A0A087XHS8_POEFO Loading...

Cyclin-dependent kinase 9 (CDC2-related kinase)

AlphaFold DB , UniProt , Accession A0A087XHS8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.4	Very low	42	Very low	247 Å²	247	155.8 Å²	155.8	100%	1.217	82%	0.819	S	S	*	*				0	84.6	0	-89.1	-179.9	170.7	0	0	109.3
2	Q	35.1	Very low	42.6	Very low	201 Å²	201	148.8 Å²	148.8	94%	0.939	80%	0.8	S	S	*	*			trans	-89.6	114	166.5	-81.9	175	-11.8	0	0	106.9
3	R	35.8	Very low	43.3	Very low	245 Å²	245	145.5 Å²	145.5	93%	0.925	78%	0.777	S	S	*	*			trans	-80.8	114.9	172.2	-85.5	-179.3	170.4	177	-3	108.2	K5	R3-K5 PolarHBondContact O-N 2.96Å
4	E	40.5	Very low	44.1	Very low	180 Å²	180	145.9 Å²	145.9	84%	0.841	77%	0.768	S	S	*	*			trans	-55.4	126	165.9	-75.7	176.9	136.6	0	0	109.9	T6	E4-T6 PolarHBondContact O-N 3.1Å
5	K	40.7	Very low	45	Very low	208 Å²	208	140.9 Å²	140.9	90%	0.904	75%	0.748	S	S	*	*			trans	-81	93	164.3	-78.4	-179.2	175.6	178.7	0	107.6	R3 S7	R3-K5 PolarHBondContact O-N 2.96Å; K5-S7 PolarHBondContact O-N 3.19Å
6	T	42	Very low	46	Very low	121 Å²	121	136.9 Å²	136.9	74%	0.742	73%	0.727	S	S	*	*			trans	-67.7	109.1	161.9	26.8	0	0	0	0	108.5	E4 N8	E4-T6 PolarHBondContact O-N 3.1Å; T6-N8 PolarHBondContact O-N 2.62Å; T6-N8 VanDerWaalsContact O-N 3.15Å
7	S	45.3	Very low	47.3	Very low	111 Å²	111	140.1 Å²	140.1	78%	0.776	73%	0.726	S	S	*	*			trans	-68.8	106.2	172.7	63.6	0	0	0	0	109	K5 A9	K5-S7 PolarHBondContact O-N 3.19Å; S7-A9 PolarHBondContact O-N 3.4Å
8	N	42.6	Very low	48.5	Very low	156 Å²	156	140.2 Å²	140.2	83%	0.834	72%	0.723	S	S	*	*			trans	-69	97.4	167.3	-89.9	-15.6	0	0	0	108.7	T6 T10	T6-N8 PolarHBondContact O-N 2.62Å; T6-N8 VanDerWaalsContact O-N 3.15Å; N8-T10 PolarHBondContact O-N 2.88Å
9	A	45.3	Very low	49.5	Very low	59 Å²	59	134.3 Å²	134.3	49%	0.488	70%	0.697	S	S	.	*			trans	-57	128.8	166.2	0	0	0	0	0	108.9	S7 E13	S7-A9 PolarHBondContact O-N 3.4Å; A9-E13 WeakPolarHBondContact CA-OE2 3.33Å; A9-E13 HydrophobicContact CB-CB 4.45Å; A9-E13 VanDerWaalsContact CB-OE2 3.3Å; A9-E13 WeakPolarHBondContact CB-OE2 3.24Å
10	T	44.3	Very low	50.4	Low	89 Å²	89	128.6 Å²	128.6	55%	0.546	67%	0.671	S	S	.	*			trans	-68.4	152.4	-177.9	56.3	0	0	0	0	110.1	N8 A12 E13	N8-T10 PolarHBondContact O-N 2.88Å; T10-A12 PolarHBondContact O-N 3.28Å; T10-E13 PolarHBondContact N-OE2 2.85Å; T10-E13 PolarHBondContact O-N 2.7Å
11	A	51.6	Low	51.5	Low	97 Å²	97	127.7 Å²	127.7	80%	0.802	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-15.2	-175.7	0	0	0	0	0	114.7
12	A	50.1	Low	52.9	Low	71 Å²	71	121 Å²	121	59%	0.587	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-21.5	174.2	0	0	0	0	0	114.3	T10 P15	T10-A12 PolarHBondContact O-N 3.28Å; A12-P15 WeakPolarHBondContact O-CD 3.29Å
13	E	50.7	Low	54.6	Low	107 Å²	107	112.1 Å²	112.1	50%	0.5	59%	0.592	S	S	.	*	H	α-helix	trans	-84.6	-21	-175.7	-71.6	174.2	139.1	0	0	113.9	A9 T10 R17	A9-E13 WeakPolarHBondContact CA-OE2 3.33Å; A9-E13 HydrophobicContact CB-CB 4.45Å; A9-E13 VanDerWaalsContact CB-OE2 3.3Å; A9-E13 WeakPolarHBondContact CB-OE2 3.24Å; T10-E13 PolarHBondContact N-OE2 2.85Å; T10-E13 PolarHBondContact O-N 2.7Å; E13-R17 PolarHBondContact O-N 2.76Å
14	K	54.5	Low	56.2	Low	151 Å²	151	108.2 Å²	108.2	66%	0.657	58%	0.582	S	S	*	*	H	α-helix	trans	-64.7	-50.5	178.4	-79.9	-174.8	175.7	-177.6	0	114.4	D16 R17 E18	K14-D16 VanDerWaalsContact C-N 3.33Å; K14-D16 PolarHBondContact O-N 3.35Å; K14-R17 PolarHBondContact O-N 3.08Å; K14-E18 PolarHBondContact O-N 3.22Å
15	P	58.5	Low	57.6	Low	71 Å²	71	108.5 Å²	108.5	46%	0.461	58%	0.577	S	S	.	*	H	α-helix	trans	-65.6	-33.5	-178.6	21.8	-31.3	0	0	0	113.2	A12 R17 A19	A12-P15 WeakPolarHBondContact O-CD 3.29Å; P15-R17 VanDerWaalsContact C-N 3.33Å; P15-R17 PolarHBondContact O-N 3.17Å; P15-A19 WeakPolarHBondContact O-CB 3.08Å; P15-A19 PolarHBondContact O-N 2.94Å
16	D	61.3	Low	58.9	Low	76 Å²	76	104.7 Å²	104.7	41%	0.406	56%	0.558	S	S	.	*	H	α-helix	trans	-70.8	-29.1	177.8	-74.9	-14	0	0	0	112.3	K14 A20	K14-D16 VanDerWaalsContact C-N 3.33Å; K14-D16 PolarHBondContact O-N 3.35Å; D16-A20 VanDerWaalsContact O-CB 3.28Å; D16-A20 WeakPolarHBondContact O-CB 3.27Å; D16-A20 PolarHBondContact O-N 3.41Å
17	R	67.7	Low	60.3	Low	192 Å²	192	103.8 Å²	103.8	73%	0.725	55%	0.549	S	S	*	.	H	α-helix	trans	-73.5	-41.7	176.6	-165.4	176.6	-177.5	-179.6	0.3	112.3	E13 K14 P15 A20 I21	E13-R17 PolarHBondContact O-N 2.76Å; K14-R17 PolarHBondContact O-N 3.08Å; P15-R17 VanDerWaalsContact C-N 3.33Å; P15-R17 PolarHBondContact O-N 3.17Å; R17-A20 PolarHBondContact O-N 2.95Å; R17-I21 WeakPolarHBondContact O-CG1 3.11Å; R17-I21 PolarHBondContact O-N 2.82Å; R17-I21 VanDerWaalsContact O-N 3.09Å
18	E	69.4	Low	61.7	Low	141 Å²	141	102 Å²	102	66%	0.659	55%	0.547	S	S	*	.	H	α-helix	trans	-64.9	-43	173	-73.9	177.8	177.8	0	0	111.3	K14 A20 I21 M22	K14-E18 PolarHBondContact O-N 3.22Å; E18-A20 VanDerWaalsContact C-N 3.31Å; E18-A20 PolarHBondContact O-N 2.9Å; E18-I21 PolarHBondContact O-N 3.5Å; E18-M22 WeakPolarHBondContact O-CG 3.39Å; E18-M22 PolarHBondContact O-N 3.47Å
19	A	66.9	Low	63.5	Low	29 Å²	29	97.5 Å²	97.5	24%	0.24	53%	0.525	C	S	.	.	H	α-helix	trans	-62.6	-37.6	175.4	0	0	0	0	0	112.3	P15 M22 S23 Y116	P15-A19 WeakPolarHBondContact O-CB 3.08Å; P15-A19 PolarHBondContact O-N 2.94Å; A19-M22 PolarHBondContact O-N 2.82Å; A19-S23 WeakPolarHBondContact O-CB 2.89Å; A19-S23 PolarHBondContact O-N 3.11Å; A19-Y116 HydrophobicContact CB-CD2 4.48Å; A19-Y116 HydrophobicContact CB-CG 4.42Å
20	A	67.8	Low	65.4	Low	20 Å²	20	103 Å²	103	17%	0.165	54%	0.541	C	S	.	.	H	α-helix	trans	-65.5	-38.8	174.3	0	0	0	0	0	112.9	D16 R17 E18 K24 Y116	D16-A20 VanDerWaalsContact O-CB 3.28Å; D16-A20 WeakPolarHBondContact O-CB 3.27Å; D16-A20 PolarHBondContact O-N 3.41Å; R17-A20 PolarHBondContact O-N 2.95Å; E18-A20 VanDerWaalsContact C-N 3.31Å; E18-A20 PolarHBondContact O-N 2.9Å; A20-K24 PolarHBondContact O-N 3.21Å; A20-Y116 HydrophobicContact CB-CD1 4.17Å; A20-Y116 HydrophobicContact CB-CD2 4.31Å; A20-Y116 HydrophobicContact CB-CE1 3.79Å; A20-Y116 HydrophobicContact CB-CE2 3.95Å; A20-Y116 HydrophobicContact CB-CG 4.41Å
21	I	72.4	Confident	67.5	Low	110 Å²	110	102.6 Å²	102.6	56%	0.564	53%	0.532	S	S	*	.	H	α-helix	trans	-66.6	-46.2	175.6	-67.8	164.6	0	0	0	110.3	R17 E18 S23 K24 Y25	R17-I21 WeakPolarHBondContact O-CG1 3.11Å; R17-I21 PolarHBondContact O-N 2.82Å; R17-I21 VanDerWaalsContact O-N 3.09Å; E18-I21 PolarHBondContact O-N 3.5Å; I21-S23 VanDerWaalsContact C-N 3.34Å; I21-S23 PolarHBondContact O-N 3.41Å; I21-K24 PolarHBondContact O-N 2.92Å; I21-Y25 PolarHBondContact O-N 2.87Å
22	M	68.9	Low	69.3	Low	106 Å²	106	102.4 Å²	102.4	52%	0.522	52%	0.522	S	S	.	.	H	α-helix	trans	-61.7	-41.2	176.7	-71.8	-70.5	-87.8	0	0	111.5	E18 A19 K24 Y25 Y26	E18-M22 WeakPolarHBondContact O-CG 3.39Å; E18-M22 PolarHBondContact O-N 3.47Å; A19-M22 PolarHBondContact O-N 2.82Å; M22-K24 VanDerWaalsContact C-N 3.29Å; M22-K24 PolarHBondContact O-N 2.92Å; M22-Y25 WeakPolarHBondContact O-CB 3.43Å; M22-Y25 PolarHBondContact O-N 3.14Å; M22-Y26 HydrophobicContact CE-CE2 4.14Å; M22-Y26 WeakPolarHBondContact O-CD2 3.48Å; M22-Y26 PolarHBondContact O-N 3.02Å
23	S	69.5	Low	71.3	Confident	14 Å²	14	108.6 Å²	108.6	10%	0.098	54%	0.536	C	S	.	.	H	α-helix	trans	-55.3	-44.2	176.1	-170.1	0	0	0	0	111.9	A19 I21 Y25 Y26 D27	A19-S23 WeakPolarHBondContact O-CB 2.89Å; A19-S23 PolarHBondContact O-N 3.11Å; I21-S23 VanDerWaalsContact C-N 3.34Å; I21-S23 PolarHBondContact O-N 3.41Å; S23-Y25 VanDerWaalsContact C-N 3.26Å; S23-Y25 PolarHBondContact O-N 3.3Å; S23-Y26 PolarHBondContact O-N 3.04Å; S23-Y26 VanDerWaalsContact O-N 3.12Å; S23-D27 VanDerWaalsContact O-CG 3.29Å; S23-D27 PolarHBondContact O-N 3.37Å
24	K	70.1	Confident	73.2	Confident	164 Å²	164	105 Å²	105	71%	0.713	52%	0.523	S	S	*	.	H	α-helix	trans	-63.7	-30.8	177.8	-69.8	-175.9	-179.8	-174	0	113.2	A20 I21 M22 Y26	A20-K24 PolarHBondContact O-N 3.21Å; I21-K24 PolarHBondContact O-N 2.92Å; M22-K24 VanDerWaalsContact C-N 3.29Å; M22-K24 PolarHBondContact O-N 2.92Å; K24-Y26 VanDerWaalsContact C-N 3.32Å
25	Y	69.4	Low	75	Confident	186 Å²	186	101.5 Å²	101.5	73%	0.729	51%	0.511	S	S	*	.	H	α-helix	trans	-68.1	-33.8	175.9	-161.9	-92.6	0	0	0	111.8	I21 M22 S23	I21-Y25 PolarHBondContact O-N 2.87Å; M22-Y25 WeakPolarHBondContact O-CB 3.43Å; M22-Y25 PolarHBondContact O-N 3.14Å; S23-Y25 VanDerWaalsContact C-N 3.26Å; S23-Y25 PolarHBondContact O-N 3.3Å
26	Y	69.1	Low	76.5	Confident	128 Å²	128	101.1 Å²	101.1	50%	0.502	50%	0.503	S	S	.	.	H	α-helix	trans	-92.7	-7	-179	-67.7	-72.8	0	0	0	114.5	M22 S23 K24 G28 V29	M22-Y26 HydrophobicContact CE-CE2 4.14Å; M22-Y26 WeakPolarHBondContact O-CD2 3.48Å; M22-Y26 PolarHBondContact O-N 3.02Å; S23-Y26 PolarHBondContact O-N 3.04Å; S23-Y26 VanDerWaalsContact O-N 3.12Å; K24-Y26 VanDerWaalsContact C-N 3.32Å; Y26-G28 PolarHBondContact O-N 2.68Å; Y26-V29 HydrophobicContact CD1-CG2 4.01Å; Y26-V29 PolarHBondContact O-N 3.04Å; Y26-V29 VanDerWaalsContact O-N 3.12Å
27	D	71.7	Confident	77.6	Confident	102 Å²	102	99.6 Å²	99.6	55%	0.545	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.3	-179	-80.4	-22.3	0	0	0	113.3	S23	S23-D27 VanDerWaalsContact O-CG 3.29Å; S23-D27 PolarHBondContact O-N 3.37Å
28	G	72.9	Confident	78.6	Confident	72 Å²	72	94 Å²	94	74%	0.742	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	2.6	176.9	0	0	0	0	0	115.3	Y26	Y26-G28 PolarHBondContact O-N 2.68Å
29	V	81.9	Confident	79.7	Confident	63 Å²	63	89.2 Å²	89.2	38%	0.382	46%	0.46	S	S	.	.			trans	-83.9	126.3	-179.1	178.5	0	0	0	0	110	Y26 F31	Y26-V29 HydrophobicContact CD1-CG2 4.01Å; Y26-V29 PolarHBondContact O-N 3.04Å; Y26-V29 VanDerWaalsContact O-N 3.12Å; V29-F31 HydrophobicContact CB-CE2 3.88Å; V29-F31 HydrophobicContact CB-CZ 4.1Å; V29-F31 HydrophobicContact CG1-CD2 4.36Å; V29-F31 HydrophobicContact CG1-CE1 4.19Å; V29-F31 HydrophobicContact CG1-CE2 3.76Å; V29-F31 HydrophobicContact CG1-CZ 3.67Å; V29-F31 WeakPolarHBondContact O-CD2 3.17Å; V29-F31 VanDerWaalsContact O-CE2 3.25Å; V29-F31 WeakPolarHBondContact O-CE2 3.48Å
30	E	85.1	Confident	81.1	Confident	173 Å²	173	88.1 Å²	88.1	81%	0.808	45%	0.45	S	S	*	.			trans	-82.5	138.9	174.9	-65.8	-171.9	171.6	0	0	111.5	P32	E30-P32 WeakPolarHBondContact O-CD 3.33Å
31	F	87.7	Confident	82.4	Confident	82 Å²	82	91.5 Å²	91.5	36%	0.36	46%	0.462	S	S	.	.			trans	-124.2	73	178.9	-63.7	-88.9	0	0	0	109.7	V29 F33 C34 R107	V29-F31 HydrophobicContact CB-CE2 3.88Å; V29-F31 HydrophobicContact CB-CZ 4.1Å; V29-F31 HydrophobicContact CG1-CD2 4.36Å; V29-F31 HydrophobicContact CG1-CE1 4.19Å; V29-F31 HydrophobicContact CG1-CE2 3.76Å; V29-F31 HydrophobicContact CG1-CZ 3.67Å; V29-F31 WeakPolarHBondContact O-CD2 3.17Å; V29-F31 VanDerWaalsContact O-CE2 3.25Å; V29-F31 WeakPolarHBondContact O-CE2 3.48Å; F31-F33 PolarHBondContact O-N 3.38Å; F31-C34 HydrophobicContact CB-CB 4.38Å; F31-C34 PolarHBondContact O-N 3.07Å; F31-C34 VanDerWaalsContact O-N 3.14Å; F31-R107 VanDerWaalsContact CD2-NH2 3.3Å
32	P	89.7	Confident	83.5	Confident	92 Å²	92	90.7 Å²	90.7	60%	0.597	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.3	-169.4	25.1	-35.1	0	0	0	114.7	E30	E30-P32 WeakPolarHBondContact O-CD 3.33Å
33	F	91.9	Very high	84.6	Confident	202 Å²	202	90.7 Å²	90.7	89%	0.886	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	7.7	-179.2	-51.9	-65.9	0	0	0	113.5	F31	F31-F33 PolarHBondContact O-N 3.38Å
34	C	91.4	Very high	85.7	Confident	32 Å²	32	92.2 Å²	92.2	22%	0.216	47%	0.468	C	S	.	.	S	Bend	trans	-141.3	86.5	-179.3	-171.7	0	0	0	0	109.9	F31 R107	F31-C34 HydrophobicContact CB-CB 4.38Å; F31-C34 PolarHBondContact O-N 3.07Å; F31-C34 VanDerWaalsContact O-N 3.14Å; C34-R107 PolarHBondContact O-NE 3.05Å
35	D	92	Very high	86.8	Confident	76 Å²	76	87.2 Å²	87.2	41%	0.406	45%	0.447	S	S	.	.			trans	-64.2	155.2	-176.4	-75.9	-15.7	0	0	0	112.5	K39 C106 R107	D35-K39 HydrophobicContact CB-CD 4.18Å; D35-K39 IonicContact OD2-NZ 3.36Å; D35-K39 PolarHBondContact OD2-NZ 2.88Å; D35-C106 VanDerWaalsContact O-CA 3.29Å; D35-C106 WeakPolarHBondContact O-CA 3.35Å; D35-C106 WeakPolarHBondContact O-CB 3.43Å; D35-R107 PolarHBondContact O-N 3.05Å
36	E	89.5	Confident	87.8	Confident	64 Å²	64	79.2 Å²	79.2	30%	0.299	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-75.6	143.5	174.4	-67.2	-172.6	-142.3	0	0	111.9	S38 K39 R107 K109	E36-S38 PolarHBondContact O-N 3.45Å; E36-K39 PolarHBondContact O-N 3.32Å; E36-R107 CarbonylContact C-O 3.57Å; E36-R107 WeakPolarHBondContact CA-O 3.5Å; E36-R107 IonicContact OE1-NH2 2.68Å; E36-K109 WeakPolarHBondContact OE1-CE 3.44Å; E36-K109 IonicContact OE1-NZ 3.45Å; E36-K109 PolarHBondContact OE1-NZ 3.38Å; E36-K109 WeakPolarHBondContact OE2-CE 3.26Å
37	F	85.5	Confident	88.5	Confident	44 Å²	44	73.7 Å²	73.7	19%	0.193	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-51.4	-24.9	174	171.8	-89.1	0	0	0	113.8	K39 Y40 K42 L68 R107 T108 Y121	F37-K39 PolarHBondContact O-N 2.74Å; F37-Y40 PolarHBondContact O-N 3.23Å; F37-K42 HydrophobicContact CZ-CB 4.08Å; F37-K42 HydrophobicContact CZ-CD 4.35Å; F37-L68 HydrophobicContact CD2-CD1 4.21Å; F37-L68 HydrophobicContact CE2-CD1 3.53Å; F37-L68 HydrophobicContact CZ-CD1 4.3Å; F37-R107 WeakPolarHBondContact CB-O 3.15Å; F37-R107 PolarHBondContact N-O 2.94Å; F37-T108 HydrophobicContact CB-CG2 3.73Å; F37-T108 HydrophobicContact CD1-CG2 4.47Å; F37-T108 HydrophobicContact CG-CG2 4.05Å; F37-Y121 HydrophobicContact CD2-CD1 4.37Å; F37-Y121 AromaticContact CD2-CD2 3.88Å; F37-Y121 HydrophobicContact CD2-CD2 3.88Å; F37-Y121 HydrophobicContact CD2-CE1 4.42Å; F37-Y121 AromaticContact CD2-CE2 3.97Å; F37-Y121 HydrophobicContact CD2-CE2 3.97Å; F37-Y121 HydrophobicContact CD2-CG 4.09Å; F37-Y121 HydrophobicContact CE2-CD1 4.31Å; F37-Y121 HydrophobicContact CE2-CD2 4.5Å; F37-Y121 HydrophobicContact CE2-CE1 4.11Å; F37-Y121 HydrophobicContact CE2-CE2 4.34Å; F37-Y121 HydrophobicContact CE2-CG 4.49Å
38	S	88.1	Confident	89	Confident	74 Å²	74	74.6 Å²	74.6	52%	0.517	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-57.3	-23.4	-174.6	55.3	0	0	0	0	114.2	E36 Y40 R60	E36-S38 PolarHBondContact O-N 3.45Å; S38-Y40 PolarHBondContact O-N 3.41Å; S38-R60 VanDerWaalsContact O-CD 3.26Å; S38-R60 WeakPolarHBondContact O-CD 3.39Å; S38-R60 PolarHBondContact O-NE 3.41Å
39	K	93	Very high	89	Confident	40 Å²	40	73.3 Å²	73.3	17%	0.174	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-67.9	-14.6	173.7	71.7	-177.2	176.1	174.7	0	114.3	D35 E36 F37 R60 E104	D35-K39 HydrophobicContact CB-CD 4.18Å; D35-K39 IonicContact OD2-NZ 3.36Å; D35-K39 PolarHBondContact OD2-NZ 2.88Å; E36-K39 PolarHBondContact O-N 3.32Å; F37-K39 PolarHBondContact O-N 2.74Å; K39-R60 WeakPolarHBondContact O-CB 3.2Å; K39-R60 WeakPolarHBondContact O-CG 3.47Å; K39-R60 PolarHBondContact O-N 3.18Å; K39-E104 VanDerWaalsContact CE-CD 3.48Å; K39-E104 WeakPolarHBondContact CE-OE1 3.32Å; K39-E104 VanDerWaalsContact CE-OE2 3.26Å; K39-E104 WeakPolarHBondContact CE-OE2 3.32Å; K39-E104 IonicContact NZ-OE1 2.91Å; K39-E104 PolarHBondContact NZ-OE1 2.97Å; K39-E104 IonicContact NZ-OE2 2.7Å; K39-E104 PolarHBondContact NZ-OE2 2.87Å
40	Y	96	Very high	88.3	Confident	7 Å²	7	76.2 Å²	76.2	3%	0.027	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	138	174.9	-64	-72.2	0	0	0	111.5	F37 S38 K58 H59 V66 L68 E104 V123	F37-Y40 PolarHBondContact O-N 3.23Å; S38-Y40 PolarHBondContact O-N 3.41Å; Y40-K58 WeakPolarHBondContact CA-O 3.25Å; Y40-H59 HydrophobicContact CD1-CB 4.03Å; Y40-H59 HydrophobicContact CE1-CB 3.78Å; Y40-H59 AromaticContact CE1-CD2 3.62Å; Y40-H59 AromaticContact CZ-CD2 3.88Å; Y40-V66 HydrophobicContact CD1-CG2 3.52Å; Y40-V66 HydrophobicContact CE1-CB 4.37Å; Y40-V66 HydrophobicContact CE1-CG1 3.94Å; Y40-V66 HydrophobicContact CE1-CG2 3.61Å; Y40-V66 HydrophobicContact CG-CG2 4.38Å; Y40-L68 HydrophobicContact CD2-CD2 4.33Å; Y40-L68 HydrophobicContact CG-CD2 4.37Å; Y40-E104 PolarHBondContact OH-OE1 3.46Å; Y40-V123 HydrophobicContact CE1-CG1 4.16Å; Y40-V123 HydrophobicContact CE2-CG1 4.09Å; Y40-V123 HydrophobicContact CE2-CG2 3.93Å
41	E	95.3	Very high	87.6	Confident	91 Å²	91	70.4 Å²	70.4	43%	0.425	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	111.2	169.2	-173.4	-175.7	175.6	0	0	109	A57 K58 R60	E41-A57 CarbonylContact O-C 3.47Å; E41-A57 WeakPolarHBondContact O-CA 2.99Å; E41-A57 VanDerWaalsContact O-CB 3.26Å; E41-A57 WeakPolarHBondContact O-CB 3.41Å; E41-K58 PolarHBondContact N-O 3.13Å; E41-K58 PolarHBondContact O-N 2.72Å; E41-R60 HydrophobicContact CB-CG 4.21Å
42	K	94.1	Very high	87.2	Confident	92 Å²	92	66.7 Å²	66.7	40%	0.4	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	128.2	177.4	-167	-177.9	-174.2	-178.8	0	109.9	F37 F55	F37-K42 HydrophobicContact CZ-CB 4.08Å; F37-K42 HydrophobicContact CZ-CD 4.35Å; K42-F55 HydrophobicContact CD-CD1 4.25Å; K42-F55 HydrophobicContact CD-CG 4.3Å; K42-F55 HydrophobicContact CG-CB 4.1Å; K42-F55 HydrophobicContact CG-CD1 4.4Å; K42-F55 HydrophobicContact CG-CG 4.32Å
43	M	93.4	Very high	87.3	Confident	106 Å²	106	64.6 Å²	64.6	52%	0.522	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	-64.3	-176.4	-58.5	179.4	74.7	0	0	111.9	K56 K58	M43-K56 WeakPolarHBondContact CB-O 3.41Å; M43-K56 PolarHBondContact N-O 3.03Å; M43-K56 HydrophobicContact SD-CG 4.29Å; M43-K58 HydrophobicContact SD-CB 4.09Å
44	A	92.7	Very high	87.3	Confident	47 Å²	47	56.7 Å²	56.7	39%	0.388	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	148.9	-172	0	0	0	0	0	111.1	F55 K56	A44-F55 CarbonylContact O-C 3.56Å; A44-F55 VanDerWaalsContact O-CA 3.26Å; A44-F55 WeakPolarHBondContact O-CA 3.1Å; A44-K56 PolarHBondContact N-O 3.41Å; A44-K56 PolarHBondContact O-N 3.43Å
45	K	92.1	Very high	87.5	Confident	59 Å²	59	55.7 Å²	55.7	26%	0.257	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.4	168.3	-167.9	174.3	175.6	174.1	0	108.6	E53 F55 Y360	K45-E53 WeakPolarHBondContact CE-OE1 3.09Å; K45-E53 IonicContact NZ-OE1 2.64Å; K45-E53 PolarHBondContact NZ-OE1 2.92Å; K45-F55 HydrophobicContact CB-CD1 3.72Å; K45-F55 HydrophobicContact CB-CE1 3.69Å; K45-F55 HydrophobicContact CD-CE1 3.96Å; K45-F55 HydrophobicContact CD-CZ 4.44Å; K45-F55 HydrophobicContact CG-CD1 3.94Å; K45-F55 HydrophobicContact CG-CE1 3.66Å; K45-F55 HydrophobicContact CG-CZ 4.38Å; K45-Y360 WeakPolarHBondContact CE-OH 3.32Å; K45-Y360 HydrophobicContact CG-CE1 4.3Å
46	I	89.9	Confident	87.6	Confident	17 Å²	17	53.8 Å²	53.8	9%	0.087	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	-9.3	-175.6	61.8	176.5	0	0	0	112.9	V54 K56 A67 F126 F358 Y360	I46-V54 HydrophobicContact CD1-CG1 3.88Å; I46-V54 HydrophobicContact CG1-CB 4.11Å; I46-V54 HydrophobicContact CG1-CG1 3.75Å; I46-V54 PolarHBondContact N-O 3.19Å; I46-K56 HydrophobicContact CD1-CB 4.3Å; I46-K56 HydrophobicContact CG2-CB 3.77Å; I46-A67 HydrophobicContact CD1-CB 4.41Å; I46-F126 HydrophobicContact CD1-CD2 4.31Å; I46-F126 HydrophobicContact CD1-CE2 3.75Å; I46-F358 HydrophobicContact CB-CD2 4.06Å; I46-F358 HydrophobicContact CB-CE2 4.04Å; I46-F358 HydrophobicContact CD1-CE2 4.46Å; I46-F358 HydrophobicContact CD1-CZ 4.29Å; I46-F358 HydrophobicContact CG2-CD2 4.2Å; I46-F358 HydrophobicContact CG2-CE2 3.94Å; I46-Y360 WeakPolarHBondContact O-CB 3.5Å
47	G	85.1	Confident	88	Confident	13 Å²	13	50.8 Å²	50.8	13%	0.134	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	155.8	176.2	0	0	0	0	0	112.5	V54	G47-V54 PolarHBondContact N-O 3.32Å; G47-V54 PolarHBondContact O-N 3.45Å
48	Q	82.4	Confident	88.5	Confident	120 Å²	120	52.8 Å²	52.8	56%	0.561	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.4	126.6	169.2	-178	174.5	-10.5	0	0	108.4	E53 Y360	Q48-E53 HydrophobicContact CG-CG 4.49Å; Q48-Y360 HydrophobicContact CB-CE2 3.9Å
49	G	71.4	Confident	88.9	Confident	46 Å²	46	50.5 Å²	50.5	47%	0.474	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	-175	177.8	0	0	0	0	0	111.6	F51 G52	G49-F51 PolarHBondContact O-N 3.28Å; G49-G52 PolarHBondContact N-O 2.87Å; G49-G52 PolarHBondContact O-N 2.96Å
50	T	68.5	Low	89.1	Confident	124 Å²	124	55.6 Å²	55.6	76%	0.761	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-29	-179.5	-48.7	0	0	0	0	112.9
51	F	69.6	Low	89	Confident	51 Å²	51	63.6 Å²	63.6	22%	0.224	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-0.2	-173.3	-56.5	-71.1	0	0	0	114.6	G49 L191	G49-F51 PolarHBondContact O-N 3.28Å; F51-L191 HydrophobicContact CE1-CD2 4.16Å; F51-L191 HydrophobicContact CE2-CD1 4.03Å; F51-L191 HydrophobicContact CE2-CD2 4.03Å; F51-L191 HydrophobicContact CE2-CG 3.6Å; F51-L191 HydrophobicContact CZ-CD1 4.14Å; F51-L191 HydrophobicContact CZ-CD2 3.38Å; F51-L191 HydrophobicContact CZ-CG 3.52Å
52	G	80.6	Confident	89	Confident	4 Å²	4	64.1 Å²	64.1	4%	0.041	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	164.7	-174.5	0	0	0	0	0	116.1	G49 K70	G49-G52 PolarHBondContact N-O 2.87Å; G49-G52 PolarHBondContact O-N 2.96Å; G52-K70 VanDerWaalsContact CA-O 3.28Å; G52-K70 WeakPolarHBondContact CA-O 3.37Å
53	E	90.1	Very high	89.1	Confident	47 Å²	47	61 Å²	61	22%	0.22	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	136.7	161.9	-59.2	-173.6	118.3	0	0	108.9	K45 Q48 F55 K69 K70	K45-E53 WeakPolarHBondContact CE-OE1 3.09Å; K45-E53 IonicContact NZ-OE1 2.64Å; K45-E53 PolarHBondContact NZ-OE1 2.92Å; Q48-E53 HydrophobicContact CG-CG 4.49Å; E53-F55 HydrophobicContact CB-CD2 4.43Å; E53-F55 HydrophobicContact CB-CE2 3.53Å; E53-F55 HydrophobicContact CB-CZ 3.72Å; E53-F55 HydrophobicContact CG-CZ 4.5Å; E53-F55 WeakPolarHBondContact OE2-CZ 3.43Å; E53-K69 WeakPolarHBondContact O-CA 3.38Å; E53-K70 PolarHBondContact O-N 2.88Å
54	V	93.3	Very high	89.2	Confident	37 Å²	37	60.9 Å²	60.9	22%	0.224	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.1	179.8	-169.3	0	0	0	0	109.5	I46 G47 A67 L68 K69	I46-V54 HydrophobicContact CD1-CG1 3.88Å; I46-V54 HydrophobicContact CG1-CB 4.11Å; I46-V54 HydrophobicContact CG1-CG1 3.75Å; I46-V54 PolarHBondContact N-O 3.19Å; G47-V54 PolarHBondContact N-O 3.32Å; G47-V54 PolarHBondContact O-N 3.45Å; V54-A67 HydrophobicContact CG1-CB 4.3Å; V54-L68 CarbonylContact C-O 3.58Å; V54-L68 WeakPolarHBondContact CA-O 3.18Å; V54-K69 HydrophobicContact CG2-CB 4.36Å; V54-K69 HydrophobicContact CG2-CG 4.2Å
55	F	94.3	Very high	89.3	Confident	11 Å²	11	63.3 Å²	63.3	5%	0.048	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	137.2	-179.8	-56.8	-84.3	0	0	0	111	K42 A44 K45 E53 A67 L68	K42-F55 HydrophobicContact CD-CD1 4.25Å; K42-F55 HydrophobicContact CD-CG 4.3Å; K42-F55 HydrophobicContact CG-CB 4.1Å; K42-F55 HydrophobicContact CG-CD1 4.4Å; K42-F55 HydrophobicContact CG-CG 4.32Å; A44-F55 CarbonylContact O-C 3.56Å; A44-F55 VanDerWaalsContact O-CA 3.26Å; A44-F55 WeakPolarHBondContact O-CA 3.1Å; K45-F55 HydrophobicContact CB-CD1 3.72Å; K45-F55 HydrophobicContact CB-CE1 3.69Å; K45-F55 HydrophobicContact CD-CE1 3.96Å; K45-F55 HydrophobicContact CD-CZ 4.44Å; K45-F55 HydrophobicContact CG-CD1 3.94Å; K45-F55 HydrophobicContact CG-CE1 3.66Å; K45-F55 HydrophobicContact CG-CZ 4.38Å; E53-F55 HydrophobicContact CB-CD2 4.43Å; E53-F55 HydrophobicContact CB-CE2 3.53Å; E53-F55 HydrophobicContact CB-CZ 3.72Å; E53-F55 HydrophobicContact CG-CZ 4.5Å; E53-F55 WeakPolarHBondContact OE2-CZ 3.43Å; F55-A67 CarbonylContact O-C 3.49Å; F55-A67 WeakPolarHBondContact O-CA 3.26Å; F55-L68 HydrophobicContact CB-CB 4.44Å; F55-L68 PolarHBondContact N-O 3.36Å; F55-L68 PolarHBondContact O-N 3.16Å
56	K	95.4	Very high	89.6	Confident	36 Å²	36	60.6 Å²	60.6	16%	0.157	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	134	162.1	-178.2	176.5	-174.7	172.4	0	108.8	M43 A44 I46 F126	M43-K56 WeakPolarHBondContact CB-O 3.41Å; M43-K56 PolarHBondContact N-O 3.03Å; M43-K56 HydrophobicContact SD-CG 4.29Å; A44-K56 PolarHBondContact N-O 3.41Å; A44-K56 PolarHBondContact O-N 3.43Å; I46-K56 HydrophobicContact CD1-CB 4.3Å; I46-K56 HydrophobicContact CG2-CB 3.77Å; K56-F126 HydrophobicContact CB-CD2 4.46Å; K56-F126 HydrophobicContact CB-CE2 3.95Å; K56-F126 HydrophobicContact CD-CE1 4.31Å; K56-F126 HydrophobicContact CD-CE2 3.83Å; K56-F126 HydrophobicContact CD-CZ 3.67Å; K56-F126 HydrophobicContact CG-CD2 4.08Å; K56-F126 HydrophobicContact CG-CE2 3.7Å; K56-F126 HydrophobicContact CG-CZ 4.06Å
57	A	96.6	Very high	89.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	170.2	175.3	0	0	0	0	0	111.4	E41 K65 V66 L68	E41-A57 CarbonylContact O-C 3.47Å; E41-A57 WeakPolarHBondContact O-CA 2.99Å; E41-A57 VanDerWaalsContact O-CB 3.26Å; E41-A57 WeakPolarHBondContact O-CB 3.41Å; A57-K65 WeakPolarHBondContact O-CA 3.5Å; A57-V66 HydrophobicContact CB-CG2 3.89Å; A57-V66 PolarHBondContact N-O 2.77Å; A57-V66 PolarHBondContact O-N 3.29Å; A57-L68 HydrophobicContact CB-CD1 3.34Å; A57-L68 HydrophobicContact CB-CG 3.71Å
58	K	97	Very high	90.4	Very high	86 Å²	86	59.8 Å²	59.8	37%	0.374	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.6	177.7	-174	178.9	175.1	-175.4	0	109.2	Y40 E41 M43 R60 G63 K64	Y40-K58 WeakPolarHBondContact CA-O 3.25Å; E41-K58 PolarHBondContact N-O 3.13Å; E41-K58 PolarHBondContact O-N 2.72Å; M43-K58 HydrophobicContact SD-CB 4.09Å; K58-R60 PolarHBondContact O-N 2.77Å; K58-G63 WeakPolarHBondContact CE-O 3.43Å; K58-G63 WeakPolarHBondContact CG-O 3.33Å; K58-K64 CarbonylContact C-O 3.6Å; K58-K64 WeakPolarHBondContact CA-O 3.17Å
59	H	96.6	Very high	91	Very high	27 Å²	27	54.8 Å²	54.8	13%	0.125	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	126.9	170.9	-172.8	-76.1	0	0	0	109.2	Y40 Q61 T62 G63 K64	Y40-H59 HydrophobicContact CD1-CB 4.03Å; Y40-H59 HydrophobicContact CE1-CB 3.78Å; Y40-H59 AromaticContact CE1-CD2 3.62Å; Y40-H59 AromaticContact CZ-CD2 3.88Å; H59-Q61 PolarHBondContact ND1-N 3.39Å; H59-Q61 PolarHBondContact O-N 2.81Å; H59-T62 WeakPolarHBondContact CB-OG1 3.4Å; H59-T62 PolarHBondContact ND1-N 3.47Å; H59-T62 PolarHBondContact ND1-OG1 3.08Å; H59-G63 WeakPolarHBondContact O-CA 3.44Å; H59-G63 PolarHBondContact O-N 3.3Å; H59-K64 HydrophobicContact CB-CB 4.48Å; H59-K64 PolarHBondContact N-O 3.38Å
60	R	96.1	Very high	92	Very high	146 Å²	146	54.7 Å²	54.7	55%	0.551	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-40	-169.5	-71.6	-178.3	-177.2	-76.3	-0.9	113.5	S38 K39 E41 K58	S38-R60 VanDerWaalsContact O-CD 3.26Å; S38-R60 WeakPolarHBondContact O-CD 3.39Å; S38-R60 PolarHBondContact O-NE 3.41Å; K39-R60 WeakPolarHBondContact O-CB 3.2Å; K39-R60 WeakPolarHBondContact O-CG 3.47Å; K39-R60 PolarHBondContact O-N 3.18Å; E41-R60 HydrophobicContact CB-CG 4.21Å; K58-R60 PolarHBondContact O-N 2.77Å
61	Q	94.9	Very high	93	Very high	175 Å²	175	49.2 Å²	49.2	82%	0.818	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-58	-177.3	-57.7	174.5	1.9	0	0	112.3	H59 G63	H59-Q61 PolarHBondContact ND1-N 3.39Å; H59-Q61 PolarHBondContact O-N 2.81Å; Q61-G63 VanDerWaalsContact C-N 3.33Å; Q61-G63 PolarHBondContact O-N 3.08Å
62	T	95.8	Very high	93.7	Very high	102 Å²	102	49.5 Å²	49.5	63%	0.626	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-17.4	-176.7	63.8	0	0	0	0	114.5	H59 K64	H59-T62 WeakPolarHBondContact CB-OG1 3.4Å; H59-T62 PolarHBondContact ND1-N 3.47Å; H59-T62 PolarHBondContact ND1-OG1 3.08Å; T62-K64 PolarHBondContact O-N 2.88Å; T62-K64 WeakPolarHBondContact OG1-CB 3.49Å; T62-K64 PolarHBondContact OG1-N 2.88Å
63	G	94.8	Very high	93.6	Very high	28 Å²	28	52.7 Å²	52.7	29%	0.289	26%	0.256	S	S	.	.			trans	68.5	6.2	-173.4	0	0	0	0	0	115.4	K58 H59 Q61 K65	K58-G63 WeakPolarHBondContact CE-O 3.43Å; K58-G63 WeakPolarHBondContact CG-O 3.33Å; H59-G63 WeakPolarHBondContact O-CA 3.44Å; H59-G63 PolarHBondContact O-N 3.3Å; Q61-G63 VanDerWaalsContact C-N 3.33Å; Q61-G63 PolarHBondContact O-N 3.08Å; G63-K65 PolarHBondContact O-N 2.92Å
64	K	95.2	Very high	92.6	Very high	103 Å²	103	58.2 Å²	58.2	45%	0.448	28%	0.282	S	S	.	.			trans	-63.5	131.4	179	-174	176.3	177.2	-174.4	0	110.6	K58 H59 T62 D125	K58-K64 CarbonylContact C-O 3.6Å; K58-K64 WeakPolarHBondContact CA-O 3.17Å; H59-K64 HydrophobicContact CB-CB 4.48Å; H59-K64 PolarHBondContact N-O 3.38Å; T62-K64 PolarHBondContact O-N 2.88Å; T62-K64 WeakPolarHBondContact OG1-CB 3.49Å; T62-K64 PolarHBondContact OG1-N 2.88Å; K64-D125 WeakPolarHBondContact CE-OD1 3.2Å; K64-D125 IonicContact NZ-OD1 2.73Å; K64-D125 PolarHBondContact NZ-OD1 3.25Å
65	K	96.6	Very high	91.2	Very high	98 Å²	98	64 Å²	64	43%	0.426	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.8	174	-68	175.1	-176.5	162.9	0	110	A57 G63 F126	A57-K65 WeakPolarHBondContact O-CA 3.5Å; G63-K65 PolarHBondContact O-N 2.92Å; K65-F126 HydrophobicContact CB-CB 3.92Å; K65-F126 HydrophobicContact CB-CD1 4.17Å; K65-F126 HydrophobicContact CB-CG 4.21Å; K65-F126 HydrophobicContact CD-CD1 4.27Å
66	V	97.1	Very high	89.8	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.006	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	159.9	178.1	-59.9	0	0	0	0	110.5	Y40 A57 L68 I103 V123 F124	Y40-V66 HydrophobicContact CD1-CG2 3.52Å; Y40-V66 HydrophobicContact CE1-CB 4.37Å; Y40-V66 HydrophobicContact CE1-CG1 3.94Å; Y40-V66 HydrophobicContact CE1-CG2 3.61Å; Y40-V66 HydrophobicContact CG-CG2 4.38Å; A57-V66 HydrophobicContact CB-CG2 3.89Å; A57-V66 PolarHBondContact N-O 2.77Å; A57-V66 PolarHBondContact O-N 3.29Å; V66-L68 HydrophobicContact CG2-CD2 3.97Å; V66-L68 HydrophobicContact CG2-CG 4.28Å; V66-I103 HydrophobicContact CG1-CD1 3.83Å; V66-V123 HydrophobicContact CB-CG1 3.86Å; V66-V123 HydrophobicContact CG1-CG1 4.04Å; V66-V123 HydrophobicContact CG2-CG1 4.02Å; V66-F124 CarbonylContact C-O 3.56Å; V66-F124 VanDerWaalsContact CA-O 3.26Å; V66-F124 WeakPolarHBondContact CA-O 3.45Å; V66-F124 VanDerWaalsContact CB-O 3.3Å; V66-F124 WeakPolarHBondContact CB-O 3.13Å
67	A	96.9	Very high	88.7	Confident	12 Å²	12	75.4 Å²	75.4	10%	0.099	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.2	165.8	0	0	0	0	0	109.7	I46 V54 F55 V123 F124 F126	I46-A67 HydrophobicContact CD1-CB 4.41Å; V54-A67 HydrophobicContact CG1-CB 4.3Å; F55-A67 CarbonylContact O-C 3.49Å; F55-A67 WeakPolarHBondContact O-CA 3.26Å; A67-V123 WeakPolarHBondContact O-CA 3.41Å; A67-F124 HydrophobicContact CB-CB 4.32Å; A67-F124 PolarHBondContact N-O 3.49Å; A67-F124 PolarHBondContact O-N 2.96Å; A67-F126 HydrophobicContact CB-CD2 4.32Å
68	L	95.3	Very high	87.7	Confident	1 Å²	1	84.3 Å²	84.3	1%	0.005	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	111	-180	-58.3	-179.8	0	0	0	109	F37 Y40 V54 F55 A57 V66 Y121 L122 V123	F37-L68 HydrophobicContact CD2-CD1 4.21Å; F37-L68 HydrophobicContact CE2-CD1 3.53Å; F37-L68 HydrophobicContact CZ-CD1 4.3Å; Y40-L68 HydrophobicContact CD2-CD2 4.33Å; Y40-L68 HydrophobicContact CG-CD2 4.37Å; V54-L68 CarbonylContact C-O 3.58Å; V54-L68 WeakPolarHBondContact CA-O 3.18Å; F55-L68 HydrophobicContact CB-CB 4.44Å; F55-L68 PolarHBondContact N-O 3.36Å; F55-L68 PolarHBondContact O-N 3.16Å; A57-L68 HydrophobicContact CB-CD1 3.34Å; A57-L68 HydrophobicContact CB-CG 3.71Å; V66-L68 HydrophobicContact CG2-CD2 3.97Å; V66-L68 HydrophobicContact CG2-CG 4.28Å; L68-Y121 HydrophobicContact CB-CD1 4.12Å; L68-L122 WeakPolarHBondContact CA-O 3.47Å; L68-V123 HydrophobicContact CD2-CB 4.13Å; L68-V123 HydrophobicContact CD2-CG1 3.86Å; L68-V123 HydrophobicContact CD2-CG2 3.66Å
69	K	94.8	Very high	87	Confident	16 Å²	16	82.1 Å²	82.1	7%	0.07	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	111.8	173.3	-175.2	175.7	174.8	-175.1	0	108.9	E53 V54 E87 Y121 L122 F124 D188	E53-K69 WeakPolarHBondContact O-CA 3.38Å; V54-K69 HydrophobicContact CG2-CB 4.36Å; V54-K69 HydrophobicContact CG2-CG 4.2Å; K69-E87 IonicContact NZ-OE1 2.66Å; K69-E87 PolarHBondContact NZ-OE1 2.95Å; K69-E87 IonicContact NZ-OE2 3.67Å; K69-E87 PolarHBondContact NZ-OE2 2.96Å; K69-Y121 WeakPolarHBondContact O-CA 3.37Å; K69-L122 HydrophobicContact CB-CB 4.36Å; K69-L122 PolarHBondContact N-O 3.44Å; K69-L122 PolarHBondContact O-N 3.46Å; K69-F124 HydrophobicContact CB-CD2 4.48Å; K69-F124 HydrophobicContact CB-CE2 3.84Å; K69-F124 HydrophobicContact CD-CE2 4.41Å; K69-D188 IonicContact NZ-OD1 2.65Å; K69-D188 PolarHBondContact NZ-OD1 3.23Å
70	K	92.8	Very high	86.5	Confident	44 Å²	44	84 Å²	84	19%	0.191	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125	175	-170.2	-172.8	179.2	-169	0	109.3	G52 E53 S119 Y121	G52-K70 VanDerWaalsContact CA-O 3.28Å; G52-K70 WeakPolarHBondContact CA-O 3.37Å; E53-K70 PolarHBondContact O-N 2.88Å; K70-S119 VanDerWaalsContact CE-OG 3.32Å; K70-S119 WeakPolarHBondContact CE-OG 3.37Å; K70-Y121 HydrophobicContact CB-CD1 3.94Å; K70-Y121 HydrophobicContact CB-CE1 3.55Å; K70-Y121 HydrophobicContact CD-CE1 4.34Å; K70-Y121 HydrophobicContact CG-CD1 4.35Å; K70-Y121 HydrophobicContact CG-CE1 3.76Å; K70-Y121 HydrophobicContact CG-CE2 4.43Å
71	V	89.7	Confident	86.1	Confident	9 Å²	9	77.2 Å²	77.2	6%	0.055	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	124.3	172	-178	0	0	0	0	108.9	M73 F80 P81 A84 I120 L122	V71-M73 HydrophobicContact CG1-SD 4.2Å; V71-F80 HydrophobicContact CG1-CE2 4.14Å; V71-F80 HydrophobicContact CG1-CZ 4.12Å; V71-F80 HydrophobicContact CG2-CZ 4.45Å; V71-P81 HydrophobicContact CG1-CG 3.95Å; V71-A84 HydrophobicContact CG1-CB 3.71Å; V71-A84 HydrophobicContact CG2-CB 4.46Å; V71-I120 HydrophobicContact CB-CB 4.39Å; V71-I120 HydrophobicContact CG2-CB 4.32Å; V71-I120 HydrophobicContact CG2-CG2 4.16Å; V71-I120 PolarHBondContact N-O 3.16Å; V71-L122 HydrophobicContact CG2-CG 4.24Å
72	L	84.1	Confident	85.7	Confident	57 Å²	57	74.3 Å²	74.3	30%	0.298	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-82.2	126.9	178.2	-60.9	175	0	0	0	110.3	P81	L72-P81 WeakPolarHBondContact O-CG 3.11Å
73	M	78.3	Confident	85.4	Confident	70 Å²	70	71.5 Å²	71.5	35%	0.345	36%	0.36	S	S	.	.			trans	-114.6	2.8	-178.7	-56.5	-72.2	-64.6	0	0	112.3	V71 N75 G79 F80 P81	V71-M73 HydrophobicContact CG1-SD 4.2Å; M73-N75 PolarHBondContact O-N 3.49Å; M73-G79 WeakPolarHBondContact CE-O 3.27Å; M73-F80 HydrophobicContact CE-CB 4.34Å; M73-F80 HydrophobicContact CE-CD2 4.01Å; M73-F80 HydrophobicContact SD-CD2 3.8Å; M73-F80 HydrophobicContact SD-CE2 4.23Å; M73-P81 WeakPolarHBondContact SD-CD 3.3Å; M73-P81 HydrophobicContact SD-CG 4.03Å
74	E	68.8	Low	85.2	Confident	163 Å²	163	70.5 Å²	70.5	76%	0.762	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-29.7	-166.2	-69	176.9	-176.5	0	0	113.9
75	N	64.9	Low	85.1	Confident	159 Å²	159	70.1 Å²	70.1	85%	0.85	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	3.5	-177.9	-67.8	-25.3	0	0	0	113.6	M73	M73-N75 PolarHBondContact O-N 3.49Å
76	E	64.9	Low	84.9	Confident	79 Å²	79	68.3 Å²	68.3	37%	0.369	34%	0.342	S	S	.	.			trans	-86.6	119.4	-175	-76.6	-64.7	167.3	0	0	111.8	G79 P81	E76-G79 VanDerWaalsContact CB-O 3.22Å; E76-G79 WeakPolarHBondContact CB-O 3.25Å; E76-P81 HydrophobicContact CG-CB 4.07Å; E76-P81 HydrophobicContact CG-CG 3.69Å; E76-P81 WeakPolarHBondContact OE1-CB 3.31Å
77	K	71.1	Confident	84.8	Confident	208 Å²	208	68.7 Å²	68.7	90%	0.904	34%	0.344	S	S	*	.	S	Bend	trans	-91.2	-19.4	173.1	-64.3	-176.2	-179.3	-179	0	112.4
78	E	75.8	Confident	84.7	Confident	186 Å²	186	69 Å²	69	87%	0.869	34%	0.343	S	S	*	.	S	Bend	trans	-106.3	21.1	-173.9	-56.5	-155	148.9	0	0	113.1
79	G	83.8	Confident	84.8	Confident	40 Å²	40	76.5 Å²	76.5	41%	0.412	38%	0.376	S	S	.	.	S	Bend	trans	89.5	-125.2	178.1	0	0	0	0	0	112.9	M73 E76	M73-G79 WeakPolarHBondContact CE-O 3.27Å; E76-G79 VanDerWaalsContact CB-O 3.22Å; E76-G79 WeakPolarHBondContact CB-O 3.25Å
80	F	85.6	Confident	84.9	Confident	66 Å²	66	76.1 Å²	76.1	29%	0.289	38%	0.375	S	S	.	.	S	Bend	trans	-80.2	130.1	-175.3	-169.2	-89.2	0	0	0	111.3	V71 M73 I82 A84 L85 I88 I120	V71-F80 HydrophobicContact CG1-CE2 4.14Å; V71-F80 HydrophobicContact CG1-CZ 4.12Å; V71-F80 HydrophobicContact CG2-CZ 4.45Å; M73-F80 HydrophobicContact CE-CB 4.34Å; M73-F80 HydrophobicContact CE-CD2 4.01Å; M73-F80 HydrophobicContact SD-CD2 3.8Å; M73-F80 HydrophobicContact SD-CE2 4.23Å; F80-I82 PolarHBondContact O-N 2.92Å; F80-A84 HydrophobicContact CD1-CB 4.41Å; F80-A84 HydrophobicContact CE1-CB 3.58Å; F80-A84 HydrophobicContact CZ-CB 3.88Å; F80-L85 HydrophobicContact CD1-CD1 4.41Å; F80-L85 HydrophobicContact CD1-CD2 3.53Å; F80-L85 HydrophobicContact CD1-CG 3.62Å; F80-L85 HydrophobicContact CE1-CD2 3.65Å; F80-L85 HydrophobicContact CE1-CG 3.91Å; F80-I88 HydrophobicContact CE1-CD1 4.07Å; F80-I88 HydrophobicContact CZ-CD1 4.01Å; F80-I120 HydrophobicContact CE2-CB 4.1Å; F80-I120 HydrophobicContact CE2-CG1 3.92Å; F80-I120 HydrophobicContact CE2-CG2 4.23Å; F80-I120 HydrophobicContact CZ-CG2 4.45Å
81	P	87.1	Confident	85.2	Confident	4 Å²	4	74 Å²	74	3%	0.026	37%	0.366	C	S	.	.			trans	-56.2	127.4	-171.8	-16.7	16.9	0	0	0	113.1	V71 L72 M73 E76 T83 A84 L85	V71-P81 HydrophobicContact CG1-CG 3.95Å; L72-P81 WeakPolarHBondContact O-CG 3.11Å; M73-P81 WeakPolarHBondContact SD-CD 3.3Å; M73-P81 HydrophobicContact SD-CG 4.03Å; E76-P81 HydrophobicContact CG-CB 4.07Å; E76-P81 HydrophobicContact CG-CG 3.69Å; E76-P81 WeakPolarHBondContact OE1-CB 3.31Å; P81-T83 PolarHBondContact O-N 3.49Å; P81-A84 HydrophobicContact CB-CB 3.97Å; P81-A84 HydrophobicContact CG-CB 4.22Å; P81-A84 WeakPolarHBondContact O-CB 3.49Å; P81-A84 PolarHBondContact O-N 3.04Å; P81-L85 PolarHBondContact O-N 3.41Å
82	I	87.7	Confident	85.5	Confident	115 Å²	115	79.4 Å²	79.4	59%	0.59	39%	0.39	S	S	*	.	H	α-helix	trans	-60.5	-29.5	175.2	-168.7	169.4	0	0	0	112.2	F80 R86	F80-I82 PolarHBondContact O-N 2.92Å; I82-R86 WeakPolarHBondContact O-CB 3.3Å; I82-R86 PolarHBondContact O-N 3.33Å; I82-R86 VanDerWaalsContact O-N 3.09Å
83	T	88	Confident	86.1	Confident	43 Å²	43	81.2 Å²	81.2	26%	0.264	40%	0.4	S	S	.	.	H	α-helix	trans	-64.1	-44.1	173.7	47.7	0	0	0	0	111.2	P81 R86 E87	P81-T83 PolarHBondContact O-N 3.49Å; T83-R86 PolarHBondContact O-N 3.04Å; T83-E87 WeakPolarHBondContact O-CB 3.32Å; T83-E87 PolarHBondContact O-N 3.46Å
84	A	90.7	Very high	87.1	Confident	6 Å²	6	78 Å²	78	5%	0.05	38%	0.384	C	S	.	.	H	α-helix	trans	-67.3	-41.4	177	0	0	0	0	0	112.1	V71 F80 P81 R86 E87 I88	V71-A84 HydrophobicContact CG1-CB 3.71Å; V71-A84 HydrophobicContact CG2-CB 4.46Å; F80-A84 HydrophobicContact CD1-CB 4.41Å; F80-A84 HydrophobicContact CE1-CB 3.58Å; F80-A84 HydrophobicContact CZ-CB 3.88Å; P81-A84 HydrophobicContact CB-CB 3.97Å; P81-A84 HydrophobicContact CG-CB 4.22Å; P81-A84 WeakPolarHBondContact O-CB 3.49Å; P81-A84 PolarHBondContact O-N 3.04Å; A84-R86 VanDerWaalsContact C-N 3.29Å; A84-R86 PolarHBondContact O-N 3.04Å; A84-E87 PolarHBondContact O-N 3.41Å; A84-I88 WeakPolarHBondContact O-CB 3.17Å; A84-I88 WeakPolarHBondContact O-CD1 3.49Å; A84-I88 VanDerWaalsContact O-CG1 3.28Å; A84-I88 WeakPolarHBondContact O-CG1 3.43Å; A84-I88 PolarHBondContact O-N 2.93Å
85	L	92.5	Very high	88.4	Confident	96 Å²	96	75 Å²	75	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-58.6	-43	174.1	-68.9	175.4	0	0	0	111.9	F80 P81 K89	F80-L85 HydrophobicContact CD1-CD1 4.41Å; F80-L85 HydrophobicContact CD1-CD2 3.53Å; F80-L85 HydrophobicContact CD1-CG 3.62Å; F80-L85 HydrophobicContact CE1-CD2 3.65Å; F80-L85 HydrophobicContact CE1-CG 3.91Å; P81-L85 PolarHBondContact O-N 3.41Å; L85-K89 WeakPolarHBondContact O-CB 3.09Å; L85-K89 PolarHBondContact O-N 3.34Å
86	R	93.3	Very high	90.1	Very high	60 Å²	60	70.5 Å²	70.5	23%	0.226	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-45.9	178	-171.1	-172.7	-61.8	140.9	12.3	111.2	I82 T83 A84 K89 I90 A192 R193	I82-R86 WeakPolarHBondContact O-CB 3.3Å; I82-R86 PolarHBondContact O-N 3.33Å; I82-R86 VanDerWaalsContact O-N 3.09Å; T83-R86 PolarHBondContact O-N 3.04Å; A84-R86 VanDerWaalsContact C-N 3.29Å; A84-R86 PolarHBondContact O-N 3.04Å; R86-K89 PolarHBondContact O-N 2.95Å; R86-I90 HydrophobicContact CG-CD1 3.79Å; R86-I90 HydrophobicContact CG-CG1 4.43Å; R86-I90 WeakPolarHBondContact O-CB 3.2Å; R86-I90 VanDerWaalsContact O-CG1 3.27Å; R86-I90 WeakPolarHBondContact O-CG1 3.46Å; R86-I90 PolarHBondContact O-N 3.27Å; R86-A192 WeakPolarHBondContact CD-O 3.43Å; R86-R193 VanDerWaalsContact NH1-NH2 3.15Å
87	E	94.8	Very high	91.6	Very high	8 Å²	8	72.6 Å²	72.6	4%	0.037	35%	0.352	C	S	.	.	H	α-helix	trans	-57.6	-48.9	176.8	178.1	169.6	-164.5	0	0	111	K69 T83 A84 K89 I90 L91 L122 F189 G190	K69-E87 IonicContact NZ-OE1 2.66Å; K69-E87 PolarHBondContact NZ-OE1 2.95Å; K69-E87 IonicContact NZ-OE2 3.67Å; K69-E87 PolarHBondContact NZ-OE2 2.96Å; T83-E87 WeakPolarHBondContact O-CB 3.32Å; T83-E87 PolarHBondContact O-N 3.46Å; A84-E87 PolarHBondContact O-N 3.41Å; E87-K89 PolarHBondContact O-N 3.28Å; E87-I90 PolarHBondContact O-N 3.47Å; E87-L91 HydrophobicContact CG-CD1 3.6Å; E87-L91 HydrophobicContact CG-CG 4.41Å; E87-L91 WeakPolarHBondContact O-CB 3.28Å; E87-L91 WeakPolarHBondContact O-CD1 3.47Å; E87-L91 VanDerWaalsContact O-CG 3.3Å; E87-L91 WeakPolarHBondContact O-CG 3.45Å; E87-L91 PolarHBondContact O-N 3.42Å; E87-L122 HydrophobicContact CG-CD1 4.32Å; E87-F189 HydrophobicContact CG-CB 4.27Å; E87-G190 WeakPolarHBondContact OE2-CA 3.45Å
88	I	95.6	Very high	92.9	Very high	19 Å²	19	63 Å²	63	10%	0.097	31%	0.31	C	S	.	.	H	α-helix	trans	-56.2	-52.4	176	-70.8	160.9	0	0	0	111	F80 A84 I90 L91 Q92 I105 L122	F80-I88 HydrophobicContact CE1-CD1 4.07Å; F80-I88 HydrophobicContact CZ-CD1 4.01Å; A84-I88 WeakPolarHBondContact O-CB 3.17Å; A84-I88 WeakPolarHBondContact O-CD1 3.49Å; A84-I88 VanDerWaalsContact O-CG1 3.28Å; A84-I88 WeakPolarHBondContact O-CG1 3.43Å; A84-I88 PolarHBondContact O-N 2.93Å; I88-I90 VanDerWaalsContact C-N 3.3Å; I88-I90 PolarHBondContact O-N 3.02Å; I88-L91 PolarHBondContact O-N 2.81Å; I88-Q92 HydrophobicContact CG2-CG 4.42Å; I88-Q92 WeakPolarHBondContact O-CB 3.32Å; I88-Q92 WeakPolarHBondContact O-CG 3.31Å; I88-Q92 PolarHBondContact O-N 3.49Å; I88-I105 HydrophobicContact CB-CD1 4.39Å; I88-I105 HydrophobicContact CD1-CD1 3.85Å; I88-I105 HydrophobicContact CG1-CD1 3.86Å; I88-I105 HydrophobicContact CG2-CD1 3.61Å; I88-L122 HydrophobicContact CD1-CD2 3.97Å; I88-L122 HydrophobicContact CG1-CD1 4.28Å; I88-L122 HydrophobicContact CG1-CD2 3.61Å
89	K	97	Very high	94	Very high	158 Å²	158	54.2 Å²	54.2	69%	0.687	27%	0.269	S	S	*	.	H	α-helix	trans	-59.7	-41.6	-178.1	-178.7	174.9	179.8	174.2	0	111.9	L85 R86 E87 L93	L85-K89 WeakPolarHBondContact O-CB 3.09Å; L85-K89 PolarHBondContact O-N 3.34Å; R86-K89 PolarHBondContact O-N 2.95Å; E87-K89 PolarHBondContact O-N 3.28Å; K89-L93 PolarHBondContact O-N 3.31Å
90	I	97.6	Very high	94.7	Very high	8 Å²	8	52.7 Å²	52.7	4%	0.041	25%	0.252	C	S	.	.	H	α-helix	trans	-66.7	-46.6	178	-71.9	173.6	0	0	0	110.6	R86 E87 I88 Q92 L93 L94 I166 F189 A192	R86-I90 HydrophobicContact CG-CD1 3.79Å; R86-I90 HydrophobicContact CG-CG1 4.43Å; R86-I90 WeakPolarHBondContact O-CB 3.2Å; R86-I90 VanDerWaalsContact O-CG1 3.27Å; R86-I90 WeakPolarHBondContact O-CG1 3.46Å; R86-I90 PolarHBondContact O-N 3.27Å; E87-I90 PolarHBondContact O-N 3.47Å; I88-I90 VanDerWaalsContact C-N 3.3Å; I88-I90 PolarHBondContact O-N 3.02Å; I90-Q92 VanDerWaalsContact C-N 3.29Å; I90-Q92 PolarHBondContact O-N 2.94Å; I90-L93 WeakPolarHBondContact O-CB 3.29Å; I90-L93 PolarHBondContact O-N 3.08Å; I90-L93 VanDerWaalsContact O-N 3.1Å; I90-L94 HydrophobicContact CG2-CD1 3.49Å; I90-L94 VanDerWaalsContact CG2-CD1 3.49Å; I90-L94 HydrophobicContact CG2-CG 4.09Å; I90-L94 WeakPolarHBondContact O-CG 3.5Å; I90-L94 PolarHBondContact O-N 3.28Å; I90-I166 HydrophobicContact CD1-CD1 4.22Å; I90-I166 HydrophobicContact CD1-CG2 4.21Å; I90-I166 HydrophobicContact CG1-CD1 3.95Å; I90-I166 HydrophobicContact CG2-CG1 4.34Å; I90-I166 HydrophobicContact CG2-CG2 3.94Å; I90-F189 HydrophobicContact CG2-CB 4.4Å; I90-F189 HydrophobicContact CG2-CD1 3.7Å; I90-F189 HydrophobicContact CG2-CE1 4.38Å; I90-F189 HydrophobicContact CG2-CG 4.3Å; I90-A192 HydrophobicContact CD1-CB 3.71Å
91	L	97.2	Very high	95.2	Very high	1 Å²	1	52 Å²	52	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-69.5	-24.8	-178.9	-73.3	165.8	0	0	0	114.1	E87 I88 K95 V100 L102 F124 F189	E87-L91 HydrophobicContact CG-CD1 3.6Å; E87-L91 HydrophobicContact CG-CG 4.41Å; E87-L91 WeakPolarHBondContact O-CB 3.28Å; E87-L91 WeakPolarHBondContact O-CD1 3.47Å; E87-L91 VanDerWaalsContact O-CG 3.3Å; E87-L91 WeakPolarHBondContact O-CG 3.45Å; E87-L91 PolarHBondContact O-N 3.42Å; I88-L91 PolarHBondContact O-N 2.81Å; L91-K95 PolarHBondContact O-NZ 2.74Å; L91-V100 HydrophobicContact CD2-CG1 3.79Å; L91-L102 HydrophobicContact CB-CB 3.87Å; L91-L102 HydrophobicContact CB-CD2 3.87Å; L91-L102 HydrophobicContact CB-CG 4.49Å; L91-L102 HydrophobicContact CD1-CB 4.47Å; L91-L102 HydrophobicContact CD1-CD2 4.49Å; L91-F124 HydrophobicContact CD1-CE1 3.56Å; L91-F124 HydrophobicContact CD1-CZ 3.73Å; L91-F124 HydrophobicContact CD2-CE1 4.16Å; L91-F124 HydrophobicContact CG-CE1 4.45Å; L91-F189 HydrophobicContact CD2-CB 4.43Å; L91-F189 HydrophobicContact CD2-CD2 3.76Å; L91-F189 HydrophobicContact CD2-CE2 4.34Å; L91-F189 HydrophobicContact CD2-CG 4.22Å; L91-F189 HydrophobicContact CG-CB 4.38Å
92	Q	96.8	Very high	95.8	Very high	122 Å²	122	52.2 Å²	52.2	57%	0.57	25%	0.252	S	S	*	.	H	α-helix	trans	-71.4	-36.4	169.8	-74.9	177.5	-29.1	0	0	111.6	I88 I90 L102	I88-Q92 HydrophobicContact CG2-CG 4.42Å; I88-Q92 WeakPolarHBondContact O-CB 3.32Å; I88-Q92 WeakPolarHBondContact O-CG 3.31Å; I88-Q92 PolarHBondContact O-N 3.49Å; I90-Q92 VanDerWaalsContact C-N 3.29Å; I90-Q92 PolarHBondContact O-N 2.94Å; Q92-L102 HydrophobicContact CG-CD2 4.28Å
93	L	97.2	Very high	96.2	Very high	95 Å²	95	49.8 Å²	49.8	50%	0.497	24%	0.24	S	C	.	.	H	α-helix	trans	-72.4	-44.1	177.3	176.6	67	0	0	0	112.5	K89 I90 K95	K89-L93 PolarHBondContact O-N 3.31Å; I90-L93 WeakPolarHBondContact O-CB 3.29Å; I90-L93 PolarHBondContact O-N 3.08Å; I90-L93 VanDerWaalsContact O-N 3.1Å; L93-K95 PolarHBondContact O-N 3.47Å
94	L	97.9	Very high	96.6	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	24%	0.237	C	C	.	.			trans	-84	112.6	-171.5	-61.4	178.4	0	0	0	111.4	I90 V99 Y160 I161 N164 I166 F189	I90-L94 HydrophobicContact CG2-CD1 3.49Å; I90-L94 VanDerWaalsContact CG2-CD1 3.49Å; I90-L94 HydrophobicContact CG2-CG 4.09Å; I90-L94 WeakPolarHBondContact O-CG 3.5Å; I90-L94 PolarHBondContact O-N 3.28Å; L94-V99 HydrophobicContact CB-CG1 4.12Å; L94-V99 HydrophobicContact CD1-CG1 4.45Å; L94-Y160 HydrophobicContact CB-CE1 4.07Å; L94-Y160 HydrophobicContact CD2-CD1 4.28Å; L94-Y160 HydrophobicContact CD2-CE1 3.7Å; L94-Y160 HydrophobicContact CG-CE1 4.47Å; L94-I161 HydrophobicContact CD1-CB 4.39Å; L94-I161 HydrophobicContact CD1-CG2 3.73Å; L94-I161 HydrophobicContact CD2-CG2 4.26Å; L94-N164 HydrophobicContact CD2-CB 3.72Å; L94-I166 HydrophobicContact CD1-CG1 4.47Å; L94-I166 HydrophobicContact CD1-CG2 4.43Å; L94-I166 HydrophobicContact CD2-CG1 4.2Å; L94-F189 HydrophobicContact CD1-CD1 4Å; L94-F189 HydrophobicContact CD1-CE1 3.44Å; L94-F189 VanDerWaalsContact CD1-CE1 3.44Å; L94-F189 HydrophobicContact CD1-CZ 3.95Å
95	K	98	Very high	96.8	Very high	102 Å²	102	51.5 Å²	51.5	44%	0.443	25%	0.245	S	C	.	.			trans	-129.6	97.8	175.9	-61.1	-61.2	178.3	-163.7	0	109.7	L91 L93 N101 L102 Y160	L91-K95 PolarHBondContact O-NZ 2.74Å; L93-K95 PolarHBondContact O-N 3.47Å; K95-N101 PolarHBondContact NZ-OD1 3.08Å; K95-L102 PolarHBondContact NZ-O 3.27Å; K95-Y160 PolarHBondContact N-OH 2.91Å; K95-Y160 PolarHBondContact O-OH 2.76Å
96	H	98.6	Very high	97	Very high	64 Å²	64	47 Å²	47	30%	0.296	22%	0.221	S	C	.	.			trans	-149.8	152.8	-176.7	-174.6	-101	0	0	0	111.2	N98 V99 Y160	H96-N98 VanDerWaalsContact C-N 3.26Å; H96-N98 PolarHBondContact CE1-OD1 3.16Å; H96-N98 PolarHBondContact ND1-N 2.85Å; H96-N98 PolarHBondContact O-N 2.91Å; H96-V99 HydrophobicContact CB-CB 4.28Å; H96-V99 HydrophobicContact CB-CG2 4.06Å; H96-V99 PolarHBondContact O-N 3.47Å; H96-Y160 HydrophobicContact CB-CD1 3.46Å; H96-Y160 VanDerWaalsContact CB-CD1 3.46Å; H96-Y160 HydrophobicContact CB-CD2 3.92Å; H96-Y160 HydrophobicContact CB-CE1 3.52Å; H96-Y160 HydrophobicContact CB-CE2 3.97Å; H96-Y160 HydrophobicContact CB-CG 3.67Å; H96-Y160 AromaticContact CD2-CD2 3.52Å; H96-Y160 AromaticContact CD2-CG 3.69Å; H96-Y160 AromaticContact CG-CD1 3.89Å; H96-Y160 AromaticContact CG-CD2 3.84Å; H96-Y160 AromaticContact CG-CG 3.6Å
97	E	98.2	Very high	96.9	Very high	123 Å²	123	46.3 Å²	46.3	58%	0.575	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-41.3	-179.5	-175.2	176.6	-168.7	0	0	111.9	V183 K185	E97-V183 HydrophobicContact CG-CG1 3.76Å; E97-K185 VanDerWaalsContact O-CD 3.26Å; E97-K185 WeakPolarHBondContact O-CD 3.44Å; E97-K185 VanDerWaalsContact O-CE 3.24Å; E97-K185 WeakPolarHBondContact O-CE 3.29Å; E97-K185 PolarHBondContact O-NZ 3.04Å
98	N	98.6	Very high	96.6	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.032	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	20.5	-178.9	-50.8	119	0	0	0	115.6	H96 M153 L184 L186	H96-N98 VanDerWaalsContact C-N 3.26Å; H96-N98 PolarHBondContact CE1-OD1 3.16Å; H96-N98 PolarHBondContact ND1-N 2.85Å; H96-N98 PolarHBondContact O-N 2.91Å; N98-M153 WeakPolarHBondContact CB-O 3.45Å; N98-M153 WeakPolarHBondContact ND2-CB 3.35Å; N98-L184 VanDerWaalsContact CA-O 3.22Å; N98-L184 WeakPolarHBondContact CA-O 3.44Å; N98-L184 PolarHBondContact ND2-O 3.14Å; N98-L186 PolarHBondContact O-N 2.94Å
99	V	98.6	Very high	96.1	Very high	2 Å²	2	51 Å²	51	1%	0.012	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-123.8	140.5	172.8	178.2	0	0	0	0	108.9	L94 H96 N101 Y160 I161 K185 F189	L94-V99 HydrophobicContact CB-CG1 4.12Å; L94-V99 HydrophobicContact CD1-CG1 4.45Å; H96-V99 HydrophobicContact CB-CB 4.28Å; H96-V99 HydrophobicContact CB-CG2 4.06Å; H96-V99 PolarHBondContact O-N 3.47Å; V99-N101 PolarHBondContact O-N 2.96Å; V99-Y160 HydrophobicContact CG2-CD1 4.11Å; V99-I161 HydrophobicContact CG2-CG2 3.86Å; V99-K185 WeakPolarHBondContact O-CD 3.42Å; V99-F189 HydrophobicContact CG1-CE2 3.79Å; V99-F189 HydrophobicContact CG1-CZ 3.7Å
100	V	97.6	Very high	95.2	Very high	8 Å²	8	44.8 Å²	44.8	5%	0.048	22%	0.218	C	C	.	.			trans	-58.6	134.4	176.7	72.1	0	0	0	0	110.6	L91 F124 L186 A187 F189	L91-V100 HydrophobicContact CD2-CG1 3.79Å; V100-F124 HydrophobicContact CG1-CD1 4.13Å; V100-F124 HydrophobicContact CG1-CE1 4.14Å; V100-F124 HydrophobicContact CG2-CB 4.04Å; V100-F124 HydrophobicContact CG2-CD1 3.7Å; V100-F124 HydrophobicContact CG2-CE1 4.49Å; V100-F124 HydrophobicContact CG2-CG 4.16Å; V100-L186 WeakPolarHBondContact CB-O 2.97Å; V100-L186 PolarHBondContact N-O 3.39Å; V100-A187 HydrophobicContact CB-CB 4.33Å; V100-A187 HydrophobicContact CG1-CB 4.38Å; V100-F189 HydrophobicContact CG1-CD2 4.36Å; V100-F189 HydrophobicContact CG1-CE2 4.28Å
101	N	97.4	Very high	94.4	Very high	50 Å²	50	47 Å²	47	27%	0.267	23%	0.233	S	C	.	.			trans	-95.1	116.1	-178.7	177.9	46.4	0	0	0	110.4	K95 V99 I103 F124 D125	K95-N101 PolarHBondContact NZ-OD1 3.08Å; V99-N101 PolarHBondContact O-N 2.96Å; N101-I103 PolarHBondContact O-N 3.21Å; N101-F124 WeakPolarHBondContact O-CA 3.24Å; N101-D125 WeakPolarHBondContact CB-OD2 3.37Å; N101-D125 PolarHBondContact ND2-OD2 3.14Å; N101-D125 PolarHBondContact O-N 2.8Å
102	L	97.8	Very high	93.3	Very high	10 Å²	10	53.8 Å²	53.8	5%	0.052	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	111.7	165.3	179.7	70.2	0	0	0	108.5	L91 Q92 K95 E104 L122 F124	L91-L102 HydrophobicContact CB-CB 3.87Å; L91-L102 HydrophobicContact CB-CD2 3.87Å; L91-L102 HydrophobicContact CB-CG 4.49Å; L91-L102 HydrophobicContact CD1-CB 4.47Å; L91-L102 HydrophobicContact CD1-CD2 4.49Å; Q92-L102 HydrophobicContact CG-CD2 4.28Å; K95-L102 PolarHBondContact NZ-O 3.27Å; L102-E104 WeakPolarHBondContact CD1-O 3.5Å; L102-L122 HydrophobicContact CD1-CB 3.85Å; L102-L122 HydrophobicContact CD1-CD2 4.38Å; L102-F124 HydrophobicContact CB-CD1 4.27Å; L102-F124 HydrophobicContact CB-CE1 4.08Å; L102-F124 HydrophobicContact CD1-CD1 4.3Å; L102-F124 HydrophobicContact CD1-CE1 3.92Å; L102-F124 HydrophobicContact CD1-CZ 4.05Å
103	I	96.6	Very high	92.2	Very high	63 Å²	63	57.6 Å²	57.6	32%	0.323	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-53.1	177.3	-58.4	175.6	0	0	0	108.8	V66 N101 V123 D125	V66-I103 HydrophobicContact CG1-CD1 3.83Å; N101-I103 PolarHBondContact O-N 3.21Å; I103-V123 HydrophobicContact CB-CB 4.5Å; I103-V123 HydrophobicContact CB-CG1 4.37Å; I103-V123 WeakPolarHBondContact CB-O 3.45Å; I103-V123 HydrophobicContact CD1-CG1 4.28Å; I103-V123 PolarHBondContact N-O 3.23Å; I103-D125 WeakPolarHBondContact CD1-OD1 3.39Å
104	E	96.1	Very high	91.1	Very high	44 Å²	44	55 Å²	55	21%	0.206	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167	179.2	-174.5	63.4	174.1	130.9	0	0	112.1	K39 Y40 L102 C106 V123	K39-E104 VanDerWaalsContact CE-CD 3.48Å; K39-E104 WeakPolarHBondContact CE-OE1 3.32Å; K39-E104 VanDerWaalsContact CE-OE2 3.26Å; K39-E104 WeakPolarHBondContact CE-OE2 3.32Å; K39-E104 IonicContact NZ-OE1 2.91Å; K39-E104 PolarHBondContact NZ-OE1 2.97Å; K39-E104 IonicContact NZ-OE2 2.7Å; K39-E104 PolarHBondContact NZ-OE2 2.87Å; Y40-E104 PolarHBondContact OH-OE1 3.46Å; L102-E104 WeakPolarHBondContact CD1-O 3.5Å; E104-C106 VanDerWaalsContact CD-SG 3.56Å; E104-C106 PolarHBondContact OE2-SG 3.34Å; E104-C106 VanDerWaalsContact OE2-SG 3.32Å; E104-V123 HydrophobicContact CG-CB 3.74Å; E104-V123 HydrophobicContact CG-CG1 4.35Å; E104-V123 HydrophobicContact CG-CG2 3.73Å; E104-V123 PolarHBondContact O-N 3.26Å
105	I	96.4	Very high	90.1	Very high	41 Å²	41	63.9 Å²	63.9	21%	0.21	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.1	173.8	-55.6	177	0	0	0	107.7	I88 I120 Y121 L122	I88-I105 HydrophobicContact CB-CD1 4.39Å; I88-I105 HydrophobicContact CD1-CD1 3.85Å; I88-I105 HydrophobicContact CG1-CD1 3.86Å; I88-I105 HydrophobicContact CG2-CD1 3.61Å; I105-I120 HydrophobicContact CG2-CG2 3.51Å; I105-Y121 WeakPolarHBondContact CA-O 3.3Å; I105-L122 HydrophobicContact CD1-CD2 4.12Å; I105-L122 HydrophobicContact CG1-CD2 3.81Å; I105-L122 HydrophobicContact CG2-CD2 4.24Å
106	C	94.9	Very high	89	Confident	1 Å²	1	62 Å²	62	1%	0.007	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	156.7	177.9	-58.5	0	0	0	0	111.6	D35 E104 I120 Y121 V123	D35-C106 VanDerWaalsContact O-CA 3.29Å; D35-C106 WeakPolarHBondContact O-CA 3.35Å; D35-C106 WeakPolarHBondContact O-CB 3.43Å; E104-C106 VanDerWaalsContact CD-SG 3.56Å; E104-C106 PolarHBondContact OE2-SG 3.34Å; E104-C106 VanDerWaalsContact OE2-SG 3.32Å; C106-I120 WeakPolarHBondContact O-CA 3.43Å; C106-Y121 PolarHBondContact N-O 2.88Å; C106-Y121 PolarHBondContact O-N 3.43Å; C106-V123 HydrophobicContact CB-CG2 4.37Å; C106-V123 VanDerWaalsContact SG-CG2 3.57Å
107	R	91.9	Very high	88	Confident	46 Å²	46	66.1 Å²	66.1	17%	0.174	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	159	177	66.3	-179.5	-173	101.6	8.8	112.3	F31 C34 D35 E36 F37 S119 I120	F31-R107 VanDerWaalsContact CD2-NH2 3.3Å; C34-R107 PolarHBondContact O-NE 3.05Å; D35-R107 PolarHBondContact O-N 3.05Å; E36-R107 CarbonylContact C-O 3.57Å; E36-R107 WeakPolarHBondContact CA-O 3.5Å; E36-R107 IonicContact OE1-NH2 2.68Å; F37-R107 WeakPolarHBondContact CB-O 3.15Å; F37-R107 PolarHBondContact N-O 2.94Å; R107-S119 CarbonylContact C-O 3.49Å; R107-S119 WeakPolarHBondContact CA-O 3.32Å; R107-I120 HydrophobicContact CB-CD1 3.82Å
108	T	88.9	Confident	87.3	Confident	29 Å²	29	62.1 Å²	62.1	18%	0.178	30%	0.299	C	S	.	.			trans	-107.9	146.4	160.7	65.9	0	0	0	0	109.7	F37 G118 S119 Y121	F37-T108 HydrophobicContact CB-CG2 3.73Å; F37-T108 HydrophobicContact CD1-CG2 4.47Å; F37-T108 HydrophobicContact CG-CG2 4.05Å; T108-G118 VanDerWaalsContact O-CA 3.26Å; T108-G118 WeakPolarHBondContact O-CA 3.37Å; T108-S119 PolarHBondContact N-O 3.4Å; T108-S119 WeakPolarHBondContact OG1-CB 3.41Å; T108-S119 PolarHBondContact OG1-N 3.23Å; T108-Y121 HydrophobicContact CG2-CD2 4.24Å; T108-Y121 HydrophobicContact CG2-CE2 3.63Å
109	K	84.5	Confident	86.8	Confident	97 Å²	97	62.8 Å²	62.8	42%	0.422	30%	0.304	S	S	.	.			trans	-60.8	149.2	170	-63.7	-167.9	-175.1	-170.5	0	111	E36 T111 N114	E36-K109 WeakPolarHBondContact OE1-CE 3.44Å; E36-K109 IonicContact OE1-NZ 3.45Å; E36-K109 PolarHBondContact OE1-NZ 3.38Å; E36-K109 WeakPolarHBondContact OE2-CE 3.26Å; K109-T111 HydrophobicContact CB-CG2 4.32Å; K109-N114 PolarHBondContact O-ND2 2.83Å
110	A	79.6	Confident	86.5	Confident	27 Å²	27	64.6 Å²	64.6	22%	0.223	31%	0.313	C	S	.	.			trans	-67.8	128	164	0	0	0	0	0	108.1	Y116	A110-Y116 WeakPolarHBondContact CB-O 3.36Å
111	T	78.9	Confident	86.3	Confident	55 Å²	55	65.1 Å²	65.1	34%	0.337	31%	0.314	S	S	.	.			trans	-141.9	161.8	-179.6	63.8	0	0	0	0	109.1	K109 F113 N114 R115 Y116	K109-T111 HydrophobicContact CB-CG2 4.32Å; T111-F113 PolarHBondContact O-N 3.44Å; T111-F113 VanDerWaalsContact O-N 3.15Å; T111-N114 PolarHBondContact N-OD1 3.44Å; T111-N114 CarbonylContact O-C 3.6Å; T111-N114 PolarHBondContact O-N 2.93Å; T111-N114 PolarHBondContact O-OD1 3.18Å; T111-N114 PolarHBondContact OG1-ND2 2.65Å; T111-R115 PolarHBondContact O-N 3.26Å; T111-Y116 WeakPolarHBondContact O-CA 3.45Å; T111-Y116 PolarHBondContact O-N 3.48Å
112	Q	74.8	Confident	86.2	Confident	144 Å²	144	62.8 Å²	62.8	67%	0.673	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-55.8	-34.5	175.2	-171	176.3	2.2	0	0	112.2	N114 R115 Y116	Q112-N114 VanDerWaalsContact C-N 3.26Å; Q112-N114 PolarHBondContact O-N 2.74Å; Q112-R115 PolarHBondContact O-N 3.48Å; Q112-Y116 HydrophobicContact CB-CE1 4.17Å; Q112-Y116 HydrophobicContact CB-CE2 4.47Å; Q112-Y116 HydrophobicContact CG-CE2 4.36Å
113	F	73.9	Confident	86.2	Confident	201 Å²	201	62.3 Å²	62.3	88%	0.882	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-66.9	-22.3	179.5	-59.3	-72.5	0	0	0	114.2	T111	T111-F113 PolarHBondContact O-N 3.44Å; T111-F113 VanDerWaalsContact O-N 3.15Å
114	N	74.5	Confident	86.2	Confident	42 Å²	42	60 Å²	60	23%	0.225	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-111.7	25.6	175.4	66.5	23.8	0	0	0	112.7	K109 T111 Q112 Y116 K117	K109-N114 PolarHBondContact O-ND2 2.83Å; T111-N114 PolarHBondContact N-OD1 3.44Å; T111-N114 CarbonylContact O-C 3.6Å; T111-N114 PolarHBondContact O-N 2.93Å; T111-N114 PolarHBondContact O-OD1 3.18Å; T111-N114 PolarHBondContact OG1-ND2 2.65Å; Q112-N114 VanDerWaalsContact C-N 3.26Å; Q112-N114 PolarHBondContact O-N 2.74Å; N114-Y116 PolarHBondContact O-N 3.47Å; N114-Y116 PolarHBondContact OD1-N 3.11Å; N114-K117 PolarHBondContact ND2-O 3.18Å; N114-K117 VanDerWaalsContact ND2-O 3.13Å; N114-K117 PolarHBondContact O-N 2.8Å; N114-K117 PolarHBondContact OD1-N 3.47Å; N114-K117 PolarHBondContact OD1-O 2.99Å
115	R	76.6	Confident	86.3	Confident	186 Å²	186	59.8 Å²	59.8	70%	0.702	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	38.1	-178.2	-53.6	-178.8	-176.8	170.8	0.4	111.9	T111 Q112 K117	T111-R115 PolarHBondContact O-N 3.26Å; Q112-R115 PolarHBondContact O-N 3.48Å; R115-K117 PolarHBondContact O-N 3.1Å
116	Y	74.5	Confident	86.3	Confident	64 Å²	64	58.6 Å²	58.6	25%	0.251	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	31.3	-178.7	-52.9	-81.9	0	0	0	113.7	A19 A20 A110 T111 Q112 N114	A19-Y116 HydrophobicContact CB-CD2 4.48Å; A19-Y116 HydrophobicContact CB-CG 4.42Å; A20-Y116 HydrophobicContact CB-CD1 4.17Å; A20-Y116 HydrophobicContact CB-CD2 4.31Å; A20-Y116 HydrophobicContact CB-CE1 3.79Å; A20-Y116 HydrophobicContact CB-CE2 3.95Å; A20-Y116 HydrophobicContact CB-CG 4.41Å; A110-Y116 WeakPolarHBondContact CB-O 3.36Å; T111-Y116 WeakPolarHBondContact O-CA 3.45Å; T111-Y116 PolarHBondContact O-N 3.48Å; Q112-Y116 HydrophobicContact CB-CE1 4.17Å; Q112-Y116 HydrophobicContact CB-CE2 4.47Å; Q112-Y116 HydrophobicContact CG-CE2 4.36Å; N114-Y116 PolarHBondContact O-N 3.47Å; N114-Y116 PolarHBondContact OD1-N 3.11Å
117	K	78.3	Confident	86.3	Confident	150 Å²	150	58.9 Å²	58.9	65%	0.652	28%	0.283	S	S	*	.			trans	-117.7	116	175.9	-67.2	-175.4	-179.7	-174.3	0	111.3	N114 R115	N114-K117 PolarHBondContact ND2-O 3.18Å; N114-K117 VanDerWaalsContact ND2-O 3.13Å; N114-K117 PolarHBondContact O-N 2.8Å; N114-K117 PolarHBondContact OD1-N 3.47Å; N114-K117 PolarHBondContact OD1-O 2.99Å; R115-K117 PolarHBondContact O-N 3.1Å
118	G	82.4	Confident	86.3	Confident	39 Å²	39	58.1 Å²	58.1	40%	0.402	28%	0.281	S	S	.	.			trans	-61.5	145	169.1	0	0	0	0	0	111.6	T108	T108-G118 VanDerWaalsContact O-CA 3.26Å; T108-G118 WeakPolarHBondContact O-CA 3.37Å
119	S	88.5	Confident	86.6	Confident	20 Å²	20	57 Å²	57	14%	0.14	27%	0.274	C	S	.	.			trans	-107.9	146.5	172.4	-66.7	0	0	0	0	109.5	K70 R107 T108	K70-S119 VanDerWaalsContact CE-OG 3.32Å; K70-S119 WeakPolarHBondContact CE-OG 3.37Å; R107-S119 CarbonylContact C-O 3.49Å; R107-S119 WeakPolarHBondContact CA-O 3.32Å; T108-S119 PolarHBondContact N-O 3.4Å; T108-S119 WeakPolarHBondContact OG1-CB 3.41Å; T108-S119 PolarHBondContact OG1-N 3.23Å
120	I	91.9	Very high	87.1	Confident	40 Å²	40	52.9 Å²	52.9	21%	0.205	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	137.6	175	-60	-59.1	0	0	0	109.2	V71 F80 I105 C106 R107	V71-I120 HydrophobicContact CB-CB 4.39Å; V71-I120 HydrophobicContact CG2-CB 4.32Å; V71-I120 HydrophobicContact CG2-CG2 4.16Å; V71-I120 PolarHBondContact N-O 3.16Å; F80-I120 HydrophobicContact CE2-CB 4.1Å; F80-I120 HydrophobicContact CE2-CG1 3.92Å; F80-I120 HydrophobicContact CE2-CG2 4.23Å; F80-I120 HydrophobicContact CZ-CG2 4.45Å; I105-I120 HydrophobicContact CG2-CG2 3.51Å; C106-I120 WeakPolarHBondContact O-CA 3.43Å; R107-I120 HydrophobicContact CB-CD1 3.82Å
121	Y	94.4	Very high	87.9	Confident	18 Å²	18	51.6 Å²	51.6	7%	0.071	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.8	179.7	-69.6	-93.8	0	0	0	109.9	F37 L68 K69 K70 I105 C106 T108	F37-Y121 HydrophobicContact CD2-CD1 4.37Å; F37-Y121 AromaticContact CD2-CD2 3.88Å; F37-Y121 HydrophobicContact CD2-CD2 3.88Å; F37-Y121 HydrophobicContact CD2-CE1 4.42Å; F37-Y121 AromaticContact CD2-CE2 3.97Å; F37-Y121 HydrophobicContact CD2-CE2 3.97Å; F37-Y121 HydrophobicContact CD2-CG 4.09Å; F37-Y121 HydrophobicContact CE2-CD1 4.31Å; F37-Y121 HydrophobicContact CE2-CD2 4.5Å; F37-Y121 HydrophobicContact CE2-CE1 4.11Å; F37-Y121 HydrophobicContact CE2-CE2 4.34Å; F37-Y121 HydrophobicContact CE2-CG 4.49Å; L68-Y121 HydrophobicContact CB-CD1 4.12Å; K69-Y121 WeakPolarHBondContact O-CA 3.37Å; K70-Y121 HydrophobicContact CB-CD1 3.94Å; K70-Y121 HydrophobicContact CB-CE1 3.55Å; K70-Y121 HydrophobicContact CD-CE1 4.34Å; K70-Y121 HydrophobicContact CG-CD1 4.35Å; K70-Y121 HydrophobicContact CG-CE1 3.76Å; K70-Y121 HydrophobicContact CG-CE2 4.43Å; I105-Y121 WeakPolarHBondContact CA-O 3.3Å; C106-Y121 PolarHBondContact N-O 2.88Å; C106-Y121 PolarHBondContact O-N 3.43Å; T108-Y121 HydrophobicContact CG2-CD2 4.24Å; T108-Y121 HydrophobicContact CG2-CE2 3.63Å
122	L	95.8	Very high	88.6	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.2	166.7	-54.5	-174.7	0	0	0	108.4	L68 K69 V71 E87 I88 L102 I105 F124	L68-L122 WeakPolarHBondContact CA-O 3.47Å; K69-L122 HydrophobicContact CB-CB 4.36Å; K69-L122 PolarHBondContact N-O 3.44Å; K69-L122 PolarHBondContact O-N 3.46Å; V71-L122 HydrophobicContact CG2-CG 4.24Å; E87-L122 HydrophobicContact CG-CD1 4.32Å; I88-L122 HydrophobicContact CD1-CD2 3.97Å; I88-L122 HydrophobicContact CG1-CD1 4.28Å; I88-L122 HydrophobicContact CG1-CD2 3.61Å; L102-L122 HydrophobicContact CD1-CB 3.85Å; L102-L122 HydrophobicContact CD1-CD2 4.38Å; I105-L122 HydrophobicContact CD1-CD2 4.12Å; I105-L122 HydrophobicContact CG1-CD2 3.81Å; I105-L122 HydrophobicContact CG2-CD2 4.24Å; L122-F124 HydrophobicContact CB-CD2 4.35Å; L122-F124 HydrophobicContact CB-CE2 3.46Å; L122-F124 VanDerWaalsContact CB-CE2 3.46Å; L122-F124 HydrophobicContact CB-CZ 3.75Å; L122-F124 HydrophobicContact CD1-CE2 4.49Å; L122-F124 HydrophobicContact CD1-CZ 4.14Å
123	V	96.9	Very high	89.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	122.7	-176.8	-171.1	0	0	0	0	109.8	Y40 V66 A67 L68 I103 E104 C106	Y40-V123 HydrophobicContact CE1-CG1 4.16Å; Y40-V123 HydrophobicContact CE2-CG1 4.09Å; Y40-V123 HydrophobicContact CE2-CG2 3.93Å; V66-V123 HydrophobicContact CB-CG1 3.86Å; V66-V123 HydrophobicContact CG1-CG1 4.04Å; V66-V123 HydrophobicContact CG2-CG1 4.02Å; A67-V123 WeakPolarHBondContact O-CA 3.41Å; L68-V123 HydrophobicContact CD2-CB 4.13Å; L68-V123 HydrophobicContact CD2-CG1 3.86Å; L68-V123 HydrophobicContact CD2-CG2 3.66Å; I103-V123 HydrophobicContact CB-CB 4.5Å; I103-V123 HydrophobicContact CB-CG1 4.37Å; I103-V123 WeakPolarHBondContact CB-O 3.45Å; I103-V123 HydrophobicContact CD1-CG1 4.28Å; I103-V123 PolarHBondContact N-O 3.23Å; E104-V123 HydrophobicContact CG-CB 3.74Å; E104-V123 HydrophobicContact CG-CG1 4.35Å; E104-V123 HydrophobicContact CG-CG2 3.73Å; E104-V123 PolarHBondContact O-N 3.26Å; C106-V123 HydrophobicContact CB-CG2 4.37Å; C106-V123 VanDerWaalsContact SG-CG2 3.57Å
124	F	97.5	Very high	90.5	Very high	16 Å²	16	33.3 Å²	33.3	7%	0.07	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	156.3	-178	-58.3	-87.6	0	0	0	111.9	V66 A67 K69 L91 V100 N101 L102 L122 F126	V66-F124 CarbonylContact C-O 3.56Å; V66-F124 VanDerWaalsContact CA-O 3.26Å; V66-F124 WeakPolarHBondContact CA-O 3.45Å; V66-F124 VanDerWaalsContact CB-O 3.3Å; V66-F124 WeakPolarHBondContact CB-O 3.13Å; A67-F124 HydrophobicContact CB-CB 4.32Å; A67-F124 PolarHBondContact N-O 3.49Å; A67-F124 PolarHBondContact O-N 2.96Å; K69-F124 HydrophobicContact CB-CD2 4.48Å; K69-F124 HydrophobicContact CB-CE2 3.84Å; K69-F124 HydrophobicContact CD-CE2 4.41Å; L91-F124 HydrophobicContact CD1-CE1 3.56Å; L91-F124 HydrophobicContact CD1-CZ 3.73Å; L91-F124 HydrophobicContact CD2-CE1 4.16Å; L91-F124 HydrophobicContact CG-CE1 4.45Å; V100-F124 HydrophobicContact CG1-CD1 4.13Å; V100-F124 HydrophobicContact CG1-CE1 4.14Å; V100-F124 HydrophobicContact CG2-CB 4.04Å; V100-F124 HydrophobicContact CG2-CD1 3.7Å; V100-F124 HydrophobicContact CG2-CE1 4.49Å; V100-F124 HydrophobicContact CG2-CG 4.16Å; N101-F124 WeakPolarHBondContact O-CA 3.24Å; L102-F124 HydrophobicContact CB-CD1 4.27Å; L102-F124 HydrophobicContact CB-CE1 4.08Å; L102-F124 HydrophobicContact CD1-CD1 4.3Å; L102-F124 HydrophobicContact CD1-CE1 3.92Å; L102-F124 HydrophobicContact CD1-CZ 4.05Å; L122-F124 HydrophobicContact CB-CD2 4.35Å; L122-F124 HydrophobicContact CB-CE2 3.46Å; L122-F124 VanDerWaalsContact CB-CE2 3.46Å; L122-F124 HydrophobicContact CB-CZ 3.75Å; L122-F124 HydrophobicContact CD1-CE2 4.49Å; L122-F124 HydrophobicContact CD1-CZ 4.14Å; F124-F126 PolarHBondContact O-N 3.46Å
125	D	96.7	Very high	91.4	Very high	39 Å²	39	31.5 Å²	31.5	21%	0.209	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	131.4	162.2	-73.5	-51.1	0	0	0	109.8	K64 N101 I103	K64-D125 WeakPolarHBondContact CE-OD1 3.2Å; K64-D125 IonicContact NZ-OD1 2.73Å; K64-D125 PolarHBondContact NZ-OD1 3.25Å; N101-D125 WeakPolarHBondContact CB-OD2 3.37Å; N101-D125 PolarHBondContact ND2-OD2 3.14Å; N101-D125 PolarHBondContact O-N 2.8Å; I103-D125 WeakPolarHBondContact CD1-OD1 3.39Å
126	F	96.2	Very high	92.1	Very high	15 Å²	15	24.8 Å²	24.8	7%	0.066	13%	0.134	C	C	.	.			trans	-74.8	132	-178.9	-177.8	-103.9	0	0	0	110.7	I46 K56 K65 A67 F124 E128 F358	I46-F126 HydrophobicContact CD1-CD2 4.31Å; I46-F126 HydrophobicContact CD1-CE2 3.75Å; K56-F126 HydrophobicContact CB-CD2 4.46Å; K56-F126 HydrophobicContact CB-CE2 3.95Å; K56-F126 HydrophobicContact CD-CE1 4.31Å; K56-F126 HydrophobicContact CD-CE2 3.83Å; K56-F126 HydrophobicContact CD-CZ 3.67Å; K56-F126 HydrophobicContact CG-CD2 4.08Å; K56-F126 HydrophobicContact CG-CE2 3.7Å; K56-F126 HydrophobicContact CG-CZ 4.06Å; K65-F126 HydrophobicContact CB-CB 3.92Å; K65-F126 HydrophobicContact CB-CD1 4.17Å; K65-F126 HydrophobicContact CB-CG 4.21Å; K65-F126 HydrophobicContact CD-CD1 4.27Å; A67-F126 HydrophobicContact CB-CD2 4.32Å; F124-F126 PolarHBondContact O-N 3.46Å; F126-E128 HydrophobicContact CE1-CG 4.03Å; F126-F358 HydrophobicContact CE2-CE2 4.29Å; F126-F358 AromaticContact CE2-CZ 3.88Å; F126-F358 HydrophobicContact CE2-CZ 3.88Å; F126-F358 HydrophobicContact CZ-CE2 4.01Å; F126-F358 AromaticContact CZ-CZ 3.73Å; F126-F358 HydrophobicContact CZ-CZ 3.73Å
127	C	95.5	Very high	92.8	Very high	7 Å²	7	23.9 Å²	23.9	5%	0.047	13%	0.134	C	C	.	.			trans	-110.3	136.6	168.4	-57.7	0	0	0	0	108.7	L177 T179 F358	C127-L177 HydrophobicContact CB-CB 3.66Å; C127-L177 HydrophobicContact CB-CD1 4.06Å; C127-L177 HydrophobicContact CB-CG 4.43Å; C127-T179 HydrophobicContact CB-CG2 4.4Å; C127-F358 WeakPolarHBondContact O-CZ 3.28Å
128	E	92.8	Very high	93.2	Very high	31 Å²	31	20 Å²	20	15%	0.145	13%	0.129	C	C	.	.	S	Bend	trans	-74.4	-25.6	-172.4	-77.6	68.2	-162.9	0	0	114.1	F126 I178 T179 R180 S356 M357 F358	F126-E128 HydrophobicContact CE1-CG 4.03Å; E128-I178 PolarHBondContact N-O 3.47Å; E128-T179 WeakPolarHBondContact OE2-CA 3.21Å; E128-R180 HydrophobicContact CG-CB 3.96Å; E128-R180 PolarHBondContact OE2-N 3.14Å; E128-S356 CarbonylContact O-C 3.56Å; E128-S356 WeakPolarHBondContact O-CA 3.46Å; E128-S356 WeakPolarHBondContact O-CB 3.43Å; E128-S356 PolarHBondContact O-OG 3.31Å; E128-M357 PolarHBondContact O-N 3.13Å; E128-F358 WeakPolarHBondContact O-CZ 3.21Å
129	H	93.8	Very high	93.5	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.019	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.2	-171.8	-46	-74.2	0	0	0	111.2	L134 L177 I178 M357	H129-L134 HydrophobicContact CB-CD1 3.94Å; H129-L134 HydrophobicContact CB-CD2 4.12Å; H129-L134 HydrophobicContact CB-CG 3.94Å; H129-L177 CarbonylContact O-C 3.58Å; H129-L177 WeakPolarHBondContact O-CA 3.13Å; H129-I178 PolarHBondContact N-O 2.72Å; H129-I178 VanDerWaalsContact N-O 3.07Å; H129-I178 PolarHBondContact O-N 3.23Å; H129-M357 WeakPolarHBondContact CA-O 3.49Å; H129-M357 PolarHBondContact ND1-N 3.04Å
130	D	95.4	Very high	93.5	Very high	11 Å²	11	23.4 Å²	23.4	6%	0.059	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	153.3	156.9	70.7	67.4	0	0	0	110.1	A132 G133 L134 V176 L177 M357 F358 E359	D130-A132 VanDerWaalsContact C-N 3.29Å; D130-A132 PolarHBondContact O-N 2.84Å; D130-A132 WeakPolarHBondContact OD1-CB 3.5Å; D130-A132 PolarHBondContact OD1-N 3.39Å; D130-G133 PolarHBondContact O-N 2.84Å; D130-G133 PolarHBondContact OD1-N 3.19Å; D130-L134 PolarHBondContact O-N 3.43Å; D130-V176 CarbonylContact C-O 3.27Å; D130-V176 WeakPolarHBondContact CA-O 3.07Å; D130-L177 HydrophobicContact CB-CD2 3.72Å; D130-M357 PolarHBondContact N-O 3.15Å; D130-F358 HydrophobicContact CB-CD1 4.37Å; D130-F358 WeakPolarHBondContact OD2-CA 3.25Å; D130-F358 WeakPolarHBondContact OD2-CB 3.32Å; D130-F358 WeakPolarHBondContact OD2-CD1 3.34Å; D130-E359 PolarHBondContact OD1-N 2.99Å; D130-E359 PolarHBondContact OD2-N 2.89Å
131	L	96.3	Very high	93.4	Very high	1 Å²	1	28 Å²	28	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.2	-34.5	-173.5	-174	63.9	0	0	0	111.5	G133 L134 L135 F142 V150 A173 V176 I178 I239 M243	L131-G133 PolarHBondContact O-N 3.08Å; L131-L134 PolarHBondContact O-N 3.22Å; L131-L135 HydrophobicContact CD1-CD1 4.4Å; L131-L135 HydrophobicContact CD1-CG 4.23Å; L131-L135 HydrophobicContact CD2-CD1 4.47Å; L131-L135 HydrophobicContact CG-CD1 3.92Å; L131-L135 HydrophobicContact CG-CG 4.19Å; L131-L135 WeakPolarHBondContact O-CB 3.47Å; L131-L135 WeakPolarHBondContact O-CG 3.36Å; L131-L135 PolarHBondContact O-N 2.91Å; L131-F142 HydrophobicContact CD1-CZ 4.27Å; L131-V150 HydrophobicContact CD2-CG1 4.47Å; L131-A173 HydrophobicContact CB-CB 4.35Å; L131-A173 WeakPolarHBondContact CB-O 3.22Å; L131-A173 HydrophobicContact CG-CB 4.46Å; L131-A173 PolarHBondContact N-O 3.22Å; L131-V176 HydrophobicContact CB-CB 3.96Å; L131-V176 HydrophobicContact CB-CG1 4.13Å; L131-V176 HydrophobicContact CD2-CB 4.25Å; L131-V176 HydrophobicContact CD2-CG1 4.08Å; L131-V176 PolarHBondContact N-O 3.4Å; L131-I178 HydrophobicContact CD1-CD1 4.09Å; L131-I239 HydrophobicContact CD2-CG2 3.56Å; L131-M243 HydrophobicContact CD1-CE 4.27Å; L131-M243 HydrophobicContact CD1-SD 3.8Å; L131-M243 HydrophobicContact CD2-SD 3.91Å; L131-M243 HydrophobicContact CG-SD 4.27Å
132	A	94.9	Very high	93.4	Very high	13 Å²	13	28.4 Å²	28.4	11%	0.107	16%	0.157	C	C	.	.	H	α-helix	trans	-62	-43.9	175.8	0	0	0	0	0	111.4	D130 L135 S136 A173 A174 E359	D130-A132 VanDerWaalsContact C-N 3.29Å; D130-A132 PolarHBondContact O-N 2.84Å; D130-A132 WeakPolarHBondContact OD1-CB 3.5Å; D130-A132 PolarHBondContact OD1-N 3.39Å; A132-L135 PolarHBondContact O-N 2.86Å; A132-S136 VanDerWaalsContact O-CB 3.31Å; A132-S136 WeakPolarHBondContact O-CB 3.44Å; A132-S136 PolarHBondContact O-N 3.28Å; A132-S136 PolarHBondContact O-OG 2.92Å; A132-A173 HydrophobicContact CB-CB 3.84Å; A132-A173 PolarHBondContact N-O 3.22Å; A132-A174 HydrophobicContact CB-CB 4.12Å; A132-E359 HydrophobicContact CB-CB 3.94Å; A132-E359 HydrophobicContact CB-CG 4.29Å
133	G	93.3	Very high	93.5	Very high	2 Å²	2	32 Å²	32	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-58.5	-48.7	173.6	0	0	0	0	0	112.1	D130 L131 L135 S136 N137	D130-G133 PolarHBondContact O-N 2.84Å; D130-G133 PolarHBondContact OD1-N 3.19Å; L131-G133 PolarHBondContact O-N 3.08Å; G133-L135 PolarHBondContact O-N 2.96Å; G133-S136 PolarHBondContact O-N 3.1Å; G133-S136 PolarHBondContact O-OG 2.95Å; G133-N137 PolarHBondContact O-N 3.35Å
134	L	93.8	Very high	93.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-44.6	176.8	-69.5	172.5	0	0	0	112.5	H129 D130 L131 S136 N137 V140 F142 I178 L350 M357	H129-L134 HydrophobicContact CB-CD1 3.94Å; H129-L134 HydrophobicContact CB-CD2 4.12Å; H129-L134 HydrophobicContact CB-CG 3.94Å; D130-L134 PolarHBondContact O-N 3.43Å; L131-L134 PolarHBondContact O-N 3.22Å; L134-S136 VanDerWaalsContact C-N 3.33Å; L134-S136 PolarHBondContact O-N 3.14Å; L134-N137 PolarHBondContact O-N 2.98Å; L134-V140 HydrophobicContact CB-CG1 4.41Å; L134-V140 HydrophobicContact CD2-CG1 4.32Å; L134-V140 HydrophobicContact CD2-CG2 4.08Å; L134-F142 HydrophobicContact CB-CE2 4.32Å; L134-F142 HydrophobicContact CB-CZ 4.1Å; L134-F142 HydrophobicContact CD1-CZ 4.16Å; L134-I178 HydrophobicContact CD1-CB 4.42Å; L134-I178 HydrophobicContact CD1-CD1 3.7Å; L134-L350 HydrophobicContact CD1-CD2 4.35Å; L134-L350 HydrophobicContact CD2-CD2 4.12Å; L134-M357 HydrophobicContact CD2-CB 4.4Å; L134-M357 HydrophobicContact CD2-CE 3.32Å; L134-M357 HydrophobicContact CD2-SD 3.95Å
135	L	93.8	Very high	93.6	Very high	4 Å²	4	34 Å²	34	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-34.4	-179.6	-68.1	175.3	0	0	0	112	L131 A132 G133 N137 F142 E242 M243 R246	L131-L135 HydrophobicContact CD1-CD1 4.4Å; L131-L135 HydrophobicContact CD1-CG 4.23Å; L131-L135 HydrophobicContact CD2-CD1 4.47Å; L131-L135 HydrophobicContact CG-CD1 3.92Å; L131-L135 HydrophobicContact CG-CG 4.19Å; L131-L135 WeakPolarHBondContact O-CB 3.47Å; L131-L135 WeakPolarHBondContact O-CG 3.36Å; L131-L135 PolarHBondContact O-N 2.91Å; A132-L135 PolarHBondContact O-N 2.86Å; G133-L135 PolarHBondContact O-N 2.96Å; L135-N137 VanDerWaalsContact C-N 3.29Å; L135-N137 PolarHBondContact O-N 3.28Å; L135-F142 HydrophobicContact CD2-CD2 4.36Å; L135-F142 HydrophobicContact CD2-CE2 4Å; L135-E242 HydrophobicContact CD1-CB 3.89Å; L135-M243 HydrophobicContact CD1-SD 4.43Å; L135-M243 HydrophobicContact CD2-SD 4.12Å; L135-R246 PolarHBondContact O-NH1 3.3Å; L135-R246 VanDerWaalsContact O-NH1 3.11Å
136	S	91.1	Very high	93.6	Very high	46 Å²	46	32.9 Å²	32.9	32%	0.322	19%	0.186	S	C	.	.	H	α-helix	trans	-68.7	-24.8	176.9	77.7	0	0	0	0	113.9	A132 G133 L134 A138	A132-S136 VanDerWaalsContact O-CB 3.31Å; A132-S136 WeakPolarHBondContact O-CB 3.44Å; A132-S136 PolarHBondContact O-N 3.28Å; A132-S136 PolarHBondContact O-OG 2.92Å; G133-S136 PolarHBondContact O-N 3.1Å; G133-S136 PolarHBondContact O-OG 2.95Å; L134-S136 VanDerWaalsContact C-N 3.33Å; L134-S136 PolarHBondContact O-N 3.14Å; S136-A138 PolarHBondContact O-N 3.42Å
137	N	88.9	Confident	93.7	Very high	45 Å²	45	32.4 Å²	32.4	24%	0.241	18%	0.184	C	C	.	.			trans	-83.4	111.6	178.5	-173.1	-9.2	0	0	0	110.7	G133 L134 L135 N139 V140 R246 M357	G133-N137 PolarHBondContact O-N 3.35Å; L134-N137 PolarHBondContact O-N 2.98Å; L135-N137 VanDerWaalsContact C-N 3.29Å; L135-N137 PolarHBondContact O-N 3.28Å; N137-N139 PolarHBondContact O-N 3.09Å; N137-N139 VanDerWaalsContact O-N 3.16Å; N137-N139 WeakPolarHBondContact OD1-CB 3.44Å; N137-N139 PolarHBondContact OD1-N 2.92Å; N137-V140 HydrophobicContact CB-CB 4.43Å; N137-V140 HydrophobicContact CB-CG2 3.86Å; N137-V140 PolarHBondContact O-N 3.05Å; N137-R246 PolarHBondContact O-NH1 3.05Å; N137-M357 HydrophobicContact CB-SD 4.03Å; N137-M357 PolarHBondContact ND2-SD 3.09Å
138	A	87.4	Confident	93.9	Very high	67 Å²	67	32 Å²	32	55%	0.554	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.2	180	0	0	0	0	0	113.8	S136 K141	S136-A138 PolarHBondContact O-N 3.42Å; A138-K141 VanDerWaalsContact O-CE 3.25Å; A138-K141 WeakPolarHBondContact O-CE 3.21Å; A138-K141 PolarHBondContact O-NZ 2.74Å
139	N	87.9	Confident	94.2	Very high	132 Å²	132	33.7 Å²	33.7	71%	0.706	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-24.5	179.8	-62	-31.2	0	0	0	112.9	N137 K141	N137-N139 PolarHBondContact O-N 3.09Å; N137-N139 VanDerWaalsContact O-N 3.16Å; N137-N139 WeakPolarHBondContact OD1-CB 3.44Å; N137-N139 PolarHBondContact OD1-N 2.92Å; N139-K141 PolarHBondContact O-N 2.99Å
140	V	90.1	Very high	94.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.187	C	C	.	.			trans	-72.2	127.4	171.2	175.2	0	0	0	0	107.2	L134 N137 F142 R246 M349 H353 M357	L134-V140 HydrophobicContact CB-CG1 4.41Å; L134-V140 HydrophobicContact CD2-CG1 4.32Å; L134-V140 HydrophobicContact CD2-CG2 4.08Å; N137-V140 HydrophobicContact CB-CB 4.43Å; N137-V140 HydrophobicContact CB-CG2 3.86Å; N137-V140 PolarHBondContact O-N 3.05Å; V140-F142 HydrophobicContact CG1-CD2 4.19Å; V140-F142 HydrophobicContact CG1-CE2 3.66Å; V140-F142 HydrophobicContact CG1-CZ 4.09Å; V140-R246 PolarHBondContact O-NH1 3.48Å; V140-R246 PolarHBondContact O-NH2 3.24Å; V140-M349 HydrophobicContact CG1-CE 4.35Å; V140-M349 HydrophobicContact CG1-SD 3.83Å; V140-H353 VanDerWaalsContact CG2-NE2 3.32Å; V140-H353 WeakPolarHBondContact CG2-NE2 3.28Å; V140-M357 HydrophobicContact CG2-CE 3.89Å; V140-M357 HydrophobicContact CG2-SD 3.69Å
141	K	89.1	Confident	94.5	Very high	137 Å²	137	33 Å²	33	60%	0.596	18%	0.184	S	C	*	.			trans	-125.3	130.4	173.7	-59.1	-60.2	-173.1	-161.7	0	109	A138 N139 M349	A138-K141 VanDerWaalsContact O-CE 3.25Å; A138-K141 WeakPolarHBondContact O-CE 3.21Å; A138-K141 PolarHBondContact O-NZ 2.74Å; N139-K141 PolarHBondContact O-N 2.99Å; K141-M349 WeakPolarHBondContact O-CG 3.43Å
142	F	94.7	Very high	94.7	Very high	25 Å²	25	34.5 Å²	34.5	11%	0.11	19%	0.192	C	C	.	.			trans	-100.2	130.8	173.3	-66.4	-90.4	0	0	0	109.4	L131 L134 L135 V140 E146 I147 V150 M243 M349	L131-F142 HydrophobicContact CD1-CZ 4.27Å; L134-F142 HydrophobicContact CB-CE2 4.32Å; L134-F142 HydrophobicContact CB-CZ 4.1Å; L134-F142 HydrophobicContact CD1-CZ 4.16Å; L135-F142 HydrophobicContact CD2-CD2 4.36Å; L135-F142 HydrophobicContact CD2-CE2 4Å; V140-F142 HydrophobicContact CG1-CD2 4.19Å; V140-F142 HydrophobicContact CG1-CE2 3.66Å; V140-F142 HydrophobicContact CG1-CZ 4.09Å; F142-E146 HydrophobicContact CD1-CB 4.36Å; F142-I147 HydrophobicContact CB-CD1 4.13Å; F142-I147 HydrophobicContact CB-CG1 3.65Å; F142-I147 HydrophobicContact CG-CG1 4.45Å; F142-V150 HydrophobicContact CE1-CG2 4.23Å; F142-M243 HydrophobicContact CD1-CE 3.91Å; F142-M243 HydrophobicContact CD2-CE 4.12Å; F142-M243 HydrophobicContact CE1-CE 4.03Å; F142-M243 HydrophobicContact CE2-CE 4.26Å; F142-M243 HydrophobicContact CG-CE 3.95Å; F142-M243 HydrophobicContact CZ-CE 4.21Å; F142-M349 HydrophobicContact CD1-CE 3.77Å; F142-M349 HydrophobicContact CE1-CE 3.34Å; F142-M349 HydrophobicContact CZ-CE 3.86Å
143	T	96.8	Very high	94.8	Very high	76 Å²	76	34.4 Å²	34.4	47%	0.466	19%	0.189	S	C	.	.			trans	-76.3	162.3	165.6	66.1	0	0	0	0	110.3	A145 E146 I147	T143-A145 VanDerWaalsContact C-N 3.29Å; T143-A145 PolarHBondContact O-N 2.79Å; T143-E146 PolarHBondContact N-OE2 3.34Å; T143-E146 PolarHBondContact O-N 3.41Å; T143-E146 WeakPolarHBondContact OG1-CB 3.4Å; T143-E146 VanDerWaalsContact OG1-CD 3.25Å; T143-E146 WeakPolarHBondContact OG1-CG 3.4Å; T143-E146 PolarHBondContact OG1-N 3.39Å; T143-E146 PolarHBondContact OG1-OE2 3.35Å; T143-I147 WeakPolarHBondContact O-CG1 3.37Å; T143-I147 PolarHBondContact O-N 2.75Å
144	L	97.9	Very high	95.1	Very high	45 Å²	45	34.3 Å²	34.3	24%	0.236	19%	0.188	C	C	.	.	H	α-helix	trans	-57.7	-41.8	177.1	178.5	59.3	0	0	0	112.3	E146 I147 K148 W244 D307 F336 P341	L144-E146 VanDerWaalsContact C-N 3.32Å; L144-E146 PolarHBondContact O-N 2.96Å; L144-I147 PolarHBondContact O-N 3.5Å; L144-K148 WeakPolarHBondContact O-CG 3.22Å; L144-K148 PolarHBondContact O-N 3.06Å; L144-W244 HydrophobicContact CD1-CZ2 4.02Å; L144-D307 HydrophobicContact CD1-CB 4.02Å; L144-D307 HydrophobicContact CD2-CB 3.94Å; L144-F336 HydrophobicContact CD1-CE2 3.89Å; L144-F336 HydrophobicContact CD1-CZ 4.46Å; L144-P341 HydrophobicContact CB-CG 4.23Å; L144-P341 HydrophobicContact CD2-CG 3.85Å; L144-P341 HydrophobicContact CG-CG 4.06Å
145	A	98.2	Very high	95.4	Very high	13 Å²	13	34.3 Å²	34.3	11%	0.107	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-37.3	178.4	0	0	0	0	0	112.4	T143 K148 K149 P341 M342 P343 S344	T143-A145 VanDerWaalsContact C-N 3.29Å; T143-A145 PolarHBondContact O-N 2.79Å; A145-K148 WeakPolarHBondContact O-CB 3.18Å; A145-K149 PolarHBondContact O-N 3.22Å; A145-P341 HydrophobicContact CB-CB 4.28Å; A145-P341 HydrophobicContact CB-CG 4.44Å; A145-M342 VanDerWaalsContact CB-O 3.29Å; A145-M342 WeakPolarHBondContact CB-O 3.11Å; A145-P343 WeakPolarHBondContact O-CA 3.22Å; A145-S344 WeakPolarHBondContact CB-OG 3.4Å; A145-S344 PolarHBondContact O-N 3.12Å
146	E	98	Very high	95.6	Very high	17 Å²	17	36.8 Å²	36.8	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-70.9	-40.6	174.8	-70.6	167.7	151.4	0	0	111.8	F142 T143 L144 K148 K149 V150 L346 M349	F142-E146 HydrophobicContact CD1-CB 4.36Å; T143-E146 PolarHBondContact N-OE2 3.34Å; T143-E146 PolarHBondContact O-N 3.41Å; T143-E146 WeakPolarHBondContact OG1-CB 3.4Å; T143-E146 VanDerWaalsContact OG1-CD 3.25Å; T143-E146 WeakPolarHBondContact OG1-CG 3.4Å; T143-E146 PolarHBondContact OG1-N 3.39Å; T143-E146 PolarHBondContact OG1-OE2 3.35Å; L144-E146 VanDerWaalsContact C-N 3.32Å; L144-E146 PolarHBondContact O-N 2.96Å; E146-K148 VanDerWaalsContact C-N 3.31Å; E146-K148 PolarHBondContact O-N 2.69Å; E146-K149 PolarHBondContact O-N 3.48Å; E146-K149 VanDerWaalsContact O-N 3.07Å; E146-V150 WeakPolarHBondContact O-CG2 3.38Å; E146-V150 PolarHBondContact O-N 3.01Å; E146-L346 HydrophobicContact CB-CD2 3.48Å; E146-L346 VanDerWaalsContact CB-CD2 3.48Å; E146-L346 HydrophobicContact CG-CD2 3.8Å; E146-M349 WeakPolarHBondContact OE1-CB 3.38Å
147	I	98.4	Very high	96	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-43.4	174.2	-62.7	172.4	0	0	0	110.4	F142 T143 L144 K149 V150 M151 M243 W244 F336	F142-I147 HydrophobicContact CB-CD1 4.13Å; F142-I147 HydrophobicContact CB-CG1 3.65Å; F142-I147 HydrophobicContact CG-CG1 4.45Å; T143-I147 WeakPolarHBondContact O-CG1 3.37Å; T143-I147 PolarHBondContact O-N 2.75Å; L144-I147 PolarHBondContact O-N 3.5Å; I147-K149 VanDerWaalsContact C-N 3.27Å; I147-K149 PolarHBondContact O-N 2.88Å; I147-V150 PolarHBondContact O-N 3.32Å; I147-M151 HydrophobicContact CG2-CG 4.34Å; I147-M151 WeakPolarHBondContact O-CG 3.46Å; I147-M151 PolarHBondContact O-N 3.15Å; I147-M243 HydrophobicContact CB-CE 4.44Å; I147-M243 HydrophobicContact CD1-CB 4.14Å; I147-M243 HydrophobicContact CG1-CB 4.21Å; I147-M243 HydrophobicContact CG1-CE 3.92Å; I147-M243 HydrophobicContact CG2-CB 3.79Å; I147-M243 HydrophobicContact CG2-CE 4.33Å; I147-M243 HydrophobicContact CG2-CG 3.96Å; I147-W244 HydrophobicContact CB-CH2 4.46Å; I147-W244 HydrophobicContact CB-CZ2 4.3Å; I147-W244 HydrophobicContact CD1-CD2 4.07Å; I147-W244 HydrophobicContact CD1-CG 4.46Å; I147-W244 HydrophobicContact CD1-CH2 4.47Å; I147-W244 HydrophobicContact CD1-CZ2 3.78Å; I147-W244 HydrophobicContact CG2-CH2 3.42Å; I147-W244 VanDerWaalsContact CG2-CH2 3.42Å; I147-W244 HydrophobicContact CG2-CZ2 3.71Å; I147-W244 HydrophobicContact CG2-CZ3 3.91Å; I147-F336 HydrophobicContact CG2-CZ 4.39Å
148	K	98.8	Very high	96.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-55.2	-44.3	172.1	-74.6	177.6	-179.5	-153.9	0	110.9	L144 A145 E146 M151 Q152 F336 F337 S339 P341 P343	L144-K148 WeakPolarHBondContact O-CG 3.22Å; L144-K148 PolarHBondContact O-N 3.06Å; A145-K148 WeakPolarHBondContact O-CB 3.18Å; E146-K148 VanDerWaalsContact C-N 3.31Å; E146-K148 PolarHBondContact O-N 2.69Å; K148-M151 PolarHBondContact O-N 2.93Å; K148-Q152 VanDerWaalsContact O-CB 3.25Å; K148-Q152 WeakPolarHBondContact O-CB 3.47Å; K148-Q152 PolarHBondContact O-N 3.16Å; K148-F336 HydrophobicContact CB-CE1 4.19Å; K148-F336 HydrophobicContact CB-CZ 4.15Å; K148-F336 HydrophobicContact CD-CE2 4.26Å; K148-F336 HydrophobicContact CD-CZ 4.46Å; K148-F336 WeakPolarHBondContact CD-O 3.44Å; K148-F336 WeakPolarHBondContact CE-O 3.31Å; K148-F336 HydrophobicContact CG-CD1 4.13Å; K148-F336 HydrophobicContact CG-CD2 4.05Å; K148-F336 HydrophobicContact CG-CE1 3.61Å; K148-F336 HydrophobicContact CG-CE2 3.5Å; K148-F336 VanDerWaalsContact CG-CE2 3.5Å; K148-F336 HydrophobicContact CG-CG 4.34Å; K148-F336 HydrophobicContact CG-CZ 3.27Å; K148-F336 PolarHBondContact NZ-O 3.48Å; K148-F337 HydrophobicContact CB-CD1 4.39Å; K148-F337 WeakPolarHBondContact O-CE1 3.42Å; K148-S339 PolarHBondContact NZ-O 2.76Å; K148-S339 PolarHBondContact NZ-OG 3.24Å; K148-P341 WeakPolarHBondContact CD-O 3.25Å; K148-P341 VanDerWaalsContact CE-O 3.27Å; K148-P341 WeakPolarHBondContact CE-O 3.19Å; K148-P341 PolarHBondContact NZ-O 3.04Å; K148-P343 HydrophobicContact CB-CB 4.07Å; K148-P343 HydrophobicContact CB-CG 4Å
149	K	98.6	Very high	97	Very high	65 Å²	65	33.1 Å²	33.1	28%	0.283	16%	0.163	S	C	.	.	H	α-helix	trans	-67.6	-41.9	179	-170.1	66.8	-175.2	174.1	0	113.5	A145 E146 I147 Q152 M153 P343 S344	A145-K149 PolarHBondContact O-N 3.22Å; E146-K149 PolarHBondContact O-N 3.48Å; E146-K149 VanDerWaalsContact O-N 3.07Å; I147-K149 VanDerWaalsContact C-N 3.27Å; I147-K149 PolarHBondContact O-N 2.88Å; K149-Q152 PolarHBondContact O-N 3.11Å; K149-M153 HydrophobicContact CG-CE 4.07Å; K149-M153 WeakPolarHBondContact O-CG 3.47Å; K149-M153 PolarHBondContact O-N 3.43Å; K149-P343 HydrophobicContact CB-CB 4.18Å; K149-P343 HydrophobicContact CD-CB 4.12Å; K149-S344 WeakPolarHBondContact CB-O 3.39Å; K149-S344 VanDerWaalsContact CG-O 3.28Å; K149-S344 WeakPolarHBondContact CG-O 3.34Å
150	V	98.6	Very high	97.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-55.9	-52.6	173.6	169.5	0	0	0	0	110.1	L131 F142 E146 I147 Q152 M153 L154 L184 M243 L346	L131-V150 HydrophobicContact CD2-CG1 4.47Å; F142-V150 HydrophobicContact CE1-CG2 4.23Å; E146-V150 WeakPolarHBondContact O-CG2 3.38Å; E146-V150 PolarHBondContact O-N 3.01Å; I147-V150 PolarHBondContact O-N 3.32Å; V150-Q152 PolarHBondContact O-N 3.27Å; V150-M153 PolarHBondContact O-N 2.94Å; V150-L154 WeakPolarHBondContact O-CB 3.22Å; V150-L154 PolarHBondContact O-N 3.22Å; V150-L184 HydrophobicContact CG1-CD1 3.91Å; V150-L184 WeakPolarHBondContact O-CD1 3.26Å; V150-M243 HydrophobicContact CB-CE 4.14Å; V150-M243 HydrophobicContact CG1-CE 3.99Å; V150-M243 HydrophobicContact CG1-SD 4.08Å; V150-M243 HydrophobicContact CG2-CE 4.06Å; V150-L346 HydrophobicContact CG2-CD1 3.62Å; V150-L346 HydrophobicContact CG2-CD2 3.95Å; V150-L346 HydrophobicContact CG2-CG 4.41Å
151	M	98.8	Very high	97.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-67.3	-36.4	-177.4	-69	-53	-52.2	0	0	112.6	I147 K148 L154 L155 M240 F336 F337	I147-M151 HydrophobicContact CG2-CG 4.34Å; I147-M151 WeakPolarHBondContact O-CG 3.46Å; I147-M151 PolarHBondContact O-N 3.15Å; K148-M151 PolarHBondContact O-N 2.93Å; M151-L154 HydrophobicContact CE-CD2 3.69Å; M151-L154 PolarHBondContact O-N 3.09Å; M151-L154 HydrophobicContact SD-CD2 4.04Å; M151-L155 WeakPolarHBondContact O-CB 3.48Å; M151-L155 VanDerWaalsContact O-CG 3.32Å; M151-L155 WeakPolarHBondContact O-CG 3.41Å; M151-L155 PolarHBondContact O-N 3.41Å; M151-M240 HydrophobicContact CE-CB 3.57Å; M151-M240 HydrophobicContact CE-CG 3.89Å; M151-M240 HydrophobicContact CE-SD 4Å; M151-M240 HydrophobicContact CG-CB 4.46Å; M151-M240 HydrophobicContact CG-CG 3.94Å; M151-M240 HydrophobicContact CG-SD 4.25Å; M151-M240 HydrophobicContact SD-CB 3.73Å; M151-M240 HydrophobicContact SD-CG 3.88Å; M151-F336 HydrophobicContact CB-CE1 4.31Å; M151-F337 HydrophobicContact CB-CE1 3.84Å; M151-F337 HydrophobicContact CB-CZ 3.83Å
152	Q	98.8	Very high	98.4	Very high	33 Å²	33	23 Å²	23	15%	0.154	11%	0.113	C	C	.	.	H	α-helix	trans	-60.4	-48.2	174.7	-177.5	-177.6	70.2	0	0	111.2	K148 K149 V150 L155 N156 L332 F337	K148-Q152 VanDerWaalsContact O-CB 3.25Å; K148-Q152 WeakPolarHBondContact O-CB 3.47Å; K148-Q152 PolarHBondContact O-N 3.16Å; K149-Q152 PolarHBondContact O-N 3.11Å; V150-Q152 PolarHBondContact O-N 3.27Å; Q152-L155 PolarHBondContact O-N 3.45Å; Q152-N156 VanDerWaalsContact O-CB 3.32Å; Q152-N156 WeakPolarHBondContact O-CB 3.24Å; Q152-N156 PolarHBondContact O-N 3.28Å; Q152-N156 PolarHBondContact O-ND2 3.24Å; Q152-L332 HydrophobicContact CG-CD2 4.21Å; Q152-F337 HydrophobicContact CB-CD1 3.9Å; Q152-F337 HydrophobicContact CB-CE1 3.85Å
153	M	98.8	Very high	98.5	Very high	11 Å²	11	30.5 Å²	30.5	5%	0.054	14%	0.14	C	C	.	.	H	α-helix	trans	-65.7	-38.1	177.6	-71.3	-170.5	-72.3	0	0	112.5	N98 K149 V150 G157 G182 L184 L346	N98-M153 WeakPolarHBondContact CB-O 3.45Å; N98-M153 WeakPolarHBondContact ND2-CB 3.35Å; K149-M153 HydrophobicContact CG-CE 4.07Å; K149-M153 WeakPolarHBondContact O-CG 3.47Å; K149-M153 PolarHBondContact O-N 3.43Å; V150-M153 PolarHBondContact O-N 2.94Å; M153-G157 PolarHBondContact O-N 3.48Å; M153-G182 WeakPolarHBondContact CE-O 3.19Å; M153-L184 HydrophobicContact CB-CB 3.8Å; M153-L184 HydrophobicContact CB-CD1 4.41Å; M153-L184 HydrophobicContact CB-CD2 4.29Å; M153-L184 HydrophobicContact CB-CG 4.4Å; M153-L184 HydrophobicContact CE-CB 3.64Å; M153-L184 HydrophobicContact SD-CB 3.92Å; M153-L184 PolarHBondContact SD-N 3.3Å; M153-L184 VanDerWaalsContact SD-N 3.41Å; M153-L346 HydrophobicContact CE-CD1 3.95Å
154	L	98.9	Very high	98.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.8	-51	176.6	-175.3	73.3	0	0	0	111	V150 M151 G157 L158 M171 V176 L184 L186 A236 I239	V150-L154 WeakPolarHBondContact O-CB 3.22Å; V150-L154 PolarHBondContact O-N 3.22Å; M151-L154 HydrophobicContact CE-CD2 3.69Å; M151-L154 PolarHBondContact O-N 3.09Å; M151-L154 HydrophobicContact SD-CD2 4.04Å; L154-G157 PolarHBondContact O-N 3.35Å; L154-L158 WeakPolarHBondContact O-CG 3.41Å; L154-L158 PolarHBondContact O-N 3.44Å; L154-M171 HydrophobicContact CD1-CE 3.93Å; L154-V176 HydrophobicContact CD1-CG1 4.13Å; L154-V176 HydrophobicContact CD1-CG2 3.64Å; L154-L184 HydrophobicContact CB-CD1 4.17Å; L154-L184 HydrophobicContact CB-CD2 4.44Å; L154-L184 HydrophobicContact CD1-CD1 4.5Å; L154-L184 HydrophobicContact CD1-CD2 4.31Å; L154-L186 HydrophobicContact CD1-CD2 3.53Å; L154-A236 HydrophobicContact CD2-CB 4.08Å; L154-I239 HydrophobicContact CD2-CG2 4.19Å
155	L	98.9	Very high	98.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.3	-36.7	-179.3	-68	169.1	0	0	0	112	M151 Q152 G157 L158 Y159 L233 A236 A331 L332 F337	M151-L155 WeakPolarHBondContact O-CB 3.48Å; M151-L155 VanDerWaalsContact O-CG 3.32Å; M151-L155 WeakPolarHBondContact O-CG 3.41Å; M151-L155 PolarHBondContact O-N 3.41Å; Q152-L155 PolarHBondContact O-N 3.45Å; L155-G157 VanDerWaalsContact C-N 3.34Å; L155-G157 PolarHBondContact O-N 2.91Å; L155-L158 PolarHBondContact O-N 3.38Å; L155-Y159 WeakPolarHBondContact O-CB 3.35Å; L155-Y159 PolarHBondContact O-N 3.38Å; L155-L233 HydrophobicContact CD2-CD1 3.71Å; L155-A236 HydrophobicContact CD2-CB 4.42Å; L155-A331 HydrophobicContact CD1-CB 3.78Å; L155-A331 HydrophobicContact CD2-CB 4.12Å; L155-L332 HydrophobicContact CB-CD1 4.42Å; L155-L332 HydrophobicContact CB-CD2 3.75Å; L155-L332 HydrophobicContact CB-CG 3.83Å; L155-F337 HydrophobicContact CD1-CE2 3.65Å; L155-F337 HydrophobicContact CD1-CZ 3.62Å
156	N	98.8	Very high	98.5	Very high	56 Å²	56	32 Å²	32	30%	0.299	14%	0.138	S	C	.	.	H	α-helix	trans	-60.6	-42.6	171	-84.4	-21.5	0	0	0	112	Q152 Y160 L332	Q152-N156 VanDerWaalsContact O-CB 3.32Å; Q152-N156 WeakPolarHBondContact O-CB 3.24Å; Q152-N156 PolarHBondContact O-N 3.28Å; Q152-N156 PolarHBondContact O-ND2 3.24Å; N156-Y160 WeakPolarHBondContact O-CB 3.28Å; N156-Y160 PolarHBondContact O-N 3.33Å; N156-L332 WeakPolarHBondContact OD1-CD1 3.45Å; N156-L332 VanDerWaalsContact OD1-CD2 3.3Å; N156-L332 WeakPolarHBondContact OD1-CD2 3.47Å
157	G	98.8	Very high	98.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.3	-45.9	173.4	0	0	0	0	0	112.1	M153 L154 L155 Y160 I161 L186	M153-G157 PolarHBondContact O-N 3.48Å; L154-G157 PolarHBondContact O-N 3.35Å; L155-G157 VanDerWaalsContact C-N 3.34Å; L155-G157 PolarHBondContact O-N 2.91Å; G157-Y160 PolarHBondContact O-N 2.75Å; G157-I161 WeakPolarHBondContact O-CG2 3.42Å; G157-I161 PolarHBondContact O-N 2.88Å; G157-I161 VanDerWaalsContact O-N 3.08Å; G157-L186 VanDerWaalsContact C-CD1 3.44Å
158	L	98.9	Very high	98.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.2	-47.7	177.7	-73	178.9	0	0	0	112	L154 L155 Y160 I161 H162 M171 L186 D232 L233 A236	L154-L158 WeakPolarHBondContact O-CG 3.41Å; L154-L158 PolarHBondContact O-N 3.44Å; L155-L158 PolarHBondContact O-N 3.38Å; L158-Y160 VanDerWaalsContact C-N 3.29Å; L158-Y160 PolarHBondContact O-N 3.25Å; L158-I161 HydrophobicContact CD2-CD1 3.9Å; L158-I161 HydrophobicContact CD2-CG1 4.49Å; L158-I161 WeakPolarHBondContact O-CG1 3.4Å; L158-I161 PolarHBondContact O-N 3.28Å; L158-H162 WeakPolarHBondContact O-CB 3.39Å; L158-H162 PolarHBondContact O-N 3.39Å; L158-H162 PolarHBondContact O-ND1 3.5Å; L158-M171 HydrophobicContact CD1-CE 4.43Å; L158-M171 HydrophobicContact CD2-CE 4.17Å; L158-M171 HydrophobicContact CD2-SD 3.87Å; L158-L186 HydrophobicContact CD2-CD1 4.03Å; L158-L186 HydrophobicContact CG-CD1 4.28Å; L158-D232 HydrophobicContact CD2-CB 3.94Å; L158-L233 HydrophobicContact CD1-CD1 4.28Å; L158-A236 HydrophobicContact CD1-CB 3.83Å
159	Y	98.8	Very high	98.5	Very high	81 Å²	81	31.3 Å²	31.3	32%	0.318	14%	0.135	S	C	.	.	H	α-helix	trans	-52.8	-48.6	174.2	175.3	-95.5	0	0	0	111.3	L155 I161 H162 R163 S328 D329	L155-Y159 WeakPolarHBondContact O-CB 3.35Å; L155-Y159 PolarHBondContact O-N 3.38Å; Y159-I161 PolarHBondContact O-N 3.46Å; Y159-H162 PolarHBondContact O-N 2.84Å; Y159-R163 VanDerWaalsContact O-CB 3.22Å; Y159-R163 WeakPolarHBondContact O-CB 3.48Å; Y159-R163 PolarHBondContact O-N 3.34Å; Y159-S328 VanDerWaalsContact CA-OG 3.26Å; Y159-S328 WeakPolarHBondContact CA-OG 3.39Å; Y159-S328 WeakPolarHBondContact CB-OG 3.46Å; Y159-D329 HydrophobicContact CD2-CB 4.03Å; Y159-D329 HydrophobicContact CE2-CB 3.96Å
160	Y	98.8	Very high	98.4	Very high	40 Å²	40	28.5 Å²	28.5	16%	0.157	12%	0.123	C	C	.	.	H	α-helix	trans	-60.5	-47.2	179.6	176.3	-93.8	0	0	0	112.5	L94 K95 H96 V99 N156 G157 L158 N164	L94-Y160 HydrophobicContact CB-CE1 4.07Å; L94-Y160 HydrophobicContact CD2-CD1 4.28Å; L94-Y160 HydrophobicContact CD2-CE1 3.7Å; L94-Y160 HydrophobicContact CG-CE1 4.47Å; K95-Y160 PolarHBondContact N-OH 2.91Å; K95-Y160 PolarHBondContact O-OH 2.76Å; H96-Y160 HydrophobicContact CB-CD1 3.46Å; H96-Y160 VanDerWaalsContact CB-CD1 3.46Å; H96-Y160 HydrophobicContact CB-CD2 3.92Å; H96-Y160 HydrophobicContact CB-CE1 3.52Å; H96-Y160 HydrophobicContact CB-CE2 3.97Å; H96-Y160 HydrophobicContact CB-CG 3.67Å; H96-Y160 AromaticContact CD2-CD2 3.52Å; H96-Y160 AromaticContact CD2-CG 3.69Å; H96-Y160 AromaticContact CG-CD1 3.89Å; H96-Y160 AromaticContact CG-CD2 3.84Å; H96-Y160 AromaticContact CG-CG 3.6Å; V99-Y160 HydrophobicContact CG2-CD1 4.11Å; N156-Y160 WeakPolarHBondContact O-CB 3.28Å; N156-Y160 PolarHBondContact O-N 3.33Å; G157-Y160 PolarHBondContact O-N 2.75Å; L158-Y160 VanDerWaalsContact C-N 3.29Å; L158-Y160 PolarHBondContact O-N 3.25Å; Y160-N164 WeakPolarHBondContact CE2-ND2 3.42Å; Y160-N164 PolarHBondContact O-N 3.08Å; Y160-N164 VanDerWaalsContact O-N 3.09Å; Y160-N164 PolarHBondContact O-ND2 2.99Å
161	I	98.7	Very high	98.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-69.1	-37.3	-179.1	67.6	172.3	0	0	0	111.6	L94 V99 G157 L158 Y159 N164 K165 I166 H168 L186 F189	L94-I161 HydrophobicContact CD1-CB 4.39Å; L94-I161 HydrophobicContact CD1-CG2 3.73Å; L94-I161 HydrophobicContact CD2-CG2 4.26Å; V99-I161 HydrophobicContact CG2-CG2 3.86Å; G157-I161 WeakPolarHBondContact O-CG2 3.42Å; G157-I161 PolarHBondContact O-N 2.88Å; G157-I161 VanDerWaalsContact O-N 3.08Å; L158-I161 HydrophobicContact CD2-CD1 3.9Å; L158-I161 HydrophobicContact CD2-CG1 4.49Å; L158-I161 WeakPolarHBondContact O-CG1 3.4Å; L158-I161 PolarHBondContact O-N 3.28Å; Y159-I161 PolarHBondContact O-N 3.46Å; I161-N164 CarbonylContact O-C 3.59Å; I161-N164 PolarHBondContact O-N 3.21Å; I161-K165 PolarHBondContact O-N 3.32Å; I161-I166 CarbonylContact C-O 3.52Å; I161-I166 HydrophobicContact CB-CB 4.35Å; I161-I166 PolarHBondContact O-N 2.9Å; I161-H168 HydrophobicContact CD1-CB 3.78Å; I161-L186 HydrophobicContact CD1-CD1 4.31Å; I161-F189 HydrophobicContact CD1-CE1 4.46Å; I161-F189 HydrophobicContact CG2-CE1 4.1Å; I161-F189 HydrophobicContact CG2-CZ 4.18Å
162	H	98.5	Very high	98.3	Very high	18 Å²	18	30.7 Å²	30.7	8%	0.083	13%	0.133	C	C	.	.	H	α-helix	trans	-68.2	-40.5	177.9	-65.6	157.4	0	0	0	111.5	L158 Y159 N164 K165 I166 P229 D232 L233	L158-H162 WeakPolarHBondContact O-CB 3.39Å; L158-H162 PolarHBondContact O-N 3.39Å; L158-H162 PolarHBondContact O-ND1 3.5Å; Y159-H162 PolarHBondContact O-N 2.84Å; H162-N164 PolarHBondContact O-N 3.48Å; H162-K165 WeakPolarHBondContact O-CA 3.34Å; H162-K165 PolarHBondContact O-N 2.86Å; H162-I166 PolarHBondContact CD2-O 3.42Å; H162-I166 VanDerWaalsContact CD2-O 3.3Å; H162-P229 HydrophobicContact CB-CB 4.38Å; H162-P229 HydrophobicContact CB-CG 4.31Å; H162-D232 IonicContact CD2-OD2 2.74Å; H162-D232 IonicContact CE1-OD2 3.16Å; H162-D232 IonicContact NE2-OD2 3.41Å; H162-D232 PolarHBondContact NE2-OD2 2.82Å; H162-L233 VanDerWaalsContact CE1-CD2 3.47Å; H162-L233 WeakPolarHBondContact CE1-CD2 3.03Å
163	R	97.8	Very high	98.2	Very high	181 Å²	181	29.1 Å²	29.1	68%	0.683	13%	0.125	S	C	*	.	H	α-helix	trans	-60.6	-34.6	172.1	-174	177.6	178	-145	0	112.2	Y159 K165	Y159-R163 VanDerWaalsContact O-CB 3.22Å; Y159-R163 WeakPolarHBondContact O-CB 3.48Å; Y159-R163 PolarHBondContact O-N 3.34Å; R163-K165 PolarHBondContact O-N 3.04Å
164	N	97.8	Very high	98	Very high	51 Å²	51	29.7 Å²	29.7	27%	0.273	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	13.7	172.3	-75.3	-80.6	0	0	0	113.6	L94 Y160 I161 H162 I166	L94-N164 HydrophobicContact CD2-CB 3.72Å; Y160-N164 WeakPolarHBondContact CE2-ND2 3.42Å; Y160-N164 PolarHBondContact O-N 3.08Å; Y160-N164 VanDerWaalsContact O-N 3.09Å; Y160-N164 PolarHBondContact O-ND2 2.99Å; I161-N164 CarbonylContact O-C 3.59Å; I161-N164 PolarHBondContact O-N 3.21Å; H162-N164 PolarHBondContact O-N 3.48Å; N164-I166 VanDerWaalsContact C-N 3.3Å; N164-I166 PolarHBondContact O-N 3.35Å
165	K	97.4	Very high	97.9	Very high	110 Å²	110	30.4 Å²	30.4	48%	0.478	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	33.2	176.6	-54.6	178.7	-176.6	175.3	0	113.7	I161 H162 R163 A194 F195	I161-K165 PolarHBondContact O-N 3.32Å; H162-K165 WeakPolarHBondContact O-CA 3.34Å; H162-K165 PolarHBondContact O-N 2.86Å; R163-K165 PolarHBondContact O-N 3.04Å; K165-A194 CarbonylContact O-C 3.14Å; K165-A194 WeakPolarHBondContact O-CA 3.37Å; K165-F195 HydrophobicContact CB-CD1 4.42Å; K165-F195 HydrophobicContact CB-CE1 4.28Å; K165-F195 WeakPolarHBondContact O-CD1 3.34Å; K165-F195 PolarHBondContact O-N 3.39Å
166	I	98.3	Very high	97.9	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.026	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.7	177	-58	-54.5	0	0	0	110.3	I90 L94 I161 H162 N164 A192 A194	I90-I166 HydrophobicContact CD1-CD1 4.22Å; I90-I166 HydrophobicContact CD1-CG2 4.21Å; I90-I166 HydrophobicContact CG1-CD1 3.95Å; I90-I166 HydrophobicContact CG2-CG1 4.34Å; I90-I166 HydrophobicContact CG2-CG2 3.94Å; L94-I166 HydrophobicContact CD1-CG1 4.47Å; L94-I166 HydrophobicContact CD1-CG2 4.43Å; L94-I166 HydrophobicContact CD2-CG1 4.2Å; I161-I166 CarbonylContact C-O 3.52Å; I161-I166 HydrophobicContact CB-CB 4.35Å; I161-I166 PolarHBondContact O-N 2.9Å; H162-I166 PolarHBondContact CD2-O 3.42Å; H162-I166 VanDerWaalsContact CD2-O 3.3Å; N164-I166 VanDerWaalsContact C-N 3.3Å; N164-I166 PolarHBondContact O-N 3.35Å; I166-A192 HydrophobicContact CG2-CB 4.13Å; I166-A194 HydrophobicContact CD1-CB 3.89Å
167	L	98.3	Very high	97.8	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	136.5	165.5	-55.1	179.3	0	0	0	109.5	R169 A192 R193 F195 Y227 G228 P229 I231	L167-R169 HydrophobicContact CB-CG 3.59Å; L167-A192 CarbonylContact O-C 3.58Å; L167-A192 WeakPolarHBondContact O-CA 3.39Å; L167-A192 WeakPolarHBondContact O-CB 3.3Å; L167-R193 PolarHBondContact N-O 3.46Å; L167-R193 PolarHBondContact O-N 3.19Å; L167-F195 HydrophobicContact CD1-CB 4Å; L167-F195 HydrophobicContact CD1-CD1 4.5Å; L167-F195 HydrophobicContact CD1-CG 4.43Å; L167-F195 HydrophobicContact CD2-CB 4.48Å; L167-F195 HydrophobicContact CD2-CD1 3.53Å; L167-F195 HydrophobicContact CD2-CE1 3.83Å; L167-F195 HydrophobicContact CD2-CG 4.04Å; L167-F195 HydrophobicContact CG-CB 3.97Å; L167-F195 HydrophobicContact CG-CD1 3.62Å; L167-F195 HydrophobicContact CG-CE1 4.38Å; L167-F195 HydrophobicContact CG-CG 4.02Å; L167-Y227 HydrophobicContact CD1-CD2 3.9Å; L167-Y227 HydrophobicContact CD1-CE2 3.89Å; L167-G228 VanDerWaalsContact CD2-C 3.45Å; L167-P229 HydrophobicContact CD2-CB 4.44Å; L167-P229 HydrophobicContact CD2-CG 4.01Å; L167-P229 VanDerWaalsContact CD2-N 3.32Å; L167-I231 HydrophobicContact CD1-CD1 4.41Å
168	H	98.3	Very high	97.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.13	C	C	.	.			trans	-74.3	-50.8	177.6	-169.4	-94	0	0	0	111.5	I161 D170 M171 A187 F189 L191 A192 D232	I161-H168 HydrophobicContact CD1-CB 3.78Å; H168-D170 PolarHBondContact CE1-O 3.31Å; H168-D170 VanDerWaalsContact CE1-O 3.31Å; H168-D170 VanDerWaalsContact ND1-C 3.31Å; H168-D170 PolarHBondContact ND1-N 3.04Å; H168-D170 PolarHBondContact ND1-O 3.29Å; H168-D170 PolarHBondContact O-N 3.31Å; H168-D170 VanDerWaalsContact O-N 3.16Å; H168-M171 HydrophobicContact CB-CG 4.38Å; H168-M171 HydrophobicContact CB-SD 3.92Å; H168-M171 PolarHBondContact ND1-N 2.76Å; H168-M171 PolarHBondContact ND1-SD 3.34Å; H168-M171 VanDerWaalsContact ND1-SD 3.4Å; H168-A187 PolarHBondContact CE1-O 3.2Å; H168-A187 PolarHBondContact NE2-O 3.27Å; H168-F189 AromaticContact CD2-CE1 3.81Å; H168-F189 AromaticContact CD2-CZ 3.92Å; H168-L191 CarbonylContact O-C 3.56Å; H168-A192 WeakPolarHBondContact O-CA 3.39Å; H168-A192 PolarHBondContact O-N 3.42Å; H168-D232 WeakPolarHBondContact CB-OD1 3.45Å; H168-D232 PolarHBondContact N-OD2 3.19Å
169	R	97.6	Very high	97.5	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.015	14%	0.136	C	C	.	.			trans	63.7	9.6	175.2	-42.7	-165.8	-64.1	159.1	4.8	116.4	L167 L191 V210 V211 Y227 I231 D232	L167-R169 HydrophobicContact CB-CG 3.59Å; R169-L191 PolarHBondContact NE-O 2.98Å; R169-L191 PolarHBondContact NH2-O 2.84Å; R169-V210 HydrophobicContact CB-CB 4.22Å; R169-V210 HydrophobicContact CB-CG2 4.23Å; R169-V211 WeakPolarHBondContact O-CA 3.27Å; R169-V211 WeakPolarHBondContact O-CG2 3.46Å; R169-V211 PolarHBondContact O-N 2.96Å; R169-Y227 PolarHBondContact NH1-OH 2.97Å; R169-I231 HydrophobicContact CB-CD1 4.41Å; R169-I231 HydrophobicContact CG-CD1 3.88Å; R169-D232 PolarHBondContact N-OD1 3.5Å
170	D	96.6	Very high	97.1	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.032	15%	0.148	C	C	.	.			trans	-144.3	51.1	167.1	-161.9	33.6	0	0	0	111.7	H168 K172 N175 L191 T212	H168-D170 PolarHBondContact CE1-O 3.31Å; H168-D170 VanDerWaalsContact CE1-O 3.31Å; H168-D170 VanDerWaalsContact ND1-C 3.31Å; H168-D170 PolarHBondContact ND1-N 3.04Å; H168-D170 PolarHBondContact ND1-O 3.29Å; H168-D170 PolarHBondContact O-N 3.31Å; H168-D170 VanDerWaalsContact O-N 3.16Å; D170-K172 PolarHBondContact O-N 3.42Å; D170-K172 IonicContact OD1-NZ 2.91Å; D170-K172 WeakPolarHBondContact OD2-CE 3.15Å; D170-K172 IonicContact OD2-NZ 2.73Å; D170-K172 PolarHBondContact OD2-NZ 3.07Å; D170-N175 PolarHBondContact O-ND2 2.89Å; D170-N175 PolarHBondContact OD2-ND2 2.78Å; D170-L191 HydrophobicContact CB-CB 4.29Å; D170-L191 HydrophobicContact CB-CD1 4.06Å; D170-T212 PolarHBondContact OD1-N 3.41Å; D170-T212 PolarHBondContact OD1-OG1 2.83Å
171	M	98.1	Very high	96.7	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.015	17%	0.166	C	C	.	.			trans	-67.1	125.1	172.8	-67.7	-52.3	-62.3	0	0	110.3	L154 L158 H168 L186 Y215 D232 I239	L154-M171 HydrophobicContact CD1-CE 3.93Å; L158-M171 HydrophobicContact CD1-CE 4.43Å; L158-M171 HydrophobicContact CD2-CE 4.17Å; L158-M171 HydrophobicContact CD2-SD 3.87Å; H168-M171 HydrophobicContact CB-CG 4.38Å; H168-M171 HydrophobicContact CB-SD 3.92Å; H168-M171 PolarHBondContact ND1-N 2.76Å; H168-M171 PolarHBondContact ND1-SD 3.34Å; H168-M171 VanDerWaalsContact ND1-SD 3.4Å; M171-L186 HydrophobicContact CE-CD2 3.81Å; M171-L186 HydrophobicContact SD-CD2 4.31Å; M171-Y215 WeakPolarHBondContact O-CB 3.1Å; M171-Y215 VanDerWaalsContact O-CG 3.26Å; M171-D232 HydrophobicContact CG-CB 3.91Å; M171-I239 HydrophobicContact CE-CD1 4.01Å
172	K	96.8	Very high	96.6	Very high	44 Å²	44	36.8 Å²	36.8	19%	0.191	17%	0.168	C	C	.	.			trans	-164.6	158.9	172.9	58.6	-173.9	173.2	-151.2	0	109.2	D170 A174 N175 Y215	D170-K172 PolarHBondContact O-N 3.42Å; D170-K172 IonicContact OD1-NZ 2.91Å; D170-K172 WeakPolarHBondContact OD2-CE 3.15Å; D170-K172 IonicContact OD2-NZ 2.73Å; D170-K172 PolarHBondContact OD2-NZ 3.07Å; K172-A174 HydrophobicContact CD-CB 4.39Å; K172-A174 HydrophobicContact CG-CB 4.32Å; K172-A174 PolarHBondContact O-N 3.02Å; K172-N175 VanDerWaalsContact CE-ND2 3.26Å; K172-N175 WeakPolarHBondContact CE-ND2 3.29Å; K172-N175 WeakPolarHBondContact CE-OD1 3.42Å; K172-N175 HydrophobicContact CG-CB 3.96Å; K172-N175 PolarHBondContact O-N 3.14Å; K172-Y215 HydrophobicContact CB-CD1 4.38Å; K172-Y215 HydrophobicContact CB-CD2 3.57Å; K172-Y215 HydrophobicContact CB-CE1 4.24Å; K172-Y215 HydrophobicContact CB-CE2 3.39Å; K172-Y215 HydrophobicContact CB-CG 4.07Å
173	A	96.9	Very high	96.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-57.6	-35.1	-178.8	0	0	0	0	0	113	L131 A132 N175 V176	L131-A173 HydrophobicContact CB-CB 4.35Å; L131-A173 WeakPolarHBondContact CB-O 3.22Å; L131-A173 HydrophobicContact CG-CB 4.46Å; L131-A173 PolarHBondContact N-O 3.22Å; A132-A173 HydrophobicContact CB-CB 3.84Å; A132-A173 PolarHBondContact N-O 3.22Å; A173-N175 PolarHBondContact O-N 3.34Å; A173-V176 PolarHBondContact O-N 2.85Å; A173-V176 VanDerWaalsContact O-N 3.14Å
174	A	95.1	Very high	96.5	Very high	23 Å²	23	28.8 Å²	28.8	19%	0.19	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-65.9	-21.1	177.4	0	0	0	0	0	114.5	A132 K172 E359	A132-A174 HydrophobicContact CB-CB 4.12Å; K172-A174 HydrophobicContact CD-CB 4.39Å; K172-A174 HydrophobicContact CG-CB 4.32Å; K172-A174 PolarHBondContact O-N 3.02Å; A174-E359 WeakPolarHBondContact CB-OE2 3.37Å
175	N	96.9	Very high	96.5	Very high	15 Å²	15	28 Å²	28	8%	0.08	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-95.4	5	177.8	-76.4	2.9	0	0	0	112.6	D170 K172 A173 A187	D170-N175 PolarHBondContact O-ND2 2.89Å; D170-N175 PolarHBondContact OD2-ND2 2.78Å; K172-N175 VanDerWaalsContact CE-ND2 3.26Å; K172-N175 WeakPolarHBondContact CE-ND2 3.29Å; K172-N175 WeakPolarHBondContact CE-OD1 3.42Å; K172-N175 HydrophobicContact CG-CB 3.96Å; K172-N175 PolarHBondContact O-N 3.14Å; A173-N175 PolarHBondContact O-N 3.34Å; N175-A187 PolarHBondContact O-N 3.43Å
176	V	98.2	Very high	96.6	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	103	174.2	179.7	0	0	0	0	107.5	D130 L131 L154 A173 L184 I239	D130-V176 CarbonylContact C-O 3.27Å; D130-V176 WeakPolarHBondContact CA-O 3.07Å; L131-V176 HydrophobicContact CB-CB 3.96Å; L131-V176 HydrophobicContact CB-CG1 4.13Å; L131-V176 HydrophobicContact CD2-CB 4.25Å; L131-V176 HydrophobicContact CD2-CG1 4.08Å; L131-V176 PolarHBondContact N-O 3.4Å; L154-V176 HydrophobicContact CD1-CG1 4.13Å; L154-V176 HydrophobicContact CD1-CG2 3.64Å; A173-V176 PolarHBondContact O-N 2.85Å; A173-V176 VanDerWaalsContact O-N 3.14Å; V176-L184 HydrophobicContact CG1-CD1 3.38Å; V176-L184 HydrophobicContact CG1-CD2 4.08Å; V176-L184 HydrophobicContact CG1-CG 3.61Å; V176-I239 HydrophobicContact CG2-CD1 4.07Å
177	L	97.8	Very high	96.5	Very high	32 Å²	32	23.1 Å²	23.1	17%	0.168	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	151.7	-178.8	-53.5	-178.3	0	0	0	110.7	C127 H129 D130 L184 K185 A187	C127-L177 HydrophobicContact CB-CB 3.66Å; C127-L177 HydrophobicContact CB-CD1 4.06Å; C127-L177 HydrophobicContact CB-CG 4.43Å; H129-L177 CarbonylContact O-C 3.58Å; H129-L177 WeakPolarHBondContact O-CA 3.13Å; D130-L177 HydrophobicContact CB-CD2 3.72Å; L177-L184 CarbonylContact O-C 3.47Å; L177-L184 VanDerWaalsContact O-CA 3.28Å; L177-L184 WeakPolarHBondContact O-CA 3.41Å; L177-K185 HydrophobicContact CB-CB 4.3Å; L177-K185 PolarHBondContact N-O 3Å; L177-K185 PolarHBondContact O-N 3.2Å; L177-A187 HydrophobicContact CD1-CB 3.46Å; L177-A187 VanDerWaalsContact CD1-CB 3.46Å; L177-A187 HydrophobicContact CG-CB 3.6Å
178	I	96.7	Very high	96.3	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	126.6	174.3	-64.2	170.1	0	0	0	108.6	E128 H129 L131 L134 L184 L346 L350	E128-I178 PolarHBondContact N-O 3.47Å; H129-I178 PolarHBondContact N-O 2.72Å; H129-I178 VanDerWaalsContact N-O 3.07Å; H129-I178 PolarHBondContact O-N 3.23Å; L131-I178 HydrophobicContact CD1-CD1 4.09Å; L134-I178 HydrophobicContact CD1-CB 4.42Å; L134-I178 HydrophobicContact CD1-CD1 3.7Å; I178-L184 HydrophobicContact CG1-CB 4.29Å; I178-L346 HydrophobicContact CD1-CD1 4.32Å; I178-L346 HydrophobicContact CG2-CD1 4.35Å; I178-L350 HydrophobicContact CG2-CD1 3.51Å
179	T	94.8	Very high	96.2	Very high	20 Å²	20	25 Å²	25	12%	0.123	13%	0.125	C	C	.	.			trans	-73.6	161.9	174.9	62.8	0	0	0	0	110.9	C127 E128 D181 G182 V183 K185	C127-T179 HydrophobicContact CB-CG2 4.4Å; E128-T179 WeakPolarHBondContact OE2-CA 3.21Å; T179-D181 PolarHBondContact O-N 3.4Å; T179-D181 VanDerWaalsContact O-N 3.14Å; T179-G182 PolarHBondContact O-N 3.07Å; T179-V183 HydrophobicContact CG2-CB 4.48Å; T179-V183 PolarHBondContact N-O 2.85Å; T179-V183 WeakPolarHBondContact OG1-CB 3.33Å; T179-V183 PolarHBondContact OG1-N 3.34Å; T179-V183 PolarHBondContact OG1-O 2.84Å; T179-V183 VanDerWaalsContact OG1-O 3.09Å; T179-K185 HydrophobicContact CG2-CG 4.26Å
180	R	90.1	Very high	95.9	Very high	153 Å²	153	24.9 Å²	24.9	58%	0.577	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-32.7	173.8	-173	178.5	-175.4	-159.5	0.2	113.2	E128 G182	E128-R180 HydrophobicContact CG-CB 3.96Å; E128-R180 PolarHBondContact OE2-N 3.14Å; R180-G182 PolarHBondContact O-N 2.91Å
181	D	91.2	Very high	95.7	Very high	101 Å²	101	26.5 Å²	26.5	54%	0.54	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	8.1	-178.3	-61.8	-48.3	0	0	0	113.1	T179	T179-D181 PolarHBondContact O-N 3.4Å; T179-D181 VanDerWaalsContact O-N 3.14Å
182	G	94.6	Very high	95.6	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.031	13%	0.132	C	C	.	.	S	Bend	trans	84.3	7.3	175.5	0	0	0	0	0	115.3	M153 T179 R180	M153-G182 WeakPolarHBondContact CE-O 3.19Å; T179-G182 PolarHBondContact O-N 3.07Å; R180-G182 PolarHBondContact O-N 2.91Å
183	V	97.1	Very high	95.5	Very high	31 Å²	31	26.8 Å²	26.8	19%	0.188	13%	0.133	C	C	.	.			trans	-84.8	122.7	176.2	-174.9	0	0	0	0	110.2	E97 T179	E97-V183 HydrophobicContact CG-CG1 3.76Å; T179-V183 HydrophobicContact CG2-CB 4.48Å; T179-V183 PolarHBondContact N-O 2.85Å; T179-V183 WeakPolarHBondContact OG1-CB 3.33Å; T179-V183 PolarHBondContact OG1-N 3.34Å; T179-V183 PolarHBondContact OG1-O 2.84Å; T179-V183 VanDerWaalsContact OG1-O 3.09Å
184	L	98.3	Very high	95.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	140.8	174.3	177.8	156.4	0	0	0	110.9	N98 V150 M153 L154 V176 L177 I178	N98-L184 VanDerWaalsContact CA-O 3.22Å; N98-L184 WeakPolarHBondContact CA-O 3.44Å; N98-L184 PolarHBondContact ND2-O 3.14Å; V150-L184 HydrophobicContact CG1-CD1 3.91Å; V150-L184 WeakPolarHBondContact O-CD1 3.26Å; M153-L184 HydrophobicContact CB-CB 3.8Å; M153-L184 HydrophobicContact CB-CD1 4.41Å; M153-L184 HydrophobicContact CB-CD2 4.29Å; M153-L184 HydrophobicContact CB-CG 4.4Å; M153-L184 HydrophobicContact CE-CB 3.64Å; M153-L184 HydrophobicContact SD-CB 3.92Å; M153-L184 PolarHBondContact SD-N 3.3Å; M153-L184 VanDerWaalsContact SD-N 3.41Å; L154-L184 HydrophobicContact CB-CD1 4.17Å; L154-L184 HydrophobicContact CB-CD2 4.44Å; L154-L184 HydrophobicContact CD1-CD1 4.5Å; L154-L184 HydrophobicContact CD1-CD2 4.31Å; V176-L184 HydrophobicContact CG1-CD1 3.38Å; V176-L184 HydrophobicContact CG1-CD2 4.08Å; V176-L184 HydrophobicContact CG1-CG 3.61Å; L177-L184 CarbonylContact O-C 3.47Å; L177-L184 VanDerWaalsContact O-CA 3.28Å; L177-L184 WeakPolarHBondContact O-CA 3.41Å; I178-L184 HydrophobicContact CG1-CB 4.29Å
185	K	98.6	Very high	95.3	Very high	36 Å²	36	29.7 Å²	29.7	16%	0.157	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	122.2	178.4	-58.5	-87.5	-179.5	-170	0	109.9	E97 V99 L177 T179	E97-K185 VanDerWaalsContact O-CD 3.26Å; E97-K185 WeakPolarHBondContact O-CD 3.44Å; E97-K185 VanDerWaalsContact O-CE 3.24Å; E97-K185 WeakPolarHBondContact O-CE 3.29Å; E97-K185 PolarHBondContact O-NZ 3.04Å; V99-K185 WeakPolarHBondContact O-CD 3.42Å; L177-K185 HydrophobicContact CB-CB 4.3Å; L177-K185 PolarHBondContact N-O 3Å; L177-K185 PolarHBondContact O-N 3.2Å; T179-K185 HydrophobicContact CG2-CG 4.26Å
186	L	98.7	Very high	94.8	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	132.4	164.6	-68	178.1	0	0	0	109.7	N98 V100 L154 G157 L158 I161 M171 F189	N98-L186 PolarHBondContact O-N 2.94Å; V100-L186 WeakPolarHBondContact CB-O 2.97Å; V100-L186 PolarHBondContact N-O 3.39Å; L154-L186 HydrophobicContact CD1-CD2 3.53Å; G157-L186 VanDerWaalsContact C-CD1 3.44Å; L158-L186 HydrophobicContact CD2-CD1 4.03Å; L158-L186 HydrophobicContact CG-CD1 4.28Å; I161-L186 HydrophobicContact CD1-CD1 4.31Å; M171-L186 HydrophobicContact CE-CD2 3.81Å; M171-L186 HydrophobicContact SD-CD2 4.31Å; L186-F189 HydrophobicContact CB-CE2 4.47Å; L186-F189 HydrophobicContact CB-CZ 4.33Å
187	A	96.9	Very high	93.8	Very high	10 Å²	10	37.2 Å²	37.2	8%	0.083	20%	0.197	C	C	.	.			trans	-135.9	168.5	-175.6	0	0	0	0	0	113.1	V100 H168 N175 L177	V100-A187 HydrophobicContact CB-CB 4.33Å; V100-A187 HydrophobicContact CG1-CB 4.38Å; H168-A187 PolarHBondContact CE1-O 3.2Å; H168-A187 PolarHBondContact NE2-O 3.27Å; N175-A187 PolarHBondContact O-N 3.43Å; L177-A187 HydrophobicContact CD1-CB 3.46Å; L177-A187 VanDerWaalsContact CD1-CB 3.46Å; L177-A187 HydrophobicContact CG-CB 3.6Å
188	D	93.5	Very high	92.2	Very high	42 Å²	42	37.8 Å²	37.8	23%	0.225	21%	0.206	C	C	.	.			trans	61.3	73.4	-178.1	-159.6	12.5	0	0	0	114.9	K69 G190	K69-D188 IonicContact NZ-OD1 2.65Å; K69-D188 PolarHBondContact NZ-OD1 3.23Å; D188-G190 PolarHBondContact O-N 3.05Å; D188-G190 PolarHBondContact OD1-N 3.41Å
189	F	95.6	Very high	90.3	Very high	1 Å²	1	47.8 Å²	47.8	0%	0.004	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-83.2	15.9	175.4	-72.1	-100.4	0	0	0	112.9	E87 I90 L91 L94 V99 V100 I161 H168 L186 L191 A192	E87-F189 HydrophobicContact CG-CB 4.27Å; I90-F189 HydrophobicContact CG2-CB 4.4Å; I90-F189 HydrophobicContact CG2-CD1 3.7Å; I90-F189 HydrophobicContact CG2-CE1 4.38Å; I90-F189 HydrophobicContact CG2-CG 4.3Å; L91-F189 HydrophobicContact CD2-CB 4.43Å; L91-F189 HydrophobicContact CD2-CD2 3.76Å; L91-F189 HydrophobicContact CD2-CE2 4.34Å; L91-F189 HydrophobicContact CD2-CG 4.22Å; L91-F189 HydrophobicContact CG-CB 4.38Å; L94-F189 HydrophobicContact CD1-CD1 4Å; L94-F189 HydrophobicContact CD1-CE1 3.44Å; L94-F189 VanDerWaalsContact CD1-CE1 3.44Å; L94-F189 HydrophobicContact CD1-CZ 3.95Å; V99-F189 HydrophobicContact CG1-CE2 3.79Å; V99-F189 HydrophobicContact CG1-CZ 3.7Å; V100-F189 HydrophobicContact CG1-CD2 4.36Å; V100-F189 HydrophobicContact CG1-CE2 4.28Å; I161-F189 HydrophobicContact CD1-CE1 4.46Å; I161-F189 HydrophobicContact CG2-CE1 4.1Å; I161-F189 HydrophobicContact CG2-CZ 4.18Å; H168-F189 AromaticContact CD2-CE1 3.81Å; H168-F189 AromaticContact CD2-CZ 3.92Å; L186-F189 HydrophobicContact CB-CE2 4.47Å; L186-F189 HydrophobicContact CB-CZ 4.33Å; F189-L191 PolarHBondContact O-N 3.06Å; F189-A192 HydrophobicContact CB-CB 3.83Å; F189-A192 HydrophobicContact CD1-CB 3.62Å; F189-A192 HydrophobicContact CG-CB 4.18Å; F189-A192 VanDerWaalsContact O-CB 3.29Å; F189-A192 WeakPolarHBondContact O-CB 3.31Å; F189-A192 PolarHBondContact O-N 3.38Å
190	G	91.9	Very high	88.3	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.01	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-59.8	-29.8	-179.3	0	0	0	0	0	113.8	E87 D188	E87-G190 WeakPolarHBondContact OE2-CA 3.45Å; D188-G190 PolarHBondContact O-N 3.05Å; D188-G190 PolarHBondContact OD1-N 3.41Å
191	L	92.8	Very high	86.8	Confident	39 Å²	39	52 Å²	52	20%	0.204	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-99.9	-1.7	173	-73.8	179.9	0	0	0	113.8	F51 H168 R169 D170 F189	F51-L191 HydrophobicContact CE1-CD2 4.16Å; F51-L191 HydrophobicContact CE2-CD1 4.03Å; F51-L191 HydrophobicContact CE2-CD2 4.03Å; F51-L191 HydrophobicContact CE2-CG 3.6Å; F51-L191 HydrophobicContact CZ-CD1 4.14Å; F51-L191 HydrophobicContact CZ-CD2 3.38Å; F51-L191 HydrophobicContact CZ-CG 3.52Å; H168-L191 CarbonylContact O-C 3.56Å; R169-L191 PolarHBondContact NE-O 2.98Å; R169-L191 PolarHBondContact NH2-O 2.84Å; D170-L191 HydrophobicContact CB-CB 4.29Å; D170-L191 HydrophobicContact CB-CD1 4.06Å; F189-L191 PolarHBondContact O-N 3.06Å
192	A	95.4	Very high	85.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.306	C	S	.	.			trans	-64.4	158.3	-177.8	0	0	0	0	0	112.3	R86 I90 I166 L167 H168 F189	R86-A192 WeakPolarHBondContact CD-O 3.43Å; I90-A192 HydrophobicContact CD1-CB 3.71Å; I166-A192 HydrophobicContact CG2-CB 4.13Å; L167-A192 CarbonylContact O-C 3.58Å; L167-A192 WeakPolarHBondContact O-CA 3.39Å; L167-A192 WeakPolarHBondContact O-CB 3.3Å; H168-A192 WeakPolarHBondContact O-CA 3.39Å; H168-A192 PolarHBondContact O-N 3.42Å; F189-A192 HydrophobicContact CB-CB 3.83Å; F189-A192 HydrophobicContact CD1-CB 3.62Å; F189-A192 HydrophobicContact CG-CB 4.18Å; F189-A192 VanDerWaalsContact O-CB 3.29Å; F189-A192 WeakPolarHBondContact O-CB 3.31Å; F189-A192 PolarHBondContact O-N 3.38Å
193	R	94.8	Very high	84.6	Confident	54 Å²	54	57.5 Å²	57.5	20%	0.204	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	143.5	177.9	-174.9	174.8	-72.9	175.8	1	111.9	R86 L167 T207	R86-R193 VanDerWaalsContact NH1-NH2 3.15Å; L167-R193 PolarHBondContact N-O 3.46Å; L167-R193 PolarHBondContact O-N 3.19Å; R193-T207 PolarHBondContact NH1-OG1 2.75Å; R193-T207 VanDerWaalsContact NH1-OG1 3.11Å; R193-T207 PolarHBondContact NH2-OG1 2.61Å
194	A	94.3	Very high	84	Confident	62 Å²	62	58 Å²	58	51%	0.512	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	135.6	169	0	0	0	0	0	111.1	K165 I166	K165-A194 CarbonylContact O-C 3.14Å; K165-A194 WeakPolarHBondContact O-CA 3.37Å; I166-A194 HydrophobicContact CD1-CB 3.89Å
195	F	92.4	Very high	83.4	Confident	21 Å²	21	67.4 Å²	67.4	9%	0.092	37%	0.365	C	S	.	.			trans	-113.1	156	174.9	74	-84.3	0	0	0	111.1	K165 L167 L197 Y206 P229	K165-F195 HydrophobicContact CB-CD1 4.42Å; K165-F195 HydrophobicContact CB-CE1 4.28Å; K165-F195 WeakPolarHBondContact O-CD1 3.34Å; K165-F195 PolarHBondContact O-N 3.39Å; L167-F195 HydrophobicContact CD1-CB 4Å; L167-F195 HydrophobicContact CD1-CD1 4.5Å; L167-F195 HydrophobicContact CD1-CG 4.43Å; L167-F195 HydrophobicContact CD2-CB 4.48Å; L167-F195 HydrophobicContact CD2-CD1 3.53Å; L167-F195 HydrophobicContact CD2-CE1 3.83Å; L167-F195 HydrophobicContact CD2-CG 4.04Å; L167-F195 HydrophobicContact CG-CB 3.97Å; L167-F195 HydrophobicContact CG-CD1 3.62Å; L167-F195 HydrophobicContact CG-CE1 4.38Å; L167-F195 HydrophobicContact CG-CG 4.02Å; F195-L197 HydrophobicContact CD2-CD2 4.47Å; F195-L197 HydrophobicContact CE2-CD2 3.67Å; F195-L197 HydrophobicContact CE2-CG 4.13Å; F195-Y206 VanDerWaalsContact CA-OH 3.31Å; F195-Y206 WeakPolarHBondContact CA-OH 3.37Å; F195-Y206 HydrophobicContact CB-CE2 4.4Å; F195-Y206 WeakPolarHBondContact CB-OH 3.38Å; F195-P229 HydrophobicContact CE1-CG 4.04Å; F195-P229 HydrophobicContact CE2-CG 3.99Å; F195-P229 HydrophobicContact CZ-CG 3.56Å
196	S	87.4	Confident	83.1	Confident	53 Å²	53	66.7 Å²	66.7	37%	0.371	36%	0.362	S	S	.	.			trans	-101.2	136.3	176.7	-171.3	0	0	0	0	110.8	A198 Y206	S196-A198 VanDerWaalsContact C-N 3.29Å; S196-A198 VanDerWaalsContact OG-CB 3.22Å; S196-A198 WeakPolarHBondContact OG-CB 3.2Å; S196-A198 PolarHBondContact OG-N 3.15Å; S196-A198 VanDerWaalsContact OG-N 3.1Å; S196-Y206 PolarHBondContact N-OH 3.08Å
197	L	76.6	Confident	82.7	Confident	121 Å²	121	69.8 Å²	69.8	63%	0.634	38%	0.381	S	S	*	.			trans	-86.8	-2.2	167.4	-67.6	172.3	0	0	0	112.2	F195 K199	F195-L197 HydrophobicContact CD2-CD2 4.47Å; F195-L197 HydrophobicContact CE2-CD2 3.67Å; F195-L197 HydrophobicContact CE2-CG 4.13Å; L197-K199 PolarHBondContact O-N 3.41Å
198	A	63.8	Low	82.5	Confident	45 Å²	45	71 Å²	71	37%	0.372	39%	0.386	S	S	.	.			trans	-64	107.9	-174.8	0	0	0	0	0	109.8	S196 N200	S196-A198 VanDerWaalsContact C-N 3.29Å; S196-A198 VanDerWaalsContact OG-CB 3.22Å; S196-A198 WeakPolarHBondContact OG-CB 3.2Å; S196-A198 PolarHBondContact OG-N 3.15Å; S196-A198 VanDerWaalsContact OG-N 3.1Å; A198-N200 PolarHBondContact O-N 3.35Å
199	K	56.7	Low	82.4	Confident	209 Å²	209	78.5 Å²	78.5	91%	0.909	41%	0.411	S	S	*	.			trans	-72.4	35	167.1	-62.4	-176.1	178.6	-178.6	0	111.3	L197	L197-K199 PolarHBondContact O-N 3.41Å
200	N	53.3	Low	82.3	Confident	125 Å²	125	78.7 Å²	78.7	67%	0.668	41%	0.412	S	S	*	.			trans	-68.1	152.9	173.2	-61.8	1.3	0	0	0	107.1	A198 Q202	A198-N200 PolarHBondContact O-N 3.35Å; N200-Q202 PolarHBondContact O-N 2.94Å
201	S	58.7	Low	82.3	Confident	136 Å²	136	79 Å²	79	95%	0.951	41%	0.414	S	S	*	.	S	Bend	trans	-60.2	3.4	-168.6	-38.5	0	0	0	0	116.5
202	Q	67.1	Low	82.3	Confident	172 Å²	172	79.5 Å²	79.5	80%	0.804	42%	0.419	S	S	*	.	S	Bend	trans	-120.6	118.3	175.2	-66.3	-175.4	-4.3	0	0	109.9	N200	N200-Q202 PolarHBondContact O-N 2.94Å
203	G	72.2	Confident	82.3	Confident	48 Å²	48	81.1 Å²	81.1	50%	0.495	43%	0.427	S	S	.	.			trans	-61.9	155	175.3	0	0	0	0	0	112.6	D226	G203-D226 WeakPolarHBondContact CA-OD2 3.25Å
204	N	84.1	Confident	82.5	Confident	43 Å²	43	83 Å²	83	23%	0.23	43%	0.434	C	S	.	.			trans	-68.3	151.9	179.3	-54.7	-71.4	0	0	0	111.1	Y206 R225 D226	N204-Y206 HydrophobicContact CB-CD1 4.4Å; N204-Y206 HydrophobicContact CB-CD2 3.86Å; N204-Y206 HydrophobicContact CB-CE1 3.95Å; N204-Y206 HydrophobicContact CB-CE2 3.31Å; N204-Y206 HydrophobicContact CB-CG 4.36Å; N204-Y206 VanDerWaalsContact CG-CZ 3.46Å; N204-Y206 PolarHBondContact ND2-OH 3.4Å; N204-Y206 PolarHBondContact OD1-OH 3.2Å; N204-R225 CarbonylContact O-C 3.56Å; N204-D226 WeakPolarHBondContact CB-OD1 3.4Å; N204-D226 PolarHBondContact N-OD1 3.5Å; N204-D226 PolarHBondContact N-OD2 3.26Å; N204-D226 PolarHBondContact ND2-OD1 2.83Å; N204-D226 WeakPolarHBondContact O-CB 3.39Å
205	R	87.2	Confident	82.7	Confident	196 Å²	196	80.7 Å²	80.7	74%	0.74	41%	0.412	S	S	*	.			trans	-120.2	61.7	177.8	-60.2	-175	88.6	-172.3	8.7	111.6	R225	R205-R225 PolarHBondContact O-NH2 2.9Å
206	Y	90.8	Very high	83	Confident	22 Å²	22	80.7 Å²	80.7	9%	0.086	41%	0.412	C	S	.	.			trans	-68.1	168.4	177.1	-52.9	-54.9	0	0	0	112.3	F195 S196 N204 N208 R225 Y227	F195-Y206 VanDerWaalsContact CA-OH 3.31Å; F195-Y206 WeakPolarHBondContact CA-OH 3.37Å; F195-Y206 HydrophobicContact CB-CE2 4.4Å; F195-Y206 WeakPolarHBondContact CB-OH 3.38Å; S196-Y206 PolarHBondContact N-OH 3.08Å; N204-Y206 HydrophobicContact CB-CD1 4.4Å; N204-Y206 HydrophobicContact CB-CD2 3.86Å; N204-Y206 HydrophobicContact CB-CE1 3.95Å; N204-Y206 HydrophobicContact CB-CE2 3.31Å; N204-Y206 HydrophobicContact CB-CG 4.36Å; N204-Y206 VanDerWaalsContact CG-CZ 3.46Å; N204-Y206 PolarHBondContact ND2-OH 3.4Å; N204-Y206 PolarHBondContact OD1-OH 3.2Å; Y206-N208 PolarHBondContact O-N 3.05Å; Y206-R225 WeakPolarHBondContact CB-O 2.91Å; Y206-R225 WeakPolarHBondContact CD2-O 3.35Å; Y206-R225 PolarHBondContact N-O 3Å; Y206-R225 PolarHBondContact O-NE 3.16Å; Y206-Y227 VanDerWaalsContact CB-CZ 3.41Å; Y206-Y227 WeakPolarHBondContact CB-OH 3.39Å; Y206-Y227 HydrophobicContact CD2-CD2 4.2Å; Y206-Y227 HydrophobicContact CD2-CE2 4.11Å; Y206-Y227 HydrophobicContact CD2-CG 4.48Å; Y206-Y227 WeakPolarHBondContact CD2-O 3.36Å; Y206-Y227 VanDerWaalsContact CE2-O 3.25Å; Y206-Y227 WeakPolarHBondContact CE2-O 3.42Å; Y206-Y227 HydrophobicContact CG-CE2 4.33Å
207	T	90.8	Very high	83.5	Confident	66 Å²	66	78.1 Å²	78.1	41%	0.405	39%	0.394	S	S	.	.			trans	-77.8	116.1	178.1	-53.3	0	0	0	0	108.8	R193 V210 Y227	R193-T207 PolarHBondContact NH1-OG1 2.75Å; R193-T207 VanDerWaalsContact NH1-OG1 3.11Å; R193-T207 PolarHBondContact NH2-OG1 2.61Å; T207-V210 WeakPolarHBondContact O-CG1 3.3Å; T207-Y227 WeakPolarHBondContact O-CE1 3.26Å; T207-Y227 PolarHBondContact O-OH 3.12Å
208	N	93.9	Very high	84.5	Confident	36 Å²	36	72.4 Å²	72.4	19%	0.193	36%	0.364	C	S	.	.	S	Bend	trans	-69.7	-43	-174.3	168.8	-91.3	0	0	0	114.3	Y206 V210 L220 G223 E224 R225	Y206-N208 PolarHBondContact O-N 3.05Å; N208-V210 PolarHBondContact O-N 3.38Å; N208-L220 PolarHBondContact ND2-O 2.88Å; N208-L220 PolarHBondContact OD1-O 2.64Å; N208-G223 VanDerWaalsContact ND2-CA 3.34Å; N208-G223 WeakPolarHBondContact ND2-CA 3.41Å; N208-E224 WeakPolarHBondContact CB-O 3.26Å; N208-E224 PolarHBondContact ND2-N 3.19Å; N208-E224 PolarHBondContact ND2-O 3.22Å; N208-R225 HydrophobicContact CB-CG 4.18Å
209	R	91.7	Very high	86.2	Confident	198 Å²	198	70.3 Å²	70.3	75%	0.747	35%	0.347	S	S	*	.	S	Bend	trans	-76.1	66.4	-173.9	-159.8	175.9	-170.2	-173.6	-0.4	112.5
210	V	91.8	Very high	88.1	Confident	6 Å²	6	60.5 Å²	60.5	4%	0.036	30%	0.304	C	S	.	.			trans	-122.5	172.7	176.8	-64	0	0	0	0	109.7	R169 T207 N208 R216 L220	R169-V210 HydrophobicContact CB-CB 4.22Å; R169-V210 HydrophobicContact CB-CG2 4.23Å; T207-V210 WeakPolarHBondContact O-CG1 3.3Å; N208-V210 PolarHBondContact O-N 3.38Å; V210-R216 PolarHBondContact O-NE 3.41Å; V210-R216 PolarHBondContact O-NH2 3.24Å; V210-L220 HydrophobicContact CG2-CD1 3.75Å
211	V	92.4	Very high	90.2	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.036	27%	0.273	C	S	.	.	S	Bend	trans	65.3	136.1	-173.9	-169	0	0	0	0	112.8	R169 Y215 R216 L220	R169-V211 WeakPolarHBondContact O-CA 3.27Å; R169-V211 WeakPolarHBondContact O-CG2 3.46Å; R169-V211 PolarHBondContact O-N 2.96Å; V211-Y215 WeakPolarHBondContact CG1-O 3.48Å; V211-R216 HydrophobicContact CB-CB 4.35Å; V211-R216 HydrophobicContact CB-CG 4.38Å; V211-R216 HydrophobicContact CG1-CB 4.32Å; V211-R216 PolarHBondContact O-NE 3.2Å; V211-R216 PolarHBondContact O-NH2 2.89Å; V211-L220 HydrophobicContact CB-CD1 4.47Å; V211-L220 HydrophobicContact CG2-CD1 3.88Å
212	T	92.6	Very high	92	Very high	50 Å²	50	48.3 Å²	48.3	31%	0.307	23%	0.228	S	C	.	.			trans	-59.7	136.1	171.7	-61.3	0	0	0	0	110.3	D170 W214 Y215 R216	D170-T212 PolarHBondContact OD1-N 3.41Å; D170-T212 PolarHBondContact OD1-OG1 2.83Å; T212-W214 VanDerWaalsContact C-N 3.31Å; T212-W214 PolarHBondContact O-N 3.44Å; T212-W214 VanDerWaalsContact O-N 3.1Å; T212-Y215 HydrophobicContact CG2-CD2 4.39Å; T212-Y215 CarbonylContact O-C 3.49Å; T212-Y215 PolarHBondContact O-N 3.08Å; T212-R216 PolarHBondContact O-N 3.15Å; T212-R216 VanDerWaalsContact O-N 3.16Å
213	L	96.9	Very high	93.3	Very high	35 Å²	35	41.3 Å²	41.3	18%	0.183	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-51.2	-42.8	-165.6	-178.7	59.7	0	0	0	114.5	Y215 R216 L221 G252 E255 Q258	L213-Y215 PolarHBondContact O-N 3.13Å; L213-R216 WeakPolarHBondContact O-CB 3.33Å; L213-R216 PolarHBondContact O-N 3.44Å; L213-R216 VanDerWaalsContact O-N 3.13Å; L213-L221 HydrophobicContact CD1-CD2 3.92Å; L213-G252 WeakPolarHBondContact CD2-O 3.19Å; L213-E255 HydrophobicContact CD1-CG 3.99Å; L213-Q258 HydrophobicContact CD1-CB 3.81Å; L213-Q258 HydrophobicContact CD1-CG 3.98Å; L213-Q258 HydrophobicContact CG-CB 4.21Å; L213-Q258 HydrophobicContact CG-CG 4.31Å; L213-Q258 VanDerWaalsContact O-CD 3.3Å
214	W	98.1	Very high	94.4	Very high	93 Å²	93	40 Å²	40	35%	0.352	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-66.8	-21.1	-178	-55.8	-17.2	0	0	0	114.1	T212 P248 M250 Q251 G252	T212-W214 VanDerWaalsContact C-N 3.31Å; T212-W214 PolarHBondContact O-N 3.44Å; T212-W214 VanDerWaalsContact O-N 3.1Å; W214-P248 HydrophobicContact CE3-CB 3.94Å; W214-P248 HydrophobicContact CE3-CG 3.81Å; W214-P248 HydrophobicContact CZ3-CG 4.07Å; W214-M250 WeakPolarHBondContact CA-O 3.16Å; W214-M250 WeakPolarHBondContact CB-O 3.43Å; W214-Q251 HydrophobicContact CD2-CB 4.36Å; W214-Q251 HydrophobicContact CD2-CG 4Å; W214-Q251 HydrophobicContact CE3-CG 4.2Å; W214-Q251 HydrophobicContact CG-CG 4.42Å; W214-Q251 HydrophobicContact CZ2-CB 4.35Å; W214-Q251 HydrophobicContact CZ2-CG 4.32Å; W214-Q251 HydrophobicContact CZ3-CG 4.45Å; W214-G252 PolarHBondContact NE1-O 3.22Å
215	Y	98.4	Very high	94.9	Very high	13 Å²	13	43.1 Å²	43.1	5%	0.051	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-107.6	4	178.4	-59.4	-89.3	0	0	0	112	M171 K172 V211 T212 L213 W234 C238 I239 E242	M171-Y215 WeakPolarHBondContact O-CB 3.1Å; M171-Y215 VanDerWaalsContact O-CG 3.26Å; K172-Y215 HydrophobicContact CB-CD1 4.38Å; K172-Y215 HydrophobicContact CB-CD2 3.57Å; K172-Y215 HydrophobicContact CB-CE1 4.24Å; K172-Y215 HydrophobicContact CB-CE2 3.39Å; K172-Y215 HydrophobicContact CB-CG 4.07Å; V211-Y215 WeakPolarHBondContact CG1-O 3.48Å; T212-Y215 HydrophobicContact CG2-CD2 4.39Å; T212-Y215 CarbonylContact O-C 3.49Å; T212-Y215 PolarHBondContact O-N 3.08Å; L213-Y215 PolarHBondContact O-N 3.13Å; Y215-W234 VanDerWaalsContact O-CD1 3.26Å; Y215-C238 HydrophobicContact CD1-CB 3.7Å; Y215-C238 HydrophobicContact CE1-CB 4.06Å; Y215-I239 HydrophobicContact CD1-CG1 4.29Å; Y215-I239 HydrophobicContact CE1-CG1 3.86Å; Y215-E242 WeakPolarHBondContact CE1-OE1 3.17Å; Y215-E242 VanDerWaalsContact OH-CD 3.29Å; Y215-E242 PolarHBondContact OH-OE1 3.16Å; Y215-E242 PolarHBondContact OH-OE2 3.34Å
216	R	98.6	Very high	95.2	Very high	21 Å²	21	37.1 Å²	37.1	8%	0.079	18%	0.175	C	C	.	.			trans	-77.2	125.9	-174.7	-170	177.4	-65	155.6	3	110.2	V210 V211 T212 L213 L220 L221 W234 E255	V210-R216 PolarHBondContact O-NE 3.41Å; V210-R216 PolarHBondContact O-NH2 3.24Å; V211-R216 HydrophobicContact CB-CB 4.35Å; V211-R216 HydrophobicContact CB-CG 4.38Å; V211-R216 HydrophobicContact CG1-CB 4.32Å; V211-R216 PolarHBondContact O-NE 3.2Å; V211-R216 PolarHBondContact O-NH2 2.89Å; T212-R216 PolarHBondContact O-N 3.15Å; T212-R216 VanDerWaalsContact O-N 3.16Å; L213-R216 WeakPolarHBondContact O-CB 3.33Å; L213-R216 PolarHBondContact O-N 3.44Å; L213-R216 VanDerWaalsContact O-N 3.13Å; R216-L220 HydrophobicContact CG-CB 3.71Å; R216-L220 HydrophobicContact CG-CD1 4.16Å; R216-L221 HydrophobicContact CB-CG 4.46Å; R216-L221 HydrophobicContact CG-CD2 4.29Å; R216-L221 HydrophobicContact CG-CG 4.06Å; R216-W234 PolarHBondContact O-NE1 3.41Å; R216-E255 IonicContact CZ-OE1 3.56Å; R216-E255 IonicContact NH1-OE1 2.72Å; R216-E255 PolarHBondContact NH1-OE1 2.96Å
217	P	98.5	Very high	95.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.172	C	C	.	.			trans	-71.1	159.2	178.4	33.1	-41.1	0	0	0	112.5	E219 L220 L221 I231 W234	P217-E219 VanDerWaalsContact C-N 3.31Å; P217-E219 HydrophobicContact CB-CG 4.43Å; P217-E219 WeakPolarHBondContact CB-OE1 3.4Å; P217-E219 WeakPolarHBondContact CB-OE2 3.48Å; P217-E219 HydrophobicContact CG-CG 4.3Å; P217-E219 PolarHBondContact O-N 3.36Å; P217-L220 HydrophobicContact CG-CB 4.22Å; P217-L220 HydrophobicContact CG-CD1 3.92Å; P217-L220 HydrophobicContact CG-CG 3.85Å; P217-L220 PolarHBondContact O-N 2.92Å; P217-L221 PolarHBondContact O-N 2.84Å; P217-I231 HydrophobicContact CG-CB 3.84Å; P217-I231 HydrophobicContact CG-CG2 3.87Å; P217-W234 HydrophobicContact CB-CB 3.75Å; P217-W234 HydrophobicContact CB-CD2 3.98Å; P217-W234 HydrophobicContact CB-CG 3.53Å
218	P	98	Very high	95.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-32.1	-175.2	28.2	-36.8	0	0	0	113.1	L220 L221 L222 W234 L259 I262 I269 W274 L320	P218-L220 VanDerWaalsContact C-N 3.31Å; P218-L220 PolarHBondContact O-N 3.3Å; P218-L221 PolarHBondContact O-N 3.37Å; P218-L222 WeakPolarHBondContact O-CG 3.19Å; P218-L222 PolarHBondContact O-N 3.21Å; P218-W234 HydrophobicContact CG-CH2 4.35Å; P218-W234 HydrophobicContact CG-CZ3 4.24Å; P218-L259 HydrophobicContact CB-CD2 4.4Å; P218-I262 HydrophobicContact CB-CD1 4.49Å; P218-I262 HydrophobicContact CB-CG2 4.45Å; P218-I269 HydrophobicContact CB-CD1 4.27Å; P218-W274 HydrophobicContact CB-CH2 4.48Å; P218-W274 HydrophobicContact CB-CZ3 3.95Å; P218-W274 HydrophobicContact CG-CH2 4.37Å; P218-W274 HydrophobicContact CG-CZ3 3.98Å; P218-L320 HydrophobicContact CG-CD2 4.21Å
219	E	97.9	Very high	95.8	Very high	2 Å²	2	34 Å²	34	1%	0.009	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-38.4	176.8	57.3	-86.4	-160.5	0	0	112.6	P217 L222 G223 E224 I231 W274 P322 R325	P217-E219 VanDerWaalsContact C-N 3.31Å; P217-E219 HydrophobicContact CB-CG 4.43Å; P217-E219 WeakPolarHBondContact CB-OE1 3.4Å; P217-E219 WeakPolarHBondContact CB-OE2 3.48Å; P217-E219 HydrophobicContact CG-CG 4.3Å; P217-E219 PolarHBondContact O-N 3.36Å; E219-L222 PolarHBondContact O-N 3.09Å; E219-G223 PolarHBondContact O-N 2.95Å; E219-E224 HydrophobicContact CB-CB 3.99Å; E219-E224 HydrophobicContact CB-CG 4.43Å; E219-E224 WeakPolarHBondContact O-CB 3.38Å; E219-E224 PolarHBondContact O-N 3.42Å; E219-I231 HydrophobicContact CG-CG2 4.24Å; E219-W274 HydrophobicContact CB-CH2 3.65Å; E219-W274 HydrophobicContact CB-CZ2 3.99Å; E219-P322 HydrophobicContact CB-CG 4.33Å; E219-P322 HydrophobicContact CG-CG 4.33Å; E219-R325 IonicContact OE1-CZ 2.74Å; E219-R325 IonicContact OE1-NH1 2.84Å; E219-R325 PolarHBondContact OE1-NH1 3.05Å; E219-R325 IonicContact OE1-NH2 3.71Å; E219-R325 IonicContact OE2-CZ 2.76Å; E219-R325 IonicContact OE2-NH1 3.8Å; E219-R325 IonicContact OE2-NH2 3.81Å; E219-R325 PolarHBondContact OE2-NH2 3.14Å
220	L	97.5	Very high	96.2	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	14%	0.138	C	C	.	.	H	α-helix	trans	-71.7	-38.1	177.1	-69.3	-173.3	0	0	0	111.1	N208 V210 V211 R216 P217 P218 L222 G223 Y227 I231	N208-L220 PolarHBondContact ND2-O 2.88Å; N208-L220 PolarHBondContact OD1-O 2.64Å; V210-L220 HydrophobicContact CG2-CD1 3.75Å; V211-L220 HydrophobicContact CB-CD1 4.47Å; V211-L220 HydrophobicContact CG2-CD1 3.88Å; R216-L220 HydrophobicContact CG-CB 3.71Å; R216-L220 HydrophobicContact CG-CD1 4.16Å; P217-L220 HydrophobicContact CG-CB 4.22Å; P217-L220 HydrophobicContact CG-CD1 3.92Å; P217-L220 HydrophobicContact CG-CG 3.85Å; P217-L220 PolarHBondContact O-N 2.92Å; P218-L220 VanDerWaalsContact C-N 3.31Å; P218-L220 PolarHBondContact O-N 3.3Å; L220-L222 PolarHBondContact O-N 2.86Å; L220-G223 PolarHBondContact O-N 3.01Å; L220-G223 VanDerWaalsContact O-N 3.07Å; L220-Y227 HydrophobicContact CD2-CD1 3.26Å; L220-Y227 HydrophobicContact CD2-CD2 4.48Å; L220-Y227 HydrophobicContact CD2-CE1 3.55Å; L220-Y227 HydrophobicContact CD2-CG 3.76Å; L220-I231 HydrophobicContact CD1-CG2 4.36Å; L220-I231 HydrophobicContact CG-CG2 4.27Å
221	L	97.3	Very high	96.5	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-66.3	-27.6	176	-66.9	164.4	0	0	0	112.4	L213 R216 P217 P218 G223 E255 Q258 L259 I262	L213-L221 HydrophobicContact CD1-CD2 3.92Å; R216-L221 HydrophobicContact CB-CG 4.46Å; R216-L221 HydrophobicContact CG-CD2 4.29Å; R216-L221 HydrophobicContact CG-CG 4.06Å; P217-L221 PolarHBondContact O-N 2.84Å; P218-L221 PolarHBondContact O-N 3.37Å; L221-G223 VanDerWaalsContact C-N 3.31Å; L221-E255 HydrophobicContact CD2-CB 3.79Å; L221-E255 HydrophobicContact CD2-CG 3.85Å; L221-Q258 HydrophobicContact CD1-CB 4.1Å; L221-Q258 HydrophobicContact CD1-CG 3.64Å; L221-Q258 HydrophobicContact CD2-CB 4.36Å; L221-Q258 HydrophobicContact CD2-CG 4.43Å; L221-L259 HydrophobicContact CB-CD1 3.88Å; L221-L259 HydrophobicContact CB-CD2 3.78Å; L221-L259 HydrophobicContact CB-CG 3.72Å; L221-L259 HydrophobicContact CD1-CD2 4.07Å; L221-L259 HydrophobicContact CD1-CG 3.97Å; L221-L259 HydrophobicContact CG-CG 4.37Å; L221-I262 HydrophobicContact CD1-CD1 3.51Å
222	L	96.6	Very high	96.8	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	6.6	173	-65.1	177.1	0	0	0	113.8	P218 E219 L220 L259 I269 W274 V277 Y281 L289	P218-L222 WeakPolarHBondContact O-CG 3.19Å; P218-L222 PolarHBondContact O-N 3.21Å; E219-L222 PolarHBondContact O-N 3.09Å; L220-L222 PolarHBondContact O-N 2.86Å; L222-L259 HydrophobicContact CD2-CD1 4.22Å; L222-L259 HydrophobicContact CD2-CD2 4.48Å; L222-L259 HydrophobicContact CG-CD2 4.49Å; L222-I269 HydrophobicContact CD1-CD1 4.39Å; L222-I269 HydrophobicContact CD1-CG2 4.31Å; L222-W274 HydrophobicContact CD1-CH2 4.32Å; L222-W274 HydrophobicContact CD1-CZ3 3.9Å; L222-V277 HydrophobicContact CD1-CG2 3.81Å; L222-Y281 HydrophobicContact CB-CD1 4.34Å; L222-Y281 HydrophobicContact CB-CD2 4.03Å; L222-Y281 HydrophobicContact CB-CG 3.86Å; L222-Y281 HydrophobicContact CD1-CD2 3.91Å; L222-Y281 HydrophobicContact CD1-CE2 4.38Å; L222-L289 HydrophobicContact CD2-CD1 4.36Å
223	G	95.2	Very high	97.1	Very high	25 Å²	25	23.5 Å²	23.5	26%	0.258	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	13.9	169.9	0	0	0	0	0	115.8	N208 E219 L220 L221	N208-G223 VanDerWaalsContact ND2-CA 3.34Å; N208-G223 WeakPolarHBondContact ND2-CA 3.41Å; E219-G223 PolarHBondContact O-N 2.95Å; L220-G223 PolarHBondContact O-N 3.01Å; L220-G223 VanDerWaalsContact O-N 3.07Å; L221-G223 VanDerWaalsContact C-N 3.31Å
224	E	94.9	Very high	97.2	Very high	22 Å²	22	21.9 Å²	21.9	10%	0.103	11%	0.112	C	C	.	.			trans	-55.6	138.6	177.9	-177.3	57.2	-82.3	0	0	112.3	N208 E219 D226 Y227 K280 Y281	N208-E224 WeakPolarHBondContact CB-O 3.26Å; N208-E224 PolarHBondContact ND2-N 3.19Å; N208-E224 PolarHBondContact ND2-O 3.22Å; E219-E224 HydrophobicContact CB-CB 3.99Å; E219-E224 HydrophobicContact CB-CG 4.43Å; E219-E224 WeakPolarHBondContact O-CB 3.38Å; E219-E224 PolarHBondContact O-N 3.42Å; E224-D226 PolarHBondContact OE1-N 3.21Å; E224-Y227 HydrophobicContact CG-CD1 4.44Å; E224-Y227 WeakPolarHBondContact O-CD1 3.13Å; E224-K280 WeakPolarHBondContact OE2-CE 3.34Å; E224-K280 IonicContact OE2-NZ 3.59Å; E224-K280 PolarHBondContact OE2-NZ 2.76Å; E224-Y281 HydrophobicContact CB-CD1 4.47Å; E224-Y281 HydrophobicContact CB-CE1 3.64Å; E224-Y281 HydrophobicContact CG-CE1 4.14Å; E224-Y281 VanDerWaalsContact OE2-CE1 3.3Å; E224-Y281 WeakPolarHBondContact OE2-CE1 3.18Å; E224-Y281 PolarHBondContact OE2-OH 2.88Å
225	R	93.8	Very high	97.2	Very high	108 Å²	108	17.4 Å²	17.4	41%	0.408	10%	0.095	S	C	.	.	S	Bend	trans	-121.9	-15.9	175.2	-63.1	-170.8	67.8	-179.6	-3.3	113.4	N204 R205 Y206 N208	N204-R225 CarbonylContact O-C 3.56Å; R205-R225 PolarHBondContact O-NH2 2.9Å; Y206-R225 WeakPolarHBondContact CB-O 2.91Å; Y206-R225 WeakPolarHBondContact CD2-O 3.35Å; Y206-R225 PolarHBondContact N-O 3Å; Y206-R225 PolarHBondContact O-NE 3.16Å; N208-R225 HydrophobicContact CB-CG 4.18Å
226	D	93.1	Very high	97.3	Very high	70 Å²	70	16.8 Å²	16.8	37%	0.374	9%	0.093	S	C	.	.	S	Bend	trans	-103.9	54.4	173	-163.1	14.3	0	0	0	110.7	G203 N204 E224	G203-D226 WeakPolarHBondContact CA-OD2 3.25Å; N204-D226 WeakPolarHBondContact CB-OD1 3.4Å; N204-D226 PolarHBondContact N-OD1 3.5Å; N204-D226 PolarHBondContact N-OD2 3.26Å; N204-D226 PolarHBondContact ND2-OD1 2.83Å; N204-D226 WeakPolarHBondContact O-CB 3.39Å; E224-D226 PolarHBondContact OE1-N 3.21Å
227	Y	94.9	Very high	97.3	Very high	9 Å²	9	15.8 Å²	15.8	4%	0.035	9%	0.089	C	C	.	.			trans	-91.1	159.1	178.2	56.2	-102.9	0	0	0	111.6	L167 R169 Y206 T207 L220 E224 I231	L167-Y227 HydrophobicContact CD1-CD2 3.9Å; L167-Y227 HydrophobicContact CD1-CE2 3.89Å; R169-Y227 PolarHBondContact NH1-OH 2.97Å; Y206-Y227 VanDerWaalsContact CB-CZ 3.41Å; Y206-Y227 WeakPolarHBondContact CB-OH 3.39Å; Y206-Y227 HydrophobicContact CD2-CD2 4.2Å; Y206-Y227 HydrophobicContact CD2-CE2 4.11Å; Y206-Y227 HydrophobicContact CD2-CG 4.48Å; Y206-Y227 WeakPolarHBondContact CD2-O 3.36Å; Y206-Y227 VanDerWaalsContact CE2-O 3.25Å; Y206-Y227 WeakPolarHBondContact CE2-O 3.42Å; Y206-Y227 HydrophobicContact CG-CE2 4.33Å; T207-Y227 WeakPolarHBondContact O-CE1 3.26Å; T207-Y227 PolarHBondContact O-OH 3.12Å; L220-Y227 HydrophobicContact CD2-CD1 3.26Å; L220-Y227 HydrophobicContact CD2-CD2 4.48Å; L220-Y227 HydrophobicContact CD2-CE1 3.55Å; L220-Y227 HydrophobicContact CD2-CG 3.76Å; E224-Y227 HydrophobicContact CG-CD1 4.44Å; E224-Y227 WeakPolarHBondContact O-CD1 3.13Å; Y227-I231 HydrophobicContact CD2-CD1 3.56Å; Y227-I231 HydrophobicContact CD2-CG2 4.27Å; Y227-I231 HydrophobicContact CE2-CD1 3.72Å; Y227-I231 HydrophobicContact CG-CD1 4.47Å; Y227-I231 HydrophobicContact CG-CG2 4.3Å
228	G	96.5	Very high	97.3	Very high	18 Å²	18	15.9 Å²	15.9	19%	0.186	9%	0.089	C	C	.	.			trans	-136.3	-157.6	-177.8	0	0	0	0	0	113.3	L167 P230 I231	L167-G228 VanDerWaalsContact CD2-C 3.45Å; G228-P230 VanDerWaalsContact C-N 3.28Å; G228-P230 WeakPolarHBondContact O-CD 3.44Å; G228-P230 VanDerWaalsContact O-N 3.1Å; G228-I231 WeakPolarHBondContact O-CG1 3.4Å; G228-I231 PolarHBondContact O-N 3.31Å
229	P	98.3	Very high	97.3	Very high	32 Å²	32	15.9 Å²	15.9	21%	0.208	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.5	-35.7	179.3	-32.5	38.8	0	0	0	117	H162 L167 F195 I231 D232 L233	H162-P229 HydrophobicContact CB-CB 4.38Å; H162-P229 HydrophobicContact CB-CG 4.31Å; L167-P229 HydrophobicContact CD2-CB 4.44Å; L167-P229 HydrophobicContact CD2-CG 4.01Å; L167-P229 VanDerWaalsContact CD2-N 3.32Å; F195-P229 HydrophobicContact CE1-CG 4.04Å; F195-P229 HydrophobicContact CE2-CG 3.99Å; F195-P229 HydrophobicContact CZ-CG 3.56Å; P229-I231 PolarHBondContact O-N 2.68Å; P229-D232 PolarHBondContact O-N 3.25Å; P229-L233 WeakPolarHBondContact O-CD2 3.41Å
230	P	98.7	Very high	97.4	Very high	36 Å²	36	15.8 Å²	15.8	23%	0.234	9%	0.089	C	C	.	.	H	α-helix	trans	-55.6	-22.9	-177.7	-30.7	37.8	0	0	0	115.7	G228 D232 L233 W234 P322 R325	G228-P230 VanDerWaalsContact C-N 3.28Å; G228-P230 WeakPolarHBondContact O-CD 3.44Å; G228-P230 VanDerWaalsContact O-N 3.1Å; P230-D232 VanDerWaalsContact C-N 3.27Å; P230-D232 PolarHBondContact O-N 2.88Å; P230-L233 PolarHBondContact O-N 2.96Å; P230-W234 PolarHBondContact O-N 3.37Å; P230-P322 HydrophobicContact CB-CB 3.76Å; P230-P322 HydrophobicContact CG-CB 4.27Å; P230-P322 WeakPolarHBondContact CG-O 3.48Å; P230-R325 PolarHBondContact O-NH1 2.94Å
231	I	98.6	Very high	97.4	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-64.6	-33.8	176.9	70.5	176.9	0	0	0	112.3	L167 R169 P217 E219 L220 Y227 G228 P229 G235	L167-I231 HydrophobicContact CD1-CD1 4.41Å; R169-I231 HydrophobicContact CB-CD1 4.41Å; R169-I231 HydrophobicContact CG-CD1 3.88Å; P217-I231 HydrophobicContact CG-CB 3.84Å; P217-I231 HydrophobicContact CG-CG2 3.87Å; E219-I231 HydrophobicContact CG-CG2 4.24Å; L220-I231 HydrophobicContact CD1-CG2 4.36Å; L220-I231 HydrophobicContact CG-CG2 4.27Å; Y227-I231 HydrophobicContact CD2-CD1 3.56Å; Y227-I231 HydrophobicContact CD2-CG2 4.27Å; Y227-I231 HydrophobicContact CE2-CD1 3.72Å; Y227-I231 HydrophobicContact CG-CD1 4.47Å; Y227-I231 HydrophobicContact CG-CG2 4.3Å; G228-I231 WeakPolarHBondContact O-CG1 3.4Å; G228-I231 PolarHBondContact O-N 3.31Å; P229-I231 PolarHBondContact O-N 2.68Å; I231-G235 PolarHBondContact O-N 3.38Å
232	D	98.8	Very high	97.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-78.4	-32.8	-180	-65.9	-34.3	0	0	0	110.1	L158 H162 H168 R169 M171 P229 P230 G235 A236	L158-D232 HydrophobicContact CD2-CB 3.94Å; H162-D232 IonicContact CD2-OD2 2.74Å; H162-D232 IonicContact CE1-OD2 3.16Å; H162-D232 IonicContact NE2-OD2 3.41Å; H162-D232 PolarHBondContact NE2-OD2 2.82Å; H168-D232 WeakPolarHBondContact CB-OD1 3.45Å; H168-D232 PolarHBondContact N-OD2 3.19Å; R169-D232 PolarHBondContact N-OD1 3.5Å; M171-D232 HydrophobicContact CG-CB 3.91Å; P229-D232 PolarHBondContact O-N 3.25Å; P230-D232 VanDerWaalsContact C-N 3.27Å; P230-D232 PolarHBondContact O-N 2.88Å; D232-G235 PolarHBondContact O-N 2.86Å; D232-A236 PolarHBondContact O-N 3.16Å
233	L	98.9	Very high	97.6	Very high	1 Å²	1	16 Å²	16	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-70	-34	176.9	-79.4	-57	0	0	0	112.3	L155 L158 H162 P229 P230 G235 A236 G237 L317	L155-L233 HydrophobicContact CD2-CD1 3.71Å; L158-L233 HydrophobicContact CD1-CD1 4.28Å; H162-L233 VanDerWaalsContact CE1-CD2 3.47Å; H162-L233 WeakPolarHBondContact CE1-CD2 3.03Å; P229-L233 WeakPolarHBondContact O-CD2 3.41Å; P230-L233 PolarHBondContact O-N 2.96Å; L233-G235 VanDerWaalsContact C-N 3.33Å; L233-A236 WeakPolarHBondContact O-CB 3.45Å; L233-A236 PolarHBondContact O-N 3.36Å; L233-G237 PolarHBondContact O-N 2.93Å; L233-L317 HydrophobicContact CB-CD2 4.17Å; L233-L317 HydrophobicContact CD1-CD2 3.96Å
234	W	98.9	Very high	97.7	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.2	-46.8	168.6	176.5	-86.7	0	0	0	111.5	Y215 R216 P217 P218 P230 A236 G237 C238 M250 I262 L318	Y215-W234 VanDerWaalsContact O-CD1 3.26Å; R216-W234 PolarHBondContact O-NE1 3.41Å; P217-W234 HydrophobicContact CB-CB 3.75Å; P217-W234 HydrophobicContact CB-CD2 3.98Å; P217-W234 HydrophobicContact CB-CG 3.53Å; P218-W234 HydrophobicContact CG-CH2 4.35Å; P218-W234 HydrophobicContact CG-CZ3 4.24Å; P230-W234 PolarHBondContact O-N 3.37Å; W234-A236 VanDerWaalsContact C-N 3.28Å; W234-A236 PolarHBondContact O-N 3.21Å; W234-G237 WeakPolarHBondContact O-CA 3.42Å; W234-G237 PolarHBondContact O-N 3.28Å; W234-G237 VanDerWaalsContact O-N 3.08Å; W234-C238 PolarHBondContact O-N 3.39Å; W234-M250 HydrophobicContact CZ2-CE 3.73Å; W234-M250 HydrophobicContact CZ2-SD 4.47Å; W234-I262 HydrophobicContact CH2-CG1 4.4Å; W234-I262 HydrophobicContact CH2-CG2 3.9Å; W234-I262 HydrophobicContact CZ2-CD1 3.89Å; W234-I262 HydrophobicContact CZ2-CG1 3.91Å; W234-I262 HydrophobicContact CZ2-CG2 4.26Å; W234-L318 HydrophobicContact CD2-CD2 4.18Å; W234-L318 HydrophobicContact CE3-CD2 4.17Å; W234-L318 HydrophobicContact CH2-CD2 4.4Å; W234-L318 HydrophobicContact CZ2-CD2 4.39Å; W234-L318 HydrophobicContact CZ3-CB 4.36Å; W234-L318 HydrophobicContact CZ3-CD2 4.3Å
235	G	98.8	Very high	97.8	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58.9	-40.1	174.4	0	0	0	0	0	112.3	I231 D232 L233 G237 C238 I239	I231-G235 PolarHBondContact O-N 3.38Å; D232-G235 PolarHBondContact O-N 2.86Å; L233-G235 VanDerWaalsContact C-N 3.33Å; G235-G237 VanDerWaalsContact C-N 3.35Å; G235-C238 PolarHBondContact O-N 3.32Å; G235-I239 VanDerWaalsContact O-CG1 3.27Å; G235-I239 WeakPolarHBondContact O-CG1 3.35Å; G235-I239 PolarHBondContact O-N 3.18Å
236	A	98.9	Very high	97.9	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.8	-38.1	173.3	0	0	0	0	0	112.5	L154 L155 L158 D232 L233 W234 I239 M240	L154-A236 HydrophobicContact CD2-CB 4.08Å; L155-A236 HydrophobicContact CD2-CB 4.42Å; L158-A236 HydrophobicContact CD1-CB 3.83Å; D232-A236 PolarHBondContact O-N 3.16Å; L233-A236 WeakPolarHBondContact O-CB 3.45Å; L233-A236 PolarHBondContact O-N 3.36Å; W234-A236 VanDerWaalsContact C-N 3.28Å; W234-A236 PolarHBondContact O-N 3.21Å; A236-I239 PolarHBondContact O-N 2.92Å; A236-M240 VanDerWaalsContact O-CB 3.29Å; A236-M240 WeakPolarHBondContact O-CB 3.46Å; A236-M240 PolarHBondContact O-N 3.46Å
237	G	98.9	Very high	98	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-62.2	-44.6	173.2	0	0	0	0	0	113	L233 W234 G235 M240 A241	L233-G237 PolarHBondContact O-N 2.93Å; W234-G237 WeakPolarHBondContact O-CA 3.42Å; W234-G237 PolarHBondContact O-N 3.28Å; W234-G237 VanDerWaalsContact O-N 3.08Å; G235-G237 VanDerWaalsContact C-N 3.35Å; G237-M240 PolarHBondContact O-N 2.88Å; G237-A241 PolarHBondContact O-N 3.37Å; G237-A241 VanDerWaalsContact O-N 3.08Å
238	C	98.8	Very high	98.1	Very high	1 Å²	1	12 Å²	12	1%	0.007	7%	0.067	C	C	.	.	H	α-helix	trans	-59.7	-49.1	173.2	-68.4	0	0	0	0	111.3	Y215 W234 G235 M240 A241 E242	Y215-C238 HydrophobicContact CD1-CB 3.7Å; Y215-C238 HydrophobicContact CE1-CB 4.06Å; W234-C238 PolarHBondContact O-N 3.39Å; G235-C238 PolarHBondContact O-N 3.32Å; C238-M240 VanDerWaalsContact C-N 3.31Å; C238-M240 PolarHBondContact O-N 3.18Å; C238-A241 PolarHBondContact O-N 2.88Å; C238-E242 WeakPolarHBondContact O-CG 3.5Å; C238-E242 PolarHBondContact O-N 2.94Å; C238-E242 VanDerWaalsContact O-N 3.09Å
239	I	98.8	Very high	98.1	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.3	-40.5	178.1	-67.7	164.9	0	0	0	111.2	L131 L154 M171 V176 Y215 G235 A236 A241 E242 M243	L131-I239 HydrophobicContact CD2-CG2 3.56Å; L154-I239 HydrophobicContact CD2-CG2 4.19Å; M171-I239 HydrophobicContact CE-CD1 4.01Å; V176-I239 HydrophobicContact CG2-CD1 4.07Å; Y215-I239 HydrophobicContact CD1-CG1 4.29Å; Y215-I239 HydrophobicContact CE1-CG1 3.86Å; G235-I239 VanDerWaalsContact O-CG1 3.27Å; G235-I239 WeakPolarHBondContact O-CG1 3.35Å; G235-I239 PolarHBondContact O-N 3.18Å; A236-I239 PolarHBondContact O-N 2.92Å; I239-A241 PolarHBondContact O-N 3.25Å; I239-E242 WeakPolarHBondContact O-CB 3.2Å; I239-E242 PolarHBondContact O-N 3.39Å; I239-E242 VanDerWaalsContact O-N 3.15Å; I239-M243 PolarHBondContact O-N 3.13Å
240	M	98.9	Very high	98.1	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-60.6	-46.1	178.4	-172.2	167.8	176.5	0	0	110.8	M151 A236 G237 C238 E242 M243 W244 A310 L313 I314 L317 F336	M151-M240 HydrophobicContact CE-CB 3.57Å; M151-M240 HydrophobicContact CE-CG 3.89Å; M151-M240 HydrophobicContact CE-SD 4Å; M151-M240 HydrophobicContact CG-CB 4.46Å; M151-M240 HydrophobicContact CG-CG 3.94Å; M151-M240 HydrophobicContact CG-SD 4.25Å; M151-M240 HydrophobicContact SD-CB 3.73Å; M151-M240 HydrophobicContact SD-CG 3.88Å; A236-M240 VanDerWaalsContact O-CB 3.29Å; A236-M240 WeakPolarHBondContact O-CB 3.46Å; A236-M240 PolarHBondContact O-N 3.46Å; G237-M240 PolarHBondContact O-N 2.88Å; C238-M240 VanDerWaalsContact C-N 3.31Å; C238-M240 PolarHBondContact O-N 3.18Å; M240-E242 VanDerWaalsContact C-N 3.29Å; M240-E242 PolarHBondContact O-N 3.49Å; M240-M243 VanDerWaalsContact O-CB 3.32Å; M240-M243 WeakPolarHBondContact O-CB 3.41Å; M240-M243 PolarHBondContact O-N 3.3Å; M240-W244 HydrophobicContact CE-CH2 3.98Å; M240-W244 HydrophobicContact CE-CZ3 4.15Å; M240-W244 HydrophobicContact CG-CZ3 3.87Å; M240-W244 WeakPolarHBondContact O-CZ3 3.31Å; M240-A310 HydrophobicContact CE-CB 4.31Å; M240-L313 HydrophobicContact CE-CB 4.06Å; M240-L313 HydrophobicContact CE-CD2 3.92Å; M240-L313 HydrophobicContact CE-CG 4.19Å; M240-L313 HydrophobicContact SD-CB 4.26Å; M240-L313 HydrophobicContact SD-CD2 3.89Å; M240-L313 HydrophobicContact SD-CG 3.9Å; M240-I314 HydrophobicContact CB-CG1 4.09Å; M240-I314 HydrophobicContact CE-CG1 4.05Å; M240-I314 HydrophobicContact CG-CD1 4.12Å; M240-I314 HydrophobicContact CG-CG1 3.6Å; M240-I314 HydrophobicContact SD-CG1 3.74Å; M240-L317 HydrophobicContact SD-CD1 3.94Å; M240-F336 HydrophobicContact CE-CD1 3.83Å; M240-F336 HydrophobicContact CE-CE1 3.5Å; M240-F336 VanDerWaalsContact CE-CE1 3.5Å; M240-F336 HydrophobicContact CE-CE2 4.28Å; M240-F336 HydrophobicContact CE-CG 4.33Å; M240-F336 HydrophobicContact CE-CZ 3.75Å
241	A	98.8	Very high	98	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.5	-38.2	175.7	0	0	0	0	0	112.3	G237 C238 I239 M243 W244 T245 I249 L301 I314	G237-A241 PolarHBondContact O-N 3.37Å; G237-A241 VanDerWaalsContact O-N 3.08Å; C238-A241 PolarHBondContact O-N 2.88Å; I239-A241 PolarHBondContact O-N 3.25Å; A241-M243 PolarHBondContact O-N 3.11Å; A241-W244 PolarHBondContact O-N 2.9Å; A241-W244 VanDerWaalsContact O-N 3.08Å; A241-T245 PolarHBondContact O-N 2.82Å; A241-T245 PolarHBondContact O-OG1 3.03Å; A241-I249 HydrophobicContact CB-CD1 3.86Å; A241-I249 HydrophobicContact CB-CG1 4.5Å; A241-I249 HydrophobicContact CB-CG2 3.76Å; A241-L301 HydrophobicContact CB-CD1 4.23Å; A241-L301 HydrophobicContact CB-CD2 4.22Å; A241-I314 HydrophobicContact CB-CD1 4.46Å; A241-I314 HydrophobicContact CB-CG2 4.37Å
242	E	98.1	Very high	98	Very high	7 Å²	7	11.7 Å²	11.7	3%	0.033	6%	0.056	C	C	.	.	H	α-helix	trans	-60.4	-25.6	177.3	-72.3	-174.8	-128.9	0	0	114.4	L135 Y215 C238 I239 M240 W244 T245 R246 S247	L135-E242 HydrophobicContact CD1-CB 3.89Å; Y215-E242 WeakPolarHBondContact CE1-OE1 3.17Å; Y215-E242 VanDerWaalsContact OH-CD 3.29Å; Y215-E242 PolarHBondContact OH-OE1 3.16Å; Y215-E242 PolarHBondContact OH-OE2 3.34Å; C238-E242 WeakPolarHBondContact O-CG 3.5Å; C238-E242 PolarHBondContact O-N 2.94Å; C238-E242 VanDerWaalsContact O-N 3.09Å; I239-E242 WeakPolarHBondContact O-CB 3.2Å; I239-E242 PolarHBondContact O-N 3.39Å; I239-E242 VanDerWaalsContact O-N 3.15Å; M240-E242 VanDerWaalsContact C-N 3.29Å; M240-E242 PolarHBondContact O-N 3.49Å; E242-W244 PolarHBondContact O-N 3.24Å; E242-W244 VanDerWaalsContact O-N 3.14Å; E242-T245 WeakPolarHBondContact CA-OG1 3.22Å; E242-R246 WeakPolarHBondContact O-CA 3.42Å; E242-R246 PolarHBondContact O-N 3.1Å; E242-S247 WeakPolarHBondContact CG-O 3.27Å
243	M	98.3	Very high	97.8	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.02	9%	0.086	C	C	.	.	H	α-helix	trans	-56.8	-29.9	174.8	-62.9	-59.6	-62.7	0	0	112.4	L131 L135 F142 I147 V150 I239 M240 A241	L131-M243 HydrophobicContact CD1-CE 4.27Å; L131-M243 HydrophobicContact CD1-SD 3.8Å; L131-M243 HydrophobicContact CD2-SD 3.91Å; L131-M243 HydrophobicContact CG-SD 4.27Å; L135-M243 HydrophobicContact CD1-SD 4.43Å; L135-M243 HydrophobicContact CD2-SD 4.12Å; F142-M243 HydrophobicContact CD1-CE 3.91Å; F142-M243 HydrophobicContact CD2-CE 4.12Å; F142-M243 HydrophobicContact CE1-CE 4.03Å; F142-M243 HydrophobicContact CE2-CE 4.26Å; F142-M243 HydrophobicContact CG-CE 3.95Å; F142-M243 HydrophobicContact CZ-CE 4.21Å; I147-M243 HydrophobicContact CB-CE 4.44Å; I147-M243 HydrophobicContact CD1-CB 4.14Å; I147-M243 HydrophobicContact CG1-CB 4.21Å; I147-M243 HydrophobicContact CG1-CE 3.92Å; I147-M243 HydrophobicContact CG2-CB 3.79Å; I147-M243 HydrophobicContact CG2-CE 4.33Å; I147-M243 HydrophobicContact CG2-CG 3.96Å; V150-M243 HydrophobicContact CB-CE 4.14Å; V150-M243 HydrophobicContact CG1-CE 3.99Å; V150-M243 HydrophobicContact CG1-SD 4.08Å; V150-M243 HydrophobicContact CG2-CE 4.06Å; I239-M243 PolarHBondContact O-N 3.13Å; M240-M243 VanDerWaalsContact O-CB 3.32Å; M240-M243 WeakPolarHBondContact O-CB 3.41Å; M240-M243 PolarHBondContact O-N 3.3Å; A241-M243 PolarHBondContact O-N 3.11Å
244	W	97.9	Very high	97.7	Very high	45 Å²	45	21.1 Å²	21.1	17%	0.17	11%	0.109	C	C	.	.	H	α-helix	trans	-103	-41.2	176.6	-67.4	-90.4	0	0	0	113.2	L144 I147 M240 A241 E242 R246 V305 A310 I314 F336	L144-W244 HydrophobicContact CD1-CZ2 4.02Å; I147-W244 HydrophobicContact CB-CH2 4.46Å; I147-W244 HydrophobicContact CB-CZ2 4.3Å; I147-W244 HydrophobicContact CD1-CD2 4.07Å; I147-W244 HydrophobicContact CD1-CG 4.46Å; I147-W244 HydrophobicContact CD1-CH2 4.47Å; I147-W244 HydrophobicContact CD1-CZ2 3.78Å; I147-W244 HydrophobicContact CG2-CH2 3.42Å; I147-W244 VanDerWaalsContact CG2-CH2 3.42Å; I147-W244 HydrophobicContact CG2-CZ2 3.71Å; I147-W244 HydrophobicContact CG2-CZ3 3.91Å; M240-W244 HydrophobicContact CE-CH2 3.98Å; M240-W244 HydrophobicContact CE-CZ3 4.15Å; M240-W244 HydrophobicContact CG-CZ3 3.87Å; M240-W244 WeakPolarHBondContact O-CZ3 3.31Å; A241-W244 PolarHBondContact O-N 2.9Å; A241-W244 VanDerWaalsContact O-N 3.08Å; E242-W244 PolarHBondContact O-N 3.24Å; E242-W244 VanDerWaalsContact O-N 3.14Å; W244-R246 VanDerWaalsContact C-N 3.33Å; W244-R246 PolarHBondContact O-N 3.38Å; W244-V305 HydrophobicContact CB-CG2 3.84Å; W244-V305 HydrophobicContact CD2-CB 4.39Å; W244-V305 HydrophobicContact CD2-CG1 4.17Å; W244-V305 HydrophobicContact CD2-CG2 3.66Å; W244-V305 HydrophobicContact CE3-CG1 4.5Å; W244-V305 HydrophobicContact CE3-CG2 3.85Å; W244-V305 HydrophobicContact CG-CB 4.41Å; W244-V305 HydrophobicContact CG-CG2 3.66Å; W244-V305 HydrophobicContact CH2-CG1 4.48Å; W244-V305 HydrophobicContact CZ2-CG1 4.14Å; W244-A310 HydrophobicContact CH2-CB 3.64Å; W244-A310 HydrophobicContact CZ2-CB 3.81Å; W244-A310 HydrophobicContact CZ3-CB 4.49Å; W244-I314 HydrophobicContact CE3-CD1 4.22Å; W244-I314 HydrophobicContact CZ3-CD1 3.92Å; W244-F336 HydrophobicContact CH2-CE2 4.37Å; W244-F336 HydrophobicContact CH2-CZ 4.04Å
245	T	97	Very high	97.6	Very high	16 Å²	16	24.3 Å²	24.3	10%	0.098	12%	0.124	C	C	.	.	H	α-helix	trans	-76	-20.7	-177.2	62.6	0	0	0	0	113.1	A241 E242 S247 I249 L301 Y304	A241-T245 PolarHBondContact O-N 2.82Å; A241-T245 PolarHBondContact O-OG1 3.03Å; E242-T245 WeakPolarHBondContact CA-OG1 3.22Å; T245-S247 PolarHBondContact O-N 2.86Å; T245-S247 VanDerWaalsContact O-N 3.1Å; T245-S247 PolarHBondContact O-OG 3.42Å; T245-S247 PolarHBondContact OG1-O 3.39Å; T245-I249 HydrophobicContact CG2-CG2 3.94Å; T245-L301 HydrophobicContact CG2-CD2 3.93Å; T245-Y304 HydrophobicContact CG2-CD1 4.36Å; T245-Y304 HydrophobicContact CG2-CD2 4.16Å; T245-Y304 HydrophobicContact CG2-CE2 4.49Å; T245-Y304 HydrophobicContact CG2-CG 4.1Å
246	R	96	Very high	97.5	Very high	55 Å²	55	27 Å²	27	21%	0.208	14%	0.137	C	C	.	.	S	Bend	trans	63.5	1.9	-175.7	-54.2	-58.6	-158.4	109.4	5.5	115.5	L135 N137 V140 E242 W244 R365	L135-R246 PolarHBondContact O-NH1 3.3Å; L135-R246 VanDerWaalsContact O-NH1 3.11Å; N137-R246 PolarHBondContact O-NH1 3.05Å; V140-R246 PolarHBondContact O-NH1 3.48Å; V140-R246 PolarHBondContact O-NH2 3.24Å; E242-R246 WeakPolarHBondContact O-CA 3.42Å; E242-R246 PolarHBondContact O-N 3.1Å; W244-R246 VanDerWaalsContact C-N 3.33Å; W244-R246 PolarHBondContact O-N 3.38Å; R246-R365 PolarHBondContact O-NH2 3.22Å
247	S	94.4	Very high	97.4	Very high	24 Å²	24	28.8 Å²	28.8	17%	0.168	15%	0.145	C	C	.	.	S	Bend	trans	-143.4	146.8	179.8	54.1	0	0	0	0	110.5	E242 T245 I249	E242-S247 WeakPolarHBondContact CG-O 3.27Å; T245-S247 PolarHBondContact O-N 2.86Å; T245-S247 VanDerWaalsContact O-N 3.1Å; T245-S247 PolarHBondContact O-OG 3.42Å; T245-S247 PolarHBondContact OG1-O 3.39Å; S247-I249 PolarHBondContact O-N 2.7Å
248	P	97.1	Very high	97.4	Very high	11 Å²	11	28.8 Å²	28.8	7%	0.071	15%	0.145	C	C	.	.			trans	-53	128.6	175.3	-26.3	34.2	0	0	0	111.6	W214 M250 Q251	W214-P248 HydrophobicContact CE3-CB 3.94Å; W214-P248 HydrophobicContact CE3-CG 3.81Å; W214-P248 HydrophobicContact CZ3-CG 4.07Å; P248-M250 VanDerWaalsContact C-N 3.34Å; P248-M250 PolarHBondContact O-N 2.94Å; P248-Q251 HydrophobicContact CB-CG 3.92Å; P248-Q251 WeakPolarHBondContact O-CG 3.36Å; P248-Q251 PolarHBondContact O-NE2 3.19Å
249	I	97.7	Very high	97.3	Very high	8 Å²	8	28.8 Å²	28.8	4%	0.041	15%	0.145	C	C	.	.	S	Bend	trans	-76.8	-15.3	-169.6	56.9	164.4	0	0	0	114.6	A241 T245 S247 L265 L318	A241-I249 HydrophobicContact CB-CD1 3.86Å; A241-I249 HydrophobicContact CB-CG1 4.5Å; A241-I249 HydrophobicContact CB-CG2 3.76Å; T245-I249 HydrophobicContact CG2-CG2 3.94Å; S247-I249 PolarHBondContact O-N 2.7Å; I249-L265 HydrophobicContact CD1-CD2 4.04Å; I249-L318 HydrophobicContact CD1-CD1 3.88Å
250	M	97.9	Very high	97.2	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.154	C	C	.	.			trans	-141.7	87.5	-177.8	-66.4	177.1	-71.9	0	0	110.1	W214 W234 P248 G252 Q258 L261 I262 L265	W214-M250 WeakPolarHBondContact CA-O 3.16Å; W214-M250 WeakPolarHBondContact CB-O 3.43Å; W234-M250 HydrophobicContact CZ2-CE 3.73Å; W234-M250 HydrophobicContact CZ2-SD 4.47Å; P248-M250 VanDerWaalsContact C-N 3.34Å; P248-M250 PolarHBondContact O-N 2.94Å; M250-G252 PolarHBondContact O-N 3.2Å; M250-Q258 PolarHBondContact O-NE2 3.19Å; M250-Q258 VanDerWaalsContact O-NE2 3.08Å; M250-Q258 PolarHBondContact O-OE1 3.04Å; M250-L261 HydrophobicContact CB-CB 4.32Å; M250-L261 HydrophobicContact CG-CB 4.38Å; M250-I262 HydrophobicContact CE-CG1 4.4Å; M250-I262 HydrophobicContact SD-CB 4.3Å; M250-I262 HydrophobicContact SD-CG1 3.59Å; M250-I262 VanDerWaalsContact SD-CG1 3.59Å; M250-L265 HydrophobicContact CG-CD2 4.16Å; M250-L265 HydrophobicContact SD-CD2 4.01Å
251	Q	97.7	Very high	97.2	Very high	72 Å²	72	30.5 Å²	30.5	34%	0.336	16%	0.155	S	C	.	.			trans	-96.5	66	-174.3	-66.6	173.8	50	0	0	112.5	W214 P248	W214-Q251 HydrophobicContact CD2-CB 4.36Å; W214-Q251 HydrophobicContact CD2-CG 4Å; W214-Q251 HydrophobicContact CE3-CG 4.2Å; W214-Q251 HydrophobicContact CG-CG 4.42Å; W214-Q251 HydrophobicContact CZ2-CB 4.35Å; W214-Q251 HydrophobicContact CZ2-CG 4.32Å; W214-Q251 HydrophobicContact CZ3-CG 4.45Å; P248-Q251 HydrophobicContact CB-CG 3.92Å; P248-Q251 WeakPolarHBondContact O-CG 3.36Å; P248-Q251 PolarHBondContact O-NE2 3.19Å
252	G	97.1	Very high	97.2	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.01	16%	0.155	C	C	.	.			trans	-66.4	145.4	175.6	0	0	0	0	0	112.2	L213 W214 M250 L261	L213-G252 WeakPolarHBondContact CD2-O 3.19Å; W214-G252 PolarHBondContact NE1-O 3.22Å; M250-G252 PolarHBondContact O-N 3.2Å; G252-L261 VanDerWaalsContact N-CD1 3.35Å
253	N	95.6	Very high	97.2	Very high	120 Å²	120	30.1 Å²	30.1	64%	0.642	15%	0.153	S	C	*	.	S	Bend	trans	-96	-19.9	176.7	-65.5	-36.3	0	0	0	112.3	H257	N253-H257 PolarHBondContact N-ND1 2.97Å
254	T	96.8	Very high	97.2	Very high	78 Å²	78	32.5 Å²	32.5	48%	0.479	16%	0.164	S	C	.	.	S	Bend	trans	-140.4	163.3	178	65.4	0	0	0	0	108.6	Q256 H257 Q258	T254-Q256 VanDerWaalsContact C-N 3.26Å; T254-Q256 PolarHBondContact O-N 3.05Å; T254-H257 PolarHBondContact O-N 3.03Å; T254-H257 WeakPolarHBondContact OG1-CB 3.49Å; T254-H257 PolarHBondContact OG1-N 2.75Å; T254-Q258 WeakPolarHBondContact O-CB 3.3Å; T254-Q258 PolarHBondContact O-N 2.93Å
255	E	96.3	Very high	97.2	Very high	68 Å²	68	30.4 Å²	30.4	32%	0.318	16%	0.157	S	C	.	.	H	α-helix	trans	-60.5	-38.2	176.9	-67.8	175.8	172.7	0	0	111.8	L213 R216 L221 Q258 L259	L213-E255 HydrophobicContact CD1-CG 3.99Å; R216-E255 IonicContact CZ-OE1 3.56Å; R216-E255 IonicContact NH1-OE1 2.72Å; R216-E255 PolarHBondContact NH1-OE1 2.96Å; L221-E255 HydrophobicContact CD2-CB 3.79Å; L221-E255 HydrophobicContact CD2-CG 3.85Å; E255-Q258 PolarHBondContact O-N 3.1Å; E255-L259 PolarHBondContact O-N 2.82Å
256	Q	96.1	Very high	97.3	Very high	56 Å²	56	29.8 Å²	29.8	26%	0.262	15%	0.153	S	C	.	.	H	α-helix	trans	-62.6	-48.5	172.9	-178.6	60.9	55.8	0	0	112.2	T254 Q258 L259 T260 M287 E288	T254-Q256 VanDerWaalsContact C-N 3.26Å; T254-Q256 PolarHBondContact O-N 3.05Å; Q256-Q258 VanDerWaalsContact C-N 3.3Å; Q256-Q258 PolarHBondContact O-N 2.72Å; Q256-L259 PolarHBondContact O-N 3.31Å; Q256-T260 PolarHBondContact O-N 3.26Å; Q256-T260 PolarHBondContact O-OG1 3.18Å; Q256-M287 HydrophobicContact CB-CE 4Å; Q256-E288 PolarHBondContact NE2-O 3.38Å
257	H	97.3	Very high	97.3	Very high	38 Å²	38	27.4 Å²	27.4	18%	0.176	15%	0.145	C	C	.	.	H	α-helix	trans	-63.2	-38.8	177.4	-178	-158.1	0	0	0	111.1	N253 T254 L259 T260 L261	N253-H257 PolarHBondContact N-ND1 2.97Å; T254-H257 PolarHBondContact O-N 3.03Å; T254-H257 WeakPolarHBondContact OG1-CB 3.49Å; T254-H257 PolarHBondContact OG1-N 2.75Å; H257-L259 PolarHBondContact O-N 3.04Å; H257-T260 WeakPolarHBondContact O-CB 3.41Å; H257-T260 PolarHBondContact O-N 3.1Å; H257-T260 VanDerWaalsContact O-N 3.16Å; H257-L261 WeakPolarHBondContact O-CG 3.33Å; H257-L261 PolarHBondContact O-N 2.93Å
258	Q	98.3	Very high	97.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-45.6	176.1	-170.5	67.6	29.6	0	0	111.6	L213 L221 M250 T254 E255 Q256 T260 L261 I262	L213-Q258 HydrophobicContact CD1-CB 3.81Å; L213-Q258 HydrophobicContact CD1-CG 3.98Å; L213-Q258 HydrophobicContact CG-CB 4.21Å; L213-Q258 HydrophobicContact CG-CG 4.31Å; L213-Q258 VanDerWaalsContact O-CD 3.3Å; L221-Q258 HydrophobicContact CD1-CB 4.1Å; L221-Q258 HydrophobicContact CD1-CG 3.64Å; L221-Q258 HydrophobicContact CD2-CB 4.36Å; L221-Q258 HydrophobicContact CD2-CG 4.43Å; M250-Q258 PolarHBondContact O-NE2 3.19Å; M250-Q258 VanDerWaalsContact O-NE2 3.08Å; M250-Q258 PolarHBondContact O-OE1 3.04Å; T254-Q258 WeakPolarHBondContact O-CB 3.3Å; T254-Q258 PolarHBondContact O-N 2.93Å; E255-Q258 PolarHBondContact O-N 3.1Å; Q256-Q258 VanDerWaalsContact C-N 3.3Å; Q256-Q258 PolarHBondContact O-N 2.72Å; Q258-T260 VanDerWaalsContact C-N 3.28Å; Q258-T260 PolarHBondContact O-N 2.97Å; Q258-L261 PolarHBondContact O-N 3.21Å; Q258-I262 HydrophobicContact CG-CD1 4.17Å; Q258-I262 VanDerWaalsContact O-CG1 3.29Å; Q258-I262 WeakPolarHBondContact O-CG1 3.29Å; Q258-I262 PolarHBondContact O-N 3.35Å
259	L	97.4	Very high	97.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.9	-35.8	174.6	-80.9	165.5	0	0	0	112.7	P218 L221 L222 E255 Q256 H257 I262 S263 I269 M287 L289	P218-L259 HydrophobicContact CB-CD2 4.4Å; L221-L259 HydrophobicContact CB-CD1 3.88Å; L221-L259 HydrophobicContact CB-CD2 3.78Å; L221-L259 HydrophobicContact CB-CG 3.72Å; L221-L259 HydrophobicContact CD1-CD2 4.07Å; L221-L259 HydrophobicContact CD1-CG 3.97Å; L221-L259 HydrophobicContact CG-CG 4.37Å; L222-L259 HydrophobicContact CD2-CD1 4.22Å; L222-L259 HydrophobicContact CD2-CD2 4.48Å; L222-L259 HydrophobicContact CG-CD2 4.49Å; E255-L259 PolarHBondContact O-N 2.82Å; Q256-L259 PolarHBondContact O-N 3.31Å; H257-L259 PolarHBondContact O-N 3.04Å; L259-I262 PolarHBondContact O-N 2.85Å; L259-S263 WeakPolarHBondContact O-CB 3.17Å; L259-S263 PolarHBondContact O-N 2.85Å; L259-S263 PolarHBondContact O-OG 2.79Å; L259-I269 HydrophobicContact CD2-CD1 3.67Å; L259-M287 HydrophobicContact CD1-CE 3.44Å; L259-M287 VanDerWaalsContact CD1-CE 3.44Å; L259-M287 HydrophobicContact CD1-SD 3.48Å; L259-M287 WeakPolarHBondContact CD1-SD 3.39Å; L259-L289 HydrophobicContact CB-CD2 4.09Å; L259-L289 HydrophobicContact CD1-CD2 4Å; L259-L289 HydrophobicContact CD2-CD2 4.4Å; L259-L289 HydrophobicContact CG-CD2 4.4Å
260	T	97.6	Very high	97.3	Very high	33 Å²	33	28.4 Å²	28.4	20%	0.202	15%	0.151	C	C	.	.	H	α-helix	trans	-61.7	-48.5	173.9	-63.5	0	0	0	0	111.5	Q256 H257 Q258 S263 Q264 P290	Q256-T260 PolarHBondContact O-N 3.26Å; Q256-T260 PolarHBondContact O-OG1 3.18Å; H257-T260 WeakPolarHBondContact O-CB 3.41Å; H257-T260 PolarHBondContact O-N 3.1Å; H257-T260 VanDerWaalsContact O-N 3.16Å; Q258-T260 VanDerWaalsContact C-N 3.28Å; Q258-T260 PolarHBondContact O-N 2.97Å; T260-S263 PolarHBondContact O-N 2.79Å; T260-Q264 VanDerWaalsContact O-CG 3.3Å; T260-Q264 WeakPolarHBondContact O-CG 2.95Å; T260-Q264 PolarHBondContact O-N 3.37Å; T260-P290 HydrophobicContact CG2-CG 3.91Å
261	L	98.3	Very high	97	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-42.9	178.2	-63.5	173.5	0	0	0	111.7	M250 G252 H257 Q258 S263 Q264 L265 V392	M250-L261 HydrophobicContact CB-CB 4.32Å; M250-L261 HydrophobicContact CG-CB 4.38Å; G252-L261 VanDerWaalsContact N-CD1 3.35Å; H257-L261 WeakPolarHBondContact O-CG 3.33Å; H257-L261 PolarHBondContact O-N 2.93Å; Q258-L261 PolarHBondContact O-N 3.21Å; L261-S263 VanDerWaalsContact C-N 3.3Å; L261-S263 PolarHBondContact O-N 3.38Å; L261-Q264 PolarHBondContact O-N 3.32Å; L261-L265 PolarHBondContact O-N 2.95Å; L261-L265 VanDerWaalsContact O-N 3.11Å; L261-V392 HydrophobicContact CD2-CG2 3.74Å
262	I	98.5	Very high	96.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-56.8	-47.5	173.7	-69.8	170.7	0	0	0	109.9	P218 L221 W234 M250 Q258 L259 Q264 L265 C266 L320	P218-I262 HydrophobicContact CB-CD1 4.49Å; P218-I262 HydrophobicContact CB-CG2 4.45Å; L221-I262 HydrophobicContact CD1-CD1 3.51Å; W234-I262 HydrophobicContact CH2-CG1 4.4Å; W234-I262 HydrophobicContact CH2-CG2 3.9Å; W234-I262 HydrophobicContact CZ2-CD1 3.89Å; W234-I262 HydrophobicContact CZ2-CG1 3.91Å; W234-I262 HydrophobicContact CZ2-CG2 4.26Å; M250-I262 HydrophobicContact CE-CG1 4.4Å; M250-I262 HydrophobicContact SD-CB 4.3Å; M250-I262 HydrophobicContact SD-CG1 3.59Å; M250-I262 VanDerWaalsContact SD-CG1 3.59Å; Q258-I262 HydrophobicContact CG-CD1 4.17Å; Q258-I262 VanDerWaalsContact O-CG1 3.29Å; Q258-I262 WeakPolarHBondContact O-CG1 3.29Å; Q258-I262 PolarHBondContact O-N 3.35Å; L259-I262 PolarHBondContact O-N 2.85Å; I262-Q264 VanDerWaalsContact C-N 3.34Å; I262-Q264 PolarHBondContact O-N 3.25Å; I262-L265 PolarHBondContact O-N 3.44Å; I262-C266 HydrophobicContact CG2-CB 4.3Å; I262-C266 WeakPolarHBondContact O-CA 3.41Å; I262-C266 VanDerWaalsContact O-CB 3.25Å; I262-C266 WeakPolarHBondContact O-CB 3.49Å; I262-C266 PolarHBondContact O-N 3.01Å; I262-L320 HydrophobicContact CG2-CD2 3.64Å
263	S	98.1	Very high	96.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-37.9	-179	-58.6	0	0	0	0	112.5	L259 T260 L261 L265 G267 Q293	L259-S263 WeakPolarHBondContact O-CB 3.17Å; L259-S263 PolarHBondContact O-N 2.85Å; L259-S263 PolarHBondContact O-OG 2.79Å; T260-S263 PolarHBondContact O-N 2.79Å; L261-S263 VanDerWaalsContact C-N 3.3Å; L261-S263 PolarHBondContact O-N 3.38Å; S263-L265 VanDerWaalsContact C-N 3.31Å; S263-L265 PolarHBondContact O-N 3.24Å; S263-G267 VanDerWaalsContact CA-O 3.32Å; S263-G267 WeakPolarHBondContact CA-O 3.33Å; S263-G267 CarbonylContact O-C 3.5Å; S263-G267 VanDerWaalsContact O-CA 3.22Å; S263-G267 WeakPolarHBondContact O-CA 3.48Å; S263-G267 PolarHBondContact O-N 2.93Å; S263-Q293 WeakPolarHBondContact O-CB 3.33Å
264	Q	97.6	Very high	96.4	Very high	54 Å²	54	32.5 Å²	32.5	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-66.3	-31.1	177.9	-73.8	172.2	-3.6	0	0	113.3	T260 L261 I262	T260-Q264 VanDerWaalsContact O-CG 3.3Å; T260-Q264 WeakPolarHBondContact O-CG 2.95Å; T260-Q264 PolarHBondContact O-N 3.37Å; L261-Q264 PolarHBondContact O-N 3.32Å; I262-Q264 VanDerWaalsContact C-N 3.34Å; I262-Q264 PolarHBondContact O-N 3.25Å
265	L	98.3	Very high	96.3	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-93.7	-52	-179.2	-178.1	62.9	0	0	0	112.3	I249 M250 L261 I262 S263 K296 V297 R300 V392 F393	I249-L265 HydrophobicContact CD1-CD2 4.04Å; M250-L265 HydrophobicContact CG-CD2 4.16Å; M250-L265 HydrophobicContact SD-CD2 4.01Å; L261-L265 PolarHBondContact O-N 2.95Å; L261-L265 VanDerWaalsContact O-N 3.11Å; I262-L265 PolarHBondContact O-N 3.44Å; S263-L265 VanDerWaalsContact C-N 3.31Å; S263-L265 PolarHBondContact O-N 3.24Å; L265-K296 CarbonylContact O-C 3.44Å; L265-K296 PolarHBondContact O-N 2.91Å; L265-V297 HydrophobicContact CG-CG2 4.13Å; L265-V297 PolarHBondContact O-N 2.8Å; L265-R300 HydrophobicContact CD1-CB 3.95Å; L265-R300 HydrophobicContact CD1-CG 3.92Å; L265-V392 HydrophobicContact CB-CG1 4.43Å; L265-F393 HydrophobicContact CD1-CZ 4.48Å
266	C	98.4	Very high	96	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.02	19%	0.187	C	C	.	.	H	α-helix	trans	-89.2	-7.3	-171.8	-61.8	0	0	0	0	113.7	I262 R295 L320	I262-C266 HydrophobicContact CG2-CB 4.3Å; I262-C266 WeakPolarHBondContact O-CA 3.41Å; I262-C266 VanDerWaalsContact O-CB 3.25Å; I262-C266 WeakPolarHBondContact O-CB 3.49Å; I262-C266 PolarHBondContact O-N 3.01Å; C266-R295 WeakPolarHBondContact O-CB 3.38Å; C266-R295 WeakPolarHBondContact O-CG 3.33Å; C266-R295 PolarHBondContact O-NH1 2.77Å; C266-L320 HydrophobicContact CB-CD2 3.65Å; C266-L320 HydrophobicContact CB-CG 4.1Å
267	G	97.9	Very high	95.9	Very high	5 Å²	5	28.8 Å²	28.8	5%	0.052	18%	0.175	C	C	.	.			trans	95.4	162	-173.5	0	0	0	0	0	112.1	S263 I269 Q293	S263-G267 VanDerWaalsContact CA-O 3.32Å; S263-G267 WeakPolarHBondContact CA-O 3.33Å; S263-G267 CarbonylContact O-C 3.5Å; S263-G267 VanDerWaalsContact O-CA 3.22Å; S263-G267 WeakPolarHBondContact O-CA 3.48Å; S263-G267 PolarHBondContact O-N 2.93Å; G267-I269 PolarHBondContact O-N 2.75Å; G267-Q293 WeakPolarHBondContact CA-O 3.44Å
268	S	97.2	Very high	95.5	Very high	9 Å²	9	29.7 Å²	29.7	6%	0.063	18%	0.18	C	C	.	.			trans	-60.1	138.3	178.7	-77.5	0	0	0	0	111	T270 P290 K291 G292 Q293	S268-T270 PolarHBondContact O-N 3.34Å; S268-T270 VanDerWaalsContact O-N 3.1Å; S268-P290 WeakPolarHBondContact CB-O 3.49Å; S268-P290 PolarHBondContact OG-O 2.56Å; S268-K291 VanDerWaalsContact OG-C 3.28Å; S268-K291 WeakPolarHBondContact OG-CA 3.11Å; S268-G292 PolarHBondContact OG-N 2.82Å; S268-G292 VanDerWaalsContact OG-N 3.16Å; S268-Q293 PolarHBondContact N-O 2.9Å; S268-Q293 WeakPolarHBondContact OG-CB 3.37Å; S268-Q293 PolarHBondContact OG-N 3.28Å
269	I	96.3	Very high	94.9	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.026	22%	0.217	C	C	.	.			trans	-72	103.8	170.6	-57.4	174.4	0	0	0	107.6	P218 L222 L259 G267 W274 V277 Y284 L289 L320	P218-I269 HydrophobicContact CB-CD1 4.27Å; L222-I269 HydrophobicContact CD1-CD1 4.39Å; L222-I269 HydrophobicContact CD1-CG2 4.31Å; L259-I269 HydrophobicContact CD2-CD1 3.67Å; G267-I269 PolarHBondContact O-N 2.75Å; I269-W274 HydrophobicContact CG2-CE3 3.96Å; I269-V277 HydrophobicContact CG2-CG1 4.29Å; I269-V277 HydrophobicContact CG2-CG2 3.72Å; I269-Y284 HydrophobicContact CG2-CD2 4.25Å; I269-Y284 HydrophobicContact CG2-CE2 3.94Å; I269-Y284 PolarHBondContact O-OH 3.11Å; I269-L289 HydrophobicContact CB-CD1 4.44Å; I269-L289 HydrophobicContact CD1-CD2 4.49Å; I269-L320 HydrophobicContact CG1-CD1 4.23Å; I269-L320 HydrophobicContact CG1-CD2 4.33Å
270	T	93.9	Very high	94.5	Very high	49 Å²	49	43.4 Å²	43.4	30%	0.301	24%	0.24	S	C	.	.			trans	-129.6	163.2	-180	67.2	0	0	0	0	110.1	S268 E272 A273 W274	S268-T270 PolarHBondContact O-N 3.34Å; S268-T270 VanDerWaalsContact O-N 3.1Å; T270-E272 PolarHBondContact O-N 3.3Å; T270-E272 PolarHBondContact OG1-N 3.27Å; T270-A273 PolarHBondContact O-N 2.53Å; T270-A273 PolarHBondContact OG1-N 2.84Å; T270-W274 PolarHBondContact O-N 3.26Å
271	A	91.7	Very high	94.2	Very high	54 Å²	54	42.2 Å²	42.2	45%	0.446	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.9	174.2	0	0	0	0	0	113.6	W274 P275	A271-W274 WeakPolarHBondContact CA-O 3.49Å; A271-W274 CarbonylContact O-C 3.57Å; A271-P275 WeakPolarHBondContact O-CA 3.42Å
272	E	90.8	Very high	93.8	Very high	182 Å²	182	49 Å²	49	85%	0.85	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-50	174.2	-178.7	-174.1	-179.4	0	0	111.2	T270 W274	T270-E272 PolarHBondContact O-N 3.3Å; T270-E272 PolarHBondContact OG1-N 3.27Å; E272-W274 VanDerWaalsContact C-N 3.33Å
273	A	92.2	Very high	93.5	Very high	42 Å²	42	52 Å²	52	35%	0.347	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-22.6	178.9	0	0	0	0	0	112.9	T270 L320	T270-A273 PolarHBondContact O-N 2.53Å; T270-A273 PolarHBondContact OG1-N 2.84Å; A273-L320 HydrophobicContact CB-CD1 4.28Å
274	W	96.4	Very high	93.2	Very high	3 Å²	3	54.9 Å²	54.9	1%	0.011	29%	0.291	C	S	.	.	S	Bend	trans	-143.6	93.7	-179.9	-170.2	-10	0	0	0	110.9	P218 E219 L222 I269 T270 A271 E272 A276 V277 Y281 L320 D321 P322	P218-W274 HydrophobicContact CB-CH2 4.48Å; P218-W274 HydrophobicContact CB-CZ3 3.95Å; P218-W274 HydrophobicContact CG-CH2 4.37Å; P218-W274 HydrophobicContact CG-CZ3 3.98Å; E219-W274 HydrophobicContact CB-CH2 3.65Å; E219-W274 HydrophobicContact CB-CZ2 3.99Å; L222-W274 HydrophobicContact CD1-CH2 4.32Å; L222-W274 HydrophobicContact CD1-CZ3 3.9Å; I269-W274 HydrophobicContact CG2-CE3 3.96Å; T270-W274 PolarHBondContact O-N 3.26Å; A271-W274 WeakPolarHBondContact CA-O 3.49Å; A271-W274 CarbonylContact O-C 3.57Å; E272-W274 VanDerWaalsContact C-N 3.33Å; W274-A276 PolarHBondContact O-N 3.47Å; W274-V277 HydrophobicContact CB-CB 3.97Å; W274-V277 HydrophobicContact CB-CG1 4.31Å; W274-V277 HydrophobicContact CB-CG2 4.45Å; W274-V277 HydrophobicContact CD2-CB 3.93Å; W274-V277 HydrophobicContact CD2-CG2 3.67Å; W274-V277 HydrophobicContact CE3-CB 4.38Å; W274-V277 HydrophobicContact CE3-CG2 3.69Å; W274-V277 HydrophobicContact CG-CB 3.71Å; W274-V277 HydrophobicContact CG-CG2 4.01Å; W274-V277 HydrophobicContact CZ3-CG2 4.25Å; W274-V277 WeakPolarHBondContact O-CB 3.48Å; W274-V277 WeakPolarHBondContact O-CG1 3.48Å; W274-V277 PolarHBondContact O-N 3.22Å; W274-Y281 AromaticContact CE2-CE2 3.85Å; W274-Y281 AromaticContact CH2-CE2 3.8Å; W274-Y281 HydrophobicContact CH2-CE2 3.8Å; W274-Y281 AromaticContact CZ2-CE2 3.4Å; W274-Y281 HydrophobicContact CZ2-CE2 3.4Å; W274-Y281 VanDerWaalsContact CZ2-CE2 3.4Å; W274-Y281 AromaticContact CZ2-CZ 3.78Å; W274-Y281 VanDerWaalsContact CZ2-OH 3.28Å; W274-Y281 WeakPolarHBondContact CZ2-OH 3.5Å; W274-L320 HydrophobicContact CE3-CB 4.3Å; W274-D321 HydrophobicContact CB-CB 4.14Å; W274-D321 VanDerWaalsContact CD1-CG 3.43Å; W274-D321 HydrophobicContact CD2-CB 4.28Å; W274-D321 HydrophobicContact CG-CB 3.78Å; W274-D321 PolarHBondContact NE1-OD1 3.37Å; W274-D321 VanDerWaalsContact NE1-OD1 3.14Å; W274-P322 HydrophobicContact CZ2-CG 3.88Å
275	P	94.1	Very high	92.7	Very high	72 Å²	72	59.7 Å²	59.7	47%	0.468	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	131.8	179.7	-28.3	36.2	0	0	0	112.6	A271 V277	A271-P275 WeakPolarHBondContact O-CA 3.42Å; P275-V277 PolarHBondContact O-N 2.69Å
276	A	90.5	Very high	92.4	Very high	52 Å²	52	66.5 Å²	66.5	43%	0.43	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	16	178.5	0	0	0	0	0	116.5	W274 D278 K279 K280	W274-A276 PolarHBondContact O-N 3.47Å; A276-D278 PolarHBondContact O-N 3.4Å; A276-K279 PolarHBondContact O-N 2.96Å; A276-K279 VanDerWaalsContact O-N 3.12Å; A276-K280 WeakPolarHBondContact O-CB 3.22Å; A276-K280 PolarHBondContact O-N 2.94Å
277	V	92.9	Very high	92	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-54.7	-36.6	176.6	69.2	0	0	0	0	113.1	L222 I269 W274 P275 Y281 Y284	L222-V277 HydrophobicContact CD1-CG2 3.81Å; I269-V277 HydrophobicContact CG2-CG1 4.29Å; I269-V277 HydrophobicContact CG2-CG2 3.72Å; W274-V277 HydrophobicContact CB-CB 3.97Å; W274-V277 HydrophobicContact CB-CG1 4.31Å; W274-V277 HydrophobicContact CB-CG2 4.45Å; W274-V277 HydrophobicContact CD2-CB 3.93Å; W274-V277 HydrophobicContact CD2-CG2 3.67Å; W274-V277 HydrophobicContact CE3-CB 4.38Å; W274-V277 HydrophobicContact CE3-CG2 3.69Å; W274-V277 HydrophobicContact CG-CB 3.71Å; W274-V277 HydrophobicContact CG-CG2 4.01Å; W274-V277 HydrophobicContact CZ3-CG2 4.25Å; W274-V277 WeakPolarHBondContact O-CB 3.48Å; W274-V277 WeakPolarHBondContact O-CG1 3.48Å; W274-V277 PolarHBondContact O-N 3.22Å; P275-V277 PolarHBondContact O-N 2.69Å; V277-Y281 HydrophobicContact CG2-CD2 3.72Å; V277-Y281 HydrophobicContact CG2-CE2 4.05Å; V277-Y281 WeakPolarHBondContact O-CD2 3.43Å; V277-Y281 PolarHBondContact O-N 3.35Å; V277-Y284 HydrophobicContact CG1-CD2 4.16Å; V277-Y284 HydrophobicContact CG1-CE2 3.84Å; V277-Y284 HydrophobicContact CG2-CD2 3.96Å; V277-Y284 HydrophobicContact CG2-CE2 4.36Å
278	D	88.5	Confident	91.6	Very high	56 Å²	56	75.8 Å²	75.8	30%	0.299	39%	0.385	S	S	.	.	H	α-helix	trans	-71.2	-32.3	-179.6	63.5	-48.5	0	0	0	113.5	A276 Y284	A276-D278 PolarHBondContact O-N 3.4Å; D278-Y284 HydrophobicContact CB-CD1 3.84Å; D278-Y284 HydrophobicContact CB-CE1 3.7Å
279	K	87.3	Confident	91.4	Very high	179 Å²	179	76.5 Å²	76.5	78%	0.778	39%	0.388	S	S	*	.	H	α-helix	trans	-87.8	-29	178.4	-62.3	179.8	-175.3	176.7	0	112.1	A276	A276-K279 PolarHBondContact O-N 2.96Å; A276-K279 VanDerWaalsContact O-N 3.12Å
280	K	88.3	Confident	91.2	Very high	109 Å²	109	77.7 Å²	77.7	47%	0.474	40%	0.396	S	S	.	.	H	α-helix	trans	-82.6	-36.5	-173.5	-169	176.3	-178.6	-153.7	0	112.7	E224 A276	E224-K280 WeakPolarHBondContact OE2-CE 3.34Å; E224-K280 IonicContact OE2-NZ 3.59Å; E224-K280 PolarHBondContact OE2-NZ 2.76Å; A276-K280 WeakPolarHBondContact O-CB 3.22Å; A276-K280 PolarHBondContact O-N 2.94Å
281	Y	92.2	Very high	91.1	Very high	8 Å²	8	84.4 Å²	84.4	3%	0.031	42%	0.421	C	S	.	.			trans	-118.8	116.3	-171.7	-56	-59.7	0	0	0	112.9	L222 E224 W274 V277 L283 Y284	L222-Y281 HydrophobicContact CB-CD1 4.34Å; L222-Y281 HydrophobicContact CB-CD2 4.03Å; L222-Y281 HydrophobicContact CB-CG 3.86Å; L222-Y281 HydrophobicContact CD1-CD2 3.91Å; L222-Y281 HydrophobicContact CD1-CE2 4.38Å; E224-Y281 HydrophobicContact CB-CD1 4.47Å; E224-Y281 HydrophobicContact CB-CE1 3.64Å; E224-Y281 HydrophobicContact CG-CE1 4.14Å; E224-Y281 VanDerWaalsContact OE2-CE1 3.3Å; E224-Y281 WeakPolarHBondContact OE2-CE1 3.18Å; E224-Y281 PolarHBondContact OE2-OH 2.88Å; W274-Y281 AromaticContact CE2-CE2 3.85Å; W274-Y281 AromaticContact CH2-CE2 3.8Å; W274-Y281 HydrophobicContact CH2-CE2 3.8Å; W274-Y281 AromaticContact CZ2-CE2 3.4Å; W274-Y281 HydrophobicContact CZ2-CE2 3.4Å; W274-Y281 VanDerWaalsContact CZ2-CE2 3.4Å; W274-Y281 AromaticContact CZ2-CZ 3.78Å; W274-Y281 VanDerWaalsContact CZ2-OH 3.28Å; W274-Y281 WeakPolarHBondContact CZ2-OH 3.5Å; V277-Y281 HydrophobicContact CG2-CD2 3.72Å; V277-Y281 HydrophobicContact CG2-CE2 4.05Å; V277-Y281 WeakPolarHBondContact O-CD2 3.43Å; V277-Y281 PolarHBondContact O-N 3.35Å; Y281-L283 PolarHBondContact O-N 3.38Å; Y281-Y284 VanDerWaalsContact O-CB 3.26Å; Y281-Y284 WeakPolarHBondContact O-CB 3.47Å; Y281-Y284 PolarHBondContact O-N 3.07Å; Y281-Y284 VanDerWaalsContact O-N 3.11Å
282	E	89.7	Confident	91.3	Very high	147 Å²	147	85.4 Å²	85.4	69%	0.687	44%	0.436	S	S	*	.	H	α-helix	trans	-59.5	-33.2	175	-65.1	-178	-163.4	0	0	113.1	Y284 K286	E282-Y284 PolarHBondContact O-N 3.4Å; E282-K286 IonicContact OE2-NZ 3.56Å; E282-K286 PolarHBondContact OE2-NZ 3.23Å
283	L	91.6	Very high	91.6	Very high	63 Å²	63	79.7 Å²	79.7	33%	0.33	41%	0.409	S	S	.	.	H	α-helix	trans	-71.1	-20.9	-179.6	-64.8	-174.4	0	0	0	112.5	Y281 Q285 K286 M287	Y281-L283 PolarHBondContact O-N 3.38Å; L283-Q285 PolarHBondContact O-N 3.25Å; L283-K286 HydrophobicContact CD2-CD 4.21Å; L283-K286 PolarHBondContact O-N 2.81Å; L283-M287 HydrophobicContact CB-CG 4.31Å; L283-M287 HydrophobicContact CB-SD 4.31Å; L283-M287 WeakPolarHBondContact O-CB 3.3Å; L283-M287 WeakPolarHBondContact O-CG 3.26Å; L283-M287 PolarHBondContact O-N 3.36Å
284	Y	91.1	Very high	91.8	Very high	59 Å²	59	85.7 Å²	85.7	23%	0.231	43%	0.428	C	S	.	.	H	α-helix	trans	-57.2	-37.6	177.5	178.7	-95.7	0	0	0	112.1	I269 V277 D278 Y281 E282 L289	I269-Y284 HydrophobicContact CG2-CD2 4.25Å; I269-Y284 HydrophobicContact CG2-CE2 3.94Å; I269-Y284 PolarHBondContact O-OH 3.11Å; V277-Y284 HydrophobicContact CG1-CD2 4.16Å; V277-Y284 HydrophobicContact CG1-CE2 3.84Å; V277-Y284 HydrophobicContact CG2-CD2 3.96Å; V277-Y284 HydrophobicContact CG2-CE2 4.36Å; D278-Y284 HydrophobicContact CB-CD1 3.84Å; D278-Y284 HydrophobicContact CB-CE1 3.7Å; Y281-Y284 VanDerWaalsContact O-CB 3.26Å; Y281-Y284 WeakPolarHBondContact O-CB 3.47Å; Y281-Y284 PolarHBondContact O-N 3.07Å; Y281-Y284 VanDerWaalsContact O-N 3.11Å; E282-Y284 PolarHBondContact O-N 3.4Å; Y284-L289 HydrophobicContact CD2-CD1 3.37Å; Y284-L289 HydrophobicContact CE2-CD1 3.53Å; Y284-L289 HydrophobicContact CG-CD1 4.25Å
285	Q	88.1	Confident	91.9	Very high	156 Å²	156	89.5 Å²	89.5	73%	0.729	44%	0.442	S	S	*	.	H	α-helix	trans	-83.7	-20.8	178.7	-60.9	-179.1	4.1	0	0	113.2	L283	L283-Q285 PolarHBondContact O-N 3.25Å
286	K	90.9	Very high	92.1	Very high	143 Å²	143	89.7 Å²	89.7	62%	0.622	44%	0.436	S	S	*	.	H	α-helix	trans	-93.3	-20.6	-176.1	-64.1	173.6	-176.1	166.6	0	112.8	E282 L283	E282-K286 IonicContact OE2-NZ 3.56Å; E282-K286 PolarHBondContact OE2-NZ 3.23Å; L283-K286 HydrophobicContact CD2-CD 4.21Å; L283-K286 PolarHBondContact O-N 2.81Å
287	M	89.8	Confident	92.4	Very high	37 Å²	37	87.2 Å²	87.2	18%	0.182	42%	0.415	C	S	.	.	S	Bend	trans	-97.9	146.3	-178.5	-64.8	-165.9	76.3	0	0	112	Q256 L259 L283 L289	Q256-M287 HydrophobicContact CB-CE 4Å; L259-M287 HydrophobicContact CD1-CE 3.44Å; L259-M287 VanDerWaalsContact CD1-CE 3.44Å; L259-M287 HydrophobicContact CD1-SD 3.48Å; L259-M287 WeakPolarHBondContact CD1-SD 3.39Å; L283-M287 HydrophobicContact CB-CG 4.31Å; L283-M287 HydrophobicContact CB-SD 4.31Å; L283-M287 WeakPolarHBondContact O-CB 3.3Å; L283-M287 WeakPolarHBondContact O-CG 3.26Å; L283-M287 PolarHBondContact O-N 3.36Å; M287-L289 HydrophobicContact CB-CD2 4.38Å; M287-L289 HydrophobicContact CB-CG 4.48Å; M287-L289 PolarHBondContact O-N 2.87Å; M287-L289 VanDerWaalsContact O-N 3.11Å
288	E	90.9	Very high	92.7	Very high	166 Å²	166	90.9 Å²	90.9	78%	0.776	43%	0.431	S	S	*	.			trans	-82.8	87	178.1	-68.3	-175.2	170	0	0	110.5	Q256	Q256-E288 PolarHBondContact NE2-O 3.38Å
289	L	92.3	Very high	93	Very high	25 Å²	25	93.7 Å²	93.7	13%	0.131	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-86	131.1	-177.8	-61.1	176.5	0	0	0	111.8	L222 L259 I269 Y284 M287 K291	L222-L289 HydrophobicContact CD2-CD1 4.36Å; L259-L289 HydrophobicContact CB-CD2 4.09Å; L259-L289 HydrophobicContact CD1-CD2 4Å; L259-L289 HydrophobicContact CD2-CD2 4.4Å; L259-L289 HydrophobicContact CG-CD2 4.4Å; I269-L289 HydrophobicContact CB-CD1 4.44Å; I269-L289 HydrophobicContact CD1-CD2 4.49Å; Y284-L289 HydrophobicContact CD2-CD1 3.37Å; Y284-L289 HydrophobicContact CE2-CD1 3.53Å; Y284-L289 HydrophobicContact CG-CD1 4.25Å; M287-L289 HydrophobicContact CB-CD2 4.38Å; M287-L289 HydrophobicContact CB-CG 4.48Å; M287-L289 PolarHBondContact O-N 2.87Å; M287-L289 VanDerWaalsContact O-N 3.11Å; L289-K291 PolarHBondContact O-N 2.83Å
290	P	92.9	Very high	93.4	Very high	29 Å²	29	88.7 Å²	88.7	19%	0.188	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-59.3	131	174.8	-24.3	33.6	0	0	0	112.4	T260 S268 Q293	T260-P290 HydrophobicContact CG2-CG 3.91Å; S268-P290 WeakPolarHBondContact CB-O 3.49Å; S268-P290 PolarHBondContact OG-O 2.56Å; P290-Q293 HydrophobicContact CB-CG 3.98Å
291	K	92.2	Very high	93.9	Very high	191 Å²	191	83.5 Å²	83.5	83%	0.83	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-102.6	154.6	177.8	-61.2	-178.9	-177.7	177.5	0	111.1	S268 L289 Q293	S268-K291 VanDerWaalsContact OG-C 3.28Å; S268-K291 WeakPolarHBondContact OG-CA 3.11Å; L289-K291 PolarHBondContact O-N 2.83Å; K291-Q293 VanDerWaalsContact C-N 3.25Å; K291-Q293 PolarHBondContact O-N 2.78Å
292	G	94.6	Very high	94	Very high	74 Å²	74	89.6 Å²	89.6	76%	0.763	43%	0.427	S	S	*	.	S	Bend	trans	72.1	10.5	175.9	0	0	0	0	0	115.5	S268 K294	S268-G292 PolarHBondContact OG-N 2.82Å; S268-G292 VanDerWaalsContact OG-N 3.16Å; G292-K294 PolarHBondContact O-N 2.9Å
293	Q	97.1	Very high	94.3	Very high	62 Å²	62	85.9 Å²	85.9	29%	0.29	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-75.7	122.4	173.9	-59.8	-61.4	-32.9	0	0	109.4	S263 G267 S268 P290 K291	S263-Q293 WeakPolarHBondContact O-CB 3.33Å; G267-Q293 WeakPolarHBondContact CA-O 3.44Å; S268-Q293 PolarHBondContact N-O 2.9Å; S268-Q293 WeakPolarHBondContact OG-CB 3.37Å; S268-Q293 PolarHBondContact OG-N 3.28Å; P290-Q293 HydrophobicContact CB-CG 3.98Å; K291-Q293 VanDerWaalsContact C-N 3.25Å; K291-Q293 PolarHBondContact O-N 2.78Å
294	K	97.1	Very high	94.6	Very high	168 Å²	168	87.2 Å²	87.2	73%	0.73	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-79.2	148.1	169	-63.5	-173.9	178.9	-175.7	0	109.7	G292 K296	G292-K294 PolarHBondContact O-N 2.9Å; K294-K296 WeakPolarHBondContact O-CG 3.15Å; K294-K296 PolarHBondContact O-N 2.79Å
295	R	97.9	Very high	94.9	Very high	83 Å²	83	84.4 Å²	84.4	31%	0.313	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-64.1	128	171.6	-176	171.1	-173.1	84	-1.9	109.9	C266 V297 D315 L318	C266-R295 WeakPolarHBondContact O-CB 3.38Å; C266-R295 WeakPolarHBondContact O-CG 3.33Å; C266-R295 PolarHBondContact O-NH1 2.77Å; R295-V297 HydrophobicContact CG-CG2 4.24Å; R295-D315 IonicContact CZ-OD1 2.8Å; R295-D315 IonicContact NE-OD1 3.91Å; R295-D315 PolarHBondContact NE-OD1 2.68Å; R295-D315 PolarHBondContact NH2-O 3.37Å; R295-D315 IonicContact NH2-OD1 3.71Å; R295-D315 PolarHBondContact NH2-OD1 3.48Å; R295-L318 PolarHBondContact NH1-O 2.91Å; R295-L318 PolarHBondContact NH2-O 2.91Å
296	K	97.7	Very high	95.2	Very high	76 Å²	76	84.4 Å²	84.4	33%	0.33	41%	0.409	S	S	.	.			trans	-132.7	15.7	-174	-66	168.1	-172.3	172.3	0	112.9	L265 K294 K298 D299 R300	L265-K296 CarbonylContact O-C 3.44Å; L265-K296 PolarHBondContact O-N 2.91Å; K294-K296 WeakPolarHBondContact O-CG 3.15Å; K294-K296 PolarHBondContact O-N 2.79Å; K296-K298 PolarHBondContact O-N 2.86Å; K296-D299 PolarHBondContact O-N 2.85Å; K296-R300 HydrophobicContact CB-CG 4.01Å; K296-R300 VanDerWaalsContact O-CB 3.27Å; K296-R300 WeakPolarHBondContact O-CB 3.42Å; K296-R300 VanDerWaalsContact O-CG 3.3Å; K296-R300 WeakPolarHBondContact O-CG 3.26Å; K296-R300 PolarHBondContact O-N 3.49Å
297	V	97.8	Very high	95.6	Very high	1 Å²	1	78.8 Å²	78.8	1%	0.006	39%	0.385	C	S	.	.	H	α-helix	trans	-51.2	-56.9	-177	176.4	0	0	0	0	111	L265 R295 L301 I314 D315 L318	L265-V297 HydrophobicContact CG-CG2 4.13Å; L265-V297 PolarHBondContact O-N 2.8Å; R295-V297 HydrophobicContact CG-CG2 4.24Å; V297-L301 HydrophobicContact CG1-CD1 3.97Å; V297-L301 WeakPolarHBondContact O-CB 3.26Å; V297-L301 WeakPolarHBondContact O-CG 3.45Å; V297-L301 PolarHBondContact O-N 3.27Å; V297-L301 VanDerWaalsContact O-N 3.08Å; V297-I314 HydrophobicContact CG1-CG2 4.1Å; V297-D315 HydrophobicContact CG1-CB 4.45Å; V297-L318 HydrophobicContact CG1-CD1 4.22Å
298	K	97.9	Very high	96	Very high	76 Å²	76	81.1 Å²	81.1	33%	0.33	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-47.7	179.6	-67.3	-177.9	173.5	168.9	0	111.9	K296 R300 L301 K302 L311 D312 D315	K296-K298 PolarHBondContact O-N 2.86Å; K298-R300 PolarHBondContact O-N 2.73Å; K298-L301 PolarHBondContact O-N 2.89Å; K298-K302 WeakPolarHBondContact O-CB 3.39Å; K298-K302 PolarHBondContact O-N 2.89Å; K298-L311 HydrophobicContact CG-CB 4.43Å; K298-D312 IonicContact NZ-OD1 2.69Å; K298-D312 PolarHBondContact NZ-OD1 2.9Å; K298-D315 HydrophobicContact CD-CB 4.38Å; K298-D315 VanDerWaalsContact CE-CB 3.47Å; K298-D315 WeakPolarHBondContact CE-OD2 3.39Å; K298-D315 HydrophobicContact CG-CB 4.11Å; K298-D315 IonicContact NZ-OD2 2.79Å; K298-D315 PolarHBondContact NZ-OD2 3Å
299	D	96.7	Very high	96.4	Very high	116 Å²	116	77.5 Å²	77.5	62%	0.62	38%	0.383	S	S	*	.	H	α-helix	trans	-58.5	-46.2	-177.3	-64.7	-33.7	0	0	0	112.6	K296 K302	K296-D299 PolarHBondContact O-N 2.85Å; D299-K302 WeakPolarHBondContact O-CB 3.35Å
300	R	95.5	Very high	96.7	Very high	73 Å²	73	76.3 Å²	76.3	28%	0.275	38%	0.377	S	S	.	.	H	α-helix	trans	-69.2	-40.8	-179.9	-75	-64.8	-146.1	162.8	5.8	112.3	L265 K296 K298 F393	L265-R300 HydrophobicContact CD1-CB 3.95Å; L265-R300 HydrophobicContact CD1-CG 3.92Å; K296-R300 HydrophobicContact CB-CG 4.01Å; K296-R300 VanDerWaalsContact O-CB 3.27Å; K296-R300 WeakPolarHBondContact O-CB 3.42Å; K296-R300 VanDerWaalsContact O-CG 3.3Å; K296-R300 WeakPolarHBondContact O-CG 3.26Å; K296-R300 PolarHBondContact O-N 3.49Å; K298-R300 PolarHBondContact O-N 2.73Å; R300-F393 HydrophobicContact CB-CE1 4.05Å; R300-F393 HydrophobicContact CB-CE2 3.82Å; R300-F393 HydrophobicContact CB-CZ 3.31Å; R300-F393 HydrophobicContact CG-CE2 3.7Å; R300-F393 HydrophobicContact CG-CZ 3.71Å; R300-F393 VanDerWaalsContact NE-CE2 3.34Å
301	L	97.1	Very high	97	Very high	1 Å²	1	75.8 Å²	75.8	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-78.9	-17.5	-179.3	-69.1	175.1	0	0	0	113.4	A241 T245 V297 K298 A303 Y304 V305 L311 I314	A241-L301 HydrophobicContact CB-CD1 4.23Å; A241-L301 HydrophobicContact CB-CD2 4.22Å; T245-L301 HydrophobicContact CG2-CD2 3.93Å; V297-L301 HydrophobicContact CG1-CD1 3.97Å; V297-L301 WeakPolarHBondContact O-CB 3.26Å; V297-L301 WeakPolarHBondContact O-CG 3.45Å; V297-L301 PolarHBondContact O-N 3.27Å; V297-L301 VanDerWaalsContact O-N 3.08Å; K298-L301 PolarHBondContact O-N 2.89Å; L301-A303 PolarHBondContact O-N 2.92Å; L301-A303 VanDerWaalsContact O-N 3.08Å; L301-Y304 PolarHBondContact O-N 3.05Å; L301-V305 HydrophobicContact CB-CG2 4.23Å; L301-V305 PolarHBondContact O-N 2.85Å; L301-L311 HydrophobicContact CB-CD2 3.53Å; L301-I314 HydrophobicContact CD1-CB 4.39Å; L301-I314 HydrophobicContact CD1-CD1 4.17Å; L301-I314 HydrophobicContact CD1-CG2 3.53Å
302	K	95.8	Very high	97.3	Very high	136 Å²	136	68.6 Å²	68.6	59%	0.591	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.9	179.1	-165.8	174	-175.1	177.1	0	113.8	K298 D299 Y304 K306	K298-K302 WeakPolarHBondContact O-CB 3.39Å; K298-K302 PolarHBondContact O-N 2.89Å; D299-K302 WeakPolarHBondContact O-CB 3.35Å; K302-Y304 VanDerWaalsContact C-N 3.29Å; K302-Y304 PolarHBondContact O-N 3.34Å; K302-K306 PolarHBondContact O-NZ 2.78Å
303	A	95.7	Very high	97.5	Very high	68 Å²	68	65.1 Å²	65.1	56%	0.562	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-35.6	173.3	0	0	0	0	0	112	L301 K306	L301-A303 PolarHBondContact O-N 2.92Å; L301-A303 VanDerWaalsContact O-N 3.08Å; A303-K306 WeakPolarHBondContact O-CE 3.38Å; A303-K306 PolarHBondContact O-NZ 2.88Å
304	Y	96.8	Very high	97.6	Very high	92 Å²	92	62.1 Å²	62.1	36%	0.361	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-44.1	-173.4	-52.3	-91.3	0	0	0	112.8	T245 L301 K302 F393	T245-Y304 HydrophobicContact CG2-CD1 4.36Å; T245-Y304 HydrophobicContact CG2-CD2 4.16Å; T245-Y304 HydrophobicContact CG2-CE2 4.49Å; T245-Y304 HydrophobicContact CG2-CG 4.1Å; L301-Y304 PolarHBondContact O-N 3.05Å; K302-Y304 VanDerWaalsContact C-N 3.29Å; K302-Y304 PolarHBondContact O-N 3.34Å; Y304-F393 AromaticContact CE2-CD1 3.51Å; Y304-F393 HydrophobicContact CE2-CD1 3.51Å; Y304-F393 AromaticContact CE2-CE1 4Å; Y304-F393 HydrophobicContact CE2-CE1 4Å; Y304-F393 HydrophobicContact CE2-CG 4.47Å; Y304-F393 AromaticContact CZ-CD1 3.94Å
305	V	97.2	Very high	97.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.267	C	S	.	.			trans	-100.5	113.7	-176.6	-167.6	0	0	0	0	108.5	W244 L301 A310 L311 I314	W244-V305 HydrophobicContact CB-CG2 3.84Å; W244-V305 HydrophobicContact CD2-CB 4.39Å; W244-V305 HydrophobicContact CD2-CG1 4.17Å; W244-V305 HydrophobicContact CD2-CG2 3.66Å; W244-V305 HydrophobicContact CE3-CG1 4.5Å; W244-V305 HydrophobicContact CE3-CG2 3.85Å; W244-V305 HydrophobicContact CG-CB 4.41Å; W244-V305 HydrophobicContact CG-CG2 3.66Å; W244-V305 HydrophobicContact CH2-CG1 4.48Å; W244-V305 HydrophobicContact CZ2-CG1 4.14Å; L301-V305 HydrophobicContact CB-CG2 4.23Å; L301-V305 PolarHBondContact O-N 2.85Å; V305-A310 HydrophobicContact CG1-CB 3.51Å; V305-L311 HydrophobicContact CB-CD2 3.68Å; V305-L311 HydrophobicContact CB-CG 3.89Å; V305-L311 HydrophobicContact CG1-CD2 4.08Å; V305-L311 HydrophobicContact CG1-CG 3.84Å; V305-L311 HydrophobicContact CG2-CD2 4.22Å; V305-I314 HydrophobicContact CG2-CD1 4.26Å
306	K	96.1	Very high	97.7	Very high	156 Å²	156	55.5 Å²	55.5	68%	0.678	27%	0.268	S	S	*	.			trans	-93.9	-26.1	179.1	-55.6	-56.1	174.8	-167.7	0	113.1	K302 A303	K302-K306 PolarHBondContact O-NZ 2.78Å; A303-K306 WeakPolarHBondContact O-CE 3.38Å; A303-K306 PolarHBondContact O-NZ 2.88Å
307	D	98.3	Very high	97.7	Very high	24 Å²	24	51.9 Å²	51.9	13%	0.128	25%	0.253	C	S	.	.			trans	-71.8	124.7	179.5	-177.3	-93.4	0	0	0	110.7	L144 Y309 A310 L311	L144-D307 HydrophobicContact CD1-CB 4.02Å; L144-D307 HydrophobicContact CD2-CB 3.94Å; D307-Y309 WeakPolarHBondContact OD1-CA 3.28Å; D307-Y309 WeakPolarHBondContact OD1-CB 3.49Å; D307-Y309 PolarHBondContact OD1-N 2.82Å; D307-Y309 VanDerWaalsContact OD1-N 3.08Å; D307-A310 HydrophobicContact CB-CB 3.91Å; D307-A310 WeakPolarHBondContact OD1-CB 3.26Å; D307-A310 PolarHBondContact OD1-N 3.32Å; D307-L311 PolarHBondContact O-N 3.24Å
308	P	98.3	Very high	97.8	Very high	87 Å²	87	51.9 Å²	51.9	57%	0.565	25%	0.252	S	S	*	.	H	α-helix	trans	-68.8	-34	-176.5	26.7	-33.7	0	0	0	112.6	L311 D312	P308-L311 PolarHBondContact O-N 3.26Å; P308-D312 WeakPolarHBondContact O-CB 3.44Å; P308-D312 PolarHBondContact O-N 2.99Å
309	Y	98.8	Very high	97.8	Very high	90 Å²	90	49.7 Å²	49.7	35%	0.353	25%	0.245	S	C	.	.	H	α-helix	trans	-72.1	-34.9	179.9	-59.5	-65.5	0	0	0	111.9	D307 D312 L313 H334 D335 S339	D307-Y309 WeakPolarHBondContact OD1-CA 3.28Å; D307-Y309 WeakPolarHBondContact OD1-CB 3.49Å; D307-Y309 PolarHBondContact OD1-N 2.82Å; D307-Y309 VanDerWaalsContact OD1-N 3.08Å; Y309-D312 PolarHBondContact O-N 3.43Å; Y309-L313 WeakPolarHBondContact O-CB 3.03Å; Y309-L313 PolarHBondContact O-N 2.66Å; Y309-H334 PolarHBondContact O-CE1 2.79Å; Y309-D335 HydrophobicContact CD1-CB 3.46Å; Y309-D335 VanDerWaalsContact CD1-CB 3.46Å; Y309-D335 HydrophobicContact CE1-CB 3.56Å; Y309-D335 HydrophobicContact CG-CB 4.12Å; Y309-S339 WeakPolarHBondContact CD2-OG 3.32Å
310	A	98.8	Very high	97.9	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-48.2	171.5	0	0	0	0	0	111.2	M240 W244 V305 D307 D312 L313 I314 F336	M240-A310 HydrophobicContact CE-CB 4.31Å; W244-A310 HydrophobicContact CH2-CB 3.64Å; W244-A310 HydrophobicContact CZ2-CB 3.81Å; W244-A310 HydrophobicContact CZ3-CB 4.49Å; V305-A310 HydrophobicContact CG1-CB 3.51Å; D307-A310 HydrophobicContact CB-CB 3.91Å; D307-A310 WeakPolarHBondContact OD1-CB 3.26Å; D307-A310 PolarHBondContact OD1-N 3.32Å; A310-D312 VanDerWaalsContact C-N 3.3Å; A310-D312 PolarHBondContact O-N 2.65Å; A310-L313 PolarHBondContact O-N 3.27Å; A310-I314 VanDerWaalsContact O-CG1 3.26Å; A310-I314 WeakPolarHBondContact O-CG1 3.46Å; A310-I314 PolarHBondContact O-N 3.39Å; A310-F336 HydrophobicContact CB-CD2 3.81Å; A310-F336 HydrophobicContact CB-CE2 3.52Å; A310-F336 HydrophobicContact CB-CZ 4.31Å
311	L	98.7	Very high	98	Very high	18 Å²	18	41.7 Å²	41.7	9%	0.094	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-39.9	175.9	-78.5	175.1	0	0	0	112	K298 L301 V305 D307 P308 D315	K298-L311 HydrophobicContact CG-CB 4.43Å; L301-L311 HydrophobicContact CB-CD2 3.53Å; V305-L311 HydrophobicContact CB-CD2 3.68Å; V305-L311 HydrophobicContact CB-CG 3.89Å; V305-L311 HydrophobicContact CG1-CD2 4.08Å; V305-L311 HydrophobicContact CG1-CG 3.84Å; V305-L311 HydrophobicContact CG2-CD2 4.22Å; D307-L311 PolarHBondContact O-N 3.24Å; P308-L311 PolarHBondContact O-N 3.26Å; L311-D315 WeakPolarHBondContact O-CB 3.48Å; L311-D315 PolarHBondContact O-N 3.47Å
312	D	98.8	Very high	98.1	Very high	40 Å²	40	42.6 Å²	42.6	21%	0.214	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-43.5	178.6	-163.9	62.5	0	0	0	112.7	K298 P308 Y309 A310 D315 K316 H334	K298-D312 IonicContact NZ-OD1 2.69Å; K298-D312 PolarHBondContact NZ-OD1 2.9Å; P308-D312 WeakPolarHBondContact O-CB 3.44Å; P308-D312 PolarHBondContact O-N 2.99Å; Y309-D312 PolarHBondContact O-N 3.43Å; A310-D312 VanDerWaalsContact C-N 3.3Å; A310-D312 PolarHBondContact O-N 2.65Å; D312-D315 WeakPolarHBondContact O-CB 3.26Å; D312-D315 PolarHBondContact O-N 3.34Å; D312-K316 WeakPolarHBondContact O-CG 3.48Å; D312-K316 PolarHBondContact O-N 2.97Å; D312-K316 WeakPolarHBondContact OD2-CE 3.33Å; D312-K316 IonicContact OD2-NZ 2.68Å; D312-K316 PolarHBondContact OD2-NZ 2.9Å; D312-H334 IonicContact OD2-CE1 3.7Å; D312-H334 IonicContact OD2-NE2 3.02Å; D312-H334 PolarHBondContact OD2-NE2 3.15Å
313	L	98.9	Very high	98.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.7	-41.4	177.1	-175.5	55.2	0	0	0	111.9	M240 Y309 A310 D315 K316 L317 A331 H334 F336 F337	M240-L313 HydrophobicContact CE-CB 4.06Å; M240-L313 HydrophobicContact CE-CD2 3.92Å; M240-L313 HydrophobicContact CE-CG 4.19Å; M240-L313 HydrophobicContact SD-CB 4.26Å; M240-L313 HydrophobicContact SD-CD2 3.89Å; M240-L313 HydrophobicContact SD-CG 3.9Å; Y309-L313 WeakPolarHBondContact O-CB 3.03Å; Y309-L313 PolarHBondContact O-N 2.66Å; A310-L313 PolarHBondContact O-N 3.27Å; L313-D315 VanDerWaalsContact C-N 3.28Å; L313-D315 PolarHBondContact O-N 2.95Å; L313-K316 PolarHBondContact O-N 2.73Å; L313-L317 HydrophobicContact CD1-CD1 4.32Å; L313-L317 HydrophobicContact CD1-CG 4.35Å; L313-L317 HydrophobicContact CG-CD1 4.03Å; L313-L317 VanDerWaalsContact O-CG 3.31Å; L313-L317 WeakPolarHBondContact O-CG 3.38Å; L313-L317 PolarHBondContact O-N 2.88Å; L313-A331 HydrophobicContact CD1-CB 3.99Å; L313-H334 HydrophobicContact CD1-CB 4.09Å; L313-H334 HydrophobicContact CD2-CB 4.44Å; L313-F336 HydrophobicContact CD2-CB 4.17Å; L313-F336 HydrophobicContact CD2-CD1 3.77Å; L313-F336 HydrophobicContact CD2-CG 4.28Å; L313-F337 HydrophobicContact CD2-CE2 3.65Å; L313-F337 HydrophobicContact CD2-CZ 3.88Å
314	I	98.9	Very high	98.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-42.2	174.1	-65.8	164.2	0	0	0	110.5	M240 A241 W244 V297 L301 V305 A310 K316 L317 L318	M240-I314 HydrophobicContact CB-CG1 4.09Å; M240-I314 HydrophobicContact CE-CG1 4.05Å; M240-I314 HydrophobicContact CG-CD1 4.12Å; M240-I314 HydrophobicContact CG-CG1 3.6Å; M240-I314 HydrophobicContact SD-CG1 3.74Å; A241-I314 HydrophobicContact CB-CD1 4.46Å; A241-I314 HydrophobicContact CB-CG2 4.37Å; W244-I314 HydrophobicContact CE3-CD1 4.22Å; W244-I314 HydrophobicContact CZ3-CD1 3.92Å; V297-I314 HydrophobicContact CG1-CG2 4.1Å; L301-I314 HydrophobicContact CD1-CB 4.39Å; L301-I314 HydrophobicContact CD1-CD1 4.17Å; L301-I314 HydrophobicContact CD1-CG2 3.53Å; V305-I314 HydrophobicContact CG2-CD1 4.26Å; A310-I314 VanDerWaalsContact O-CG1 3.26Å; A310-I314 WeakPolarHBondContact O-CG1 3.46Å; A310-I314 PolarHBondContact O-N 3.39Å; I314-K316 VanDerWaalsContact C-N 3.34Å; I314-K316 PolarHBondContact O-N 2.93Å; I314-L317 PolarHBondContact O-N 2.91Å; I314-L318 HydrophobicContact CG2-CD1 3.72Å; I314-L318 HydrophobicContact CG2-CG 4.25Å; I314-L318 WeakPolarHBondContact O-CB 3.39Å; I314-L318 WeakPolarHBondContact O-CG 3.42Å; I314-L318 PolarHBondContact O-N 3.27Å
315	D	98.8	Very high	98.3	Very high	32 Å²	32	38.7 Å²	38.7	17%	0.171	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-40.9	178.4	-167.2	40.5	0	0	0	112	R295 V297 K298 L311 D312 L313 L318	R295-D315 IonicContact CZ-OD1 2.8Å; R295-D315 IonicContact NE-OD1 3.91Å; R295-D315 PolarHBondContact NE-OD1 2.68Å; R295-D315 PolarHBondContact NH2-O 3.37Å; R295-D315 IonicContact NH2-OD1 3.71Å; R295-D315 PolarHBondContact NH2-OD1 3.48Å; V297-D315 HydrophobicContact CG1-CB 4.45Å; K298-D315 HydrophobicContact CD-CB 4.38Å; K298-D315 VanDerWaalsContact CE-CB 3.47Å; K298-D315 WeakPolarHBondContact CE-OD2 3.39Å; K298-D315 HydrophobicContact CG-CB 4.11Å; K298-D315 IonicContact NZ-OD2 2.79Å; K298-D315 PolarHBondContact NZ-OD2 3Å; L311-D315 WeakPolarHBondContact O-CB 3.48Å; L311-D315 PolarHBondContact O-N 3.47Å; D312-D315 WeakPolarHBondContact O-CB 3.26Å; D312-D315 PolarHBondContact O-N 3.34Å; L313-D315 VanDerWaalsContact C-N 3.28Å; L313-D315 PolarHBondContact O-N 2.95Å; D315-L318 PolarHBondContact O-N 3.11Å
316	K	98.9	Very high	98.4	Very high	80 Å²	80	39.7 Å²	39.7	35%	0.348	21%	0.21	S	C	.	.	H	α-helix	trans	-69.4	-31.1	175.6	-72.9	171.3	174.9	161.5	0	113.8	D312 L313 I314 V319 V326 H334	D312-K316 WeakPolarHBondContact O-CG 3.48Å; D312-K316 PolarHBondContact O-N 2.97Å; D312-K316 WeakPolarHBondContact OD2-CE 3.33Å; D312-K316 IonicContact OD2-NZ 2.68Å; D312-K316 PolarHBondContact OD2-NZ 2.9Å; L313-K316 PolarHBondContact O-N 2.73Å; I314-K316 VanDerWaalsContact C-N 3.34Å; I314-K316 PolarHBondContact O-N 2.93Å; K316-V319 VanDerWaalsContact O-CG2 3.29Å; K316-V319 WeakPolarHBondContact O-CG2 3.49Å; K316-V326 HydrophobicContact CB-CB 4.1Å; K316-V326 HydrophobicContact CB-CG1 3.87Å; K316-V326 PolarHBondContact O-N 3.09Å; K316-H334 PolarHBondContact NZ-CD2 2.78Å; K316-H334 PolarHBondContact NZ-NE2 3.13Å
317	L	98.9	Very high	98.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-76.8	-33.5	175.4	-71.1	165.3	0	0	0	112.4	L233 M240 L313 I314 V319 R325 V326	L233-L317 HydrophobicContact CB-CD2 4.17Å; L233-L317 HydrophobicContact CD1-CD2 3.96Å; M240-L317 HydrophobicContact SD-CD1 3.94Å; L313-L317 HydrophobicContact CD1-CD1 4.32Å; L313-L317 HydrophobicContact CD1-CG 4.35Å; L313-L317 HydrophobicContact CG-CD1 4.03Å; L313-L317 VanDerWaalsContact O-CG 3.31Å; L313-L317 WeakPolarHBondContact O-CG 3.38Å; L313-L317 PolarHBondContact O-N 2.88Å; I314-L317 PolarHBondContact O-N 2.91Å; L317-V319 VanDerWaalsContact C-N 3.29Å; L317-V319 PolarHBondContact O-N 3.36Å; L317-R325 WeakPolarHBondContact O-CD 3.47Å; L317-R325 VanDerWaalsContact O-CG 3.3Å; L317-R325 WeakPolarHBondContact O-CG 3.47Å; L317-V326 HydrophobicContact CD2-CG1 3.59Å; L317-V326 HydrophobicContact CG-CG1 3.87Å
318	L	98.8	Very high	98.5	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	36.5	-179.8	-62.2	-179.4	0	0	0	112.8	W234 I249 R295 V297 I314 D315	W234-L318 HydrophobicContact CD2-CD2 4.18Å; W234-L318 HydrophobicContact CE3-CD2 4.17Å; W234-L318 HydrophobicContact CH2-CD2 4.4Å; W234-L318 HydrophobicContact CZ2-CD2 4.39Å; W234-L318 HydrophobicContact CZ3-CB 4.36Å; W234-L318 HydrophobicContact CZ3-CD2 4.3Å; I249-L318 HydrophobicContact CD1-CD1 3.88Å; R295-L318 PolarHBondContact NH1-O 2.91Å; R295-L318 PolarHBondContact NH2-O 2.91Å; V297-L318 HydrophobicContact CG1-CD1 4.22Å; I314-L318 HydrophobicContact CG2-CD1 3.72Å; I314-L318 HydrophobicContact CG2-CG 4.25Å; I314-L318 WeakPolarHBondContact O-CB 3.39Å; I314-L318 WeakPolarHBondContact O-CG 3.42Å; I314-L318 PolarHBondContact O-N 3.27Å; D315-L318 PolarHBondContact O-N 3.11Å
319	V	98.8	Very high	98.5	Very high	30 Å²	30	34.3 Å²	34.3	18%	0.182	18%	0.184	C	C	.	.			trans	-78.5	135.1	173.1	174.4	0	0	0	0	109.7	K316 L317 Q324 R325	K316-V319 VanDerWaalsContact O-CG2 3.29Å; K316-V319 WeakPolarHBondContact O-CG2 3.49Å; L317-V319 VanDerWaalsContact C-N 3.29Å; L317-V319 PolarHBondContact O-N 3.36Å; V319-Q324 HydrophobicContact CG1-CB 3.84Å; V319-R325 HydrophobicContact CB-CB 4.16Å; V319-R325 HydrophobicContact CB-CG 4.38Å; V319-R325 PolarHBondContact O-NE 2.99Å; V319-R325 PolarHBondContact O-NH2 2.84Å
320	L	98.5	Very high	98.5	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.031	19%	0.193	C	C	.	.	S	Bend	trans	-65.5	-53	-176.2	-67.4	175.8	0	0	0	111.7	P218 I262 C266 I269 A273 W274 P322 R325	P218-L320 HydrophobicContact CG-CD2 4.21Å; I262-L320 HydrophobicContact CG2-CD2 3.64Å; C266-L320 HydrophobicContact CB-CD2 3.65Å; C266-L320 HydrophobicContact CB-CG 4.1Å; I269-L320 HydrophobicContact CG1-CD1 4.23Å; I269-L320 HydrophobicContact CG1-CD2 4.33Å; A273-L320 HydrophobicContact CB-CD1 4.28Å; W274-L320 HydrophobicContact CE3-CB 4.3Å; L320-P322 WeakPolarHBondContact O-CD 3.46Å; L320-R325 PolarHBondContact O-NH2 3.35Å; L320-R325 VanDerWaalsContact O-NH2 3.14Å
321	D	98.2	Very high	98.5	Very high	15 Å²	15	34.8 Å²	34.8	8%	0.08	19%	0.193	C	C	.	.	S	Bend	trans	-71.1	115.4	176.6	-177.8	7.2	0	0	0	110.8	W274 A323 Q324 R325	W274-D321 HydrophobicContact CB-CB 4.14Å; W274-D321 VanDerWaalsContact CD1-CG 3.43Å; W274-D321 HydrophobicContact CD2-CB 4.28Å; W274-D321 HydrophobicContact CG-CB 3.78Å; W274-D321 PolarHBondContact NE1-OD1 3.37Å; W274-D321 VanDerWaalsContact NE1-OD1 3.14Å; D321-A323 PolarHBondContact O-N 2.86Å; D321-A323 VanDerWaalsContact O-N 3.15Å; D321-A323 WeakPolarHBondContact OD1-CB 3.47Å; D321-A323 PolarHBondContact OD1-N 3.18Å; D321-Q324 HydrophobicContact CB-CB 4.3Å; D321-Q324 HydrophobicContact CB-CG 4.36Å; D321-Q324 PolarHBondContact O-N 2.87Å; D321-Q324 PolarHBondContact OD2-NE2 2.95Å; D321-R325 PolarHBondContact O-N 2.7Å; D321-R325 VanDerWaalsContact O-N 3.13Å
322	P	97.7	Very high	98.5	Very high	20 Å²	20	34.8 Å²	34.8	13%	0.13	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.7	178.9	26.9	-35.4	0	0	0	113.2	E219 P230 W274 L320 Q324	E219-P322 HydrophobicContact CB-CG 4.33Å; E219-P322 HydrophobicContact CG-CG 4.33Å; P230-P322 HydrophobicContact CB-CB 3.76Å; P230-P322 HydrophobicContact CG-CB 4.27Å; P230-P322 WeakPolarHBondContact CG-O 3.48Å; W274-P322 HydrophobicContact CZ2-CG 3.88Å; L320-P322 WeakPolarHBondContact O-CD 3.46Å; P322-Q324 VanDerWaalsContact C-N 3.31Å
323	A	96.8	Very high	98.5	Very high	88 Å²	88	37.7 Å²	37.7	73%	0.727	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-20.6	176.2	0	0	0	0	0	113.2	D321	D321-A323 PolarHBondContact O-N 2.86Å; D321-A323 VanDerWaalsContact O-N 3.15Å; D321-A323 WeakPolarHBondContact OD1-CB 3.47Å; D321-A323 PolarHBondContact OD1-N 3.18Å
324	Q	98	Very high	98.5	Very high	114 Å²	114	38.3 Å²	38.3	53%	0.533	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-7.1	178.2	-66.3	176.8	62.5	0	0	112.5	V319 D321 P322	V319-Q324 HydrophobicContact CG1-CB 3.84Å; D321-Q324 HydrophobicContact CB-CB 4.3Å; D321-Q324 HydrophobicContact CB-CG 4.36Å; D321-Q324 PolarHBondContact O-N 2.87Å; D321-Q324 PolarHBondContact OD2-NE2 2.95Å; P322-Q324 VanDerWaalsContact C-N 3.31Å
325	R	98.6	Very high	98.5	Very high	12 Å²	12	42.7 Å²	42.7	5%	0.045	24%	0.235	C	C	.	.	S	Bend	trans	-70.9	132	177.6	-167.3	179.2	-59	142	7.2	109.5	E219 P230 L317 V319 L320 D321 D327	E219-R325 IonicContact OE1-CZ 2.74Å; E219-R325 IonicContact OE1-NH1 2.84Å; E219-R325 PolarHBondContact OE1-NH1 3.05Å; E219-R325 IonicContact OE1-NH2 3.71Å; E219-R325 IonicContact OE2-CZ 2.76Å; E219-R325 IonicContact OE2-NH1 3.8Å; E219-R325 IonicContact OE2-NH2 3.81Å; E219-R325 PolarHBondContact OE2-NH2 3.14Å; P230-R325 PolarHBondContact O-NH1 2.94Å; L317-R325 WeakPolarHBondContact O-CD 3.47Å; L317-R325 VanDerWaalsContact O-CG 3.3Å; L317-R325 WeakPolarHBondContact O-CG 3.47Å; V319-R325 HydrophobicContact CB-CB 4.16Å; V319-R325 HydrophobicContact CB-CG 4.38Å; V319-R325 PolarHBondContact O-NE 2.99Å; V319-R325 PolarHBondContact O-NH2 2.84Å; L320-R325 PolarHBondContact O-NH2 3.35Å; L320-R325 VanDerWaalsContact O-NH2 3.14Å; D321-R325 PolarHBondContact O-N 2.7Å; D321-R325 VanDerWaalsContact O-N 3.13Å; R325-D327 PolarHBondContact O-N 3.04Å
326	V	98.8	Very high	98.5	Very high	21 Å²	21	41.2 Å²	41.2	13%	0.127	23%	0.227	C	C	.	.			trans	-58.2	136.5	179.9	71.2	0	0	0	0	110.5	K316 L317 D330 A331	K316-V326 HydrophobicContact CB-CB 4.1Å; K316-V326 HydrophobicContact CB-CG1 3.87Å; K316-V326 PolarHBondContact O-N 3.09Å; L317-V326 HydrophobicContact CD2-CG1 3.59Å; L317-V326 HydrophobicContact CG-CG1 3.87Å; V326-D330 HydrophobicContact CG2-CB 3.5Å; V326-D330 VanDerWaalsContact CG2-CB 3.5Å; V326-A331 HydrophobicContact CG1-CB 4.28Å; V326-A331 HydrophobicContact CG2-CB 4.2Å
327	D	98.8	Very high	98.5	Very high	76 Å²	76	37.4 Å²	37.4	41%	0.406	21%	0.21	S	C	.	.			trans	-84.1	178	174.2	75.2	25.1	0	0	0	111.4	R325 D329 D330 A331	R325-D327 PolarHBondContact O-N 3.04Å; D327-D329 VanDerWaalsContact C-N 3.32Å; D327-D329 PolarHBondContact O-N 3.45Å; D327-D329 WeakPolarHBondContact OD1-CA 3.29Å; D327-D329 WeakPolarHBondContact OD1-CB 3.48Å; D327-D329 PolarHBondContact OD1-N 2.99Å; D327-D330 PolarHBondContact OD1-N 3.02Å; D327-A331 WeakPolarHBondContact O-CB 3.47Å; D327-A331 PolarHBondContact O-N 3.06Å
328	S	98.5	Very high	98.5	Very high	6 Å²	6	44.8 Å²	44.8	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-67.7	-31.3	-178.1	54.9	0	0	0	0	113.3	Y159 L332	Y159-S328 VanDerWaalsContact CA-OG 3.26Å; Y159-S328 WeakPolarHBondContact CA-OG 3.39Å; Y159-S328 WeakPolarHBondContact CB-OG 3.46Å; S328-L332 WeakPolarHBondContact O-CB 3.46Å; S328-L332 VanDerWaalsContact O-CD1 3.31Å; S328-L332 WeakPolarHBondContact O-CD1 2.79Å; S328-L332 WeakPolarHBondContact O-CG 3.28Å; S328-L332 PolarHBondContact O-N 2.82Å
329	D	98.3	Very high	98.4	Very high	72 Å²	72	45.7 Å²	45.7	39%	0.385	25%	0.245	S	C	.	.	H	α-helix	trans	-74.8	-50.1	-175.9	-164.9	21.8	0	0	0	110	Y159 D327 A331 L332 N333	Y159-D329 HydrophobicContact CD2-CB 4.03Å; Y159-D329 HydrophobicContact CE2-CB 3.96Å; D327-D329 VanDerWaalsContact C-N 3.32Å; D327-D329 PolarHBondContact O-N 3.45Å; D327-D329 WeakPolarHBondContact OD1-CA 3.29Å; D327-D329 WeakPolarHBondContact OD1-CB 3.48Å; D327-D329 PolarHBondContact OD1-N 2.99Å; D329-A331 VanDerWaalsContact C-N 3.28Å; D329-A331 PolarHBondContact O-N 2.99Å; D329-L332 PolarHBondContact O-N 2.82Å; D329-L332 VanDerWaalsContact O-N 3.16Å; D329-N333 PolarHBondContact O-N 2.91Å; D329-N333 VanDerWaalsContact O-N 3.11Å; D329-N333 PolarHBondContact O-ND2 3.45Å; D329-N333 PolarHBondContact OD1-ND2 2.87Å
330	D	98.7	Very high	98.4	Very high	100 Å²	100	50.9 Å²	50.9	54%	0.535	27%	0.272	S	S	.	.	H	α-helix	trans	-61.8	-37.7	174.2	-74.4	-21.1	0	0	0	111.5	V326 D327 N333 H334	V326-D330 HydrophobicContact CG2-CB 3.5Å; V326-D330 VanDerWaalsContact CG2-CB 3.5Å; D327-D330 PolarHBondContact OD1-N 3.02Å; D330-N333 PolarHBondContact O-N 3.3Å; D330-H334 PolarHBondContact O-N 3.2Å
331	A	98.8	Very high	98.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-41.5	175.5	0	0	0	0	0	112	L155 L313 V326 D327 D329 N333 H334 F337	L155-A331 HydrophobicContact CD1-CB 3.78Å; L155-A331 HydrophobicContact CD2-CB 4.12Å; L313-A331 HydrophobicContact CD1-CB 3.99Å; V326-A331 HydrophobicContact CG1-CB 4.28Å; V326-A331 HydrophobicContact CG2-CB 4.2Å; D327-A331 WeakPolarHBondContact O-CB 3.47Å; D327-A331 PolarHBondContact O-N 3.06Å; D329-A331 VanDerWaalsContact C-N 3.28Å; D329-A331 PolarHBondContact O-N 2.99Å; A331-N333 VanDerWaalsContact C-N 3.26Å; A331-N333 PolarHBondContact O-N 3.29Å; A331-H334 WeakPolarHBondContact O-CB 3.37Å; A331-H334 PolarHBondContact O-N 2.87Å; A331-H334 VanDerWaalsContact O-N 3.14Å; A331-F337 VanDerWaalsContact O-CD2 3.32Å; A331-F337 WeakPolarHBondContact O-CD2 3.5Å; A331-F337 WeakPolarHBondContact O-CE2 3.26Å
332	L	98.8	Very high	98.4	Very high	18 Å²	18	56.6 Å²	56.6	9%	0.094	30%	0.304	C	S	.	.	H	α-helix	trans	-66.3	-28.4	177.1	-77.2	163.3	0	0	0	112.9	Q152 L155 N156 S328 D329 H334 W338	Q152-L332 HydrophobicContact CG-CD2 4.21Å; L155-L332 HydrophobicContact CB-CD1 4.42Å; L155-L332 HydrophobicContact CB-CD2 3.75Å; L155-L332 HydrophobicContact CB-CG 3.83Å; N156-L332 WeakPolarHBondContact OD1-CD1 3.45Å; N156-L332 VanDerWaalsContact OD1-CD2 3.3Å; N156-L332 WeakPolarHBondContact OD1-CD2 3.47Å; S328-L332 WeakPolarHBondContact O-CB 3.46Å; S328-L332 VanDerWaalsContact O-CD1 3.31Å; S328-L332 WeakPolarHBondContact O-CD1 2.79Å; S328-L332 WeakPolarHBondContact O-CG 3.28Å; S328-L332 PolarHBondContact O-N 2.82Å; D329-L332 PolarHBondContact O-N 2.82Å; D329-L332 VanDerWaalsContact O-N 3.16Å; L332-H334 VanDerWaalsContact C-N 3.3Å; L332-W338 PolarHBondContact O-NE1 3.19Å
333	N	98.7	Very high	98.4	Very high	101 Å²	101	57.1 Å²	57.1	54%	0.54	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	2.2	175.1	-69	-68.4	0	0	0	113.4	D329 D330 A331	D329-N333 PolarHBondContact O-N 2.91Å; D329-N333 VanDerWaalsContact O-N 3.11Å; D329-N333 PolarHBondContact O-ND2 3.45Å; D329-N333 PolarHBondContact OD1-ND2 2.87Å; D330-N333 PolarHBondContact O-N 3.3Å; A331-N333 VanDerWaalsContact C-N 3.26Å; A331-N333 PolarHBondContact O-N 3.29Å
334	H	98.9	Very high	98.4	Very high	14 Å²	14	55 Å²	55	7%	0.065	29%	0.286	C	S	.	.	S	Bend	trans	-68.4	142.8	178.8	-167.4	-93	0	0	0	112.6	Y309 D312 L313 K316 D330 A331 L332 F336 F337	Y309-H334 PolarHBondContact O-CE1 2.79Å; D312-H334 IonicContact OD2-CE1 3.7Å; D312-H334 IonicContact OD2-NE2 3.02Å; D312-H334 PolarHBondContact OD2-NE2 3.15Å; L313-H334 HydrophobicContact CD1-CB 4.09Å; L313-H334 HydrophobicContact CD2-CB 4.44Å; K316-H334 PolarHBondContact NZ-CD2 2.78Å; K316-H334 PolarHBondContact NZ-NE2 3.13Å; D330-H334 PolarHBondContact O-N 3.2Å; A331-H334 WeakPolarHBondContact O-CB 3.37Å; A331-H334 PolarHBondContact O-N 2.87Å; A331-H334 VanDerWaalsContact O-N 3.14Å; L332-H334 VanDerWaalsContact C-N 3.3Å; H334-F336 WeakPolarHBondContact ND1-CB 3.44Å; H334-F336 PolarHBondContact ND1-N 3.05Å; H334-F336 VanDerWaalsContact ND1-N 3.17Å; H334-F336 PolarHBondContact O-N 2.88Å; H334-F337 PolarHBondContact O-N 3.43Å
335	D	98.7	Very high	98.2	Very high	92 Å²	92	53.8 Å²	53.8	49%	0.492	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-50.3	-25	179	-68.1	-20.8	0	0	0	114.2	Y309 F337 W338 S339	Y309-D335 HydrophobicContact CD1-CB 3.46Å; Y309-D335 VanDerWaalsContact CD1-CB 3.46Å; Y309-D335 HydrophobicContact CE1-CB 3.56Å; Y309-D335 HydrophobicContact CG-CB 4.12Å; D335-F337 PolarHBondContact O-N 3.22Å; D335-W338 PolarHBondContact O-N 3.38Å; D335-W338 VanDerWaalsContact O-N 3.1Å; D335-S339 VanDerWaalsContact O-CB 3.24Å; D335-S339 WeakPolarHBondContact O-CB 3.34Å; D335-S339 PolarHBondContact O-N 3.38Å; D335-S339 PolarHBondContact O-OG 3.04Å
336	F	98.8	Very high	97.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-53.5	-35.9	174.4	178.5	-115.3	0	0	0	112.4	L144 I147 K148 M151 M240 W244 A310 L313 H334	L144-F336 HydrophobicContact CD1-CE2 3.89Å; L144-F336 HydrophobicContact CD1-CZ 4.46Å; I147-F336 HydrophobicContact CG2-CZ 4.39Å; K148-F336 HydrophobicContact CB-CE1 4.19Å; K148-F336 HydrophobicContact CB-CZ 4.15Å; K148-F336 HydrophobicContact CD-CE2 4.26Å; K148-F336 HydrophobicContact CD-CZ 4.46Å; K148-F336 WeakPolarHBondContact CD-O 3.44Å; K148-F336 WeakPolarHBondContact CE-O 3.31Å; K148-F336 HydrophobicContact CG-CD1 4.13Å; K148-F336 HydrophobicContact CG-CD2 4.05Å; K148-F336 HydrophobicContact CG-CE1 3.61Å; K148-F336 HydrophobicContact CG-CE2 3.5Å; K148-F336 VanDerWaalsContact CG-CE2 3.5Å; K148-F336 HydrophobicContact CG-CG 4.34Å; K148-F336 HydrophobicContact CG-CZ 3.27Å; K148-F336 PolarHBondContact NZ-O 3.48Å; M151-F336 HydrophobicContact CB-CE1 4.31Å; M240-F336 HydrophobicContact CE-CD1 3.83Å; M240-F336 HydrophobicContact CE-CE1 3.5Å; M240-F336 VanDerWaalsContact CE-CE1 3.5Å; M240-F336 HydrophobicContact CE-CE2 4.28Å; M240-F336 HydrophobicContact CE-CG 4.33Å; M240-F336 HydrophobicContact CE-CZ 3.75Å; W244-F336 HydrophobicContact CH2-CE2 4.37Å; W244-F336 HydrophobicContact CH2-CZ 4.04Å; A310-F336 HydrophobicContact CB-CD2 3.81Å; A310-F336 HydrophobicContact CB-CE2 3.52Å; A310-F336 HydrophobicContact CB-CZ 4.31Å; L313-F336 HydrophobicContact CD2-CB 4.17Å; L313-F336 HydrophobicContact CD2-CD1 3.77Å; L313-F336 HydrophobicContact CD2-CG 4.28Å; H334-F336 WeakPolarHBondContact ND1-CB 3.44Å; H334-F336 PolarHBondContact ND1-N 3.05Å; H334-F336 VanDerWaalsContact ND1-N 3.17Å; H334-F336 PolarHBondContact O-N 2.88Å
337	F	98.8	Very high	97.1	Very high	1 Å²	1	57.2 Å²	57.2	0%	0.004	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-90.7	-11.9	-179.8	-59.8	-63.2	0	0	0	114.4	K148 M151 Q152 L155 L313 A331 H334 D335 P343	K148-F337 HydrophobicContact CB-CD1 4.39Å; K148-F337 WeakPolarHBondContact O-CE1 3.42Å; M151-F337 HydrophobicContact CB-CE1 3.84Å; M151-F337 HydrophobicContact CB-CZ 3.83Å; Q152-F337 HydrophobicContact CB-CD1 3.9Å; Q152-F337 HydrophobicContact CB-CE1 3.85Å; L155-F337 HydrophobicContact CD1-CE2 3.65Å; L155-F337 HydrophobicContact CD1-CZ 3.62Å; L313-F337 HydrophobicContact CD2-CE2 3.65Å; L313-F337 HydrophobicContact CD2-CZ 3.88Å; A331-F337 VanDerWaalsContact O-CD2 3.32Å; A331-F337 WeakPolarHBondContact O-CD2 3.5Å; A331-F337 WeakPolarHBondContact O-CE2 3.26Å; H334-F337 PolarHBondContact O-N 3.43Å; D335-F337 PolarHBondContact O-N 3.22Å; F337-P343 WeakPolarHBondContact O-CD 3.47Å
338	W	98.3	Very high	96.3	Very high	154 Å²	154	59.7 Å²	59.7	58%	0.583	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	9.7	-170.4	-54.6	104.2	0	0	0	113.6	L332 D335 M342	L332-W338 PolarHBondContact O-NE1 3.19Å; D335-W338 PolarHBondContact O-N 3.38Å; D335-W338 VanDerWaalsContact O-N 3.1Å; W338-M342 HydrophobicContact CE3-CE 4.15Å
339	S	98.1	Very high	95.5	Very high	20 Å²	20	60.2 Å²	60.2	14%	0.14	31%	0.313	C	S	.	.	S	Bend	trans	-111.6	154	173.1	54.5	0	0	0	0	110.8	K148 Y309 D335 P341	K148-S339 PolarHBondContact NZ-O 2.76Å; K148-S339 PolarHBondContact NZ-OG 3.24Å; Y309-S339 WeakPolarHBondContact CD2-OG 3.32Å; D335-S339 VanDerWaalsContact O-CB 3.24Å; D335-S339 WeakPolarHBondContact O-CB 3.34Å; D335-S339 PolarHBondContact O-N 3.38Å; D335-S339 PolarHBondContact O-OG 3.04Å; S339-P341 CarbonylContact O-C 3.37Å; S339-P341 VanDerWaalsContact O-C 3.27Å; S339-P341 VanDerWaalsContact O-O 3.06Å
340	D	97.7	Very high	94.7	Very high	139 Å²	139	57 Å²	57	74%	0.743	30%	0.295	S	S	*	.	S	Bend	trans	-67.9	144.4	174.4	-76.8	-38.4	0	0	0	112.4
341	P	98.1	Very high	93.4	Very high	58 Å²	58	55.4 Å²	55.4	38%	0.377	29%	0.292	S	S	.	.	S	Bend	cis	-70.6	138.5	-8.7	31.4	-34.8	0	0	0	110.8	L144 A145 K148 S339	L144-P341 HydrophobicContact CB-CG 4.23Å; L144-P341 HydrophobicContact CD2-CG 3.85Å; L144-P341 HydrophobicContact CG-CG 4.06Å; A145-P341 HydrophobicContact CB-CB 4.28Å; A145-P341 HydrophobicContact CB-CG 4.44Å; K148-P341 WeakPolarHBondContact CD-O 3.25Å; K148-P341 VanDerWaalsContact CE-O 3.27Å; K148-P341 WeakPolarHBondContact CE-O 3.19Å; K148-P341 PolarHBondContact NZ-O 3.04Å; S339-P341 CarbonylContact O-C 3.37Å; S339-P341 VanDerWaalsContact O-C 3.27Å; S339-P341 VanDerWaalsContact O-O 3.06Å
342	M	98.4	Very high	92.1	Very high	83 Å²	83	60.2 Å²	60.2	41%	0.409	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-65.8	156.9	176.8	-69.9	-61.1	-73.6	0	0	112.2	A145 W338 S344	A145-M342 VanDerWaalsContact CB-O 3.29Å; A145-M342 WeakPolarHBondContact CB-O 3.11Å; W338-M342 HydrophobicContact CE3-CE 4.15Å; M342-S344 PolarHBondContact O-N 3.29Å
343	P	98.1	Very high	90.9	Very high	30 Å²	30	60.9 Å²	60.9	20%	0.195	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-54.4	132.4	176.5	-21.1	28.9	0	0	0	112.7	A145 K148 K149 F337	A145-P343 WeakPolarHBondContact O-CA 3.22Å; K148-P343 HydrophobicContact CB-CB 4.07Å; K148-P343 HydrophobicContact CB-CG 4Å; K149-P343 HydrophobicContact CB-CB 4.18Å; K149-P343 HydrophobicContact CD-CB 4.12Å; F337-P343 WeakPolarHBondContact O-CD 3.47Å
344	S	96.8	Very high	89.5	Confident	43 Å²	43	62.6 Å²	62.6	30%	0.301	33%	0.333	S	S	.	.			trans	-122.1	154.5	-179.4	68.9	0	0	0	0	112.9	A145 K149 M342	A145-S344 WeakPolarHBondContact CB-OG 3.4Å; A145-S344 PolarHBondContact O-N 3.12Å; K149-S344 WeakPolarHBondContact CB-O 3.39Å; K149-S344 VanDerWaalsContact CG-O 3.28Å; K149-S344 WeakPolarHBondContact CG-O 3.34Å; M342-S344 PolarHBondContact O-N 3.29Å
345	D	94.6	Very high	88.6	Confident	89 Å²	89	66.8 Å²	66.8	48%	0.476	36%	0.36	S	S	.	.			trans	-60.4	146	177.4	-169.1	-5.3	0	0	0	112.3	K347	D345-K347 WeakPolarHBondContact OD1-CB 3.16Å; D345-K347 PolarHBondContact OD1-N 3.22Å; D345-K347 WeakPolarHBondContact OD2-CB 3.41Å
346	L	92.5	Very high	87.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	-85.8	-12.3	176.4	-52.4	-178.7	0	0	0	112.9	E146 V150 M153 I178 N348 M349 L350	E146-L346 HydrophobicContact CB-CD2 3.48Å; E146-L346 VanDerWaalsContact CB-CD2 3.48Å; E146-L346 HydrophobicContact CG-CD2 3.8Å; V150-L346 HydrophobicContact CG2-CD1 3.62Å; V150-L346 HydrophobicContact CG2-CD2 3.95Å; V150-L346 HydrophobicContact CG2-CG 4.41Å; M153-L346 HydrophobicContact CE-CD1 3.95Å; I178-L346 HydrophobicContact CD1-CD1 4.32Å; I178-L346 HydrophobicContact CG2-CD1 4.35Å; L346-N348 VanDerWaalsContact C-N 3.27Å; L346-N348 PolarHBondContact O-N 3.06Å; L346-M349 PolarHBondContact O-N 3.33Å; L346-M349 VanDerWaalsContact O-N 3.13Å; L346-L350 HydrophobicContact CB-CD1 3.89Å; L346-L350 HydrophobicContact CB-CG 4.36Å; L346-L350 WeakPolarHBondContact O-CG 3.32Å; L346-L350 PolarHBondContact O-N 3.15Å
347	K	81.3	Confident	86.8	Confident	105 Å²	105	64.9 Å²	64.9	46%	0.457	35%	0.352	S	S	.	.	H	α-helix	trans	-52.8	-41.4	-172.2	-172.7	174.5	-174.6	173.7	0	113.5	D345 L350 S351	D345-K347 WeakPolarHBondContact OD1-CB 3.16Å; D345-K347 PolarHBondContact OD1-N 3.22Å; D345-K347 WeakPolarHBondContact OD2-CB 3.41Å; K347-L350 PolarHBondContact O-N 2.85Å; K347-S351 VanDerWaalsContact O-CB 3.24Å; K347-S351 WeakPolarHBondContact O-CB 3.4Å; K347-S351 PolarHBondContact O-N 3.32Å
348	N	80.8	Confident	85.9	Confident	128 Å²	128	65.6 Å²	65.6	68%	0.684	36%	0.355	S	S	*	.	H	α-helix	trans	-65.5	-47.4	-179.8	-69.6	-21.6	0	0	0	111.4	L346 L350 S351	L346-N348 VanDerWaalsContact C-N 3.27Å; L346-N348 PolarHBondContact O-N 3.06Å; N348-L350 PolarHBondContact O-N 3.12Å; N348-S351 PolarHBondContact O-N 3.26Å; N348-S351 PolarHBondContact O-OG 3.26Å
349	M	82.8	Confident	85.1	Confident	18 Å²	18	63 Å²	63	9%	0.089	35%	0.35	C	S	.	.	H	α-helix	trans	-62.8	-42.5	177.3	179.9	-79.5	-72.2	0	0	111.7	V140 K141 F142 E146 L346 T352 H353	V140-M349 HydrophobicContact CG1-CE 4.35Å; V140-M349 HydrophobicContact CG1-SD 3.83Å; K141-M349 WeakPolarHBondContact O-CG 3.43Å; F142-M349 HydrophobicContact CD1-CE 3.77Å; F142-M349 HydrophobicContact CE1-CE 3.34Å; F142-M349 HydrophobicContact CZ-CE 3.86Å; E146-M349 WeakPolarHBondContact OE1-CB 3.38Å; L346-M349 PolarHBondContact O-N 3.33Å; L346-M349 VanDerWaalsContact O-N 3.13Å; M349-T352 PolarHBondContact O-N 3.31Å; M349-T352 PolarHBondContact O-OG1 3.46Å; M349-H353 PolarHBondContact O-ND1 2.86Å
350	L	81.3	Confident	84	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-74.7	-27.8	-179.4	-65.3	171.5	0	0	0	113.3	L134 I178 L346 K347 N348 T352 H353	L134-L350 HydrophobicContact CD1-CD2 4.35Å; L134-L350 HydrophobicContact CD2-CD2 4.12Å; I178-L350 HydrophobicContact CG2-CD1 3.51Å; L346-L350 HydrophobicContact CB-CD1 3.89Å; L346-L350 HydrophobicContact CB-CG 4.36Å; L346-L350 WeakPolarHBondContact O-CG 3.32Å; L346-L350 PolarHBondContact O-N 3.15Å; K347-L350 PolarHBondContact O-N 2.85Å; N348-L350 PolarHBondContact O-N 3.12Å; L350-T352 PolarHBondContact O-N 3.04Å; L350-T352 VanDerWaalsContact O-N 3.16Å; L350-H353 PolarHBondContact O-N 3.33Å
351	S	72.1	Confident	82.7	Confident	66 Å²	66	65.2 Å²	65.2	46%	0.462	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-24.1	177.1	73.2	0	0	0	0	113.4	K347 N348 H353	K347-S351 VanDerWaalsContact O-CB 3.24Å; K347-S351 WeakPolarHBondContact O-CB 3.4Å; K347-S351 PolarHBondContact O-N 3.32Å; N348-S351 PolarHBondContact O-N 3.26Å; N348-S351 PolarHBondContact O-OG 3.26Å; S351-H353 VanDerWaalsContact C-N 3.27Å
352	T	70.2	Confident	81.4	Confident	101 Å²	101	64 Å²	64	62%	0.62	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-9.5	176.1	63.5	0	0	0	0	112.9	M349 L350	M349-T352 PolarHBondContact O-N 3.31Å; M349-T352 PolarHBondContact O-OG1 3.46Å; L350-T352 PolarHBondContact O-N 3.04Å; L350-T352 VanDerWaalsContact O-N 3.16Å
353	H	75.3	Confident	79.7	Confident	32 Å²	32	65.2 Å²	65.2	15%	0.148	36%	0.361	C	S	.	.			trans	-113.1	87.1	-175.6	-66.2	87	0	0	0	111.7	V140 M349 L350 S351 T355 M357	V140-H353 VanDerWaalsContact CG2-NE2 3.32Å; V140-H353 WeakPolarHBondContact CG2-NE2 3.28Å; M349-H353 PolarHBondContact O-ND1 2.86Å; L350-H353 PolarHBondContact O-N 3.33Å; S351-H353 VanDerWaalsContact C-N 3.27Å; H353-T355 VanDerWaalsContact C-N 3.33Å; H353-T355 PolarHBondContact O-N 3.47Å; H353-M357 HydrophobicContact CB-CE 3.51Å
354	N	69.1	Low	77.5	Confident	138 Å²	138	69.8 Å²	69.8	74%	0.738	39%	0.391	S	S	*	.			trans	-78.2	-10.4	-174.2	-70.5	-41.7	0	0	0	115.5
355	T	78.1	Confident	75.5	Confident	102 Å²	102	74.2 Å²	74.2	63%	0.626	40%	0.401	S	S	*	.	S	Bend	trans	-101.6	130.9	177.5	46.7	0	0	0	0	110.9	H353 M357	H353-T355 VanDerWaalsContact C-N 3.33Å; H353-T355 PolarHBondContact O-N 3.47Å; T355-M357 PolarHBondContact O-N 2.93Å
356	S	80.6	Confident	72.9	Confident	35 Å²	35	81.9 Å²	81.9	25%	0.245	42%	0.423	C	S	.	.			trans	-54.1	133.7	171.2	-69.7	0	0	0	0	110.6	E128	E128-S356 CarbonylContact O-C 3.56Å; E128-S356 WeakPolarHBondContact O-CA 3.46Å; E128-S356 WeakPolarHBondContact O-CB 3.43Å; E128-S356 PolarHBondContact O-OG 3.31Å
357	M	80.1	Confident	70.4	Confident	17 Å²	17	91.5 Å²	91.5	8%	0.084	46%	0.459	C	S	.	.	B	Isolated β-bridge	trans	-117.5	98.2	-177.1	-76.9	177.4	-83.1	0	0	108.7	E128 H129 D130 L134 N137 V140 H353 T355	E128-M357 PolarHBondContact O-N 3.13Å; H129-M357 WeakPolarHBondContact CA-O 3.49Å; H129-M357 PolarHBondContact ND1-N 3.04Å; D130-M357 PolarHBondContact N-O 3.15Å; L134-M357 HydrophobicContact CD2-CB 4.4Å; L134-M357 HydrophobicContact CD2-CE 3.32Å; L134-M357 HydrophobicContact CD2-SD 3.95Å; N137-M357 HydrophobicContact CB-SD 4.03Å; N137-M357 PolarHBondContact ND2-SD 3.09Å; V140-M357 HydrophobicContact CG2-CE 3.89Å; V140-M357 HydrophobicContact CG2-SD 3.69Å; H353-M357 HydrophobicContact CB-CE 3.51Å; T355-M357 PolarHBondContact O-N 2.93Å
358	F	79.8	Confident	68	Low	15 Å²	15	89.7 Å²	89.7	7%	0.066	47%	0.47	C	S	.	.			trans	-110.9	139.2	172.5	-58.5	-69.4	0	0	0	110.2	I46 F126 C127 E128 D130 Y360 L361 A362	I46-F358 HydrophobicContact CB-CD2 4.06Å; I46-F358 HydrophobicContact CB-CE2 4.04Å; I46-F358 HydrophobicContact CD1-CE2 4.46Å; I46-F358 HydrophobicContact CD1-CZ 4.29Å; I46-F358 HydrophobicContact CG2-CD2 4.2Å; I46-F358 HydrophobicContact CG2-CE2 3.94Å; F126-F358 HydrophobicContact CE2-CE2 4.29Å; F126-F358 AromaticContact CE2-CZ 3.88Å; F126-F358 HydrophobicContact CE2-CZ 3.88Å; F126-F358 HydrophobicContact CZ-CE2 4.01Å; F126-F358 AromaticContact CZ-CZ 3.73Å; F126-F358 HydrophobicContact CZ-CZ 3.73Å; C127-F358 WeakPolarHBondContact O-CZ 3.28Å; E128-F358 WeakPolarHBondContact O-CZ 3.21Å; D130-F358 HydrophobicContact CB-CD1 4.37Å; D130-F358 WeakPolarHBondContact OD2-CA 3.25Å; D130-F358 WeakPolarHBondContact OD2-CB 3.32Å; D130-F358 WeakPolarHBondContact OD2-CD1 3.34Å; F358-Y360 PolarHBondContact O-N 3.21Å; F358-L361 HydrophobicContact CB-CD1 4.42Å; F358-L361 HydrophobicContact CB-CG 4.24Å; F358-L361 HydrophobicContact CD2-CD1 3.83Å; F358-L361 HydrophobicContact CD2-CG 4.48Å; F358-L361 PolarHBondContact O-N 3.42Å; F358-A362 PolarHBondContact O-N 3.4Å
359	E	81.8	Confident	65.6	Low	101 Å²	101	92.9 Å²	92.9	47%	0.472	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-53.5	-39.5	174.9	-178.8	-177.1	-156.7	0	0	110.8	D130 A132 A174 L361 A362	D130-E359 PolarHBondContact OD1-N 2.99Å; D130-E359 PolarHBondContact OD2-N 2.89Å; A132-E359 HydrophobicContact CB-CB 3.94Å; A132-E359 HydrophobicContact CB-CG 4.29Å; A174-E359 WeakPolarHBondContact CB-OE2 3.37Å; E359-L361 PolarHBondContact O-N 2.95Å; E359-A362 WeakPolarHBondContact O-CB 3.3Å; E359-A362 PolarHBondContact O-N 3.03Å
360	Y	73.9	Confident	63.2	Low	108 Å²	108	99 Å²	99	42%	0.424	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-57.3	-30.8	177.2	-177.7	-102.1	0	0	0	114	K45 I46 Q48 F358	K45-Y360 WeakPolarHBondContact CE-OH 3.32Å; K45-Y360 HydrophobicContact CG-CE1 4.3Å; I46-Y360 WeakPolarHBondContact O-CB 3.5Å; Q48-Y360 HydrophobicContact CB-CE2 3.9Å; F358-Y360 PolarHBondContact O-N 3.21Å
361	L	71.7	Confident	60.9	Low	97 Å²	97	104 Å²	104	51%	0.508	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-94.8	-8.9	179.9	-59.6	-178.8	0	0	0	112.6	F358 E359	F358-L361 HydrophobicContact CB-CD1 4.42Å; F358-L361 HydrophobicContact CB-CG 4.24Å; F358-L361 HydrophobicContact CD2-CD1 3.83Å; F358-L361 HydrophobicContact CD2-CG 4.48Å; F358-L361 PolarHBondContact O-N 3.42Å; E359-L361 PolarHBondContact O-N 2.95Å
362	A	71.3	Confident	59	Low	31 Å²	31	110.2 Å²	110.2	26%	0.256	57%	0.566	S	S	.	*	S	Bend	trans	-71.9	144.4	179.8	0	0	0	0	0	110.4	F358 E359	F358-A362 PolarHBondContact O-N 3.4Å; E359-A362 WeakPolarHBondContact O-CB 3.3Å; E359-A362 PolarHBondContact O-N 3.03Å
363	P	61.1	Low	57.2	Low	110 Å²	110	114 Å²	114	71%	0.714	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-54.1	137.9	171.7	-21.8	31.3	0	0	0	110	R365	P363-R365 PolarHBondContact O-N 3.49Å; P363-R365 VanDerWaalsContact O-N 3.08Å
364	P	52.6	Low	55	Low	126 Å²	126	121 Å²	121	82%	0.818	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-55.7	123.2	176.1	20.8	-29.9	0	0	0	108.5	R366	P364-R366 PolarHBondContact O-N 3.25Å; P364-R366 VanDerWaalsContact O-N 3.15Å
365	R	55.3	Low	53.1	Low	136 Å²	136	120.6 Å²	120.6	51%	0.513	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-49.1	126.8	176.1	-74.4	-178.9	171.1	177.2	-6.2	107.6	R246 P363 R367	R246-R365 PolarHBondContact O-NH2 3.22Å; P363-R365 PolarHBondContact O-N 3.49Å; P363-R365 VanDerWaalsContact O-N 3.08Å; R365-R367 VanDerWaalsContact C-N 3.3Å; R365-R367 PolarHBondContact O-N 3.34Å
366	R	38.7	Very low	50.8	Low	249 Å²	249	123.4 Å²	123.4	94%	0.94	63%	0.625	S	S	*	*			trans	-54.1	101.1	172	-80.2	-175.1	179	179.6	0.1	106.8	P364 G368	P364-R366 PolarHBondContact O-N 3.25Å; P364-R366 VanDerWaalsContact O-N 3.15Å; R366-G368 PolarHBondContact O-N 3.41Å; R366-G368 VanDerWaalsContact O-N 3.13Å
367	R	40.3	Very low	48.6	Very low	202 Å²	202	130.2 Å²	130.2	76%	0.762	65%	0.653	S	S	*	*			trans	-56.6	119.4	161.6	-72.2	-178.6	177.9	179.1	-0.5	104.3	R365 H369	R365-R367 VanDerWaalsContact C-N 3.3Å; R365-R367 PolarHBondContact O-N 3.34Å; R367-H369 PolarHBondContact O-N 3.27Å
368	G	32.5	Very low	46.3	Very low	67 Å²	67	136.7 Å²	136.7	69%	0.691	69%	0.688	S	S	*	*			trans	-45.1	130.7	161.8	0	0	0	0	0	107.4	R366 M370	R366-G368 PolarHBondContact O-N 3.41Å; R366-G368 VanDerWaalsContact O-N 3.13Å; G368-M370 PolarHBondContact O-N 3.02Å
369	H	30.3	Very low	43.9	Very low	195 Å²	195	148 Å²	148	90%	0.903	73%	0.73	S	S	*	*			trans	-34.4	108	-173.2	-91.9	14	0	0	0	112.3	R367 P371	R367-H369 PolarHBondContact O-N 3.27Å; H369-P371 WeakPolarHBondContact O-CD 3.14Å
370	M	31.7	Very low	41.4	Very low	148 Å²	148	150.8 Å²	150.8	73%	0.729	75%	0.748	S	S	*	*			trans	-91.8	113.4	157	-75.1	-171.1	-164.2	0	0	106.6	G368 Q372	G368-M370 PolarHBondContact O-N 3.02Å; M370-Q372 PolarHBondContact O-N 2.89Å
371	P	33.3	Very low	39.3	Very low	107 Å²	107	151.6 Å²	151.6	70%	0.695	77%	0.767	S	S	*	*			trans	-62.3	122.1	159.7	-11.8	26.8	0	0	0	107.3	H369 Q373	H369-P371 WeakPolarHBondContact O-CD 3.14Å; P371-Q373 PolarHBondContact O-N 2.91Å
372	Q	31.8	Very low	37.3	Very low	198 Å²	198	151.1 Å²	151.1	93%	0.925	78%	0.777	S	S	*	*			trans	-60.4	104.1	162.7	-86.4	176.5	-15.1	0	0	107.6	M370	M370-Q372 PolarHBondContact O-N 2.89Å
373	Q	31.7	Very low	35.2	Very low	180 Å²	180	156.3 Å²	156.3	84%	0.841	81%	0.806	S	S	*	*			trans	-97.3	116.8	162.8	-79.8	-175.9	2.9	0	0	108.7	P371	P371-Q373 PolarHBondContact O-N 2.91Å
374	Q	29.6	Very low	33.7	Very low	178 Å²	178	157.6 Å²	157.6	83%	0.832	81%	0.812	S	S	*	*			trans	-55.7	148.3	164.9	-73.9	173.9	-2.3	0	0	109.8	N376	Q374-N376 PolarHBondContact O-N 3.39Å
375	P	29.7	Very low	32.6	Very low	130 Å²	130	155.4 Å²	155.4	84%	0.844	80%	0.799	S	S	*	*			trans	-70.7	103.1	-177.4	28.1	-31.5	0	0	0	109.6
376	N	28.5	Very low	31.3	Very low	162 Å²	162	157.3 Å²	157.3	87%	0.866	81%	0.814	S	S	*	*			trans	-101.5	120.1	165.8	-135.1	3.6	0	0	0	108.6	Q374	Q374-N376 PolarHBondContact O-N 3.39Å
377	Q	34.3	Very low	30.9	Very low	177 Å²	177	150.6 Å²	150.6	83%	0.827	80%	0.801	S	S	*	*			trans	-65.2	148.2	176.2	-72.7	173.2	-10	0	0	110.5
378	N	32	Very low	30.7	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	79%	0.791	S	S	*	*			trans	84.1	102.2	174.8	-64.8	-16.4	0	0	0	118
379	R	29.9	Very low	30.9	Very low	254 Å²	254	150.5 Å²	150.5	96%	0.958	79%	0.789	S	S	*	*				-171.5	146.3	119.8	-101.4	166.7	-176.5	-162.9	1.2	113.2
380	N	28.8	Very low	31.1	Very low	158 Å²	158	147.9 Å²	147.9	85%	0.845	78%	0.781	S	S	*	*			trans	-63.4	160.4	-173.9	-83	-18.1	0	0	0	115.6
381	P	30.5	Very low	31.6	Very low	126 Å²	126	147.7 Å²	147.7	82%	0.818	77%	0.773	S	S	*	*			trans	-92.1	115.7	-173.6	34.5	-28.5	0	0	0	111.9
382	A	29.8	Very low	32.1	Very low	86 Å²	86	142.8 Å²	142.8	71%	0.711	74%	0.74	S	S	*	*			trans	-153.8	139.9	155.3	0	0	0	0	0	108.7
383	T	27.3	Very low	32.6	Very low	141 Å²	141	137.1 Å²	137.1	87%	0.865	71%	0.713	S	S	*	*			trans	93.5	91.3	177	69.4	0	0	0	0	117	S385	T383-S385 PolarHBondContact O-N 3.01Å
384	T	29.6	Very low	32.7	Very low	137 Å²	137	135 Å²	135	84%	0.84	71%	0.706	S	S	*	*			trans	-71.9	109.3	160.8	-39	0	0	0	0	108.2
385	S	28.4	Very low	32.8	Very low	79 Å²	79	132.7 Å²	132.7	55%	0.552	70%	0.7	S	S	*	*			trans	-98.1	147.3	175.9	70.6	0	0	0	0	111.5	T383 T387	T383-S385 PolarHBondContact O-N 3.01Å; S385-T387 PolarHBondContact O-N 3.22Å; S385-T387 PolarHBondContact OG-OG1 3.15Å
386	Q	28.9	Very low	33	Very low	177 Å²	177	132.8 Å²	132.8	83%	0.827	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-62.5	13	-170.1	-72.3	165.6	-31.2	0	0	116.7
387	T	29.2	Very low	33.3	Very low	108 Å²	108	131.1 Å²	131.1	66%	0.663	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-88.9	-4.2	-176.3	45.2	0	0	0	0	114.5	S385	S385-T387 PolarHBondContact O-N 3.22Å; S385-T387 PolarHBondContact OG-OG1 3.15Å
388	E	36.7	Very low	33.2	Very low	119 Å²	119	128.3 Å²	128.3	56%	0.556	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-81.1	-10.2	176.1	-100.3	-176.7	158.7	0	0	114.5	D390	E388-D390 VanDerWaalsContact C-N 3.32Å; E388-D390 PolarHBondContact O-N 3.28Å
389	F	37.5	Very low	33.3	Very low	148 Å²	148	126.6 Å²	126.6	65%	0.649	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-73.4	-18.2	-175.6	-83	-83.4	0	0	0	114.9
390	D	34.9	Very low	33.5	Very low	139 Å²	139	117.5 Å²	117.5	74%	0.743	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-86	-2.7	-178.6	-77.6	-15.5	0	0	0	113.8	E388 V392 F393	E388-D390 VanDerWaalsContact C-N 3.32Å; E388-D390 PolarHBondContact O-N 3.28Å; D390-V392 VanDerWaalsContact C-N 3.34Å; D390-V392 PolarHBondContact O-N 3.4Å; D390-F393 VanDerWaalsContact O-O 3.1Å
391	R	42.4	Very low	33.9	Very low	145 Å²	145	114.4 Å²	114.4	55%	0.547	63%	0.626	S	S	.	*	G	3₁₀ helix	trans	-88.9	3.4	-175.6	-68.4	-174.5	-179.9	168.4	2	115.4
392	V	43.1	Very low	34.2	Very low	3 Å²	3	113.4 Å²	113.4	2%	0.018	61%	0.61	C	S	.	*	G	3₁₀ helix	trans	-101.6	-3.5	172.6	-167.7	0	0	0	0	111.1	L261 L265 D390	L261-V392 HydrophobicContact CD2-CG2 3.74Å; L265-V392 HydrophobicContact CB-CG1 4.43Å; D390-V392 VanDerWaalsContact C-N 3.34Å; D390-V392 PolarHBondContact O-N 3.4Å
393	F	42.3	Very low	34.6	Very low	79 Å²	79	115.9 Å²	115.9	35%	0.346	60%	0.601	S	S	.	*			trans	-136.8	0	173.8	-71.1	-74.6	0	0	0	112.5	L265 R300 Y304 D390	L265-F393 HydrophobicContact CD1-CZ 4.48Å; R300-F393 HydrophobicContact CB-CE1 4.05Å; R300-F393 HydrophobicContact CB-CE2 3.82Å; R300-F393 HydrophobicContact CB-CZ 3.31Å; R300-F393 HydrophobicContact CG-CE2 3.7Å; R300-F393 HydrophobicContact CG-CZ 3.71Å; R300-F393 VanDerWaalsContact NE-CE2 3.34Å; Y304-F393 AromaticContact CE2-CD1 3.51Å; Y304-F393 HydrophobicContact CE2-CD1 3.51Å; Y304-F393 AromaticContact CE2-CE1 4Å; Y304-F393 HydrophobicContact CE2-CE1 4Å; Y304-F393 HydrophobicContact CE2-CG 4.47Å; Y304-F393 AromaticContact CZ-CD1 3.94Å; D390-F393 VanDerWaalsContact O-O 3.1Å

Retrieved 393 of 393 residues in 687.1 ms (Link to these results)

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