127.7	-178.1	-25.8	34.2	0	0	0	111.3	N135 A216 K220	N135-P218 HydrophobicContact CB-CG 4.3Å; A216-P218 WeakPolarHBondContact O-CD 3.24Å; P218-K220 PolarHBondContact O-N 2.84Å; P218-K220 VanDerWaalsContact O-N 3.17Å
219	E	70.8	Confident	80.2	Confident	92 Å²	92	95.3 Å²	95.3	43%	0.43	47%	0.468	S	S	.	.			trans	-66.7	115.8	172.8	-173.2	160.1	151.9	0	0	108.5	R137 E217 D221 K302	R137-E219 IonicContact CZ-OE2 2.7Å; R137-E219 VanDerWaalsContact CZ-OE2 3.28Å; R137-E219 IonicContact NH1-OE2 2.78Å; R137-E219 PolarHBondContact NH1-OE2 3.04Å; R137-E219 IonicContact NH2-OE2 3.95Å; R137-E219 PolarHBondContact NH2-OE2 2.78Å; E217-E219 PolarHBondContact O-N 3.07Å; E219-D221 PolarHBondContact O-N 2.95Å; E219-D221 VanDerWaalsContact O-N 3.13Å; E219-K302 VanDerWaalsContact CG-NZ 3.32Å; E219-K302 WeakPolarHBondContact OE1-CE 3.33Å; E219-K302 IonicContact OE1-NZ 3.58Å; E219-K302 PolarHBondContact OE1-NZ 3.32Å; E219-K302 IonicContact OE2-NZ 2.69Å
220	K	66.3	Low	80.6	Confident	172 Å²	172	91 Å²	91	75%	0.748	45%	0.449	S	S	*	.			trans	-68.7	112.5	176.1	-67	-173.8	-179.5	-176	0	109.3	P218 V222	P218-K220 PolarHBondContact O-N 2.84Å; P218-K220 VanDerWaalsContact O-N 3.17Å; K220-V222 PolarHBondContact O-N 2.83Å
221	D	65.4	Low	81	Confident	139 Å²	139	91.1 Å²	91.1	74%	0.743	44%	0.436	S	S	*	.			trans	-54.8	132.2	161.3	-66.4	-47.4	0	0	0	108.8	E219	E219-D221 PolarHBondContact O-N 2.95Å; E219-D221 VanDerWaalsContact O-N 3.13Å
222	V	69.9	Low	81.2	Confident	53 Å²	53	91.3 Å²	91.3	32%	0.321	44%	0.438	S	S	.	.			trans	-114.5	129.3	178.9	-78.3	0	0	0	0	108.2	K220 E224 P303	K220-V222 PolarHBondContact O-N 2.83Å; V222-E224 PolarHBondContact O-N 3.2Å; V222-P303 HydrophobicContact CB-CG 4.38Å; V222-P303 HydrophobicContact CG1-CG 4.07Å
223	D	69.8	Low	81.4	Confident	121 Å²	121	85.6 Å²	85.6	65%	0.647	41%	0.411	S	S	*	.			trans	-49.5	135.3	-176	-79.2	-58.4	0	0	0	112.3	E225 V226 M227	D223-E225 PolarHBondContact O-N 3.49Å; D223-E225 VanDerWaalsContact O-N 3.16Å; D223-V226 HydrophobicContact CB-CG2 4.03Å; D223-V226 WeakPolarHBondContact O-CA 3.37Å; D223-V226 PolarHBondContact O-N 3.4Å; D223-M227 PolarHBondContact O-N 3.22Å
224	E	76.9	Confident	81.6	Confident	118 Å²	118	87.7 Å²	87.7	55%	0.551	42%	0.419	S	S	*	.	H	α-helix	trans	-56.2	-36.6	-177.4	-62.7	-179.1	-146.3	0	0	110.9	R106 V222 V226 M227 Q228	R106-E224 IonicContact CZ-OE1 2.9Å; R106-E224 IonicContact NH1-OE1 3.2Å; R106-E224 PolarHBondContact NH1-OE1 3.25Å; V222-E224 PolarHBondContact O-N 3.2Å; E224-V226 PolarHBondContact O-N 3.48Å; E224-M227 PolarHBondContact O-N 3Å; E224-Q228 WeakPolarHBondContact O-CB 3.36Å; E224-Q228 VanDerWaalsContact O-CG 3.24Å; E224-Q228 WeakPolarHBondContact O-CG 3.43Å; E224-Q228 PolarHBondContact O-N 3.1Å
225	E	79.2	Confident	81.6	Confident	123 Å²	123	83.6 Å²	83.6	58%	0.575	40%	0.397	S	S	*	.	H	α-helix	trans	-60	-37.4	172.8	-75.7	-161.3	-152	0	0	114.5	D223 R229	D223-E225 PolarHBondContact O-N 3.49Å; D223-E225 VanDerWaalsContact O-N 3.16Å; E225-R229 WeakPolarHBondContact O-CG 3.44Å; E225-R229 PolarHBondContact O-NE 3.01Å; E225-R229 IonicContact OE2-NH2 3.18Å; E225-R229 PolarHBondContact OE2-NH2 2.89Å; E225-R229 VanDerWaalsContact OE2-NH2 3.15Å
226	V	82.3	Confident	81.6	Confident	64 Å²	64	83 Å²	83	39%	0.388	39%	0.394	S	S	.	.	H	α-helix	trans	-76.9	-40.2	178.9	-172.8	0	0	0	0	108.9	D223 E224 Q228 R229 V230 P303	D223-V226 HydrophobicContact CB-CG2 4.03Å; D223-V226 WeakPolarHBondContact O-CA 3.37Å; D223-V226 PolarHBondContact O-N 3.4Å; E224-V226 PolarHBondContact O-N 3.48Å; V226-Q228 VanDerWaalsContact C-N 3.31Å; V226-Q228 PolarHBondContact O-N 3.13Å; V226-R229 WeakPolarHBondContact O-CB 3.39Å; V226-R229 PolarHBondContact O-N 2.88Å; V226-V230 PolarHBondContact O-N 2.85Å; V226-P303 HydrophobicContact CG1-CB 4.15Å; V226-P303 HydrophobicContact CG1-CG 3.81Å
227	M	83.1	Confident	81.5	Confident	52 Å²	52	84.1 Å²	84.1	26%	0.256	40%	0.399	S	S	.	.	H	α-helix	trans	-65.6	-30.5	176.2	-165.4	57.6	156.4	0	0	112.9	D223 E224 R229 V230 R276 L300	D223-M227 PolarHBondContact O-N 3.22Å; E224-M227 PolarHBondContact O-N 3Å; M227-R229 VanDerWaalsContact C-N 3.26Å; M227-R229 PolarHBondContact O-N 2.95Å; M227-V230 PolarHBondContact O-N 2.88Å; M227-V230 HydrophobicContact SD-CB 4.39Å; M227-V230 HydrophobicContact SD-CG2 3.94Å; M227-R276 PolarHBondContact O-NH2 3.29Å; M227-L300 HydrophobicContact CE-CB 3.55Å; M227-L300 HydrophobicContact CE-CD1 4.4Å; M227-L300 HydrophobicContact SD-CB 4.23Å
228	Q	82.9	Confident	81.7	Confident	128 Å²	128	75.9 Å²	75.9	60%	0.598	36%	0.361	S	S	*	.	H	α-helix	trans	-62.5	-31.6	169.7	-77.7	171.7	22.7	0	0	112.4	E224 V226 R276	E224-Q228 WeakPolarHBondContact O-CB 3.36Å; E224-Q228 VanDerWaalsContact O-CG 3.24Å; E224-Q228 WeakPolarHBondContact O-CG 3.43Å; E224-Q228 PolarHBondContact O-N 3.1Å; V226-Q228 VanDerWaalsContact C-N 3.31Å; V226-Q228 PolarHBondContact O-N 3.13Å; Q228-R276 WeakPolarHBondContact O-CD 3.42Å; Q228-R276 PolarHBondContact O-NE 3.36Å
229	R	85.3	Confident	82.2	Confident	179 Å²	179	75.9 Å²	75.9	68%	0.675	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.1	-180	-59	170.7	-155.1	-157.9	6.4	113.7	E225 V226 M227 R231	E225-R229 WeakPolarHBondContact O-CG 3.44Å; E225-R229 PolarHBondContact O-NE 3.01Å; E225-R229 IonicContact OE2-NH2 3.18Å; E225-R229 PolarHBondContact OE2-NH2 2.89Å; E225-R229 VanDerWaalsContact OE2-NH2 3.15Å; V226-R229 WeakPolarHBondContact O-CB 3.39Å; V226-R229 PolarHBondContact O-N 2.88Å; M227-R229 VanDerWaalsContact C-N 3.26Å; M227-R229 PolarHBondContact O-N 2.95Å; R229-R231 PolarHBondContact O-N 3Å
230	V	87.6	Confident	82.8	Confident	12 Å²	12	77.1 Å²	77.1	7%	0.073	36%	0.363	C	S	.	.			trans	-69.2	111.4	-177.7	170.9	0	0	0	0	112.2	V226 M227 V232 R276 L300 A301	V226-V230 PolarHBondContact O-N 2.85Å; M227-V230 PolarHBondContact O-N 2.88Å; M227-V230 HydrophobicContact SD-CB 4.39Å; M227-V230 HydrophobicContact SD-CG2 3.94Å; V230-V232 WeakPolarHBondContact CG1-O 3.43Å; V230-R276 WeakPolarHBondContact O-CD 3.34Å; V230-R276 PolarHBondContact O-NE 3.36Å; V230-L300 HydrophobicContact CG1-CB 4.32Å; V230-L300 HydrophobicContact CG1-CD2 3.95Å; V230-A301 WeakPolarHBondContact CG1-O 3.21Å
231	R	91.3	Very high	83.6	Confident	89 Å²	89	75.5 Å²	75.5	34%	0.336	36%	0.363	S	S	.	.			trans	-99	17.5	173.9	73.5	-168.6	-169.6	101.3	-2.3	114.3	R229 E260 Y273	R229-R231 PolarHBondContact O-N 3Å; R231-E260 IonicContact CZ-OE1 2.72Å; R231-E260 IonicContact CZ-OE2 3.32Å; R231-E260 IonicContact NH1-OE1 3.29Å; R231-E260 PolarHBondContact NH1-OE1 2.86Å; R231-E260 IonicContact NH1-OE2 2.64Å; R231-E260 PolarHBondContact NH1-OE2 2.96Å; R231-E260 IonicContact NH2-OE1 3.46Å; R231-E260 PolarHBondContact NH2-OE1 2.9Å; R231-E260 IonicContact NH2-OE2 3.05Å; R231-E260 PolarHBondContact NH2-OE2 3.26Å; R231-Y273 WeakPolarHBondContact CD-O 3.46Å; R231-Y273 WeakPolarHBondContact CG-O 3.48Å; R231-Y273 PolarHBondContact NH1-O 2.88Å; R231-Y273 PolarHBondContact O-N 2.68Å
232	V	92.3	Very high	84.7	Confident	26 Å²	26	68.9 Å²	68.9	16%	0.158	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.5	-174.7	-173.7	0	0	0	0	109.8	V230 F270 I271 H272 A301	V230-V232 WeakPolarHBondContact CG1-O 3.43Å; V232-F270 HydrophobicContact CG1-CB 4.14Å; V232-F270 HydrophobicContact CG1-CD1 4.3Å; V232-I271 CarbonylContact C-O 3.59Å; V232-I271 WeakPolarHBondContact CA-O 3.16Å; V232-H272 HydrophobicContact CG2-CB 4.5Å; V232-A301 HydrophobicContact CB-CB 4Å; V232-A301 HydrophobicContact CG1-CB 3.78Å; V232-A301 WeakPolarHBondContact O-CB 3.27Å; V232-A301 PolarHBondContact O-N 2.9Å
233	L	92.6	Very high	85.7	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	143.7	171.6	-56.8	-173.7	0	0	0	110.2	F270 I271 Y273 A279 A282 L283 V298 T299 L300	L233-F270 WeakPolarHBondContact O-CA 3.43Å; L233-I271 PolarHBondContact N-O 2.66Å; L233-I271 PolarHBondContact O-N 2.85Å; L233-Y273 HydrophobicContact CD1-CD2 4.26Å; L233-Y273 HydrophobicContact CD1-CE2 3.64Å; L233-Y273 HydrophobicContact CG-CD2 4.16Å; L233-Y273 HydrophobicContact CG-CE2 3.98Å; L233-A279 HydrophobicContact CD2-CB 4.13Å; L233-A279 HydrophobicContact CG-CB 4.41Å; L233-A282 HydrophobicContact CD1-CB 4.05Å; L233-L283 HydrophobicContact CD1-CB 4.33Å; L233-L283 HydrophobicContact CD2-CB 4.1Å; L233-V298 HydrophobicContact CB-CG1 4.06Å; L233-V298 HydrophobicContact CD1-CG1 3.8Å; L233-V298 HydrophobicContact CG-CG1 4.36Å; L233-T299 WeakPolarHBondContact CA-O 3.35Å; L233-L300 HydrophobicContact CD2-CD2 3.75Å; L233-L300 HydrophobicContact CD2-CG 4.39Å
234	Y	93.4	Very high	86.8	Confident	56 Å²	56	66.8 Å²	66.8	22%	0.22	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.4	168.2	173.1	-106.2	0	0	0	107.8	R236 Y268 F270 T299	Y234-R236 HydrophobicContact CE1-CB 3.94Å; Y234-R236 HydrophobicContact CE1-CG 4.39Å; Y234-Y268 HydrophobicContact CD2-CD2 4.37Å; Y234-Y268 AromaticContact CE2-CD2 3.59Å; Y234-Y268 HydrophobicContact CE2-CD2 3.59Å; Y234-Y268 HydrophobicContact CE2-CE2 4.34Å; Y234-Y268 AromaticContact CE2-CG 3.85Å; Y234-Y268 HydrophobicContact CE2-CG 3.85Å; Y234-F270 HydrophobicContact CD2-CD1 4.12Å; Y234-F270 AromaticContact CD2-CE1 3.57Å; Y234-F270 HydrophobicContact CD2-CE1 3.57Å; Y234-F270 AromaticContact CD2-CZ 3.87Å; Y234-F270 HydrophobicContact CD2-CZ 3.87Å; Y234-F270 HydrophobicContact CE2-CE1 4.37Å; Y234-F270 HydrophobicContact CE2-CZ 4.23Å; Y234-F270 HydrophobicContact CG-CE1 4.38Å; Y234-T299 PolarHBondContact N-O 2.92Å; Y234-T299 PolarHBondContact O-N 3.46Å
235	V	91.2	Very high	87.4	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.8	179.7	-173.3	0	0	0	0	108	L238 F251 Y268 A269 I271 V296 E297 V298	V235-L238 HydrophobicContact CG1-CD2 3.73Å; V235-L238 HydrophobicContact CG1-CG 4.33Å; V235-F251 HydrophobicContact CG1-CE2 4.42Å; V235-F251 HydrophobicContact CG1-CZ 4.08Å; V235-F251 HydrophobicContact CG2-CE1 4.03Å; V235-F251 HydrophobicContact CG2-CE2 4.18Å; V235-F251 HydrophobicContact CG2-CZ 3.59Å; V235-Y268 CarbonylContact O-C 3.56Å; V235-Y268 WeakPolarHBondContact O-CA 3.42Å; V235-Y268 WeakPolarHBondContact O-CB 3.29Å; V235-A269 PolarHBondContact N-O 3.5Å; V235-A269 PolarHBondContact O-N 2.95Å; V235-I271 HydrophobicContact CG2-CD1 3.74Å; V235-I271 HydrophobicContact CG2-CG1 4.16Å; V235-V296 HydrophobicContact CG1-CB 3.93Å; V235-V296 HydrophobicContact CG1-CG2 4.27Å; V235-E297 CarbonylContact C-O 3.54Å; V235-E297 WeakPolarHBondContact CA-O 3.35Å; V235-V298 HydrophobicContact CG1-CG2 4.26Å; V235-V298 HydrophobicContact CG2-CG1 4.28Å; V235-V298 HydrophobicContact CG2-CG2 4.26Å
236	R	89.5	Confident	88	Confident	74 Å²	74	62.3 Å²	62.3	28%	0.279	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	169.4	177.6	71.4	178.9	-174	-177.3	1.3	112.2	Y234 E297	Y234-R236 HydrophobicContact CE1-CB 3.94Å; Y234-R236 HydrophobicContact CE1-CG 4.39Å; R236-E297 HydrophobicContact CG-CB 3.75Å; R236-E297 IonicContact CZ-OE2 2.65Å; R236-E297 PolarHBondContact N-O 3.32Å; R236-E297 IonicContact NE-OE2 2.69Å; R236-E297 PolarHBondContact NE-OE2 3.47Å; R236-E297 IonicContact NH2-OE2 2.96Å; R236-E297 PolarHBondContact NH2-OE2 3.49Å; R236-E297 PolarHBondContact O-N 2.85Å; R236-E297 VanDerWaalsContact O-N 3.1Å
237	N	86.7	Confident	88.5	Confident	29 Å²	29	59.2 Å²	59.2	16%	0.155	28%	0.277	C	S	.	.	S	Bend	trans	67.3	29.7	-175.9	-163.4	30.7	0	0	0	114.8	K175 D267 T295	K175-N237 WeakPolarHBondContact CE-OD1 3.4Å; K175-N237 PolarHBondContact NZ-O 3Å; N237-D267 PolarHBondContact N-O 2.92Å; N237-D267 VanDerWaalsContact N-O 3.08Å; N237-T295 PolarHBondContact ND2-O 2.64Å
238	L	86.9	Confident	88.8	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.016	28%	0.282	C	S	.	.			trans	-69	157.1	173.7	-58.9	-177.8	0	0	0	111.9	K175 V235 L247 D267 A269 V296	K175-L238 WeakPolarHBondContact CE-O 3.26Å; K175-L238 PolarHBondContact NZ-O 3.47Å; V235-L238 HydrophobicContact CG1-CD2 3.73Å; V235-L238 HydrophobicContact CG1-CG 4.33Å; L238-L247 HydrophobicContact CD1-CD1 3.8Å; L238-L247 HydrophobicContact CD1-CD2 4.03Å; L238-L247 HydrophobicContact CD2-CD2 3.76Å; L238-D267 PolarHBondContact N-O 3.46Å; L238-A269 HydrophobicContact CD1-CB 3.67Å; L238-V296 HydrophobicContact CD2-CB 4.37Å; L238-V296 HydrophobicContact CD2-CG1 3.68Å
239	M	83.4	Confident	89.2	Confident	63 Å²	63	60.7 Å²	60.7	31%	0.31	28%	0.277	S	S	.	.			trans	-76.4	156.3	168.8	-62.3	-68.3	-108.2	0	0	109.9	K175 D241 T242 K264 D292 A294	K175-M239 HydrophobicContact CD-SD 3.84Å; K175-M239 VanDerWaalsContact CE-SD 3.5Å; K175-M239 PolarHBondContact NZ-SD 2.96Å; M239-D241 PolarHBondContact O-N 2.95Å; M239-T242 WeakPolarHBondContact CB-OG1 3.41Å; M239-T242 PolarHBondContact N-OG1 2.95Å; M239-T242 PolarHBondContact O-N 3.45Å; M239-K264 PolarHBondContact O-NZ 3.37Å; M239-D292 HydrophobicContact CG-CB 4.11Å; M239-A294 HydrophobicContact CG-CB 3.98Å; M239-A294 HydrophobicContact SD-CB 4.01Å
240	M	81.9	Confident	89.4	Confident	118 Å²	118	55 Å²	55	58%	0.581	26%	0.258	S	S	*	.	S	Bend	trans	-61.7	-32	172	-71.6	-168.6	62.3	0	0	111.3	K264	M240-K264 PolarHBondContact O-NZ 3.5Å
241	D	84.8	Confident	89.5	Confident	138 Å²	138	54.6 Å²	54.6	74%	0.738	26%	0.255	S	S	*	.	S	Bend	trans	-83.1	-18.6	-178	-46.9	-58.9	0	0	0	114.3	M239 T243	M239-D241 PolarHBondContact O-N 2.95Å; D241-T243 PolarHBondContact O-N 3.25Å; D241-T243 VanDerWaalsContact O-N 3.16Å
242	T	87.9	Confident	89.4	Confident	1 Å²	1	51 Å²	51	1%	0.006	24%	0.244	C	C	.	.			trans	-58.2	116.1	178.7	-59.7	0	0	0	0	111	M239 T246 L247 K264 I291 D292	M239-T242 WeakPolarHBondContact CB-OG1 3.41Å; M239-T242 PolarHBondContact N-OG1 2.95Å; M239-T242 PolarHBondContact O-N 3.45Å; T242-T246 HydrophobicContact CG2-CG2 4.16Å; T242-L247 HydrophobicContact CG2-CD1 4.41Å; T242-L247 HydrophobicContact CG2-CD2 3.81Å; T242-L247 HydrophobicContact CG2-CG 3.84Å; T242-K264 VanDerWaalsContact O-CD 3.23Å; T242-K264 WeakPolarHBondContact O-CD 3.22Å; T242-K264 WeakPolarHBondContact O-CE 3.49Å; T242-K264 PolarHBondContact O-NZ 3.17Å; T242-I291 HydrophobicContact CG2-CG2 4.12Å; T242-D292 VanDerWaalsContact CA-OD2 3.23Å; T242-D292 WeakPolarHBondContact CA-OD2 3.5Å; T242-D292 WeakPolarHBondContact CB-OD2 3.42Å; T242-D292 VanDerWaalsContact CG2-OD2 3.27Å; T242-D292 WeakPolarHBondContact CG2-OD2 3.2Å; T242-D292 PolarHBondContact OG1-OD2 2.86Å
243	T	91.4	Very high	89.1	Confident	63 Å²	63	53.6 Å²	53.6	39%	0.387	26%	0.264	S	S	.	.			trans	-86.2	165.5	-176.6	82.1	0	0	0	0	113.1	D241 E245 T246 L247	D241-T243 PolarHBondContact O-N 3.25Å; D241-T243 VanDerWaalsContact O-N 3.16Å; T243-E245 WeakPolarHBondContact CB-OE2 3.41Å; T243-E245 PolarHBondContact O-N 2.91Å; T243-E245 PolarHBondContact OG1-N 2.89Å; T243-E245 PolarHBondContact OG1-OE2 2.89Å; T243-T246 PolarHBondContact O-N 2.62Å; T243-T246 PolarHBondContact OG1-N 2.98Å; T243-L247 WeakPolarHBondContact O-CG 3.35Å; T243-L247 PolarHBondContact O-N 2.87Å
244	E	92	Very high	88.7	Confident	67 Å²	67	59.1 Å²	59.1	31%	0.313	29%	0.288	S	S	.	.	H	α-helix	trans	-64	-29.9	176.3	-66.3	-161.7	152.2	0	0	112.1	L247 H248 V262 K263 K264	E244-L247 PolarHBondContact O-N 2.86Å; E244-H248 VanDerWaalsContact O-CB 3.31Å; E244-H248 WeakPolarHBondContact O-CB 3.42Å; E244-H248 PolarHBondContact O-N 3.37Å; E244-V262 HydrophobicContact CB-CG1 4.18Å; E244-V262 HydrophobicContact CG-CG1 4.26Å; E244-K263 VanDerWaalsContact OE1-CA 3.29Å; E244-K263 WeakPolarHBondContact OE1-CA 3.01Å; E244-K264 HydrophobicContact CG-CB 3.78Å; E244-K264 PolarHBondContact OE1-N 2.82Å
245	E	90.6	Very high	88.3	Confident	127 Å²	127	60.8 Å²	60.8	59%	0.593	30%	0.296	S	S	*	.	H	α-helix	trans	-71.9	-39.7	179	-55.2	72.5	-157.7	0	0	111.7	T243 H248 R249	T243-E245 WeakPolarHBondContact CB-OE2 3.41Å; T243-E245 PolarHBondContact O-N 2.91Å; T243-E245 PolarHBondContact OG1-N 2.89Å; T243-E245 PolarHBondContact OG1-OE2 2.89Å; E245-H248 PolarHBondContact O-N 3.35Å; E245-R249 WeakPolarHBondContact O-CB 3.35Å; E245-R249 PolarHBondContact O-N 3.33Å
246	T	91.4	Very high	87.9	Confident	19 Å²	19	66.5 Å²	66.5	12%	0.117	33%	0.333	C	S	.	.	H	α-helix	trans	-61.9	-47.9	171.5	-83.4	0	0	0	0	110.3	T242 T243 H248 R249 E250 I291	T242-T246 HydrophobicContact CG2-CG2 4.16Å; T243-T246 PolarHBondContact O-N 2.62Å; T243-T246 PolarHBondContact OG1-N 2.98Å; T246-H248 VanDerWaalsContact C-N 3.34Å; T246-H248 PolarHBondContact O-N 2.94Å; T246-R249 PolarHBondContact O-N 3.03Å; T246-R249 PolarHBondContact OG1-NH1 2.95Å; T246-R249 PolarHBondContact OG1-NH2 2.95Å; T246-E250 HydrophobicContact CG2-CG 4.36Å; T246-E250 WeakPolarHBondContact O-CG 3.5Å; T246-E250 PolarHBondContact O-N 3.2Å; T246-I291 HydrophobicContact CG2-CG2 3.87Å
247	L	91.4	Very high	87.6	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-45.4	174.9	-64.7	169.9	0	0	0	111.9	L238 T242 T243 E244 R249 E250 F251 V262 K264 A269 I291	L238-L247 HydrophobicContact CD1-CD1 3.8Å; L238-L247 HydrophobicContact CD1-CD2 4.03Å; L238-L247 HydrophobicContact CD2-CD2 3.76Å; T242-L247 HydrophobicContact CG2-CD1 4.41Å; T242-L247 HydrophobicContact CG2-CD2 3.81Å; T242-L247 HydrophobicContact CG2-CG 3.84Å; T243-L247 WeakPolarHBondContact O-CG 3.35Å; T243-L247 PolarHBondContact O-N 2.87Å; E244-L247 PolarHBondContact O-N 2.86Å; L247-R249 VanDerWaalsContact C-N 3.3Å; L247-R249 PolarHBondContact O-N 2.83Å; L247-E250 PolarHBondContact O-N 3.19Å; L247-F251 HydrophobicContact CD2-CE2 4.34Å; L247-F251 WeakPolarHBondContact O-CB 3.39Å; L247-F251 WeakPolarHBondContact O-CD2 3.34Å; L247-F251 PolarHBondContact O-N 3.33Å; L247-V262 HydrophobicContact CB-CG1 4.08Å; L247-V262 HydrophobicContact CD1-CG1 4.06Å; L247-K264 HydrophobicContact CD1-CB 4.35Å; L247-A269 HydrophobicContact CD1-CB 3.72Å; L247-I291 HydrophobicContact CD2-CD1 4.41Å
248	H	91.4	Very high	87.6	Confident	81 Å²	81	63.6 Å²	63.6	38%	0.375	33%	0.332	S	S	.	.	H	α-helix	trans	-61.3	-39.4	178.6	-173	-74.5	0	0	0	111.9	E244 E245 T246 S252 V262	E244-H248 VanDerWaalsContact O-CB 3.31Å; E244-H248 WeakPolarHBondContact O-CB 3.42Å; E244-H248 PolarHBondContact O-N 3.37Å; E245-H248 PolarHBondContact O-N 3.35Å; T246-H248 VanDerWaalsContact C-N 3.34Å; T246-H248 PolarHBondContact O-N 2.94Å; H248-S252 WeakPolarHBondContact O-CB 3.3Å; H248-S252 PolarHBondContact O-N 3.09Å; H248-S252 VanDerWaalsContact O-N 3.1Å; H248-S252 PolarHBondContact O-OG 3.46Å; H248-V262 HydrophobicContact CB-CG2 3.95Å
249	R	89.8	Confident	87.8	Confident	130 Å²	130	63.7 Å²	63.7	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-65.9	-55.6	176.3	-177.3	-176.7	64.2	-111.4	-8.3	111.4	E245 T246 L247 F251 S252 S253	E245-R249 WeakPolarHBondContact O-CB 3.35Å; E245-R249 PolarHBondContact O-N 3.33Å; T246-R249 PolarHBondContact O-N 3.03Å; T246-R249 PolarHBondContact OG1-NH1 2.95Å; T246-R249 PolarHBondContact OG1-NH2 2.95Å; L247-R249 VanDerWaalsContact C-N 3.3Å; L247-R249 PolarHBondContact O-N 2.83Å; R249-F251 PolarHBondContact O-N 3.04Å; R249-S252 PolarHBondContact O-N 3.28Å; R249-S252 VanDerWaalsContact O-N 3.15Å; R249-S253 PolarHBondContact O-N 3Å; R249-S253 VanDerWaalsContact O-N 3.08Å
250	E	90.4	Very high	88.2	Confident	59 Å²	59	65.3 Å²	65.3	28%	0.276	34%	0.34	S	S	.	.	H	α-helix	trans	-62	-43.5	-176.6	-58.3	-36.6	131.1	0	0	111.7	T246 L247 S252 S253 M286 I291	T246-E250 HydrophobicContact CG2-CG 4.36Å; T246-E250 WeakPolarHBondContact O-CG 3.5Å; T246-E250 PolarHBondContact O-N 3.2Å; L247-E250 PolarHBondContact O-N 3.19Å; E250-S252 VanDerWaalsContact C-N 3.3Å; E250-S252 PolarHBondContact O-N 3.39Å; E250-S253 VanDerWaalsContact O-CB 3.26Å; E250-S253 WeakPolarHBondContact O-CB 3.25Å; E250-S253 PolarHBondContact O-N 3.47Å; E250-S253 PolarHBondContact O-OG 3.21Å; E250-M286 HydrophobicContact CB-CE 3.98Å; E250-I291 HydrophobicContact CB-CD1 4.09Å; E250-I291 HydrophobicContact CG-CD1 4.2Å; E250-I291 HydrophobicContact CG-CG1 4.44Å; E250-I291 HydrophobicContact CG-CG2 4.5Å
251	F	89.6	Confident	88.6	Confident	3 Å²	3	66.4 Å²	66.4	1%	0.013	34%	0.338	C	S	.	.	H	α-helix	trans	-78.8	-8.3	179.1	-78	-92.5	0	0	0	114.5	V235 L247 R249 V259 I271 Y273 M286 I291 V298	V235-F251 HydrophobicContact CG1-CE2 4.42Å; V235-F251 HydrophobicContact CG1-CZ 4.08Å; V235-F251 HydrophobicContact CG2-CE1 4.03Å; V235-F251 HydrophobicContact CG2-CE2 4.18Å; V235-F251 HydrophobicContact CG2-CZ 3.59Å; L247-F251 HydrophobicContact CD2-CE2 4.34Å; L247-F251 WeakPolarHBondContact O-CB 3.39Å; L247-F251 WeakPolarHBondContact O-CD2 3.34Å; L247-F251 PolarHBondContact O-N 3.33Å; R249-F251 PolarHBondContact O-N 3.04Å; F251-V259 HydrophobicContact CB-CG2 4.28Å; F251-I271 HydrophobicContact CB-CD1 3.91Å; F251-I271 HydrophobicContact CB-CG2 4.45Å; F251-I271 HydrophobicContact CD1-CD1 3.66Å; F251-I271 HydrophobicContact CD2-CD1 3.35Å; F251-I271 HydrophobicContact CE1-CD1 3.97Å; F251-I271 HydrophobicContact CE2-CD1 3.68Å; F251-I271 HydrophobicContact CG-CD1 3.34Å; F251-I271 HydrophobicContact CZ-CD1 3.98Å; F251-Y273 WeakPolarHBondContact CB-OH 3.34Å; F251-Y273 PolarHBondContact O-OH 2.97Å; F251-M286 HydrophobicContact CD1-CB 4.22Å; F251-M286 HydrophobicContact CD1-CG 3.89Å; F251-M286 HydrophobicContact CD2-CE 4.42Å; F251-M286 HydrophobicContact CE1-CB 3.53Å; F251-M286 HydrophobicContact CE1-CG 3.73Å; F251-M286 HydrophobicContact CE2-CE 4.28Å; F251-M286 HydrophobicContact CZ-CB 3.87Å; F251-M286 HydrophobicContact CZ-CE 4.39Å; F251-M286 HydrophobicContact CZ-CG 4.28Å; F251-I291 HydrophobicContact CD2-CD1 4.47Å; F251-I291 HydrophobicContact CE2-CD1 3.79Å; F251-V298 HydrophobicContact CE1-CG1 4.39Å; F251-V298 HydrophobicContact CE1-CG2 4.07Å; F251-V298 HydrophobicContact CZ-CG2 3.89Å
252	S	89.8	Confident	89	Confident	15 Å²	15	60.3 Å²	60.3	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-95.1	-10.3	167.6	-62.8	0	0	0	0	113.6	H248 R249 E250 F254 K255	H248-S252 WeakPolarHBondContact O-CB 3.3Å; H248-S252 PolarHBondContact O-N 3.09Å; H248-S252 VanDerWaalsContact O-N 3.1Å; H248-S252 PolarHBondContact O-OG 3.46Å; R249-S252 PolarHBondContact O-N 3.28Å; R249-S252 VanDerWaalsContact O-N 3.15Å; E250-S252 VanDerWaalsContact C-N 3.3Å; E250-S252 PolarHBondContact O-N 3.39Å; S252-F254 VanDerWaalsContact C-N 3.34Å; S252-F254 PolarHBondContact O-N 2.88Å; S252-K255 CarbonylContact O-C 3.55Å; S252-K255 PolarHBondContact O-N 2.76Å
253	S	85.9	Confident	89.2	Confident	80 Å²	80	65.2 Å²	65.2	56%	0.559	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-44.5	-173	62.2	0	0	0	0	113.5	R249 E250 K255	R249-S253 PolarHBondContact O-N 3Å; R249-S253 VanDerWaalsContact O-N 3.08Å; E250-S253 VanDerWaalsContact O-CB 3.26Å; E250-S253 WeakPolarHBondContact O-CB 3.25Å; E250-S253 PolarHBondContact O-N 3.47Å; E250-S253 PolarHBondContact O-OG 3.21Å; S253-K255 VanDerWaalsContact C-N 3.34Å; S253-K255 PolarHBondContact O-N 2.78Å
254	F	83.2	Confident	89.2	Confident	115 Å²	115	64 Å²	64	50%	0.504	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-36.4	176.3	167.3	-107.9	0	0	0	113.6	S252 A281 L285	S252-F254 VanDerWaalsContact C-N 3.34Å; S252-F254 PolarHBondContact O-N 2.88Å; F254-A281 HydrophobicContact CD1-CB 4.38Å; F254-A281 HydrophobicContact CE1-CB 3.66Å; F254-A281 HydrophobicContact CZ-CB 3.88Å; F254-L285 HydrophobicContact CB-CD2 3.84Å; F254-L285 HydrophobicContact CD2-CD2 4.19Å; F254-L285 HydrophobicContact CG-CD2 4.26Å
255	K	84.6	Confident	89	Confident	92 Å²	92	64.8 Å²	64.8	40%	0.4	32%	0.322	S	S	.	.	S	Bend	trans	-158.8	100.7	-172.7	-173.7	178.6	179.7	-169.1	0	109.9	S252 S253 G257 S258 D278	S252-K255 CarbonylContact O-C 3.55Å; S252-K255 PolarHBondContact O-N 2.76Å; S253-K255 VanDerWaalsContact C-N 3.34Å; S253-K255 PolarHBondContact O-N 2.78Å; K255-G257 PolarHBondContact O-N 3.08Å; K255-S258 VanDerWaalsContact O-CB 3.26Å; K255-S258 WeakPolarHBondContact O-CB 3.05Å; K255-S258 PolarHBondContact O-N 2.75Å; K255-S258 PolarHBondContact O-OG 2.99Å; K255-D278 WeakPolarHBondContact CE-OD2 3.33Å; K255-D278 IonicContact NZ-OD1 2.7Å; K255-D278 PolarHBondContact NZ-OD1 2.76Å; K255-D278 IonicContact NZ-OD2 2.9Å; K255-D278 PolarHBondContact NZ-OD2 3.48Å
256	P	83.1	Confident	88.6	Confident	119 Å²	119	62.4 Å²	62.4	77%	0.773	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	135.5	-178.2	23.6	-33.2	0	0	0	111.1	S258	P256-S258 VanDerWaalsContact C-N 3.32Å; P256-S258 PolarHBondContact O-N 2.98Å
257	G	82.8	Confident	88.2	Confident	38 Å²	38	62.8 Å²	62.8	39%	0.392	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	8.7	-178.4	0	0	0	0	0	115.7	K255 R274	K255-G257 PolarHBondContact O-N 3.08Å; G257-R274 WeakPolarHBondContact O-CD 3.49Å; G257-R274 VanDerWaalsContact O-CZ 3.31Å; G257-R274 PolarHBondContact O-NE 2.85Å
258	S	87.4	Confident	88.1	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.028	33%	0.329	C	S	.	.			trans	-72.1	-35	171.7	57.6	0	0	0	0	113.1	K255 P256 Y273 R274	K255-S258 VanDerWaalsContact O-CB 3.26Å; K255-S258 WeakPolarHBondContact O-CB 3.05Å; K255-S258 PolarHBondContact O-N 2.75Å; K255-S258 PolarHBondContact O-OG 2.99Å; P256-S258 VanDerWaalsContact C-N 3.32Å; P256-S258 PolarHBondContact O-N 2.98Å; S258-Y273 WeakPolarHBondContact O-CD1 3.34Å; S258-R274 PolarHBondContact O-N 3.38Å
259	V	90.8	Very high	88.2	Confident	5 Å²	5	61.9 Å²	61.9	3%	0.03	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.7	171.7	-178.2	0	0	0	0	109.7	F251 V262 I271 Y273	F251-V259 HydrophobicContact CB-CG2 4.28Å; V259-V262 HydrophobicContact CG1-CG2 4.12Å; V259-I271 HydrophobicContact CG1-CG2 3.98Å; V259-I271 HydrophobicContact CG2-CG2 4.11Å; V259-Y273 HydrophobicContact CG2-CD1 4.5Å; V259-Y273 HydrophobicContact CG2-CE1 3.83Å
260	E	91.5	Very high	88.4	Confident	97 Å²	97	58.7 Å²	58.7	45%	0.453	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-40.6	173.7	179.5	176.8	118.4	0	0	111.3	R231 H272 R274	R231-E260 IonicContact CZ-OE1 2.72Å; R231-E260 IonicContact CZ-OE2 3.32Å; R231-E260 IonicContact NH1-OE1 3.29Å; R231-E260 PolarHBondContact NH1-OE1 2.86Å; R231-E260 IonicContact NH1-OE2 2.64Å; R231-E260 PolarHBondContact NH1-OE2 2.96Å; R231-E260 IonicContact NH2-OE1 3.46Å; R231-E260 PolarHBondContact NH2-OE1 2.9Å; R231-E260 IonicContact NH2-OE2 3.05Å; R231-E260 PolarHBondContact NH2-OE2 3.26Å; E260-H272 HydrophobicContact CB-CB 4.38Å; E260-H272 PolarHBondContact N-O 3.04Å; E260-R274 HydrophobicContact CB-CG 4.13Å
261	R	90.3	Very high	88.6	Confident	142 Å²	142	55.9 Å²	55.9	54%	0.536	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	140.1	-178.9	176.7	171.7	-176.4	103.4	23	111.6	H272	R261-H272 HydrophobicContact CB-CB 4.18Å; R261-H272 PolarHBondContact N-O 2.89Å; R261-H272 PolarHBondContact O-N 3.49Å
262	V	93.1	Very high	88.7	Confident	10 Å²	10	58.3 Å²	58.3	6%	0.061	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	150.4	161	-180	0	0	0	0	109.5	E244 L247 H248 V259 F270 I271	E244-V262 HydrophobicContact CB-CG1 4.18Å; E244-V262 HydrophobicContact CG-CG1 4.26Å; L247-V262 HydrophobicContact CB-CG1 4.08Å; L247-V262 HydrophobicContact CD1-CG1 4.06Å; H248-V262 HydrophobicContact CB-CG2 3.95Å; V259-V262 HydrophobicContact CG1-CG2 4.12Å; V262-F270 CarbonylContact C-O 3.29Å; V262-I271 HydrophobicContact CG2-CG1 4.4Å; V262-I271 HydrophobicContact CG2-CG2 4.46Å
263	K	93.1	Very high	88.9	Confident	103 Å²	103	57.6 Å²	57.6	45%	0.448	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	99.7	165.7	-173.7	-173.7	178.2	-175.5	0	110	E244 L265 A269 F270	E244-K263 VanDerWaalsContact OE1-CA 3.29Å; E244-K263 WeakPolarHBondContact OE1-CA 3.01Å; K263-L265 HydrophobicContact CD-CD1 4.41Å; K263-L265 HydrophobicContact CG-CD1 4.28Å; K263-A269 CarbonylContact O-C 3.6Å; K263-A269 VanDerWaalsContact O-CA 3.3Å; K263-A269 WeakPolarHBondContact O-CA 3.42Å; K263-F270 PolarHBondContact N-O 3.14Å; K263-F270 PolarHBondContact O-N 3.08Å
264	K	91.3	Very high	89.2	Confident	39 Å²	39	61.8 Å²	61.8	17%	0.17	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	149.8	169.4	-173.4	-173.4	172	-169	0	110	M239 M240 T242 E244 L247 T266 A269	M239-K264 PolarHBondContact O-NZ 3.37Å; M240-K264 PolarHBondContact O-NZ 3.5Å; T242-K264 VanDerWaalsContact O-CD 3.23Å; T242-K264 WeakPolarHBondContact O-CD 3.22Å; T242-K264 WeakPolarHBondContact O-CE 3.49Å; T242-K264 PolarHBondContact O-NZ 3.17Å; E244-K264 HydrophobicContact CG-CB 3.78Å; E244-K264 PolarHBondContact OE1-N 2.82Å; L247-K264 HydrophobicContact CD1-CB 4.35Å; K264-T266 WeakPolarHBondContact CE-O 3.4Å; K264-A269 HydrophobicContact CB-CB 4.17Å; K264-A269 HydrophobicContact CG-CB 4.5Å
265	L	87.8	Confident	89.6	Confident	83 Å²	83	58.3 Å²	58.3	44%	0.435	29%	0.288	S	S	.	.			trans	-114.6	-90.1	161.4	-76.7	81.1	0	0	0	109.4	K263 Y268 F270	K263-L265 HydrophobicContact CD-CD1 4.41Å; K263-L265 HydrophobicContact CG-CD1 4.28Å; L265-Y268 HydrophobicContact CB-CE1 4.45Å; L265-Y268 HydrophobicContact CB-CE2 4Å; L265-Y268 HydrophobicContact CD1-CE2 4.02Å; L265-Y268 HydrophobicContact CD2-CE2 4.17Å; L265-Y268 HydrophobicContact CG-CE2 4.28Å; L265-Y268 PolarHBondContact N-O 3.34Å; L265-F270 HydrophobicContact CD1-CD2 4.35Å; L265-F270 HydrophobicContact CD1-CE2 4.4Å
266	T	82.1	Confident	89.9	Confident	77 Å²	77	57 Å²	57	47%	0.472	28%	0.28	S	S	.	.	S	Bend	trans	-110.1	-85.6	-177.5	42.5	0	0	0	0	111.3	K264	K264-T266 WeakPolarHBondContact CE-O 3.4Å
267	D	83.2	Confident	90.3	Very high	26 Å²	26	54.5 Å²	54.5	14%	0.139	27%	0.266	C	S	.	.	S	Bend	trans	-104.6	7.3	-177.2	53.4	-50.2	0	0	0	112	R179 N237 L238	R179-D267 IonicContact CZ-OD2 2.68Å; R179-D267 IonicContact NH1-OD2 3.97Å; R179-D267 PolarHBondContact NH1-OD2 3.4Å; R179-D267 IonicContact NH2-OD2 3.71Å; R179-D267 PolarHBondContact NH2-OD2 2.98Å; N237-D267 PolarHBondContact N-O 2.92Å; N237-D267 VanDerWaalsContact N-O 3.08Å; L238-D267 PolarHBondContact N-O 3.46Å
268	Y	90.2	Very high	90.7	Very high	62 Å²	62	53.5 Å²	53.5	24%	0.243	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	159.8	-179.8	64.3	-89.5	0	0	0	112.3	Y234 V235 L265 F270	Y234-Y268 HydrophobicContact CD2-CD2 4.37Å; Y234-Y268 AromaticContact CE2-CD2 3.59Å; Y234-Y268 HydrophobicContact CE2-CD2 3.59Å; Y234-Y268 HydrophobicContact CE2-CE2 4.34Å; Y234-Y268 AromaticContact CE2-CG 3.85Å; Y234-Y268 HydrophobicContact CE2-CG 3.85Å; V235-Y268 CarbonylContact O-C 3.56Å; V235-Y268 WeakPolarHBondContact O-CA 3.42Å; V235-Y268 WeakPolarHBondContact O-CB 3.29Å; L265-Y268 HydrophobicContact CB-CE1 4.45Å; L265-Y268 HydrophobicContact CB-CE2 4Å; L265-Y268 HydrophobicContact CD1-CE2 4.02Å; L265-Y268 HydrophobicContact CD2-CE2 4.17Å; L265-Y268 HydrophobicContact CG-CE2 4.28Å; L265-Y268 PolarHBondContact N-O 3.34Å; Y268-F270 HydrophobicContact CD2-CE2 4.17Å; Y268-F270 AromaticContact CE2-CE2 3.9Å; Y268-F270 HydrophobicContact CE2-CE2 3.9Å; Y268-F270 HydrophobicContact CE2-CZ 4.42Å
269	A	92.9	Very high	90.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	155.1	176.5	0	0	0	0	0	112.2	V235 L238 L247 K263 K264	V235-A269 PolarHBondContact N-O 3.5Å; V235-A269 PolarHBondContact O-N 2.95Å; L238-A269 HydrophobicContact CD1-CB 3.67Å; L247-A269 HydrophobicContact CD1-CB 3.72Å; K263-A269 CarbonylContact O-C 3.6Å; K263-A269 VanDerWaalsContact O-CA 3.3Å; K263-A269 WeakPolarHBondContact O-CA 3.42Å; K264-A269 HydrophobicContact CB-CB 4.17Å; K264-A269 HydrophobicContact CG-CB 4.5Å
270	F	94.2	Very high	91	Very high	63 Å²	63	56.8 Å²	56.8	28%	0.276	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	131.6	168.2	-63.4	-80.5	0	0	0	109.9	V232 L233 Y234 V262 K263 L265 Y268 A301	V232-F270 HydrophobicContact CG1-CB 4.14Å; V232-F270 HydrophobicContact CG1-CD1 4.3Å; L233-F270 WeakPolarHBondContact O-CA 3.43Å; Y234-F270 HydrophobicContact CD2-CD1 4.12Å; Y234-F270 AromaticContact CD2-CE1 3.57Å; Y234-F270 HydrophobicContact CD2-CE1 3.57Å; Y234-F270 AromaticContact CD2-CZ 3.87Å; Y234-F270 HydrophobicContact CD2-CZ 3.87Å; Y234-F270 HydrophobicContact CE2-CE1 4.37Å; Y234-F270 HydrophobicContact CE2-CZ 4.23Å; Y234-F270 HydrophobicContact CG-CE1 4.38Å; V262-F270 CarbonylContact C-O 3.29Å; K263-F270 PolarHBondContact N-O 3.14Å; K263-F270 PolarHBondContact O-N 3.08Å; L265-F270 HydrophobicContact CD1-CD2 4.35Å; L265-F270 HydrophobicContact CD1-CE2 4.4Å; Y268-F270 HydrophobicContact CD2-CE2 4.17Å; Y268-F270 AromaticContact CE2-CE2 3.9Å; Y268-F270 HydrophobicContact CE2-CE2 3.9Å; Y268-F270 HydrophobicContact CE2-CZ 4.42Å; F270-A301 HydrophobicContact CD1-CB 3.83Å; F270-A301 HydrophobicContact CE1-CB 3.99Å
271	I	93.4	Very high	91	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	112.4	180	-54.3	-175	0	0	0	108.5	V232 L233 V235 F251 V259 V262 Y273	V232-I271 CarbonylContact C-O 3.59Å; V232-I271 WeakPolarHBondContact CA-O 3.16Å; L233-I271 PolarHBondContact N-O 2.66Å; L233-I271 PolarHBondContact O-N 2.85Å; V235-I271 HydrophobicContact CG2-CD1 3.74Å; V235-I271 HydrophobicContact CG2-CG1 4.16Å; F251-I271 HydrophobicContact CB-CD1 3.91Å; F251-I271 HydrophobicContact CB-CG2 4.45Å; F251-I271 HydrophobicContact CD1-CD1 3.66Å; F251-I271 HydrophobicContact CD2-CD1 3.35Å; F251-I271 HydrophobicContact CE1-CD1 3.97Å; F251-I271 HydrophobicContact CE2-CD1 3.68Å; F251-I271 HydrophobicContact CG-CD1 3.34Å; F251-I271 HydrophobicContact CZ-CD1 3.98Å; V259-I271 HydrophobicContact CG1-CG2 3.98Å; V259-I271 HydrophobicContact CG2-CG2 4.11Å; V262-I271 HydrophobicContact CG2-CG1 4.4Å; V262-I271 HydrophobicContact CG2-CG2 4.46Å; I271-Y273 HydrophobicContact CB-CE2 4.32Å; I271-Y273 HydrophobicContact CG2-CD2 4.15Å; I271-Y273 HydrophobicContact CG2-CE2 3.57Å
272	H	93.3	Very high	91	Very high	54 Å²	54	47.2 Å²	47.2	25%	0.25	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.2	180	-63.2	-113.7	0	0	0	109.2	V232 E260 R261	V232-H272 HydrophobicContact CG2-CB 4.5Å; E260-H272 HydrophobicContact CB-CB 4.38Å; E260-H272 PolarHBondContact N-O 3.04Å; R261-H272 HydrophobicContact CB-CB 4.18Å; R261-H272 PolarHBondContact N-O 2.89Å; R261-H272 PolarHBondContact O-N 3.49Å
273	Y	93.5	Very high	90.9	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	149.5	174.4	-80.4	-90.1	0	0	0	111.6	R231 L233 F251 S258 V259 I271 S275 D278 A279 A282	R231-Y273 WeakPolarHBondContact CD-O 3.46Å; R231-Y273 WeakPolarHBondContact CG-O 3.48Å; R231-Y273 PolarHBondContact NH1-O 2.88Å; R231-Y273 PolarHBondContact O-N 2.68Å; L233-Y273 HydrophobicContact CD1-CD2 4.26Å; L233-Y273 HydrophobicContact CD1-CE2 3.64Å; L233-Y273 HydrophobicContact CG-CD2 4.16Å; L233-Y273 HydrophobicContact CG-CE2 3.98Å; F251-Y273 WeakPolarHBondContact CB-OH 3.34Å; F251-Y273 PolarHBondContact O-OH 2.97Å; S258-Y273 WeakPolarHBondContact O-CD1 3.34Å; V259-Y273 HydrophobicContact CG2-CD1 4.5Å; V259-Y273 HydrophobicContact CG2-CE1 3.83Å; I271-Y273 HydrophobicContact CB-CE2 4.32Å; I271-Y273 HydrophobicContact CG2-CD2 4.15Å; I271-Y273 HydrophobicContact CG2-CE2 3.57Å; Y273-S275 VanDerWaalsContact C-N 3.34Å; Y273-D278 HydrophobicContact CD1-CB 3.84Å; Y273-D278 HydrophobicContact CE1-CB 4.5Å; Y273-A279 HydrophobicContact CD2-CB 3.96Å; Y273-A279 HydrophobicContact CG-CB 4.04Å; Y273-A282 HydrophobicContact CE1-CB 4.06Å; Y273-A282 HydrophobicContact CE2-CB 4.09Å; Y273-A282 WeakPolarHBondContact OH-CB 3.34Å
274	R	91.1	Very high	90.9	Very high	167 Å²	167	49 Å²	49	63%	0.63	25%	0.253	S	S	*	.	S	Bend	trans	-64.8	-37.3	174.2	-63.7	-177.6	-174.6	-164.6	2	112.4	G257 S258 E260	G257-R274 WeakPolarHBondContact O-CD 3.49Å; G257-R274 VanDerWaalsContact O-CZ 3.31Å; G257-R274 PolarHBondContact O-NE 2.85Å; S258-R274 PolarHBondContact O-N 3.38Å; E260-R274 HydrophobicContact CB-CG 4.13Å
275	S	91.6	Very high	90.8	Very high	43 Å²	43	51.8 Å²	51.8	30%	0.301	27%	0.27	S	S	.	.			trans	-123.5	148.6	-179	-177.4	0	0	0	0	112.8	Y273 S277 D278 A279	Y273-S275 VanDerWaalsContact C-N 3.34Å; S275-S277 VanDerWaalsContact C-N 3.3Å; S275-S277 WeakPolarHBondContact CB-OG 3.47Å; S275-S277 PolarHBondContact O-N 3.1Å; S275-S277 PolarHBondContact OG-N 2.75Å; S275-S277 PolarHBondContact OG-OG 3.14Å; S275-D278 PolarHBondContact O-N 2.95Å; S275-A279 PolarHBondContact O-N 2.8Å
276	R	90.6	Very high	90.9	Very high	63 Å²	63	48.7 Å²	48.7	24%	0.238	25%	0.253	C	S	.	.	H	α-helix	trans	-61.2	-37.3	170	-176.2	60.8	169.1	120	-10.2	112.2	M227 Q228 V230 D278 A279 I280	M227-R276 PolarHBondContact O-NH2 3.29Å; Q228-R276 WeakPolarHBondContact O-CD 3.42Å; Q228-R276 PolarHBondContact O-NE 3.36Å; V230-R276 WeakPolarHBondContact O-CD 3.34Å; V230-R276 PolarHBondContact O-NE 3.36Å; R276-D278 VanDerWaalsContact C-N 3.34Å; R276-D278 PolarHBondContact O-N 3.28Å; R276-A279 PolarHBondContact O-N 2.96Å; R276-I280 HydrophobicContact CG-CD1 4.15Å; R276-I280 WeakPolarHBondContact O-CG1 3.22Å; R276-I280 PolarHBondContact O-N 3.45Å; R276-I280 VanDerWaalsContact O-N 3.08Å
277	S	92	Very high	91.4	Very high	68 Å²	68	49.3 Å²	49.3	48%	0.476	25%	0.254	S	S	.	.	H	α-helix	trans	-58.5	-46.4	176.4	56.3	0	0	0	0	111.8	S275 I280 A281	S275-S277 VanDerWaalsContact C-N 3.3Å; S275-S277 WeakPolarHBondContact CB-OG 3.47Å; S275-S277 PolarHBondContact O-N 3.1Å; S275-S277 PolarHBondContact OG-N 2.75Å; S275-S277 PolarHBondContact OG-OG 3.14Å; S277-I280 PolarHBondContact O-N 3.44Å; S277-A281 PolarHBondContact O-N 3.11Å
278	D	92.3	Very high	91.5	Very high	16 Å²	16	50.3 Å²	50.3	9%	0.086	27%	0.27	C	S	.	.	H	α-helix	trans	-71.3	-37.1	-174.4	-62	8.3	0	0	0	110.2	K255 Y273 S275 R276 A281 A282	K255-D278 WeakPolarHBondContact CE-OD2 3.33Å; K255-D278 IonicContact NZ-OD1 2.7Å; K255-D278 PolarHBondContact NZ-OD1 2.76Å; K255-D278 IonicContact NZ-OD2 2.9Å; K255-D278 PolarHBondContact NZ-OD2 3.48Å; Y273-D278 HydrophobicContact CD1-CB 3.84Å; Y273-D278 HydrophobicContact CE1-CB 4.5Å; S275-D278 PolarHBondContact O-N 2.95Å; R276-D278 VanDerWaalsContact C-N 3.34Å; R276-D278 PolarHBondContact O-N 3.28Å; D278-A281 PolarHBondContact O-N 2.66Å; D278-A282 VanDerWaalsContact O-CB 3.31Å; D278-A282 WeakPolarHBondContact O-CB 3.37Å; D278-A282 PolarHBondContact O-N 3.21Å
279	A	90.4	Very high	91.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-40.3	171	0	0	0	0	0	112.6	L233 Y273 S275 R276 L283	L233-A279 HydrophobicContact CD2-CB 4.13Å; L233-A279 HydrophobicContact CG-CB 4.41Å; Y273-A279 HydrophobicContact CD2-CB 3.96Å; Y273-A279 HydrophobicContact CG-CB 4.04Å; S275-A279 PolarHBondContact O-N 2.8Å; R276-A279 PolarHBondContact O-N 2.96Å; A279-L283 WeakPolarHBondContact O-CB 3.3Å; A279-L283 PolarHBondContact O-N 3.22Å
280	I	92.3	Very high	91.3	Very high	78 Å²	78	55.6 Å²	55.6	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-69.1	-44.7	177.4	-65.7	166.8	0	0	0	110.7	R276 S277 A282 L283 T284	R276-I280 HydrophobicContact CG-CD1 4.15Å; R276-I280 WeakPolarHBondContact O-CG1 3.22Å; R276-I280 PolarHBondContact O-N 3.45Å; R276-I280 VanDerWaalsContact O-N 3.08Å; S277-I280 PolarHBondContact O-N 3.44Å; I280-A282 PolarHBondContact O-N 2.79Å; I280-L283 WeakPolarHBondContact O-CB 3.33Å; I280-L283 PolarHBondContact O-N 3.29Å; I280-T284 PolarHBondContact O-N 2.83Å; I280-T284 PolarHBondContact O-OG1 3.05Å
281	A	91.8	Very high	91	Very high	34 Å²	34	53 Å²	53	28%	0.281	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-45.7	177.2	0	0	0	0	0	111.8	F254 S277 D278 T284 L285	F254-A281 HydrophobicContact CD1-CB 4.38Å; F254-A281 HydrophobicContact CE1-CB 3.66Å; F254-A281 HydrophobicContact CZ-CB 3.88Å; S277-A281 PolarHBondContact O-N 3.11Å; D278-A281 PolarHBondContact O-N 2.66Å; A281-T284 PolarHBondContact O-N 3.09Å; A281-L285 WeakPolarHBondContact O-CB 3.39Å; A281-L285 PolarHBondContact O-N 3.27Å
282	A	90.8	Very high	90.5	Very high	4 Å²	4	56.7 Å²	56.7	3%	0.033	31%	0.311	C	S	.	.	H	α-helix	trans	-67.1	-36	176.2	0	0	0	0	0	113	L233 Y273 D278 I280 L285 M286	L233-A282 HydrophobicContact CD1-CB 4.05Å; Y273-A282 HydrophobicContact CE1-CB 4.06Å; Y273-A282 HydrophobicContact CE2-CB 4.09Å; Y273-A282 WeakPolarHBondContact OH-CB 3.34Å; D278-A282 VanDerWaalsContact O-CB 3.31Å; D278-A282 WeakPolarHBondContact O-CB 3.37Å; D278-A282 PolarHBondContact O-N 3.21Å; I280-A282 PolarHBondContact O-N 2.79Å; A282-L285 PolarHBondContact O-N 2.87Å; A282-M286 VanDerWaalsContact O-CB 3.22Å; A282-M286 WeakPolarHBondContact O-CB 3.33Å; A282-M286 WeakPolarHBondContact O-CG 3.33Å; A282-M286 PolarHBondContact O-N 2.87Å
283	L	92	Very high	89.9	Confident	34 Å²	34	56.7 Å²	56.7	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-59.1	-50.3	172.6	171.8	68.3	0	0	0	111.4	L233 A279 I280 L285 N287 V298 L300	L233-L283 HydrophobicContact CD1-CB 4.33Å; L233-L283 HydrophobicContact CD2-CB 4.1Å; A279-L283 WeakPolarHBondContact O-CB 3.3Å; A279-L283 PolarHBondContact O-N 3.22Å; I280-L283 WeakPolarHBondContact O-CB 3.33Å; I280-L283 PolarHBondContact O-N 3.29Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.3Å; L283-N287 WeakPolarHBondContact O-CB 3.36Å; L283-N287 PolarHBondContact O-N 3.47Å; L283-V298 HydrophobicContact CD1-CB 4.09Å; L283-V298 HydrophobicContact CD1-CG1 3.77Å; L283-V298 WeakPolarHBondContact CD1-O 3.07Å; L283-L300 HydrophobicContact CD2-CD1 4.25Å; L283-L300 HydrophobicContact CD2-CG 4.12Å
284	T	91.3	Very high	89.5	Confident	116 Å²	116	57 Å²	57	71%	0.712	33%	0.328	S	S	*	.	H	α-helix	trans	-67.6	-33.2	-179.6	-59	0	0	0	0	112.6	I280 A281	I280-T284 PolarHBondContact O-N 2.83Å; I280-T284 PolarHBondContact O-OG1 3.05Å; A281-T284 PolarHBondContact O-N 3.09Å
285	L	91	Very high	89.4	Confident	99 Å²	99	52.7 Å²	52.7	52%	0.518	32%	0.32	S	S	.	.	H	α-helix	trans	-81.6	-39.2	-178.9	-175.4	65.4	0	0	0	113.7	F254 A281 A282 L283	F254-L285 HydrophobicContact CB-CD2 3.84Å; F254-L285 HydrophobicContact CD2-CD2 4.19Å; F254-L285 HydrophobicContact CG-CD2 4.26Å; A281-L285 WeakPolarHBondContact O-CB 3.39Å; A281-L285 PolarHBondContact O-N 3.27Å; A282-L285 PolarHBondContact O-N 2.87Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.3Å
286	M	89.6	Confident	89.3	Confident	17 Å²	17	50.7 Å²	50.7	8%	0.084	31%	0.306	C	S	.	.	H	α-helix	trans	-98.5	-11.5	-170	-59.3	-61	-65.7	0	0	114.1	E250 F251 A282 G288 A289 I291 V298	E250-M286 HydrophobicContact CB-CE 3.98Å; F251-M286 HydrophobicContact CD1-CB 4.22Å; F251-M286 HydrophobicContact CD1-CG 3.89Å; F251-M286 HydrophobicContact CD2-CE 4.42Å; F251-M286 HydrophobicContact CE1-CB 3.53Å; F251-M286 HydrophobicContact CE1-CG 3.73Å; F251-M286 HydrophobicContact CE2-CE 4.28Å; F251-M286 HydrophobicContact CZ-CB 3.87Å; F251-M286 HydrophobicContact CZ-CE 4.39Å; F251-M286 HydrophobicContact CZ-CG 4.28Å; A282-M286 VanDerWaalsContact O-CB 3.22Å; A282-M286 WeakPolarHBondContact O-CB 3.33Å; A282-M286 WeakPolarHBondContact O-CG 3.33Å; A282-M286 PolarHBondContact O-N 2.87Å; M286-G288 PolarHBondContact O-N 2.89Å; M286-A289 HydrophobicContact CE-CB 4.13Å; M286-A289 VanDerWaalsContact O-CB 3.26Å; M286-A289 WeakPolarHBondContact O-CB 3.28Å; M286-A289 PolarHBondContact O-N 2.83Å; M286-A289 VanDerWaalsContact O-N 3.07Å; M286-I291 HydrophobicContact CE-CD1 4.2Å; M286-V298 HydrophobicContact CB-CG2 4.16Å
287	N	91.5	Very high	89.3	Confident	90 Å²	90	51.3 Å²	51.3	48%	0.481	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	114.9	176.9	-173.9	42.7	0	0	0	110.9	L283 V298	L283-N287 WeakPolarHBondContact O-CB 3.36Å; L283-N287 PolarHBondContact O-N 3.47Å; N287-V298 HydrophobicContact CB-CB 4.08Å; N287-V298 PolarHBondContact OD1-N 2.85Å; N287-V298 PolarHBondContact OD1-O 3.29Å
288	G	86.6	Confident	89.3	Confident	47 Å²	47	48.2 Å²	48.2	49%	0.485	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	-1.3	-172.5	0	0	0	0	0	114.6	M286 V296	M286-G288 PolarHBondContact O-N 2.89Å; G288-V296 WeakPolarHBondContact CA-O 3.5Å; G288-V296 PolarHBondContact N-O 2.9Å
289	A	89	Confident	89.2	Confident	28 Å²	28	50.5 Å²	50.5	23%	0.231	31%	0.305	C	S	.	.			trans	-64.9	154.6	175.8	0	0	0	0	0	111.8	M286 T295 V296	M286-A289 HydrophobicContact CE-CB 4.13Å; M286-A289 VanDerWaalsContact O-CB 3.26Å; M286-A289 WeakPolarHBondContact O-CB 3.28Å; M286-A289 PolarHBondContact O-N 2.83Å; M286-A289 VanDerWaalsContact O-N 3.07Å; A289-T295 CarbonylContact O-C 3.08Å; A289-T295 WeakPolarHBondContact O-CA 3.37Å; A289-V296 HydrophobicContact CB-CG2 4.4Å; A289-V296 PolarHBondContact O-N 2.79Å
290	Q	89.3	Confident	89.3	Confident	145 Å²	145	52 Å²	52	68%	0.678	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.5	114.4	-179.9	-161.1	173.7	23.5	0	0	110.8	G293 A294	Q290-G293 PolarHBondContact NE2-O 2.84Å; Q290-A294 CarbonylContact C-O 3.57Å; Q290-A294 WeakPolarHBondContact CA-O 3.3Å
291	I	87.6	Confident	89	Confident	8 Å²	8	48.6 Å²	48.6	4%	0.041	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.4	176.4	-54.8	-175.1	0	0	0	108.1	T242 T246 L247 E250 F251 M286 G293 A294 V296	T242-I291 HydrophobicContact CG2-CG2 4.12Å; T246-I291 HydrophobicContact CG2-CG2 3.87Å; L247-I291 HydrophobicContact CD2-CD1 4.41Å; E250-I291 HydrophobicContact CB-CD1 4.09Å; E250-I291 HydrophobicContact CG-CD1 4.2Å; E250-I291 HydrophobicContact CG-CG1 4.44Å; E250-I291 HydrophobicContact CG-CG2 4.5Å; F251-I291 HydrophobicContact CD2-CD1 4.47Å; F251-I291 HydrophobicContact CE2-CD1 3.79Å; M286-I291 HydrophobicContact CE-CD1 4.2Å; I291-G293 PolarHBondContact O-N 3.33Å; I291-G293 VanDerWaalsContact O-N 3.16Å; I291-A294 PolarHBondContact N-O 2.89Å; I291-A294 PolarHBondContact O-N 3.01Å; I291-V296 HydrophobicContact CB-CG1 3.81Å; I291-V296 HydrophobicContact CD1-CG1 3.99Å; I291-V296 HydrophobicContact CD1-CG2 4.01Å; I291-V296 HydrophobicContact CG1-CG1 3.87Å; I291-V296 HydrophobicContact CG1-CG2 4.23Å
292	D	83.3	Confident	88.7	Confident	79 Å²	79	52.1 Å²	52.1	42%	0.422	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	39.8	-177.1	-51.4	-35.2	0	0	0	113.3	M239 T242 A294	M239-D292 HydrophobicContact CG-CB 4.11Å; T242-D292 VanDerWaalsContact CA-OD2 3.23Å; T242-D292 WeakPolarHBondContact CA-OD2 3.5Å; T242-D292 WeakPolarHBondContact CB-OD2 3.42Å; T242-D292 VanDerWaalsContact CG2-OD2 3.27Å; T242-D292 WeakPolarHBondContact CG2-OD2 3.2Å; T242-D292 PolarHBondContact OG1-OD2 2.86Å; D292-A294 VanDerWaalsContact C-N 3.27Å; D292-A294 PolarHBondContact O-N 3.11Å
293	G	81.3	Confident	88.2	Confident	54 Å²	54	54 Å²	54	56%	0.557	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	-10.2	-177.8	0	0	0	0	0	115.4	Q290 I291	Q290-G293 PolarHBondContact NE2-O 2.84Å; I291-G293 PolarHBondContact O-N 3.33Å; I291-G293 VanDerWaalsContact O-N 3.16Å
294	A	84.6	Confident	86.9	Confident	6 Å²	6	57 Å²	57	5%	0.05	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	137	-180	0	0	0	0	0	112.9	K175 M239 Q290 I291 D292 V296	K175-A294 HydrophobicContact CD-CB 4.22Å; M239-A294 HydrophobicContact CG-CB 3.98Å; M239-A294 HydrophobicContact SD-CB 4.01Å; Q290-A294 CarbonylContact C-O 3.57Å; Q290-A294 WeakPolarHBondContact CA-O 3.3Å; I291-A294 PolarHBondContact N-O 2.89Å; I291-A294 PolarHBondContact O-N 3.01Å; D292-A294 VanDerWaalsContact C-N 3.27Å; D292-A294 PolarHBondContact O-N 3.11Å; A294-V296 PolarHBondContact O-N 3.49Å
295	T	88.1	Confident	85.2	Confident	78 Å²	78	54.8 Å²	54.8	48%	0.479	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	110.9	171.4	41.7	0	0	0	0	110.2	N237 A289	N237-T295 PolarHBondContact ND2-O 2.64Å; A289-T295 CarbonylContact O-C 3.08Å; A289-T295 WeakPolarHBondContact O-CA 3.37Å
296	V	90.3	Very high	83	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.006	36%	0.356	C	S	.	.			trans	-85.7	133.6	-179	-51.6	0	0	0	0	110.4	V235 L238 G288 A289 I291 A294 V298	V235-V296 HydrophobicContact CG1-CB 3.93Å; V235-V296 HydrophobicContact CG1-CG2 4.27Å; L238-V296 HydrophobicContact CD2-CB 4.37Å; L238-V296 HydrophobicContact CD2-CG1 3.68Å; G288-V296 WeakPolarHBondContact CA-O 3.5Å; G288-V296 PolarHBondContact N-O 2.9Å; A289-V296 HydrophobicContact CB-CG2 4.4Å; A289-V296 PolarHBondContact O-N 2.79Å; I291-V296 HydrophobicContact CB-CG1 3.81Å; I291-V296 HydrophobicContact CD1-CG1 3.99Å; I291-V296 HydrophobicContact CD1-CG2 4.01Å; I291-V296 HydrophobicContact CG1-CG1 3.87Å; I291-V296 HydrophobicContact CG1-CG2 4.23Å; A294-V296 PolarHBondContact O-N 3.49Å; V296-V298 HydrophobicContact CG2-CG2 4.22Å
297	E	89.6	Confident	80.9	Confident	76 Å²	76	65.6 Å²	65.6	36%	0.355	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.3	174.6	-69.1	174.9	-143.7	0	0	108.8	V235 R236	V235-E297 CarbonylContact C-O 3.54Å; V235-E297 WeakPolarHBondContact CA-O 3.35Å; R236-E297 HydrophobicContact CG-CB 3.75Å; R236-E297 IonicContact CZ-OE2 2.65Å; R236-E297 PolarHBondContact N-O 3.32Å; R236-E297 IonicContact NE-OE2 2.69Å; R236-E297 PolarHBondContact NE-OE2 3.47Å; R236-E297 IonicContact NH2-OE2 2.96Å; R236-E297 PolarHBondContact NH2-OE2 3.49Å; R236-E297 PolarHBondContact O-N 2.85Å; R236-E297 VanDerWaalsContact O-N 3.1Å
298	V	92.4	Very high	78.2	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.012	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.5	-174.1	-171.6	0	0	0	0	108.5	L233 V235 F251 L283 M286 N287 V296	L233-V298 HydrophobicContact CB-CG1 4.06Å; L233-V298 HydrophobicContact CD1-CG1 3.8Å; L233-V298 HydrophobicContact CG-CG1 4.36Å; V235-V298 HydrophobicContact CG1-CG2 4.26Å; V235-V298 HydrophobicContact CG2-CG1 4.28Å; V235-V298 HydrophobicContact CG2-CG2 4.26Å; F251-V298 HydrophobicContact CE1-CG1 4.39Å; F251-V298 HydrophobicContact CE1-CG2 4.07Å; F251-V298 HydrophobicContact CZ-CG2 3.89Å; L283-V298 HydrophobicContact CD1-CB 4.09Å; L283-V298 HydrophobicContact CD1-CG1 3.77Å; L283-V298 WeakPolarHBondContact CD1-O 3.07Å; M286-V298 HydrophobicContact CB-CG2 4.16Å; N287-V298 HydrophobicContact CB-CB 4.08Å; N287-V298 PolarHBondContact OD1-N 2.85Å; N287-V298 PolarHBondContact OD1-O 3.29Å; V296-V298 HydrophobicContact CG2-CG2 4.22Å
299	T	91.4	Very high	75.9	Confident	64 Å²	64	68.6 Å²	68.6	39%	0.393	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	172.2	172.2	66.5	0	0	0	0	110.3	L233 Y234	L233-T299 WeakPolarHBondContact CA-O 3.35Å; Y234-T299 PolarHBondContact N-O 2.92Å; Y234-T299 PolarHBondContact O-N 3.46Å
300	L	90.9	Very high	73.4	Confident	32 Å²	32	73.7 Å²	73.7	17%	0.168	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	128.7	171.3	-76.4	159.1	0	0	0	109.7	M227 V230 L233 L283 K302	M227-L300 HydrophobicContact CE-CB 3.55Å; M227-L300 HydrophobicContact CE-CD1 4.4Å; M227-L300 HydrophobicContact SD-CB 4.23Å; V230-L300 HydrophobicContact CG1-CB 4.32Å; V230-L300 HydrophobicContact CG1-CD2 3.95Å; L233-L300 HydrophobicContact CD2-CD2 3.75Å; L233-L300 HydrophobicContact CD2-CG 4.39Å; L283-L300 HydrophobicContact CD2-CD1 4.25Å; L283-L300 HydrophobicContact CD2-CG 4.12Å; L300-K302 PolarHBondContact O-N 3.49Å
301	A	87.8	Confident	70.7	Confident	7 Å²	7	70.8 Å²	70.8	6%	0.058	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-67.7	119.1	178	0	0	0	0	0	109.4	V230 V232 F270	V230-A301 WeakPolarHBondContact CG1-O 3.21Å; V232-A301 HydrophobicContact CB-CB 4Å; V232-A301 HydrophobicContact CG1-CB 3.78Å; V232-A301 WeakPolarHBondContact O-CB 3.27Å; V232-A301 PolarHBondContact O-N 2.9Å; F270-A301 HydrophobicContact CD1-CB 3.83Å; F270-A301 HydrophobicContact CE1-CB 3.99Å
302	K	84.6	Confident	68	Low	107 Å²	107	75.2 Å²	75.2	47%	0.465	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-53.9	135.4	173.7	-69.2	171.9	-175.6	161.8	0	109.3	E219 L300 A304	E219-K302 VanDerWaalsContact CG-NZ 3.32Å; E219-K302 WeakPolarHBondContact OE1-CE 3.33Å; E219-K302 IonicContact OE1-NZ 3.58Å; E219-K302 PolarHBondContact OE1-NZ 3.32Å; E219-K302 IonicContact OE2-NZ 2.69Å; L300-K302 PolarHBondContact O-N 3.49Å; K302-A304 PolarHBondContact O-N 2.74Å
303	P	79.3	Confident	65.8	Low	44 Å²	44	75 Å²	75	29%	0.286	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-57.7	128.1	175.9	26.7	-34.8	0	0	0	108.5	V222 V226 G305	V222-P303 HydrophobicContact CB-CG 4.38Å; V222-P303 HydrophobicContact CG1-CG 4.07Å; V226-P303 HydrophobicContact CG1-CB 4.15Å; V226-P303 HydrophobicContact CG1-CG 3.81Å; P303-G305 PolarHBondContact O-N 3.43Å
304	A	66.5	Low	63.6	Low	97 Å²	97	80.8 Å²	80.8	80%	0.802	51%	0.509	S	S	*	.			trans	-62	110.5	171.9	0	0	0	0	0	107.5	K302 I306	K302-A304 PolarHBondContact O-N 2.74Å; A304-I306 PolarHBondContact O-N 3.06Å
305	G	54.1	Low	61	Low	69 Å²	69	91.7 Å²	91.7	71%	0.711	55%	0.548	S	S	*	.			trans	-51.8	127.3	-174.9	0	0	0	0	0	110.7	P303 K307	P303-G305 PolarHBondContact O-N 3.43Å; G305-K307 PolarHBondContact O-N 3.49Å
306	I	45.1	Very low	58.1	Low	139 Å²	139	92.9 Å²	92.9	71%	0.713	55%	0.545	S	S	*	.			trans	-56.9	130.1	178.3	-61.8	174	0	0	0	107.2	A304 D308	A304-I306 PolarHBondContact O-N 3.06Å; I306-D308 VanDerWaalsContact C-N 3.33Å; I306-D308 WeakPolarHBondContact CG2-OD1 3.47Å; I306-D308 PolarHBondContact O-N 3.19Å
307	K	44.8	Very low	55.1	Low	205 Å²	205	99.6 Å²	99.6	89%	0.891	58%	0.581	S	S	*	*			trans	-75.3	94.6	168.3	-78.5	-172.3	175.4	-177.9	0	107.1	G305 G309	G305-K307 PolarHBondContact O-N 3.49Å; K307-G309 VanDerWaalsContact C-N 3.26Å; K307-G309 PolarHBondContact O-N 3.19Å
308	D	36.6	Very low	52.2	Low	135 Å²	135	102.1 Å²	102.1	72%	0.722	60%	0.602	S	S	*	*			trans	-65.5	79.5	-175.8	-61.5	-42.3	0	0	0	112.6	I306	I306-D308 VanDerWaalsContact C-N 3.33Å; I306-D308 WeakPolarHBondContact CG2-OD1 3.47Å; I306-D308 PolarHBondContact O-N 3.19Å
309	G	38.5	Very low	49.2	Very low	64 Å²	64	112.7 Å²	112.7	66%	0.66	64%	0.641	S	S	*	*			trans	-75.6	137.6	150.3	0	0	0	0	0	108.9	K307	K307-G309 VanDerWaalsContact C-N 3.26Å; K307-G309 PolarHBondContact O-N 3.19Å
310	S	35.2	Very low	46.2	Very low	136 Å²	136	112.2 Å²	112.2	95%	0.951	65%	0.649	S	S	*	*	S	Bend	trans	86.5	39.6	177	-44.8	0	0	0	0	117.9
311	A	32.1	Very low	43.1	Very low	84 Å²	84	122.2 Å²	122.2	69%	0.694	69%	0.686	S	S	*	*	S	Bend	trans	-129.8	145.2	153.1	0	0	0	0	0	110.5
312	A	32.5	Very low	40.2	Very low	101 Å²	101	129.7 Å²	129.7	84%	0.835	72%	0.724	S	S	*	*			trans	-64.7	136.4	-176.3	0	0	0	0	0	111.5	R314	A312-R314 PolarHBondContact O-N 3.02Å
313	G	35.9	Very low	37.5	Very low	75 Å²	75	127.2 Å²	127.2	77%	0.773	73%	0.729	S	S	*	*			trans	-72.5	96.4	-158.3	0	0	0	0	0	116.2	R315	G313-R315 PolarHBondContact O-N 2.78Å
314	R	35.3	Very low	35	Very low	174 Å²	174	133 Å²	133	66%	0.657	76%	0.758	S	S	*	*			trans	-75.4	71.3	154.7	-64.7	-158.1	-159.4	-166	8.3	110.9	D117 A312 Y316	D117-R314 IonicContact OD2-CZ 3.26Å; D117-R314 IonicContact OD2-NH1 2.66Å; D117-R314 PolarHBondContact OD2-NH1 2.71Å; D117-R314 IonicContact OD2-NH2 2.83Å; A312-R314 PolarHBondContact O-N 3.02Å; R314-Y316 VanDerWaalsContact C-N 3.32Å; R314-Y316 PolarHBondContact O-N 3.3Å
315	R	29.4	Very low	33.2	Very low	235 Å²	235	135 Å²	135	89%	0.887	76%	0.76	S	S	*	*			trans	-68.6	91.6	164.4	-73.8	-174.1	-179.4	174.2	1.4	109	G313 N317	G313-R315 PolarHBondContact O-N 2.78Å; R315-N317 PolarHBondContact O-N 3.23Å
316	Y	28.9	Very low	31.9	Very low	103 Å²	103	137 Å²	137	40%	0.404	77%	0.77	S	S	.	*			trans	-60.5	108.1	156.9	-87.5	-92	0	0	0	107.2	R314 T318	R314-Y316 VanDerWaalsContact C-N 3.32Å; R314-Y316 PolarHBondContact O-N 3.3Å; Y316-T318 PolarHBondContact O-N 3.45Å
317	N	26	Very low	31.1	Very low	143 Å²	143	135 Å²	135	77%	0.765	77%	0.774	S	S	*	*			trans	-80.9	70.7	-173.5	-166.6	15.4	0	0	0	109.4	R315 R319	R315-N317 PolarHBondContact O-N 3.23Å; N317-R319 PolarHBondContact O-N 3.47Å
318	T	29.7	Very low	30.1	Very low	129 Å²	129	129.5 Å²	129.5	79%	0.791	78%	0.775	S	S	*	*			trans	-66.8	74.9	169.6	-51.7	0	0	0	0	108.3	Y316 G320	Y316-T318 PolarHBondContact O-N 3.45Å; T318-G320 PolarHBondContact O-N 2.98Å
319	R	28.8	Very low	29.6	Very low	224 Å²	224	126.9 Å²	126.9	85%	0.845	78%	0.78	S	S	*	*			trans	-62.2	104.8	178.9	-173.1	176.9	-173.2	172	1.8	107.1	N317	N317-R319 PolarHBondContact O-N 3.47Å
320	G	27.3	Very low	29	Very low	53 Å²	53	131.4 Å²	131.4	55%	0.546	80%	0.795	S	S	.	*			trans	-55.2	143.8	-168.1	0	0	0	0	0	112.9	T318 L322	T318-G320 PolarHBondContact O-N 2.98Å; G320-L322 PolarHBondContact O-N 2.92Å
321	Y	27.3	Very low	28.5	Very low	242 Å²	242	127.9 Å²	127.9	95%	0.949	78%	0.78	S	S	*	*			trans	-70	85.3	170.7	-137.4	-90.8	0	0	0	108.3	G323	Y321-G323 PolarHBondContact O-N 3.4Å
322	L	26.8	Very low	28.1	Very low	165 Å²	165	130.7 Å²	130.7	86%	0.864	78%	0.783	S	S	*	*			trans	-70.1	82.4	174.6	-94.6	153.8	0	0	0	109.2	G320 N324	G320-L322 PolarHBondContact O-N 2.92Å; L322-N324 PolarHBondContact O-N 2.95Å
323	G	27.7	Very low	27.7	Very low	55 Å²	55	129.4 Å²	129.4	57%	0.567	78%	0.78	S	S	*	*			trans	-68.9	123	166.1	0	0	0	0	0	109.8	Y321 T325	Y321-G323 PolarHBondContact O-N 3.4Å; G323-T325 PolarHBondContact O-N 3.37Å
324	N	27.6	Very low	27.1	Very low	166 Å²	166	135.7 Å²	135.7	89%	0.888	78%	0.78	S	S	*	*			trans	-66	120.6	174.2	-88.8	-4.8	0	0	0	110.7	L322	L322-N324 PolarHBondContact O-N 2.95Å
325	T	27.9	Very low	26.5	Very low	138 Å²	138	133.2 Å²	133.2	85%	0.847	79%	0.788	S	S	*	*			trans	-124.8	98.3	157.7	39.8	0	0	0	0	109.4	G323 A327	G323-T325 PolarHBondContact O-N 3.37Å; T325-A327 PolarHBondContact O-N 3.04Å
326	A	25.6	Very low	26.2	Very low	111 Å²	111	126.4 Å²	126.4	92%	0.917	78%	0.776	S	S	*	*			trans	-81.9	109	171.4	0	0	0	0	0	109.4
327	A	28.8	Very low	26	Very low	98 Å²	98	128.9 Å²	128.9	81%	0.81	80%	0.796	S	S	*	*			trans	-143	115.4	170.1	0	0	0	0	0	109.4	T325	T325-A327 PolarHBondContact O-N 3.04Å
328	G	24.3	Very low	25.8	Very low	88 Å²	88	132.8 Å²	132.8	91%	0.907	80%	0.8	S	S	*	*			trans	-90.4	140.8	171.9	0	0	0	0	0	111
329	G	25.8	Very low	25.5	Very low	80 Å²	80	131.1 Å²	131.1	83%	0.825	80%	0.799	S	S	*	*			trans	-168.7	115.2	177.6	0	0	0	0	0	112.3
330	V	25.9	Very low	25.3	Very low	159 Å²	159	126.4 Å²	126.4	96%	0.964	80%	0.795	S	S	*	*			trans	-100.1	143.9	173.2	-179.6	0	0	0	0	107.7
331	G	25.1	Very low	25.4	Very low	63 Å²	63	129.4 Å²	129.4	65%	0.649	81%	0.805	S	S	*	*			cis	161	-156.6	-2.6	0	0	0	0	0	111.9
332	D	23.8	Very low	25.2	Very low	142 Å²	142	125.3 Å²	125.3	76%	0.759	80%	0.799	S	S	*	*			trans	67.4	147.6	172	-123.6	-35.9	0	0	0	119.4	R334	D332-R334 IonicContact OD1-NE 2.64Å
333	G	23.9	Very low	25.1	Very low	74 Å²	74	126.5 Å²	126.5	76%	0.763	80%	0.8	S	S	*	*			trans	144	81.9	-174.8	0	0	0	0	0	114.4
334	R	22.8	Very low	24.9	Very low	208 Å²	208	129.9 Å²	129.9	79%	0.785	81%	0.81	S	S	*	*			trans	-85.7	143.9	-175.6	-48.9	174.1	-164.5	178.3	3	110.8	D332	D332-R334 IonicContact OD1-NE 2.64Å
335	C	22.3	Very low	24.7	Very low	121 Å²	121	133.3 Å²	133.3	82%	0.818	81%	0.81	S	S	*	*				167.1	166.8	85.2	-92.5	0	0	0	0	109.1
336	S	23.7	Very low	24.5	Very low	92 Å²	92	135.4 Å²	135.4	64%	0.643	82%	0.816	S	S	*	*			cis	-175	145.7	-27.8	-169.2	0	0	0	0	110.2
337	L	24.1	Very low	24.3	Very low	155 Å²	155	133.4 Å²	133.4	81%	0.812	81%	0.805	S	S	*	*			trans	68.3	158.5	166.4	-65.2	158.5	0	0	0	117.2
338	R	22.5	Very low	24.3	Very low	226 Å²	226	136.2 Å²	136.2	85%	0.853	81%	0.807	S	S	*	*			cis	-151.2	141.8	18.3	-153.1	178.5	-168.3	178.7	4	115.2
339	A	23.5	Very low	24.8	Very low	93 Å²	93	137 Å²	137	77%	0.769	80%	0.796	S	S	*	*			trans	67.5	140.2	151.9	0	0	0	0	0	123.1
340	T	23.8	Very low	24.7	Very low	125 Å²	125	142.9 Å²	142.9	77%	0.767	80%	0.795	S	S	*	*			trans	-112.6	-178.6	163.5	56.4	0	0	0	0	109.5
341	P	30.7	Very low	24.6	Very low	116 Å²	116	145.1 Å²	145.1	75%	0.753	79%	0.787	S	S	*	*				-149.4	140.6	92.7	36.8	-18.1	0	0	0	118
342	L	22.4	Very low	24.6	Very low	156 Å²	156	149 Å²	149	82%	0.817	79%	0.793	S	S	*	*				46.8	120.8	124.3	-56.8	171.3	0	0	0	123.1
343	Q	24.6	Very low	24.6	Very low	190 Å²	190	145.6 Å²	145.6	89%	0.888	79%	0.792	S	S	*	*				-164.3	160	121.3	-99.8	174.5	9.8	0	0	107.8
344	T	23.8	Very low	24.6	Very low	126 Å²	126	146 Å²	146	77%	0.773	80%	0.796	S	S	*	*			cis	-174	152.3	-35.6	-87.3	0	0	0	0	103.8
345	R	23.1	Very low	24.7	Very low	238 Å²	238	141.2 Å²	141.2	90%	0.898	80%	0.801	S	S	*	*			trans	-63	156.7	-177.7	-58.7	173.3	175.8	171.8	-3.7	112.7
346	L	24.6	Very low	24.7	Very low	183 Å²	183	145 Å²	145	96%	0.958	80%	0.804	S	S	*	*				-153.4	165.6	129.7	-112.4	165.9	0	0	0	111.8
347	G	21.8	Very low	24.6	Very low	68 Å²	68	145.5 Å²	145.5	70%	0.701	81%	0.808	S	S	*	*			trans	-93.9	169.7	-158.3	0	0	0	0	0	116.7
348	N	28.6	Very low	24.6	Very low	158 Å²	158	144.1 Å²	144.1	85%	0.845	80%	0.8	S	S	*	*			trans	-103.7	134.3	174.8	-177.1	65.6	0	0	0	110.4
349	P	33.2	Very low	24.6	Very low	104 Å²	104	141.6 Å²	141.6	68%	0.675	80%	0.798	S	S	*	*			trans	-125.1	127	168.5	34.6	-20.6	0	0	0	115
350	Y	25	Very low	25.4	Very low	204 Å²	204	142.6 Å²	142.6	80%	0.8	80%	0.797	S	S	*	*			trans	19.5	134.4	143.8	-65.3	-95.5	0	0	0	121.6
351	Y	24	Very low	25.4	Very low	206 Å²	206	142.4 Å²	142.4	81%	0.808	79%	0.791	S	S	*	*				-165	108.2	93.6	-123.2	-102.1	0	0	0	116.3
352	N	24.8	Very low	25.2	Very low	143 Å²	143	140.9 Å²	140.9	77%	0.765	79%	0.789	S	S	*	*				62.2	153.5	124.9	-149	12.1	0	0	0	125
353	G	23.5	Very low	25.3	Very low	72 Å²	72	141 Å²	141	74%	0.742	78%	0.782	S	S	*	*			trans	94.7	121.2	171.7	0	0	0	0	0	113.6
354	G	23.5	Very low	25.3	Very low	82 Å²	82	139.2 Å²	139.2	85%	0.845	78%	0.778	S	S	*	*			cis	146.7	149.6	13.4	0	0	0	0	0	106.6
355	A	24.3	Very low	25.2	Very low	108 Å²	108	142.1 Å²	142.1	89%	0.893	78%	0.78	S	S	*	*			cis	-145	-164.2	9.2	0	0	0	0	0	111.6
356	F	22.2	Very low	25.3	Very low	199 Å²	199	137.4 Å²	137.4	87%	0.873	78%	0.777	S	S	*	*			trans	-129.3	153.9	-161.8	-126.8	-92.6	0	0	0	113.8
357	S	23.5	Very low	25.2	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	77%	0.769	S	S	*	*			trans	-167.6	104.6	149.2	-145.7	0	0	0	0	109.9
358	L	23.5	Very low	25.3	Very low	126 Å²	126	136.6 Å²	136.6	66%	0.66	78%	0.776	S	S	*	*				67.1	109.9	95.9	-63.3	170.3	0	0	0	114.1
359	Q	22	Very low	26.5	Very low	172 Å²	172	133.9 Å²	133.9	80%	0.804	77%	0.767	S	S	*	*				87.1	158.5	62.3	-87.6	-163.2	-14.3	0	0	114.3
360	P	40.3	Very low	27.1	Very low	114 Å²	114	133.8 Å²	133.8	74%	0.74	77%	0.767	S	S	*	*			cis	-115.3	-160	-9.5	43	-29.3	0	0	0	111
361	D	23.6	Very low	27.3	Very low	121 Å²	121	130.2 Å²	130.2	65%	0.647	76%	0.761	S	S	*	*			cis	-129.9	-118.5	-2.3	-161.9	31.2	0	0	0	112.1	K363	D361-K363 WeakPolarHBondContact OD1-CE 3.45Å; D361-K363 IonicContact OD1-NZ 2.65Å; D361-K363 PolarHBondContact OD1-NZ 3.02Å; D361-K363 WeakPolarHBondContact OD2-CE 3.38Å; D361-K363 IonicContact OD2-NZ 2.67Å; D361-K363 PolarHBondContact OD2-NZ 2.91Å
362	A	26.1	Very low	27.4	Very low	85 Å²	85	129 Å²	129	70%	0.702	76%	0.755	S	S	*	*			cis	-151.1	-178.1	-0.8	0	0	0	0	0	110.7
363	K	25.4	Very low	27.5	Very low	157 Å²	157	130.8 Å²	130.8	68%	0.683	76%	0.757	S	S	*	*			trans	-141.8	176.1	-176.1	-51.9	94.3	-163.2	-177.3	0	111.4	D361	D361-K363 WeakPolarHBondContact OD1-CE 3.45Å; D361-K363 IonicContact OD1-NZ 2.65Å; D361-K363 PolarHBondContact OD1-NZ 3.02Å; D361-K363 WeakPolarHBondContact OD2-CE 3.38Å; D361-K363 IonicContact OD2-NZ 2.67Å; D361-K363 PolarHBondContact OD2-NZ 2.91Å
364	I	24.3	Very low	27.5	Very low	154 Å²	154	130.4 Å²	130.4	79%	0.79	75%	0.752	S	S	*	*			cis	-154.5	-165.2	13.6	-154	154.7	0	0	0	112.8
365	F	22.4	Very low	27.6	Very low	187 Å²	187	135.1 Å²	135.1	82%	0.82	76%	0.757	S	S	*	*			trans	-60.7	176.2	172	-82.9	-121.7	0	0	0	114.1
366	T	24	Very low	27.6	Very low	138 Å²	138	138.2 Å²	138.2	85%	0.847	76%	0.755	S	S	*	*			cis	-156.5	170.5	33.1	53.5	0	0	0	0	113.6
367	G	22.9	Very low	27.8	Very low	76 Å²	76	134.5 Å²	134.5	78%	0.784	75%	0.748	S	S	*	*			trans	142.5	135.5	149.9	0	0	0	0	0	117.2
368	N	23.1	Very low	27.9	Very low	158 Å²	158	136.3 Å²	136.3	85%	0.845	76%	0.755	S	S	*	*			trans	-156.3	-172.1	173.7	-148.4	-4.8	0	0	0	111.6
369	P	55.3	Low	28.1	Very low	102 Å²	102	133.4 Å²	133.4	66%	0.662	76%	0.756	S	S	*	*				-101.6	-162.8	-124.4	42.7	-24.5	0	0	0	112.9
370	P	46	Very low	28.3	Very low	102 Å²	102	133.4 Å²	133.4	66%	0.662	76%	0.761	S	S	*	*				-161.4	169.2	79.4	43.4	-22.9	0	0	0	119.2
371	N	27.5	Very low	27.7	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	77%	0.766	S	S	*	*			trans	63.1	152.1	151.1	-69.1	-37.9	0	0	0	119.2
372	R	27.7	Very low	27.8	Very low	181 Å²	181	131.6 Å²	131.6	68%	0.683	76%	0.763	S	S	*	*			cis	-153.2	-164.3	-8.1	-126.3	-177.8	-82.1	149.9	-3.5	106.9
373	F	25.4	Very low	27.8	Very low	181 Å²	181	135.9 Å²	135.9	79%	0.794	77%	0.773	S	S	*	*			cis	-151.6	-149.8	10.2	-138.1	-31	0	0	0	109.4
374	G	24.4	Very low	27.7	Very low	63 Å²	63	136.4 Å²	136.4	65%	0.649	78%	0.78	S	S	*	*			trans	-171.5	171.5	172.7	0	0	0	0	0	115.1
375	L	25.8	Very low	27.8	Very low	181 Å²	181	135.3 Å²	135.3	95%	0.948	78%	0.78	S	S	*	*			trans	-154.2	162.9	172.2	-153.9	68.5	0	0	0	111.8
376	M	23.6	Very low	28.2	Very low	174 Å²	174	132.9 Å²	132.9	86%	0.857	78%	0.781	S	S	*	*			trans	-126.6	180	-175.9	-77.7	-179.1	162.9	0	0	112.2
377	V	26.3	Very low	28.4	Very low	120 Å²	120	130 Å²	130	73%	0.727	78%	0.779	S	S	*	*				130.3	117.4	128.9	-177	0	0	0	0	116.3
378	T	27.2	Very low	28.7	Very low	142 Å²	142	134.4 Å²	134.4	87%	0.871	78%	0.783	S	S	*	*			trans	59.7	157.6	161.4	55.2	0	0	0	0	121
379	G	26	Very low	29	Very low	65 Å²	65	133.8 Å²	133.8	67%	0.67	79%	0.785	S	S	*	*			cis	148.7	133.2	-14.1	0	0	0	0	0	115.8
380	L	27	Very low	27.6	Very low	173 Å²	173	132 Å²	132	91%	0.906	79%	0.786	S	S	*	*			trans	66.5	164.2	172.3	-60.9	165.2	0	0	0	115.5
381	V	27.2	Very low	26.6	Very low	140 Å²	140	135 Å²	135	85%	0.848	80%	0.795	S	S	*	*			cis	-145.3	179.6	-5	-119.2	0	0	0	0	107.3
382	G	25.3	Very low	26.5	Very low	57 Å²	57	137.8 Å²	137.8	59%	0.588	81%	0.806	S	S	*	*			cis	143.4	136.3	-2.7	0	0	0	0	0	113.3
383	L	26.9	Very low	26.5	Very low	175 Å²	175	135.4 Å²	135.4	92%	0.916	81%	0.811	S	S	*	*			trans	62.9	170.6	180	-87.3	80	0	0	0	116
384	M	24.1	Very low	26.7	Very low	167 Å²	167	133.5 Å²	133.5	82%	0.823	82%	0.815	S	S	*	*			cis	-168.8	-172	-49.1	-131.2	-153.2	-158.1	0	0	109.1
385	V	26.7	Very low	26.8	Very low	131 Å²	131	134.1 Å²	134.1	79%	0.794	82%	0.821	S	S	*	*			trans	85	130.2	161.5	-165.9	0	0	0	0	118.9
386	T	30.1	Very low	27.1	Very low	136 Å²	136	134.5 Å²	134.5	83%	0.834	82%	0.823	S	S	*	*			trans	-71.9	153.9	174.5	49.5	0	0	0	0	114.9
387	G	27.4	Very low	27.3	Very low	78 Å²	78	130 Å²	130	80%	0.804	82%	0.822	S	S	*	*			trans	-172.7	107	161.9	0	0	0	0	0	113.5
388	L	29.7	Very low	27.4	Very low	168 Å²	168	128.1 Å²	128.1	88%	0.88	83%	0.826	S	S	*	*			trans	-106.4	111.3	177.3	-170.7	157.6	0	0	0	109.7
389	V	28.8	Very low	27.4	Very low	145 Å²	145	129.2 Å²	129.2	88%	0.879	83%	0.826	S	S	*	*			trans	-135	121.9	167.1	-172.5	0	0	0	0	107.2
390	G	25.5	Very low	27.4	Very low	66 Å²	66	134 Å²	134	68%	0.68	83%	0.833	S	S	*	*			trans	-90.7	152.4	-174.6	0	0	0	0	0	113.4
391	L	26.7	Very low	27.4	Very low	165 Å²	165	131.6 Å²	131.6	86%	0.864	83%	0.825	S	S	*	*			trans	-118.4	112.8	156.8	-166.7	76.6	0	0	0	107.4
392	M	23.7	Very low	27.3	Very low	186 Å²	186	130.8 Å²	130.8	92%	0.916	82%	0.82	S	S	*	*			trans	-78	129.1	173.3	-70.1	-161.5	-165.5	0	0	110.1
393	V	29.1	Very low	27.3	Very low	130 Å²	130	135.6 Å²	135.6	79%	0.788	83%	0.827	S	S	*	*			trans	-127.1	132.8	154.5	-179	0	0	0	0	106.9
394	T	28.8	Very low	27.2	Very low	141 Å²	141	131.7 Å²	131.7	87%	0.865	82%	0.82	S	S	*	*			trans	-84.4	126.4	-169.5	35.1	0	0	0	0	112.4
395	G	27.9	Very low	27.3	Very low	76 Å²	76	132.8 Å²	132.8	78%	0.784	82%	0.82	S	S	*	*			trans	-167.3	128.4	173.3	0	0	0	0	0	110.1
396	L	30.1	Very low	27.3	Very low	190 Å²	190	136.4 Å²	136.4	100%	0.995	83%	0.829	S	S	*	*			trans	-88	115.2	-168.4	-80.7	160.1	0	0	0	113.1
397	G	28.2	Very low	27.2	Very low	80 Å²	80	132.8 Å²	132.8	83%	0.825	82%	0.818	S	S	*	*			trans	107.3	120.4	149.1	0	0	0	0	0	117.5
398	G	29.8	Very low	27.4	Very low	79 Å²	79	136 Å²	136	81%	0.814	83%	0.825	S	S	*	*			trans	116.7	96.9	162	0	0	0	0	0	115.1
399	L	26.7	Very low	27.3	Very low	165 Å²	165	131.2 Å²	131.2	86%	0.864	82%	0.817	S	S	*	*			trans	-77.7	121.9	174.8	-174.4	74.3	0	0	0	110.6	V401	L399-V401 HydrophobicContact CD2-CG2 4.41Å
400	M	24.9	Very low	27.4	Very low	166 Å²	166	128.2 Å²	128.2	82%	0.818	81%	0.807	S	S	*	*			trans	-95.1	126.4	168.3	-70.7	-143.9	-62.4	0	0	111.3
401	V	27.3	Very low	27.3	Very low	123 Å²	123	135 Å²	135	75%	0.745	82%	0.818	S	S	*	*			trans	-107.7	107.8	166.8	178.6	0	0	0	0	107.8	L399	L399-V401 HydrophobicContact CD2-CG2 4.41Å
402	V	26	Very low	27.3	Very low	122 Å²	122	136.8 Å²	136.8	74%	0.739	82%	0.815	S	S	*	*			trans	-98.3	115.3	177.6	-177.9	0	0	0	0	108.7
403	Q	24.8	Very low	27.4	Very low	159 Å²	159	134.7 Å²	134.7	74%	0.743	81%	0.806	S	S	*	*			trans	-120.7	98.8	173.9	-166.6	170.2	-0.4	0	0	109.3
404	A	25.1	Very low	27.2	Very low	92 Å²	92	138.2 Å²	138.2	76%	0.76	81%	0.811	S	S	*	*			trans	-82.2	133.3	-177.7	0	0	0	0	0	111.6
405	F	25.6	Very low	27	Very low	190 Å²	190	141.7 Å²	141.7	83%	0.833	81%	0.81	S	S	*	*			trans	-121.8	139.3	161.7	-92	-87.2	0	0	0	109.1
406	Q	26.4	Very low	26.9	Very low	208 Å²	208	147.5 Å²	147.5	97%	0.972	82%	0.816	S	S	*	*			trans	-98.7	109.3	-166.3	-167.6	172.4	6	0	0	111
407	G	29.3	Very low	26.6	Very low	60 Å²	60	147.9 Å²	147.9	62%	0.619	81%	0.81	S	S	*	*			trans	-151.6	153.1	175.8	0	0	0	0	0	111.1	G409	G407-G409 PolarHBondContact O-N 3.29Å
408	P	31.1	Very low	26.8	Very low	144 Å²	144	154.1 Å²	154.1	94%	0.935	82%	0.815	S	S	*	*	S	Bend	trans	-83.9	109	-169.2	31.7	-34.1	0	0	0	112.9
409	G	27.3	Very low	27	Very low	69 Å²	69	153.8 Å²	153.8	71%	0.711	81%	0.811	S	S	*	*	S	Bend	trans	167.5	132.3	170.4	0	0	0	0	0	112.7	G407	G407-G409 PolarHBondContact O-N 3.29Å
410	A	30.3	Very low	27.1	Very low	82 Å²	82	151.3 Å²	151.3	68%	0.678	81%	0.808	S	S	*	*			trans	-10.1	121.9	178.2	0	0	0	0	0	118.9	Y412	A410-Y412 HydrophobicContact CB-CD2 4.11Å; A410-Y412 HydrophobicContact CB-CE2 3.83Å
411	F	24.2	Very low	27.6	Very low	209 Å²	209	152.4 Å²	152.4	92%	0.917	81%	0.811	S	S	*	*			trans	-63.2	131.8	162	-80.6	-98.5	0	0	0	110.8
412	Y	27.2	Very low	27.7	Very low	201 Å²	201	152.2 Å²	152.2	79%	0.788	81%	0.805	S	S	*	*			trans	-130.5	136	163	-84.3	-86.6	0	0	0	110.6	A410	A410-Y412 HydrophobicContact CB-CD2 4.11Å; A410-Y412 HydrophobicContact CB-CE2 3.83Å
413	I	26.5	Very low	28.4	Very low	143 Å²	143	150.9 Å²	150.9	73%	0.733	80%	0.799	S	S	*	*			trans	-97.5	116.9	178.8	-61.7	172.7	0	0	0	108	Y415	I413-Y415 HydrophobicContact CG2-CD2 4.12Å; I413-Y415 HydrophobicContact CG2-CE2 4.07Å; I413-Y415 PolarHBondContact O-N 3.21Å
414	F	23.8	Very low	28.9	Very low	204 Å²	204	150.3 Å²	150.3	90%	0.895	80%	0.797	S	S	*	*			trans	-76.4	104.9	175.3	-80.8	-82.2	0	0	0	111.4
415	Y	24.6	Very low	29.7	Very low	213 Å²	213	156 Å²	156	84%	0.835	80%	0.799	S	S	*	*			trans	-85.3	105.7	164.6	-90.2	-88.7	0	0	0	110.2	I413 K417	I413-Y415 HydrophobicContact CG2-CD2 4.12Å; I413-Y415 HydrophobicContact CG2-CE2 4.07Å; I413-Y415 PolarHBondContact O-N 3.21Å; Y415-K417 PolarHBondContact O-N 2.96Å; Y415-K417 VanDerWaalsContact O-N 3.14Å
416	Q	25.6	Very low	30.4	Very low	198 Å²	198	154.9 Å²	154.9	93%	0.925	79%	0.793	S	S	*	*			trans	-80.8	92	174.1	-169	177.4	21.7	0	0	111
417	K	24.4	Very low	31	Very low	199 Å²	199	151.4 Å²	151.4	87%	0.865	78%	0.779	S	S	*	*			trans	-91.9	126.7	165.7	-166	177.7	-179.6	-174.6	0	109.7	Y415 G419	Y415-K417 PolarHBondContact O-N 2.96Å; Y415-K417 VanDerWaalsContact O-N 3.14Å; K417-G419 PolarHBondContact O-N 3.4Å
418	K	31.6	Very low	32	Very low	211 Å²	211	156.9 Å²	156.9	92%	0.917	79%	0.786	S	S	*	*	S	Bend	trans	-83.2	106.8	-175.1	-170.7	179.8	-177.2	-177.8	0	111
419	G	33.4	Very low	32.9	Very low	72 Å²	72	155.4 Å²	155.4	74%	0.742	78%	0.776	S	S	*	*			trans	121.3	82.8	162.3	0	0	0	0	0	116.9	K417	K417-G419 PolarHBondContact O-N 3.4Å
420	S	29.9	Very low	34	Very low	113 Å²	113	158.2 Å²	158.2	79%	0.79	77%	0.774	S	S	*	*			trans	-173.7	153.9	150.9	48.7	0	0	0	0	108
421	E	34.3	Very low	35.2	Very low	188 Å²	188	160.2 Å²	160.2	88%	0.879	77%	0.773	S	S	*	*			trans	-83.3	130.3	174.1	-62.5	-171.5	115.2	0	0	110.4	P423	E421-P423 WeakPolarHBondContact O-CD 3.35Å
422	D	30.4	Very low	36.3	Very low	119 Å²	119	156 Å²	156	64%	0.636	77%	0.767	S	S	*	*			trans	-71.6	120.8	-179.3	-90.7	-46.7	0	0	0	111.8	E424 R425	D422-E424 VanDerWaalsContact C-N 3.26Å; D422-E424 PolarHBondContact O-N 3.07Å; D422-R425 PolarHBondContact O-N 3.31Å
423	P	39.7	Very low	37.2	Very low	94 Å²	94	152.8 Å²	152.8	61%	0.61	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-70.7	-21.5	178.7	28.9	-34.7	0	0	0	112.9	E421 R425 F426	E421-P423 WeakPolarHBondContact O-CD 3.35Å; P423-R425 PolarHBondContact O-N 3.18Å; P423-R425 VanDerWaalsContact O-N 3.1Å; P423-F426 PolarHBondContact O-N 2.85Å
424	E	37.2	Very low	39.3	Very low	147 Å²	147	149 Å²	149	69%	0.687	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-63.8	-16.3	179.8	-62.3	-163.4	158.4	0	0	113.4	D422 F426 M427	D422-E424 VanDerWaalsContact C-N 3.26Å; D422-E424 PolarHBondContact O-N 3.07Å; E424-F426 PolarHBondContact O-N 3.49Å; E424-M427 HydrophobicContact CG-SD 4.29Å; E424-M427 PolarHBondContact O-N 3.36Å
425	R	41	Very low	40.4	Very low	213 Å²	213	145 Å²	145	80%	0.804	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-58.1	-13.9	176.8	-112.8	-179.6	178.3	-176.4	0.1	115	D422 P423	D422-R425 PolarHBondContact O-N 3.31Å; P423-R425 PolarHBondContact O-N 3.18Å; P423-R425 VanDerWaalsContact O-N 3.1Å
426	F	41.2	Very low	41.9	Very low	165 Å²	165	141 Å²	141	72%	0.724	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-121.7	7.7	179.2	-57.3	-77.8	0	0	0	113.5	P423 E424 F428	P423-F426 PolarHBondContact O-N 2.85Å; E424-F426 PolarHBondContact O-N 3.49Å; F426-F428 WeakPolarHBondContact O-CD2 3.44Å
427	M	37.7	Very low	43.1	Very low	136 Å²	136	137 Å²	137	67%	0.67	73%	0.732	S	S	*	*			trans	-94.1	107.3	-178.5	-66.5	-176.1	68.1	0	0	111.1	E424	E424-M427 HydrophobicContact CG-SD 4.29Å; E424-M427 PolarHBondContact O-N 3.36Å
428	F	51.1	Low	44.1	Very low	175 Å²	175	133.9 Å²	133.9	77%	0.768	73%	0.732	S	S	*	*			trans	-95.7	132.6	178.5	-60.8	-83.9	0	0	0	111.1	F426 L430	F426-F428 WeakPolarHBondContact O-CD2 3.44Å; F428-L430 PolarHBondContact O-N 3.09Å
429	P	50.5	Low	45	Very low	112 Å²	112	129.7 Å²	129.7	73%	0.727	72%	0.718	S	S	*	*			trans	-69.1	124.6	178.7	27.7	-33.9	0	0	0	111	L431	P429-L431 PolarHBondContact O-N 3.05Å
430	L	50.3	Low	46.3	Very low	128 Å²	128	129.9 Å²	129.9	67%	0.67	71%	0.708	S	S	*	*			trans	-69.3	112.9	173.6	-69.3	176.5	0	0	0	109.8	F428 L436	F428-L430 PolarHBondContact O-N 3.09Å; L430-L436 HydrophobicContact CD1-CD1 4.41Å; L430-L436 HydrophobicContact CD2-CD2 4.09Å
431	L	55.6	Low	47.6	Very low	124 Å²	124	127.5 Å²	127.5	65%	0.649	69%	0.686	S	S	*	*			trans	-73.7	146.9	175.1	-64.1	176	0	0	0	110.4	P429 C433 T434	P429-L431 PolarHBondContact O-N 3.05Å; L431-C433 PolarHBondContact O-N 3.38Å; L431-T434 PolarHBondContact N-OG1 3.48Å; L431-T434 WeakPolarHBondContact O-CB 3.39Å; L431-T434 PolarHBondContact O-N 3.5Å; L431-T434 VanDerWaalsContact O-N 3.12Å; L431-T434 PolarHBondContact O-OG1 3.1Å
432	P	45.3	Very low	48.8	Very low	121 Å²	121	123 Å²	123	79%	0.786	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.3	138.6	172.9	-27.3	35.5	0	0	0	111.8	T434	P432-T434 VanDerWaalsContact C-N 3.3Å; P432-T434 PolarHBondContact O-N 3.42Å
433	C	46.5	Very low	50.2	Low	134 Å²	134	121 Å²	121	91%	0.905	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.8	16.5	-176.5	-52.7	0	0	0	0	116.4	L431 P435	L431-C433 PolarHBondContact O-N 3.38Å; C433-P435 WeakPolarHBondContact O-CD 3.49Å
434	T	71.2	Confident	51.1	Low	64 Å²	64	119.3 Å²	119.3	39%	0.393	65%	0.653	S	S	.	*			trans	-63.1	123.3	168	-58.6	0	0	0	0	110.6	L431 P432 L436	L431-T434 PolarHBondContact N-OG1 3.48Å; L431-T434 WeakPolarHBondContact O-CB 3.39Å; L431-T434 PolarHBondContact O-N 3.5Å; L431-T434 VanDerWaalsContact O-N 3.12Å; L431-T434 PolarHBondContact O-OG1 3.1Å; P432-T434 VanDerWaalsContact C-N 3.3Å; P432-T434 PolarHBondContact O-N 3.42Å; T434-L436 HydrophobicContact CG2-CD2 4.49Å; T434-L436 PolarHBondContact O-N 3.46Å
435	P	46.6	Very low	52.1	Low	119 Å²	119	119.3 Å²	119.3	77%	0.773	65%	0.651	S	S	*	*			trans	-75.2	112.8	179.1	29.5	-33.2	0	0	0	111.1	C433	C433-P435 WeakPolarHBondContact O-CD 3.49Å
436	L	55.4	Low	53	Low	129 Å²	129	113.1 Å²	113.1	68%	0.675	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-94.9	119.9	175.2	-62.3	178.1	0	0	0	110.2	L430 T434	L430-L436 HydrophobicContact CD1-CD1 4.41Å; L430-L436 HydrophobicContact CD2-CD2 4.09Å; T434-L436 HydrophobicContact CG2-CD2 4.49Å; T434-L436 PolarHBondContact O-N 3.46Å
437	T	50.8	Low	53.8	Low	115 Å²	115	110.7 Å²	110.7	71%	0.706	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-90.9	133.6	171.4	46	0	0	0	0	110.3	I439	T437-I439 PolarHBondContact O-N 3.35Å
438	P	46.1	Very low	54.6	Low	133 Å²	133	110.2 Å²	110.2	86%	0.864	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-71.2	122.5	176.1	28.2	-33	0	0	0	110.3
439	I	51.2	Low	55.5	Low	122 Å²	122	103 Å²	103	63%	0.626	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-101.4	129.9	177.5	-62.3	175.3	0	0	0	108.7	T437 A443 L444	T437-I439 PolarHBondContact O-N 3.35Å; I439-A443 HydrophobicContact CG2-CB 4.15Å; I439-L444 HydrophobicContact CG2-CD2 4.28Å
440	S	59.7	Low	55.8	Low	76 Å²	76	101.6 Å²	101.6	53%	0.531	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-73.4	141	172.1	-178.9	0	0	0	0	110.7	L442 A443	S440-L442 PolarHBondContact O-N 3.04Å; S440-L442 VanDerWaalsContact O-N 3.1Å; S440-L442 PolarHBondContact OG-N 3.05Å; S440-A443 WeakPolarHBondContact O-CB 3.28Å; S440-A443 PolarHBondContact O-N 3.44Å
441	L	58.7	Low	56.9	Low	63 Å²	63	97.5 Å²	97.5	33%	0.33	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-54.1	-30.5	174.7	-67.6	175.6	0	0	0	112.6	A443 L444 E457 Y458	L441-A443 PolarHBondContact O-N 3.48Å; L441-L444 HydrophobicContact CD2-CD1 4.25Å; L441-L444 PolarHBondContact O-N 3.25Å; L441-E457 HydrophobicContact CD1-CB 4.44Å; L441-Y458 WeakPolarHBondContact O-CD2 3.41Å
442	L	59.2	Low	57.5	Low	95 Å²	95	92 Å²	92	50%	0.497	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-68.9	-15.6	177.2	-68.1	173.8	0	0	0	114.1	S440 Y458 H461	S440-L442 PolarHBondContact O-N 3.04Å; S440-L442 VanDerWaalsContact O-N 3.1Å; S440-L442 PolarHBondContact OG-N 3.05Å; L442-Y458 HydrophobicContact CD2-CD2 4.43Å; L442-Y458 HydrophobicContact CD2-CE2 4.34Å; L442-H461 HydrophobicContact CD2-CB 4.21Å
443	A	58.7	Low	58.8	Low	76 Å²	76	87.5 Å²	87.5	63%	0.628	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-87.7	-8.6	175.2	0	0	0	0	0	113.4	I439 S440 L441	I439-A443 HydrophobicContact CG2-CB 4.15Å; S440-A443 WeakPolarHBondContact O-CB 3.28Å; S440-A443 PolarHBondContact O-N 3.44Å; L441-A443 PolarHBondContact O-N 3.48Å
444	L	59.1	Low	60.1	Low	59 Å²	59	83 Å²	83	31%	0.309	50%	0.501	S	S	.	.	S	Bend	trans	-87.2	146.2	175.4	-60.3	176.5	0	0	0	110.6	I439 L441 I449	I439-L444 HydrophobicContact CG2-CD2 4.28Å; L441-L444 HydrophobicContact CD2-CD1 4.25Å; L441-L444 PolarHBondContact O-N 3.25Å; L444-I449 HydrophobicContact CB-CG1 4.43Å
445	K	59	Low	60.2	Low	147 Å²	147	81.6 Å²	81.6	64%	0.639	49%	0.491	S	S	*	.			trans	-77	143.7	168.7	-63.4	-175.5	177.5	-176.6	0	109.4	S447 Q448	K445-S447 PolarHBondContact O-N 2.94Å; K445-S447 VanDerWaalsContact O-N 3.07Å; K445-Q448 HydrophobicContact CB-CG 4.2Å; K445-Q448 WeakPolarHBondContact O-CB 3.35Å; K445-Q448 PolarHBondContact O-N 3.15Å
446	Q	59.3	Low	61.4	Low	82 Å²	82	75.9 Å²	75.9	38%	0.383	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-52.4	-34.8	178.6	-167.1	178.2	-18.8	0	0	112.9	Q448 I449 L455	Q446-Q448 PolarHBondContact O-N 3.39Å; Q446-I449 PolarHBondContact O-N 3.43Å; Q446-L455 HydrophobicContact CG-CD1 3.54Å
447	S	56.9	Low	62.2	Low	114 Å²	114	72.9 Å²	72.9	80%	0.797	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-72.8	3.1	176.3	67.6	0	0	0	0	115.3	K445	K445-S447 PolarHBondContact O-N 2.94Å; K445-S447 VanDerWaalsContact O-N 3.07Å
448	Q	56	Low	63.2	Low	127 Å²	127	69 Å²	69	59%	0.593	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-110.7	-3	176.5	-58.7	175	-68.3	0	0	112	K445 Q446	K445-Q448 HydrophobicContact CB-CG 4.2Å; K445-Q448 WeakPolarHBondContact O-CB 3.35Å; K445-Q448 PolarHBondContact O-N 3.15Å; Q446-Q448 PolarHBondContact O-N 3.39Å
449	I	69.3	Low	64.3	Low	22 Å²	22	65.5 Å²	65.5	11%	0.113	38%	0.381	C	S	.	.			trans	-100.4	103.1	-177.3	-54.6	177.4	0	0	0	108.2	L444 Q446 L455 Y458	L444-I449 HydrophobicContact CB-CG1 4.43Å; Q446-I449 PolarHBondContact O-N 3.43Å; I449-L455 HydrophobicContact CG2-CB 4.07Å; I449-Y458 HydrophobicContact CD1-CD2 3.87Å; I449-Y458 HydrophobicContact CD1-CG 3.94Å
450	G	57.3	Low	65.1	Low	84 Å²	84	59.7 Å²	59.7	87%	0.866	35%	0.351	S	S	*	.			trans	-84.2	-18.9	-173.7	0	0	0	0	0	116.1
451	S	73.9	Confident	65.5	Low	41 Å²	41	61.2 Å²	61.2	29%	0.287	35%	0.35	S	S	.	.			trans	-101.2	135.7	177.1	163.3	0	0	0	0	111	V453 S454 L455 E518	S451-V453 VanDerWaalsContact C-N 3.26Å; S451-V453 PolarHBondContact O-N 2.93Å; S451-V453 PolarHBondContact OG-N 2.82Å; S451-V453 VanDerWaalsContact OG-N 3.17Å; S451-S454 PolarHBondContact O-N 2.89Å; S451-L455 WeakPolarHBondContact O-CB 3.34Å; S451-L455 PolarHBondContact O-N 3.13Å; S451-E518 PolarHBondContact OG-OE2 3.37Å
452	A	67.8	Low	66	Low	9 Å²	9	64.4 Å²	64.4	7%	0.074	36%	0.361	C	S	.	.	H	α-helix	trans	-62.8	-30.5	174.3	0	0	0	0	0	112.8	L455 L456 E518 A521 Q522 L525	A452-L455 PolarHBondContact O-N 2.98Å; A452-L456 VanDerWaalsContact O-CB 3.29Å; A452-L456 WeakPolarHBondContact O-CB 3.49Å; A452-L456 PolarHBondContact O-N 2.99Å; A452-E518 WeakPolarHBondContact CB-OE1 3.43Å; A452-E518 VanDerWaalsContact N-CD 3.33Å; A452-E518 PolarHBondContact N-OE1 3.36Å; A452-E518 PolarHBondContact N-OE2 2.84Å; A452-E518 VanDerWaalsContact N-OE2 3.14Å; A452-A521 HydrophobicContact CB-CB 3.96Å; A452-Q522 HydrophobicContact CB-CB 4.44Å; A452-Q522 HydrophobicContact CB-CG 3.39Å; A452-L525 HydrophobicContact CB-CD1 4.19Å
453	V	72.4	Confident	66.1	Low	27 Å²	27	63.3 Å²	63.3	16%	0.164	36%	0.355	C	S	.	.	H	α-helix	trans	-60.2	-55.6	174.1	174.5	0	0	0	0	110.3	S451 L455 L456 E457 K517 E518 A521	S451-V453 VanDerWaalsContact C-N 3.26Å; S451-V453 PolarHBondContact O-N 2.93Å; S451-V453 PolarHBondContact OG-N 2.82Å; S451-V453 VanDerWaalsContact OG-N 3.17Å; V453-L455 VanDerWaalsContact C-N 3.28Å; V453-L455 PolarHBondContact O-N 3.46Å; V453-L456 PolarHBondContact O-N 3.1Å; V453-E457 WeakPolarHBondContact O-CG 3.26Å; V453-E457 PolarHBondContact O-N 3.09Å; V453-K517 HydrophobicContact CG2-CB 4.08Å; V453-E518 PolarHBondContact N-OE2 3.43Å; V453-A521 HydrophobicContact CG2-CB 4.12Å
454	S	73.2	Confident	66.1	Low	39 Å²	39	64.2 Å²	64.2	27%	0.273	36%	0.356	S	S	.	.	H	α-helix	trans	-67.7	-28.1	178.8	-58.3	0	0	0	0	112.9	S451 Y458	S451-S454 PolarHBondContact O-N 2.89Å; S454-Y458 WeakPolarHBondContact O-CB 3.37Å; S454-Y458 PolarHBondContact O-N 3.1Å
455	L	74.4	Confident	66.4	Low	34 Å²	34	65.2 Å²	65.2	18%	0.178	36%	0.356	C	S	.	.	H	α-helix	trans	-70	-36.8	173.8	-178.2	57.3	0	0	0	111.9	Q446 I449 S451 A452 V453 H459 L525	Q446-L455 HydrophobicContact CG-CD1 3.54Å; I449-L455 HydrophobicContact CG2-CB 4.07Å; S451-L455 WeakPolarHBondContact O-CB 3.34Å; S451-L455 PolarHBondContact O-N 3.13Å; A452-L455 PolarHBondContact O-N 2.98Å; V453-L455 VanDerWaalsContact C-N 3.28Å; V453-L455 PolarHBondContact O-N 3.46Å; L455-H459 WeakPolarHBondContact O-CB 3.43Å; L455-H459 PolarHBondContact O-N 2.85Å; L455-L525 HydrophobicContact CB-CD1 4.13Å; L455-L525 HydrophobicContact CD2-CD1 3.89Å; L455-L525 HydrophobicContact CG-CD1 3.88Å
456	L	70.3	Confident	66.3	Low	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-70.7	-41.9	173.9	-177.9	60.2	0	0	0	111.5	A452 V453 Y458 H459 C460 P468 I488 I490 A521 T524 L525 L528	A452-L456 VanDerWaalsContact O-CB 3.29Å; A452-L456 WeakPolarHBondContact O-CB 3.49Å; A452-L456 PolarHBondContact O-N 2.99Å; V453-L456 PolarHBondContact O-N 3.1Å; L456-Y458 VanDerWaalsContact C-N 3.35Å; L456-Y458 PolarHBondContact O-N 3.19Å; L456-H459 PolarHBondContact O-N 3.37Å; L456-H459 VanDerWaalsContact O-N 3.13Å; L456-C460 PolarHBondContact O-N 3.14Å; L456-C460 PolarHBondContact O-SG 3.4Å; L456-P468 HydrophobicContact CD2-CB 3.98Å; L456-P468 HydrophobicContact CD2-CG 4.17Å; L456-P468 HydrophobicContact CG-CB 4.35Å; L456-P468 HydrophobicContact CG-CG 4.18Å; L456-I488 HydrophobicContact CD2-CD1 3.85Å; L456-I488 HydrophobicContact CD2-CG2 4.49Å; L456-I490 HydrophobicContact CD1-CD1 3.97Å; L456-I490 HydrophobicContact CD2-CD1 4.44Å; L456-A521 HydrophobicContact CB-CB 4.44Å; L456-A521 HydrophobicContact CD2-CB 4.07Å; L456-T524 HydrophobicContact CD1-CG2 4.07Å; L456-T524 HydrophobicContact CD2-CG2 4Å; L456-L525 HydrophobicContact CB-CD1 4.3Å; L456-L525 HydrophobicContact CB-CD2 4.26Å; L456-L525 HydrophobicContact CB-CG 4.17Å; L456-L525 HydrophobicContact CD1-CD2 3.86Å; L456-L525 HydrophobicContact CD1-CG 4.09Å; L456-L528 HydrophobicContact CD1-CD1 4Å
457	E	71.9	Confident	66.4	Low	65 Å²	65	59.8 Å²	59.8	30%	0.304	34%	0.343	S	S	.	.	H	α-helix	trans	-57.8	-46.1	171.7	-71.3	174.9	161.3	0	0	111.7	L441 V453 H459 C460 H461 P468	L441-E457 HydrophobicContact CD1-CB 4.44Å; V453-E457 WeakPolarHBondContact O-CG 3.26Å; V453-E457 PolarHBondContact O-N 3.09Å; E457-H459 VanDerWaalsContact C-N 3.32Å; E457-H459 PolarHBondContact O-N 3.41Å; E457-C460 PolarHBondContact O-N 2.79Å; E457-H461 WeakPolarHBondContact O-CB 3.17Å; E457-H461 PolarHBondContact O-CD2 3.41Å; E457-H461 PolarHBondContact O-N 3.45Å; E457-P468 HydrophobicContact CG-CG 4.17Å
458	Y	73.3	Confident	66.8	Low	35 Å²	35	54.9 Å²	54.9	14%	0.137	31%	0.309	C	S	.	.	H	α-helix	trans	-58.5	-42.2	173.2	177.7	-88	0	0	0	111.9	L441 L442 I449 S454 L456 K462	L441-Y458 WeakPolarHBondContact O-CD2 3.41Å; L442-Y458 HydrophobicContact CD2-CD2 4.43Å; L442-Y458 HydrophobicContact CD2-CE2 4.34Å; I449-Y458 HydrophobicContact CD1-CD2 3.87Å; I449-Y458 HydrophobicContact CD1-CG 3.94Å; S454-Y458 WeakPolarHBondContact O-CB 3.37Å; S454-Y458 PolarHBondContact O-N 3.1Å; L456-Y458 VanDerWaalsContact C-N 3.35Å; L456-Y458 PolarHBondContact O-N 3.19Å; Y458-K462 HydrophobicContact CE1-CD 4.29Å; Y458-K462 VanDerWaalsContact O-CB 3.28Å; Y458-K462 WeakPolarHBondContact O-CB 3.3Å; Y458-K462 PolarHBondContact O-N 3.2Å
459	H	69.4	Low	67.1	Low	58 Å²	58	53.2 Å²	53.2	27%	0.269	30%	0.301	S	S	.	.	H	α-helix	trans	-67.2	-42.1	178.4	-160.6	97.2	0	0	0	112.3	L455 L456 E457 K462 N463 W465 L525	L455-H459 WeakPolarHBondContact O-CB 3.43Å; L455-H459 PolarHBondContact O-N 2.85Å; L456-H459 PolarHBondContact O-N 3.37Å; L456-H459 VanDerWaalsContact O-N 3.13Å; E457-H459 VanDerWaalsContact C-N 3.32Å; E457-H459 PolarHBondContact O-N 3.41Å; H459-K462 PolarHBondContact O-N 3.37Å; H459-N463 PolarHBondContact CD2-ND2 2.94Å; H459-N463 PolarHBondContact NE2-ND2 3.36Å; H459-N463 PolarHBondContact O-N 3.28Å; H459-N463 VanDerWaalsContact O-N 3.15Å; H459-N463 PolarHBondContact O-ND2 2.99Å; H459-W465 AromaticContact CD2-CZ3 3.82Å; H459-L525 HydrophobicContact CB-CD2 4.27Å
460	C	67.6	Low	66.7	Low	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.9	-48.4	173.8	-73.2	0	0	0	0	111.5	L456 E457 K462 N463 C464 W465 S466	L456-C460 PolarHBondContact O-N 3.14Å; L456-C460 PolarHBondContact O-SG 3.4Å; E457-C460 PolarHBondContact O-N 2.79Å; C460-K462 VanDerWaalsContact C-N 3.33Å; C460-K462 PolarHBondContact O-N 3.12Å; C460-N463 PolarHBondContact O-N 3.14Å; C460-C464 PolarHBondContact O-N 3.27Å; C460-W465 HydrophobicContact CB-CB 4.13Å; C460-W465 PolarHBondContact O-N 3.38Å; C460-S466 VanDerWaalsContact CB-O 3.26Å; C460-S466 WeakPolarHBondContact CB-O 3.36Å; C460-S466 PolarHBondContact SG-O 3.46Å
461	H	68.4	Low	66.8	Low	108 Å²	108	53.5 Å²	53.5	50%	0.5	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-41.3	177.2	-90.5	-77.8	0	0	0	112.6	L442 E457 N463 C464	L442-H461 HydrophobicContact CD2-CB 4.21Å; E457-H461 WeakPolarHBondContact O-CB 3.17Å; E457-H461 PolarHBondContact O-CD2 3.41Å; E457-H461 PolarHBondContact O-N 3.45Å; H461-N463 VanDerWaalsContact C-N 3.34Å; H461-N463 PolarHBondContact O-N 3.28Å; H461-C464 PolarHBondContact O-N 2.88Å
462	K	67.6	Low	65.9	Low	131 Å²	131	55.6 Å²	55.6	57%	0.57	29%	0.285	S	S	*	.	H	α-helix	trans	-64.2	-34.8	178.5	-177.2	178.1	-179	-175.1	0	113.2	Y458 H459 C460	Y458-K462 HydrophobicContact CE1-CD 4.29Å; Y458-K462 VanDerWaalsContact O-CB 3.28Å; Y458-K462 WeakPolarHBondContact O-CB 3.3Å; Y458-K462 PolarHBondContact O-N 3.2Å; H459-K462 PolarHBondContact O-N 3.37Å; C460-K462 VanDerWaalsContact C-N 3.33Å; C460-K462 PolarHBondContact O-N 3.12Å
463	N	62.7	Low	65.3	Low	71 Å²	71	61.8 Å²	61.8	38%	0.38	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	7	179.9	-64.5	-72.9	0	0	0	113.7	H459 C460 H461 W465	H459-N463 PolarHBondContact CD2-ND2 2.94Å; H459-N463 PolarHBondContact NE2-ND2 3.36Å; H459-N463 PolarHBondContact O-N 3.28Å; H459-N463 VanDerWaalsContact O-N 3.15Å; H459-N463 PolarHBondContact O-ND2 2.99Å; C460-N463 PolarHBondContact O-N 3.14Å; H461-N463 VanDerWaalsContact C-N 3.34Å; H461-N463 PolarHBondContact O-N 3.28Å; N463-W465 VanDerWaalsContact C-N 3.33Å; N463-W465 HydrophobicContact CB-CD2 3.9Å; N463-W465 HydrophobicContact CB-CE3 4.47Å; N463-W465 HydrophobicContact CB-CG 4.22Å; N463-W465 HydrophobicContact CB-CH2 4.46Å; N463-W465 HydrophobicContact CB-CZ2 3.89Å; N463-W465 VanDerWaalsContact O-CD1 3.3Å; N463-W465 PolarHBondContact O-N 3.23Å; N463-W465 PolarHBondContact O-NE1 2.95Å
464	C	59.3	Low	64.3	Low	95 Å²	95	64.4 Å²	64.4	64%	0.642	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	43.2	-174.9	-55.9	0	0	0	0	113.6	C460 H461 A493	C460-C464 PolarHBondContact O-N 3.27Å; H461-C464 PolarHBondContact O-N 2.88Å; C464-A493 WeakPolarHBondContact O-CB 3.32Å
465	W	64.4	Low	63.2	Low	81 Å²	81	65.7 Å²	65.7	31%	0.307	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-94.2	168.7	168.7	-56.3	-16.9	0	0	0	110.6	H459 C460 N463 I490 L528	H459-W465 AromaticContact CD2-CZ3 3.82Å; C460-W465 HydrophobicContact CB-CB 4.13Å; C460-W465 PolarHBondContact O-N 3.38Å; N463-W465 VanDerWaalsContact C-N 3.33Å; N463-W465 HydrophobicContact CB-CD2 3.9Å; N463-W465 HydrophobicContact CB-CE3 4.47Å; N463-W465 HydrophobicContact CB-CG 4.22Å; N463-W465 HydrophobicContact CB-CH2 4.46Å; N463-W465 HydrophobicContact CB-CZ2 3.89Å; N463-W465 VanDerWaalsContact O-CD1 3.3Å; N463-W465 PolarHBondContact O-N 3.23Å; N463-W465 PolarHBondContact O-NE1 2.95Å; W465-I490 HydrophobicContact CB-CG2 4.1Å; W465-I490 HydrophobicContact CD2-CG2 4.41Å; W465-I490 HydrophobicContact CE3-CG2 3.98Å; W465-L528 HydrophobicContact CH2-CD2 3.96Å; W465-L528 HydrophobicContact CZ3-CD1 4.03Å; W465-L528 HydrophobicContact CZ3-CD2 3.9Å
466	S	56.4	Low	62	Low	25 Å²	25	69 Å²	69	18%	0.175	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-62.6	160.1	170.6	73	0	0	0	0	111.3	C460 Y491	C460-S466 VanDerWaalsContact CB-O 3.26Å; C460-S466 WeakPolarHBondContact CB-O 3.36Å; C460-S466 PolarHBondContact SG-O 3.46Å; S466-Y491 PolarHBondContact N-O 2.7Å; S466-Y491 WeakPolarHBondContact OG-CB 3.45Å; S466-Y491 WeakPolarHBondContact OG-CD2 3.41Å; S466-Y491 PolarHBondContact OG-N 2.94Å; S466-Y491 PolarHBondContact OG-O 2.9Å
467	P	62.4	Low	61	Low	89 Å²	89	69.5 Å²	69.5	58%	0.578	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-50.8	144	156.7	-23.5	34.8	0	0	0	110.5
468	P	64.9	Low	60	Low	12 Å²	12	76 Å²	76	8%	0.078	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-69.2	130.1	174.9	26.6	-32.3	0	0	0	110.9	L456 E457 Y470 I488 I490	L456-P468 HydrophobicContact CD2-CB 3.98Å; L456-P468 HydrophobicContact CD2-CG 4.17Å; L456-P468 HydrophobicContact CG-CB 4.35Å; L456-P468 HydrophobicContact CG-CG 4.18Å; E457-P468 HydrophobicContact CG-CG 4.17Å; P468-Y470 HydrophobicContact CB-CE2 4.05Å; P468-Y470 HydrophobicContact CG-CE2 3.87Å; P468-Y470 WeakPolarHBondContact O-CD2 3.47Å; P468-I488 HydrophobicContact CB-CG2 3.72Å; P468-I490 HydrophobicContact CB-CG1 4.27Å
469	E	62.1	Low	58.9	Low	91 Å²	91	81.6 Å²	81.6	43%	0.425	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124	178.2	-169.1	165.4	-179.4	0	0	110.5	H471 I488 D489	E469-H471 IonicContact OE1-CE1 3.96Å; E469-H471 PolarHBondContact OE1-CE1 3.12Å; E469-H471 IonicContact OE1-NE2 2.85Å; E469-I488 WeakPolarHBondContact O-CA 3.32Å; E469-D489 PolarHBondContact N-O 3.31Å; E469-D489 PolarHBondContact O-N 2.94Å; E469-D489 VanDerWaalsContact O-N 3.07Å
470	Y	60.8	Low	57.8	Low	55 Å²	55	82 Å²	82	22%	0.216	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	110.7	-174.9	-67.9	-100.4	0	0	0	111	P468 I488 K517	P468-Y470 HydrophobicContact CB-CE2 4.05Å; P468-Y470 HydrophobicContact CG-CE2 3.87Å; P468-Y470 WeakPolarHBondContact O-CD2 3.47Å; Y470-I488 HydrophobicContact CD1-CD1 3.92Å; Y470-I488 HydrophobicContact CD1-CG1 3.68Å; Y470-I488 HydrophobicContact CE1-CD1 3.3Å; Y470-I488 HydrophobicContact CE1-CG1 3.64Å; Y470-I488 HydrophobicContact CG-CG1 4.34Å; Y470-K517 HydrophobicContact CD1-CB 3.89Å; Y470-K517 HydrophobicContact CD1-CG 3.81Å; Y470-K517 HydrophobicContact CE1-CB 3.78Å; Y470-K517 HydrophobicContact CE1-CG 4.2Å; Y470-K517 HydrophobicContact CG-CG 4.43Å
471	H	59.2	Low	56.8	Low	58 Å²	58	89.1 Å²	89.1	27%	0.269	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	116.9	179.7	-69.9	-40.5	0	0	0	111.2	E469 S486 H487 D489	E469-H471 IonicContact OE1-CE1 3.96Å; E469-H471 PolarHBondContact OE1-CE1 3.12Å; E469-H471 IonicContact OE1-NE2 2.85Å; H471-S486 VanDerWaalsContact O-CA 3.32Å; H471-S486 WeakPolarHBondContact O-CA 3.17Å; H471-H487 WeakPolarHBondContact CB-CE1 3.38Å; H471-H487 AromaticContact CD2-CE1 3.97Å; H471-H487 AromaticContact CD2-NE2 3.55Å; H471-H487 PolarHBondContact N-O 2.62Å; H471-H487 PolarHBondContact O-N 3.39Å; H471-H487 PolarHBondContact O-ND1 3.44Å; H471-D489 IonicContact CD2-OD2 3.61Å
472	L	55	Low	55.5	Low	84 Å²	84	88.6 Å²	88.6	44%	0.44	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.1	-173.7	-172	73.5	0	0	0	112.7	R484 L513	L472-R484 HydrophobicContact CD1-CB 4.24Å; L472-L513 HydrophobicContact CD1-CD1 3.55Å; L472-L513 HydrophobicContact CD2-CD1 3.66Å; L472-L513 HydrophobicContact CG-CD1 4.2Å
473	Y	55.9	Low	54.3	Low	140 Å²	140	85.5 Å²	85.5	55%	0.549	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	160.2	169.1	-59.1	-51.1	0	0	0	110.8	R484 L485 H487	Y473-R484 WeakPolarHBondContact O-CA 3.29Å; Y473-L485 PolarHBondContact N-O 3.17Å; Y473-L485 PolarHBondContact O-N 3.42Å; Y473-L485 VanDerWaalsContact O-O 3.11Å; Y473-H487 AromaticContact CD2-ND1 3.94Å; Y473-H487 AromaticContact CE2-CE1 3.36Å; Y473-H487 WeakPolarHBondContact CE2-CE1 3.35Å; Y473-H487 AromaticContact CE2-ND1 3.31Å; Y473-H487 VanDerWaalsContact CE2-ND1 3.31Å; Y473-H487 WeakPolarHBondContact CE2-ND1 3.33Å; Y473-H487 AromaticContact CZ-CE1 3.66Å; Y473-H487 PolarHBondContact OH-CE1 3.23Å
474	S	50.4	Low	53.3	Low	82 Å²	82	86 Å²	86	57%	0.573	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	141.6	178.3	60.4	0	0	0	0	112.1	Q483	S474-Q483 CarbonylContact C-O 3.51Å; S474-Q483 VanDerWaalsContact CA-O 3.26Å; S474-Q483 WeakPolarHBondContact CA-O 3.26Å
475	T	49.9	Very low	52.4	Low	65 Å²	65	83.3 Å²	83.3	40%	0.399	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.4	176.7	-171.7	0	0	0	0	110	G477 Q483 L509	T475-G477 PolarHBondContact O-N 3.35Å; T475-Q483 HydrophobicContact CG2-CB 4.14Å; T475-Q483 PolarHBondContact N-O 2.92Å; T475-Q483 PolarHBondContact O-N 3.21Å; T475-Q483 VanDerWaalsContact O-O 3.12Å; T475-L509 HydrophobicContact CG2-CD1 3.96Å; T475-L509 HydrophobicContact CG2-CD2 4.15Å
476	P	50.3	Low	51.1	Low	103 Å²	103	79.5 Å²	79.5	67%	0.669	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.4	174.8	28.8	-33.2	0	0	0	110.6
477	G	49.4	Very low	50.4	Low	12 Å²	12	78.7 Å²	78.7	12%	0.124	42%	0.419	C	S	.	.			trans	-77	161.9	172.8	0	0	0	0	0	112.6	T475 D479 G480 K481	T475-G477 PolarHBondContact O-N 3.35Å; G477-D479 PolarHBondContact O-N 3.36Å; G477-G480 PolarHBondContact O-N 3.37Å; G477-K481 WeakPolarHBondContact CA-O 3.47Å; G477-K481 PolarHBondContact N-O 2.87Å
478	Q	51.1	Low	49.4	Very low	202 Å²	202	74.5 Å²	74.5	94%	0.944	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-30.2	-176	-69.7	177.3	-19.2	0	0	113.7	G480	Q478-G480 VanDerWaalsContact C-N 3.25Å; Q478-G480 PolarHBondContact O-N 3.05Å
479	D	49.1	Very low	48.2	Very low	151 Å²	151	73.9 Å²	73.9	81%	0.807	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	16.7	175.7	-57.4	-39.5	0	0	0	114.1	G477 K481	G477-D479 PolarHBondContact O-N 3.36Å; D479-K481 PolarHBondContact O-N 3.42Å; D479-K481 VanDerWaalsContact O-N 3.1Å
480	G	46.9	Very low	47	Very low	68 Å²	68	70.2 Å²	70.2	70%	0.701	37%	0.37	S	S	*	.	S	Bend	trans	71.6	0.3	-179.5	0	0	0	0	0	115.6	G477 Q478	G477-G480 PolarHBondContact O-N 3.37Å; Q478-G480 VanDerWaalsContact C-N 3.25Å; Q478-G480 PolarHBondContact O-N 3.05Å
481	K	46.3	Very low	45.9	Very low	149 Å²	149	72.5 Å²	72.5	65%	0.648	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-82.9	135	171.9	-71.3	177.8	-179.9	170.8	0	110.8	G477 D479 Q483	G477-K481 WeakPolarHBondContact CA-O 3.47Å; G477-K481 PolarHBondContact N-O 2.87Å; D479-K481 PolarHBondContact O-N 3.42Å; D479-K481 VanDerWaalsContact O-N 3.1Å; K481-Q483 PolarHBondContact O-N 2.97Å
482	L	42.3	Very low	44.5	Very low	96 Å²	96	72.5 Å²	72.5	50%	0.503	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	119.6	172.4	-78.3	161.2	0	0	0	110.6
483	Q	41.1	Very low	43.4	Very low	67 Å²	67	72.1 Å²	72.1	31%	0.313	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	150.8	169.7	-62.1	-180	-2.1	0	0	109.2	S474 T475 K481 L509	S474-Q483 CarbonylContact C-O 3.51Å; S474-Q483 VanDerWaalsContact CA-O 3.26Å; S474-Q483 WeakPolarHBondContact CA-O 3.26Å; T475-Q483 HydrophobicContact CG2-CB 4.14Å; T475-Q483 PolarHBondContact N-O 2.92Å; T475-Q483 PolarHBondContact O-N 3.21Å; T475-Q483 VanDerWaalsContact O-O 3.12Å; K481-Q483 PolarHBondContact O-N 2.97Å; Q483-L509 HydrophobicContact CB-CB 4.4Å
484	R	42.6	Very low	42.3	Very low	82 Å²	82	68.8 Å²	68.8	31%	0.309	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	144.2	-172.3	-62.8	-178.3	178.5	101.5	-4	111.1	L472 Y473 C510 V511	L472-R484 HydrophobicContact CD1-CB 4.24Å; Y473-R484 WeakPolarHBondContact O-CA 3.29Å; R484-C510 PolarHBondContact N-O 3.41Å; R484-C510 PolarHBondContact O-N 3.5Å; R484-V511 PolarHBondContact NH1-O 2.64Å
485	L	39	Very low	41	Very low	37 Å²	37	70.9 Å²	70.9	19%	0.194	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.3	173.3	-163.8	76.1	0	0	0	107.5	Y473 I505 P506 K508 L509	Y473-L485 PolarHBondContact N-O 3.17Å; Y473-L485 PolarHBondContact O-N 3.42Å; Y473-L485 VanDerWaalsContact O-O 3.11Å; L485-I505 HydrophobicContact CD2-CG2 3.99Å; L485-P506 HydrophobicContact CD1-CG 4.14Å; L485-K508 WeakPolarHBondContact CD1-O 3.39Å; L485-L509 HydrophobicContact CB-CD2 3.75Å; L485-L509 HydrophobicContact CD1-CD2 3.89Å; L485-L509 HydrophobicContact CD1-CG 4.43Å; L485-L509 HydrophobicContact CG-CD2 4.38Å
486	S	38.6	Very low	40.1	Very low	2 Å²	2	79 Å²	79	1%	0.014	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	136.3	163.3	39.2	0	0	0	0	109.8	H471 P506 A516 K517 A520	H471-S486 VanDerWaalsContact O-CA 3.32Å; H471-S486 WeakPolarHBondContact O-CA 3.17Å; S486-P506 VanDerWaalsContact O-CD 3.29Å; S486-P506 WeakPolarHBondContact O-CD 3.23Å; S486-P506 WeakPolarHBondContact O-CG 3.4Å; S486-A516 WeakPolarHBondContact OG-CB 3.34Å; S486-A516 PolarHBondContact OG-O 3.01Å; S486-K517 PolarHBondContact OG-N 3.28Å; S486-A520 WeakPolarHBondContact O-CB 3.32Å
487	H	41.5	Very low	38.9	Very low	8 Å²	8	81.7 Å²	81.7	4%	0.037	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	160.8	166.8	71.8	-86.3	0	0	0	110	H471 Y473 D489 Y504 I505	H471-H487 WeakPolarHBondContact CB-CE1 3.38Å; H471-H487 AromaticContact CD2-CE1 3.97Å; H471-H487 AromaticContact CD2-NE2 3.55Å; H471-H487 PolarHBondContact N-O 2.62Å; H471-H487 PolarHBondContact O-N 3.39Å; H471-H487 PolarHBondContact O-ND1 3.44Å; Y473-H487 AromaticContact CD2-ND1 3.94Å; Y473-H487 AromaticContact CE2-CE1 3.36Å; Y473-H487 WeakPolarHBondContact CE2-CE1 3.35Å; Y473-H487 AromaticContact CE2-ND1 3.31Å; Y473-H487 VanDerWaalsContact CE2-ND1 3.31Å; Y473-H487 WeakPolarHBondContact CE2-ND1 3.33Å; Y473-H487 AromaticContact CZ-CE1 3.66Å; Y473-H487 PolarHBondContact OH-CE1 3.23Å; H487-D489 IonicContact CD2-OD2 3.67Å; H487-D489 IonicContact NE2-OD2 3.54Å; H487-Y504 WeakPolarHBondContact CB-O 3.34Å; H487-I505 HydrophobicContact CB-CB 4.47Å; H487-I505 HydrophobicContact CB-CG1 3.93Å
488	I	41	Very low	38.2	Very low	0 Å²	0	87 Å²	87	0%	0	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.4	177.6	-61	176.6	0	0	0	109.5	L456 P468 E469 Y470 I490 Y504 A520 A521	L456-I488 HydrophobicContact CD2-CD1 3.85Å; L456-I488 HydrophobicContact CD2-CG2 4.49Å; P468-I488 HydrophobicContact CB-CG2 3.72Å; E469-I488 WeakPolarHBondContact O-CA 3.32Å; Y470-I488 HydrophobicContact CD1-CD1 3.92Å; Y470-I488 HydrophobicContact CD1-CG1 3.68Å; Y470-I488 HydrophobicContact CE1-CD1 3.3Å; Y470-I488 HydrophobicContact CE1-CG1 3.64Å; Y470-I488 HydrophobicContact CG-CG1 4.34Å; I488-I490 HydrophobicContact CG2-CD1 4.44Å; I488-I490 HydrophobicContact CG2-CG1 3.93Å; I488-Y504 PolarHBondContact N-O 2.72Å; I488-Y504 VanDerWaalsContact N-O 3.08Å; I488-Y504 PolarHBondContact O-N 3.21Å; I488-A520 VanDerWaalsContact CD1-C 3.46Å; I488-A520 HydrophobicContact CD1-CB 3.81Å; I488-A520 HydrophobicContact CG1-CB 3.88Å; I488-A521 HydrophobicContact CD1-CB 4.18Å
489	D	39.1	Very low	37.4	Very low	0 Å²	0	82.5 Å²	82.5	0%	0	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	142.9	161	-74.6	-64.6	0	0	0	110.6	E469 H471 H487 R501 T503	E469-D489 PolarHBondContact N-O 3.31Å; E469-D489 PolarHBondContact O-N 2.94Å; E469-D489 VanDerWaalsContact O-N 3.07Å; H471-D489 IonicContact CD2-OD2 3.61Å; H487-D489 IonicContact CD2-OD2 3.67Å; H487-D489 IonicContact NE2-OD2 3.54Å; D489-R501 VanDerWaalsContact CG-NE 3.28Å; D489-R501 VanDerWaalsContact OD1-CG 3.32Å; D489-R501 WeakPolarHBondContact OD1-CG 3.48Å; D489-R501 IonicContact OD1-CZ 3.54Å; D489-R501 IonicContact OD1-NE 3.21Å; D489-R501 PolarHBondContact OD1-NE 2.86Å; D489-R501 IonicContact OD1-NH2 2.77Å; D489-R501 IonicContact OD2-CZ 3.37Å; D489-R501 IonicContact OD2-NE 3.27Å; D489-R501 PolarHBondContact OD2-NE 3.32Å; D489-R501 IonicContact OD2-NH2 2.67Å; D489-R501 PolarHBondContact OD2-NH2 3.5Å; D489-T503 WeakPolarHBondContact OD1-CA 3.49Å; D489-T503 WeakPolarHBondContact OD1-CB 3.49Å; D489-T503 PolarHBondContact OD1-OG1 3.37Å
490	I	37.7	Very low	37	Very low	13 Å²	13	80.7 Å²	80.7	7%	0.067	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.1	176	-60.2	179	0	0	0	108.3	L456 W465 P468 I488 T524 L528	L456-I490 HydrophobicContact CD1-CD1 3.97Å; L456-I490 HydrophobicContact CD2-CD1 4.44Å; W465-I490 HydrophobicContact CB-CG2 4.1Å; W465-I490 HydrophobicContact CD2-CG2 4.41Å; W465-I490 HydrophobicContact CE3-CG2 3.98Å; P468-I490 HydrophobicContact CB-CG1 4.27Å; I488-I490 HydrophobicContact CG2-CD1 4.44Å; I488-I490 HydrophobicContact CG2-CG1 3.93Å; I490-T524 HydrophobicContact CD1-CG2 3.56Å; I490-L528 HydrophobicContact CD1-CD1 4.18Å
491	Y	36.9	Very low	37.1	Very low	104 Å²	104	84.5 Å²	84.5	41%	0.408	45%	0.452	S	S	.	.			trans	-108.5	136.2	178.7	-53.1	-83.5	0	0	0	111.3	S466	S466-Y491 PolarHBondContact N-O 2.7Å; S466-Y491 WeakPolarHBondContact OG-CB 3.45Å; S466-Y491 WeakPolarHBondContact OG-CD2 3.41Å; S466-Y491 PolarHBondContact OG-N 2.94Å; S466-Y491 PolarHBondContact OG-O 2.9Å
492	S	30.1	Very low	37.4	Very low	57 Å²	57	79.3 Å²	79.3	40%	0.399	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-66.4	131.5	164.4	170.2	0	0	0	0	109.8	A494	S492-A494 VanDerWaalsContact C-N 3.25Å; S492-A494 PolarHBondContact OG-N 3.16Å; S492-A494 PolarHBondContact OG-O 2.92Å
493	A	33.2	Very low	38	Very low	77 Å²	77	77.1 Å²	77.1	64%	0.636	43%	0.427	S	S	*	.	S	Bend	trans	-79.7	-9.9	169.5	0	0	0	0	0	112.8	C464	C464-A493 WeakPolarHBondContact O-CB 3.32Å
494	A	31.1	Very low	38.8	Very low	70 Å²	70	76.2 Å²	76.2	58%	0.579	42%	0.421	S	S	*	.	S	Bend	trans	-87.7	125.5	172.9	0	0	0	0	0	110.7	S492	S492-A494 VanDerWaalsContact C-N 3.25Å; S492-A494 PolarHBondContact OG-N 3.16Å; S492-A494 PolarHBondContact OG-O 2.92Å
495	C	23.9	Very low	39.5	Very low	126 Å²	126	77.3 Å²	77.3	85%	0.851	43%	0.432	S	S	*	.	S	Bend	trans	72.2	144.2	178.3	-64.2	0	0	0	0	117.3
496	R	31.5	Very low	40.6	Very low	235 Å²	235	75.9 Å²	75.9	89%	0.887	43%	0.425	S	S	*	.	S	Bend	trans	-82.6	163.3	169.7	-58.3	178	-173.5	172.6	1.9	109.5
497	L	25.6	Very low	41.2	Very low	159 Å²	159	81.8 Å²	81.8	83%	0.832	46%	0.457	S	S	*	.	S	Bend	trans	85.5	148.1	-179.8	-66.2	109	0	0	0	116.2	S499	L497-S499 PolarHBondContact O-N 3.36Å
498	P	34	Very low	42	Very low	123 Å²	123	87.1 Å²	87.1	80%	0.799	48%	0.48	S	S	*	.	S	Bend	trans	-108.4	65.5	-149.4	40	-31.1	0	0	0	112.8
499	S	33.4	Very low	42.7	Very low	109 Å²	109	91.2 Å²	91.2	76%	0.762	50%	0.501	S	S	*	.			trans	-122	3.1	-168.6	-56.1	0	0	0	0	116.1	L497	L497-S499 PolarHBondContact O-N 3.36Å
500	T	41.4	Very low	43.5	Very low	113 Å²	113	92.2 Å²	92.2	69%	0.693	51%	0.508	S	S	*	.			trans	-133.9	61.9	174.9	58.4	0	0	0	0	111.3	A502	T500-A502 PolarHBondContact O-N 3.03Å
501	R	48.7	Very low	44.3	Very low	148 Å²	148	95.4 Å²	95.4	56%	0.558	53%	0.528	S	S	*	.			trans	-81.1	104.8	168.9	-173.9	-171.3	-178.8	-170.5	-4.3	108.6	D489 T503	D489-R501 VanDerWaalsContact CG-NE 3.28Å; D489-R501 VanDerWaalsContact OD1-CG 3.32Å; D489-R501 WeakPolarHBondContact OD1-CG 3.48Å; D489-R501 IonicContact OD1-CZ 3.54Å; D489-R501 IonicContact OD1-NE 3.21Å; D489-R501 PolarHBondContact OD1-NE 2.86Å; D489-R501 IonicContact OD1-NH2 2.77Å; D489-R501 IonicContact OD2-CZ 3.37Å; D489-R501 IonicContact OD2-NE 3.27Å; D489-R501 PolarHBondContact OD2-NE 3.32Å; D489-R501 IonicContact OD2-NH2 2.67Å; D489-R501 PolarHBondContact OD2-NH2 3.5Å; R501-T503 WeakPolarHBondContact CD-OG1 3.37Å; R501-T503 WeakPolarHBondContact CG-OG1 3.33Å; R501-T503 PolarHBondContact NE-OG1 2.95Å; R501-T503 PolarHBondContact O-N 3.43Å
502	A	53.5	Low	45	Very low	40 Å²	40	95.3 Å²	95.3	33%	0.331	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	89	171.6	0	0	0	0	0	108.9	T500 Y504	T500-A502 PolarHBondContact O-N 3.03Å; A502-Y504 HydrophobicContact CB-CE2 3.65Å; A502-Y504 WeakPolarHBondContact O-CD2 3.4Å; A502-Y504 WeakPolarHBondContact O-CE2 3.47Å
503	T	53.7	Low	46.2	Very low	50 Å²	50	95.8 Å²	95.8	31%	0.307	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	120.2	178.3	-55.9	0	0	0	0	110	D489 R501 I505	D489-T503 WeakPolarHBondContact OD1-CA 3.49Å; D489-T503 WeakPolarHBondContact OD1-CB 3.49Å; D489-T503 PolarHBondContact OD1-OG1 3.37Å; R501-T503 WeakPolarHBondContact CD-OG1 3.37Å; R501-T503 WeakPolarHBondContact CG-OG1 3.33Å; R501-T503 PolarHBondContact NE-OG1 2.95Å; R501-T503 PolarHBondContact O-N 3.43Å; T503-I505 HydrophobicContact CG2-CD1 4.38Å; T503-I505 HydrophobicContact CG2-CG1 4.06Å
504	Y	58.9	Low	47.5	Very low	48 Å²	48	96.9 Å²	96.9	19%	0.188	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.9	178.8	-62.3	-76.9	0	0	0	110.4	H487 I488 A502 T524 N527 L528	H487-Y504 WeakPolarHBondContact CB-O 3.34Å; I488-Y504 PolarHBondContact N-O 2.72Å; I488-Y504 VanDerWaalsContact N-O 3.08Å; I488-Y504 PolarHBondContact O-N 3.21Å; A502-Y504 HydrophobicContact CB-CE2 3.65Å; A502-Y504 WeakPolarHBondContact O-CD2 3.4Å; A502-Y504 WeakPolarHBondContact O-CE2 3.47Å; Y504-T524 WeakPolarHBondContact CB-OG1 3.36Å; Y504-T524 HydrophobicContact CD2-CG2 3.56Å; Y504-T524 HydrophobicContact CE2-CG2 4.01Å; Y504-T524 HydrophobicContact CG-CG2 4.1Å; Y504-N527 HydrophobicContact CD1-CB 3.89Å; Y504-N527 HydrophobicContact CE1-CB 3.48Å; Y504-N527 VanDerWaalsContact CE1-CB 3.48Å; Y504-L528 HydrophobicContact CE2-CD2 4.45Å
505	I	57.8	Low	48.9	Very low	105 Å²	105	97.5 Å²	97.5	54%	0.538	52%	0.52	S	S	.	.			trans	-118.5	121.3	-177.4	-50	-179	0	0	0	108.1	L485 H487 T503	L485-I505 HydrophobicContact CD2-CG2 3.99Å; H487-I505 HydrophobicContact CB-CB 4.47Å; H487-I505 HydrophobicContact CB-CG1 3.93Å; T503-I505 HydrophobicContact CG2-CD1 4.38Å; T503-I505 HydrophobicContact CG2-CG1 4.06Å
506	P	61.9	Low	50.6	Low	7 Å²	7	91.7 Å²	91.7	5%	0.045	48%	0.481	C	S	.	.			trans	-71	150.7	174.1	29.7	-33.8	0	0	0	111.4	L485 S486 K508 L519 A520	L485-P506 HydrophobicContact CD1-CG 4.14Å; S486-P506 VanDerWaalsContact O-CD 3.29Å; S486-P506 WeakPolarHBondContact O-CD 3.23Å; S486-P506 WeakPolarHBondContact O-CG 3.4Å; P506-K508 VanDerWaalsContact C-N 3.27Å; P506-K508 PolarHBondContact O-N 3.41Å; P506-L519 HydrophobicContact CB-CD2 3.97Å; P506-L519 HydrophobicContact CB-CG 3.94Å; P506-L519 HydrophobicContact CG-CD2 4.43Å; P506-A520 HydrophobicContact CG-CB 4.16Å
507	D	51.2	Low	52	Low	126 Å²	126	83.3 Å²	83.3	67%	0.674	45%	0.451	S	S	*	.	S	Bend	trans	-80.7	-2.6	-177.4	67.3	-42	0	0	0	114.1
508	K	57.2	Low	54.1	Low	120 Å²	120	77.9 Å²	77.9	52%	0.522	42%	0.422	S	S	.	.	S	Bend	trans	-129.7	144.3	-169.2	-64.3	168.5	-170.3	84	0	111.8	L485 P506 L519	L485-K508 WeakPolarHBondContact CD1-O 3.39Å; P506-K508 VanDerWaalsContact C-N 3.27Å; P506-K508 PolarHBondContact O-N 3.41Å; K508-L519 HydrophobicContact CB-CD2 4.06Å
509	L	55.8	Low	55.6	Low	85 Å²	85	73.8 Å²	73.8	45%	0.445	39%	0.393	S	S	.	.			trans	-94	139.3	178.2	-73.5	162.6	0	0	0	111.2	T475 Q483 L485	T475-L509 HydrophobicContact CG2-CD1 3.96Å; T475-L509 HydrophobicContact CG2-CD2 4.15Å; Q483-L509 HydrophobicContact CB-CB 4.4Å; L485-L509 HydrophobicContact CB-CD2 3.75Å; L485-L509 HydrophobicContact CD1-CD2 3.89Å; L485-L509 HydrophobicContact CD1-CG 4.43Å; L485-L509 HydrophobicContact CG-CD2 4.38Å
510	C	56.8	Low	57	Low	21 Å²	21	68.6 Å²	68.6	14%	0.142	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-112.4	158.2	178.9	-68	0	0	0	0	111.1	R484 D515 A516	R484-C510 PolarHBondContact N-O 3.41Å; R484-C510 PolarHBondContact O-N 3.5Å; C510-D515 HydrophobicContact CB-CB 4.13Å; C510-A516 HydrophobicContact CB-CB 3.82Å
511	V	53.2	Low	58.2	Low	81 Å²	81	63.2 Å²	63.2	49%	0.491	32%	0.323	S	S	.	.	S	Bend	trans	-94.2	-42.1	177.4	-176.7	0	0	0	0	111	R484	R484-V511 PolarHBondContact NH1-O 2.64Å
512	L	52.3	Low	59.2	Low	102 Å²	102	61 Å²	61	53%	0.534	32%	0.319	S	S	.	.	S	Bend	trans	-87.2	156.9	175.6	-53.3	179.3	0	0	0	111.1	D515	L512-D515 HydrophobicContact CB-CB 4.35Å; L512-D515 WeakPolarHBondContact CB-OD2 3.47Å
513	L	56.2	Low	59.7	Low	66 Å²	66	60.6 Å²	60.6	35%	0.346	31%	0.313	S	S	.	.	H	α-helix	trans	-72.5	-40.9	-178.7	176.1	58.6	0	0	0	112	L472 A516 K517	L472-L513 HydrophobicContact CD1-CD1 3.55Å; L472-L513 HydrophobicContact CD2-CD1 3.66Å; L472-L513 HydrophobicContact CG-CD1 4.2Å; L513-A516 WeakPolarHBondContact O-CB 3.29Å; L513-A516 PolarHBondContact O-N 2.77Å; L513-K517 PolarHBondContact O-N 2.93Å
514	D	59.9	Low	60.3	Low	101 Å²	101	58.2 Å²	58.2	54%	0.54	30%	0.298	S	S	.	.	H	α-helix	trans	-80.5	-35.2	-170.9	-53	-57.2	0	0	0	111.3	A516 K517 E518	D514-A516 PolarHBondContact O-N 3.07Å; D514-K517 PolarHBondContact O-N 3.11Å; D514-K517 IonicContact OD1-NZ 3.46Å; D514-K517 PolarHBondContact OD1-NZ 3.19Å; D514-E518 VanDerWaalsContact O-CB 3.32Å; D514-E518 WeakPolarHBondContact O-CB 3.33Å; D514-E518 PolarHBondContact O-N 3.26Å
515	D	60.5	Low	60.7	Low	83 Å²	83	57.3 Å²	57.3	44%	0.444	30%	0.297	S	S	.	.	H	α-helix	trans	-51.3	-42.3	164.4	-57.8	-4.5	0	0	0	111.9	C510 L512 L519	C510-D515 HydrophobicContact CB-CB 4.13Å; L512-D515 HydrophobicContact CB-CB 4.35Å; L512-D515 WeakPolarHBondContact CB-OD2 3.47Å; D515-L519 VanDerWaalsContact O-CB 3.23Å; D515-L519 WeakPolarHBondContact O-CB 3.47Å; D515-L519 PolarHBondContact O-N 3.28Å
516	A	58	Low	61.2	Low	3 Å²	3	59.9 Å²	59.9	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-68	-38.5	-178	0	0	0	0	0	112.2	S486 C510 L513 D514 A520	S486-A516 WeakPolarHBondContact OG-CB 3.34Å; S486-A516 PolarHBondContact OG-O 3.01Å; C510-A516 HydrophobicContact CB-CB 3.82Å; L513-A516 WeakPolarHBondContact O-CB 3.29Å; L513-A516 PolarHBondContact O-N 2.77Å; D514-A516 PolarHBondContact O-N 3.07Å; A516-A520 WeakPolarHBondContact O-CB 3.26Å; A516-A520 PolarHBondContact O-N 3.08Å; A516-A520 VanDerWaalsContact O-N 3.11Å
517	K	62.7	Low	61.3	Low	60 Å²	60	63.8 Å²	63.8	26%	0.261	32%	0.32	S	S	.	.	H	α-helix	trans	-69.6	-46.6	175.3	-64.9	171.5	-170.5	154	0	111.1	V453 Y470 S486 L513 D514 A520 A521	V453-K517 HydrophobicContact CG2-CB 4.08Å; Y470-K517 HydrophobicContact CD1-CB 3.89Å; Y470-K517 HydrophobicContact CD1-CG 3.81Å; Y470-K517 HydrophobicContact CE1-CB 3.78Å; Y470-K517 HydrophobicContact CE1-CG 4.2Å; Y470-K517 HydrophobicContact CG-CG 4.43Å; S486-K517 PolarHBondContact OG-N 3.28Å; L513-K517 PolarHBondContact O-N 2.93Å; D514-K517 PolarHBondContact O-N 3.11Å; D514-K517 IonicContact OD1-NZ 3.46Å; D514-K517 PolarHBondContact OD1-NZ 3.19Å; K517-A520 PolarHBondContact O-N 2.9Å; K517-A521 WeakPolarHBondContact O-CB 3.32Å; K517-A521 PolarHBondContact O-N 3.05Å
518	E	69.7	Low	62.1	Low	45 Å²	45	60.3 Å²	60.3	21%	0.21	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-46	180	-176.5	66.2	-158.9	0	0	110.5	S451 A452 V453 D514 A521 Q522	S451-E518 PolarHBondContact OG-OE2 3.37Å; A452-E518 WeakPolarHBondContact CB-OE1 3.43Å; A452-E518 VanDerWaalsContact N-CD 3.33Å; A452-E518 PolarHBondContact N-OE1 3.36Å; A452-E518 PolarHBondContact N-OE2 2.84Å; A452-E518 VanDerWaalsContact N-OE2 3.14Å; V453-E518 PolarHBondContact N-OE2 3.43Å; D514-E518 VanDerWaalsContact O-CB 3.32Å; D514-E518 WeakPolarHBondContact O-CB 3.33Å; D514-E518 PolarHBondContact O-N 3.26Å; E518-A521 PolarHBondContact O-N 3.39Å; E518-Q522 VanDerWaalsContact O-CG 3.3Å; E518-Q522 WeakPolarHBondContact O-CG 3.41Å; E518-Q522 PolarHBondContact O-N 2.67Å; E518-Q522 PolarHBondContact OE1-NE2 3.41Å
519	L	63.9	Low	61.8	Low	36 Å²	36	56.7 Å²	56.7	19%	0.188	30%	0.298	C	S	.	.	H	α-helix	trans	-58.6	-49.9	172.9	175.9	64.8	0	0	0	112.1	P506 K508 D515 A521 Q522 T523	P506-L519 HydrophobicContact CB-CD2 3.97Å; P506-L519 HydrophobicContact CB-CG 3.94Å; P506-L519 HydrophobicContact CG-CD2 4.43Å; K508-L519 HydrophobicContact CB-CD2 4.06Å; D515-L519 VanDerWaalsContact O-CB 3.23Å; D515-L519 WeakPolarHBondContact O-CB 3.47Å; D515-L519 PolarHBondContact O-N 3.28Å; L519-A521 VanDerWaalsContact C-N 3.28Å; L519-A521 PolarHBondContact O-N 3.21Å; L519-Q522 PolarHBondContact O-N 3.27Å; L519-T523 PolarHBondContact O-N 3.05Å; L519-T523 PolarHBondContact O-OG1 2.77Å
520	A	62.6	Low	61.6	Low	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-36.2	-179.8	0	0	0	0	0	111.9	S486 I488 P506 A516 K517 T523 T524	S486-A520 WeakPolarHBondContact O-CB 3.32Å; I488-A520 VanDerWaalsContact CD1-C 3.46Å; I488-A520 HydrophobicContact CD1-CB 3.81Å; I488-A520 HydrophobicContact CG1-CB 3.88Å; P506-A520 HydrophobicContact CG-CB 4.16Å; A516-A520 WeakPolarHBondContact O-CB 3.26Å; A516-A520 PolarHBondContact O-N 3.08Å; A516-A520 VanDerWaalsContact O-N 3.11Å; K517-A520 PolarHBondContact O-N 2.9Å; A520-T523 PolarHBondContact O-N 3.31Å; A520-T524 WeakPolarHBondContact O-CB 3.46Å; A520-T524 PolarHBondContact O-N 3.41Å; A520-T524 PolarHBondContact O-OG1 2.8Å
521	A	66.9	Low	60.7	Low	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-67.3	-40.9	175.3	0	0	0	0	0	111.7	A452 V453 L456 I488 K517 E518 L519 T524 L525	A452-A521 HydrophobicContact CB-CB 3.96Å; V453-A521 HydrophobicContact CG2-CB 4.12Å; L456-A521 HydrophobicContact CB-CB 4.44Å; L456-A521 HydrophobicContact CD2-CB 4.07Å; I488-A521 HydrophobicContact CD1-CB 4.18Å; K517-A521 WeakPolarHBondContact O-CB 3.32Å; K517-A521 PolarHBondContact O-N 3.05Å; E518-A521 PolarHBondContact O-N 3.39Å; L519-A521 VanDerWaalsContact C-N 3.28Å; L519-A521 PolarHBondContact O-N 3.21Å; A521-T524 PolarHBondContact O-N 2.85Å; A521-L525 WeakPolarHBondContact O-CB 3.31Å; A521-L525 WeakPolarHBondContact O-CG 3.39Å; A521-L525 PolarHBondContact O-N 2.67Å
522	Q	69.4	Low	59.6	Low	101 Å²	101	64 Å²	64	47%	0.472	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-47.7	173.1	-69.9	173.9	15.9	0	0	111.8	A452 E518 L519 T524 L525 W526	A452-Q522 HydrophobicContact CB-CB 4.44Å; A452-Q522 HydrophobicContact CB-CG 3.39Å; E518-Q522 VanDerWaalsContact O-CG 3.3Å; E518-Q522 WeakPolarHBondContact O-CG 3.41Å; E518-Q522 PolarHBondContact O-N 2.67Å; E518-Q522 PolarHBondContact OE1-NE2 3.41Å; L519-Q522 PolarHBondContact O-N 3.27Å; Q522-T524 VanDerWaalsContact C-N 3.27Å; Q522-T524 PolarHBondContact O-N 2.98Å; Q522-L525 PolarHBondContact O-N 2.65Å; Q522-W526 WeakPolarHBondContact O-CB 3.45Å; Q522-W526 PolarHBondContact O-N 2.88Å
523	T	65.6	Low	58.8	Low	32 Å²	32	66.4 Å²	66.4	20%	0.196	36%	0.356	C	S	.	.	H	α-helix	trans	-59.4	-38.7	175.2	-57	0	0	0	0	111.8	L519 A520 N527	L519-T523 PolarHBondContact O-N 3.05Å; L519-T523 PolarHBondContact O-OG1 2.77Å; A520-T523 PolarHBondContact O-N 3.31Å; T523-N527 PolarHBondContact O-N 2.91Å; T523-N527 PolarHBondContact O-ND2 3.4Å
524	T	65.1	Low	57.5	Low	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-69.4	-48.9	179.1	-57.8	0	0	0	0	111.5	L456 I490 Y504 A520 A521 Q522 W526 N527 L528	L456-T524 HydrophobicContact CD1-CG2 4.07Å; L456-T524 HydrophobicContact CD2-CG2 4Å; I490-T524 HydrophobicContact CD1-CG2 3.56Å; Y504-T524 WeakPolarHBondContact CB-OG1 3.36Å; Y504-T524 HydrophobicContact CD2-CG2 3.56Å; Y504-T524 HydrophobicContact CE2-CG2 4.01Å; Y504-T524 HydrophobicContact CG-CG2 4.1Å; A520-T524 WeakPolarHBondContact O-CB 3.46Å; A520-T524 PolarHBondContact O-N 3.41Å; A520-T524 PolarHBondContact O-OG1 2.8Å; A521-T524 PolarHBondContact O-N 2.85Å; Q522-T524 VanDerWaalsContact C-N 3.27Å; Q522-T524 PolarHBondContact O-N 2.98Å; T524-W526 VanDerWaalsContact C-N 3.31Å; T524-W526 PolarHBondContact O-N 2.92Å; T524-N527 PolarHBondContact O-N 2.93Å; T524-L528 HydrophobicContact CG2-CD1 3.77Å; T524-L528 HydrophobicContact CG2-CG 4.45Å; T524-L528 WeakPolarHBondContact O-CD1 3.26Å; T524-L528 VanDerWaalsContact O-CG 3.26Å; T524-L528 WeakPolarHBondContact O-CG 3.49Å; T524-L528 PolarHBondContact O-N 2.8Å; T524-L528 VanDerWaalsContact O-N 3.12Å
525	L	68.9	Low	56.2	Low	30 Å²	30	68.8 Å²	68.8	16%	0.157	38%	0.38	C	S	.	.	H	α-helix	trans	-57.9	-41.7	175.4	-76.4	169.2	0	0	0	112.4	A452 L455 L456 H459 A521 Q522 N527 L528	A452-L525 HydrophobicContact CB-CD1 4.19Å; L455-L525 HydrophobicContact CB-CD1 4.13Å; L455-L525 HydrophobicContact CD2-CD1 3.89Å; L455-L525 HydrophobicContact CG-CD1 3.88Å; L456-L525 HydrophobicContact CB-CD1 4.3Å; L456-L525 HydrophobicContact CB-CD2 4.26Å; L456-L525 HydrophobicContact CB-CG 4.17Å; L456-L525 HydrophobicContact CD1-CD2 3.86Å; L456-L525 HydrophobicContact CD1-CG 4.09Å; H459-L525 HydrophobicContact CB-CD2 4.27Å; A521-L525 WeakPolarHBondContact O-CB 3.31Å; A521-L525 WeakPolarHBondContact O-CG 3.39Å; A521-L525 PolarHBondContact O-N 2.67Å; Q522-L525 PolarHBondContact O-N 2.65Å; L525-N527 VanDerWaalsContact C-N 3.34Å; L525-N527 PolarHBondContact O-N 2.89Å; L525-L528 PolarHBondContact O-N 3.42Å
526	W	67.5	Low	54.7	Low	158 Å²	158	73 Å²	73	60%	0.598	40%	0.397	S	S	*	.	H	α-helix	trans	-59.7	-43.2	177.1	-174.2	-90.6	0	0	0	112.3	Q522 T524 L528	Q522-W526 WeakPolarHBondContact O-CB 3.45Å; Q522-W526 PolarHBondContact O-N 2.88Å; T524-W526 VanDerWaalsContact C-N 3.31Å; T524-W526 PolarHBondContact O-N 2.92Å; W526-L528 VanDerWaalsContact C-N 3.34Å; W526-L528 PolarHBondContact O-N 3.34Å
527	N	63.9	Low	53.5	Low	89 Å²	89	77.7 Å²	77.7	48%	0.476	43%	0.427	S	S	.	.	H	α-helix	trans	-77.2	-15.7	-179.6	-69.3	-39.7	0	0	0	114.3	Y504 T523 T524 L525	Y504-N527 HydrophobicContact CD1-CB 3.89Å; Y504-N527 HydrophobicContact CE1-CB 3.48Å; Y504-N527 VanDerWaalsContact CE1-CB 3.48Å; T523-N527 PolarHBondContact O-N 2.91Å; T523-N527 PolarHBondContact O-ND2 3.4Å; T524-N527 PolarHBondContact O-N 2.93Å; L525-N527 VanDerWaalsContact C-N 3.34Å; L525-N527 PolarHBondContact O-N 2.89Å
528	L	67.2	Low	51.9	Low	53 Å²	53	79.6 Å²	79.6	28%	0.277	45%	0.446	S	S	.	.	H	α-helix	trans	-86.4	-18.7	179.8	-73.1	166.6	0	0	0	113.6	L456 W465 I490 Y504 T524 L525 W526	L456-L528 HydrophobicContact CD1-CD1 4Å; W465-L528 HydrophobicContact CH2-CD2 3.96Å; W465-L528 HydrophobicContact CZ3-CD1 4.03Å; W465-L528 HydrophobicContact CZ3-CD2 3.9Å; I490-L528 HydrophobicContact CD1-CD1 4.18Å; Y504-L528 HydrophobicContact CE2-CD2 4.45Å; T524-L528 HydrophobicContact CG2-CD1 3.77Å; T524-L528 HydrophobicContact CG2-CG 4.45Å; T524-L528 WeakPolarHBondContact O-CD1 3.26Å; T524-L528 VanDerWaalsContact O-CG 3.26Å; T524-L528 WeakPolarHBondContact O-CG 3.49Å; T524-L528 PolarHBondContact O-N 2.8Å; T524-L528 VanDerWaalsContact O-N 3.12Å; L525-L528 PolarHBondContact O-N 3.42Å; W526-L528 VanDerWaalsContact C-N 3.34Å; W526-L528 PolarHBondContact O-N 3.34Å
529	G	52.3	Low	50.1	Low	45 Å²	45	83.9 Å²	83.9	46%	0.464	48%	0.479	S	S	.	.	S	Bend	trans	145.6	136.6	169.1	0	0	0	0	0	114.5	V531	G529-V531 PolarHBondContact O-N 3.1Å; G529-V531 VanDerWaalsContact O-N 3.09Å
530	N	50.5	Low	48.7	Very low	158 Å²	158	92.3 Å²	92.3	85%	0.845	51%	0.508	S	S	*	.			trans	-30	103.2	-175.7	-81.4	-12.5	0	0	0	116.4
531	V	38.2	Very low	47.3	Very low	87 Å²	87	97 Å²	97	53%	0.527	55%	0.547	S	S	.	.			trans	-116.4	101.9	148.3	178.7	0	0	0	0	107.1	G529 L533	G529-V531 PolarHBondContact O-N 3.1Å; G529-V531 VanDerWaalsContact O-N 3.09Å; V531-L533 PolarHBondContact O-N 2.99Å
532	S	31	Very low	45.9	Very low	94 Å²	94	102.4 Å²	102.4	66%	0.657	58%	0.581	S	S	*	*			trans	-76.1	93.3	-174.7	56	0	0	0	0	112
533	L	33.7	Very low	44.2	Very low	153 Å²	153	104.3 Å²	104.3	80%	0.801	59%	0.594	S	S	*	*			trans	-98.1	63.4	161.9	-74	175.4	0	0	0	110.4	V531 P535	V531-L533 PolarHBondContact O-N 2.99Å; L533-P535 WeakPolarHBondContact O-CD 3.49Å
534	T	29.8	Very low	42.5	Very low	94 Å²	94	112.1 Å²	112.1	58%	0.577	63%	0.63	S	S	*	*			trans	-96.7	113.3	172.2	49.1	0	0	0	0	110.1
535	P	31.8	Very low	40.9	Very low	123 Å²	123	120.8 Å²	120.8	80%	0.799	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-60.7	148.7	167.5	-21	33.6	0	0	0	111.3	L533	L533-P535 WeakPolarHBondContact O-CD 3.49Å
536	Q	30.3	Very low	39.7	Very low	172 Å²	172	124.3 Å²	124.3	80%	0.804	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-68.3	148.7	172.7	-72.7	-71.1	-42.5	0	0	111.1
537	P	32.2	Very low	38	Very low	101 Å²	101	128.7 Å²	128.7	66%	0.656	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-74.6	149.2	-179.6	31.4	-35.4	0	0	0	112.3
538	P	29.8	Very low	36.7	Very low	101 Å²	101	130.7 Å²	130.7	66%	0.656	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-77.4	141.3	173.2	31.9	-34.2	0	0	0	111.9	W540	P538-W540 PolarHBondContact O-N 3.2Å
539	C	30.9	Very low	35.1	Very low	135 Å²	135	134.8 Å²	134.8	91%	0.912	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	102.6	179.9	-51.3	0	0	0	0	112.2
540	W	35.5	Very low	34.1	Very low	212 Å²	212	139.8 Å²	139.8	80%	0.803	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160.7	-5.4	157.8	56.5	-90.4	0	0	0	115.6	P538 T542	P538-W540 PolarHBondContact O-N 3.2Å; W540-T542 VanDerWaalsContact C-N 3.33Å; W540-T542 PolarHBondContact O-N 3.32Å
541	A	32.3	Very low	33.2	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	78%	0.78	S	S	*	*			trans	-82.1	72.1	179.1	0	0	0	0	0	112.8
542	T	37.3	Very low	32.8	Very low	115 Å²	115	141.9 Å²	141.9	71%	0.706	80%	0.796	S	S	*	*			trans	-89.5	166.9	154.4	-18.2	0	0	0	0	109.2	W540	W540-T542 VanDerWaalsContact C-N 3.33Å; W540-T542 PolarHBondContact O-N 3.32Å
543	D	34.3	Very low	33	Very low	141 Å²	141	145.1 Å²	145.1	75%	0.754	81%	0.805	S	S	*	*			trans	65.4	78	166.1	-50.5	-23.1	0	0	0	117.4
544	M	30.7	Very low	32.9	Very low	195 Å²	195	144.6 Å²	144.6	96%	0.961	81%	0.806	S	S	*	*				-163.5	140	107.3	-107.6	177.8	-75.3	0	0	112.8
545	E	30.6	Very low	33.1	Very low	182 Å²	182	148.5 Å²	148.5	85%	0.85	82%	0.823	S	S	*	*			trans	-128.3	173.9	174.3	-142.8	-160.3	-144.4	0	0	107.8
546	P	42.9	Very low	33.3	Very low	105 Å²	105	150.6 Å²	150.6	68%	0.682	83%	0.825	S	S	*	*				-116.4	172	-89.3	39.1	-27.9	0	0	0	113.8
547	L	32.3	Very low	33.5	Very low	250 Å²	250	148.6 Å²	148.6	100%	1.309	83%	0.827	S	S	*	*			trans	-146.6	0	151.8	-96.5	177.7	0	0	0	110

Retrieved 547 of 547 residues in 615.6 ms (Link to these results)

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