A0A077ZF64_TRITR Loading...

Galactosylgalactosylxylosylprotein 3-beta-glucuronosyltransferase

AlphaFold DB , UniProt , Accession A0A077ZF64, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 344 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	35.6	Very low	246 Å²	246	146.1 Å²	146.1	100%	1.212	80%	0.802	S	S	*	*				0	115.1	0	-81.3	161.6	157.5	0	0	107.6
2	K	32.3	Very low	35.8	Very low	215 Å²	215	147.9 Å²	147.9	94%	0.935	80%	0.796	S	S	*	*			trans	-115	115.4	165.9	-96.7	-176.1	174.2	-179.3	0	106.6
3	L	29.5	Very low	36.2	Very low	166 Å²	166	142.1 Å²	142.1	87%	0.869	77%	0.774	S	S	*	*			trans	-71.3	131.9	172.7	-71.6	158.7	0	0	0	107.7
4	S	35.9	Very low	36.3	Very low	87 Å²	87	137.1 Å²	137.1	61%	0.608	75%	0.753	S	S	*	*			trans	-83.2	157.4	166.7	89.8	0	0	0	0	109.7	N6 G7	S4-N6 PolarHBondContact O-N 2.8Å; S4-G7 PolarHBondContact O-N 2.92Å
5	S	50.3	Low	36.7	Very low	120 Å²	120	135.3 Å²	135.3	84%	0.839	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-8	-165.8	43	0	0	0	0	116.5
6	N	43.4	Very low	36.8	Very low	142 Å²	142	139.2 Å²	139.2	76%	0.759	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	22.7	-179.7	-74.5	1.4	0	0	0	114.7	S4 Q8	S4-N6 PolarHBondContact O-N 2.8Å; N6-Q8 PolarHBondContact O-N 3.46Å
7	G	34.1	Very low	37.1	Very low	68 Å²	68	143.1 Å²	143.1	70%	0.701	74%	0.744	S	S	*	*			trans	66.6	3.2	160.8	0	0	0	0	0	117.3	S4	S4-G7 PolarHBondContact O-N 2.92Å
8	Q	31.3	Very low	37.4	Very low	178 Å²	178	145.2 Å²	145.2	83%	0.832	74%	0.74	S	S	*	*			trans	-90.5	120.4	176	-74.2	-170.9	-13.1	0	0	111.6	N6 N10	N6-Q8 PolarHBondContact O-N 3.46Å; Q8-N10 PolarHBondContact O-N 2.88Å; Q8-N10 VanDerWaalsContact O-N 3.15Å
9	C	31.1	Very low	38.2	Very low	114 Å²	114	140.2 Å²	140.2	77%	0.77	72%	0.724	S	S	*	*			trans	-68.7	106.4	178.2	-161.6	0	0	0	0	110.2	F11	C9-F11 VanDerWaalsContact C-N 3.33Å; C9-F11 PolarHBondContact O-N 2.81Å
10	N	34.7	Very low	38.6	Very low	113 Å²	113	141.9 Å²	141.9	60%	0.604	72%	0.72	S	S	*	*			trans	-79.4	80.3	-175.7	-153.7	-17	0	0	0	111.1	Q8 K12 S13	Q8-N10 PolarHBondContact O-N 2.88Å; Q8-N10 VanDerWaalsContact O-N 3.15Å; N10-K12 PolarHBondContact O-N 2.78Å; N10-K12 VanDerWaalsContact O-N 3.07Å; N10-S13 PolarHBondContact O-N 3.36Å; N10-S13 VanDerWaalsContact O-N 3.14Å; N10-S13 PolarHBondContact O-OG 3.11Å
11	F	34.8	Very low	39.4	Very low	158 Å²	158	139.5 Å²	139.5	69%	0.693	71%	0.713	S	S	*	*	H	α-helix	trans	-54.8	-25.1	-177.3	-131.4	-93.6	0	0	0	113.5	C9 S13 C14 L15	C9-F11 VanDerWaalsContact C-N 3.33Å; C9-F11 PolarHBondContact O-N 2.81Å; F11-S13 VanDerWaalsContact C-N 3.32Å; F11-S13 PolarHBondContact O-N 3.29Å; F11-C14 PolarHBondContact O-N 2.78Å; F11-L15 HydrophobicContact CD1-CD1 4.43Å
12	K	37.7	Very low	40.5	Very low	168 Å²	168	135.2 Å²	135.2	73%	0.73	69%	0.688	S	S	*	*	H	α-helix	trans	-65.6	-30.4	179.2	-71.4	-173.8	175.5	-178.5	0	113.4	N10 W16	N10-K12 PolarHBondContact O-N 2.78Å; N10-K12 VanDerWaalsContact O-N 3.07Å; K12-W16 PolarHBondContact O-N 2.88Å
13	S	41.4	Very low	41.8	Very low	72 Å²	72	133.6 Å²	133.6	50%	0.503	68%	0.676	S	S	.	*	H	α-helix	trans	-74.7	-28.4	-177.7	68.7	0	0	0	0	113.7	N10 F11 R17	N10-S13 PolarHBondContact O-N 3.36Å; N10-S13 VanDerWaalsContact O-N 3.14Å; N10-S13 PolarHBondContact O-OG 3.11Å; F11-S13 VanDerWaalsContact C-N 3.32Å; F11-S13 PolarHBondContact O-N 3.29Å; S13-R17 PolarHBondContact O-N 3.32Å
14	C	37.6	Very low	43.5	Very low	72 Å²	72	128.1 Å²	128.1	49%	0.486	65%	0.651	S	S	.	*	H	α-helix	trans	-77.9	-37.8	-179	-159.7	0	0	0	0	111.9	F11 R17 R18	F11-C14 PolarHBondContact O-N 2.78Å; C14-R17 PolarHBondContact O-N 3.16Å; C14-R18 PolarHBondContact O-N 3.33Å; C14-R18 VanDerWaalsContact O-N 3.14Å
15	L	41.9	Very low	45	Very low	111 Å²	111	129.4 Å²	129.4	58%	0.581	65%	0.65	S	S	*	*	H	α-helix	trans	-64.2	-40.1	173.4	-83	155.9	0	0	0	111.9	F11 R18 A19	F11-L15 HydrophobicContact CD1-CD1 4.43Å; L15-R18 PolarHBondContact O-N 3.12Å; L15-A19 VanDerWaalsContact O-CB 3.25Å; L15-A19 WeakPolarHBondContact O-CB 3.46Å; L15-A19 PolarHBondContact O-N 3.1Å
16	W	38.9	Very low	45.6	Very low	197 Å²	197	128.2 Å²	128.2	75%	0.746	63%	0.634	S	S	*	*	H	α-helix	trans	-65.7	-42.2	177.2	-95.4	64	0	0	0	112.9	K12 A19 W20	K12-W16 PolarHBondContact O-N 2.88Å; W16-A19 PolarHBondContact O-N 2.85Å; W16-W20 WeakPolarHBondContact O-CB 3.09Å; W16-W20 PolarHBondContact O-N 3.4Å
17	R	42	Very low	46.9	Very low	205 Å²	205	126.2 Å²	126.2	77%	0.774	62%	0.622	S	S	*	*	H	α-helix	trans	-64.9	-41.6	176.3	-78.4	-176.1	-179.4	-113.8	-0.6	112.5	S13 C14 W20 T21	S13-R17 PolarHBondContact O-N 3.32Å; C14-R17 PolarHBondContact O-N 3.16Å; R17-W20 PolarHBondContact O-N 3.3Å; R17-T21 PolarHBondContact O-N 3.14Å; R17-T21 PolarHBondContact O-OG1 2.84Å
18	R	43	Very low	48.6	Very low	181 Å²	181	127 Å²	127	68%	0.683	61%	0.613	S	S	*	*	H	α-helix	trans	-65.9	-39.3	175.6	-76.7	-175.3	176.5	-175.1	-0.9	112.5	C14 L15 T21 F22	C14-R18 PolarHBondContact O-N 3.33Å; C14-R18 VanDerWaalsContact O-N 3.14Å; L15-R18 PolarHBondContact O-N 3.12Å; R18-T21 WeakPolarHBondContact CA-OG1 3.43Å; R18-T21 PolarHBondContact O-OG1 2.6Å; R18-F22 PolarHBondContact O-N 3.1Å
19	A	52.1	Low	50.4	Low	51 Å²	51	121.9 Å²	121.9	42%	0.421	59%	0.594	S	S	.	*	H	α-helix	trans	-67	-36.9	175.7	0	0	0	0	0	112.1	L15 W16 F22 R23	L15-A19 VanDerWaalsContact O-CB 3.25Å; L15-A19 WeakPolarHBondContact O-CB 3.46Å; L15-A19 PolarHBondContact O-N 3.1Å; W16-A19 PolarHBondContact O-N 2.85Å; A19-F22 PolarHBondContact O-N 3.13Å; A19-R23 WeakPolarHBondContact O-CB 3.45Å; A19-R23 WeakPolarHBondContact O-CG 3.41Å; A19-R23 PolarHBondContact O-N 3.48Å
20	W	45	Very low	52.2	Low	174 Å²	174	120 Å²	120	66%	0.659	58%	0.579	S	S	*	*	H	α-helix	trans	-68.1	-45	176.4	-130.6	70.6	0	0	0	111.7	W16 R17 F22 R23 C24	W16-W20 WeakPolarHBondContact O-CB 3.09Å; W16-W20 PolarHBondContact O-N 3.4Å; R17-W20 PolarHBondContact O-N 3.3Å; W20-F22 VanDerWaalsContact C-N 3.29Å; W20-F22 PolarHBondContact O-N 3.22Å; W20-R23 PolarHBondContact O-N 3.1Å; W20-C24 WeakPolarHBondContact O-CB 3.5Å; W20-C24 PolarHBondContact O-N 3.07Å; W20-C24 PolarHBondContact O-SG 3.32Å
21	T	56.2	Low	53.9	Low	91 Å²	91	118.9 Å²	118.9	56%	0.558	57%	0.572	S	S	*	*	H	α-helix	trans	-60.8	-39.2	174.8	47.4	0	0	0	0	111.8	R17 R18 L25	R17-T21 PolarHBondContact O-N 3.14Å; R17-T21 PolarHBondContact O-OG1 2.84Å; R18-T21 WeakPolarHBondContact CA-OG1 3.43Å; R18-T21 PolarHBondContact O-OG1 2.6Å; T21-L25 VanDerWaalsContact O-CB 3.31Å; T21-L25 WeakPolarHBondContact O-CB 3.44Å; T21-L25 PolarHBondContact O-N 3.21Å
22	F	57.6	Low	55.5	Low	156 Å²	156	114.7 Å²	114.7	68%	0.684	56%	0.559	S	S	*	*	H	α-helix	trans	-67.1	-42.9	175.5	-109.3	-89.1	0	0	0	112.5	R18 A19 W20 L25 L26	R18-F22 PolarHBondContact O-N 3.1Å; A19-F22 PolarHBondContact O-N 3.13Å; W20-F22 VanDerWaalsContact C-N 3.29Å; W20-F22 PolarHBondContact O-N 3.22Å; F22-L25 PolarHBondContact O-N 3Å; F22-L26 WeakPolarHBondContact O-CB 3.45Å; F22-L26 PolarHBondContact O-N 3.04Å
23	R	60.5	Low	56.4	Low	181 Å²	181	109.7 Å²	109.7	68%	0.683	54%	0.537	S	S	*	.	H	α-helix	trans	-65.9	-41.8	177.1	-80.8	-174.6	176.7	-147	-0.2	112.4	A19 W20 L26 I27	A19-R23 WeakPolarHBondContact O-CB 3.45Å; A19-R23 WeakPolarHBondContact O-CG 3.41Å; A19-R23 PolarHBondContact O-N 3.48Å; W20-R23 PolarHBondContact O-N 3.1Å; R23-L26 WeakPolarHBondContact O-CB 3.38Å; R23-L26 PolarHBondContact O-N 3.17Å; R23-I27 VanDerWaalsContact O-CG1 3.26Å; R23-I27 WeakPolarHBondContact O-CG1 3.29Å; R23-I27 PolarHBondContact O-N 3.21Å
24	C	63.4	Low	57.5	Low	51 Å²	51	109.6 Å²	109.6	35%	0.345	54%	0.537	S	S	.	.	H	α-helix	trans	-64.2	-43.1	175.7	-68.3	0	0	0	0	111.2	W20 L26 I27 V28	W20-C24 WeakPolarHBondContact O-CB 3.5Å; W20-C24 PolarHBondContact O-N 3.07Å; W20-C24 PolarHBondContact O-SG 3.32Å; C24-L26 VanDerWaalsContact C-N 3.32Å; C24-L26 PolarHBondContact O-N 3.03Å; C24-I27 PolarHBondContact O-N 3.05Å; C24-V28 VanDerWaalsContact O-CG2 3.29Å; C24-V28 WeakPolarHBondContact O-CG2 3.44Å; C24-V28 PolarHBondContact O-N 3.21Å
25	L	67.5	Low	58.8	Low	115 Å²	115	112.2 Å²	112.2	60%	0.602	54%	0.542	S	S	*	.	H	α-helix	trans	-61.6	-42	175.7	-158	83.1	0	0	0	111.2	T21 F22 V28 V29	T21-L25 VanDerWaalsContact O-CB 3.31Å; T21-L25 WeakPolarHBondContact O-CB 3.44Å; T21-L25 PolarHBondContact O-N 3.21Å; F22-L25 PolarHBondContact O-N 3Å; L25-V28 PolarHBondContact O-N 2.95Å; L25-V29 WeakPolarHBondContact O-CB 3.36Å; L25-V29 VanDerWaalsContact O-CG2 3.25Å; L25-V29 WeakPolarHBondContact O-CG2 3.39Å; L25-V29 PolarHBondContact O-N 2.86Å
26	L	64.3	Low	59.6	Low	94 Å²	94	111 Å²	111	49%	0.492	54%	0.535	S	S	.	.	H	α-helix	trans	-61.6	-45.1	176.7	-163.9	82.1	0	0	0	111.8	F22 R23 C24 V29 V30	F22-L26 WeakPolarHBondContact O-CB 3.45Å; F22-L26 PolarHBondContact O-N 3.04Å; R23-L26 WeakPolarHBondContact O-CB 3.38Å; R23-L26 PolarHBondContact O-N 3.17Å; C24-L26 VanDerWaalsContact C-N 3.32Å; C24-L26 PolarHBondContact O-N 3.03Å; L26-V29 PolarHBondContact O-N 2.95Å; L26-V30 VanDerWaalsContact O-CG2 3.26Å; L26-V30 WeakPolarHBondContact O-CG2 3.38Å; L26-V30 PolarHBondContact O-N 2.75Å
27	I	69.5	Low	60.2	Low	100 Å²	100	103.3 Å²	103.3	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-43.1	178.3	-68.5	164.7	0	0	0	110.6	R23 C24 V30 I31	R23-I27 VanDerWaalsContact O-CG1 3.26Å; R23-I27 WeakPolarHBondContact O-CG1 3.29Å; R23-I27 PolarHBondContact O-N 3.21Å; C24-I27 PolarHBondContact O-N 3.05Å; I27-V30 PolarHBondContact O-N 3.3Å; I27-I31 HydrophobicContact CG2-CD1 3.67Å; I27-I31 HydrophobicContact CG2-CG1 4.32Å; I27-I31 VanDerWaalsContact O-CG1 3.28Å; I27-I31 WeakPolarHBondContact O-CG1 3.46Å; I27-I31 PolarHBondContact O-N 3.42Å
28	V	69.3	Low	61	Low	86 Å²	86	99 Å²	99	52%	0.521	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-44.4	177.3	172.8	0	0	0	0	110.8	C24 L25 V30 I31 V32	C24-V28 VanDerWaalsContact O-CG2 3.29Å; C24-V28 WeakPolarHBondContact O-CG2 3.44Å; C24-V28 PolarHBondContact O-N 3.21Å; L25-V28 PolarHBondContact O-N 2.95Å; V28-V30 VanDerWaalsContact C-N 3.35Å; V28-V30 PolarHBondContact O-N 2.94Å; V28-I31 PolarHBondContact O-N 3.16Å; V28-V32 HydrophobicContact CG1-CG2 4.23Å; V28-V32 WeakPolarHBondContact O-CB 3.48Å; V28-V32 VanDerWaalsContact O-CG2 3.25Å; V28-V32 WeakPolarHBondContact O-CG2 3.3Å; V28-V32 PolarHBondContact O-N 2.74Å
29	V	70.4	Confident	61.7	Low	70 Å²	70	101.1 Å²	101.1	42%	0.424	52%	0.515	S	S	.	.	H	α-helix	trans	-59.4	-46.8	175.9	170.8	0	0	0	0	110.2	L25 L26 I31 V32 F33	L25-V29 WeakPolarHBondContact O-CB 3.36Å; L25-V29 VanDerWaalsContact O-CG2 3.25Å; L25-V29 WeakPolarHBondContact O-CG2 3.39Å; L25-V29 PolarHBondContact O-N 2.86Å; L26-V29 PolarHBondContact O-N 2.95Å; V29-I31 PolarHBondContact O-N 2.9Å; V29-V32 PolarHBondContact O-N 2.74Å; V29-F33 WeakPolarHBondContact O-CB 3.43Å; V29-F33 PolarHBondContact O-N 3.2Å
30	V	69.5	Low	61.9	Low	74 Å²	74	102.5 Å²	102.5	45%	0.448	52%	0.519	S	S	.	.	H	α-helix	trans	-63.5	-41.1	178.9	172.4	0	0	0	0	112.3	L26 I27 V28 F33 S34	L26-V30 VanDerWaalsContact O-CG2 3.26Å; L26-V30 WeakPolarHBondContact O-CG2 3.38Å; L26-V30 PolarHBondContact O-N 2.75Å; I27-V30 PolarHBondContact O-N 3.3Å; V28-V30 VanDerWaalsContact C-N 3.35Å; V28-V30 PolarHBondContact O-N 2.94Å; V30-F33 PolarHBondContact O-N 3.27Å; V30-S34 VanDerWaalsContact O-CB 3.3Å; V30-S34 WeakPolarHBondContact O-CB 3.38Å; V30-S34 PolarHBondContact O-N 3Å
31	I	70.4	Confident	62	Low	89 Å²	89	97.8 Å²	97.8	46%	0.456	52%	0.524	S	S	.	.	H	α-helix	trans	-66	-48.4	178.2	-68.9	168.4	0	0	0	110.8	I27 V28 V29 F33 S34 Q35	I27-I31 HydrophobicContact CG2-CD1 3.67Å; I27-I31 HydrophobicContact CG2-CG1 4.32Å; I27-I31 VanDerWaalsContact O-CG1 3.28Å; I27-I31 WeakPolarHBondContact O-CG1 3.46Å; I27-I31 PolarHBondContact O-N 3.42Å; V28-I31 PolarHBondContact O-N 3.16Å; V29-I31 PolarHBondContact O-N 2.9Å; I31-F33 VanDerWaalsContact C-N 3.26Å; I31-F33 PolarHBondContact O-N 3.01Å; I31-S34 PolarHBondContact O-N 2.88Å; I31-Q35 WeakPolarHBondContact O-CG 3.32Å; I31-Q35 PolarHBondContact O-N 3.09Å
32	V	66.8	Low	61.4	Low	70 Å²	70	101 Å²	101	42%	0.424	53%	0.531	S	S	.	.	H	α-helix	trans	-60.4	-41.4	177.8	173	0	0	0	0	109.9	V28 V29 Q35 I36	V28-V32 HydrophobicContact CG1-CG2 4.23Å; V28-V32 WeakPolarHBondContact O-CB 3.48Å; V28-V32 VanDerWaalsContact O-CG2 3.25Å; V28-V32 WeakPolarHBondContact O-CG2 3.3Å; V28-V32 PolarHBondContact O-N 2.74Å; V29-V32 PolarHBondContact O-N 2.74Å; V32-Q35 PolarHBondContact O-N 3.24Å; V32-I36 HydrophobicContact CG1-CD1 3.82Å; V32-I36 WeakPolarHBondContact O-CD1 3.21Å; V32-I36 VanDerWaalsContact O-CG1 3.25Å; V32-I36 WeakPolarHBondContact O-CG1 3.43Å; V32-I36 PolarHBondContact O-N 3.01Å
33	F	58.2	Low	60.8	Low	63 Å²	63	100.4 Å²	100.4	28%	0.276	53%	0.534	S	S	.	.	H	α-helix	trans	-69	-39.8	178.7	-140.8	-97.9	0	0	0	112.5	V29 V30 I31 Q35 I36 C37 V44 L48	V29-F33 WeakPolarHBondContact O-CB 3.43Å; V29-F33 PolarHBondContact O-N 3.2Å; V30-F33 PolarHBondContact O-N 3.27Å; I31-F33 VanDerWaalsContact C-N 3.26Å; I31-F33 PolarHBondContact O-N 3.01Å; F33-Q35 VanDerWaalsContact C-N 3.3Å; F33-Q35 PolarHBondContact O-N 2.99Å; F33-I36 PolarHBondContact O-N 3.23Å; F33-C37 WeakPolarHBondContact O-CB 3.27Å; F33-C37 PolarHBondContact O-N 3.4Å; F33-C37 PolarHBondContact O-SG 2.89Å; F33-V44 HydrophobicContact CE1-CB 4.03Å; F33-V44 HydrophobicContact CE1-CG1 3.64Å; F33-V44 HydrophobicContact CZ-CG1 3.81Å; F33-L48 HydrophobicContact CD1-CD1 4.31Å; F33-L48 HydrophobicContact CE1-CD1 4.39Å; F33-L48 HydrophobicContact CG-CD1 4.38Å
34	S	62.7	Low	60	Low	70 Å²	70	93.4 Å²	93.4	49%	0.49	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-39.2	174.2	-177.1	0	0	0	0	111.4	V30 I31 T38	V30-S34 VanDerWaalsContact O-CB 3.3Å; V30-S34 WeakPolarHBondContact O-CB 3.38Å; V30-S34 PolarHBondContact O-N 3Å; I31-S34 PolarHBondContact O-N 2.88Å; S34-T38 WeakPolarHBondContact O-CG2 3.27Å; S34-T38 PolarHBondContact O-N 2.99Å; S34-T38 VanDerWaalsContact O-N 3.13Å; S34-T38 PolarHBondContact O-OG1 2.93Å
35	Q	65.1	Low	59.3	Low	127 Å²	127	98.2 Å²	98.2	59%	0.593	53%	0.531	S	S	*	.	H	α-helix	trans	-70.1	-33.1	175.7	-73.5	-177	-14.1	0	0	112.7	I31 V32 F33 T38 R39	I31-Q35 WeakPolarHBondContact O-CG 3.32Å; I31-Q35 PolarHBondContact O-N 3.09Å; V32-Q35 PolarHBondContact O-N 3.24Å; F33-Q35 VanDerWaalsContact C-N 3.3Å; F33-Q35 PolarHBondContact O-N 2.99Å; Q35-T38 PolarHBondContact O-OG1 2.72Å; Q35-T38 VanDerWaalsContact O-OG1 3.1Å; Q35-R39 WeakPolarHBondContact O-CB 3.44Å; Q35-R39 PolarHBondContact O-N 3.14Å
36	I	59.3	Low	58.2	Low	86 Å²	86	98 Å²	98	44%	0.441	53%	0.53	S	S	.	.	H	α-helix	trans	-71.5	-43.3	175.2	-68.2	164.5	0	0	0	110.3	V32 F33 T38 R39 T40	V32-I36 HydrophobicContact CG1-CD1 3.82Å; V32-I36 WeakPolarHBondContact O-CD1 3.21Å; V32-I36 VanDerWaalsContact O-CG1 3.25Å; V32-I36 WeakPolarHBondContact O-CG1 3.43Å; V32-I36 PolarHBondContact O-N 3.01Å; F33-I36 PolarHBondContact O-N 3.23Å; I36-T38 PolarHBondContact O-N 2.9Å; I36-R39 PolarHBondContact O-N 2.99Å; I36-R39 VanDerWaalsContact O-N 3.11Å; I36-T40 PolarHBondContact O-N 2.93Å; I36-T40 PolarHBondContact O-OG1 3.05Å; I36-T40 VanDerWaalsContact O-OG1 3.09Å
37	C	51	Low	57.5	Low	35 Å²	35	98 Å²	98	24%	0.236	53%	0.53	C	S	.	.	H	α-helix	trans	-64.3	-39.4	-179.7	-67.8	0	0	0	0	112.6	F33 R39 G41	F33-C37 WeakPolarHBondContact O-CB 3.27Å; F33-C37 PolarHBondContact O-N 3.4Å; F33-C37 PolarHBondContact O-SG 2.89Å; C37-R39 PolarHBondContact O-N 2.89Å; C37-G41 PolarHBondContact O-N 2.82Å; C37-G41 VanDerWaalsContact O-N 3.14Å
38	T	59	Low	56.6	Low	115 Å²	115	96 Å²	96	71%	0.706	52%	0.52	S	S	*	.	H	α-helix	trans	-67.6	-26.4	174.6	52.2	0	0	0	0	112.6	S34 Q35 I36	S34-T38 WeakPolarHBondContact O-CG2 3.27Å; S34-T38 PolarHBondContact O-N 2.99Å; S34-T38 VanDerWaalsContact O-N 3.13Å; S34-T38 PolarHBondContact O-OG1 2.93Å; Q35-T38 PolarHBondContact O-OG1 2.72Å; Q35-T38 VanDerWaalsContact O-OG1 3.1Å; I36-T38 PolarHBondContact O-N 2.9Å
39	R	58.5	Low	55.6	Low	225 Å²	225	98.2 Å²	98.2	85%	0.849	53%	0.525	S	S	*	.	H	α-helix	trans	-84	-28.8	-179	-130.6	175.6	-177.7	177.8	-0.1	113.8	Q35 I36 C37	Q35-R39 WeakPolarHBondContact O-CB 3.44Å; Q35-R39 PolarHBondContact O-N 3.14Å; I36-R39 PolarHBondContact O-N 2.99Å; I36-R39 VanDerWaalsContact O-N 3.11Å; C37-R39 PolarHBondContact O-N 2.89Å
40	T	56.2	Low	54.6	Low	81 Å²	81	97.9 Å²	97.9	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-108.5	-6.1	-174.8	59.7	0	0	0	0	114.3	I36 F42	I36-T40 PolarHBondContact O-N 2.93Å; I36-T40 PolarHBondContact O-OG1 3.05Å; I36-T40 VanDerWaalsContact O-OG1 3.09Å; T40-F42 VanDerWaalsContact O-CD2 3.32Å; T40-F42 WeakPolarHBondContact O-CD2 3.4Å; T40-F42 PolarHBondContact O-N 2.68Å; T40-F42 VanDerWaalsContact O-N 3.1Å
41	G	46.3	Very low	53.8	Low	74 Å²	74	101.5 Å²	101.5	76%	0.763	53%	0.533	S	S	*	.			trans	64	16.9	171.5	0	0	0	0	0	114.7	C37	C37-G41 PolarHBondContact O-N 2.82Å; C37-G41 VanDerWaalsContact O-N 3.14Å
42	F	43.8	Very low	53.2	Low	160 Å²	160	102.4 Å²	102.4	70%	0.702	54%	0.538	S	S	*	.			trans	-100.6	139.7	179.8	-93.1	-87.6	0	0	0	111.6	T40 V44	T40-F42 VanDerWaalsContact O-CD2 3.32Å; T40-F42 WeakPolarHBondContact O-CD2 3.4Å; T40-F42 PolarHBondContact O-N 2.68Å; T40-F42 VanDerWaalsContact O-N 3.1Å; F42-V44 VanDerWaalsContact C-N 3.3Å; F42-V44 HydrophobicContact CB-CG2 3.86Å; F42-V44 WeakPolarHBondContact O-CG2 3.4Å; F42-V44 PolarHBondContact O-N 2.87Å
43	D	44.4	Very low	53.1	Low	142 Å²	142	105 Å²	105	76%	0.759	54%	0.543	S	S	*	.			trans	-72.3	79.4	175.6	-164.2	0.3	0	0	0	110.1
44	V	44.5	Very low	53	Low	35 Å²	35	106.4 Å²	106.4	21%	0.212	56%	0.559	C	S	.	*			trans	-99.8	31.8	-176.8	-157.1	0	0	0	0	112	F33 F42 L46 N47	F33-V44 HydrophobicContact CE1-CB 4.03Å; F33-V44 HydrophobicContact CE1-CG1 3.64Å; F33-V44 HydrophobicContact CZ-CG1 3.81Å; F42-V44 VanDerWaalsContact C-N 3.3Å; F42-V44 HydrophobicContact CB-CG2 3.86Å; F42-V44 WeakPolarHBondContact O-CG2 3.4Å; F42-V44 PolarHBondContact O-N 2.87Å; V44-L46 PolarHBondContact O-N 3.03Å; V44-N47 HydrophobicContact CG1-CB 3.89Å; V44-N47 WeakPolarHBondContact CG1-ND2 3.38Å
45	M	48	Very low	53	Low	152 Å²	152	108.8 Å²	108.8	75%	0.749	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-25.3	166.3	-105.1	-117.4	87.9	0	0	111.7	N47	M45-N47 PolarHBondContact O-N 2.95Å
46	L	45.6	Very low	52.8	Low	111 Å²	111	107.8 Å²	107.8	58%	0.581	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-17.8	-173.5	-83.1	159.9	0	0	0	115	V44 Y50	V44-L46 PolarHBondContact O-N 3.03Å; L46-Y50 WeakPolarHBondContact O-CD2 3.43Å; L46-Y50 WeakPolarHBondContact O-CE2 3.28Å
47	N	49.7	Very low	53.1	Low	93 Å²	93	107.2 Å²	107.2	50%	0.497	56%	0.561	S	S	.	*	H	α-helix	trans	-91.2	-17.7	-170.7	-75.3	-37.6	0	0	0	116	V44 M45	V44-N47 HydrophobicContact CG1-CB 3.89Å; V44-N47 WeakPolarHBondContact CG1-ND2 3.38Å; M45-N47 PolarHBondContact O-N 2.95Å
48	L	49.1	Very low	53.8	Low	58 Å²	58	115 Å²	115	30%	0.304	59%	0.585	S	S	.	*	H	α-helix	trans	-77.4	-32.2	-176.7	-129.6	89.2	0	0	0	112.8	F33 Y50	F33-L48 HydrophobicContact CD1-CD1 4.31Å; F33-L48 HydrophobicContact CE1-CD1 4.39Å; F33-L48 HydrophobicContact CG-CD1 4.38Å; L48-Y50 VanDerWaalsContact C-N 3.32Å; L48-Y50 PolarHBondContact O-N 3.15Å
49	E	49.4	Very low	53.9	Low	132 Å²	132	113.9 Å²	113.9	62%	0.617	57%	0.574	S	S	*	*	H	α-helix	trans	-66.9	-31.9	176.5	-72.3	-174	162.3	0	0	112.2	L52 F53	E49-L52 PolarHBondContact O-N 2.9Å; E49-F53 WeakPolarHBondContact O-CD2 3.24Å; E49-F53 PolarHBondContact O-N 3.48Å
50	Y	48.5	Very low	54.3	Low	64 Å²	64	108.4 Å²	108.4	25%	0.251	55%	0.554	S	S	.	*	H	α-helix	trans	-75.3	-28.3	-178.6	-68.5	-70.4	0	0	0	114.4	L46 L48 L57 Y60	L46-Y50 WeakPolarHBondContact O-CD2 3.43Å; L46-Y50 WeakPolarHBondContact O-CE2 3.28Å; L48-Y50 VanDerWaalsContact C-N 3.32Å; L48-Y50 PolarHBondContact O-N 3.15Å; Y50-L57 HydrophobicContact CD1-CB 4.1Å; Y50-L57 HydrophobicContact CD1-CD1 4.07Å; Y50-Y60 HydrophobicContact CE1-CG 4.49Å
51	L	54.2	Low	55.1	Low	150 Å²	150	108.8 Å²	108.8	79%	0.785	55%	0.553	S	S	*	*	H	α-helix	trans	-75.4	-28.6	175.7	-93.9	157.2	0	0	0	112.4
52	L	56.6	Low	56	Low	107 Å²	107	110.1 Å²	110.1	56%	0.56	54%	0.536	S	S	*	.	H	α-helix	trans	-85.2	-20.4	-178.8	-68	171.1	0	0	0	113.2	E49	E49-L52 PolarHBondContact O-N 2.9Å
53	F	65.1	Low	57	Low	124 Å²	124	111.1 Å²	111.1	54%	0.544	54%	0.535	S	S	.	.			trans	-135.6	83.7	-176.6	-59	-77.6	0	0	0	111.7	E49 D55 M56 L57	E49-F53 WeakPolarHBondContact O-CD2 3.24Å; E49-F53 PolarHBondContact O-N 3.48Å; F53-D55 PolarHBondContact O-N 3.22Å; F53-D55 VanDerWaalsContact O-N 3.07Å; F53-M56 HydrophobicContact CB-CB 4.16Å; F53-M56 HydrophobicContact CB-CG 4.07Å; F53-M56 WeakPolarHBondContact O-CB 3.41Å; F53-M56 PolarHBondContact O-N 3.34Å; F53-L57 PolarHBondContact O-N 3.43Å
54	P	57	Low	58	Low	93 Å²	93	107.5 Å²	107.5	60%	0.604	52%	0.515	S	S	*	.	H	α-helix	trans	-55.9	-26.9	178.6	18.5	-30.1	0	0	0	113.6	M56 L57 R58	P54-M56 VanDerWaalsContact C-N 3.35Å; P54-M56 PolarHBondContact O-N 3.13Å; P54-L57 PolarHBondContact O-N 3.43Å; P54-R58 WeakPolarHBondContact O-CB 2.93Å; P54-R58 PolarHBondContact O-N 3.15Å
55	D	60.8	Low	59.1	Low	120 Å²	120	112 Å²	112	64%	0.642	53%	0.533	S	S	*	.	H	α-helix	trans	-65.1	-35.2	175	-67	-35.4	0	0	0	112.9	F53 R58 L59	F53-D55 PolarHBondContact O-N 3.22Å; F53-D55 VanDerWaalsContact O-N 3.07Å; D55-R58 PolarHBondContact O-N 3.06Å; D55-L59 VanDerWaalsContact O-CG 3.29Å; D55-L59 WeakPolarHBondContact O-CG 3.41Å; D55-L59 PolarHBondContact O-N 2.88Å
56	M	61.1	Low	59.5	Low	107 Å²	107	106.1 Å²	106.1	53%	0.527	51%	0.507	S	S	.	.	H	α-helix	trans	-70.5	-39.8	177.4	-77.7	-66	-71.2	0	0	111.7	F53 P54 R58 L59 Y60	F53-M56 HydrophobicContact CB-CB 4.16Å; F53-M56 HydrophobicContact CB-CG 4.07Å; F53-M56 WeakPolarHBondContact O-CB 3.41Å; F53-M56 PolarHBondContact O-N 3.34Å; P54-M56 VanDerWaalsContact C-N 3.35Å; P54-M56 PolarHBondContact O-N 3.13Å; M56-R58 VanDerWaalsContact C-N 3.31Å; M56-R58 PolarHBondContact O-N 2.98Å; M56-L59 PolarHBondContact O-N 3.09Å; M56-L59 HydrophobicContact SD-CD1 4.34Å; M56-Y60 WeakPolarHBondContact O-CB 3.31Å; M56-Y60 PolarHBondContact O-N 3.2Å
57	L	66.4	Low	60	Low	74 Å²	74	103.5 Å²	103.5	39%	0.387	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-41.9	173.1	-177.3	63.1	0	0	0	110.8	Y50 F53 P54 Y60 L61	Y50-L57 HydrophobicContact CD1-CB 4.1Å; Y50-L57 HydrophobicContact CD1-CD1 4.07Å; F53-L57 PolarHBondContact O-N 3.43Å; P54-L57 PolarHBondContact O-N 3.43Å; L57-Y60 PolarHBondContact O-N 3.18Å; L57-L61 HydrophobicContact CD1-CD1 4.41Å; L57-L61 HydrophobicContact CD1-CG 4.32Å; L57-L61 HydrophobicContact CG-CD1 4.14Å; L57-L61 HydrophobicContact CG-CG 4.45Å; L57-L61 WeakPolarHBondContact O-CB 3.14Å; L57-L61 WeakPolarHBondContact O-CG 3.29Å; L57-L61 PolarHBondContact O-N 3.13Å
58	R	66.2	Low	60.5	Low	199 Å²	199	106.4 Å²	106.4	75%	0.751	50%	0.504	S	S	*	.	H	α-helix	trans	-62.3	-43.3	176.8	-156.3	177	-169	-125.9	0.2	111.9	P54 D55 M56 Y62	P54-R58 WeakPolarHBondContact O-CB 2.93Å; P54-R58 PolarHBondContact O-N 3.15Å; D55-R58 PolarHBondContact O-N 3.06Å; M56-R58 VanDerWaalsContact C-N 3.31Å; M56-R58 PolarHBondContact O-N 2.98Å; R58-Y62 VanDerWaalsContact O-CB 3.26Å; R58-Y62 WeakPolarHBondContact O-CB 3.49Å; R58-Y62 PolarHBondContact O-N 3.11Å
59	L	60.9	Low	60.9	Low	91 Å²	91	105.3 Å²	105.3	48%	0.476	50%	0.502	S	S	.	.	H	α-helix	trans	-65.7	-37.3	175.4	-72.4	170.7	0	0	0	112.6	D55 M56 R63	D55-L59 VanDerWaalsContact O-CG 3.29Å; D55-L59 WeakPolarHBondContact O-CG 3.41Å; D55-L59 PolarHBondContact O-N 2.88Å; M56-L59 PolarHBondContact O-N 3.09Å; M56-L59 HydrophobicContact SD-CD1 4.34Å; L59-R63 WeakPolarHBondContact O-CB 3.38Å; L59-R63 PolarHBondContact O-N 2.87Å
60	Y	66.6	Low	61.2	Low	109 Å²	109	103.1 Å²	103.1	43%	0.427	49%	0.491	S	S	.	.	H	α-helix	trans	-69.4	-47.2	177.4	179.2	-103.9	0	0	0	112.1	Y50 M56 L57 Y62 R63 L64	Y50-Y60 HydrophobicContact CE1-CG 4.49Å; M56-Y60 WeakPolarHBondContact O-CB 3.31Å; M56-Y60 PolarHBondContact O-N 3.2Å; L57-Y60 PolarHBondContact O-N 3.18Å; Y60-Y62 VanDerWaalsContact C-N 3.29Å; Y60-Y62 PolarHBondContact O-N 3.41Å; Y60-R63 WeakPolarHBondContact O-CB 3.18Å; Y60-R63 PolarHBondContact O-N 3.11Å; Y60-R63 VanDerWaalsContact O-N 3.11Å; Y60-L64 HydrophobicContact CD1-CD1 3.88Å; Y60-L64 HydrophobicContact CD1-CG 4.41Å; Y60-L64 HydrophobicContact CE1-CD1 3.29Å; Y60-L64 HydrophobicContact CE1-CG 3.98Å; Y60-L64 HydrophobicContact CE2-CG 4.44Å; Y60-L64 PolarHBondContact O-N 3.45Å
61	L	72.5	Confident	61.5	Low	89 Å²	89	109.8 Å²	109.8	47%	0.466	52%	0.516	S	S	.	.	H	α-helix	trans	-59.6	-42.2	174.4	-69.8	175.5	0	0	0	111	L57 R63 L64 E65	L57-L61 HydrophobicContact CD1-CD1 4.41Å; L57-L61 HydrophobicContact CD1-CG 4.32Å; L57-L61 HydrophobicContact CG-CD1 4.14Å; L57-L61 HydrophobicContact CG-CG 4.45Å; L57-L61 WeakPolarHBondContact O-CB 3.14Å; L57-L61 WeakPolarHBondContact O-CG 3.29Å; L57-L61 PolarHBondContact O-N 3.13Å; L61-R63 VanDerWaalsContact C-N 3.34Å; L61-R63 PolarHBondContact O-N 2.92Å; L61-L64 PolarHBondContact O-N 2.81Å; L61-E65 PolarHBondContact O-N 3.29Å
62	Y	66.3	Low	61.6	Low	103 Å²	103	105.6 Å²	105.6	40%	0.404	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-42.3	173.6	-174.5	-102.1	0	0	0	112.2	R58 Y60 E65 C66 A136	R58-Y62 VanDerWaalsContact O-CB 3.26Å; R58-Y62 WeakPolarHBondContact O-CB 3.49Å; R58-Y62 PolarHBondContact O-N 3.11Å; Y60-Y62 VanDerWaalsContact C-N 3.29Å; Y60-Y62 PolarHBondContact O-N 3.41Å; Y62-E65 PolarHBondContact O-N 2.88Å; Y62-C66 WeakPolarHBondContact O-CB 3.29Å; Y62-C66 PolarHBondContact O-N 3.48Å; Y62-C66 PolarHBondContact O-SG 3.27Å; Y62-A136 WeakPolarHBondContact OH-CB 3.32Å
63	R	64.2	Low	61.5	Low	181 Å²	181	102.1 Å²	102.1	68%	0.683	48%	0.482	S	S	*	.	H	α-helix	trans	-65	-38.5	175.9	-169.4	-177.1	-67.7	-124.3	2.2	112.1	L59 Y60 L61 C66 T67	L59-R63 WeakPolarHBondContact O-CB 3.38Å; L59-R63 PolarHBondContact O-N 2.87Å; Y60-R63 WeakPolarHBondContact O-CB 3.18Å; Y60-R63 PolarHBondContact O-N 3.11Å; Y60-R63 VanDerWaalsContact O-N 3.11Å; L61-R63 VanDerWaalsContact C-N 3.34Å; L61-R63 PolarHBondContact O-N 2.92Å; R63-C66 PolarHBondContact O-N 3.33Å; R63-T67 WeakPolarHBondContact O-CB 3.28Å; R63-T67 PolarHBondContact O-N 3.31Å; R63-T67 PolarHBondContact O-OG1 3.15Å
64	L	65.5	Low	61.1	Low	66 Å²	66	98 Å²	98	35%	0.346	48%	0.476	S	S	.	.	H	α-helix	trans	-65.6	-43.2	174.9	-75.8	176.6	0	0	0	111.8	Y60 L61 T67 K68	Y60-L64 HydrophobicContact CD1-CD1 3.88Å; Y60-L64 HydrophobicContact CD1-CG 4.41Å; Y60-L64 HydrophobicContact CE1-CD1 3.29Å; Y60-L64 HydrophobicContact CE1-CG 3.98Å; Y60-L64 HydrophobicContact CE2-CG 4.44Å; Y60-L64 PolarHBondContact O-N 3.45Å; L61-L64 PolarHBondContact O-N 2.81Å; L64-T67 PolarHBondContact O-N 3.01Å; L64-K68 WeakPolarHBondContact O-CG 3.35Å; L64-K68 PolarHBondContact O-N 3.35Å
65	E	67.1	Low	61	Low	128 Å²	128	97.4 Å²	97.4	60%	0.598	47%	0.474	S	S	*	.	H	α-helix	trans	-62.4	-43.1	174.1	-76.1	176.3	175.1	0	0	111.7	L61 Y62 T67 K68 S69	L61-E65 PolarHBondContact O-N 3.29Å; Y62-E65 PolarHBondContact O-N 2.88Å; E65-T67 VanDerWaalsContact C-N 3.34Å; E65-T67 PolarHBondContact O-N 3.34Å; E65-K68 PolarHBondContact O-N 3Å; E65-S69 WeakPolarHBondContact O-CB 3.13Å; E65-S69 PolarHBondContact O-N 3.17Å
66	C	56	Low	60.6	Low	30 Å²	30	93.1 Å²	93.1	20%	0.203	46%	0.458	C	S	.	.	H	α-helix	trans	-59.6	-43.6	173.5	-70.1	0	0	0	0	111.9	Y62 R63 S69 Q70	Y62-C66 WeakPolarHBondContact O-CB 3.29Å; Y62-C66 PolarHBondContact O-N 3.48Å; Y62-C66 PolarHBondContact O-SG 3.27Å; R63-C66 PolarHBondContact O-N 3.33Å; C66-S69 WeakPolarHBondContact O-CB 3.44Å; C66-S69 PolarHBondContact O-N 2.99Å; C66-Q70 WeakPolarHBondContact O-CG 3.41Å; C66-Q70 PolarHBondContact O-N 2.92Å
67	T	57.3	Low	60.3	Low	56 Å²	56	89.6 Å²	89.6	34%	0.344	44%	0.441	S	S	.	.	H	α-helix	trans	-68.2	-38.6	-179.6	-50.4	0	0	0	0	111.5	R63 L64 E65 Q70 R71	R63-T67 WeakPolarHBondContact O-CB 3.28Å; R63-T67 PolarHBondContact O-N 3.31Å; R63-T67 PolarHBondContact O-OG1 3.15Å; L64-T67 PolarHBondContact O-N 3.01Å; E65-T67 VanDerWaalsContact C-N 3.34Å; E65-T67 PolarHBondContact O-N 3.34Å; T67-Q70 PolarHBondContact O-N 2.88Å; T67-R71 PolarHBondContact O-N 3Å
68	K	59.9	Low	59.6	Low	153 Å²	153	96 Å²	96	67%	0.665	46%	0.46	S	S	*	.	H	α-helix	trans	-64	-44	172.7	-74.7	177.2	-179.2	177.6	0	111.3	L64 E65 R71 A72	L64-K68 WeakPolarHBondContact O-CG 3.35Å; L64-K68 PolarHBondContact O-N 3.35Å; E65-K68 PolarHBondContact O-N 3Å; K68-R71 PolarHBondContact O-N 3.27Å; K68-A72 WeakPolarHBondContact O-CB 3.27Å; K68-A72 PolarHBondContact O-N 2.96Å
69	S	57	Low	59	Low	36 Å²	36	94 Å²	94	25%	0.252	46%	0.457	S	S	.	.	H	α-helix	trans	-58.7	-47.4	174.6	-176.5	0	0	0	0	111.1	E65 C66 R71 A72 Y73	E65-S69 WeakPolarHBondContact O-CB 3.13Å; E65-S69 PolarHBondContact O-N 3.17Å; C66-S69 WeakPolarHBondContact O-CB 3.44Å; C66-S69 PolarHBondContact O-N 2.99Å; S69-R71 PolarHBondContact O-N 2.93Å; S69-A72 PolarHBondContact O-N 3.09Å; S69-Y73 VanDerWaalsContact O-CB 3.23Å; S69-Y73 WeakPolarHBondContact O-CB 3.41Å; S69-Y73 PolarHBondContact O-N 3.21Å
70	Q	56.8	Low	58.9	Low	85 Å²	85	90.9 Å²	90.9	40%	0.397	44%	0.441	S	S	.	.	H	α-helix	trans	-61	-42.6	176.6	-74.7	178.7	-19.6	0	0	113.4	C66 T67 Y73 G74 T134	C66-Q70 WeakPolarHBondContact O-CG 3.41Å; C66-Q70 PolarHBondContact O-N 2.92Å; T67-Q70 PolarHBondContact O-N 2.88Å; Q70-Y73 PolarHBondContact O-N 2.87Å; Q70-G74 PolarHBondContact O-N 2.9Å; Q70-T134 PolarHBondContact NE2-O 2.84Å
71	R	54.2	Low	58.3	Low	205 Å²	205	85.9 Å²	85.9	77%	0.774	42%	0.423	S	S	*	.	H	α-helix	trans	-66.9	-42.2	176.3	-79.2	-177	178.5	169.6	0.4	112.6	T67 K68 S69 Y73 G74 S75	T67-R71 PolarHBondContact O-N 3Å; K68-R71 PolarHBondContact O-N 3.27Å; S69-R71 PolarHBondContact O-N 2.93Å; R71-Y73 VanDerWaalsContact C-N 3.28Å; R71-G74 PolarHBondContact O-N 2.63Å; R71-S75 PolarHBondContact O-N 3.14Å
72	A	55.5	Low	57.3	Low	62 Å²	62	85 Å²	85	51%	0.512	42%	0.424	S	S	.	.	H	α-helix	trans	-65.6	-34.2	175	0	0	0	0	0	111.8	K68 S69 S75 G76	K68-A72 WeakPolarHBondContact O-CB 3.27Å; K68-A72 PolarHBondContact O-N 2.96Å; S69-A72 PolarHBondContact O-N 3.09Å; A72-S75 PolarHBondContact O-OG 2.83Å; A72-G76 PolarHBondContact O-N 3.06Å; A72-G76 VanDerWaalsContact O-N 3.15Å
73	Y	55.9	Low	56.7	Low	33 Å²	33	89.2 Å²	89.2	13%	0.129	44%	0.439	C	S	.	.	H	α-helix	trans	-66.8	-44.8	176.5	-164.1	-101.8	0	0	0	112.4	S69 Q70 R71 S75 G76 L77 H149 V150 L151	S69-Y73 VanDerWaalsContact O-CB 3.23Å; S69-Y73 WeakPolarHBondContact O-CB 3.41Å; S69-Y73 PolarHBondContact O-N 3.21Å; Q70-Y73 PolarHBondContact O-N 2.87Å; R71-Y73 VanDerWaalsContact C-N 3.28Å; Y73-S75 VanDerWaalsContact C-N 3.29Å; Y73-S75 PolarHBondContact O-N 3.4Å; Y73-G76 WeakPolarHBondContact O-CA 3.39Å; Y73-G76 PolarHBondContact O-N 3.2Å; Y73-L77 HydrophobicContact CD1-CD1 3.98Å; Y73-L77 HydrophobicContact CD1-CD2 4.46Å; Y73-L77 HydrophobicContact CD1-CG 4.04Å; Y73-L77 HydrophobicContact CE1-CD1 3.83Å; Y73-L77 HydrophobicContact CE1-CD2 3.71Å; Y73-L77 HydrophobicContact CE1-CG 3.78Å; Y73-L77 PolarHBondContact O-N 3.5Å; Y73-H149 AromaticContact CE2-CD2 3.83Å; Y73-H149 AromaticContact CE2-NE2 3.64Å; Y73-H149 PolarHBondContact OH-CD2 2.82Å; Y73-H149 VanDerWaalsContact OH-CD2 3.23Å; Y73-V150 VanDerWaalsContact OH-CA 3.31Å; Y73-V150 WeakPolarHBondContact OH-CA 3.49Å; Y73-L151 HydrophobicContact CE1-CB 3.58Å; Y73-L151 VanDerWaalsContact CZ-CB 3.5Å; Y73-L151 WeakPolarHBondContact OH-CA 3.22Å; Y73-L151 WeakPolarHBondContact OH-CB 3.49Å; Y73-L151 PolarHBondContact OH-N 2.89Å
74	G	55.1	Low	56.3	Low	39 Å²	39	81.9 Å²	81.9	40%	0.402	41%	0.413	S	S	.	.	H	α-helix	trans	-59.1	-35.4	177.8	0	0	0	0	0	114	Q70 R71	Q70-G74 PolarHBondContact O-N 2.9Å; R71-G74 PolarHBondContact O-N 2.63Å
75	S	55.7	Low	55.6	Low	80 Å²	80	85.8 Å²	85.8	56%	0.559	43%	0.43	S	S	*	.	H	α-helix	trans	-74.6	-34.1	173.1	72.2	0	0	0	0	112.3	R71 A72 Y73	R71-S75 PolarHBondContact O-N 3.14Å; A72-S75 PolarHBondContact O-OG 2.83Å; Y73-S75 VanDerWaalsContact C-N 3.29Å; Y73-S75 PolarHBondContact O-N 3.4Å
76	G	52.2	Low	54.6	Low	30 Å²	30	84.2 Å²	84.2	31%	0.309	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-41.4	173.1	0	0	0	0	0	113.6	A72 Y73 R78 K79 V80	A72-G76 PolarHBondContact O-N 3.06Å; A72-G76 VanDerWaalsContact O-N 3.15Å; Y73-G76 WeakPolarHBondContact O-CA 3.39Å; Y73-G76 PolarHBondContact O-N 3.2Å; G76-R78 VanDerWaalsContact C-N 3.34Å; G76-R78 PolarHBondContact O-N 3.15Å; G76-K79 WeakPolarHBondContact O-CA 3.47Å; G76-K79 WeakPolarHBondContact O-CB 3.02Å; G76-K79 PolarHBondContact O-N 2.87Å; G76-V80 PolarHBondContact O-N 3.18Å
77	L	54.3	Low	54.1	Low	32 Å²	32	86 Å²	86	17%	0.168	45%	0.446	C	S	.	.	H	α-helix	trans	-58.4	-40.7	179.6	-72	176.1	0	0	0	113.2	Y73 K79 G81 V150	Y73-L77 HydrophobicContact CD1-CD1 3.98Å; Y73-L77 HydrophobicContact CD1-CD2 4.46Å; Y73-L77 HydrophobicContact CD1-CG 4.04Å; Y73-L77 HydrophobicContact CE1-CD1 3.83Å; Y73-L77 HydrophobicContact CE1-CD2 3.71Å; Y73-L77 HydrophobicContact CE1-CG 3.78Å; Y73-L77 PolarHBondContact O-N 3.5Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.09Å; L77-G81 PolarHBondContact O-N 2.95Å; L77-V150 HydrophobicContact CD2-CB 4.06Å; L77-V150 HydrophobicContact CD2-CG1 3.76Å; L77-V150 HydrophobicContact CD2-CG2 3.92Å
78	R	53.3	Low	53.4	Low	210 Å²	210	86.6 Å²	86.6	79%	0.792	46%	0.463	S	S	*	.	H	α-helix	trans	-66.2	-32.4	175.2	-69.5	-178.2	72.2	175.4	2.1	112.1	G76 S82	G76-R78 VanDerWaalsContact C-N 3.34Å; G76-R78 PolarHBondContact O-N 3.15Å; R78-S82 PolarHBondContact O-N 3.41Å
79	K	53.6	Low	53.2	Low	157 Å²	157	88.1 Å²	88.1	68%	0.683	48%	0.479	S	S	*	.	H	α-helix	trans	-77.1	-33.7	-178.6	-156.6	174.4	-175.4	178.6	0	112.6	G76 L77 S82 R83	G76-K79 WeakPolarHBondContact O-CA 3.47Å; G76-K79 WeakPolarHBondContact O-CB 3.02Å; G76-K79 PolarHBondContact O-N 2.87Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.09Å; K79-S82 PolarHBondContact O-N 2.96Å; K79-S82 PolarHBondContact O-OG 2.76Å; K79-R83 PolarHBondContact O-N 2.81Å
80	V	58.3	Low	54.1	Low	24 Å²	24	88.9 Å²	88.9	15%	0.145	48%	0.484	C	S	.	.	H	α-helix	trans	-61.1	-48.4	170.4	169.8	0	0	0	0	110.1	G76 S82 R83 L84 L124 E148 V150	G76-V80 PolarHBondContact O-N 3.18Å; V80-S82 VanDerWaalsContact C-N 3.27Å; V80-S82 PolarHBondContact O-N 3.42Å; V80-R83 PolarHBondContact O-N 2.74Å; V80-L84 HydrophobicContact CG1-CD1 4.42Å; V80-L84 PolarHBondContact O-N 2.69Å; V80-L124 HydrophobicContact CG1-CD1 3.79Å; V80-E148 HydrophobicContact CG1-CG 4.4Å; V80-V150 HydrophobicContact CG1-CG2 4.41Å
81	G	54.1	Low	55.6	Low	5 Å²	5	88.9 Å²	88.9	5%	0.052	49%	0.485	C	S	.	.	H	α-helix	trans	-56.7	-36.2	177.6	0	0	0	0	0	114.2	L77	L77-G81 PolarHBondContact O-N 2.95Å
82	S	52	Low	57.5	Low	70 Å²	70	81.3 Å²	81.3	49%	0.49	46%	0.463	S	S	.	.	H	α-helix	trans	-75.6	-28.6	177.3	63.5	0	0	0	0	113.9	R78 K79 V80	R78-S82 PolarHBondContact O-N 3.41Å; K79-S82 PolarHBondContact O-N 2.96Å; K79-S82 PolarHBondContact O-OG 2.76Å; V80-S82 VanDerWaalsContact C-N 3.27Å; V80-S82 PolarHBondContact O-N 3.42Å
83	R	53.3	Low	59.5	Low	192 Å²	192	78.8 Å²	78.8	73%	0.725	44%	0.441	S	S	*	.	H	α-helix	trans	-76.1	-28.4	-177.3	-140.9	-179.3	-162	-173.3	2.8	112.4	K79 V80 Q85	K79-R83 PolarHBondContact O-N 2.81Å; V80-R83 PolarHBondContact O-N 2.74Å; R83-Q85 PolarHBondContact O-N 3.07Å
84	L	55.3	Low	61.5	Low	26 Å²	26	77.2 Å²	77.2	14%	0.136	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-9.7	176.3	-67.9	168.6	0	0	0	113.9	V80 T93 Y95 L124 L191	V80-L84 HydrophobicContact CG1-CD1 4.42Å; V80-L84 PolarHBondContact O-N 2.69Å; L84-T93 HydrophobicContact CD2-CG2 4.39Å; L84-Y95 HydrophobicContact CD1-CE1 4.3Å; L84-L124 HydrophobicContact CD1-CD2 3.97Å; L84-L191 HydrophobicContact CD1-CD2 3.91Å
85	Q	51.2	Low	63.6	Low	148 Å²	148	75.5 Å²	75.5	69%	0.692	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-8.4	-174.6	-62.4	-177.1	14.4	0	0	114.2	R83	R83-Q85 PolarHBondContact O-N 3.07Å
86	S	44.8	Very low	65.7	Low	96 Å²	96	71.7 Å²	71.7	67%	0.671	39%	0.389	S	S	*	.			trans	-118.7	19.4	-162.9	75	0	0	0	0	117.6	G88	S86-G88 PolarHBondContact O-N 3.35Å
87	S	46.3	Very low	67.9	Low	67 Å²	67	70.2 Å²	70.2	47%	0.469	38%	0.375	S	S	.	.			trans	-97.2	90.4	-177.4	64.7	0	0	0	0	112.6	S90	S87-S90 WeakPolarHBondContact CB-OG 3.42Å; S87-S90 PolarHBondContact O-OG 3.45Å; S87-S90 PolarHBondContact OG-OG 2.89Å
88	G	43.1	Very low	70	Confident	69 Å²	69	68.7 Å²	68.7	71%	0.711	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	140.4	165.8	0	0	0	0	0	111.9	S86 S90	S86-G88 PolarHBondContact O-N 3.35Å; G88-S90 WeakPolarHBondContact O-CB 3.25Å; G88-S90 PolarHBondContact O-N 3.1Å
89	D	55.5	Low	72.2	Confident	184 Å²	184	59.4 Å²	59.4	98%	0.984	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.9	28.9	174.7	-144.4	21.6	0	0	0	117.9
90	S	76.5	Confident	74.2	Confident	53 Å²	53	52.1 Å²	52.1	37%	0.371	30%	0.302	S	S	.	.			trans	-100.6	146.3	-159.5	58.8	0	0	0	0	114.2	S87 G88	S87-S90 WeakPolarHBondContact CB-OG 3.42Å; S87-S90 PolarHBondContact O-OG 3.45Å; S87-S90 PolarHBondContact OG-OG 2.89Å; G88-S90 WeakPolarHBondContact O-CB 3.25Å; G88-S90 PolarHBondContact O-N 3.1Å
91	M	88.5	Confident	76	Confident	84 Å²	84	55.1 Å²	55.1	41%	0.414	31%	0.312	S	S	.	.			trans	-38.8	129.6	167.7	178.1	-178.2	-78.9	0	0	110.8	P121 N122 R217	M91-P121 HydrophobicContact CE-CG 4.4Å; M91-P121 HydrophobicContact SD-CB 4.3Å; M91-P121 HydrophobicContact SD-CG 3.95Å; M91-N122 PolarHBondContact O-ND2 3.36Å; M91-N122 HydrophobicContact SD-CB 4.4Å; M91-R217 PolarHBondContact SD-NH1 3.4Å
92	P	93.7	Very high	77.9	Confident	47 Å²	47	63.3 Å²	63.3	31%	0.305	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-61.1	138.4	-179.3	-24.8	34.5	0	0	0	113.1	R217	P92-R217 PolarHBondContact O-NH1 3.22Å
93	T	97.2	Very high	79.8	Confident	9 Å²	9	61.9 Å²	61.9	6%	0.055	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	136.1	175.6	-56.8	0	0	0	0	110.7	L84 Y95 N122 L124 G197 V198	L84-T93 HydrophobicContact CD2-CG2 4.39Å; T93-Y95 HydrophobicContact CG2-CD1 4.33Å; T93-Y95 HydrophobicContact CG2-CE1 3.93Å; T93-Y95 HydrophobicContact CG2-CE2 4.31Å; T93-N122 WeakPolarHBondContact CA-ND2 3.41Å; T93-N122 VanDerWaalsContact CA-O 3.32Å; T93-N122 WeakPolarHBondContact CA-O 3.33Å; T93-N122 PolarHBondContact N-ND2 2.89Å; T93-N122 VanDerWaalsContact OG1-CG 3.29Å; T93-N122 PolarHBondContact OG1-ND2 3.12Å; T93-N122 PolarHBondContact OG1-OD1 3.46Å; T93-L124 HydrophobicContact CG2-CB 4.31Å; T93-G197 CarbonylContact O-C 3.53Å; T93-G197 WeakPolarHBondContact O-CA 3.22Å; T93-V198 PolarHBondContact O-N 3.21Å
94	I	98.6	Very high	81.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.1	170.5	-52.3	173.4	0	0	0	108.4	V96 V120 N122 I123 L124 V198 F213 M216 R217	I94-V96 HydrophobicContact CG2-CG2 3.64Å; I94-V96 PolarHBondContact O-N 3.28Å; I94-V120 HydrophobicContact CD1-CG1 4.06Å; I94-N122 PolarHBondContact N-O 2.79Å; I94-N122 VanDerWaalsContact N-O 3.08Å; I94-I123 HydrophobicContact CB-CG1 4.36Å; I94-I123 WeakPolarHBondContact O-CA 3.41Å; I94-I123 WeakPolarHBondContact O-CG1 3.4Å; I94-L124 PolarHBondContact O-N 2.94Å; I94-V198 CarbonylContact C-O 3.57Å; I94-V198 WeakPolarHBondContact CA-O 3.29Å; I94-F213 HydrophobicContact CD1-CB 3.97Å; I94-F213 HydrophobicContact CD1-CD1 4.4Å; I94-F213 VanDerWaalsContact CD1-O 3.22Å; I94-F213 WeakPolarHBondContact CD1-O 3.33Å; I94-M216 HydrophobicContact CD1-CG 4.07Å; I94-M216 HydrophobicContact CD1-SD 4.25Å; I94-M216 HydrophobicContact CG2-SD 3.77Å; I94-R217 HydrophobicContact CD1-CG 4.16Å
95	Y	98.7	Very high	83.5	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.008	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	98.8	173.9	-59.2	-77.7	0	0	0	108.7	L84 T93 L124 L187 L191 T195 V198 Y200 I269	L84-Y95 HydrophobicContact CD1-CE1 4.3Å; T93-Y95 HydrophobicContact CG2-CD1 4.33Å; T93-Y95 HydrophobicContact CG2-CE1 3.93Å; T93-Y95 HydrophobicContact CG2-CE2 4.31Å; Y95-L124 HydrophobicContact CD1-CB 3.95Å; Y95-L124 HydrophobicContact CD1-CD2 3.76Å; Y95-L124 HydrophobicContact CD1-CG 4.42Å; Y95-L124 HydrophobicContact CE1-CB 4.3Å; Y95-L124 HydrophobicContact CE1-CD2 3.9Å; Y95-L187 HydrophobicContact CD1-CD2 3.65Å; Y95-L187 HydrophobicContact CE1-CD2 4.28Å; Y95-L187 HydrophobicContact CG-CD2 3.85Å; Y95-L191 HydrophobicContact CD1-CD1 4.3Å; Y95-L191 HydrophobicContact CD2-CD1 4.42Å; Y95-L191 HydrophobicContact CE1-CD1 3.79Å; Y95-L191 HydrophobicContact CE1-CD2 3.88Å; Y95-L191 HydrophobicContact CE1-CG 4.46Å; Y95-L191 HydrophobicContact CE2-CD1 3.9Å; Y95-T195 HydrophobicContact CE2-CG2 4.3Å; Y95-T195 WeakPolarHBondContact OH-CG2 3.42Å; Y95-V198 PolarHBondContact N-O 3Å; Y95-Y200 PolarHBondContact O-N 3.43Å; Y95-I269 HydrophobicContact CD2-CB 4.29Å; Y95-I269 HydrophobicContact CD2-CD1 4.1Å; Y95-I269 HydrophobicContact CD2-CG1 4Å; Y95-I269 HydrophobicContact CE2-CB 4.34Å; Y95-I269 HydrophobicContact CE2-CG1 4.04Å; Y95-I269 HydrophobicContact CE2-CG2 4.37Å
96	V	98.8	Very high	85.6	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	115.2	-177.9	179.7	0	0	0	0	109.7	I94 L117 I123 L124 I126 Y200 A202 F213	I94-V96 HydrophobicContact CG2-CG2 3.64Å; I94-V96 PolarHBondContact O-N 3.28Å; V96-L117 HydrophobicContact CG1-CD1 4.38Å; V96-I123 HydrophobicContact CB-CD1 4.37Å; V96-I123 HydrophobicContact CG2-CD1 3.54Å; V96-I123 HydrophobicContact CG2-CG1 3.87Å; V96-L124 PolarHBondContact N-O 2.78Å; V96-I126 PolarHBondContact O-N 3.22Å; V96-Y200 CarbonylContact C-O 3.53Å; V96-Y200 WeakPolarHBondContact CA-O 3.41Å; V96-Y200 HydrophobicContact CG2-CD1 4.34Å; V96-A202 HydrophobicContact CG1-CB 3.56Å; V96-F213 HydrophobicContact CG2-CE1 4.42Å
97	V	98.9	Very high	88.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	119.9	177.8	176.1	0	0	0	0	109.6	I126 R180 A183 L187 L199 Y200 F201 A202	V97-I126 WeakPolarHBondContact CA-O 3.47Å; V97-I126 HydrophobicContact CG2-CB 4.35Å; V97-I126 HydrophobicContact CG2-CD1 4.38Å; V97-R180 HydrophobicContact CG1-CG 4.48Å; V97-A183 HydrophobicContact CB-CB 4.23Å; V97-A183 HydrophobicContact CG1-CB 3.46Å; V97-A183 VanDerWaalsContact CG1-CB 3.46Å; V97-A183 HydrophobicContact CG2-CB 3.68Å; V97-L187 HydrophobicContact CG2-CD1 4.43Å; V97-L199 HydrophobicContact CG2-CD1 3.64Å; V97-Y200 PolarHBondContact N-O 3.24Å; V97-F201 HydrophobicContact CB-CD1 3.72Å; V97-F201 HydrophobicContact CB-CE1 4Å; V97-F201 HydrophobicContact CG1-CD1 3.85Å; V97-F201 HydrophobicContact CG1-CE1 3.98Å; V97-F201 HydrophobicContact CG2-CD1 4.48Å; V97-F201 HydrophobicContact CG2-CE1 4.33Å; V97-A202 PolarHBondContact O-N 2.94Å
98	T	98.7	Very high	90.5	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	98.9	-178	-62.3	0	0	0	0	110.7	L110 L113 W125 I126 V127 V128 A202 D204	T98-L110 HydrophobicContact CG2-CD2 4.43Å; T98-L113 HydrophobicContact CG2-CD2 3.92Å; T98-W125 PolarHBondContact OG1-NE1 3.36Å; T98-I126 PolarHBondContact N-O 2.98Å; T98-V127 WeakPolarHBondContact O-CA 3.44Å; T98-V128 PolarHBondContact O-N 3.05Å; T98-A202 VanDerWaalsContact CA-O 3.31Å; T98-A202 WeakPolarHBondContact CA-O 3.42Å; T98-A202 WeakPolarHBondContact CB-O 3.33Å; T98-A202 WeakPolarHBondContact CG2-O 3.41Å; T98-A202 PolarHBondContact OG1-O 3.33Å; T98-D204 HydrophobicContact CG2-CB 3.63Å
99	P	98.3	Very high	93.1	Very high	15 Å²	15	45.9 Å²	45.9	10%	0.097	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	136.2	165.1	-21	34.8	0	0	0	110.4	V128 Q179 R180	P99-V128 WeakPolarHBondContact CA-O 3.22Å; P99-Q179 HydrophobicContact CB-CB 3.73Å; P99-Q179 HydrophobicContact CB-CG 4.22Å; P99-Q179 HydrophobicContact CG-CB 4.06Å; P99-R180 HydrophobicContact CG-CG 3.82Å
100	T	97.2	Very high	95.2	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.018	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	163.4	173.2	-168.5	0	0	0	0	110.3	Q106 L110 V127 V128 E129 D130 D204	T100-Q106 WeakPolarHBondContact OG1-CG 3.45Å; T100-Q106 PolarHBondContact OG1-NE2 3.08Å; T100-L110 HydrophobicContact CG2-CD1 4.36Å; T100-V127 HydrophobicContact CG2-CG1 3.69Å; T100-V128 PolarHBondContact N-O 2.99Å; T100-E129 HydrophobicContact CG2-CB 4.42Å; T100-E129 HydrophobicContact CG2-CG 3.75Å; T100-E129 CarbonylContact O-C 3.56Å; T100-E129 WeakPolarHBondContact O-CA 3.23Å; T100-D130 PolarHBondContact O-N 3.18Å; T100-D204 WeakPolarHBondContact CB-OD2 3.39Å; T100-D204 PolarHBondContact OG1-OD2 3.11Å
101	Y	95.1	Very high	96.2	Very high	88 Å²	88	36.1 Å²	36.1	35%	0.345	18%	0.179	S	C	.	.			trans	-150.4	155.6	179.6	67.2	-79.1	0	0	0	110.6	R103 Q106	Y101-R103 HydrophobicContact CD2-CB 4.34Å; Y101-R103 HydrophobicContact CE2-CB 3.94Å; Y101-R103 HydrophobicContact CE2-CG 4.28Å; Y101-R103 PolarHBondContact O-N 3.41Å; Y101-R103 PolarHBondContact O-NH1 2.94Å; Y101-R103 WeakPolarHBondContact OH-CD 3.29Å; Y101-Q106 VanDerWaalsContact O-CD 3.26Å; Y101-Q106 WeakPolarHBondContact O-CG 3.38Å; Y101-Q106 PolarHBondContact O-NE2 3.01Å
102	Q	93.4	Very high	96.7	Very high	177 Å²	177	35.9 Å²	35.9	83%	0.827	17%	0.174	S	C	*	.			trans	-61.5	119.3	179.7	-171.8	-179.8	-3	0	0	111.2
103	R	91.8	Very high	96.9	Very high	40 Å²	40	33.6 Å²	33.6	15%	0.151	16%	0.159	C	C	.	.	S	Bend	trans	-159.8	163.6	174.6	65.2	-174.7	-175.2	-93.7	15.5	109.7	Y101 T105 Q106 D109 D204	Y101-R103 HydrophobicContact CD2-CB 4.34Å; Y101-R103 HydrophobicContact CE2-CB 3.94Å; Y101-R103 HydrophobicContact CE2-CG 4.28Å; Y101-R103 PolarHBondContact O-N 3.41Å; Y101-R103 PolarHBondContact O-NH1 2.94Å; Y101-R103 WeakPolarHBondContact OH-CD 3.29Å; R103-T105 PolarHBondContact NE-OG1 2.75Å; R103-T105 VanDerWaalsContact NE-OG1 3.08Å; R103-T105 PolarHBondContact O-N 2.92Å; R103-T105 VanDerWaalsContact O-N 3.13Å; R103-Q106 HydrophobicContact CG-CB 3.91Å; R103-Q106 VanDerWaalsContact O-CB 3.28Å; R103-Q106 WeakPolarHBondContact O-CB 3.28Å; R103-Q106 PolarHBondContact O-N 2.73Å; R103-D109 IonicContact CZ-OD2 3.97Å; R103-D109 VanDerWaalsContact CZ-OD2 3.32Å; R103-D109 IonicContact NE-OD2 3.21Å; R103-D109 PolarHBondContact NE-OD2 2.89Å; R103-D109 VanDerWaalsContact NE-OD2 3.15Å; R103-D109 IonicContact NH2-OD2 3.05Å; R103-D109 PolarHBondContact NH2-OD2 2.83Å; R103-D204 IonicContact CZ-OD1 3.32Å; R103-D204 IonicContact CZ-OD2 2.94Å; R103-D204 IonicContact NH1-OD1 3.47Å; R103-D204 IonicContact NH1-OD2 3.46Å; R103-D204 PolarHBondContact NH1-OD2 2.83Å; R103-D204 IonicContact NH2-OD1 2.69Å; R103-D204 PolarHBondContact NH2-OD1 3.37Å; R103-D204 IonicContact NH2-OD2 3.11Å; R103-D204 PolarHBondContact NH2-OD2 2.86Å
104	Y	92.5	Very high	96.9	Very high	135 Å²	135	33.4 Å²	33.4	53%	0.529	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.3	179.5	-66.7	-55.3	0	0	0	114.7	L325 I344	Y104-L325 HydrophobicContact CD1-CD1 4.37Å; Y104-L325 HydrophobicContact CD2-CD1 3.76Å; Y104-L325 HydrophobicContact CE1-CD1 4.14Å; Y104-L325 HydrophobicContact CE2-CD1 3.49Å; Y104-L325 VanDerWaalsContact CE2-CD1 3.49Å; Y104-L325 HydrophobicContact CG-CD1 4.2Å; Y104-I344 WeakPolarHBondContact O-CG2 3.32Å
105	T	94.9	Very high	96.9	Very high	17 Å²	17	40.3 Å²	40.3	10%	0.104	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	1.8	-179.5	66.9	0	0	0	0	112.9	R103 K107 A108 D109 T320 P323	R103-T105 PolarHBondContact NE-OG1 2.75Å; R103-T105 VanDerWaalsContact NE-OG1 3.08Å; R103-T105 PolarHBondContact O-N 2.92Å; R103-T105 VanDerWaalsContact O-N 3.13Å; T105-K107 PolarHBondContact O-N 2.76Å; T105-A108 PolarHBondContact O-N 2.93Å; T105-A108 VanDerWaalsContact O-N 3.08Å; T105-D109 WeakPolarHBondContact CB-OD2 3.19Å; T105-D109 WeakPolarHBondContact O-CB 3.46Å; T105-D109 PolarHBondContact O-N 3.22Å; T105-D109 PolarHBondContact OG1-OD2 3.41Å; T105-T320 HydrophobicContact CG2-CG2 3.74Å; T105-P323 HydrophobicContact CG2-CG 3.82Å
106	Q	96.1	Very high	96.9	Very high	7 Å²	7	41.4 Å²	41.4	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-56.1	-49.6	-171	-170.6	-174.6	17.4	0	0	111.8	T100 Y101 R103 A108 D109 L110	T100-Q106 WeakPolarHBondContact OG1-CG 3.45Å; T100-Q106 PolarHBondContact OG1-NE2 3.08Å; Y101-Q106 VanDerWaalsContact O-CD 3.26Å; Y101-Q106 WeakPolarHBondContact O-CG 3.38Å; Y101-Q106 PolarHBondContact O-NE2 3.01Å; R103-Q106 HydrophobicContact CG-CB 3.91Å; R103-Q106 VanDerWaalsContact O-CB 3.28Å; R103-Q106 WeakPolarHBondContact O-CB 3.28Å; R103-Q106 PolarHBondContact O-N 2.73Å; Q106-A108 PolarHBondContact O-N 2.5Å; Q106-D109 PolarHBondContact O-N 3.08Å; Q106-L110 HydrophobicContact CG-CD1 4.08Å; Q106-L110 WeakPolarHBondContact O-CB 3.32Å; Q106-L110 WeakPolarHBondContact O-CG 3.46Å; Q106-L110 PolarHBondContact O-N 3.43Å
107	K	96.9	Very high	96.9	Very high	41 Å²	41	41.4 Å²	41.4	18%	0.178	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-40.3	178.7	-170.2	175.1	172.3	170.1	0	112	T105 T111 L137 V141 E343 I344	T105-K107 PolarHBondContact O-N 2.76Å; K107-T111 WeakPolarHBondContact O-CB 3.41Å; K107-T111 PolarHBondContact O-N 3.21Å; K107-T111 PolarHBondContact O-OG1 2.94Å; K107-L137 HydrophobicContact CB-CD1 4.29Å; K107-L137 HydrophobicContact CB-CD2 4.02Å; K107-L137 HydrophobicContact CB-CG 4.36Å; K107-L137 HydrophobicContact CD-CD1 4.44Å; K107-L137 HydrophobicContact CD-CG 4.42Å; K107-L137 HydrophobicContact CG-CD2 4.42Å; K107-V141 HydrophobicContact CG-CG2 3.9Å; K107-E343 WeakPolarHBondContact CD-O 3.41Å; K107-E343 PolarHBondContact NZ-O 3.06Å; K107-E343 IonicContact NZ-OE2 3.56Å; K107-E343 PolarHBondContact NZ-OE2 3.3Å; K107-I344 WeakPolarHBondContact CB-OXT 3.5Å
108	A	96.8	Very high	96.8	Very high	59 Å²	59	46.3 Å²	46.3	49%	0.488	22%	0.216	S	C	.	.	H	α-helix	trans	-64.7	-44.9	180	0	0	0	0	0	111.3	T105 Q106 T111 R112	T105-A108 PolarHBondContact O-N 2.93Å; T105-A108 VanDerWaalsContact O-N 3.08Å; Q106-A108 PolarHBondContact O-N 2.5Å; A108-T111 PolarHBondContact O-N 3.23Å; A108-R112 WeakPolarHBondContact O-CB 3.35Å; A108-R112 PolarHBondContact O-N 3.36Å
109	D	98	Very high	96.7	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-49.9	179.1	-68	-27.5	0	0	0	110.9	R103 T105 Q106 T111 R112 L113 T320	R103-D109 IonicContact CZ-OD2 3.97Å; R103-D109 VanDerWaalsContact CZ-OD2 3.32Å; R103-D109 IonicContact NE-OD2 3.21Å; R103-D109 PolarHBondContact NE-OD2 2.89Å; R103-D109 VanDerWaalsContact NE-OD2 3.15Å; R103-D109 IonicContact NH2-OD2 3.05Å; R103-D109 PolarHBondContact NH2-OD2 2.83Å; T105-D109 WeakPolarHBondContact CB-OD2 3.19Å; T105-D109 WeakPolarHBondContact O-CB 3.46Å; T105-D109 PolarHBondContact O-N 3.22Å; T105-D109 PolarHBondContact OG1-OD2 3.41Å; Q106-D109 PolarHBondContact O-N 3.08Å; D109-T111 VanDerWaalsContact C-N 3.33Å; D109-T111 PolarHBondContact O-N 2.95Å; D109-R112 PolarHBondContact O-N 3.28Å; D109-R112 IonicContact OD1-NH2 3.41Å; D109-L113 PolarHBondContact O-N 2.67Å; D109-T320 VanDerWaalsContact OD1-CB 3.24Å; D109-T320 WeakPolarHBondContact OD1-CB 3.28Å; D109-T320 WeakPolarHBondContact OD1-CG2 3.22Å; D109-T320 PolarHBondContact OD1-OG1 3.33Å
110	L	98.5	Very high	96.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.6	-35.6	176.5	-68	173.5	0	0	0	112.8	T98 T100 Q106 S114 W125 V127 V138 V141 D204	T98-L110 HydrophobicContact CG2-CD2 4.43Å; T100-L110 HydrophobicContact CG2-CD1 4.36Å; Q106-L110 HydrophobicContact CG-CD1 4.08Å; Q106-L110 WeakPolarHBondContact O-CB 3.32Å; Q106-L110 WeakPolarHBondContact O-CG 3.46Å; Q106-L110 PolarHBondContact O-N 3.43Å; L110-S114 VanDerWaalsContact O-CB 3.25Å; L110-S114 WeakPolarHBondContact O-CB 3.49Å; L110-S114 PolarHBondContact O-N 2.94Å; L110-W125 HydrophobicContact CD2-CH2 4.29Å; L110-W125 HydrophobicContact CD2-CZ2 3.94Å; L110-V127 HydrophobicContact CD2-CG1 4.46Å; L110-V138 HydrophobicContact CD1-CB 4.42Å; L110-V138 HydrophobicContact CD1-CG1 4.08Å; L110-V138 HydrophobicContact CD1-CG2 3.76Å; L110-V141 HydrophobicContact CB-CG1 3.84Å; L110-D204 HydrophobicContact CD2-CB 4.02Å
111	T	98	Very high	96.6	Very high	32 Å²	32	55.3 Å²	55.3	20%	0.196	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-48.2	176.2	-62.1	0	0	0	0	110.1	K107 A108 D109 L113 S114 Y115	K107-T111 WeakPolarHBondContact O-CB 3.41Å; K107-T111 PolarHBondContact O-N 3.21Å; K107-T111 PolarHBondContact O-OG1 2.94Å; A108-T111 PolarHBondContact O-N 3.23Å; D109-T111 VanDerWaalsContact C-N 3.33Å; D109-T111 PolarHBondContact O-N 2.95Å; T111-L113 PolarHBondContact O-N 3.16Å; T111-S114 PolarHBondContact O-N 3.33Å; T111-S114 PolarHBondContact O-OG 2.89Å; T111-Y115 HydrophobicContact CG2-CD2 4.45Å; T111-Y115 HydrophobicContact CG2-CE2 3.82Å; T111-Y115 PolarHBondContact O-N 3.49Å; T111-Y115 VanDerWaalsContact O-N 3.16Å
112	R	98	Very high	96.7	Very high	78 Å²	78	53.6 Å²	53.6	29%	0.294	26%	0.261	S	S	.	.	H	α-helix	trans	-60.3	-47.5	178	179.5	175.3	54.6	75.3	-5.4	111.6	A108 D109 S114 Y115 T116 D205 N206	A108-R112 WeakPolarHBondContact O-CB 3.35Å; A108-R112 PolarHBondContact O-N 3.36Å; D109-R112 PolarHBondContact O-N 3.28Å; D109-R112 IonicContact OD1-NH2 3.41Å; R112-S114 VanDerWaalsContact C-N 3.3Å; R112-S114 PolarHBondContact O-N 3.39Å; R112-Y115 PolarHBondContact O-N 3.3Å; R112-T116 PolarHBondContact O-N 3.3Å; R112-D205 PolarHBondContact NH2-O 3.19Å; R112-N206 PolarHBondContact NH1-O 3.23Å
113	L	98.5	Very high	96.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-39.8	177	-179.3	56.9	0	0	0	111.5	T98 D109 T111 Y115 T116 L117 W125 Y208	T98-L113 HydrophobicContact CG2-CD2 3.92Å; D109-L113 PolarHBondContact O-N 2.67Å; T111-L113 PolarHBondContact O-N 3.16Å; L113-Y115 VanDerWaalsContact C-N 3.28Å; L113-Y115 PolarHBondContact O-N 3.4Å; L113-T116 WeakPolarHBondContact O-CB 3.3Å; L113-T116 PolarHBondContact O-N 3.29Å; L113-L117 HydrophobicContact CD1-CD1 4.23Å; L113-L117 HydrophobicContact CD1-CD2 4.18Å; L113-L117 HydrophobicContact CD1-CG 3.97Å; L113-L117 HydrophobicContact CG-CD1 4.06Å; L113-L117 HydrophobicContact CG-CG 4.18Å; L113-L117 WeakPolarHBondContact O-CG 3.35Å; L113-L117 PolarHBondContact O-N 3Å; L113-W125 HydrophobicContact CB-CZ2 4.43Å; L113-W125 HydrophobicContact CD2-CZ2 3.79Å; L113-W125 HydrophobicContact CG-CZ2 4.01Å; L113-Y208 HydrophobicContact CD1-CD2 3.85Å; L113-Y208 HydrophobicContact CD1-CE2 3.83Å
114	S	98.3	Very high	97.2	Very high	5 Å²	5	43.9 Å²	43.9	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-60.4	-36.7	178.5	79.6	0	0	0	0	112.9	L110 T111 R112 T116 L117 M118	L110-S114 VanDerWaalsContact O-CB 3.25Å; L110-S114 WeakPolarHBondContact O-CB 3.49Å; L110-S114 PolarHBondContact O-N 2.94Å; T111-S114 PolarHBondContact O-N 3.33Å; T111-S114 PolarHBondContact O-OG 2.89Å; R112-S114 VanDerWaalsContact C-N 3.3Å; R112-S114 PolarHBondContact O-N 3.39Å; S114-T116 VanDerWaalsContact C-N 3.33Å; S114-L117 PolarHBondContact O-N 3.17Å; S114-M118 WeakPolarHBondContact O-CB 3.36Å; S114-M118 PolarHBondContact O-N 2.64Å
115	Y	98	Very high	97.5	Very high	144 Å²	144	37.5 Å²	37.5	57%	0.565	19%	0.192	S	C	*	.	H	α-helix	trans	-69.7	-29.6	174.9	-65.4	-25.7	0	0	0	112.7	T111 R112 L113 M118 H119	T111-Y115 HydrophobicContact CG2-CD2 4.45Å; T111-Y115 HydrophobicContact CG2-CE2 3.82Å; T111-Y115 PolarHBondContact O-N 3.49Å; T111-Y115 VanDerWaalsContact O-N 3.16Å; R112-Y115 PolarHBondContact O-N 3.3Å; L113-Y115 VanDerWaalsContact C-N 3.28Å; L113-Y115 PolarHBondContact O-N 3.4Å; Y115-M118 HydrophobicContact CD1-SD 3.89Å; Y115-M118 VanDerWaalsContact O-CG 3.27Å; Y115-M118 WeakPolarHBondContact O-CG 3.45Å; Y115-H119 PolarHBondContact O-CD2 2.91Å; Y115-H119 PolarHBondContact O-NE2 2.93Å
116	T	98.2	Very high	97.7	Very high	26 Å²	26	36.7 Å²	36.7	16%	0.16	19%	0.187	C	C	.	.	H	α-helix	trans	-68.9	-49.5	169.7	-56.6	0	0	0	0	110.5	R112 L113 S114 M118 H119 L210 F213	R112-T116 PolarHBondContact O-N 3.3Å; L113-T116 WeakPolarHBondContact O-CB 3.3Å; L113-T116 PolarHBondContact O-N 3.29Å; S114-T116 VanDerWaalsContact C-N 3.33Å; T116-M118 VanDerWaalsContact C-N 3.34Å; T116-M118 PolarHBondContact O-N 3.02Å; T116-H119 PolarHBondContact O-N 3.31Å; T116-L210 HydrophobicContact CG2-CD2 3.94Å; T116-L210 WeakPolarHBondContact O-CD2 3.42Å; T116-F213 HydrophobicContact CG2-CE2 3.88Å; T116-F213 HydrophobicContact CG2-CZ 4.42Å
117	L	98.4	Very high	97.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-71.2	-25.8	-172.8	-60.6	-173.1	0	0	0	113.7	V96 L113 S114 H119 V120 I123 W125 V147 F213	V96-L117 HydrophobicContact CG1-CD1 4.38Å; L113-L117 HydrophobicContact CD1-CD1 4.23Å; L113-L117 HydrophobicContact CD1-CD2 4.18Å; L113-L117 HydrophobicContact CD1-CG 3.97Å; L113-L117 HydrophobicContact CG-CD1 4.06Å; L113-L117 HydrophobicContact CG-CG 4.18Å; L113-L117 WeakPolarHBondContact O-CG 3.35Å; L113-L117 PolarHBondContact O-N 3Å; S114-L117 PolarHBondContact O-N 3.17Å; L117-H119 PolarHBondContact O-N 3.15Å; L117-H119 VanDerWaalsContact O-N 3.17Å; L117-V120 PolarHBondContact O-N 3.47Å; L117-I123 HydrophobicContact CB-CD1 4.22Å; L117-I123 HydrophobicContact CD1-CD1 4.35Å; L117-I123 HydrophobicContact CD2-CD1 3.74Å; L117-I123 HydrophobicContact CG-CD1 4.3Å; L117-W125 HydrophobicContact CD1-CB 4.25Å; L117-W125 HydrophobicContact CD1-CD2 3.58Å; L117-W125 HydrophobicContact CD1-CE3 4.17Å; L117-W125 HydrophobicContact CD1-CG 3.59Å; L117-W125 HydrophobicContact CD1-CZ2 4.36Å; L117-V147 HydrophobicContact CB-CG1 4.48Å; L117-V147 HydrophobicContact CB-CG2 4.32Å; L117-F213 HydrophobicContact CD2-CE1 3.68Å; L117-F213 HydrophobicContact CD2-CE2 4.31Å; L117-F213 HydrophobicContact CD2-CZ 3.49Å; L117-F213 VanDerWaalsContact CD2-CZ 3.49Å
118	M	97.3	Very high	97.9	Very high	103 Å²	103	34.4 Å²	34.4	51%	0.507	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-18.7	176.1	72.5	-178.4	-62.4	0	0	113.7	S114 Y115 T116 V147	S114-M118 WeakPolarHBondContact O-CB 3.36Å; S114-M118 PolarHBondContact O-N 2.64Å; Y115-M118 HydrophobicContact CD1-SD 3.89Å; Y115-M118 VanDerWaalsContact O-CG 3.27Å; Y115-M118 WeakPolarHBondContact O-CG 3.45Å; T116-M118 VanDerWaalsContact C-N 3.34Å; T116-M118 PolarHBondContact O-N 3.02Å; M118-V147 HydrophobicContact CB-CG2 3.98Å
119	H	97.3	Very high	98	Very high	123 Å²	123	31.9 Å²	31.9	57%	0.569	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-1.1	175.4	-60.7	-58.6	0	0	0	113.2	Y115 T116 L117 P121 L210	Y115-H119 PolarHBondContact O-CD2 2.91Å; Y115-H119 PolarHBondContact O-NE2 2.93Å; T116-H119 PolarHBondContact O-N 3.31Å; L117-H119 PolarHBondContact O-N 3.15Å; L117-H119 VanDerWaalsContact O-N 3.17Å; H119-P121 WeakPolarHBondContact O-CD 3.38Å; H119-L210 HydrophobicContact CB-CD1 3.79Å; H119-L210 HydrophobicContact CB-CD2 3.77Å; H119-L210 HydrophobicContact CB-CG 4.47Å
120	V	97.7	Very high	98	Very high	9 Å²	9	33.8 Å²	33.8	6%	0.055	17%	0.165	C	C	.	.	S	Bend	trans	-102.1	109.8	-177.9	-175.6	0	0	0	0	109.4	I94 L117 I123 L210 F213	I94-V120 HydrophobicContact CD1-CG1 4.06Å; L117-V120 PolarHBondContact O-N 3.47Å; V120-I123 HydrophobicContact CB-CD1 4.08Å; V120-I123 HydrophobicContact CG1-CB 4.26Å; V120-I123 HydrophobicContact CG1-CD1 4.02Å; V120-I123 WeakPolarHBondContact O-CG2 3.36Å; V120-L210 HydrophobicContact CG2-CD2 4.17Å; V120-F213 HydrophobicContact CB-CG 4.5Å; V120-F213 HydrophobicContact CG1-CB 3.7Å; V120-F213 HydrophobicContact CG1-CD1 4.28Å; V120-F213 HydrophobicContact CG1-CG 4.03Å; V120-F213 HydrophobicContact CG2-CB 3.92Å; V120-F213 HydrophobicContact CG2-CD1 4.2Å; V120-F213 HydrophobicContact CG2-CD2 3.6Å; V120-F213 HydrophobicContact CG2-CE2 4.14Å; V120-F213 HydrophobicContact CG2-CG 3.63Å
121	P	95.9	Very high	97.8	Very high	75 Å²	75	34.9 Å²	34.9	49%	0.487	18%	0.175	S	C	.	.	S	Bend	trans	-70.7	153.9	178.8	27.5	-33.3	0	0	0	112	M91 H119 R217	M91-P121 HydrophobicContact CE-CG 4.4Å; M91-P121 HydrophobicContact SD-CB 4.3Å; M91-P121 HydrophobicContact SD-CG 3.95Å; H119-P121 WeakPolarHBondContact O-CD 3.38Å; P121-R217 PolarHBondContact O-NH1 3.14Å; P121-R217 VanDerWaalsContact O-NH1 3.15Å; P121-R217 PolarHBondContact O-NH2 3.09Å
122	N	96.4	Very high	97.8	Very high	52 Å²	52	37.9 Å²	37.9	28%	0.278	20%	0.195	S	C	.	.	S	Bend	trans	47.1	63.2	180	-163.9	21.7	0	0	0	113.5	M91 T93 I94	M91-N122 PolarHBondContact O-ND2 3.36Å; M91-N122 HydrophobicContact SD-CB 4.4Å; T93-N122 WeakPolarHBondContact CA-ND2 3.41Å; T93-N122 VanDerWaalsContact CA-O 3.32Å; T93-N122 WeakPolarHBondContact CA-O 3.33Å; T93-N122 PolarHBondContact N-ND2 2.89Å; T93-N122 VanDerWaalsContact OG1-CG 3.29Å; T93-N122 PolarHBondContact OG1-ND2 3.12Å; T93-N122 PolarHBondContact OG1-OD1 3.46Å; I94-N122 PolarHBondContact N-O 2.79Å; I94-N122 VanDerWaalsContact N-O 3.08Å
123	I	97.9	Very high	97.8	Very high	12 Å²	12	38.6 Å²	38.6	6%	0.062	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.8	-179.9	-171.1	168.1	0	0	0	109.2	I94 V96 L117 V120 V147	I94-I123 HydrophobicContact CB-CG1 4.36Å; I94-I123 WeakPolarHBondContact O-CA 3.41Å; I94-I123 WeakPolarHBondContact O-CG1 3.4Å; V96-I123 HydrophobicContact CB-CD1 4.37Å; V96-I123 HydrophobicContact CG2-CD1 3.54Å; V96-I123 HydrophobicContact CG2-CG1 3.87Å; L117-I123 HydrophobicContact CB-CD1 4.22Å; L117-I123 HydrophobicContact CD1-CD1 4.35Å; L117-I123 HydrophobicContact CD2-CD1 3.74Å; L117-I123 HydrophobicContact CG-CD1 4.3Å; V120-I123 HydrophobicContact CB-CD1 4.08Å; V120-I123 HydrophobicContact CG1-CB 4.26Å; V120-I123 HydrophobicContact CG1-CD1 4.02Å; V120-I123 WeakPolarHBondContact O-CG2 3.36Å; I123-V147 HydrophobicContact CG2-CG1 3.88Å
124	L	98.5	Very high	97.7	Very high	1 Å²	1	40 Å²	40	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.5	167	-177.6	68.6	0	0	0	108.9	V80 L84 T93 I94 Y95 V96 I126 E148 V150 W186	V80-L124 HydrophobicContact CG1-CD1 3.79Å; L84-L124 HydrophobicContact CD1-CD2 3.97Å; T93-L124 HydrophobicContact CG2-CB 4.31Å; I94-L124 PolarHBondContact O-N 2.94Å; Y95-L124 HydrophobicContact CD1-CB 3.95Å; Y95-L124 HydrophobicContact CD1-CD2 3.76Å; Y95-L124 HydrophobicContact CD1-CG 4.42Å; Y95-L124 HydrophobicContact CE1-CB 4.3Å; Y95-L124 HydrophobicContact CE1-CD2 3.9Å; V96-L124 PolarHBondContact N-O 2.78Å; L124-I126 HydrophobicContact CD2-CD1 4.26Å; L124-I126 HydrophobicContact CD2-CG1 4.19Å; L124-I126 HydrophobicContact CG-CG1 4.17Å; L124-E148 HydrophobicContact CD1-CB 4.43Å; L124-E148 HydrophobicContact CD1-CG 3.81Å; L124-V150 HydrophobicContact CD1-CG2 4.15Å; L124-V150 HydrophobicContact CD2-CG2 4.29Å; L124-V150 HydrophobicContact CG-CG2 4.47Å; L124-W186 HydrophobicContact CD2-CH2 3.79Å; L124-W186 HydrophobicContact CD2-CZ3 3.73Å
125	W	98.8	Very high	97.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	105.8	-179.8	-170	23.5	0	0	0	111.5	T98 L110 L113 L117 V127 L142 V147 E148 H149 V150	T98-W125 PolarHBondContact OG1-NE1 3.36Å; L110-W125 HydrophobicContact CD2-CH2 4.29Å; L110-W125 HydrophobicContact CD2-CZ2 3.94Å; L113-W125 HydrophobicContact CB-CZ2 4.43Å; L113-W125 HydrophobicContact CD2-CZ2 3.79Å; L113-W125 HydrophobicContact CG-CZ2 4.01Å; L117-W125 HydrophobicContact CD1-CB 4.25Å; L117-W125 HydrophobicContact CD1-CD2 3.58Å; L117-W125 HydrophobicContact CD1-CE3 4.17Å; L117-W125 HydrophobicContact CD1-CG 3.59Å; L117-W125 HydrophobicContact CD1-CZ2 4.36Å; W125-V127 HydrophobicContact CD2-CG2 3.74Å; W125-V127 HydrophobicContact CE3-CG2 4.44Å; W125-V127 HydrophobicContact CG-CG2 4.03Å; W125-V127 HydrophobicContact CH2-CG2 4.41Å; W125-V127 HydrophobicContact CZ2-CG2 3.71Å; W125-L142 HydrophobicContact CD2-CD2 3.99Å; W125-L142 HydrophobicContact CE3-CD2 3.38Å; W125-L142 HydrophobicContact CH2-CD2 3.82Å; W125-L142 HydrophobicContact CZ2-CD2 4.37Å; W125-L142 HydrophobicContact CZ3-CD2 3.29Å; W125-V147 HydrophobicContact CB-CG1 3.95Å; W125-V147 HydrophobicContact CE3-CB 4.46Å; W125-V147 HydrophobicContact CE3-CG1 4.47Å; W125-E148 PolarHBondContact N-O 3.28Å; W125-H149 HydrophobicContact CB-CB 4.34Å; W125-H149 CarbonylContact O-C 3.49Å; W125-H149 WeakPolarHBondContact O-CA 3.4Å; W125-H149 VanDerWaalsContact O-CB 3.3Å; W125-H149 WeakPolarHBondContact O-CB 3.31Å; W125-V150 PolarHBondContact O-N 2.99Å
126	I	98.9	Very high	97.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	98.3	179.5	-52.4	176.1	0	0	0	108.6	V96 V97 T98 L124 V128 V150 L152 A183 W186 L187	V96-I126 PolarHBondContact O-N 3.22Å; V97-I126 WeakPolarHBondContact CA-O 3.47Å; V97-I126 HydrophobicContact CG2-CB 4.35Å; V97-I126 HydrophobicContact CG2-CD1 4.38Å; T98-I126 PolarHBondContact N-O 2.98Å; L124-I126 HydrophobicContact CD2-CD1 4.26Å; L124-I126 HydrophobicContact CD2-CG1 4.19Å; L124-I126 HydrophobicContact CG-CG1 4.17Å; I126-V128 HydrophobicContact CG2-CG2 4.14Å; I126-V150 CarbonylContact C-O 3.58Å; I126-V150 WeakPolarHBondContact CA-O 3.26Å; I126-V150 HydrophobicContact CB-CB 4.47Å; I126-V150 HydrophobicContact CG1-CB 4.18Å; I126-V150 HydrophobicContact CG2-CB 4.28Å; I126-V150 HydrophobicContact CG2-CG1 4.15Å; I126-L152 HydrophobicContact CG2-CD1 4.15Å; I126-A183 HydrophobicContact CG2-CB 3.91Å; I126-W186 HydrophobicContact CD1-CE3 3.84Å; I126-W186 HydrophobicContact CD1-CZ3 3.94Å; I126-L187 HydrophobicContact CD1-CD1 4.23Å; I126-L187 HydrophobicContact CD1-CD2 3.6Å; I126-L187 HydrophobicContact CD1-CG 3.83Å
127	V	98.9	Very high	97.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	133.8	175.5	-179.8	0	0	0	0	110	T98 T100 L110 W125 V138 L142 V150 L151 L152	T98-V127 WeakPolarHBondContact O-CA 3.44Å; T100-V127 HydrophobicContact CG2-CG1 3.69Å; L110-V127 HydrophobicContact CD2-CG1 4.46Å; W125-V127 HydrophobicContact CD2-CG2 3.74Å; W125-V127 HydrophobicContact CE3-CG2 4.44Å; W125-V127 HydrophobicContact CG-CG2 4.03Å; W125-V127 HydrophobicContact CH2-CG2 4.41Å; W125-V127 HydrophobicContact CZ2-CG2 3.71Å; V127-V138 HydrophobicContact CG1-CG1 3.86Å; V127-L142 HydrophobicContact CB-CD1 4.16Å; V127-L142 HydrophobicContact CB-CD2 4.45Å; V127-L142 HydrophobicContact CG2-CD1 4.29Å; V127-L142 HydrophobicContact CG2-CD2 3.72Å; V127-V150 PolarHBondContact N-O 2.75Å; V127-L151 HydrophobicContact CB-CD1 4.08Å; V127-L151 HydrophobicContact CG1-CD1 3.99Å; V127-L151 WeakPolarHBondContact O-CA 3.29Å; V127-L152 PolarHBondContact O-N 3.26Å
128	V	98.8	Very high	97.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	112.9	-179.7	-169.3	0	0	0	0	110.6	T98 P99 T100 I126 L152 A154 Q179 A182 A183	T98-V128 PolarHBondContact O-N 3.05Å; P99-V128 WeakPolarHBondContact CA-O 3.22Å; T100-V128 PolarHBondContact N-O 2.99Å; I126-V128 HydrophobicContact CG2-CG2 4.14Å; V128-L152 WeakPolarHBondContact CA-O 3.28Å; V128-L152 HydrophobicContact CB-CB 4.4Å; V128-L152 HydrophobicContact CG1-CB 3.98Å; V128-L152 HydrophobicContact CG2-CB 4.06Å; V128-L152 HydrophobicContact CG2-CD1 4.14Å; V128-L152 HydrophobicContact CG2-CG 4.46Å; V128-A154 HydrophobicContact CG1-CB 3.85Å; V128-Q179 HydrophobicContact CB-CB 3.85Å; V128-Q179 HydrophobicContact CB-CG 4.27Å; V128-Q179 HydrophobicContact CG1-CB 3.74Å; V128-Q179 HydrophobicContact CG1-CG 3.91Å; V128-A182 HydrophobicContact CG1-CB 4.23Å; V128-A183 HydrophobicContact CG2-CB 4.09Å
129	E	98.2	Very high	97.5	Very high	7 Å²	7	31.1 Å²	31.1	3%	0.033	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.6	-179.7	-67.5	-176	-97.3	0	0	111.7	T100 A131 T134 S135 V138 L151 L152 A153 A154	T100-E129 HydrophobicContact CG2-CB 4.42Å; T100-E129 HydrophobicContact CG2-CG 3.75Å; T100-E129 CarbonylContact O-C 3.56Å; T100-E129 WeakPolarHBondContact O-CA 3.23Å; E129-A131 HydrophobicContact CB-CB 4.31Å; E129-A131 PolarHBondContact O-N 3.04Å; E129-T134 WeakPolarHBondContact OE1-CA 3.29Å; E129-S135 PolarHBondContact OE1-N 3.32Å; E129-S135 VanDerWaalsContact OE2-CB 3.28Å; E129-S135 WeakPolarHBondContact OE2-CB 3.22Å; E129-S135 PolarHBondContact OE2-N 2.8Å; E129-S135 PolarHBondContact OE2-OG 2.78Å; E129-V138 VanDerWaalsContact CD-CG2 3.46Å; E129-V138 HydrophobicContact CG-CB 4.25Å; E129-V138 HydrophobicContact CG-CG1 4.21Å; E129-V138 HydrophobicContact CG-CG2 3.96Å; E129-V138 VanDerWaalsContact OE2-CG2 3.22Å; E129-V138 WeakPolarHBondContact OE2-CG2 3.13Å; E129-L151 HydrophobicContact CG-CD1 4.1Å; E129-L152 PolarHBondContact N-O 3.21Å; E129-A153 WeakPolarHBondContact O-CA 3.47Å; E129-A154 PolarHBondContact O-N 3.49Å
130	D	96.8	Very high	97.5	Very high	42 Å²	42	27.6 Å²	27.6	23%	0.225	17%	0.171	C	C	.	.	S	Bend	trans	-72.4	68.5	165.8	-170.6	-7	0	0	0	111	T100 A154 Q155 T156 Q179	T100-D130 PolarHBondContact O-N 3.18Å; D130-A154 WeakPolarHBondContact CA-O 3.38Å; D130-Q155 WeakPolarHBondContact OD1-CA 2.95Å; D130-T156 WeakPolarHBondContact OD1-CB 3.34Å; D130-T156 PolarHBondContact OD1-N 2.76Å; D130-T156 PolarHBondContact OD1-OG1 3.1Å; D130-T156 VanDerWaalsContact OD2-CB 3.29Å; D130-T156 WeakPolarHBondContact OD2-CB 3.44Å; D130-T156 PolarHBondContact OD2-OG1 3.23Å; D130-Q179 VanDerWaalsContact CB-NE2 3.29Å; D130-Q179 VanDerWaalsContact CG-NE2 3.27Å
131	A	96.3	Very high	97.5	Very high	24 Å²	24	27.3 Å²	27.3	20%	0.198	17%	0.169	C	C	.	.	S	Bend	trans	-150	160.8	-179.1	0	0	0	0	0	110.2	E129 T133 Q155	E129-A131 HydrophobicContact CB-CB 4.31Å; E129-A131 PolarHBondContact O-N 3.04Å; A131-T133 WeakPolarHBondContact CB-O 3.37Å; A131-T133 PolarHBondContact O-N 3.13Å; A131-Q155 PolarHBondContact O-N 3.43Å
132	P	96.9	Very high	97.6	Very high	95 Å²	95	23.8 Å²	23.8	62%	0.617	15%	0.146	S	C	*	.	S	Bend	trans	-65	-27.7	173	-18.9	32	0	0	0	113.1
133	T	97.7	Very high	97.7	Very high	93 Å²	93	26 Å²	26	57%	0.571	16%	0.157	S	C	*	.	S	Bend	trans	-144.6	158.3	-176.1	57.7	0	0	0	0	109.8	A131 A153	A131-T133 WeakPolarHBondContact CB-O 3.37Å; A131-T133 PolarHBondContact O-N 3.13Å; T133-A153 VanDerWaalsContact C-CB 3.47Å
134	T	97.6	Very high	97.6	Very high	28 Å²	28	32.3 Å²	32.3	17%	0.172	18%	0.18	C	C	.	.			trans	-69.3	150.2	174.9	60.2	0	0	0	0	111.3	Q70 E129 L151 A153	Q70-T134 PolarHBondContact NE2-O 2.84Å; E129-T134 WeakPolarHBondContact OE1-CA 3.29Å; T134-L151 HydrophobicContact CG2-CD1 4.4Å; T134-L151 HydrophobicContact CG2-CD2 4.09Å; T134-L151 HydrophobicContact CG2-CG 3.7Å; T134-A153 HydrophobicContact CG2-CB 3.96Å
135	S	96.2	Very high	97.6	Very high	36 Å²	36	33 Å²	33	25%	0.252	19%	0.185	S	C	.	.			trans	-102.3	151.6	179.3	72	0	0	0	0	112.2	E129 L137 V138 T139	E129-S135 PolarHBondContact OE1-N 3.32Å; E129-S135 VanDerWaalsContact OE2-CB 3.28Å; E129-S135 WeakPolarHBondContact OE2-CB 3.22Å; E129-S135 PolarHBondContact OE2-N 2.8Å; E129-S135 PolarHBondContact OE2-OG 2.78Å; S135-L137 PolarHBondContact O-N 3.39Å; S135-V138 PolarHBondContact O-N 3.4Å; S135-V138 WeakPolarHBondContact OG-CG2 3.39Å; S135-V138 PolarHBondContact OG-N 3.21Å; S135-T139 WeakPolarHBondContact O-CB 3.31Å; S135-T139 PolarHBondContact O-N 3.33Å; S135-T139 VanDerWaalsContact O-N 3.09Å; S135-T139 PolarHBondContact O-OG1 3.17Å
136	A	96.2	Very high	97.4	Very high	23 Å²	23	36.4 Å²	36.4	19%	0.19	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-34.3	173.7	0	0	0	0	0	111.7	Y62 T139 N140	Y62-A136 WeakPolarHBondContact OH-CB 3.32Å; A136-T139 PolarHBondContact O-N 2.87Å; A136-N140 VanDerWaalsContact O-CB 3.25Å; A136-N140 WeakPolarHBondContact O-CB 3.22Å; A136-N140 PolarHBondContact O-N 3.37Å; A136-N140 PolarHBondContact O-ND2 2.78Å
137	L	96.5	Very high	97.4	Very high	27 Å²	27	36.8 Å²	36.8	14%	0.141	22%	0.223	C	C	.	.	H	α-helix	trans	-56.6	-53.7	176.9	-179.8	153.1	0	0	0	111.4	K107 S135 N140 V141 I344	K107-L137 HydrophobicContact CB-CD1 4.29Å; K107-L137 HydrophobicContact CB-CD2 4.02Å; K107-L137 HydrophobicContact CB-CG 4.36Å; K107-L137 HydrophobicContact CD-CD1 4.44Å; K107-L137 HydrophobicContact CD-CG 4.42Å; K107-L137 HydrophobicContact CG-CD2 4.42Å; S135-L137 PolarHBondContact O-N 3.39Å; L137-N140 PolarHBondContact O-N 3.06Å; L137-V141 WeakPolarHBondContact O-CG2 3.44Å; L137-V141 PolarHBondContact O-N 3.19Å; L137-V141 VanDerWaalsContact O-N 3.11Å; L137-I344 WeakPolarHBondContact CD1-O 3.45Å
138	V	97.8	Very high	97.4	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.3	-41.6	-178.3	177.1	0	0	0	0	110.5	L110 V127 E129 S135 N140 V141 L142 L151	L110-V138 HydrophobicContact CD1-CB 4.42Å; L110-V138 HydrophobicContact CD1-CG1 4.08Å; L110-V138 HydrophobicContact CD1-CG2 3.76Å; V127-V138 HydrophobicContact CG1-CG1 3.86Å; E129-V138 VanDerWaalsContact CD-CG2 3.46Å; E129-V138 HydrophobicContact CG-CB 4.25Å; E129-V138 HydrophobicContact CG-CG1 4.21Å; E129-V138 HydrophobicContact CG-CG2 3.96Å; E129-V138 VanDerWaalsContact OE2-CG2 3.22Å; E129-V138 WeakPolarHBondContact OE2-CG2 3.13Å; S135-V138 PolarHBondContact O-N 3.4Å; S135-V138 WeakPolarHBondContact OG-CG2 3.39Å; S135-V138 PolarHBondContact OG-N 3.21Å; V138-N140 VanDerWaalsContact C-N 3.29Å; V138-N140 PolarHBondContact O-N 2.84Å; V138-V141 PolarHBondContact O-N 3.02Å; V138-L142 HydrophobicContact CG1-CD1 4.14Å; V138-L142 HydrophobicContact CG1-CG 4.39Å; V138-L142 WeakPolarHBondContact O-CG 3.37Å; V138-L142 PolarHBondContact O-N 3.08Å; V138-L151 HydrophobicContact CB-CD1 4.44Å; V138-L151 HydrophobicContact CB-CD2 4.44Å; V138-L151 HydrophobicContact CG1-CD1 3.52Å; V138-L151 HydrophobicContact CG1-CD2 4.08Å; V138-L151 HydrophobicContact CG1-CG 4.45Å
139	T	97.9	Very high	97.3	Very high	6 Å²	6	41.4 Å²	41.4	4%	0.037	24%	0.244	C	C	.	.	H	α-helix	trans	-54.2	-46.9	174.7	-55.1	0	0	0	0	111.4	S135 A136 V141 L142 L143 L151	S135-T139 WeakPolarHBondContact O-CB 3.31Å; S135-T139 PolarHBondContact O-N 3.33Å; S135-T139 VanDerWaalsContact O-N 3.09Å; S135-T139 PolarHBondContact O-OG1 3.17Å; A136-T139 PolarHBondContact O-N 2.87Å; T139-V141 PolarHBondContact O-N 3.31Å; T139-L142 PolarHBondContact O-N 3.13Å; T139-L143 HydrophobicContact CG2-CD1 3.99Å; T139-L143 HydrophobicContact CG2-CG 4.42Å; T139-L143 WeakPolarHBondContact O-CG 3.37Å; T139-L143 PolarHBondContact O-N 3.15Å; T139-L151 WeakPolarHBondContact OG1-CD2 3.48Å
140	N	97.5	Very high	97.4	Very high	50 Å²	50	41 Å²	41	27%	0.267	24%	0.243	S	C	.	.	H	α-helix	trans	-67.2	-36.9	-179.2	-71.3	-16.1	0	0	0	112.5	A136 L137 V138 R144 E343	A136-N140 VanDerWaalsContact O-CB 3.25Å; A136-N140 WeakPolarHBondContact O-CB 3.22Å; A136-N140 PolarHBondContact O-N 3.37Å; A136-N140 PolarHBondContact O-ND2 2.78Å; L137-N140 PolarHBondContact O-N 3.06Å; V138-N140 VanDerWaalsContact C-N 3.29Å; V138-N140 PolarHBondContact O-N 2.84Å; N140-R144 WeakPolarHBondContact O-CB 3.31Å; N140-R144 VanDerWaalsContact O-CG 3.28Å; N140-R144 WeakPolarHBondContact O-CG 2.85Å; N140-R144 PolarHBondContact O-N 3Å; N140-R144 VanDerWaalsContact O-N 3.14Å; N140-E343 PolarHBondContact ND2-OE1 3Å
141	V	97.7	Very high	97.5	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.018	23%	0.233	C	C	.	.	H	α-helix	trans	-62.8	-46.9	174.7	173.1	0	0	0	0	110.6	K107 L110 L137 V138 T139 R144 S145	K107-V141 HydrophobicContact CG-CG2 3.9Å; L110-V141 HydrophobicContact CB-CG1 3.84Å; L137-V141 WeakPolarHBondContact O-CG2 3.44Å; L137-V141 PolarHBondContact O-N 3.19Å; L137-V141 VanDerWaalsContact O-N 3.11Å; V138-V141 PolarHBondContact O-N 3.02Å; T139-V141 PolarHBondContact O-N 3.31Å; V141-R144 PolarHBondContact O-N 2.83Å; V141-S145 PolarHBondContact O-N 3.13Å; V141-S145 VanDerWaalsContact O-N 3.09Å
142	L	98.3	Very high	97.6	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-45.8	-179.2	-63.6	177.2	0	0	0	112.4	W125 V127 V138 T139 R144 S145 H149 L151	W125-L142 HydrophobicContact CD2-CD2 3.99Å; W125-L142 HydrophobicContact CE3-CD2 3.38Å; W125-L142 HydrophobicContact CH2-CD2 3.82Å; W125-L142 HydrophobicContact CZ2-CD2 4.37Å; W125-L142 HydrophobicContact CZ3-CD2 3.29Å; V127-L142 HydrophobicContact CB-CD1 4.16Å; V127-L142 HydrophobicContact CB-CD2 4.45Å; V127-L142 HydrophobicContact CG2-CD1 4.29Å; V127-L142 HydrophobicContact CG2-CD2 3.72Å; V138-L142 HydrophobicContact CG1-CD1 4.14Å; V138-L142 HydrophobicContact CG1-CG 4.39Å; V138-L142 WeakPolarHBondContact O-CG 3.37Å; V138-L142 PolarHBondContact O-N 3.08Å; T139-L142 PolarHBondContact O-N 3.13Å; L142-R144 VanDerWaalsContact C-N 3.32Å; L142-R144 PolarHBondContact O-N 3.46Å; L142-S145 WeakPolarHBondContact O-CB 3.46Å; L142-S145 PolarHBondContact O-N 3.08Å; L142-S145 VanDerWaalsContact O-N 3.15Å; L142-S145 PolarHBondContact O-OG 3.43Å; L142-H149 HydrophobicContact CD1-CB 4.49Å; L142-H149 HydrophobicContact CD2-CB 4.35Å; L142-L151 HydrophobicContact CD1-CB 3.78Å; L142-L151 HydrophobicContact CD1-CD1 4.04Å; L142-L151 HydrophobicContact CD1-CD2 4.08Å; L142-L151 HydrophobicContact CD1-CG 4.15Å
143	L	97.7	Very high	97.6	Very high	97 Å²	97	36.7 Å²	36.7	51%	0.508	22%	0.216	S	C	.	.	H	α-helix	trans	-59.6	-42.2	177.3	-71.3	175.1	0	0	0	112.2	T139 S145	T139-L143 HydrophobicContact CG2-CD1 3.99Å; T139-L143 HydrophobicContact CG2-CG 4.42Å; T139-L143 WeakPolarHBondContact O-CG 3.37Å; T139-L143 PolarHBondContact O-N 3.15Å; L143-S145 VanDerWaalsContact C-N 3.3Å; L143-S145 PolarHBondContact O-N 2.64Å
144	R	97	Very high	97.7	Very high	145 Å²	145	33 Å²	33	55%	0.547	19%	0.194	S	C	.	.	H	α-helix	trans	-69.1	-26.6	177.9	-72.5	-170.1	-46.3	-117.7	-4.6	113.6	N140 V141 L142 G146	N140-R144 WeakPolarHBondContact O-CB 3.31Å; N140-R144 VanDerWaalsContact O-CG 3.28Å; N140-R144 WeakPolarHBondContact O-CG 2.85Å; N140-R144 PolarHBondContact O-N 3Å; N140-R144 VanDerWaalsContact O-N 3.14Å; V141-R144 PolarHBondContact O-N 2.83Å; L142-R144 VanDerWaalsContact C-N 3.32Å; L142-R144 PolarHBondContact O-N 3.46Å; R144-G146 PolarHBondContact O-N 2.91Å
145	S	97.1	Very high	97.6	Very high	15 Å²	15	35.8 Å²	35.8	11%	0.105	21%	0.206	C	C	.	.	H	α-helix	trans	-67	-26	-177.5	74.2	0	0	0	0	113.4	V141 L142 L143 V147	V141-S145 PolarHBondContact O-N 3.13Å; V141-S145 VanDerWaalsContact O-N 3.09Å; L142-S145 WeakPolarHBondContact O-CB 3.46Å; L142-S145 PolarHBondContact O-N 3.08Å; L142-S145 VanDerWaalsContact O-N 3.15Å; L142-S145 PolarHBondContact O-OG 3.43Å; L143-S145 VanDerWaalsContact C-N 3.3Å; L143-S145 PolarHBondContact O-N 2.64Å; S145-V147 PolarHBondContact O-N 2.69Å; S145-V147 VanDerWaalsContact O-N 3.12Å; S145-V147 PolarHBondContact OG-N 3.34Å; S145-V147 VanDerWaalsContact OG-N 3.17Å
146	G	96.3	Very high	97.5	Very high	72 Å²	72	34.6 Å²	34.6	74%	0.742	20%	0.197	S	C	*	.			trans	68.3	-2.7	-171.5	0	0	0	0	0	114.6	R144	R144-G146 PolarHBondContact O-N 2.91Å
147	V	97.8	Very high	97.3	Very high	9 Å²	9	36 Å²	36	6%	0.055	20%	0.204	C	C	.	.			trans	-72.4	137.4	176.4	-177.5	0	0	0	0	109.1	L117 M118 I123 W125 S145 H149	L117-V147 HydrophobicContact CB-CG1 4.48Å; L117-V147 HydrophobicContact CB-CG2 4.32Å; M118-V147 HydrophobicContact CB-CG2 3.98Å; I123-V147 HydrophobicContact CG2-CG1 3.88Å; W125-V147 HydrophobicContact CB-CG1 3.95Å; W125-V147 HydrophobicContact CE3-CB 4.46Å; W125-V147 HydrophobicContact CE3-CG1 4.47Å; S145-V147 PolarHBondContact O-N 2.69Å; S145-V147 VanDerWaalsContact O-N 3.12Å; S145-V147 PolarHBondContact OG-N 3.34Å; S145-V147 VanDerWaalsContact OG-N 3.17Å; V147-H149 PolarHBondContact O-N 2.88Å; V147-H149 PolarHBondContact O-ND1 3.02Å
148	E	98.1	Very high	96.9	Very high	68 Å²	68	43.6 Å²	43.6	32%	0.318	24%	0.236	S	C	.	.			trans	-64.4	126.5	173.2	-168.9	169.4	-179.4	0	0	109.6	V80 L124 W125	V80-E148 HydrophobicContact CG1-CG 4.4Å; L124-E148 HydrophobicContact CD1-CB 4.43Å; L124-E148 HydrophobicContact CD1-CG 3.81Å; W125-E148 PolarHBondContact N-O 3.28Å
149	H	98.6	Very high	96.3	Very high	28 Å²	28	52.6 Å²	52.6	13%	0.13	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	160.5	-166.3	61.4	-89	0	0	0	114.1	Y73 W125 L142 V147	Y73-H149 AromaticContact CE2-CD2 3.83Å; Y73-H149 AromaticContact CE2-NE2 3.64Å; Y73-H149 PolarHBondContact OH-CD2 2.82Å; Y73-H149 VanDerWaalsContact OH-CD2 3.23Å; W125-H149 HydrophobicContact CB-CB 4.34Å; W125-H149 CarbonylContact O-C 3.49Å; W125-H149 WeakPolarHBondContact O-CA 3.4Å; W125-H149 VanDerWaalsContact O-CB 3.3Å; W125-H149 WeakPolarHBondContact O-CB 3.31Å; L142-H149 HydrophobicContact CD1-CB 4.49Å; L142-H149 HydrophobicContact CD2-CB 4.35Å; V147-H149 PolarHBondContact O-N 2.88Å; V147-H149 PolarHBondContact O-ND1 3.02Å
150	V	98.6	Very high	95.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	140.6	170.1	169.8	0	0	0	0	106.9	Y73 L77 V80 L124 W125 I126 V127 L152 W186	Y73-V150 VanDerWaalsContact OH-CA 3.31Å; Y73-V150 WeakPolarHBondContact OH-CA 3.49Å; L77-V150 HydrophobicContact CD2-CB 4.06Å; L77-V150 HydrophobicContact CD2-CG1 3.76Å; L77-V150 HydrophobicContact CD2-CG2 3.92Å; V80-V150 HydrophobicContact CG1-CG2 4.41Å; L124-V150 HydrophobicContact CD1-CG2 4.15Å; L124-V150 HydrophobicContact CD2-CG2 4.29Å; L124-V150 HydrophobicContact CG-CG2 4.47Å; W125-V150 PolarHBondContact O-N 2.99Å; I126-V150 CarbonylContact C-O 3.58Å; I126-V150 WeakPolarHBondContact CA-O 3.26Å; I126-V150 HydrophobicContact CB-CB 4.47Å; I126-V150 HydrophobicContact CG1-CB 4.18Å; I126-V150 HydrophobicContact CG2-CB 4.28Å; I126-V150 HydrophobicContact CG2-CG1 4.15Å; V127-V150 PolarHBondContact N-O 2.75Å; V150-L152 HydrophobicContact CG1-CD1 4.31Å; V150-L152 HydrophobicContact CG1-CD2 3.83Å; V150-L152 HydrophobicContact CG1-CG 3.86Å; V150-W186 HydrophobicContact CB-CZ2 4.39Å; V150-W186 HydrophobicContact CG1-CD2 4.05Å; V150-W186 HydrophobicContact CG1-CG 4.4Å; V150-W186 HydrophobicContact CG1-CZ2 4.13Å; V150-W186 HydrophobicContact CG2-CH2 3.55Å; V150-W186 HydrophobicContact CG2-CZ2 3.4Å; V150-W186 HydrophobicContact CG2-CZ3 4.16Å
151	L	98.7	Very high	94.6	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	117.5	-176.5	178.1	57.1	0	0	0	106.4	Y73 V127 E129 T134 V138 T139 L142	Y73-L151 HydrophobicContact CE1-CB 3.58Å; Y73-L151 VanDerWaalsContact CZ-CB 3.5Å; Y73-L151 WeakPolarHBondContact OH-CA 3.22Å; Y73-L151 WeakPolarHBondContact OH-CB 3.49Å; Y73-L151 PolarHBondContact OH-N 2.89Å; V127-L151 HydrophobicContact CB-CD1 4.08Å; V127-L151 HydrophobicContact CG1-CD1 3.99Å; V127-L151 WeakPolarHBondContact O-CA 3.29Å; E129-L151 HydrophobicContact CG-CD1 4.1Å; T134-L151 HydrophobicContact CG2-CD1 4.4Å; T134-L151 HydrophobicContact CG2-CD2 4.09Å; T134-L151 HydrophobicContact CG2-CG 3.7Å; V138-L151 HydrophobicContact CB-CD1 4.44Å; V138-L151 HydrophobicContact CB-CD2 4.44Å; V138-L151 HydrophobicContact CG1-CD1 3.52Å; V138-L151 HydrophobicContact CG1-CD2 4.08Å; V138-L151 HydrophobicContact CG1-CG 4.45Å; T139-L151 WeakPolarHBondContact OG1-CD2 3.48Å; L142-L151 HydrophobicContact CD1-CB 3.78Å; L142-L151 HydrophobicContact CD1-CD1 4.04Å; L142-L151 HydrophobicContact CD1-CD2 4.08Å; L142-L151 HydrophobicContact CD1-CG 4.15Å
152	L	98.8	Very high	93.2	Very high	29 Å²	29	56.4 Å²	56.4	15%	0.152	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	163.7	179.9	-52.1	174.3	0	0	0	109	I126 V127 V128 E129 V150 W186	I126-L152 HydrophobicContact CG2-CD1 4.15Å; V127-L152 PolarHBondContact O-N 3.26Å; V128-L152 WeakPolarHBondContact CA-O 3.28Å; V128-L152 HydrophobicContact CB-CB 4.4Å; V128-L152 HydrophobicContact CG1-CB 3.98Å; V128-L152 HydrophobicContact CG2-CB 4.06Å; V128-L152 HydrophobicContact CG2-CD1 4.14Å; V128-L152 HydrophobicContact CG2-CG 4.46Å; E129-L152 PolarHBondContact N-O 3.21Å; V150-L152 HydrophobicContact CG1-CD1 4.31Å; V150-L152 HydrophobicContact CG1-CD2 3.83Å; V150-L152 HydrophobicContact CG1-CG 3.86Å; L152-W186 HydrophobicContact CD1-CB 3.73Å; L152-W186 HydrophobicContact CD1-CG 4Å; L152-W186 HydrophobicContact CD2-CG 4.39Å
153	A	98.4	Very high	91.6	Very high	36 Å²	36	66.4 Å²	66.4	30%	0.298	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	131.3	170.5	0	0	0	0	0	108.5	E129 T133 T134	E129-A153 WeakPolarHBondContact O-CA 3.47Å; T133-A153 VanDerWaalsContact C-CB 3.47Å; T134-A153 HydrophobicContact CG2-CB 3.96Å
154	A	98.1	Very high	89.8	Confident	15 Å²	15	64.6 Å²	64.6	12%	0.124	32%	0.318	C	S	.	.			trans	-145.9	104.1	177.4	0	0	0	0	0	108.2	V128 E129 D130 A178 Q179 A182	V128-A154 HydrophobicContact CG1-CB 3.85Å; E129-A154 PolarHBondContact O-N 3.49Å; D130-A154 WeakPolarHBondContact CA-O 3.38Å; A154-A178 HydrophobicContact CB-CB 4.24Å; A154-Q179 PolarHBondContact O-NE2 3.06Å; A154-A182 HydrophobicContact CB-CB 3.7Å
155	Q	96.2	Very high	87.9	Confident	87 Å²	87	61 Å²	61	41%	0.407	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-76.3	129	-178.3	-169.9	172.4	58.1	0	0	111.1	D130 A131	D130-Q155 WeakPolarHBondContact OD1-CA 2.95Å; A131-Q155 PolarHBondContact O-N 3.43Å
156	T	94.7	Very high	85.9	Confident	11 Å²	11	66.3 Å²	66.3	7%	0.067	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-61	126.8	168.7	-58.9	0	0	0	0	109.4	D130 K161 Q179 Y282	D130-T156 WeakPolarHBondContact OD1-CB 3.34Å; D130-T156 PolarHBondContact OD1-N 2.76Å; D130-T156 PolarHBondContact OD1-OG1 3.1Å; D130-T156 VanDerWaalsContact OD2-CB 3.29Å; D130-T156 WeakPolarHBondContact OD2-CB 3.44Å; D130-T156 PolarHBondContact OD2-OG1 3.23Å; T156-K161 HydrophobicContact CG2-CG 4.09Å; T156-K161 WeakPolarHBondContact O-CE 3.35Å; T156-Q179 PolarHBondContact OG1-NE2 3.05Å; T156-Q179 VanDerWaalsContact OG1-NE2 3.09Å; T156-Y282 HydrophobicContact CG2-CE1 4.08Å
157	P	92.3	Very high	83.9	Confident	52 Å²	52	64.2 Å²	64.2	34%	0.338	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-56.7	141.1	179.2	-24.5	33	0	0	0	112.2	R159 Y160 K161 Y282	P157-R159 HydrophobicContact CB-CG 4.44Å; P157-R159 PolarHBondContact O-N 2.85Å; P157-Y160 HydrophobicContact CB-CD2 3.9Å; P157-Y160 HydrophobicContact CB-CE2 4.44Å; P157-Y160 HydrophobicContact CG-CD2 4.02Å; P157-Y160 HydrophobicContact CG-CE2 4.47Å; P157-Y160 PolarHBondContact O-N 3.13Å; P157-K161 PolarHBondContact O-N 3.03Å; P157-Y282 WeakPolarHBondContact CD-OH 3.45Å; P157-Y282 HydrophobicContact CG-CE2 4.39Å
158	K	87.5	Confident	81.7	Confident	187 Å²	187	68.6 Å²	68.6	81%	0.813	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-52	-35.7	-174.8	-68.6	-176	-178.9	178.1	0	113.8	Y160 K161	K158-Y160 PolarHBondContact O-N 3.08Å; K158-K161 PolarHBondContact O-N 3.31Å
159	R	85.3	Confident	79.5	Confident	189 Å²	189	74.5 Å²	74.5	71%	0.713	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-65.4	-24.4	179.1	69.8	-174.7	-174.5	-141.6	1.9	114.1	P157	P157-R159 HydrophobicContact CB-CG 4.44Å; P157-R159 PolarHBondContact O-N 2.85Å
160	Y	82.5	Confident	77.4	Confident	22 Å²	22	75.3 Å²	75.3	9%	0.086	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-103.3	-3.1	177.4	-55.9	-61.9	0	0	0	112.8	P157 K158 H173 Y282 E283	P157-Y160 HydrophobicContact CB-CD2 3.9Å; P157-Y160 HydrophobicContact CB-CE2 4.44Å; P157-Y160 HydrophobicContact CG-CD2 4.02Å; P157-Y160 HydrophobicContact CG-CE2 4.47Å; P157-Y160 PolarHBondContact O-N 3.13Å; K158-Y160 PolarHBondContact O-N 3.08Å; Y160-H173 AromaticContact CD1-CE1 3.76Å; Y160-H173 AromaticContact CD1-CG 3.92Å; Y160-H173 AromaticContact CD1-ND1 3.62Å; Y160-Y282 HydrophobicContact CD1-CD1 4.03Å; Y160-Y282 HydrophobicContact CD1-CG 4.11Å; Y160-Y282 AromaticContact CD2-CD1 3.71Å; Y160-Y282 HydrophobicContact CD2-CD1 3.71Å; Y160-Y282 AromaticContact CD2-CD2 3.77Å; Y160-Y282 HydrophobicContact CD2-CD2 3.77Å; Y160-Y282 AromaticContact CD2-CE1 3.99Å; Y160-Y282 HydrophobicContact CD2-CE1 3.99Å; Y160-Y282 HydrophobicContact CD2-CE2 4.05Å; Y160-Y282 AromaticContact CD2-CG 3.6Å; Y160-Y282 HydrophobicContact CD2-CG 3.6Å; Y160-Y282 HydrophobicContact CE1-CG 4.22Å; Y160-Y282 HydrophobicContact CE2-CD1 4.31Å; Y160-Y282 AromaticContact CE2-CD2 3.74Å; Y160-Y282 HydrophobicContact CE2-CD2 3.74Å; Y160-Y282 HydrophobicContact CE2-CE2 4.34Å; Y160-Y282 AromaticContact CE2-CG 3.73Å; Y160-Y282 HydrophobicContact CE2-CG 3.73Å; Y160-Y282 AromaticContact CG-CD1 3.56Å; Y160-Y282 HydrophobicContact CG-CD1 3.56Å; Y160-Y282 HydrophobicContact CG-CD2 4.44Å; Y160-Y282 AromaticContact CG-CE1 3.99Å; Y160-Y282 HydrophobicContact CG-CE1 3.99Å; Y160-Y282 AromaticContact CG-CG 3.81Å; Y160-Y282 HydrophobicContact CG-CG 3.81Å; Y160-E283 WeakPolarHBondContact CE1-OE1 3.49Å; Y160-E283 PolarHBondContact OH-OE1 3.49Å
161	K	76.6	Confident	75.6	Confident	81 Å²	81	78.9 Å²	78.9	35%	0.352	39%	0.385	S	S	.	.	S	Bend	trans	-69.9	133.8	174.8	-72.6	-160.2	175.8	-160.2	0	110.1	T156 P157 K158 K163	T156-K161 HydrophobicContact CG2-CG 4.09Å; T156-K161 WeakPolarHBondContact O-CE 3.35Å; P157-K161 PolarHBondContact O-N 3.03Å; K158-K161 PolarHBondContact O-N 3.31Å; K161-K163 PolarHBondContact O-N 3.49Å
162	L	68.3	Low	74	Confident	37 Å²	37	84.1 Å²	84.1	19%	0.194	41%	0.411	C	S	.	.			trans	-62.2	118.9	172.9	-61	175.1	0	0	0	109.4	N164 P165 N170 R175	L162-N164 PolarHBondContact O-N 3.5Å; L162-P165 HydrophobicContact CB-CG 4.43Å; L162-N170 HydrophobicContact CD2-CB 4.13Å; L162-N170 WeakPolarHBondContact CD2-O 3.24Å; L162-R175 VanDerWaalsContact CD1-NH2 3.32Å
163	K	64.2	Low	72.7	Confident	211 Å²	211	85.5 Å²	85.5	92%	0.917	42%	0.417	S	S	*	.	S	Bend	trans	-57.9	-38.8	175.7	-70	-174.1	-179.9	-179.9	0	111.9	K161	K161-K163 PolarHBondContact O-N 3.49Å
164	N	60.5	Low	71.8	Confident	58 Å²	58	85.3 Å²	85.3	31%	0.31	41%	0.412	S	S	.	.			trans	-132.7	106.1	168.1	-178.2	-1.4	0	0	0	108.2	L162 M166 A167 N170	L162-N164 PolarHBondContact O-N 3.5Å; N164-M166 PolarHBondContact O-N 2.86Å; N164-M166 VanDerWaalsContact O-N 3.12Å; N164-M166 WeakPolarHBondContact OD1-CA 3.31Å; N164-M166 WeakPolarHBondContact OD1-CB 3.37Å; N164-M166 VanDerWaalsContact OD1-CE 3.22Å; N164-M166 WeakPolarHBondContact OD1-CE 3.5Å; N164-M166 WeakPolarHBondContact OD1-CG 3.36Å; N164-M166 PolarHBondContact OD1-N 2.85Å; N164-A167 HydrophobicContact CB-CB 4.31Å; N164-A167 PolarHBondContact O-N 2.91Å; N164-N170 WeakPolarHBondContact CB-ND2 3.37Å; N164-N170 PolarHBondContact N-ND2 2.72Å; N164-N170 PolarHBondContact O-ND2 3.4Å
165	P	58.1	Low	71.2	Confident	70 Å²	70	89.3 Å²	89.3	46%	0.455	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.5	175.3	-23.6	32.9	0	0	0	113.5	L162 R175	L162-P165 HydrophobicContact CB-CG 4.43Å; P165-R175 PolarHBondContact O-NH2 2.54Å
166	M	53.4	Low	71	Confident	126 Å²	126	85.6 Å²	85.6	62%	0.621	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-19.6	-176.8	-50.4	178.4	-80.5	0	0	113.8	N164 V168 M322	N164-M166 PolarHBondContact O-N 2.86Å; N164-M166 VanDerWaalsContact O-N 3.12Å; N164-M166 WeakPolarHBondContact OD1-CA 3.31Å; N164-M166 WeakPolarHBondContact OD1-CB 3.37Å; N164-M166 VanDerWaalsContact OD1-CE 3.22Å; N164-M166 WeakPolarHBondContact OD1-CE 3.5Å; N164-M166 WeakPolarHBondContact OD1-CG 3.36Å; N164-M166 PolarHBondContact OD1-N 2.85Å; M166-V168 PolarHBondContact O-N 2.98Å; M166-M322 HydrophobicContact CG-CE 3.91Å; M166-M322 HydrophobicContact CG-SD 4.37Å; M166-M322 HydrophobicContact SD-CE 4.4Å; M166-M322 HydrophobicContact SD-SD 4.1Å
167	A	55.1	Low	71.1	Confident	28 Å²	28	85.1 Å²	85.1	23%	0.231	41%	0.406	C	S	.	.			trans	-84.6	110.6	177.2	0	0	0	0	0	108.8	N164 K169 N170	N164-A167 HydrophobicContact CB-CB 4.31Å; N164-A167 PolarHBondContact O-N 2.91Å; A167-K169 PolarHBondContact O-N 2.87Å; A167-K169 VanDerWaalsContact O-N 3.13Å; A167-N170 HydrophobicContact CB-CB 4.27Å; A167-N170 WeakPolarHBondContact O-CA 3.15Å; A167-N170 VanDerWaalsContact O-CB 3.31Å; A167-N170 WeakPolarHBondContact O-CB 3.47Å; A167-N170 PolarHBondContact O-N 2.71Å
168	V	53	Low	71.3	Confident	101 Å²	101	83.5 Å²	83.5	61%	0.612	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-51.8	-35	172.3	179.8	0	0	0	0	110.8	M166 N170 W171	M166-V168 PolarHBondContact O-N 2.98Å; V168-N170 PolarHBondContact O-N 2.86Å; V168-N170 VanDerWaalsContact O-N 3.11Å; V168-W171 WeakPolarHBondContact O-CB 3.32Å; V168-W171 PolarHBondContact O-N 2.64Å; V168-W171 VanDerWaalsContact O-N 3.11Å
169	K	51.8	Low	71.8	Confident	193 Å²	193	74.8 Å²	74.8	84%	0.839	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-57.6	-23.1	174	-167.5	174.4	-179.4	178.9	0	113.9	A167	A167-K169 PolarHBondContact O-N 2.87Å; A167-K169 VanDerWaalsContact O-N 3.13Å
170	N	53.4	Low	72.4	Confident	45 Å²	45	66.5 Å²	66.5	24%	0.241	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-86.4	-1.9	-179.9	-69	-13.4	0	0	0	113.9	L162 N164 A167 V168 I172	L162-N170 HydrophobicContact CD2-CB 4.13Å; L162-N170 WeakPolarHBondContact CD2-O 3.24Å; N164-N170 WeakPolarHBondContact CB-ND2 3.37Å; N164-N170 PolarHBondContact N-ND2 2.72Å; N164-N170 PolarHBondContact O-ND2 3.4Å; A167-N170 HydrophobicContact CB-CB 4.27Å; A167-N170 WeakPolarHBondContact O-CA 3.15Å; A167-N170 VanDerWaalsContact O-CB 3.31Å; A167-N170 WeakPolarHBondContact O-CB 3.47Å; A167-N170 PolarHBondContact O-N 2.71Å; V168-N170 PolarHBondContact O-N 2.86Å; V168-N170 VanDerWaalsContact O-N 3.11Å; N170-I172 PolarHBondContact O-N 3.12Å
171	W	60.8	Low	73.2	Confident	75 Å²	75	66.7 Å²	66.7	28%	0.284	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	54.9	176.6	-72.1	33.3	0	0	0	112.1	V168 R286	V168-W171 WeakPolarHBondContact O-CB 3.32Å; V168-W171 PolarHBondContact O-N 2.64Å; V168-W171 VanDerWaalsContact O-N 3.11Å; W171-R286 WeakPolarHBondContact O-CD 3.25Å
172	I	65.2	Low	74.2	Confident	114 Å²	114	64.1 Å²	64.1	59%	0.585	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-38.3	179.1	-58.4	169.7	0	0	0	109.1	N170	N170-I172 PolarHBondContact O-N 3.12Å
173	H	72.4	Confident	75.7	Confident	58 Å²	58	62.3 Å²	62.3	27%	0.269	32%	0.315	S	S	.	.	S	Bend	trans	-107	143.9	-178.1	-61	-61.7	0	0	0	112.4	Y160	Y160-H173 AromaticContact CD1-CE1 3.76Å; Y160-H173 AromaticContact CD1-CG 3.92Å; Y160-H173 AromaticContact CD1-ND1 3.62Å
174	P	79.2	Confident	77.3	Confident	31 Å²	31	52.3 Å²	52.3	20%	0.201	27%	0.272	C	S	.	.			trans	-63.1	143.2	173	27.2	-34.5	0	0	0	111.1	V177 Q289	P174-V177 HydrophobicContact CB-CG2 3.87Å; P174-V177 HydrophobicContact CG-CG2 3.65Å; P174-Q289 VanDerWaalsContact CB-OE1 3.25Å; P174-Q289 VanDerWaalsContact CG-OE1 3.27Å
175	R	85.6	Confident	79.1	Confident	100 Å²	100	53.1 Å²	53.1	38%	0.377	28%	0.279	S	S	.	.	S	Bend	trans	-90.8	153.5	174.8	-61.7	-178.4	-176.8	-157.6	-2.2	110.1	L162 P165 V177 R180	L162-R175 VanDerWaalsContact CD1-NH2 3.32Å; P165-R175 PolarHBondContact O-NH2 2.54Å; R175-V177 VanDerWaalsContact C-N 3.31Å; R175-V177 PolarHBondContact O-N 2.9Å; R175-R180 PolarHBondContact O-NH1 2.66Å
176	G	91.9	Very high	81	Confident	9 Å²	9	51 Å²	51	9%	0.093	26%	0.262	C	S	.	.	S	Bend	trans	80.4	3.2	170.5	0	0	0	0	0	115.3	Q179 R180	G176-Q179 PolarHBondContact O-N 3.23Å; G176-Q179 PolarHBondContact O-OE1 3.34Å; G176-R180 WeakPolarHBondContact O-CB 3.41Å; G176-R180 VanDerWaalsContact O-CG 3.29Å; G176-R180 WeakPolarHBondContact O-CG 3.42Å; G176-R180 PolarHBondContact O-N 3.23Å
177	V	95.3	Very high	83.1	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-54.3	-174.1	173.3	0	0	0	0	111.9	P174 R175 Q179 N181 F280 Y282	P174-V177 HydrophobicContact CB-CG2 3.87Å; P174-V177 HydrophobicContact CG-CG2 3.65Å; R175-V177 VanDerWaalsContact C-N 3.31Å; R175-V177 PolarHBondContact O-N 2.9Å; V177-Q179 PolarHBondContact O-N 3.04Å; V177-N181 VanDerWaalsContact O-CB 3.32Å; V177-N181 WeakPolarHBondContact O-CB 3.32Å; V177-N181 VanDerWaalsContact O-CG 3.24Å; V177-N181 PolarHBondContact O-N 3.27Å; V177-N181 PolarHBondContact O-ND2 3.46Å; V177-F280 HydrophobicContact CB-CB 4.45Å; V177-F280 HydrophobicContact CG1-CB 3.92Å; V177-F280 HydrophobicContact CG2-CB 4.45Å; V177-Y282 HydrophobicContact CB-CD1 3.99Å; V177-Y282 HydrophobicContact CB-CD2 4.27Å; V177-Y282 HydrophobicContact CB-CE1 3.61Å; V177-Y282 HydrophobicContact CB-CE2 3.91Å; V177-Y282 HydrophobicContact CB-CG 4.3Å; V177-Y282 HydrophobicContact CG1-CD1 4.25Å; V177-Y282 HydrophobicContact CG1-CD2 3.69Å; V177-Y282 HydrophobicContact CG1-CE1 4.14Å; V177-Y282 HydrophobicContact CG1-CE2 3.55Å; V177-Y282 HydrophobicContact CG1-CG 4.04Å; V177-Y282 HydrophobicContact CG2-CD1 4.02Å; V177-Y282 HydrophobicContact CG2-CE1 4.02Å; V177-Y282 HydrophobicContact CG2-CG 4.45Å
178	A	97.1	Very high	85.1	Confident	19 Å²	19	46 Å²	46	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-60	-36.9	178.7	0	0	0	0	0	111.9	A154 A182 Y282	A154-A178 HydrophobicContact CB-CB 4.24Å; A178-A182 WeakPolarHBondContact O-CB 3.44Å; A178-A182 PolarHBondContact O-N 3.28Å; A178-Y282 VanDerWaalsContact CB-OH 3.23Å; A178-Y282 WeakPolarHBondContact CB-OH 3.36Å; A178-Y282 PolarHBondContact N-OH 2.97Å
179	Q	98.3	Very high	87.2	Confident	3 Å²	3	45.6 Å²	45.6	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-71.3	-49.2	-175.7	-64.5	77	20.8	0	0	111.4	P99 V128 D130 A154 T156 G176 V177 N181 A182 A183	P99-Q179 HydrophobicContact CB-CB 3.73Å; P99-Q179 HydrophobicContact CB-CG 4.22Å; P99-Q179 HydrophobicContact CG-CB 4.06Å; V128-Q179 HydrophobicContact CB-CB 3.85Å; V128-Q179 HydrophobicContact CB-CG 4.27Å; V128-Q179 HydrophobicContact CG1-CB 3.74Å; V128-Q179 HydrophobicContact CG1-CG 3.91Å; D130-Q179 VanDerWaalsContact CB-NE2 3.29Å; D130-Q179 VanDerWaalsContact CG-NE2 3.27Å; A154-Q179 PolarHBondContact O-NE2 3.06Å; T156-Q179 PolarHBondContact OG1-NE2 3.05Å; T156-Q179 VanDerWaalsContact OG1-NE2 3.09Å; G176-Q179 PolarHBondContact O-N 3.23Å; G176-Q179 PolarHBondContact O-OE1 3.34Å; V177-Q179 PolarHBondContact O-N 3.04Å; Q179-N181 VanDerWaalsContact C-N 3.32Å; Q179-N181 PolarHBondContact O-N 3.09Å; Q179-A182 PolarHBondContact O-N 3.1Å; Q179-A183 PolarHBondContact O-N 3.48Å
180	R	98.4	Very high	89.3	Confident	15 Å²	15	38.7 Å²	38.7	6%	0.057	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-40.6	174.8	-66.6	-177.6	-172.1	107.3	2	111	V97 P99 R175 G176 A183 L184 F201 D203 F280	V97-R180 HydrophobicContact CG1-CG 4.48Å; P99-R180 HydrophobicContact CG-CG 3.82Å; R175-R180 PolarHBondContact O-NH1 2.66Å; G176-R180 WeakPolarHBondContact O-CB 3.41Å; G176-R180 VanDerWaalsContact O-CG 3.29Å; G176-R180 WeakPolarHBondContact O-CG 3.42Å; G176-R180 PolarHBondContact O-N 3.23Å; R180-A183 PolarHBondContact O-N 3.27Å; R180-L184 VanDerWaalsContact O-CG 3.29Å; R180-L184 WeakPolarHBondContact O-CG 3.48Å; R180-L184 PolarHBondContact O-N 2.79Å; R180-F201 HydrophobicContact CB-CD1 4.42Å; R180-F201 HydrophobicContact CB-CE1 3.93Å; R180-F201 HydrophobicContact CG-CD1 3.81Å; R180-F201 HydrophobicContact CG-CE1 3.83Å; R180-D203 IonicContact NH2-OD1 2.83Å; R180-D203 PolarHBondContact NH2-OD1 3.01Å; R180-F280 HydrophobicContact CB-CD2 3.42Å; R180-F280 VanDerWaalsContact CB-CD2 3.42Å; R180-F280 HydrophobicContact CB-CE2 3.44Å; R180-F280 VanDerWaalsContact CB-CE2 3.44Å; R180-F280 HydrophobicContact CB-CG 4.4Å; R180-F280 HydrophobicContact CB-CZ 4.41Å; R180-F280 HydrophobicContact CG-CD2 4.37Å; R180-F280 HydrophobicContact CG-CE2 4.11Å
181	N	98.4	Very high	91.4	Very high	27 Å²	27	37.2 Å²	37.2	14%	0.144	20%	0.196	C	C	.	.	H	α-helix	trans	-63.7	-42.1	175.3	-74.4	-11.1	0	0	0	112.9	V177 Q179 A183 L184 T185 L279 F280	V177-N181 VanDerWaalsContact O-CB 3.32Å; V177-N181 WeakPolarHBondContact O-CB 3.32Å; V177-N181 VanDerWaalsContact O-CG 3.24Å; V177-N181 PolarHBondContact O-N 3.27Å; V177-N181 PolarHBondContact O-ND2 3.46Å; Q179-N181 VanDerWaalsContact C-N 3.32Å; Q179-N181 PolarHBondContact O-N 3.09Å; N181-A183 VanDerWaalsContact C-N 3.3Å; N181-A183 PolarHBondContact O-N 3.18Å; N181-L184 PolarHBondContact O-N 2.89Å; N181-T185 WeakPolarHBondContact O-CB 3.46Å; N181-T185 PolarHBondContact O-N 3.29Å; N181-T185 PolarHBondContact O-OG1 2.98Å; N181-T185 VanDerWaalsContact O-OG1 3.1Å; N181-L279 HydrophobicContact CB-CD2 4.11Å; N181-F280 PolarHBondContact ND2-O 2.93Å; N181-F280 WeakPolarHBondContact OD1-CB 3.19Å; N181-F280 PolarHBondContact OD1-N 2.87Å
182	A	98.6	Very high	93	Very high	26 Å²	26	36.1 Å²	36.1	22%	0.215	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-40	175.7	0	0	0	0	0	111.7	V128 A154 A178 Q179 W186	V128-A182 HydrophobicContact CG1-CB 4.23Å; A154-A182 HydrophobicContact CB-CB 3.7Å; A178-A182 WeakPolarHBondContact O-CB 3.44Å; A178-A182 PolarHBondContact O-N 3.28Å; Q179-A182 PolarHBondContact O-N 3.1Å; A182-W186 WeakPolarHBondContact O-CB 3.42Å; A182-W186 PolarHBondContact O-N 2.9Å
183	A	98.6	Very high	94.3	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-44.5	173.7	0	0	0	0	0	112.5	V97 I126 V128 Q179 R180 N181 T185 W186 L187	V97-A183 HydrophobicContact CB-CB 4.23Å; V97-A183 HydrophobicContact CG1-CB 3.46Å; V97-A183 VanDerWaalsContact CG1-CB 3.46Å; V97-A183 HydrophobicContact CG2-CB 3.68Å; I126-A183 HydrophobicContact CG2-CB 3.91Å; V128-A183 HydrophobicContact CG2-CB 4.09Å; Q179-A183 PolarHBondContact O-N 3.48Å; R180-A183 PolarHBondContact O-N 3.27Å; N181-A183 VanDerWaalsContact C-N 3.3Å; N181-A183 PolarHBondContact O-N 3.18Å; A183-T185 PolarHBondContact O-N 3.05Å; A183-W186 PolarHBondContact O-N 3.44Å; A183-L187 WeakPolarHBondContact O-CB 3.18Å; A183-L187 VanDerWaalsContact O-CG 3.29Å; A183-L187 WeakPolarHBondContact O-CG 3.27Å; A183-L187 PolarHBondContact O-N 2.73Å
184	L	98.5	Very high	95.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-44.7	176	-70.8	173.8	0	0	0	111.9	R180 N181 L187 R188 L199 F201 V272 L279 F280 F293	R180-L184 VanDerWaalsContact O-CG 3.29Å; R180-L184 WeakPolarHBondContact O-CG 3.48Å; R180-L184 PolarHBondContact O-N 2.79Å; N181-L184 PolarHBondContact O-N 2.89Å; L184-L187 PolarHBondContact O-N 2.86Å; L184-R188 WeakPolarHBondContact O-CG 3.35Å; L184-R188 PolarHBondContact O-N 3.29Å; L184-L199 HydrophobicContact CD2-CD2 3.76Å; L184-F201 HydrophobicContact CD2-CZ 4.34Å; L184-V272 HydrophobicContact CD2-CG1 3.49Å; L184-V272 VanDerWaalsContact CD2-CG1 3.49Å; L184-L279 HydrophobicContact CB-CD2 4.46Å; L184-L279 HydrophobicContact CD1-CD2 4.37Å; L184-F280 HydrophobicContact CD1-CD2 3.99Å; L184-F280 HydrophobicContact CD1-CE2 3.94Å; L184-F293 HydrophobicContact CD1-CE2 3.93Å; L184-F293 HydrophobicContact CD2-CE2 4.36Å; L184-F293 HydrophobicContact CD2-CZ 4.46Å
185	T	98.1	Very high	96	Very high	75 Å²	75	38 Å²	38	46%	0.46	22%	0.216	S	C	.	.	H	α-helix	trans	-60.9	-46.9	174.5	-62.5	0	0	0	0	110.9	N181 A183 L187 R188 S189	N181-T185 WeakPolarHBondContact O-CB 3.46Å; N181-T185 PolarHBondContact O-N 3.29Å; N181-T185 PolarHBondContact O-OG1 2.98Å; N181-T185 VanDerWaalsContact O-OG1 3.1Å; A183-T185 PolarHBondContact O-N 3.05Å; T185-L187 PolarHBondContact O-N 3.29Å; T185-R188 PolarHBondContact O-N 3.38Å; T185-S189 PolarHBondContact O-N 3.41Å; T185-S189 PolarHBondContact O-OG 3.03Å; T185-S189 VanDerWaalsContact O-OG 3.13Å
186	W	98.2	Very high	96.5	Very high	25 Å²	25	40.4 Å²	40.4	10%	0.095	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-45.8	178	-176	93.4	0	0	0	111.9	L124 I126 V150 L152 A182 A183 R188 S189 N190	L124-W186 HydrophobicContact CD2-CH2 3.79Å; L124-W186 HydrophobicContact CD2-CZ3 3.73Å; I126-W186 HydrophobicContact CD1-CE3 3.84Å; I126-W186 HydrophobicContact CD1-CZ3 3.94Å; V150-W186 HydrophobicContact CB-CZ2 4.39Å; V150-W186 HydrophobicContact CG1-CD2 4.05Å; V150-W186 HydrophobicContact CG1-CG 4.4Å; V150-W186 HydrophobicContact CG1-CZ2 4.13Å; V150-W186 HydrophobicContact CG2-CH2 3.55Å; V150-W186 HydrophobicContact CG2-CZ2 3.4Å; V150-W186 HydrophobicContact CG2-CZ3 4.16Å; L152-W186 HydrophobicContact CD1-CB 3.73Å; L152-W186 HydrophobicContact CD1-CG 4Å; L152-W186 HydrophobicContact CD2-CG 4.39Å; A182-W186 WeakPolarHBondContact O-CB 3.42Å; A182-W186 PolarHBondContact O-N 2.9Å; A183-W186 PolarHBondContact O-N 3.44Å; W186-R188 PolarHBondContact O-N 3.31Å; W186-S189 PolarHBondContact O-N 3.44Å; W186-N190 HydrophobicContact CD2-CB 4.36Å; W186-N190 HydrophobicContact CE3-CB 4.44Å; W186-N190 HydrophobicContact CH2-CB 3.95Å; W186-N190 HydrophobicContact CZ2-CB 3.89Å; W186-N190 HydrophobicContact CZ3-CB 4.25Å; W186-N190 PolarHBondContact NE1-ND2 3.23Å; W186-N190 WeakPolarHBondContact O-CB 3.44Å; W186-N190 PolarHBondContact O-N 3.47Å; W186-N190 PolarHBondContact O-ND2 2.91Å
187	L	98.2	Very high	96.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.9	-47.1	177.4	-74.7	163.5	0	0	0	111.2	Y95 V97 I126 A183 L184 T185 S189 N190 L191 L199 I269	Y95-L187 HydrophobicContact CD1-CD2 3.65Å; Y95-L187 HydrophobicContact CE1-CD2 4.28Å; Y95-L187 HydrophobicContact CG-CD2 3.85Å; V97-L187 HydrophobicContact CG2-CD1 4.43Å; I126-L187 HydrophobicContact CD1-CD1 4.23Å; I126-L187 HydrophobicContact CD1-CD2 3.6Å; I126-L187 HydrophobicContact CD1-CG 3.83Å; A183-L187 WeakPolarHBondContact O-CB 3.18Å; A183-L187 VanDerWaalsContact O-CG 3.29Å; A183-L187 WeakPolarHBondContact O-CG 3.27Å; A183-L187 PolarHBondContact O-N 2.73Å; L184-L187 PolarHBondContact O-N 2.86Å; T185-L187 PolarHBondContact O-N 3.29Å; L187-S189 VanDerWaalsContact C-N 3.3Å; L187-S189 PolarHBondContact O-N 2.92Å; L187-N190 PolarHBondContact O-N 3.05Å; L187-L191 HydrophobicContact CB-CD1 4.35Å; L187-L191 HydrophobicContact CD2-CD1 3.57Å; L187-L191 HydrophobicContact CD2-CG 4.27Å; L187-L191 VanDerWaalsContact O-CB 3.24Å; L187-L191 WeakPolarHBondContact O-CB 3.35Å; L187-L191 WeakPolarHBondContact O-CG 3.36Å; L187-L191 PolarHBondContact O-N 3.44Å; L187-L199 HydrophobicContact CD1-CD1 3.74Å; L187-I269 HydrophobicContact CD1-CD1 4.26Å; L187-I269 HydrophobicContact CD2-CD1 4.39Å
188	R	96.9	Very high	96.9	Very high	50 Å²	50	40.3 Å²	40.3	19%	0.189	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-34.1	177.8	-71.9	175.1	-176.2	128.1	9	113.3	L184 T185 W186 V272 L273 K275 P276 L278	L184-R188 WeakPolarHBondContact O-CG 3.35Å; L184-R188 PolarHBondContact O-N 3.29Å; T185-R188 PolarHBondContact O-N 3.38Å; W186-R188 PolarHBondContact O-N 3.31Å; R188-V272 PolarHBondContact NE-O 2.88Å; R188-V272 PolarHBondContact NH2-O 2.89Å; R188-L273 HydrophobicContact CG-CD2 3.99Å; R188-K275 PolarHBondContact NH2-O 3.33Å; R188-P276 VanDerWaalsContact CZ-O 3.32Å; R188-P276 PolarHBondContact NH1-O 3.34Å; R188-L278 PolarHBondContact NH1-O 3.45Å; R188-L278 PolarHBondContact NH2-O 3.44Å
189	S	96.4	Very high	97	Very high	93 Å²	93	39.5 Å²	39.5	65%	0.65	22%	0.221	S	C	*	.	H	α-helix	trans	-80.4	-21.2	179.7	-59.9	0	0	0	0	114	T185 W186 L187	T185-S189 PolarHBondContact O-N 3.41Å; T185-S189 PolarHBondContact O-OG 3.03Å; T185-S189 VanDerWaalsContact O-OG 3.13Å; W186-S189 PolarHBondContact O-N 3.44Å; L187-S189 VanDerWaalsContact C-N 3.3Å; L187-S189 PolarHBondContact O-N 2.92Å
190	N	97	Very high	97	Very high	47 Å²	47	39.3 Å²	39.3	25%	0.251	22%	0.22	S	C	.	.	H	α-helix	trans	-115.8	-15.7	-171.8	-69.1	-90.2	0	0	0	114.1	W186 L187	W186-N190 HydrophobicContact CD2-CB 4.36Å; W186-N190 HydrophobicContact CE3-CB 4.44Å; W186-N190 HydrophobicContact CH2-CB 3.95Å; W186-N190 HydrophobicContact CZ2-CB 3.89Å; W186-N190 HydrophobicContact CZ3-CB 4.25Å; W186-N190 PolarHBondContact NE1-ND2 3.23Å; W186-N190 WeakPolarHBondContact O-CB 3.44Å; W186-N190 PolarHBondContact O-N 3.47Å; W186-N190 PolarHBondContact O-ND2 2.91Å; L187-N190 PolarHBondContact O-N 3.05Å
191	L	96.4	Very high	97	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.073	22%	0.218	C	C	.	.	S	Bend	trans	-100.7	146.7	176.8	-58	-174.8	0	0	0	111.3	L84 Y95 L187 T195 I269 L273	L84-L191 HydrophobicContact CD1-CD2 3.91Å; Y95-L191 HydrophobicContact CD1-CD1 4.3Å; Y95-L191 HydrophobicContact CD2-CD1 4.42Å; Y95-L191 HydrophobicContact CE1-CD1 3.79Å; Y95-L191 HydrophobicContact CE1-CD2 3.88Å; Y95-L191 HydrophobicContact CE1-CG 4.46Å; Y95-L191 HydrophobicContact CE2-CD1 3.9Å; L187-L191 HydrophobicContact CB-CD1 4.35Å; L187-L191 HydrophobicContact CD2-CD1 3.57Å; L187-L191 HydrophobicContact CD2-CG 4.27Å; L187-L191 VanDerWaalsContact O-CB 3.24Å; L187-L191 WeakPolarHBondContact O-CB 3.35Å; L187-L191 WeakPolarHBondContact O-CG 3.36Å; L187-L191 PolarHBondContact O-N 3.44Å; L191-T195 HydrophobicContact CB-CG2 4.46Å; L191-T195 HydrophobicContact CD1-CG2 4.21Å; L191-T195 HydrophobicContact CD2-CG2 4.38Å; L191-I269 HydrophobicContact CD1-CD1 4.25Å; L191-I269 HydrophobicContact CD1-CG1 3.9Å; L191-L273 HydrophobicContact CB-CD1 4.13Å; L191-L273 HydrophobicContact CB-CD2 4.35Å
192	S	95.1	Very high	97	Very high	52 Å²	52	37.4 Å²	37.4	36%	0.364	21%	0.211	S	C	.	.			trans	-71.6	144.8	169.2	173.1	0	0	0	0	109.3	L194 T195 L273	S192-L194 PolarHBondContact O-N 2.89Å; S192-L194 PolarHBondContact OG-N 3.2Å; S192-T195 PolarHBondContact N-OG1 2.91Å; S192-T195 WeakPolarHBondContact O-CB 3.1Å; S192-T195 PolarHBondContact O-N 3.29Å; S192-T195 PolarHBondContact O-OG1 3.01Å; S192-L273 WeakPolarHBondContact O-CD1 3.33Å
193	P	92.6	Very high	96.9	Very high	90 Å²	90	37.6 Å²	37.6	58%	0.584	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-25.1	171.3	-26.2	35	0	0	0	113.5
194	L	92.7	Very high	96.8	Very high	132 Å²	132	38 Å²	38	69%	0.691	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.2	178.3	-59.3	179.6	0	0	0	113.7	S192 K196 R270	S192-L194 PolarHBondContact O-N 2.89Å; S192-L194 PolarHBondContact OG-N 3.2Å; L194-K196 PolarHBondContact O-N 2.89Å; L194-R270 PolarHBondContact O-NE 3.46Å; L194-R270 PolarHBondContact O-NH2 3.45Å
195	T	94.8	Very high	96.7	Very high	21 Å²	21	39.4 Å²	39.4	13%	0.129	22%	0.218	C	C	.	.			trans	-56	136	179.1	-69	0	0	0	0	110.6	Y95 L191 S192 I269 R270	Y95-T195 HydrophobicContact CE2-CG2 4.3Å; Y95-T195 WeakPolarHBondContact OH-CG2 3.42Å; L191-T195 HydrophobicContact CB-CG2 4.46Å; L191-T195 HydrophobicContact CD1-CG2 4.21Å; L191-T195 HydrophobicContact CD2-CG2 4.38Å; S192-T195 PolarHBondContact N-OG1 2.91Å; S192-T195 WeakPolarHBondContact O-CB 3.1Å; S192-T195 PolarHBondContact O-N 3.29Å; S192-T195 PolarHBondContact O-OG1 3.01Å; T195-I269 HydrophobicContact CG2-CG2 4.48Å; T195-R270 WeakPolarHBondContact O-CG 3.45Å; T195-R270 PolarHBondContact O-NE 2.96Å; T195-R270 VanDerWaalsContact O-NE 3.13Å
196	K	94.9	Very high	96.7	Very high	151 Å²	151	35.8 Å²	35.8	66%	0.657	20%	0.196	S	C	*	.			trans	-100	140.9	172.4	-64.4	179.6	-176.9	176.3	0	108.5	L194	L194-K196 PolarHBondContact O-N 2.89Å
197	G	97.2	Very high	96.7	Very high	5 Å²	5	37 Å²	37	5%	0.052	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.5	-174.5	-179.6	0	0	0	0	0	112.3	T93 I269	T93-G197 CarbonylContact O-C 3.53Å; T93-G197 WeakPolarHBondContact O-CA 3.22Å; G197-I269 WeakPolarHBondContact O-CG2 3.47Å; G197-I269 PolarHBondContact O-N 3.44Å
198	V	98.5	Very high	96.7	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	127.5	-172	-177.7	0	0	0	0	108.8	T93 I94 Y95 M216 A266 V267	T93-V198 PolarHBondContact O-N 3.21Å; I94-V198 CarbonylContact C-O 3.57Å; I94-V198 WeakPolarHBondContact CA-O 3.29Å; Y95-V198 PolarHBondContact N-O 3Å; V198-M216 HydrophobicContact CG1-CB 4.37Å; V198-M216 HydrophobicContact CG1-CG 4.49Å; V198-M216 WeakPolarHBondContact CG2-O 3.42Å; V198-A266 HydrophobicContact CG1-CB 3.61Å; V198-V267 CarbonylContact C-O 3.57Å; V198-V267 WeakPolarHBondContact CA-O 3.37Å
199	L	98.7	Very high	96.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	129.6	169.9	177.1	64.1	0	0	0	109.3	V97 L184 L187 F201 A266 V267 I269 V272 F293	V97-L199 HydrophobicContact CG2-CD1 3.64Å; L184-L199 HydrophobicContact CD2-CD2 3.76Å; L187-L199 HydrophobicContact CD1-CD1 3.74Å; L199-F201 HydrophobicContact CD1-CZ 4.46Å; L199-F201 HydrophobicContact CD2-CE2 3.87Å; L199-F201 HydrophobicContact CD2-CZ 3.69Å; L199-F201 HydrophobicContact CG-CE2 4.2Å; L199-F201 HydrophobicContact CG-CZ 4.19Å; L199-A266 WeakPolarHBondContact O-CA 3.19Å; L199-V267 PolarHBondContact N-O 2.99Å; L199-V267 PolarHBondContact O-N 3.15Å; L199-I269 HydrophobicContact CB-CD1 4.08Å; L199-V272 HydrophobicContact CD2-CG1 4.23Å; L199-V272 HydrophobicContact CD2-CG2 3.83Å; L199-F293 HydrophobicContact CD2-CZ 4.17Å
200	Y	98.8	Very high	96.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.9	174.6	-178.5	-130.2	0	0	0	110.9	Y95 V96 V97 A202 Y208 F213 M216 W225 A263 F265 A266	Y95-Y200 PolarHBondContact O-N 3.43Å; V96-Y200 CarbonylContact C-O 3.53Å; V96-Y200 WeakPolarHBondContact CA-O 3.41Å; V96-Y200 HydrophobicContact CG2-CD1 4.34Å; V97-Y200 PolarHBondContact N-O 3.24Å; Y200-A202 HydrophobicContact CD1-CB 4.16Å; Y200-A202 HydrophobicContact CE1-CB 3.89Å; Y200-Y208 HydrophobicContact CE1-CD1 4.31Å; Y200-Y208 HydrophobicContact CE1-CE1 4.15Å; Y200-Y208 WeakPolarHBondContact OH-CD1 3.29Å; Y200-Y208 WeakPolarHBondContact OH-CE1 3.47Å; Y200-F213 HydrophobicContact CD1-CE1 4.16Å; Y200-F213 HydrophobicContact CE1-CE1 4.12Å; Y200-M216 HydrophobicContact CD1-CE 3.71Å; Y200-M216 HydrophobicContact CD1-SD 4Å; Y200-M216 HydrophobicContact CD2-CE 4.1Å; Y200-M216 HydrophobicContact CD2-SD 4.41Å; Y200-M216 HydrophobicContact CE1-CE 3.83Å; Y200-M216 HydrophobicContact CE2-CE 4.26Å; Y200-M216 HydrophobicContact CG-CE 3.83Å; Y200-M216 HydrophobicContact CG-SD 3.82Å; Y200-W225 HydrophobicContact CD2-CH2 4.12Å; Y200-W225 HydrophobicContact CD2-CZ2 4.01Å; Y200-W225 AromaticContact CE2-CH2 3.95Å; Y200-W225 HydrophobicContact CE2-CH2 3.95Å; Y200-W225 AromaticContact CE2-CZ2 3.38Å; Y200-W225 HydrophobicContact CE2-CZ2 3.38Å; Y200-W225 AromaticContact CZ-CZ2 3.88Å; Y200-A263 PolarHBondContact OH-O 3.14Å; Y200-F265 VanDerWaalsContact CD2-O 3.31Å; Y200-F265 WeakPolarHBondContact CD2-O 3.16Å; Y200-A266 HydrophobicContact CD2-CB 4.26Å
201	F	98.6	Very high	96.9	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	117.4	174.5	-64.2	-74.6	0	0	0	109	V97 R180 L184 L199 M262 F265 F280 F293	V97-F201 HydrophobicContact CB-CD1 3.72Å; V97-F201 HydrophobicContact CB-CE1 4Å; V97-F201 HydrophobicContact CG1-CD1 3.85Å; V97-F201 HydrophobicContact CG1-CE1 3.98Å; V97-F201 HydrophobicContact CG2-CD1 4.48Å; V97-F201 HydrophobicContact CG2-CE1 4.33Å; R180-F201 HydrophobicContact CB-CD1 4.42Å; R180-F201 HydrophobicContact CB-CE1 3.93Å; R180-F201 HydrophobicContact CG-CD1 3.81Å; R180-F201 HydrophobicContact CG-CE1 3.83Å; L184-F201 HydrophobicContact CD2-CZ 4.34Å; L199-F201 HydrophobicContact CD1-CZ 4.46Å; L199-F201 HydrophobicContact CD2-CE2 3.87Å; L199-F201 HydrophobicContact CD2-CZ 3.69Å; L199-F201 HydrophobicContact CG-CE2 4.2Å; L199-F201 HydrophobicContact CG-CZ 4.19Å; F201-M262 HydrophobicContact CB-CG 3.66Å; F201-M262 HydrophobicContact CB-SD 4.23Å; F201-M262 HydrophobicContact CD2-CG 4.47Å; F201-M262 HydrophobicContact CD2-SD 3.93Å; F201-M262 HydrophobicContact CG-CG 4.19Å; F201-M262 HydrophobicContact CG-SD 4.12Å; F201-F265 HydrophobicContact CD2-CE2 4.33Å; F201-F280 HydrophobicContact CD2-CZ 4.44Å; F201-F280 AromaticContact CE1-CE2 3.87Å; F201-F280 HydrophobicContact CE1-CE2 3.87Å; F201-F280 HydrophobicContact CE1-CZ 4.2Å; F201-F280 HydrophobicContact CE2-CE2 4.16Å; F201-F280 AromaticContact CE2-CZ 3.81Å; F201-F280 HydrophobicContact CE2-CZ 3.81Å; F201-F280 AromaticContact CZ-CE2 3.53Å; F201-F280 HydrophobicContact CZ-CE2 3.53Å; F201-F280 AromaticContact CZ-CZ 3.67Å; F201-F280 HydrophobicContact CZ-CZ 3.67Å; F201-F293 HydrophobicContact CE2-CD1 4.33Å; F201-F293 AromaticContact CE2-CE1 3.68Å; F201-F293 HydrophobicContact CE2-CE1 3.68Å; F201-F293 AromaticContact CE2-CZ 3.81Å; F201-F293 HydrophobicContact CE2-CZ 3.81Å; F201-F293 HydrophobicContact CZ-CE1 4.34Å; F201-F293 HydrophobicContact CZ-CE2 4.44Å; F201-F293 HydrophobicContact CZ-CZ 4Å
202	A	98	Very high	97	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.			trans	-122.3	111.1	-178.4	0	0	0	0	0	109.8	V96 V97 T98 Y200 Y208	V96-A202 HydrophobicContact CG1-CB 3.56Å; V97-A202 PolarHBondContact O-N 2.94Å; T98-A202 VanDerWaalsContact CA-O 3.31Å; T98-A202 WeakPolarHBondContact CA-O 3.42Å; T98-A202 WeakPolarHBondContact CB-O 3.33Å; T98-A202 WeakPolarHBondContact CG2-O 3.41Å; T98-A202 PolarHBondContact OG1-O 3.33Å; Y200-A202 HydrophobicContact CD1-CB 4.16Å; Y200-A202 HydrophobicContact CE1-CB 3.89Å; A202-Y208 VanDerWaalsContact C-OH 3.28Å; A202-Y208 VanDerWaalsContact CA-OH 3.22Å; A202-Y208 WeakPolarHBondContact CA-OH 3.22Å; A202-Y208 HydrophobicContact CB-CE1 4.33Å; A202-Y208 HydrophobicContact CB-CE2 4.26Å; A202-Y208 WeakPolarHBondContact CB-OH 3.49Å
203	D	96.5	Very high	97.2	Very high	31 Å²	31	36.9 Å²	36.9	17%	0.166	19%	0.188	C	C	.	.			trans	-63	141.9	171	-73	4	0	0	0	110	R180 D205 N206 Y208	R180-D203 IonicContact NH2-OD1 2.83Å; R180-D203 PolarHBondContact NH2-OD1 3.01Å; D203-D205 VanDerWaalsContact C-N 3.3Å; D203-D205 PolarHBondContact O-N 3.34Å; D203-N206 HydrophobicContact CB-CB 4.41Å; D203-Y208 PolarHBondContact N-OH 3.01Å; D203-Y208 PolarHBondContact O-OH 3.43Å
204	D	97.1	Very high	97.4	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.037	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.8	-172	61.1	1.3	0	0	0	113.7	T98 T100 R103 L110	T98-D204 HydrophobicContact CG2-CB 3.63Å; T100-D204 WeakPolarHBondContact CB-OD2 3.39Å; T100-D204 PolarHBondContact OG1-OD2 3.11Å; R103-D204 IonicContact CZ-OD1 3.32Å; R103-D204 IonicContact CZ-OD2 2.94Å; R103-D204 IonicContact NH1-OD1 3.47Å; R103-D204 IonicContact NH1-OD2 3.46Å; R103-D204 PolarHBondContact NH1-OD2 2.83Å; R103-D204 IonicContact NH2-OD1 2.69Å; R103-D204 PolarHBondContact NH2-OD1 3.37Å; R103-D204 IonicContact NH2-OD2 3.11Å; R103-D204 PolarHBondContact NH2-OD2 2.86Å; L110-D204 HydrophobicContact CD2-CB 4.02Å
205	D	95.9	Very high	97.6	Very high	30 Å²	30	34.7 Å²	34.7	16%	0.16	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-4.9	-178.8	65.6	-15.8	0	0	0	114.2	R112 D203 T318	R112-D205 PolarHBondContact NH2-O 3.19Å; D203-D205 VanDerWaalsContact C-N 3.3Å; D203-D205 PolarHBondContact O-N 3.34Å; D205-T318 PolarHBondContact O-OG1 3.45Å; D205-T318 VanDerWaalsContact O-OG1 3.09Å
206	N	97.6	Very high	97.8	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.16	C	C	.	.			trans	-78.5	164.9	175.6	-80.7	-2	0	0	0	113.3	R112 D203 Y208 H317	R112-N206 PolarHBondContact NH1-O 3.23Å; D203-N206 HydrophobicContact CB-CB 4.41Å; N206-Y208 HydrophobicContact CB-CE1 4.2Å; N206-Y208 HydrophobicContact CB-CE2 3.86Å; N206-Y208 VanDerWaalsContact CB-OH 3.28Å; N206-Y208 WeakPolarHBondContact CB-OH 3.22Å; N206-H317 PolarHBondContact ND2-ND1 3.3Å; N206-H317 WeakPolarHBondContact OD1-CA 3.25Å; N206-H317 PolarHBondContact OD1-ND1 2.85Å
207	T	98.3	Very high	97.9	Very high	50 Å²	50	27.3 Å²	27.3	31%	0.307	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.4	176.4	-56.6	0	0	0	0	110.3	W316 T318	T207-W316 HydrophobicContact CG2-CE3 4.15Å; T207-W316 PolarHBondContact N-O 3.39Å; T207-W316 PolarHBondContact O-N 2.94Å; T207-T318 WeakPolarHBondContact OG1-CG2 3.41Å; T207-T318 PolarHBondContact OG1-OG1 3.42Å
208	Y	98.6	Very high	97.8	Very high	10 Å²	10	30.4 Å²	30.4	4%	0.039	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.6	-175.7	-50.1	-85	0	0	0	110.5	L113 Y200 A202 D203 N206 F213 A263 V315	L113-Y208 HydrophobicContact CD1-CD2 3.85Å; L113-Y208 HydrophobicContact CD1-CE2 3.83Å; Y200-Y208 HydrophobicContact CE1-CD1 4.31Å; Y200-Y208 HydrophobicContact CE1-CE1 4.15Å; Y200-Y208 WeakPolarHBondContact OH-CD1 3.29Å; Y200-Y208 WeakPolarHBondContact OH-CE1 3.47Å; A202-Y208 VanDerWaalsContact C-OH 3.28Å; A202-Y208 VanDerWaalsContact CA-OH 3.22Å; A202-Y208 WeakPolarHBondContact CA-OH 3.22Å; A202-Y208 HydrophobicContact CB-CE1 4.33Å; A202-Y208 HydrophobicContact CB-CE2 4.26Å; A202-Y208 WeakPolarHBondContact CB-OH 3.49Å; D203-Y208 PolarHBondContact N-OH 3.01Å; D203-Y208 PolarHBondContact O-OH 3.43Å; N206-Y208 HydrophobicContact CB-CE1 4.2Å; N206-Y208 HydrophobicContact CB-CE2 3.86Å; N206-Y208 VanDerWaalsContact CB-OH 3.28Å; N206-Y208 WeakPolarHBondContact CB-OH 3.22Å; Y208-F213 HydrophobicContact CG-CZ 4.24Å; Y208-A263 HydrophobicContact CE1-CB 4.39Å; Y208-V315 HydrophobicContact CD1-CB 4.47Å; Y208-V315 HydrophobicContact CD1-CG1 3.72Å; Y208-V315 HydrophobicContact CD1-CG2 4.1Å; Y208-V315 HydrophobicContact CE1-CG1 3.73Å
209	D	98.4	Very high	97.8	Very high	40 Å²	40	30.7 Å²	30.7	21%	0.214	15%	0.154	C	C	.	.			trans	-74.8	140	167	-170.7	-58.3	0	0	0	109.2	R211 I212 L314 W316	D209-R211 PolarHBondContact O-N 3.36Å; D209-R211 VanDerWaalsContact O-N 3.09Å; D209-R211 VanDerWaalsContact OD1-CB 3.29Å; D209-R211 WeakPolarHBondContact OD1-CB 3.47Å; D209-R211 VanDerWaalsContact OD1-CG 3.28Å; D209-R211 WeakPolarHBondContact OD1-CG 3.44Å; D209-R211 IonicContact OD1-CZ 3.46Å; D209-R211 PolarHBondContact OD1-N 2.97Å; D209-R211 IonicContact OD1-NE 3.44Å; D209-R211 PolarHBondContact OD1-NE 3.11Å; D209-R211 IonicContact OD2-CZ 3.37Å; D209-R211 IonicContact OD2-NE 3Å; D209-R211 PolarHBondContact OD2-NE 2.95Å; D209-R211 IonicContact OD2-NH2 2.8Å; D209-R211 PolarHBondContact OD2-NH2 3.04Å; D209-I212 VanDerWaalsContact O-CG2 3.22Å; D209-I212 WeakPolarHBondContact O-CG2 3.18Å; D209-I212 PolarHBondContact O-N 3.35Å; D209-L314 HydrophobicContact CB-CB 4.1Å; D209-L314 HydrophobicContact CB-CD2 4.11Å; D209-L314 WeakPolarHBondContact CB-O 3.26Å; D209-L314 PolarHBondContact N-O 3.33Å; D209-W316 HydrophobicContact CB-CH2 4.14Å; D209-W316 HydrophobicContact CB-CZ3 3.95Å
210	L	98.2	Very high	97.7	Very high	78 Å²	78	38.1 Å²	38.1	41%	0.408	19%	0.187	S	C	.	.	H	α-helix	trans	-56.1	-30.8	180	-65.7	179.8	0	0	0	112.8	T116 H119 V120 I212 F213	T116-L210 HydrophobicContact CG2-CD2 3.94Å; T116-L210 WeakPolarHBondContact O-CD2 3.42Å; H119-L210 HydrophobicContact CB-CD1 3.79Å; H119-L210 HydrophobicContact CB-CD2 3.77Å; H119-L210 HydrophobicContact CB-CG 4.47Å; V120-L210 HydrophobicContact CG2-CD2 4.17Å; L210-I212 PolarHBondContact O-N 3.18Å; L210-F213 PolarHBondContact O-N 2.64Å
211	R	98.3	Very high	97.7	Very high	123 Å²	123	40.7 Å²	40.7	46%	0.464	20%	0.199	S	C	.	.	H	α-helix	trans	-59.7	-29.5	179.4	-67.5	176.6	-70.6	156.4	-1.4	112.7	D209 F213 E214 E215 E312 L314	D209-R211 PolarHBondContact O-N 3.36Å; D209-R211 VanDerWaalsContact O-N 3.09Å; D209-R211 VanDerWaalsContact OD1-CB 3.29Å; D209-R211 WeakPolarHBondContact OD1-CB 3.47Å; D209-R211 VanDerWaalsContact OD1-CG 3.28Å; D209-R211 WeakPolarHBondContact OD1-CG 3.44Å; D209-R211 IonicContact OD1-CZ 3.46Å; D209-R211 PolarHBondContact OD1-N 2.97Å; D209-R211 IonicContact OD1-NE 3.44Å; D209-R211 PolarHBondContact OD1-NE 3.11Å; D209-R211 IonicContact OD2-CZ 3.37Å; D209-R211 IonicContact OD2-NE 3Å; D209-R211 PolarHBondContact OD2-NE 2.95Å; D209-R211 IonicContact OD2-NH2 2.8Å; D209-R211 PolarHBondContact OD2-NH2 3.04Å; R211-F213 VanDerWaalsContact C-N 3.26Å; R211-F213 PolarHBondContact O-N 2.86Å; R211-E214 PolarHBondContact O-N 2.75Å; R211-E214 VanDerWaalsContact O-N 3.13Å; R211-E215 WeakPolarHBondContact O-CG 3.2Å; R211-E215 PolarHBondContact O-N 3.39Å; R211-E312 IonicContact NH1-OE2 3.15Å; R211-E312 PolarHBondContact NH1-OE2 3.32Å; R211-E312 VanDerWaalsContact NH1-OE2 3.12Å; R211-L314 HydrophobicContact CB-CD1 4Å; R211-L314 HydrophobicContact CB-CD2 4.32Å
212	I	98.6	Very high	97.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-33.1	-179.5	-160.3	57.5	0	0	0	112.5	D209 L210 E214 E215 M216 W225 L314 V315	D209-I212 VanDerWaalsContact O-CG2 3.22Å; D209-I212 WeakPolarHBondContact O-CG2 3.18Å; D209-I212 PolarHBondContact O-N 3.35Å; L210-I212 PolarHBondContact O-N 3.18Å; I212-E214 VanDerWaalsContact C-N 3.29Å; I212-E214 PolarHBondContact O-N 3.5Å; I212-E215 HydrophobicContact CD1-CB 4.28Å; I212-E215 PolarHBondContact O-N 3.32Å; I212-M216 HydrophobicContact CG1-CE 4.01Å; I212-M216 HydrophobicContact CG2-CE 4.13Å; I212-M216 VanDerWaalsContact O-CE 3.23Å; I212-M216 WeakPolarHBondContact O-CE 3.15Å; I212-M216 WeakPolarHBondContact O-CG 3.42Å; I212-M216 PolarHBondContact O-N 2.77Å; I212-M216 VanDerWaalsContact O-N 3.15Å; I212-W225 HydrophobicContact CD1-CB 4.21Å; I212-W225 HydrophobicContact CD1-CD2 3.51Å; I212-W225 HydrophobicContact CD1-CE3 3.87Å; I212-W225 HydrophobicContact CD1-CG 3.67Å; I212-W225 HydrophobicContact CD1-CH2 4.43Å; I212-W225 HydrophobicContact CD1-CZ2 4.14Å; I212-W225 HydrophobicContact CD1-CZ3 4.32Å; I212-W225 HydrophobicContact CG1-CD2 4.09Å; I212-W225 HydrophobicContact CG1-CG 4.47Å; I212-W225 HydrophobicContact CG1-CH2 4.26Å; I212-W225 HydrophobicContact CG1-CZ2 3.8Å; I212-L314 HydrophobicContact CB-CB 4Å; I212-L314 HydrophobicContact CB-CD1 4.44Å; I212-L314 HydrophobicContact CD1-CB 4.13Å; I212-L314 HydrophobicContact CD1-CD1 4.07Å; I212-L314 HydrophobicContact CG1-CB 4.44Å; I212-V315 HydrophobicContact CB-CG2 4.26Å; I212-V315 HydrophobicContact CG1-CG2 3.83Å; I212-V315 HydrophobicContact CG2-CG2 4.22Å
213	F	98.5	Very high	97.8	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-69	-31.5	177.1	-60.6	-79.4	0	0	0	111.5	I94 V96 T116 L117 V120 Y200 Y208 L210 R211 M216 R217	I94-F213 HydrophobicContact CD1-CB 3.97Å; I94-F213 HydrophobicContact CD1-CD1 4.4Å; I94-F213 VanDerWaalsContact CD1-O 3.22Å; I94-F213 WeakPolarHBondContact CD1-O 3.33Å; V96-F213 HydrophobicContact CG2-CE1 4.42Å; T116-F213 HydrophobicContact CG2-CE2 3.88Å; T116-F213 HydrophobicContact CG2-CZ 4.42Å; L117-F213 HydrophobicContact CD2-CE1 3.68Å; L117-F213 HydrophobicContact CD2-CE2 4.31Å; L117-F213 HydrophobicContact CD2-CZ 3.49Å; L117-F213 VanDerWaalsContact CD2-CZ 3.49Å; V120-F213 HydrophobicContact CB-CG 4.5Å; V120-F213 HydrophobicContact CG1-CB 3.7Å; V120-F213 HydrophobicContact CG1-CD1 4.28Å; V120-F213 HydrophobicContact CG1-CG 4.03Å; V120-F213 HydrophobicContact CG2-CB 3.92Å; V120-F213 HydrophobicContact CG2-CD1 4.2Å; V120-F213 HydrophobicContact CG2-CD2 3.6Å; V120-F213 HydrophobicContact CG2-CE2 4.14Å; V120-F213 HydrophobicContact CG2-CG 3.63Å; Y200-F213 HydrophobicContact CD1-CE1 4.16Å; Y200-F213 HydrophobicContact CE1-CE1 4.12Å; Y208-F213 HydrophobicContact CG-CZ 4.24Å; L210-F213 PolarHBondContact O-N 2.64Å; R211-F213 VanDerWaalsContact C-N 3.26Å; R211-F213 PolarHBondContact O-N 2.86Å; F213-M216 HydrophobicContact CD1-CE 4.11Å; F213-M216 HydrophobicContact CD1-SD 4.36Å; F213-M216 WeakPolarHBondContact O-CG 3.25Å; F213-R217 VanDerWaalsContact O-CG 3.31Å; F213-R217 WeakPolarHBondContact O-CG 3.01Å
214	E	97.2	Very high	97.9	Very high	109 Å²	109	39.1 Å²	39.1	51%	0.509	19%	0.191	S	C	.	.	H	α-helix	trans	-73.4	-45.5	173.6	-169.2	53.1	-144.9	0	0	111.7	R211 I212 M216 R217	R211-E214 PolarHBondContact O-N 2.75Å; R211-E214 VanDerWaalsContact O-N 3.13Å; I212-E214 VanDerWaalsContact C-N 3.29Å; I212-E214 PolarHBondContact O-N 3.5Å; E214-M216 PolarHBondContact O-N 3.15Å; E214-R217 PolarHBondContact O-N 3.17Å; E214-R217 VanDerWaalsContact O-N 3.15Å; E214-R217 WeakPolarHBondContact OE2-CD 3.45Å; E214-R217 IonicContact OE2-NE 2.75Å; E214-R217 PolarHBondContact OE2-NE 3.46Å
215	E	97.8	Very high	97.9	Very high	68 Å²	68	38.9 Å²	38.9	32%	0.318	19%	0.19	S	C	.	.	H	α-helix	trans	-53.3	-40.8	177.6	-74.9	-72.6	128.7	0	0	112.7	R211 I212 S218 K306 A307 L314	R211-E215 WeakPolarHBondContact O-CG 3.2Å; R211-E215 PolarHBondContact O-N 3.39Å; I212-E215 HydrophobicContact CD1-CB 4.28Å; I212-E215 PolarHBondContact O-N 3.32Å; E215-S218 PolarHBondContact O-OG 2.98Å; E215-K306 HydrophobicContact CB-CB 4.22Å; E215-K306 HydrophobicContact CB-CD 4.37Å; E215-K306 HydrophobicContact CB-CG 4.41Å; E215-K306 VanDerWaalsContact O-CE 3.25Å; E215-K306 WeakPolarHBondContact O-CE 3.07Å; E215-K306 PolarHBondContact O-NZ 2.89Å; E215-K306 WeakPolarHBondContact OE2-CB 3.46Å; E215-A307 PolarHBondContact OE2-N 2.91Å; E215-L314 HydrophobicContact CG-CD1 4.22Å
216	M	98.3	Very high	98.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-78.1	-17.5	-175.9	70.2	179.3	71.4	0	0	114.3	I94 V198 Y200 I212 F213 E214 S218 T219 W225 A266	I94-M216 HydrophobicContact CD1-CG 4.07Å; I94-M216 HydrophobicContact CD1-SD 4.25Å; I94-M216 HydrophobicContact CG2-SD 3.77Å; V198-M216 HydrophobicContact CG1-CB 4.37Å; V198-M216 HydrophobicContact CG1-CG 4.49Å; V198-M216 WeakPolarHBondContact CG2-O 3.42Å; Y200-M216 HydrophobicContact CD1-CE 3.71Å; Y200-M216 HydrophobicContact CD1-SD 4Å; Y200-M216 HydrophobicContact CD2-CE 4.1Å; Y200-M216 HydrophobicContact CD2-SD 4.41Å; Y200-M216 HydrophobicContact CE1-CE 3.83Å; Y200-M216 HydrophobicContact CE2-CE 4.26Å; Y200-M216 HydrophobicContact CG-CE 3.83Å; Y200-M216 HydrophobicContact CG-SD 3.82Å; I212-M216 HydrophobicContact CG1-CE 4.01Å; I212-M216 HydrophobicContact CG2-CE 4.13Å; I212-M216 VanDerWaalsContact O-CE 3.23Å; I212-M216 WeakPolarHBondContact O-CE 3.15Å; I212-M216 WeakPolarHBondContact O-CG 3.42Å; I212-M216 PolarHBondContact O-N 2.77Å; I212-M216 VanDerWaalsContact O-N 3.15Å; F213-M216 HydrophobicContact CD1-CE 4.11Å; F213-M216 HydrophobicContact CD1-SD 4.36Å; F213-M216 WeakPolarHBondContact O-CG 3.25Å; E214-M216 PolarHBondContact O-N 3.15Å; M216-S218 PolarHBondContact O-N 3.38Å; M216-S218 VanDerWaalsContact O-N 3.14Å; M216-T219 VanDerWaalsContact O-CB 3.29Å; M216-T219 WeakPolarHBondContact O-CB 3.2Å; M216-T219 PolarHBondContact O-N 3.33Å; M216-T219 PolarHBondContact O-OG1 3.45Å; M216-W225 HydrophobicContact CB-CH2 4.14Å; M216-W225 HydrophobicContact CB-CZ3 4.14Å; M216-W225 HydrophobicContact CE-CH2 3.66Å; M216-W225 HydrophobicContact CE-CZ2 4Å; M216-A266 HydrophobicContact CB-CB 3.9Å; M216-A266 HydrophobicContact SD-CB 4.3Å
217	R	96.3	Very high	98.1	Very high	16 Å²	16	37.6 Å²	37.6	6%	0.06	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.8	-177	-65.5	-166.7	-175.2	-77.8	-3.4	113.7	M91 P92 I94 P121 F213 E214 T219	M91-R217 PolarHBondContact SD-NH1 3.4Å; P92-R217 PolarHBondContact O-NH1 3.22Å; I94-R217 HydrophobicContact CD1-CG 4.16Å; P121-R217 PolarHBondContact O-NH1 3.14Å; P121-R217 VanDerWaalsContact O-NH1 3.15Å; P121-R217 PolarHBondContact O-NH2 3.09Å; F213-R217 VanDerWaalsContact O-CG 3.31Å; F213-R217 WeakPolarHBondContact O-CG 3.01Å; E214-R217 PolarHBondContact O-N 3.17Å; E214-R217 VanDerWaalsContact O-N 3.15Å; E214-R217 WeakPolarHBondContact OE2-CD 3.45Å; E214-R217 IonicContact OE2-NE 2.75Å; E214-R217 PolarHBondContact OE2-NE 3.46Å; R217-T219 VanDerWaalsContact C-N 3.31Å; R217-T219 PolarHBondContact O-N 3.37Å
218	S	95.5	Very high	98.1	Very high	70 Å²	70	35.4 Å²	35.4	49%	0.49	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	11.5	-177.7	56.6	0	0	0	0	113.9	E215 M216 K220 K306	E215-S218 PolarHBondContact O-OG 2.98Å; M216-S218 PolarHBondContact O-N 3.38Å; M216-S218 VanDerWaalsContact O-N 3.14Å; S218-K220 PolarHBondContact O-N 2.77Å; S218-K306 PolarHBondContact OG-NZ 3.39Å
219	T	98.4	Very high	98	Very high	8 Å²	8	40 Å²	40	5%	0.049	19%	0.19	C	C	.	.			trans	-58.6	118.1	179.5	-60.6	0	0	0	0	111.2	M216 R217 S223 E304	M216-T219 VanDerWaalsContact O-CB 3.29Å; M216-T219 WeakPolarHBondContact O-CB 3.2Å; M216-T219 PolarHBondContact O-N 3.33Å; M216-T219 PolarHBondContact O-OG1 3.45Å; R217-T219 VanDerWaalsContact C-N 3.31Å; R217-T219 PolarHBondContact O-N 3.37Å; T219-S223 WeakPolarHBondContact CB-OG 3.49Å; T219-S223 WeakPolarHBondContact OG1-CB 3.16Å; T219-S223 PolarHBondContact OG1-OG 3.13Å; T219-E304 WeakPolarHBondContact CA-OE2 3.34Å
220	K	97.8	Very high	97.7	Very high	158 Å²	158	38.5 Å²	38.5	69%	0.687	18%	0.183	S	C	*	.	S	Bend	trans	-91.6	-42.8	178	-55.3	176.4	-179.5	174.9	0	111.6	S218 N268 E304	S218-K220 PolarHBondContact O-N 2.77Å; K220-N268 VanDerWaalsContact O-CB 3.29Å; K220-N268 WeakPolarHBondContact O-CB 3.36Å; K220-N268 PolarHBondContact O-ND2 2.85Å; K220-E304 WeakPolarHBondContact CA-OE1 3.42Å; K220-E304 VanDerWaalsContact CB-OE1 3.27Å; K220-E304 WeakPolarHBondContact CB-OE1 3.49Å; K220-E304 PolarHBondContact N-OE1 3.15Å; K220-E304 VanDerWaalsContact N-OE1 3.14Å; K220-E304 PolarHBondContact N-OE2 3.48Å
221	M	98.1	Very high	97.2	Very high	53 Å²	53	36.2 Å²	36.2	26%	0.261	18%	0.178	S	C	.	.	S	Bend	trans	-118.9	-82.9	177	-64.7	-65.3	-66.3	0	0	109.9	N268 L271 V298 E304	M221-N268 PolarHBondContact O-N 3.29Å; M221-L271 HydrophobicContact CB-CD1 4.34Å; M221-L271 HydrophobicContact CE-CD1 3.88Å; M221-L271 HydrophobicContact CE-CD2 3.96Å; M221-L271 WeakPolarHBondContact O-CD1 3.47Å; M221-L271 HydrophobicContact SD-CD1 4.13Å; M221-L271 HydrophobicContact SD-CD2 4.19Å; M221-V298 HydrophobicContact CB-CG2 4.32Å; M221-E304 PolarHBondContact N-OE1 3.37Å
222	V	98.8	Very high	96.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	117.9	178	177.1	0	0	0	0	108.4	V224 F265 A266 V267 L271 L294 V298 L303 E304	V222-V224 HydrophobicContact CG1-CG1 4.35Å; V222-F265 HydrophobicContact CG1-CB 4.22Å; V222-A266 CarbonylContact C-O 3.54Å; V222-A266 VanDerWaalsContact CA-O 3.26Å; V222-A266 WeakPolarHBondContact CA-O 3.4Å; V222-V267 HydrophobicContact CG1-CG2 4.43Å; V222-V267 HydrophobicContact CG2-CG1 4.23Å; V222-V267 HydrophobicContact CG2-CG2 4.11Å; V222-L271 HydrophobicContact CG2-CD1 4.5Å; V222-L294 HydrophobicContact CG1-CD2 3.93Å; V222-L294 HydrophobicContact CG2-CD2 4.22Å; V222-V298 HydrophobicContact CB-CB 4.38Å; V222-V298 HydrophobicContact CB-CG1 4.06Å; V222-V298 HydrophobicContact CB-CG2 4.26Å; V222-V298 HydrophobicContact CG2-CB 3.82Å; V222-V298 HydrophobicContact CG2-CG1 3.7Å; V222-V298 HydrophobicContact CG2-CG2 4.13Å; V222-L303 HydrophobicContact CB-CD2 3.92Å; V222-L303 HydrophobicContact CG1-CD2 3.8Å; V222-L303 WeakPolarHBondContact O-CA 3.5Å; V222-E304 PolarHBondContact O-N 3.47Å
223	S	98.8	Very high	96.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	145.2	173.5	-68.7	0	0	0	0	110.4	T219 F265 A266 E304 K306	T219-S223 WeakPolarHBondContact CB-OG 3.49Å; T219-S223 WeakPolarHBondContact OG1-CB 3.16Å; T219-S223 PolarHBondContact OG1-OG 3.13Å; S223-F265 CarbonylContact O-C 3.57Å; S223-F265 WeakPolarHBondContact O-CA 3.35Å; S223-F265 VanDerWaalsContact O-CB 3.28Å; S223-F265 WeakPolarHBondContact O-CB 3.29Å; S223-A266 PolarHBondContact N-O 2.89Å; S223-A266 PolarHBondContact O-N 3.42Å; S223-E304 CarbonylContact C-O 3.58Å; S223-E304 VanDerWaalsContact CA-O 3.29Å; S223-E304 WeakPolarHBondContact CA-O 3.46Å; S223-K306 WeakPolarHBondContact OG-CE 2.9Å
224	V	98.8	Very high	96.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.8	179.7	-65.5	0	0	0	0	111.8	V222 P238 V245 I260 A264 F265 L303 E304 K306	V222-V224 HydrophobicContact CG1-CG1 4.35Å; V224-P238 HydrophobicContact CB-CG 3.91Å; V224-P238 HydrophobicContact CG2-CB 4.29Å; V224-P238 HydrophobicContact CG2-CG 3.65Å; V224-V245 HydrophobicContact CG2-CG2 3.93Å; V224-I260 HydrophobicContact CG1-CD1 4.26Å; V224-A264 WeakPolarHBondContact CA-O 2.92Å; V224-F265 HydrophobicContact CG1-CB 4.02Å; V224-L303 HydrophobicContact CG1-CB 4.47Å; V224-L303 HydrophobicContact CG1-CD1 4.2Å; V224-L303 HydrophobicContact CG1-CD2 3.92Å; V224-L303 HydrophobicContact CG1-CG 4.42Å; V224-L303 HydrophobicContact CG2-CB 4.08Å; V224-L303 HydrophobicContact CG2-CD1 4.47Å; V224-E304 PolarHBondContact N-O 3.14Å; V224-K306 PolarHBondContact O-N 3.19Å
225	W	98.7	Very high	96.5	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.008	23%	0.23	C	C	.	.			trans	-152.1	168	-178.9	50.1	83.7	0	0	0	112.7	Y200 I212 M216 A263 A264 A266 K306 A307	Y200-W225 HydrophobicContact CD2-CH2 4.12Å; Y200-W225 HydrophobicContact CD2-CZ2 4.01Å; Y200-W225 AromaticContact CE2-CH2 3.95Å; Y200-W225 HydrophobicContact CE2-CH2 3.95Å; Y200-W225 AromaticContact CE2-CZ2 3.38Å; Y200-W225 HydrophobicContact CE2-CZ2 3.38Å; Y200-W225 AromaticContact CZ-CZ2 3.88Å; I212-W225 HydrophobicContact CD1-CB 4.21Å; I212-W225 HydrophobicContact CD1-CD2 3.51Å; I212-W225 HydrophobicContact CD1-CE3 3.87Å; I212-W225 HydrophobicContact CD1-CG 3.67Å; I212-W225 HydrophobicContact CD1-CH2 4.43Å; I212-W225 HydrophobicContact CD1-CZ2 4.14Å; I212-W225 HydrophobicContact CD1-CZ3 4.32Å; I212-W225 HydrophobicContact CG1-CD2 4.09Å; I212-W225 HydrophobicContact CG1-CG 4.47Å; I212-W225 HydrophobicContact CG1-CH2 4.26Å; I212-W225 HydrophobicContact CG1-CZ2 3.8Å; M216-W225 HydrophobicContact CB-CH2 4.14Å; M216-W225 HydrophobicContact CB-CZ3 4.14Å; M216-W225 HydrophobicContact CE-CH2 3.66Å; M216-W225 HydrophobicContact CE-CZ2 4Å; W225-A263 PolarHBondContact NE1-O 3.01Å; W225-A264 PolarHBondContact N-O 3.33Å; W225-A266 HydrophobicContact CH2-CB 3.55Å; W225-A266 HydrophobicContact CZ3-CB 3.9Å; W225-K306 HydrophobicContact CB-CB 4.39Å; W225-K306 HydrophobicContact CE3-CB 4.15Å; W225-K306 HydrophobicContact CE3-CG 4.26Å; W225-A307 HydrophobicContact CB-CB 4.22Å
226	P	98.4	Very high	96.5	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	22%	0.216	C	C	.	.			trans	-68.1	144.4	173.5	-21.8	36.3	0	0	0	113	V235 E236 R237 C310 E312 V313	P226-V235 HydrophobicContact CB-CG1 3.6Å; P226-E236 WeakPolarHBondContact CA-O 3.39Å; P226-R237 HydrophobicContact CB-CB 3.83Å; P226-R237 HydrophobicContact CG-CB 3.94Å; P226-C310 HydrophobicContact CG-CB 3.69Å; P226-C310 WeakPolarHBondContact CG-O 3.22Å; P226-E312 WeakPolarHBondContact CD-O 3.46Å; P226-E312 VanDerWaalsContact CG-O 3.27Å; P226-E312 WeakPolarHBondContact CG-O 3.48Å; P226-V313 HydrophobicContact CB-CG2 4.23Å
227	V	98.5	Very high	96.5	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.6	169.5	-170.9	0	0	0	0	109.1	V230 E236 A264 V315 H317	V227-V230 HydrophobicContact CB-CG2 3.84Å; V227-V230 HydrophobicContact CG1-CG2 3.47Å; V227-V230 VanDerWaalsContact CG1-CG2 3.47Å; V227-E236 PolarHBondContact N-O 2.77Å; V227-E236 PolarHBondContact O-N 3.47Å; V227-A264 HydrophobicContact CG2-CB 3.48Å; V227-A264 VanDerWaalsContact CG2-CB 3.48Å; V227-V315 WeakPolarHBondContact CA-O 3.26Å; V227-V315 HydrophobicContact CG1-CB 4.32Å; V227-V315 HydrophobicContact CG1-CG1 4.03Å; V227-V315 HydrophobicContact CG2-CB 4.3Å; V227-V315 HydrophobicContact CG2-CG1 4.41Å; V227-H317 HydrophobicContact CG1-CB 4.34Å
228	A	98.3	Very high	96.6	Very high	4 Å²	4	46 Å²	46	3%	0.033	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	149.4	176.9	0	0	0	0	0	112.4	V230 L234 V313 V315 W316 H317	A228-V230 PolarHBondContact O-N 2.62Å; A228-L234 VanDerWaalsContact CA-O 3.27Å; A228-L234 WeakPolarHBondContact CA-O 3.5Å; A228-V313 HydrophobicContact CB-CG1 3.62Å; A228-V315 PolarHBondContact N-O 2.81Å; A228-W316 VanDerWaalsContact CB-CD1 3.45Å; A228-W316 HydrophobicContact CB-CG 4.17Å; A228-H317 WeakPolarHBondContact O-CB 3.49Å; A228-H317 PolarHBondContact O-N 3.23Å
229	F	96.1	Very high	96.7	Very high	106 Å²	106	45.7 Å²	45.7	47%	0.465	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	16.6	173.3	-43.1	-45.4	0	0	0	115.8	I233 L234 W316	F229-I233 WeakPolarHBondContact CA-O 3.32Å; F229-L234 HydrophobicContact CE1-CD1 3.94Å; F229-L234 PolarHBondContact N-O 3.02Å; F229-W316 HydrophobicContact CD2-CB 4.46Å; F229-W316 AromaticContact CE2-CD1 3.76Å
230	V	92.4	Very high	96.7	Very high	10 Å²	10	46.9 Å²	46.9	6%	0.061	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-80.8	144.6	168.2	176.7	0	0	0	0	109.5	V227 A228 E232 I233 E236 D261 H317	V227-V230 HydrophobicContact CB-CG2 3.84Å; V227-V230 HydrophobicContact CG1-CG2 3.47Å; V227-V230 VanDerWaalsContact CG1-CG2 3.47Å; A228-V230 PolarHBondContact O-N 2.62Å; V230-E232 PolarHBondContact O-N 3.34Å; V230-E232 VanDerWaalsContact O-N 3.13Å; V230-I233 WeakPolarHBondContact O-CG1 3.23Å; V230-I233 PolarHBondContact O-N 3.29Å; V230-E236 HydrophobicContact CB-CB 4.04Å; V230-E236 HydrophobicContact CG1-CB 4.24Å; V230-D261 HydrophobicContact CG1-CB 3.96Å; V230-D261 HydrophobicContact CG2-CB 3.88Å; V230-H317 HydrophobicContact CG2-CB 3.61Å
231	G	87.6	Confident	96.6	Very high	30 Å²	30	46.7 Å²	46.7	31%	0.309	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	63.9	23.4	169.1	0	0	0	0	0	114.9	I233	G231-I233 PolarHBondContact O-N 3.49Å
232	E	88.7	Confident	96.5	Very high	199 Å²	199	52 Å²	52	93%	0.93	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	60.9	22.1	-178.2	-57	176.2	-176.6	0	0	113.8	V230	V230-E232 PolarHBondContact O-N 3.34Å; V230-E232 VanDerWaalsContact O-N 3.13Å
233	I	95.2	Very high	96.4	Very high	45 Å²	45	53.5 Å²	53.5	23%	0.231	27%	0.271	C	S	.	.	S	Bend	trans	-115.7	164.7	171.7	61.1	169.6	0	0	0	110.9	F229 V230 G231 V235 E236 V249 M251	F229-I233 WeakPolarHBondContact CA-O 3.32Å; V230-I233 WeakPolarHBondContact O-CG1 3.23Å; V230-I233 PolarHBondContact O-N 3.29Å; G231-I233 PolarHBondContact O-N 3.49Å; I233-V235 WeakPolarHBondContact CD1-O 3.34Å; I233-E236 HydrophobicContact CD1-CB 4.24Å; I233-V249 HydrophobicContact CD1-CG1 4.46Å; I233-M251 HydrophobicContact CG2-CB 3.76Å; I233-M251 HydrophobicContact CG2-CG 4.42Å
234	L	96.8	Very high	96.3	Very high	132 Å²	132	59.3 Å²	59.3	69%	0.691	30%	0.297	S	S	*	.	S	Bend	trans	-61.9	-48.7	-178.8	-175.2	62.4	0	0	0	111.5	A228 F229	A228-L234 VanDerWaalsContact CA-O 3.27Å; A228-L234 WeakPolarHBondContact CA-O 3.5Å; F229-L234 HydrophobicContact CE1-CD1 3.94Å; F229-L234 PolarHBondContact N-O 3.02Å
235	V	97.9	Very high	96.3	Very high	36 Å²	36	59.7 Å²	59.7	22%	0.218	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	119.6	-179.6	-169.7	0	0	0	0	110.6	P226 I233 R237 V313	P226-V235 HydrophobicContact CB-CG1 3.6Å; I233-V235 WeakPolarHBondContact CD1-O 3.34Å; V235-R237 HydrophobicContact CG1-CB 4.16Å; V235-R237 HydrophobicContact CG1-CG 4.46Å; V235-V313 HydrophobicContact CG1-CG2 3.94Å; V235-V313 HydrophobicContact CG2-CG2 3.89Å
236	E	97.6	Very high	96.2	Very high	8 Å²	8	63.6 Å²	63.6	4%	0.037	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	128.6	162.2	-169.5	169.8	98.4	0	0	108	P226 V227 V230 I233 V249 A250 I260 D261	P226-E236 WeakPolarHBondContact CA-O 3.39Å; V227-E236 PolarHBondContact N-O 2.77Å; V227-E236 PolarHBondContact O-N 3.47Å; V230-E236 HydrophobicContact CB-CB 4.04Å; V230-E236 HydrophobicContact CG1-CB 4.24Å; I233-E236 HydrophobicContact CD1-CB 4.24Å; E236-V249 WeakPolarHBondContact CA-O 3.33Å; E236-V249 VanDerWaalsContact CG-O 3.3Å; E236-V249 WeakPolarHBondContact CG-O 3.49Å; E236-A250 HydrophobicContact CG-CB 3.89Å; E236-A250 WeakPolarHBondContact OE2-CB 3.44Å; E236-I260 VanDerWaalsContact OE1-C 3.27Å; E236-I260 WeakPolarHBondContact OE1-CA 3.29Å; E236-D261 PolarHBondContact OE1-N 3.09Å; E236-D261 VanDerWaalsContact OE1-N 3.09Å
237	R	97.6	Very high	96.1	Very high	102 Å²	102	64.2 Å²	64.2	39%	0.385	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	154.8	-174.7	63.2	175	-175	145.5	-0.3	115.2	P226 V235 F248 V249 C310	P226-R237 HydrophobicContact CB-CB 3.83Å; P226-R237 HydrophobicContact CG-CB 3.94Å; V235-R237 HydrophobicContact CG1-CB 4.16Å; V235-R237 HydrophobicContact CG1-CG 4.46Å; R237-F248 CarbonylContact O-C 3.58Å; R237-F248 WeakPolarHBondContact O-CA 3.38Å; R237-V249 HydrophobicContact CG-CB 4.08Å; R237-V249 HydrophobicContact CG-CG2 4.17Å; R237-V249 PolarHBondContact N-O 3.46Å; R237-V249 VanDerWaalsContact N-O 3.1Å; R237-V249 PolarHBondContact O-N 3.02Å; R237-C310 PolarHBondContact NH1-O 3.42Å
238	P	98	Very high	96.1	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	140.4	161.7	-19.9	33	0	0	0	111.8	V224 V240 V245 F248 C310	V224-P238 HydrophobicContact CB-CG 3.91Å; V224-P238 HydrophobicContact CG2-CB 4.29Å; V224-P238 HydrophobicContact CG2-CG 3.65Å; P238-V240 HydrophobicContact CB-CG2 4.18Å; P238-V245 HydrophobicContact CB-CG1 3.98Å; P238-V245 HydrophobicContact CB-CG2 4.09Å; P238-F248 HydrophobicContact CB-CD1 4.26Å; P238-F248 HydrophobicContact CB-CE1 4.23Å; P238-F248 HydrophobicContact CG-CD1 4.32Å; P238-F248 HydrophobicContact CG-CE1 4.18Å; P238-C310 HydrophobicContact CB-CB 4.41Å; P238-C310 HydrophobicContact CG-CB 4.48Å
239	I	98	Very high	96	Very high	63 Å²	63	68.2 Å²	68.2	32%	0.323	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	111.7	166.3	-60	170.7	0	0	0	106.8	E246 G247 V249	I239-E246 PolarHBondContact O-N 2.79Å; I239-G247 PolarHBondContact N-O 3.22Å; I239-V249 HydrophobicContact CD1-CG2 3.99Å; I239-V249 HydrophobicContact CG1-CG2 3.69Å
240	V	98.3	Very high	96	Very high	33 Å²	33	63.8 Å²	63.8	20%	0.2	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.4	-176.6	-174.1	0	0	0	0	110	P238 K244 V245 P305 N309 C310	P238-V240 HydrophobicContact CB-CG2 4.18Å; V240-K244 CarbonylContact C-O 3.56Å; V240-K244 VanDerWaalsContact CA-O 3.29Å; V240-K244 WeakPolarHBondContact CA-O 3.24Å; V240-V245 HydrophobicContact CG2-CG2 4.46Å; V240-P305 HydrophobicContact CG1-CB 4.09Å; V240-P305 HydrophobicContact CG1-CG 3.9Å; V240-P305 HydrophobicContact CG2-CB 3.58Å; V240-P305 HydrophobicContact CG2-CG 4.26Å; V240-N309 HydrophobicContact CB-CB 4.37Å; V240-N309 WeakPolarHBondContact CB-O 3.47Å; V240-N309 HydrophobicContact CG1-CB 3.93Å; V240-N309 WeakPolarHBondContact CG2-O 3.38Å; V240-C310 HydrophobicContact CG2-CB 3.86Å
241	R	97.3	Very high	96	Very high	154 Å²	154	69.7 Å²	69.7	58%	0.581	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.9	167.9	-60.2	-159.5	-176.9	139.9	-14.8	109.3	G243 K244 E246	R241-G243 PolarHBondContact O-N 3.23Å; R241-G243 VanDerWaalsContact O-N 3.11Å; R241-K244 PolarHBondContact N-O 2.69Å; R241-K244 PolarHBondContact O-N 3.32Å; R241-E246 HydrophobicContact CB-CG 4.17Å; R241-E246 WeakPolarHBondContact CB-OE1 3.16Å; R241-E246 WeakPolarHBondContact CD-OE2 3.45Å; R241-E246 HydrophobicContact CG-CG 4.36Å; R241-E246 WeakPolarHBondContact CG-OE2 3.4Å; R241-E246 IonicContact CZ-OE2 3.84Å; R241-E246 IonicContact NE-OE2 3.53Å; R241-E246 PolarHBondContact NE-OE2 3.44Å; R241-E246 IonicContact NH1-OE2 2.75Å; R241-E246 PolarHBondContact NH1-OE2 3.07Å
242	N	95.9	Very high	96.1	Very high	165 Å²	165	72.4 Å²	72.4	88%	0.882	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	38.9	-179.7	-56.7	-30.4	0	0	0	113.2	K244	N242-K244 VanDerWaalsContact C-N 3.26Å; N242-K244 PolarHBondContact O-N 3.44Å
243	G	95.7	Very high	96.1	Very high	31 Å²	31	64.7 Å²	64.7	32%	0.32	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	13.7	-178.4	0	0	0	0	0	115.3	R241 P305	R241-G243 PolarHBondContact O-N 3.23Å; R241-G243 VanDerWaalsContact O-N 3.11Å; G243-P305 WeakPolarHBondContact O-CG 3.33Å
244	K	97.6	Very high	96	Very high	123 Å²	123	66.5 Å²	66.5	54%	0.535	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142.3	179.5	-64.5	-61.9	-176.6	-177.2	0	111.7	V240 R241 N242 E246	V240-K244 CarbonylContact C-O 3.56Å; V240-K244 VanDerWaalsContact CA-O 3.29Å; V240-K244 WeakPolarHBondContact CA-O 3.24Å; R241-K244 PolarHBondContact N-O 2.69Å; R241-K244 PolarHBondContact O-N 3.32Å; N242-K244 VanDerWaalsContact C-N 3.26Å; N242-K244 PolarHBondContact O-N 3.44Å; K244-E246 PolarHBondContact O-N 3.22Å
245	V	98	Very high	95.8	Very high	7 Å²	7	64.6 Å²	64.6	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	111.3	175.8	-179.4	0	0	0	0	109.4	V224 P238 V240 F248 R300 L303 P305	V224-V245 HydrophobicContact CG2-CG2 3.93Å; P238-V245 HydrophobicContact CB-CG1 3.98Å; P238-V245 HydrophobicContact CB-CG2 4.09Å; V240-V245 HydrophobicContact CG2-CG2 4.46Å; V245-F248 HydrophobicContact CG1-CE1 4.16Å; V245-F248 HydrophobicContact CG1-CE2 4.38Å; V245-F248 HydrophobicContact CG1-CZ 3.94Å; V245-R300 HydrophobicContact CB-CG 4.48Å; V245-R300 HydrophobicContact CG1-CG 4.01Å; V245-L303 HydrophobicContact CB-CB 4.26Å; V245-L303 HydrophobicContact CB-CD1 4.32Å; V245-L303 HydrophobicContact CG1-CD1 4.07Å; V245-L303 HydrophobicContact CG2-CB 3.85Å; V245-L303 HydrophobicContact CG2-CD1 4.41Å; V245-P305 HydrophobicContact CG2-CB 4.3Å
246	E	96.6	Very high	95.7	Very high	84 Å²	84	63.6 Å²	63.6	39%	0.393	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-30.4	178.4	-67.3	-167.2	168	0	0	112.3	I239 R241 K244 R300	I239-E246 PolarHBondContact O-N 2.79Å; R241-E246 HydrophobicContact CB-CG 4.17Å; R241-E246 WeakPolarHBondContact CB-OE1 3.16Å; R241-E246 WeakPolarHBondContact CD-OE2 3.45Å; R241-E246 HydrophobicContact CG-CG 4.36Å; R241-E246 WeakPolarHBondContact CG-OE2 3.4Å; R241-E246 IonicContact CZ-OE2 3.84Å; R241-E246 IonicContact NE-OE2 3.53Å; R241-E246 PolarHBondContact NE-OE2 3.44Å; R241-E246 IonicContact NH1-OE2 2.75Å; R241-E246 PolarHBondContact NH1-OE2 3.07Å; K244-E246 PolarHBondContact O-N 3.22Å; E246-R300 PolarHBondContact O-NH1 3.39Å
247	G	97	Very high	95.6	Very high	15 Å²	15	65.5 Å²	65.5	16%	0.155	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	-161.8	-177.9	0	0	0	0	0	111.4	I239	I239-G247 PolarHBondContact N-O 3.22Å
248	F	97.8	Very high	95.6	Very high	30 Å²	30	61.1 Å²	61.1	13%	0.132	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.2	-177.8	-61.4	-88	0	0	0	110.2	R237 P238 V245 F258 P259 I260 R300 L303	R237-F248 CarbonylContact O-C 3.58Å; R237-F248 WeakPolarHBondContact O-CA 3.38Å; P238-F248 HydrophobicContact CB-CD1 4.26Å; P238-F248 HydrophobicContact CB-CE1 4.23Å; P238-F248 HydrophobicContact CG-CD1 4.32Å; P238-F248 HydrophobicContact CG-CE1 4.18Å; V245-F248 HydrophobicContact CG1-CE1 4.16Å; V245-F248 HydrophobicContact CG1-CE2 4.38Å; V245-F248 HydrophobicContact CG1-CZ 3.94Å; F248-F258 HydrophobicContact CZ-CD1 4.26Å; F248-P259 HydrophobicContact CB-CG 3.56Å; F248-P259 VanDerWaalsContact CD2-CD 3.42Å; F248-P259 HydrophobicContact CD2-CG 3.79Å; F248-P259 HydrophobicContact CG-CG 3.76Å; F248-I260 HydrophobicContact CD1-CG2 3.4Å; F248-I260 VanDerWaalsContact CD1-CG2 3.4Å; F248-I260 HydrophobicContact CE1-CG2 3.38Å; F248-I260 HydrophobicContact CG-CG2 4.37Å; F248-I260 HydrophobicContact CZ-CG2 4.31Å; F248-R300 HydrophobicContact CE2-CG 4.14Å; F248-R300 HydrophobicContact CZ-CG 4.45Å; F248-L303 HydrophobicContact CE1-CD1 4.37Å; F248-L303 HydrophobicContact CZ-CD1 3.71Å
249	V	97	Very high	95.5	Very high	58 Å²	58	61.2 Å²	61.2	35%	0.352	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	106.4	165.3	-178.7	0	0	0	0	106.7	I233 E236 R237 I239	I233-V249 HydrophobicContact CD1-CG1 4.46Å; E236-V249 WeakPolarHBondContact CA-O 3.33Å; E236-V249 VanDerWaalsContact CG-O 3.3Å; E236-V249 WeakPolarHBondContact CG-O 3.49Å; R237-V249 HydrophobicContact CG-CB 4.08Å; R237-V249 HydrophobicContact CG-CG2 4.17Å; R237-V249 PolarHBondContact N-O 3.46Å; R237-V249 VanDerWaalsContact N-O 3.1Å; R237-V249 PolarHBondContact O-N 3.02Å; I239-V249 HydrophobicContact CD1-CG2 3.99Å; I239-V249 HydrophobicContact CG1-CG2 3.69Å
250	A	95.5	Very high	95.4	Very high	14 Å²	14	58.4 Å²	58.4	12%	0.116	31%	0.311	C	S	.	.			trans	-148.9	142.5	175.9	0	0	0	0	0	109.1	E236 P259	E236-A250 HydrophobicContact CG-CB 3.89Å; E236-A250 WeakPolarHBondContact OE2-CB 3.44Å; A250-P259 HydrophobicContact CB-CB 3.8Å; A250-P259 HydrophobicContact CB-CG 4.29Å
251	M	92.9	Very high	95.2	Very high	133 Å²	133	57.9 Å²	57.9	66%	0.655	31%	0.307	S	S	*	.	S	Bend	trans	-94.1	-39.5	-179.5	-170.3	62.3	-136.6	0	0	112.5	I233 D253	I233-M251 HydrophobicContact CG2-CB 3.76Å; I233-M251 HydrophobicContact CG2-CG 4.42Å; M251-D253 PolarHBondContact O-N 3.03Å
252	Y	88.3	Confident	95.2	Very high	88 Å²	88	50.8 Å²	50.8	35%	0.345	28%	0.281	S	S	.	.	S	Bend	trans	-79.8	112.3	179.2	-179.8	-92.4	0	0	0	110.7	R256 R286	Y252-R256 PolarHBondContact O-NE 3.43Å; Y252-R256 PolarHBondContact O-NH2 3.48Å; Y252-R286 WeakPolarHBondContact CE1-O 3.39Å; Y252-R286 WeakPolarHBondContact OH-CB 3.42Å; Y252-R286 WeakPolarHBondContact OH-CD 3.33Å; Y252-R286 WeakPolarHBondContact OH-CG 3.49Å; Y252-R286 PolarHBondContact OH-O 2.85Å
253	D	90	Very high	95.2	Very high	37 Å²	37	42.9 Å²	42.9	20%	0.198	24%	0.239	C	C	.	.			trans	41.7	69.7	178.8	-161.8	-12.2	0	0	0	112.6	M251 S255 R256 K285 Y288	M251-D253 PolarHBondContact O-N 3.03Å; D253-S255 PolarHBondContact O-N 3.28Å; D253-S255 PolarHBondContact OD1-N 2.84Å; D253-S255 PolarHBondContact OD1-OG 3.42Å; D253-R256 HydrophobicContact CB-CG 4.21Å; D253-R256 VanDerWaalsContact O-CG 3.24Å; D253-R256 WeakPolarHBondContact O-CG 3.47Å; D253-R256 PolarHBondContact O-N 2.97Å; D253-R256 VanDerWaalsContact O-N 3.16Å; D253-R256 PolarHBondContact O-NE 3.5Å; D253-K285 IonicContact OD2-NZ 3.12Å; D253-K285 PolarHBondContact OD2-NZ 3.28Å; D253-Y288 VanDerWaalsContact OD2-CE2 3.28Å; D253-Y288 WeakPolarHBondContact OD2-CE2 3.26Å; D253-Y288 PolarHBondContact OD2-OH 3.11Å
254	P	91.9	Very high	95.3	Very high	83 Å²	83	41.6 Å²	41.6	54%	0.539	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-9	-179.1	26.3	-34.4	0	0	0	113.3	R256	P254-R256 PolarHBondContact O-N 3.25Å
255	S	93.5	Very high	95.4	Very high	91 Å²	91	35.8 Å²	35.8	64%	0.636	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.4	175.4	81.4	0	0	0	0	113.4	D253	D253-S255 PolarHBondContact O-N 3.28Å; D253-S255 PolarHBondContact OD1-N 2.84Å; D253-S255 PolarHBondContact OD1-OG 3.42Å
256	R	95.1	Very high	95.4	Very high	16 Å²	16	35.5 Å²	35.5	6%	0.06	20%	0.198	C	C	.	.	S	Bend	trans	-53.6	141.5	174	-71.9	-179.9	-71	151.6	2.5	110.3	Y252 D253 P254 F258 P259 G287 Y288	Y252-R256 PolarHBondContact O-NE 3.43Å; Y252-R256 PolarHBondContact O-NH2 3.48Å; D253-R256 HydrophobicContact CB-CG 4.21Å; D253-R256 VanDerWaalsContact O-CG 3.24Å; D253-R256 WeakPolarHBondContact O-CG 3.47Å; D253-R256 PolarHBondContact O-N 2.97Å; D253-R256 VanDerWaalsContact O-N 3.16Å; D253-R256 PolarHBondContact O-NE 3.5Å; P254-R256 PolarHBondContact O-N 3.25Å; R256-F258 PolarHBondContact O-N 2.84Å; R256-P259 HydrophobicContact CB-CB 3.96Å; R256-P259 VanDerWaalsContact O-CD 3.31Å; R256-P259 WeakPolarHBondContact O-CD 3.31Å; R256-G287 WeakPolarHBondContact CD-O 3.28Å; R256-G287 PolarHBondContact NH1-O 2.97Å; R256-Y288 HydrophobicContact CB-CE1 4.37Å; R256-Y288 HydrophobicContact CG-CD1 4.1Å; R256-Y288 HydrophobicContact CG-CD2 3.82Å; R256-Y288 HydrophobicContact CG-CE1 3.78Å; R256-Y288 HydrophobicContact CG-CE2 3.44Å; R256-Y288 VanDerWaalsContact CG-CE2 3.44Å; R256-Y288 HydrophobicContact CG-CG 4.14Å; R256-Y288 VanDerWaalsContact CG-CZ 3.44Å
257	P	95.1	Very high	95.5	Very high	48 Å²	48	31.5 Å²	31.5	31%	0.312	18%	0.179	S	C	.	.	S	Bend	trans	-54.7	-38.3	176.2	-27.9	34.8	0	0	0	113.6	Q295	P257-Q295 HydrophobicContact CB-CG 3.91Å; P257-Q295 HydrophobicContact CG-CG 4.34Å; P257-Q295 VanDerWaalsContact CG-NE2 3.26Å
258	F	97.3	Very high	95.6	Very high	9 Å²	9	32.4 Å²	32.4	4%	0.039	18%	0.18	C	C	.	.	S	Bend	trans	-134	87.8	172.8	-60.3	-85.8	0	0	0	108.1	F248 R256 I260 S291 L294 Q295 V298 L303	F248-F258 HydrophobicContact CZ-CD1 4.26Å; R256-F258 PolarHBondContact O-N 2.84Å; F258-I260 HydrophobicContact CB-CD1 4.46Å; F258-I260 HydrophobicContact CB-CG1 4.26Å; F258-I260 PolarHBondContact O-N 3.3Å; F258-S291 PolarHBondContact N-OG 3.04Å; F258-S291 PolarHBondContact O-OG 3.04Å; F258-L294 HydrophobicContact CB-CD1 4.15Å; F258-L294 HydrophobicContact CD1-CD1 4.28Å; F258-L294 HydrophobicContact CD2-CB 3.83Å; F258-L294 HydrophobicContact CE2-CB 4Å; F258-L294 HydrophobicContact CG-CB 4.13Å; F258-L294 HydrophobicContact CG-CD1 4.11Å; F258-L294 HydrophobicContact CZ-CB 4.43Å; F258-Q295 HydrophobicContact CD2-CG 4.02Å; F258-Q295 HydrophobicContact CE2-CB 4.45Å; F258-Q295 HydrophobicContact CE2-CG 3.74Å; F258-V298 HydrophobicContact CE1-CG1 4.24Å; F258-V298 HydrophobicContact CZ-CG1 4.07Å; F258-V298 WeakPolarHBondContact CZ-O 3.45Å; F258-L303 HydrophobicContact CD1-CD1 4.17Å; F258-L303 HydrophobicContact CE1-CD1 3.94Å; F258-L303 HydrophobicContact CE1-CD2 4.15Å; F258-L303 HydrophobicContact CE1-CG 4.31Å
259	P	96.2	Very high	95.6	Very high	4 Å²	4	31 Å²	31	3%	0.026	17%	0.174	C	C	.	.			trans	-81.2	68.9	177.6	34.1	-29.9	0	0	0	109.2	F248 A250 R256	F248-P259 HydrophobicContact CB-CG 3.56Å; F248-P259 VanDerWaalsContact CD2-CD 3.42Å; F248-P259 HydrophobicContact CD2-CG 3.79Å; F248-P259 HydrophobicContact CG-CG 3.76Å; A250-P259 HydrophobicContact CB-CB 3.8Å; A250-P259 HydrophobicContact CB-CG 4.29Å; R256-P259 HydrophobicContact CB-CB 3.96Å; R256-P259 VanDerWaalsContact O-CD 3.31Å; R256-P259 WeakPolarHBondContact O-CD 3.31Å
260	I	96.2	Very high	95.6	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.015	17%	0.173	C	C	.	.			trans	-132.5	155.4	-179.2	63.8	179.8	0	0	0	110.3	V224 E236 F248 F258 A264 F265 E290 L294	V224-I260 HydrophobicContact CG1-CD1 4.26Å; E236-I260 VanDerWaalsContact OE1-C 3.27Å; E236-I260 WeakPolarHBondContact OE1-CA 3.29Å; F248-I260 HydrophobicContact CD1-CG2 3.4Å; F248-I260 VanDerWaalsContact CD1-CG2 3.4Å; F248-I260 HydrophobicContact CE1-CG2 3.38Å; F248-I260 HydrophobicContact CG-CG2 4.37Å; F248-I260 HydrophobicContact CZ-CG2 4.31Å; F258-I260 HydrophobicContact CB-CD1 4.46Å; F258-I260 HydrophobicContact CB-CG1 4.26Å; F258-I260 PolarHBondContact O-N 3.3Å; I260-A264 HydrophobicContact CB-CB 4.07Å; I260-F265 HydrophobicContact CD1-CB 4.12Å; I260-F265 HydrophobicContact CD1-CD1 3.57Å; I260-F265 HydrophobicContact CD1-CE1 4.35Å; I260-F265 HydrophobicContact CD1-CG 4.16Å; I260-F265 HydrophobicContact CG1-CD1 4.06Å; I260-F265 HydrophobicContact CG1-CE1 4.49Å; I260-E290 VanDerWaalsContact O-CG 3.29Å; I260-E290 WeakPolarHBondContact O-CG 3.3Å; I260-L294 HydrophobicContact CD1-CD1 3.72Å; I260-L294 HydrophobicContact CG1-CD1 4.41Å
261	D	95	Very high	95.7	Very high	23 Å²	23	32.9 Å²	32.9	12%	0.123	17%	0.174	C	C	.	.			trans	-73.6	156.3	172.4	-171.4	76.1	0	0	0	112.9	V230 E236 A263 A264 F265	V230-D261 HydrophobicContact CG1-CB 3.96Å; V230-D261 HydrophobicContact CG2-CB 3.88Å; E236-D261 PolarHBondContact OE1-N 3.09Å; E236-D261 VanDerWaalsContact OE1-N 3.09Å; D261-A263 PolarHBondContact O-N 3.34Å; D261-A263 WeakPolarHBondContact OD2-CB 3.39Å; D261-A263 PolarHBondContact OD2-N 2.98Å; D261-A264 HydrophobicContact CB-CB 4.28Å; D261-A264 WeakPolarHBondContact O-CB 3.44Å; D261-A264 PolarHBondContact O-N 2.82Å; D261-F265 WeakPolarHBondContact O-CD1 3.12Å
262	M	96.1	Very high	95.9	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.02	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-57.6	-33.7	176.9	-165.1	66.5	60	0	0	113.2	F201 A264 F265 F280 Q289 E290	F201-M262 HydrophobicContact CB-CG 3.66Å; F201-M262 HydrophobicContact CB-SD 4.23Å; F201-M262 HydrophobicContact CD2-CG 4.47Å; F201-M262 HydrophobicContact CD2-SD 3.93Å; F201-M262 HydrophobicContact CG-CG 4.19Å; F201-M262 HydrophobicContact CG-SD 4.12Å; M262-A264 VanDerWaalsContact C-N 3.3Å; M262-F265 HydrophobicContact SD-CE1 4.3Å; M262-F265 HydrophobicContact SD-CZ 3.85Å; M262-F280 HydrophobicContact CE-CD1 4.47Å; M262-F280 HydrophobicContact CE-CE1 3.65Å; M262-F280 HydrophobicContact CE-CZ 4.17Å; M262-F280 HydrophobicContact SD-CE1 3.97Å; M262-F280 HydrophobicContact SD-CZ 3.91Å; M262-Q289 HydrophobicContact CE-CB 4.37Å; M262-Q289 HydrophobicContact CE-CG 4Å; M262-E290 HydrophobicContact CB-CG 4.38Å; M262-E290 HydrophobicContact CE-CG 3.8Å; M262-E290 HydrophobicContact SD-CG 4.34Å
263	A	96.8	Very high	96.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-85.2	1.3	178	0	0	0	0	0	113.4	Y200 Y208 W225 D261 V315	Y200-A263 PolarHBondContact OH-O 3.14Å; Y208-A263 HydrophobicContact CE1-CB 4.39Å; W225-A263 PolarHBondContact NE1-O 3.01Å; D261-A263 PolarHBondContact O-N 3.34Å; D261-A263 WeakPolarHBondContact OD2-CB 3.39Å; D261-A263 PolarHBondContact OD2-N 2.98Å; A263-V315 HydrophobicContact CB-CG1 4.13Å
264	A	98.2	Very high	96.6	Very high	4 Å²	4	26.7 Å²	26.7	3%	0.033	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-88.8	-0.7	-176.3	0	0	0	0	0	114.1	V224 W225 V227 I260 D261 M262	V224-A264 WeakPolarHBondContact CA-O 2.92Å; W225-A264 PolarHBondContact N-O 3.33Å; V227-A264 HydrophobicContact CG2-CB 3.48Å; V227-A264 VanDerWaalsContact CG2-CB 3.48Å; I260-A264 HydrophobicContact CB-CB 4.07Å; D261-A264 HydrophobicContact CB-CB 4.28Å; D261-A264 WeakPolarHBondContact O-CB 3.44Å; D261-A264 PolarHBondContact O-N 2.82Å; M262-A264 VanDerWaalsContact C-N 3.3Å
265	F	98.7	Very high	96.8	Very high	1 Å²	1	26 Å²	26	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.8	-175	66.5	-92.3	0	0	0	113.8	Y200 F201 V222 S223 V224 I260 D261 M262 V267 E290 F293 L294	Y200-F265 VanDerWaalsContact CD2-O 3.31Å; Y200-F265 WeakPolarHBondContact CD2-O 3.16Å; F201-F265 HydrophobicContact CD2-CE2 4.33Å; V222-F265 HydrophobicContact CG1-CB 4.22Å; S223-F265 CarbonylContact O-C 3.57Å; S223-F265 WeakPolarHBondContact O-CA 3.35Å; S223-F265 VanDerWaalsContact O-CB 3.28Å; S223-F265 WeakPolarHBondContact O-CB 3.29Å; V224-F265 HydrophobicContact CG1-CB 4.02Å; I260-F265 HydrophobicContact CD1-CB 4.12Å; I260-F265 HydrophobicContact CD1-CD1 3.57Å; I260-F265 HydrophobicContact CD1-CE1 4.35Å; I260-F265 HydrophobicContact CD1-CG 4.16Å; I260-F265 HydrophobicContact CG1-CD1 4.06Å; I260-F265 HydrophobicContact CG1-CE1 4.49Å; D261-F265 WeakPolarHBondContact O-CD1 3.12Å; M262-F265 HydrophobicContact SD-CE1 4.3Å; M262-F265 HydrophobicContact SD-CZ 3.85Å; F265-V267 HydrophobicContact CD2-CG2 3.86Å; F265-V267 HydrophobicContact CE2-CG2 4.02Å; F265-E290 HydrophobicContact CE1-CB 4.03Å; F265-E290 HydrophobicContact CE1-CG 3.93Å; F265-F293 HydrophobicContact CE2-CD1 4.06Å; F265-F293 HydrophobicContact CE2-CE1 4.22Å; F265-F293 HydrophobicContact CZ-CD1 4.27Å; F265-L294 HydrophobicContact CD1-CD1 4Å; F265-L294 HydrophobicContact CD2-CD1 4.25Å; F265-L294 HydrophobicContact CD2-CD2 3.84Å; F265-L294 HydrophobicContact CD2-CG 4.44Å; F265-L294 HydrophobicContact CE1-CD1 4.02Å; F265-L294 HydrophobicContact CE2-CD1 4.29Å; F265-L294 HydrophobicContact CE2-CD2 3.78Å; F265-L294 HydrophobicContact CE2-CG 4.17Å; F265-L294 HydrophobicContact CG-CD1 4.11Å; F265-L294 HydrophobicContact CG-CD2 4.46Å; F265-L294 HydrophobicContact CZ-CD1 4.17Å; F265-L294 HydrophobicContact CZ-CD2 4.35Å; F265-L294 HydrophobicContact CZ-CG 4.23Å
266	A	98.8	Very high	96.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150.9	168.7	0	0	0	0	0	110.6	V198 L199 Y200 M216 V222 S223 W225	V198-A266 HydrophobicContact CG1-CB 3.61Å; L199-A266 WeakPolarHBondContact O-CA 3.19Å; Y200-A266 HydrophobicContact CD2-CB 4.26Å; M216-A266 HydrophobicContact CB-CB 3.9Å; M216-A266 HydrophobicContact SD-CB 4.3Å; V222-A266 CarbonylContact C-O 3.54Å; V222-A266 VanDerWaalsContact CA-O 3.26Å; V222-A266 WeakPolarHBondContact CA-O 3.4Å; S223-A266 PolarHBondContact N-O 2.89Å; S223-A266 PolarHBondContact O-N 3.42Å; W225-A266 HydrophobicContact CH2-CB 3.55Å; W225-A266 HydrophobicContact CZ3-CB 3.9Å
267	V	98.7	Very high	96.7	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.2	-172.3	-177.6	0	0	0	0	109.8	V198 L199 V222 F265 I269 L271 V272 F293 L294 L297	V198-V267 CarbonylContact C-O 3.57Å; V198-V267 WeakPolarHBondContact CA-O 3.37Å; L199-V267 PolarHBondContact N-O 2.99Å; L199-V267 PolarHBondContact O-N 3.15Å; V222-V267 HydrophobicContact CG1-CG2 4.43Å; V222-V267 HydrophobicContact CG2-CG1 4.23Å; V222-V267 HydrophobicContact CG2-CG2 4.11Å; F265-V267 HydrophobicContact CD2-CG2 3.86Å; F265-V267 HydrophobicContact CE2-CG2 4.02Å; V267-I269 PolarHBondContact O-N 3.35Å; V267-L271 HydrophobicContact CG1-CB 4.26Å; V267-L271 HydrophobicContact CG1-CD1 4.39Å; V267-V272 HydrophobicContact CB-CG2 4.42Å; V267-V272 HydrophobicContact CG1-CG2 3.71Å; V267-F293 HydrophobicContact CG2-CE1 4.07Å; V267-L294 HydrophobicContact CG2-CD2 4.11Å; V267-L297 HydrophobicContact CG1-CD1 3.75Å; V267-L297 HydrophobicContact CG2-CD1 4.34Å
268	N	98.4	Very high	96.8	Very high	33 Å²	33	30.3 Å²	30.3	18%	0.176	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	124.6	168.9	-178.4	-32.7	0	0	0	110	K220 M221 R270 L271	K220-N268 VanDerWaalsContact O-CB 3.29Å; K220-N268 WeakPolarHBondContact O-CB 3.36Å; K220-N268 PolarHBondContact O-ND2 2.85Å; M221-N268 PolarHBondContact O-N 3.29Å; N268-R270 PolarHBondContact O-N 3.01Å; N268-R270 VanDerWaalsContact O-N 3.08Å; N268-R270 WeakPolarHBondContact OD1-CB 3.47Å; N268-R270 PolarHBondContact OD1-N 3.38Å; N268-L271 HydrophobicContact CB-CD1 4.38Å; N268-L271 HydrophobicContact CB-CG 4.3Å; N268-L271 WeakPolarHBondContact O-CB 3Å; N268-L271 PolarHBondContact O-N 3.35Å
269	I	98	Very high	96.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.5	-32.8	-173.3	-168.3	60.2	0	0	0	112.6	Y95 L187 L191 T195 G197 L199 V267 L271 V272 L273	Y95-I269 HydrophobicContact CD2-CB 4.29Å; Y95-I269 HydrophobicContact CD2-CD1 4.1Å; Y95-I269 HydrophobicContact CD2-CG1 4Å; Y95-I269 HydrophobicContact CE2-CB 4.34Å; Y95-I269 HydrophobicContact CE2-CG1 4.04Å; Y95-I269 HydrophobicContact CE2-CG2 4.37Å; L187-I269 HydrophobicContact CD1-CD1 4.26Å; L187-I269 HydrophobicContact CD2-CD1 4.39Å; L191-I269 HydrophobicContact CD1-CD1 4.25Å; L191-I269 HydrophobicContact CD1-CG1 3.9Å; T195-I269 HydrophobicContact CG2-CG2 4.48Å; G197-I269 WeakPolarHBondContact O-CG2 3.47Å; G197-I269 PolarHBondContact O-N 3.44Å; L199-I269 HydrophobicContact CB-CD1 4.08Å; V267-I269 PolarHBondContact O-N 3.35Å; I269-L271 VanDerWaalsContact C-N 3.32Å; I269-L271 PolarHBondContact O-N 3.38Å; I269-V272 WeakPolarHBondContact O-CB 3.48Å; I269-V272 PolarHBondContact O-N 2.95Å; I269-V272 VanDerWaalsContact O-N 3.08Å; I269-L273 HydrophobicContact CG1-CD1 4.09Å; I269-L273 HydrophobicContact CG1-CG 4.16Å; I269-L273 WeakPolarHBondContact O-CG 3.42Å; I269-L273 PolarHBondContact O-N 3.37Å
270	R	97.2	Very high	96.8	Very high	87 Å²	87	33 Å²	33	33%	0.328	17%	0.171	S	C	.	.	H	α-helix	trans	-62.1	-38.6	179.8	-68.9	-175.9	177.7	173.7	-9.3	112.6	L194 T195 N268 V272 L273 D274	L194-R270 PolarHBondContact O-NE 3.46Å; L194-R270 PolarHBondContact O-NH2 3.45Å; T195-R270 WeakPolarHBondContact O-CG 3.45Å; T195-R270 PolarHBondContact O-NE 2.96Å; T195-R270 VanDerWaalsContact O-NE 3.13Å; N268-R270 PolarHBondContact O-N 3.01Å; N268-R270 VanDerWaalsContact O-N 3.08Å; N268-R270 WeakPolarHBondContact OD1-CB 3.47Å; N268-R270 PolarHBondContact OD1-N 3.38Å; R270-V272 PolarHBondContact O-N 3.46Å; R270-V272 VanDerWaalsContact O-N 3.13Å; R270-L273 PolarHBondContact O-N 2.9Å; R270-L273 VanDerWaalsContact O-N 3.17Å; R270-D274 WeakPolarHBondContact O-CB 3.28Å; R270-D274 PolarHBondContact O-N 2.93Å
271	L	97.4	Very high	96.7	Very high	25 Å²	25	36.3 Å²	36.3	13%	0.131	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-28.5	177.2	-66	-178	0	0	0	112.9	M221 V222 V267 N268 I269 L297	M221-L271 HydrophobicContact CB-CD1 4.34Å; M221-L271 HydrophobicContact CE-CD1 3.88Å; M221-L271 HydrophobicContact CE-CD2 3.96Å; M221-L271 WeakPolarHBondContact O-CD1 3.47Å; M221-L271 HydrophobicContact SD-CD1 4.13Å; M221-L271 HydrophobicContact SD-CD2 4.19Å; V222-L271 HydrophobicContact CG2-CD1 4.5Å; V267-L271 HydrophobicContact CG1-CB 4.26Å; V267-L271 HydrophobicContact CG1-CD1 4.39Å; N268-L271 HydrophobicContact CB-CD1 4.38Å; N268-L271 HydrophobicContact CB-CG 4.3Å; N268-L271 WeakPolarHBondContact O-CB 3Å; N268-L271 PolarHBondContact O-N 3.35Å; I269-L271 VanDerWaalsContact C-N 3.32Å; I269-L271 PolarHBondContact O-N 3.38Å; L271-L297 HydrophobicContact CB-CD2 4.05Å; L271-L297 WeakPolarHBondContact O-CD2 3.43Å
272	V	97.2	Very high	96.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-84.9	-39.3	179.1	179.2	0	0	0	0	111.3	L184 R188 L199 V267 I269 R270 K275 F293	L184-V272 HydrophobicContact CD2-CG1 3.49Å; L184-V272 VanDerWaalsContact CD2-CG1 3.49Å; R188-V272 PolarHBondContact NE-O 2.88Å; R188-V272 PolarHBondContact NH2-O 2.89Å; L199-V272 HydrophobicContact CD2-CG1 4.23Å; L199-V272 HydrophobicContact CD2-CG2 3.83Å; V267-V272 HydrophobicContact CB-CG2 4.42Å; V267-V272 HydrophobicContact CG1-CG2 3.71Å; I269-V272 WeakPolarHBondContact O-CB 3.48Å; I269-V272 PolarHBondContact O-N 2.95Å; I269-V272 VanDerWaalsContact O-N 3.08Å; R270-V272 PolarHBondContact O-N 3.46Å; R270-V272 VanDerWaalsContact O-N 3.13Å; V272-K275 PolarHBondContact O-N 3.11Å; V272-F293 HydrophobicContact CG2-CZ 4.28Å
273	L	97.3	Very high	96.2	Very high	22 Å²	22	42.5 Å²	42.5	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-39.4	176.4	-63.7	178.6	0	0	0	111.5	R188 L191 S192 I269 R270 K275	R188-L273 HydrophobicContact CG-CD2 3.99Å; L191-L273 HydrophobicContact CB-CD1 4.13Å; L191-L273 HydrophobicContact CB-CD2 4.35Å; S192-L273 WeakPolarHBondContact O-CD1 3.33Å; I269-L273 HydrophobicContact CG1-CD1 4.09Å; I269-L273 HydrophobicContact CG1-CG 4.16Å; I269-L273 WeakPolarHBondContact O-CG 3.42Å; I269-L273 PolarHBondContact O-N 3.37Å; R270-L273 PolarHBondContact O-N 2.9Å; R270-L273 VanDerWaalsContact O-N 3.17Å; L273-K275 PolarHBondContact O-N 3.43Å
274	D	96	Very high	95.9	Very high	107 Å²	107	43.7 Å²	43.7	57%	0.572	22%	0.223	S	C	*	.	S	Bend	trans	-68.5	-14.2	178.2	-66.4	-18.6	0	0	0	113.1	R270 P276	R270-D274 WeakPolarHBondContact O-CB 3.28Å; R270-D274 PolarHBondContact O-N 2.93Å; D274-P276 WeakPolarHBondContact O-CD 3.28Å
275	K	95.9	Very high	95.4	Very high	69 Å²	69	49.1 Å²	49.1	30%	0.3	25%	0.246	S	C	.	.			trans	-117.5	80.9	178.7	-63.9	-154.2	-179.5	76.4	0	110.9	R188 V272 L273 N277 L278 P296 L297	R188-K275 PolarHBondContact NH2-O 3.33Å; V272-K275 PolarHBondContact O-N 3.11Å; L273-K275 PolarHBondContact O-N 3.43Å; K275-N277 PolarHBondContact O-N 2.87Å; K275-N277 VanDerWaalsContact O-N 3.13Å; K275-L278 HydrophobicContact CB-CB 3.84Å; K275-L278 WeakPolarHBondContact O-CB 3.22Å; K275-L278 PolarHBondContact O-N 2.93Å; K275-P296 HydrophobicContact CD-CB 4.31Å; K275-P296 WeakPolarHBondContact CE-O 3.26Å; K275-P296 PolarHBondContact NZ-O 2.95Å; K275-L297 HydrophobicContact CD-CD2 4.08Å
276	P	92.1	Very high	94.8	Very high	84 Å²	84	54.9 Å²	54.9	55%	0.545	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27.9	-175.4	22.9	-33.9	0	0	0	113.8	R188 D274	R188-P276 VanDerWaalsContact CZ-O 3.32Å; R188-P276 PolarHBondContact NH1-O 3.34Å; D274-P276 WeakPolarHBondContact O-CD 3.28Å
277	N	94.5	Very high	94.3	Very high	149 Å²	149	56 Å²	56	80%	0.797	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	1.6	-179.2	-60.4	-26.8	0	0	0	113.8	K275 L279	K275-N277 PolarHBondContact O-N 2.87Å; K275-N277 VanDerWaalsContact O-N 3.13Å; N277-L279 PolarHBondContact O-N 3.3Å
278	L	96.8	Very high	94.1	Very high	11 Å²	11	58.1 Å²	58.1	6%	0.058	29%	0.287	C	S	.	.			trans	-73.6	109.1	176.3	-179	75.2	0	0	0	109.5	R188 K275 F293 P296 L297	R188-L278 PolarHBondContact NH1-O 3.45Å; R188-L278 PolarHBondContact NH2-O 3.44Å; K275-L278 HydrophobicContact CB-CB 3.84Å; K275-L278 WeakPolarHBondContact O-CB 3.22Å; K275-L278 PolarHBondContact O-N 2.93Å; L278-F293 HydrophobicContact CD1-CD2 4.19Å; L278-F293 HydrophobicContact CD1-CE2 4.5Å; L278-F293 WeakPolarHBondContact CD1-O 3.37Å; L278-F293 HydrophobicContact CD2-CD2 4.01Å; L278-F293 HydrophobicContact CD2-CE2 3.52Å; L278-F293 HydrophobicContact CD2-CZ 3.92Å; L278-F293 HydrophobicContact CG-CD2 3.93Å; L278-F293 HydrophobicContact CG-CE2 3.78Å; L278-P296 HydrophobicContact CD1-CB 4.14Å; L278-P296 HydrophobicContact CD1-CG 3.94Å; L278-L297 HydrophobicContact CD2-CD1 3.77Å; L278-L297 HydrophobicContact CD2-CD2 3.52Å; L278-L297 HydrophobicContact CD2-CG 3.76Å
279	L	97	Very high	93.9	Very high	64 Å²	64	57 Å²	57	34%	0.335	28%	0.281	S	S	.	.			trans	-138.8	159.9	-179.8	-67.1	173.4	0	0	0	109.5	N181 L184 N277 H292	N181-L279 HydrophobicContact CB-CD2 4.11Å; L184-L279 HydrophobicContact CB-CD2 4.46Å; L184-L279 HydrophobicContact CD1-CD2 4.37Å; N277-L279 PolarHBondContact O-N 3.3Å; L279-H292 PolarHBondContact O-CD2 3.47Å; L279-H292 PolarHBondContact O-NE2 2.92Å
280	F	96.8	Very high	93.9	Very high	5 Å²	5	58.1 Å²	58.1	2%	0.022	29%	0.286	C	S	.	.			trans	-78.1	149.7	165.1	-63.9	-78.5	0	0	0	110.2	V177 R180 N181 L184 F201 M262 Q289 F293	V177-F280 HydrophobicContact CB-CB 4.45Å; V177-F280 HydrophobicContact CG1-CB 3.92Å; V177-F280 HydrophobicContact CG2-CB 4.45Å; R180-F280 HydrophobicContact CB-CD2 3.42Å; R180-F280 VanDerWaalsContact CB-CD2 3.42Å; R180-F280 HydrophobicContact CB-CE2 3.44Å; R180-F280 VanDerWaalsContact CB-CE2 3.44Å; R180-F280 HydrophobicContact CB-CG 4.4Å; R180-F280 HydrophobicContact CB-CZ 4.41Å; R180-F280 HydrophobicContact CG-CD2 4.37Å; R180-F280 HydrophobicContact CG-CE2 4.11Å; N181-F280 PolarHBondContact ND2-O 2.93Å; N181-F280 WeakPolarHBondContact OD1-CB 3.19Å; N181-F280 PolarHBondContact OD1-N 2.87Å; L184-F280 HydrophobicContact CD1-CD2 3.99Å; L184-F280 HydrophobicContact CD1-CE2 3.94Å; F201-F280 HydrophobicContact CD2-CZ 4.44Å; F201-F280 AromaticContact CE1-CE2 3.87Å; F201-F280 HydrophobicContact CE1-CE2 3.87Å; F201-F280 HydrophobicContact CE1-CZ 4.2Å; F201-F280 HydrophobicContact CE2-CE2 4.16Å; F201-F280 AromaticContact CE2-CZ 3.81Å; F201-F280 HydrophobicContact CE2-CZ 3.81Å; F201-F280 AromaticContact CZ-CE2 3.53Å; F201-F280 HydrophobicContact CZ-CE2 3.53Å; F201-F280 AromaticContact CZ-CZ 3.67Å; F201-F280 HydrophobicContact CZ-CZ 3.67Å; M262-F280 HydrophobicContact CE-CD1 4.47Å; M262-F280 HydrophobicContact CE-CE1 3.65Å; M262-F280 HydrophobicContact CE-CZ 4.17Å; M262-F280 HydrophobicContact SD-CE1 3.97Å; M262-F280 HydrophobicContact SD-CZ 3.91Å; F280-Q289 HydrophobicContact CD1-CG 3.49Å; F280-Q289 VanDerWaalsContact CD1-CG 3.49Å; F280-Q289 HydrophobicContact CE1-CG 4Å; F280-Q289 HydrophobicContact CG-CG 4.45Å; F280-F293 HydrophobicContact CD1-CB 4.17Å; F280-F293 HydrophobicContact CD1-CD2 4.37Å; F280-F293 HydrophobicContact CD1-CG 4.5Å; F280-F293 HydrophobicContact CD2-CD2 4.46Å; F280-F293 HydrophobicContact CE1-CB 3.58Å; F280-F293 HydrophobicContact CE1-CD1 4.45Å; F280-F293 AromaticContact CE1-CD2 3.86Å; F280-F293 HydrophobicContact CE1-CD2 3.86Å; F280-F293 AromaticContact CE1-CG 3.71Å; F280-F293 HydrophobicContact CE1-CG 3.71Å; F280-F293 AromaticContact CE2-CD2 3.89Å; F280-F293 HydrophobicContact CE2-CD2 3.89Å; F280-F293 HydrophobicContact CE2-CE2 4.03Å; F280-F293 HydrophobicContact CE2-CG 4.43Å; F280-F293 HydrophobicContact CZ-CB 4.1Å; F280-F293 HydrophobicContact CZ-CD1 4.16Å; F280-F293 AromaticContact CZ-CD2 3.6Å; F280-F293 HydrophobicContact CZ-CD2 3.6Å; F280-F293 HydrophobicContact CZ-CE2 4.03Å; F280-F293 AromaticContact CZ-CG 3.68Å; F280-F293 HydrophobicContact CZ-CG 3.68Å; F280-F293 HydrophobicContact CZ-CZ 4.48Å
281	D	94.5	Very high	93.8	Very high	73 Å²	73	54 Å²	54	39%	0.39	27%	0.271	S	S	.	.			trans	-131.5	137.5	-177.6	-174.5	-9.7	0	0	0	110.8	E283 V284 Q289	D281-E283 VanDerWaalsContact C-N 3.34Å; D281-E283 PolarHBondContact OD1-N 2.72Å; D281-V284 HydrophobicContact CB-CG2 3.85Å; D281-Q289 PolarHBondContact O-NE2 3.07Å; D281-Q289 PolarHBondContact O-OE1 3.5Å; D281-Q289 VanDerWaalsContact O-OE1 3.07Å
282	Y	91.2	Very high	93.8	Very high	28 Å²	28	56 Å²	56	11%	0.11	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-26.1	179.1	-74.3	-77.3	0	0	0	113.4	T156 P157 Y160 V177 A178 V284	T156-Y282 HydrophobicContact CG2-CE1 4.08Å; P157-Y282 WeakPolarHBondContact CD-OH 3.45Å; P157-Y282 HydrophobicContact CG-CE2 4.39Å; Y160-Y282 HydrophobicContact CD1-CD1 4.03Å; Y160-Y282 HydrophobicContact CD1-CG 4.11Å; Y160-Y282 AromaticContact CD2-CD1 3.71Å; Y160-Y282 HydrophobicContact CD2-CD1 3.71Å; Y160-Y282 AromaticContact CD2-CD2 3.77Å; Y160-Y282 HydrophobicContact CD2-CD2 3.77Å; Y160-Y282 AromaticContact CD2-CE1 3.99Å; Y160-Y282 HydrophobicContact CD2-CE1 3.99Å; Y160-Y282 HydrophobicContact CD2-CE2 4.05Å; Y160-Y282 AromaticContact CD2-CG 3.6Å; Y160-Y282 HydrophobicContact CD2-CG 3.6Å; Y160-Y282 HydrophobicContact CE1-CG 4.22Å; Y160-Y282 HydrophobicContact CE2-CD1 4.31Å; Y160-Y282 AromaticContact CE2-CD2 3.74Å; Y160-Y282 HydrophobicContact CE2-CD2 3.74Å; Y160-Y282 HydrophobicContact CE2-CE2 4.34Å; Y160-Y282 AromaticContact CE2-CG 3.73Å; Y160-Y282 HydrophobicContact CE2-CG 3.73Å; Y160-Y282 AromaticContact CG-CD1 3.56Å; Y160-Y282 HydrophobicContact CG-CD1 3.56Å; Y160-Y282 HydrophobicContact CG-CD2 4.44Å; Y160-Y282 AromaticContact CG-CE1 3.99Å; Y160-Y282 HydrophobicContact CG-CE1 3.99Å; Y160-Y282 AromaticContact CG-CG 3.81Å; Y160-Y282 HydrophobicContact CG-CG 3.81Å; V177-Y282 HydrophobicContact CB-CD1 3.99Å; V177-Y282 HydrophobicContact CB-CD2 4.27Å; V177-Y282 HydrophobicContact CB-CE1 3.61Å; V177-Y282 HydrophobicContact CB-CE2 3.91Å; V177-Y282 HydrophobicContact CB-CG 4.3Å; V177-Y282 HydrophobicContact CG1-CD1 4.25Å; V177-Y282 HydrophobicContact CG1-CD2 3.69Å; V177-Y282 HydrophobicContact CG1-CE1 4.14Å; V177-Y282 HydrophobicContact CG1-CE2 3.55Å; V177-Y282 HydrophobicContact CG1-CG 4.04Å; V177-Y282 HydrophobicContact CG2-CD1 4.02Å; V177-Y282 HydrophobicContact CG2-CE1 4.02Å; V177-Y282 HydrophobicContact CG2-CG 4.45Å; A178-Y282 VanDerWaalsContact CB-OH 3.23Å; A178-Y282 WeakPolarHBondContact CB-OH 3.36Å; A178-Y282 PolarHBondContact N-OH 2.97Å; Y282-V284 PolarHBondContact O-N 2.91Å
283	E	89.7	Confident	93.8	Very high	130 Å²	130	56 Å²	56	61%	0.607	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	9.7	-176.3	-57.1	-58.2	149.7	0	0	112.6	Y160 D281	Y160-E283 WeakPolarHBondContact CE1-OE1 3.49Å; Y160-E283 PolarHBondContact OH-OE1 3.49Å; D281-E283 VanDerWaalsContact C-N 3.34Å; D281-E283 PolarHBondContact OD1-N 2.72Å
284	V	89.7	Confident	93.9	Very high	25 Å²	25	54.9 Å²	54.9	15%	0.152	27%	0.274	C	S	.	.	S	Bend	trans	-76.9	138.3	174.5	175.1	0	0	0	0	110.1	D281 Y282 Y288 H292	D281-V284 HydrophobicContact CB-CG2 3.85Å; Y282-V284 PolarHBondContact O-N 2.91Å; V284-Y288 VanDerWaalsContact CG1-C 3.49Å; V284-Y288 VanDerWaalsContact CG1-CB 3.46Å; V284-Y288 WeakPolarHBondContact CG1-O 3.44Å; V284-H292 HydrophobicContact CG1-CB 4.09Å; V284-H292 HydrophobicContact CG2-CB 4.03Å
285	K	88.5	Confident	94	Very high	118 Å²	118	55 Å²	55	51%	0.513	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-50.5	142	176.3	-177.7	179.5	171.3	-155.1	0	110.7	D253 G287 Y288	D253-K285 IonicContact OD2-NZ 3.12Å; D253-K285 PolarHBondContact OD2-NZ 3.28Å; K285-G287 PolarHBondContact O-N 3.48Å; K285-Y288 HydrophobicContact CB-CD2 3.8Å; K285-Y288 HydrophobicContact CB-CE2 4.33Å; K285-Y288 HydrophobicContact CB-CG 4.14Å; K285-Y288 HydrophobicContact CD-CD2 3.82Å; K285-Y288 HydrophobicContact CD-CE2 3.45Å; K285-Y288 VanDerWaalsContact CD-CE2 3.45Å; K285-Y288 HydrophobicContact CG-CD2 3.8Å; K285-Y288 HydrophobicContact CG-CE2 3.95Å; K285-Y288 PolarHBondContact NZ-OH 2.9Å; K285-Y288 VanDerWaalsContact O-CB 3.32Å; K285-Y288 WeakPolarHBondContact O-CB 3.09Å; K285-Y288 PolarHBondContact O-N 2.95Å
286	R	85.9	Confident	94	Very high	121 Å²	121	54.9 Å²	54.9	46%	0.457	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	124.3	178.5	-178.1	-175.6	172.5	-179.4	-2.7	111.5	W171 Y252 Y288	W171-R286 WeakPolarHBondContact O-CD 3.25Å; Y252-R286 WeakPolarHBondContact CE1-O 3.39Å; Y252-R286 WeakPolarHBondContact OH-CB 3.42Å; Y252-R286 WeakPolarHBondContact OH-CD 3.33Å; Y252-R286 WeakPolarHBondContact OH-CG 3.49Å; Y252-R286 PolarHBondContact OH-O 2.85Å; R286-Y288 VanDerWaalsContact C-N 3.33Å
287	G	88.2	Confident	94.3	Very high	24 Å²	24	51.4 Å²	51.4	25%	0.247	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	4	-179	0	0	0	0	0	114.8	R256 K285	R256-G287 WeakPolarHBondContact CD-O 3.28Å; R256-G287 PolarHBondContact NH1-O 2.97Å; K285-G287 PolarHBondContact O-N 3.48Å
288	Y	94	Very high	94.4	Very high	46 Å²	46	44.6 Å²	44.6	18%	0.18	22%	0.218	C	C	.	.			trans	-96.5	9.1	176.1	-77.8	-112.8	0	0	0	112.7	D253 R256 V284 K285 R286 E290 S291 H292	D253-Y288 VanDerWaalsContact OD2-CE2 3.28Å; D253-Y288 WeakPolarHBondContact OD2-CE2 3.26Å; D253-Y288 PolarHBondContact OD2-OH 3.11Å; R256-Y288 HydrophobicContact CB-CE1 4.37Å; R256-Y288 HydrophobicContact CG-CD1 4.1Å; R256-Y288 HydrophobicContact CG-CD2 3.82Å; R256-Y288 HydrophobicContact CG-CE1 3.78Å; R256-Y288 HydrophobicContact CG-CE2 3.44Å; R256-Y288 VanDerWaalsContact CG-CE2 3.44Å; R256-Y288 HydrophobicContact CG-CG 4.14Å; R256-Y288 VanDerWaalsContact CG-CZ 3.44Å; V284-Y288 VanDerWaalsContact CG1-C 3.49Å; V284-Y288 VanDerWaalsContact CG1-CB 3.46Å; V284-Y288 WeakPolarHBondContact CG1-O 3.44Å; K285-Y288 HydrophobicContact CB-CD2 3.8Å; K285-Y288 HydrophobicContact CB-CE2 4.33Å; K285-Y288 HydrophobicContact CB-CG 4.14Å; K285-Y288 HydrophobicContact CD-CD2 3.82Å; K285-Y288 HydrophobicContact CD-CE2 3.45Å; K285-Y288 VanDerWaalsContact CD-CE2 3.45Å; K285-Y288 HydrophobicContact CG-CD2 3.8Å; K285-Y288 HydrophobicContact CG-CE2 3.95Å; K285-Y288 PolarHBondContact NZ-OH 2.9Å; K285-Y288 VanDerWaalsContact O-CB 3.32Å; K285-Y288 WeakPolarHBondContact O-CB 3.09Å; K285-Y288 PolarHBondContact O-N 2.95Å; R286-Y288 VanDerWaalsContact C-N 3.33Å; Y288-E290 PolarHBondContact O-N 3.03Å; Y288-S291 PolarHBondContact O-N 2.89Å; Y288-H292 VanDerWaalsContact O-CB 3.3Å; Y288-H292 WeakPolarHBondContact O-CB 3.35Å; Y288-H292 PolarHBondContact O-N 3.2Å
289	Q	94.9	Very high	94.5	Very high	9 Å²	9	51.2 Å²	51.2	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-42.8	-173.5	-167.9	70.4	86.1	0	0	111.8	P174 M262 F280 D281 H292 F293	P174-Q289 VanDerWaalsContact CB-OE1 3.25Å; P174-Q289 VanDerWaalsContact CG-OE1 3.27Å; M262-Q289 HydrophobicContact CE-CB 4.37Å; M262-Q289 HydrophobicContact CE-CG 4Å; F280-Q289 HydrophobicContact CD1-CG 3.49Å; F280-Q289 VanDerWaalsContact CD1-CG 3.49Å; F280-Q289 HydrophobicContact CE1-CG 4Å; F280-Q289 HydrophobicContact CG-CG 4.45Å; D281-Q289 PolarHBondContact O-NE2 3.07Å; D281-Q289 PolarHBondContact O-OE1 3.5Å; D281-Q289 VanDerWaalsContact O-OE1 3.07Å; Q289-H292 PolarHBondContact O-N 3.49Å; Q289-F293 PolarHBondContact O-N 3.42Å; Q289-F293 VanDerWaalsContact O-N 3.1Å
290	E	96.3	Very high	94.5	Very high	24 Å²	24	54.1 Å²	54.1	11%	0.112	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-44.1	176.6	-59.9	78.7	-169.4	0	0	110.3	I260 M262 F265 Y288 F293 L294	I260-E290 VanDerWaalsContact O-CG 3.29Å; I260-E290 WeakPolarHBondContact O-CG 3.3Å; M262-E290 HydrophobicContact CB-CG 4.38Å; M262-E290 HydrophobicContact CE-CG 3.8Å; M262-E290 HydrophobicContact SD-CG 4.34Å; F265-E290 HydrophobicContact CE1-CB 4.03Å; F265-E290 HydrophobicContact CE1-CG 3.93Å; Y288-E290 PolarHBondContact O-N 3.03Å; E290-F293 PolarHBondContact O-N 3.42Å; E290-L294 WeakPolarHBondContact O-CB 3.42Å; E290-L294 WeakPolarHBondContact O-CG 3.43Å; E290-L294 PolarHBondContact O-N 3.38Å
291	S	97	Very high	94.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-46.7	175.3	-71	0	0	0	0	111.9	F258 Y288 F293 L294 Q295	F258-S291 PolarHBondContact N-OG 3.04Å; F258-S291 PolarHBondContact O-OG 3.04Å; Y288-S291 PolarHBondContact O-N 2.89Å; S291-F293 VanDerWaalsContact C-N 3.26Å; S291-F293 PolarHBondContact O-N 2.88Å; S291-L294 PolarHBondContact O-N 3.14Å; S291-Q295 VanDerWaalsContact O-CB 3.32Å; S291-Q295 WeakPolarHBondContact O-CB 3.46Å; S291-Q295 WeakPolarHBondContact O-CG 3.29Å; S291-Q295 PolarHBondContact O-N 3.32Å; S291-Q295 PolarHBondContact O-OE1 3.47Å
292	H	96.7	Very high	94.6	Very high	66 Å²	66	58.4 Å²	58.4	31%	0.306	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-39.3	177.2	177.9	83.2	0	0	0	111.9	L279 V284 Y288 Q289 P296	L279-H292 PolarHBondContact O-CD2 3.47Å; L279-H292 PolarHBondContact O-NE2 2.92Å; V284-H292 HydrophobicContact CG1-CB 4.09Å; V284-H292 HydrophobicContact CG2-CB 4.03Å; Y288-H292 VanDerWaalsContact O-CB 3.3Å; Y288-H292 WeakPolarHBondContact O-CB 3.35Å; Y288-H292 PolarHBondContact O-N 3.2Å; Q289-H292 PolarHBondContact O-N 3.49Å; H292-P296 WeakPolarHBondContact O-CD 3.47Å
293	F	98	Very high	95	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-74.4	-39.6	178.3	-175.1	-104.3	0	0	0	113.3	L184 L199 F201 F265 V267 V272 L278 F280 Q289 E290 S291 L297	L184-F293 HydrophobicContact CD1-CE2 3.93Å; L184-F293 HydrophobicContact CD2-CE2 4.36Å; L184-F293 HydrophobicContact CD2-CZ 4.46Å; L199-F293 HydrophobicContact CD2-CZ 4.17Å; F201-F293 HydrophobicContact CE2-CD1 4.33Å; F201-F293 AromaticContact CE2-CE1 3.68Å; F201-F293 HydrophobicContact CE2-CE1 3.68Å; F201-F293 AromaticContact CE2-CZ 3.81Å; F201-F293 HydrophobicContact CE2-CZ 3.81Å; F201-F293 HydrophobicContact CZ-CE1 4.34Å; F201-F293 HydrophobicContact CZ-CE2 4.44Å; F201-F293 HydrophobicContact CZ-CZ 4Å; F265-F293 HydrophobicContact CE2-CD1 4.06Å; F265-F293 HydrophobicContact CE2-CE1 4.22Å; F265-F293 HydrophobicContact CZ-CD1 4.27Å; V267-F293 HydrophobicContact CG2-CE1 4.07Å; V272-F293 HydrophobicContact CG2-CZ 4.28Å; L278-F293 HydrophobicContact CD1-CD2 4.19Å; L278-F293 HydrophobicContact CD1-CE2 4.5Å; L278-F293 WeakPolarHBondContact CD1-O 3.37Å; L278-F293 HydrophobicContact CD2-CD2 4.01Å; L278-F293 HydrophobicContact CD2-CE2 3.52Å; L278-F293 HydrophobicContact CD2-CZ 3.92Å; L278-F293 HydrophobicContact CG-CD2 3.93Å; L278-F293 HydrophobicContact CG-CE2 3.78Å; F280-F293 HydrophobicContact CD1-CB 4.17Å; F280-F293 HydrophobicContact CD1-CD2 4.37Å; F280-F293 HydrophobicContact CD1-CG 4.5Å; F280-F293 HydrophobicContact CD2-CD2 4.46Å; F280-F293 HydrophobicContact CE1-CB 3.58Å; F280-F293 HydrophobicContact CE1-CD1 4.45Å; F280-F293 AromaticContact CE1-CD2 3.86Å; F280-F293 HydrophobicContact CE1-CD2 3.86Å; F280-F293 AromaticContact CE1-CG 3.71Å; F280-F293 HydrophobicContact CE1-CG 3.71Å; F280-F293 AromaticContact CE2-CD2 3.89Å; F280-F293 HydrophobicContact CE2-CD2 3.89Å; F280-F293 HydrophobicContact CE2-CE2 4.03Å; F280-F293 HydrophobicContact CE2-CG 4.43Å; F280-F293 HydrophobicContact CZ-CB 4.1Å; F280-F293 HydrophobicContact CZ-CD1 4.16Å; F280-F293 AromaticContact CZ-CD2 3.6Å; F280-F293 HydrophobicContact CZ-CD2 3.6Å; F280-F293 HydrophobicContact CZ-CE2 4.03Å; F280-F293 AromaticContact CZ-CG 3.68Å; F280-F293 HydrophobicContact CZ-CG 3.68Å; F280-F293 HydrophobicContact CZ-CZ 4.48Å; Q289-F293 PolarHBondContact O-N 3.42Å; Q289-F293 VanDerWaalsContact O-N 3.1Å; E290-F293 PolarHBondContact O-N 3.42Å; S291-F293 VanDerWaalsContact C-N 3.26Å; S291-F293 PolarHBondContact O-N 2.88Å; F293-L297 HydrophobicContact CD1-CD1 4.28Å; F293-L297 HydrophobicContact CE1-CD1 3.92Å; F293-L297 HydrophobicContact CZ-CD1 4.24Å; F293-L297 WeakPolarHBondContact O-CG 3.23Å
294	L	98.3	Very high	95.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-85.2	-31.6	-173.8	-70.5	175.3	0	0	0	114.3	V222 F258 I260 F265 V267 E290 S291 L297 V298	V222-L294 HydrophobicContact CG1-CD2 3.93Å; V222-L294 HydrophobicContact CG2-CD2 4.22Å; F258-L294 HydrophobicContact CB-CD1 4.15Å; F258-L294 HydrophobicContact CD1-CD1 4.28Å; F258-L294 HydrophobicContact CD2-CB 3.83Å; F258-L294 HydrophobicContact CE2-CB 4Å; F258-L294 HydrophobicContact CG-CB 4.13Å; F258-L294 HydrophobicContact CG-CD1 4.11Å; F258-L294 HydrophobicContact CZ-CB 4.43Å; I260-L294 HydrophobicContact CD1-CD1 3.72Å; I260-L294 HydrophobicContact CG1-CD1 4.41Å; F265-L294 HydrophobicContact CD1-CD1 4Å; F265-L294 HydrophobicContact CD2-CD1 4.25Å; F265-L294 HydrophobicContact CD2-CD2 3.84Å; F265-L294 HydrophobicContact CD2-CG 4.44Å; F265-L294 HydrophobicContact CE1-CD1 4.02Å; F265-L294 HydrophobicContact CE2-CD1 4.29Å; F265-L294 HydrophobicContact CE2-CD2 3.78Å; F265-L294 HydrophobicContact CE2-CG 4.17Å; F265-L294 HydrophobicContact CG-CD1 4.11Å; F265-L294 HydrophobicContact CG-CD2 4.46Å; F265-L294 HydrophobicContact CZ-CD1 4.17Å; F265-L294 HydrophobicContact CZ-CD2 4.35Å; F265-L294 HydrophobicContact CZ-CG 4.23Å; V267-L294 HydrophobicContact CG2-CD2 4.11Å; E290-L294 WeakPolarHBondContact O-CB 3.42Å; E290-L294 WeakPolarHBondContact O-CG 3.43Å; E290-L294 PolarHBondContact O-N 3.38Å; S291-L294 PolarHBondContact O-N 3.14Å; L294-L297 HydrophobicContact CD2-CD1 4.44Å; L294-L297 WeakPolarHBondContact O-CA 3.43Å; L294-L297 WeakPolarHBondContact O-CB 3.39Å; L294-L297 PolarHBondContact O-N 3.37Å; L294-V298 HydrophobicContact CB-CG1 4.46Å; L294-V298 PolarHBondContact O-N 3.15Å
295	Q	97.3	Very high	95.8	Very high	108 Å²	108	52.6 Å²	52.6	51%	0.505	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-42	-177.1	-80.3	179	-66.5	0	0	114.3	P257 F258 S291 L297	P257-Q295 HydrophobicContact CB-CG 3.91Å; P257-Q295 HydrophobicContact CG-CG 4.34Å; P257-Q295 VanDerWaalsContact CG-NE2 3.26Å; F258-Q295 HydrophobicContact CD2-CG 4.02Å; F258-Q295 HydrophobicContact CE2-CB 4.45Å; F258-Q295 HydrophobicContact CE2-CG 3.74Å; S291-Q295 VanDerWaalsContact O-CB 3.32Å; S291-Q295 WeakPolarHBondContact O-CB 3.46Å; S291-Q295 WeakPolarHBondContact O-CG 3.29Å; S291-Q295 PolarHBondContact O-N 3.32Å; S291-Q295 PolarHBondContact O-OE1 3.47Å; Q295-L297 PolarHBondContact O-N 3.07Å
296	P	97.2	Very high	96.3	Very high	68 Å²	68	48.2 Å²	48.2	44%	0.442	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-15.9	175.1	-18.7	33.3	0	0	0	113.4	K275 L278 H292	K275-P296 HydrophobicContact CD-CB 4.31Å; K275-P296 WeakPolarHBondContact CE-O 3.26Å; K275-P296 PolarHBondContact NZ-O 2.95Å; L278-P296 HydrophobicContact CD1-CB 4.14Å; L278-P296 HydrophobicContact CD1-CG 3.94Å; H292-P296 WeakPolarHBondContact O-CD 3.47Å
297	L	97.7	Very high	96.8	Very high	10 Å²	10	42.5 Å²	42.5	5%	0.052	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-42.9	-173.1	-65.6	-177.3	0	0	0	113.4	V267 L271 K275 L278 F293 L294 Q295	V267-L297 HydrophobicContact CG1-CD1 3.75Å; V267-L297 HydrophobicContact CG2-CD1 4.34Å; L271-L297 HydrophobicContact CB-CD2 4.05Å; L271-L297 WeakPolarHBondContact O-CD2 3.43Å; K275-L297 HydrophobicContact CD-CD2 4.08Å; L278-L297 HydrophobicContact CD2-CD1 3.77Å; L278-L297 HydrophobicContact CD2-CD2 3.52Å; L278-L297 HydrophobicContact CD2-CG 3.76Å; F293-L297 HydrophobicContact CD1-CD1 4.28Å; F293-L297 HydrophobicContact CE1-CD1 3.92Å; F293-L297 HydrophobicContact CZ-CD1 4.24Å; F293-L297 WeakPolarHBondContact O-CG 3.23Å; L294-L297 HydrophobicContact CD2-CD1 4.44Å; L294-L297 WeakPolarHBondContact O-CA 3.43Å; L294-L297 WeakPolarHBondContact O-CB 3.39Å; L294-L297 PolarHBondContact O-N 3.37Å; Q295-L297 PolarHBondContact O-N 3.07Å
298	V	97.8	Very high	97.3	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.042	22%	0.222	C	C	.	.			trans	-152.4	151	-162.9	74.4	0	0	0	0	111.5	M221 V222 F258 L294 Q302 L303	M221-V298 HydrophobicContact CB-CG2 4.32Å; V222-V298 HydrophobicContact CB-CB 4.38Å; V222-V298 HydrophobicContact CB-CG1 4.06Å; V222-V298 HydrophobicContact CB-CG2 4.26Å; V222-V298 HydrophobicContact CG2-CB 3.82Å; V222-V298 HydrophobicContact CG2-CG1 3.7Å; V222-V298 HydrophobicContact CG2-CG2 4.13Å; F258-V298 HydrophobicContact CE1-CG1 4.24Å; F258-V298 HydrophobicContact CZ-CG1 4.07Å; F258-V298 WeakPolarHBondContact CZ-O 3.45Å; L294-V298 HydrophobicContact CB-CG1 4.46Å; L294-V298 PolarHBondContact O-N 3.15Å; V298-Q302 HydrophobicContact CG2-CB 3.51Å; V298-L303 HydrophobicContact CG1-CD2 3.81Å; V298-L303 HydrophobicContact CG2-CD2 4.24Å
299	K	97.4	Very high	97.4	Very high	150 Å²	150	45.8 Å²	45.8	65%	0.652	24%	0.235	S	C	*	.			trans	-96.7	155.3	165.9	-62.4	-179.2	-178.3	178.9	0	110.1	S301 Q302	K299-S301 PolarHBondContact O-N 3.27Å; K299-S301 VanDerWaalsContact O-N 3.1Å; K299-Q302 HydrophobicContact CB-CG 4.5Å; K299-Q302 WeakPolarHBondContact O-CB 3.47Å; K299-Q302 PolarHBondContact O-N 2.96Å
300	R	97.1	Very high	97.6	Very high	125 Å²	125	45.4 Å²	45.4	47%	0.472	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-49.6	-40.7	177.9	-164.2	-166.7	-39.4	158.3	11	113.7	V245 E246 F248 Q302 L303	V245-R300 HydrophobicContact CB-CG 4.48Å; V245-R300 HydrophobicContact CG1-CG 4.01Å; E246-R300 PolarHBondContact O-NH1 3.39Å; F248-R300 HydrophobicContact CE2-CG 4.14Å; F248-R300 HydrophobicContact CZ-CG 4.45Å; R300-Q302 PolarHBondContact O-N 3.3Å; R300-L303 HydrophobicContact CG-CD1 4.21Å; R300-L303 WeakPolarHBondContact O-CB 3.39Å; R300-L303 WeakPolarHBondContact O-CG 3.37Å; R300-L303 PolarHBondContact O-N 3.42Å; R300-L303 VanDerWaalsContact O-N 3.17Å
301	S	96.2	Very high	97.6	Very high	83 Å²	83	49.1 Å²	49.1	58%	0.58	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-66.8	-15.5	179.5	55.3	0	0	0	0	114.8	K299	K299-S301 PolarHBondContact O-N 3.27Å; K299-S301 VanDerWaalsContact O-N 3.1Å
302	Q	97.7	Very high	97.7	Very high	84 Å²	84	53 Å²	53	39%	0.393	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-99.1	-1.4	178.6	-61.6	173.8	-64.4	0	0	112.6	V298 K299 R300	V298-Q302 HydrophobicContact CG2-CB 3.51Å; K299-Q302 HydrophobicContact CB-CG 4.5Å; K299-Q302 WeakPolarHBondContact O-CB 3.47Å; K299-Q302 PolarHBondContact O-N 2.96Å; R300-Q302 PolarHBondContact O-N 3.3Å
303	L	98.6	Very high	97.8	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	141.6	174.6	-63.1	177.4	0	0	0	110.9	V222 V224 V245 F248 F258 V298 R300 P305	V222-L303 HydrophobicContact CB-CD2 3.92Å; V222-L303 HydrophobicContact CG1-CD2 3.8Å; V222-L303 WeakPolarHBondContact O-CA 3.5Å; V224-L303 HydrophobicContact CG1-CB 4.47Å; V224-L303 HydrophobicContact CG1-CD1 4.2Å; V224-L303 HydrophobicContact CG1-CD2 3.92Å; V224-L303 HydrophobicContact CG1-CG 4.42Å; V224-L303 HydrophobicContact CG2-CB 4.08Å; V224-L303 HydrophobicContact CG2-CD1 4.47Å; V245-L303 HydrophobicContact CB-CB 4.26Å; V245-L303 HydrophobicContact CB-CD1 4.32Å; V245-L303 HydrophobicContact CG1-CD1 4.07Å; V245-L303 HydrophobicContact CG2-CB 3.85Å; V245-L303 HydrophobicContact CG2-CD1 4.41Å; F248-L303 HydrophobicContact CE1-CD1 4.37Å; F248-L303 HydrophobicContact CZ-CD1 3.71Å; F258-L303 HydrophobicContact CD1-CD1 4.17Å; F258-L303 HydrophobicContact CE1-CD1 3.94Å; F258-L303 HydrophobicContact CE1-CD2 4.15Å; F258-L303 HydrophobicContact CE1-CG 4.31Å; V298-L303 HydrophobicContact CG1-CD2 3.81Å; V298-L303 HydrophobicContact CG2-CD2 4.24Å; R300-L303 HydrophobicContact CG-CD1 4.21Å; R300-L303 WeakPolarHBondContact O-CB 3.39Å; R300-L303 WeakPolarHBondContact O-CG 3.37Å; R300-L303 PolarHBondContact O-N 3.42Å; R300-L303 VanDerWaalsContact O-N 3.17Å; L303-P305 WeakPolarHBondContact O-CD 3.47Å
304	E	98.6	Very high	97.8	Very high	37 Å²	37	52 Å²	52	17%	0.173	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	101.9	-179	-67.3	161	-143.1	0	0	109.4	T219 K220 M221 V222 S223 V224 K306	T219-E304 WeakPolarHBondContact CA-OE2 3.34Å; K220-E304 WeakPolarHBondContact CA-OE1 3.42Å; K220-E304 VanDerWaalsContact CB-OE1 3.27Å; K220-E304 WeakPolarHBondContact CB-OE1 3.49Å; K220-E304 PolarHBondContact N-OE1 3.15Å; K220-E304 VanDerWaalsContact N-OE1 3.14Å; K220-E304 PolarHBondContact N-OE2 3.48Å; M221-E304 PolarHBondContact N-OE1 3.37Å; V222-E304 PolarHBondContact O-N 3.47Å; S223-E304 CarbonylContact C-O 3.58Å; S223-E304 VanDerWaalsContact CA-O 3.29Å; S223-E304 WeakPolarHBondContact CA-O 3.46Å; V224-E304 PolarHBondContact N-O 3.14Å; E304-K306 PolarHBondContact O-N 3.01Å
305	P	98.5	Very high	97.8	Very high	22 Å²	22	52 Å²	52	14%	0.143	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	130.3	178.8	28.6	-33.5	0	0	0	110.7	V240 G243 V245 L303	V240-P305 HydrophobicContact CG1-CB 4.09Å; V240-P305 HydrophobicContact CG1-CG 3.9Å; V240-P305 HydrophobicContact CG2-CB 3.58Å; V240-P305 HydrophobicContact CG2-CG 4.26Å; G243-P305 WeakPolarHBondContact O-CG 3.33Å; V245-P305 HydrophobicContact CG2-CB 4.3Å; L303-P305 WeakPolarHBondContact O-CD 3.47Å
306	K	98.4	Very high	97.9	Very high	25 Å²	25	50.2 Å²	50.2	11%	0.109	26%	0.263	C	S	.	.			trans	-113.4	-178.4	177.3	-62.7	-60.1	-178.7	164.5	0	111.1	E215 S218 S223 V224 W225 E304 C310	E215-K306 HydrophobicContact CB-CB 4.22Å; E215-K306 HydrophobicContact CB-CD 4.37Å; E215-K306 HydrophobicContact CB-CG 4.41Å; E215-K306 VanDerWaalsContact O-CE 3.25Å; E215-K306 WeakPolarHBondContact O-CE 3.07Å; E215-K306 PolarHBondContact O-NZ 2.89Å; E215-K306 WeakPolarHBondContact OE2-CB 3.46Å; S218-K306 PolarHBondContact OG-NZ 3.39Å; S223-K306 WeakPolarHBondContact OG-CE 2.9Å; V224-K306 PolarHBondContact O-N 3.19Å; W225-K306 HydrophobicContact CB-CB 4.39Å; W225-K306 HydrophobicContact CE3-CB 4.15Å; W225-K306 HydrophobicContact CE3-CG 4.26Å; E304-K306 PolarHBondContact O-N 3.01Å; K306-C310 WeakPolarHBondContact O-CA 3.25Å; K306-C310 PolarHBondContact O-N 3.45Å
307	A	97.8	Very high	97.8	Very high	2 Å²	2	47.9 Å²	47.9	2%	0.017	25%	0.246	C	C	.	.	H	α-helix	trans	56.7	59.3	177.9	0	0	0	0	0	111.4	E215 W225 C310 T311 E312 L314	E215-A307 PolarHBondContact OE2-N 2.91Å; W225-A307 HydrophobicContact CB-CB 4.22Å; A307-C310 PolarHBondContact O-N 3.05Å; A307-C310 VanDerWaalsContact O-N 3.14Å; A307-T311 PolarHBondContact O-N 2.9Å; A307-T311 VanDerWaalsContact O-N 3.16Å; A307-E312 HydrophobicContact CB-CB 4.19Å; A307-E312 WeakPolarHBondContact CB-O 3.5Å; A307-E312 PolarHBondContact O-N 2.93Å; A307-E312 VanDerWaalsContact O-N 3.1Å; A307-L314 HydrophobicContact CB-CD1 3.8Å; A307-L314 HydrophobicContact CB-CG 4.08Å
308	A	97.4	Very high	97.6	Very high	51 Å²	51	50.4 Å²	50.4	42%	0.421	26%	0.262	S	S	.	.	H	α-helix	trans	53.6	56.1	-177.4	0	0	0	0	0	113.4	C310 T311 E312	A308-C310 VanDerWaalsContact C-N 3.26Å; A308-C310 PolarHBondContact O-N 3.37Å; A308-T311 WeakPolarHBondContact CB-OG1 3.4Å; A308-T311 WeakPolarHBondContact O-CG2 3.39Å; A308-T311 PolarHBondContact O-N 2.86Å; A308-T311 PolarHBondContact O-OG1 2.93Å; A308-E312 HydrophobicContact CB-CG 4.13Å
309	N	97.5	Very high	97.3	Very high	87 Å²	87	55.6 Å²	55.6	47%	0.465	28%	0.281	S	S	.	.	H	α-helix	trans	55.7	39.8	-174.4	-71.9	-37.1	0	0	0	113.2	V240 T311	V240-N309 HydrophobicContact CB-CB 4.37Å; V240-N309 WeakPolarHBondContact CB-O 3.47Å; V240-N309 HydrophobicContact CG1-CB 3.93Å; V240-N309 WeakPolarHBondContact CG2-O 3.38Å; N309-T311 VanDerWaalsContact C-N 3.3Å; N309-T311 PolarHBondContact O-N 3.37Å
310	C	97.9	Very high	97.1	Very high	1 Å²	1	51 Å²	51	1%	0.007	27%	0.266	C	S	.	.	H	α-helix	trans	61.9	33.8	179.2	-53	0	0	0	0	114	P226 R237 P238 V240 K306 A307 A308	P226-C310 HydrophobicContact CG-CB 3.69Å; P226-C310 WeakPolarHBondContact CG-O 3.22Å; R237-C310 PolarHBondContact NH1-O 3.42Å; P238-C310 HydrophobicContact CB-CB 4.41Å; P238-C310 HydrophobicContact CG-CB 4.48Å; V240-C310 HydrophobicContact CG2-CB 3.86Å; K306-C310 WeakPolarHBondContact O-CA 3.25Å; K306-C310 PolarHBondContact O-N 3.45Å; A307-C310 PolarHBondContact O-N 3.05Å; A307-C310 VanDerWaalsContact O-N 3.14Å; A308-C310 VanDerWaalsContact C-N 3.26Å; A308-C310 PolarHBondContact O-N 3.37Å
311	T	97.4	Very high	96.8	Very high	102 Å²	102	52.9 Å²	52.9	63%	0.626	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-16.5	170	64.9	0	0	0	0	113	A307 A308 N309	A307-T311 PolarHBondContact O-N 2.9Å; A307-T311 VanDerWaalsContact O-N 3.16Å; A308-T311 WeakPolarHBondContact CB-OG1 3.4Å; A308-T311 WeakPolarHBondContact O-CG2 3.39Å; A308-T311 PolarHBondContact O-N 2.86Å; A308-T311 PolarHBondContact O-OG1 2.93Å; N309-T311 VanDerWaalsContact C-N 3.3Å; N309-T311 PolarHBondContact O-N 3.37Å
312	E	98.1	Very high	96.3	Very high	83 Å²	83	54.8 Å²	54.8	39%	0.388	28%	0.283	S	S	.	.	S	Bend	trans	-107.1	143.3	176.6	-69	-174.5	-163.2	0	0	112.3	R211 P226 A307 A308	R211-E312 IonicContact NH1-OE2 3.15Å; R211-E312 PolarHBondContact NH1-OE2 3.32Å; R211-E312 VanDerWaalsContact NH1-OE2 3.12Å; P226-E312 WeakPolarHBondContact CD-O 3.46Å; P226-E312 VanDerWaalsContact CG-O 3.27Å; P226-E312 WeakPolarHBondContact CG-O 3.48Å; A307-E312 HydrophobicContact CB-CB 4.19Å; A307-E312 WeakPolarHBondContact CB-O 3.5Å; A307-E312 PolarHBondContact O-N 2.93Å; A307-E312 VanDerWaalsContact O-N 3.1Å; A308-E312 HydrophobicContact CB-CG 4.13Å
313	V	98.5	Very high	96	Very high	41 Å²	41	53.2 Å²	53.2	25%	0.248	28%	0.28	C	S	.	.			trans	-97.8	118.8	171.6	178.6	0	0	0	0	108.6	P226 A228 V235 V315 W316	P226-V313 HydrophobicContact CB-CG2 4.23Å; A228-V313 HydrophobicContact CB-CG1 3.62Å; V235-V313 HydrophobicContact CG1-CG2 3.94Å; V235-V313 HydrophobicContact CG2-CG2 3.89Å; V313-V315 VanDerWaalsContact CG1-O 3.32Å; V313-V315 WeakPolarHBondContact CG1-O 3.33Å; V313-W316 HydrophobicContact CG1-CD2 4.29Å; V313-W316 HydrophobicContact CG1-CG 4.48Å; V313-W316 HydrophobicContact CG1-CZ2 4.12Å; V313-W316 WeakPolarHBondContact O-CZ2 3.44Å
314	L	98.6	Very high	95.6	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.016	32%	0.318	C	S	.	.			trans	-118.8	-1.1	177.2	-58.2	-179.1	0	0	0	112.8	D209 R211 I212 E215 A307 W316	D209-L314 HydrophobicContact CB-CB 4.1Å; D209-L314 HydrophobicContact CB-CD2 4.11Å; D209-L314 WeakPolarHBondContact CB-O 3.26Å; D209-L314 PolarHBondContact N-O 3.33Å; R211-L314 HydrophobicContact CB-CD1 4Å; R211-L314 HydrophobicContact CB-CD2 4.32Å; I212-L314 HydrophobicContact CB-CB 4Å; I212-L314 HydrophobicContact CB-CD1 4.44Å; I212-L314 HydrophobicContact CD1-CB 4.13Å; I212-L314 HydrophobicContact CD1-CD1 4.07Å; I212-L314 HydrophobicContact CG1-CB 4.44Å; E215-L314 HydrophobicContact CG-CD1 4.22Å; A307-L314 HydrophobicContact CB-CD1 3.8Å; A307-L314 HydrophobicContact CB-CG 4.08Å; L314-W316 WeakPolarHBondContact O-CZ3 3.31Å
315	V	98.7	Very high	95.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	135.2	179.7	-174.1	0	0	0	0	109.1	Y208 I212 V227 A228 A263 V313	Y208-V315 HydrophobicContact CD1-CB 4.47Å; Y208-V315 HydrophobicContact CD1-CG1 3.72Å; Y208-V315 HydrophobicContact CD1-CG2 4.1Å; Y208-V315 HydrophobicContact CE1-CG1 3.73Å; I212-V315 HydrophobicContact CB-CG2 4.26Å; I212-V315 HydrophobicContact CG1-CG2 3.83Å; I212-V315 HydrophobicContact CG2-CG2 4.22Å; V227-V315 WeakPolarHBondContact CA-O 3.26Å; V227-V315 HydrophobicContact CG1-CB 4.32Å; V227-V315 HydrophobicContact CG1-CG1 4.03Å; V227-V315 HydrophobicContact CG2-CB 4.3Å; V227-V315 HydrophobicContact CG2-CG1 4.41Å; A228-V315 PolarHBondContact N-O 2.81Å; A263-V315 HydrophobicContact CB-CG1 4.13Å; V313-V315 VanDerWaalsContact CG1-O 3.32Å; V313-V315 WeakPolarHBondContact CG1-O 3.33Å
316	W	98.4	Very high	94.5	Very high	71 Å²	71	69.2 Å²	69.2	27%	0.269	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.2	179.9	-59.9	-100.8	0	0	0	110.7	T207 D209 A228 F229 V313 L314 T318	T207-W316 HydrophobicContact CG2-CE3 4.15Å; T207-W316 PolarHBondContact N-O 3.39Å; T207-W316 PolarHBondContact O-N 2.94Å; D209-W316 HydrophobicContact CB-CH2 4.14Å; D209-W316 HydrophobicContact CB-CZ3 3.95Å; A228-W316 VanDerWaalsContact CB-CD1 3.45Å; A228-W316 HydrophobicContact CB-CG 4.17Å; F229-W316 HydrophobicContact CD2-CB 4.46Å; F229-W316 AromaticContact CE2-CD1 3.76Å; V313-W316 HydrophobicContact CG1-CD2 4.29Å; V313-W316 HydrophobicContact CG1-CG 4.48Å; V313-W316 HydrophobicContact CG1-CZ2 4.12Å; V313-W316 WeakPolarHBondContact O-CZ2 3.44Å; L314-W316 WeakPolarHBondContact O-CZ3 3.31Å; W316-T318 HydrophobicContact CB-CG2 3.74Å; W316-T318 PolarHBondContact O-N 2.9Å
317	H	96.2	Very high	94.1	Very high	18 Å²	18	74.4 Å²	74.4	8%	0.083	39%	0.385	C	S	.	.			trans	-81.4	62.1	173.6	-157.4	62.8	0	0	0	111.2	N206 V227 A228 V230 R319	N206-H317 PolarHBondContact ND2-ND1 3.3Å; N206-H317 WeakPolarHBondContact OD1-CA 3.25Å; N206-H317 PolarHBondContact OD1-ND1 2.85Å; V227-H317 HydrophobicContact CG1-CB 4.34Å; A228-H317 WeakPolarHBondContact O-CB 3.49Å; A228-H317 PolarHBondContact O-N 3.23Å; V230-H317 HydrophobicContact CG2-CB 3.61Å; H317-R319 PolarHBondContact CD2-NE 2.91Å; H317-R319 PolarHBondContact CD2-NH2 3.1Å; H317-R319 PolarHBondContact NE2-NE 3.38Å; H317-R319 PolarHBondContact NE2-NH2 2.89Å; H317-R319 VanDerWaalsContact NE2-NH2 3.15Å
318	T	93.4	Very high	93.5	Very high	64 Å²	64	77.2 Å²	77.2	39%	0.393	40%	0.398	S	S	.	.			trans	-67.5	-43.2	-168.6	44.1	0	0	0	0	113.3	D205 T207 W316	D205-T318 PolarHBondContact O-OG1 3.45Å; D205-T318 VanDerWaalsContact O-OG1 3.09Å; T207-T318 WeakPolarHBondContact OG1-CG2 3.41Å; T207-T318 PolarHBondContact OG1-OG1 3.42Å; W316-T318 HydrophobicContact CB-CG2 3.74Å; W316-T318 PolarHBondContact O-N 2.9Å
319	R	90.4	Very high	92.8	Very high	115 Å²	115	82.3 Å²	82.3	43%	0.434	41%	0.41	S	S	.	.			trans	56.9	127.1	-172.9	-55.6	-179.6	-173.8	171.9	3.1	113.7	H317 M321	H317-R319 PolarHBondContact CD2-NE 2.91Å; H317-R319 PolarHBondContact CD2-NH2 3.1Å; H317-R319 PolarHBondContact NE2-NE 3.38Å; H317-R319 PolarHBondContact NE2-NH2 2.89Å; H317-R319 VanDerWaalsContact NE2-NH2 3.15Å; R319-M321 PolarHBondContact O-N 2.98Å
320	T	92.8	Very high	92.3	Very high	54 Å²	54	85.4 Å²	85.4	33%	0.331	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-74.4	129.1	178	-59.2	0	0	0	0	111	T105 D109	T105-T320 HydrophobicContact CG2-CG2 3.74Å; D109-T320 VanDerWaalsContact OD1-CB 3.24Å; D109-T320 WeakPolarHBondContact OD1-CB 3.28Å; D109-T320 WeakPolarHBondContact OD1-CG2 3.22Å; D109-T320 PolarHBondContact OD1-OG1 3.33Å
321	M	91.1	Very high	91.7	Very high	165 Å²	165	90.1 Å²	90.1	81%	0.813	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-62.1	138.4	175.8	-73.4	-174.9	64.6	0	0	111.3	R319	R319-M321 PolarHBondContact O-N 2.98Å
322	M	86.6	Confident	90.9	Very high	123 Å²	123	90.2 Å²	90.2	61%	0.606	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-67.7	132.4	174.3	-172.7	173	-62.3	0	0	110.7	M166 M324	M166-M322 HydrophobicContact CG-CE 3.91Å; M166-M322 HydrophobicContact CG-SD 4.37Å; M166-M322 HydrophobicContact SD-CE 4.4Å; M166-M322 HydrophobicContact SD-SD 4.1Å; M322-M324 PolarHBondContact O-N 3.48Å
323	P	90.2	Very high	90.3	Very high	51 Å²	51	93 Å²	93	33%	0.331	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-60.9	131.9	176	-25.5	35.4	0	0	0	112.4	T105 L325	T105-P323 HydrophobicContact CG2-CG 3.82Å; P323-L325 HydrophobicContact CB-CD1 4.5Å; P323-L325 HydrophobicContact CB-CD2 4.09Å; P323-L325 HydrophobicContact CB-CG 4.06Å; P323-L325 PolarHBondContact O-N 3.31Å
324	M	90.5	Very high	89.7	Confident	163 Å²	163	95.2 Å²	95.2	80%	0.803	47%	0.472	S	S	*	.			trans	-81.8	94.4	174.7	-65.8	-169.9	-72.9	0	0	110.8	M322	M322-M324 PolarHBondContact O-N 3.48Å
325	L	88.3	Confident	88.8	Confident	74 Å²	74	97.3 Å²	97.3	39%	0.387	49%	0.487	S	S	.	.			trans	-100.7	29.1	-174.4	-57.9	179.5	0	0	0	114.2	Y104 P323 L327 E328	Y104-L325 HydrophobicContact CD1-CD1 4.37Å; Y104-L325 HydrophobicContact CD2-CD1 3.76Å; Y104-L325 HydrophobicContact CE1-CD1 4.14Å; Y104-L325 HydrophobicContact CE2-CD1 3.49Å; Y104-L325 VanDerWaalsContact CE2-CD1 3.49Å; Y104-L325 HydrophobicContact CG-CD1 4.2Å; P323-L325 HydrophobicContact CB-CD1 4.5Å; P323-L325 HydrophobicContact CB-CD2 4.09Å; P323-L325 HydrophobicContact CB-CG 4.06Å; P323-L325 PolarHBondContact O-N 3.31Å; L325-L327 VanDerWaalsContact C-N 3.25Å; L325-L327 PolarHBondContact O-N 3.46Å; L325-E328 HydrophobicContact CB-CB 4.02Å; L325-E328 WeakPolarHBondContact O-CB 3.3Å; L325-E328 PolarHBondContact O-N 3.28Å; L325-E328 VanDerWaalsContact O-N 3.1Å
326	H	86.5	Confident	87.7	Confident	161 Å²	161	100.5 Å²	100.5	75%	0.745	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-29.9	-176.8	-58.8	95.6	0	0	0	113.7
327	L	89.8	Confident	86.2	Confident	133 Å²	133	101.7 Å²	101.7	70%	0.696	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.5	178.2	-62.4	-178.7	0	0	0	113.5	L325 K329 K330 L331	L325-L327 VanDerWaalsContact C-N 3.25Å; L325-L327 PolarHBondContact O-N 3.46Å; L327-K329 VanDerWaalsContact C-N 3.29Å; L327-K329 PolarHBondContact O-N 2.88Å; L327-K330 WeakPolarHBondContact O-CA 3.43Å; L327-K330 WeakPolarHBondContact O-CB 3.32Å; L327-K330 PolarHBondContact O-N 2.86Å; L327-L331 PolarHBondContact O-N 2.81Å
328	E	86	Confident	84.6	Confident	61 Å²	61	106.3 Å²	106.3	29%	0.285	56%	0.562	S	S	.	*	H	α-helix	trans	-60.8	-40.1	-177.7	178.2	57.7	-159.9	0	0	111.2	L325 K330 L331 R332	L325-E328 HydrophobicContact CB-CB 4.02Å; L325-E328 WeakPolarHBondContact O-CB 3.3Å; L325-E328 PolarHBondContact O-N 3.28Å; L325-E328 VanDerWaalsContact O-N 3.1Å; E328-K330 VanDerWaalsContact C-N 3.32Å; E328-K330 PolarHBondContact O-N 3.21Å; E328-L331 PolarHBondContact O-N 3.43Å; E328-R332 VanDerWaalsContact CG-NH2 3.26Å; E328-R332 VanDerWaalsContact O-CG 3.26Å; E328-R332 WeakPolarHBondContact O-CG 3.25Å; E328-R332 PolarHBondContact O-N 3.38Å; E328-R332 IonicContact OE1-CZ 2.74Å; E328-R332 IonicContact OE1-NE 2.95Å; E328-R332 PolarHBondContact OE1-NE 2.95Å; E328-R332 IonicContact OE1-NH2 3.28Å; E328-R332 PolarHBondContact OE1-NH2 2.93Å; E328-R332 VanDerWaalsContact OE1-NH2 3.11Å
329	K	81.9	Confident	83.1	Confident	158 Å²	158	108.7 Å²	108.7	69%	0.687	57%	0.571	S	S	*	*	H	α-helix	trans	-63	-38.8	174.2	-170.1	178.1	-179.5	-177.9	0	112	L327 L333	L327-K329 VanDerWaalsContact C-N 3.29Å; L327-K329 PolarHBondContact O-N 2.88Å; K329-L333 WeakPolarHBondContact O-CG 3.43Å; K329-L333 PolarHBondContact O-N 3.15Å
330	K	87	Confident	81.6	Confident	153 Å²	153	109 Å²	109	67%	0.665	58%	0.575	S	S	*	*	H	α-helix	trans	-69.4	-41.1	178.2	-171.8	178.4	179.7	-179.1	0	111.2	L327 E328 L333 A334	L327-K330 WeakPolarHBondContact O-CA 3.43Å; L327-K330 WeakPolarHBondContact O-CB 3.32Å; L327-K330 PolarHBondContact O-N 2.86Å; E328-K330 VanDerWaalsContact C-N 3.32Å; E328-K330 PolarHBondContact O-N 3.21Å; K330-L333 PolarHBondContact O-N 3.46Å; K330-A334 WeakPolarHBondContact O-CB 3.5Å; K330-A334 PolarHBondContact O-N 3.35Å
331	L	85.4	Confident	80	Confident	100 Å²	100	113.3 Å²	113.3	52%	0.524	60%	0.597	S	S	.	*	H	α-helix	trans	-60.6	-45.5	175.5	-178.8	63.6	0	0	0	111.4	L327 E328 L333 A334 S335	L327-L331 PolarHBondContact O-N 2.81Å; E328-L331 PolarHBondContact O-N 3.43Å; L331-L333 VanDerWaalsContact C-N 3.34Å; L331-L333 PolarHBondContact O-N 2.97Å; L331-A334 PolarHBondContact O-N 3.11Å; L331-S335 WeakPolarHBondContact O-CB 3.29Å; L331-S335 PolarHBondContact O-N 3.44Å; L331-S335 PolarHBondContact O-OG 3.09Å
332	R	81.1	Confident	79	Confident	103 Å²	103	111.8 Å²	111.8	39%	0.389	59%	0.586	S	S	.	*	H	α-helix	trans	-58.4	-43	176.8	-71.8	172.3	-165.7	-178.6	4.5	112.9	E328 G336	E328-R332 VanDerWaalsContact CG-NH2 3.26Å; E328-R332 VanDerWaalsContact O-CG 3.26Å; E328-R332 WeakPolarHBondContact O-CG 3.25Å; E328-R332 PolarHBondContact O-N 3.38Å; E328-R332 IonicContact OE1-CZ 2.74Å; E328-R332 IonicContact OE1-NE 2.95Å; E328-R332 PolarHBondContact OE1-NE 2.95Å; E328-R332 IonicContact OE1-NH2 3.28Å; E328-R332 PolarHBondContact OE1-NH2 2.93Å; E328-R332 VanDerWaalsContact OE1-NH2 3.11Å; R332-G336 PolarHBondContact O-N 3.43Å
333	L	84	Confident	77.8	Confident	142 Å²	142	109.4 Å²	109.4	74%	0.743	57%	0.573	S	S	*	*	H	α-helix	trans	-69	-36.6	178	-69.6	171.6	0	0	0	112.2	K329 K330 L331	K329-L333 WeakPolarHBondContact O-CG 3.43Å; K329-L333 PolarHBondContact O-N 3.15Å; K330-L333 PolarHBondContact O-N 3.46Å; L331-L333 VanDerWaalsContact C-N 3.34Å; L331-L333 PolarHBondContact O-N 2.97Å
334	A	86	Confident	76.5	Confident	87 Å²	87	112 Å²	112	72%	0.719	58%	0.583	S	S	*	*	H	α-helix	trans	-78.2	-34.6	-176.7	0	0	0	0	0	113.7	K330 L331	K330-A334 WeakPolarHBondContact O-CB 3.5Å; K330-A334 PolarHBondContact O-N 3.35Å; L331-A334 PolarHBondContact O-N 3.11Å
335	S	81.1	Confident	75.8	Confident	47 Å²	47	109.4 Å²	109.4	33%	0.329	57%	0.572	S	S	.	*	H	α-helix	trans	-90.2	-19.1	-173.7	65.6	0	0	0	0	114.4	L331 M337	L331-S335 WeakPolarHBondContact O-CB 3.29Å; L331-S335 PolarHBondContact O-N 3.44Å; L331-S335 PolarHBondContact O-OG 3.09Å; S335-M337 PolarHBondContact O-N 3.39Å; S335-M337 WeakPolarHBondContact OG-CB 3.25Å; S335-M337 PolarHBondContact OG-N 3.1Å
336	G	74.2	Confident	75.1	Confident	68 Å²	68	111.3 Å²	111.3	70%	0.701	58%	0.582	S	S	*	*			trans	60.1	8.3	-169	0	0	0	0	0	113.8	R332	R332-G336 PolarHBondContact O-N 3.43Å
337	M	67.2	Low	74.5	Confident	96 Å²	96	108.5 Å²	108.5	47%	0.473	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-81.3	139.2	-177.3	-71.5	-167.5	-97.4	0	0	110.7	S335 F340	S335-M337 PolarHBondContact O-N 3.39Å; S335-M337 WeakPolarHBondContact OG-CB 3.25Å; S335-M337 PolarHBondContact OG-N 3.1Å; M337-F340 HydrophobicContact CE-CE2 4.44Å; M337-F340 HydrophobicContact CE-CZ 4.39Å; M337-F340 HydrophobicContact SD-CE2 4.04Å; M337-F340 HydrophobicContact SD-CZ 3.7Å
338	P	63.2	Low	73.6	Confident	114 Å²	114	107.1 Å²	107.1	74%	0.74	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-62.7	164	169.6	26.5	-32	0	0	0	111	F340	P338-F340 PolarHBondContact O-N 3.18Å
339	I	61.4	Low	72.8	Confident	115 Å²	115	109.9 Å²	109.9	59%	0.59	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-50.7	117.9	173	-59.7	170.4	0	0	0	107.4	N341	I339-N341 PolarHBondContact O-N 3.48Å; I339-N341 VanDerWaalsContact O-N 3.11Å
340	F	59.3	Low	72.2	Confident	120 Å²	120	106.7 Å²	106.7	53%	0.526	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-58.9	120.8	169.2	-77.2	-85.1	0	0	0	107.9	M337 P338 F342	M337-F340 HydrophobicContact CE-CE2 4.44Å; M337-F340 HydrophobicContact CE-CZ 4.39Å; M337-F340 HydrophobicContact SD-CE2 4.04Å; M337-F340 HydrophobicContact SD-CZ 3.7Å; P338-F340 PolarHBondContact O-N 3.18Å; F340-F342 HydrophobicContact CB-CD2 3.24Å; F340-F342 HydrophobicContact CB-CE2 3.2Å; F340-F342 HydrophobicContact CB-CG 4.15Å; F340-F342 HydrophobicContact CB-CZ 4.08Å; F340-F342 HydrophobicContact CD1-CD2 4.49Å; F340-F342 AromaticContact CD1-CE2 3.7Å; F340-F342 HydrophobicContact CD1-CE2 3.7Å; F340-F342 AromaticContact CD1-CZ 3.79Å; F340-F342 HydrophobicContact CD1-CZ 3.79Å; F340-F342 AromaticContact CD2-CE2 3.9Å; F340-F342 HydrophobicContact CD2-CE2 3.9Å; F340-F342 HydrophobicContact CE1-CZ 4.36Å; F340-F342 AromaticContact CG-CD2 3.96Å; F340-F342 HydrophobicContact CG-CD2 3.96Å; F340-F342 AromaticContact CG-CE2 3.34Å; F340-F342 HydrophobicContact CG-CE2 3.34Å; F340-F342 AromaticContact CG-CZ 3.94Å; F340-F342 HydrophobicContact CG-CZ 3.94Å; F340-F342 PolarHBondContact O-N 3.13Å
341	N	60.1	Low	71.1	Confident	145 Å²	145	103.4 Å²	103.4	78%	0.775	57%	0.569	S	S	*	*			trans	-74.3	61.7	166.6	-75.5	-15.8	0	0	0	108.9	I339	I339-N341 PolarHBondContact O-N 3.48Å; I339-N341 VanDerWaalsContact O-N 3.11Å
342	F	69.5	Low	70	Confident	134 Å²	134	103.7 Å²	103.7	59%	0.588	57%	0.573	S	S	*	*			trans	-70.7	135.2	161.6	-68.5	-67.7	0	0	0	107.3	F340 I344	F340-F342 HydrophobicContact CB-CD2 3.24Å; F340-F342 HydrophobicContact CB-CE2 3.2Å; F340-F342 HydrophobicContact CB-CG 4.15Å; F340-F342 HydrophobicContact CB-CZ 4.08Å; F340-F342 HydrophobicContact CD1-CD2 4.49Å; F340-F342 AromaticContact CD1-CE2 3.7Å; F340-F342 HydrophobicContact CD1-CE2 3.7Å; F340-F342 AromaticContact CD1-CZ 3.79Å; F340-F342 HydrophobicContact CD1-CZ 3.79Å; F340-F342 AromaticContact CD2-CE2 3.9Å; F340-F342 HydrophobicContact CD2-CE2 3.9Å; F340-F342 HydrophobicContact CE1-CZ 4.36Å; F340-F342 AromaticContact CG-CD2 3.96Å; F340-F342 HydrophobicContact CG-CD2 3.96Å; F340-F342 AromaticContact CG-CE2 3.34Å; F340-F342 HydrophobicContact CG-CE2 3.34Å; F340-F342 AromaticContact CG-CZ 3.94Å; F340-F342 HydrophobicContact CG-CZ 3.94Å; F340-F342 PolarHBondContact O-N 3.13Å; F342-I344 HydrophobicContact CB-CD1 3.88Å; F342-I344 HydrophobicContact CB-CG1 3.6Å; F342-I344 HydrophobicContact CD2-CD1 4.47Å; F342-I344 PolarHBondContact O-N 3.14Å
343	E	60.5	Low	69.1	Low	73 Å²	73	103.8 Å²	103.8	34%	0.341	59%	0.588	S	S	.	*			trans	-68.2	83.3	159.4	-70	-172.7	166	0	0	107.7	K107 N140	K107-E343 WeakPolarHBondContact CD-O 3.41Å; K107-E343 PolarHBondContact NZ-O 3.06Å; K107-E343 IonicContact NZ-OE2 3.56Å; K107-E343 PolarHBondContact NZ-OE2 3.3Å; N140-E343 PolarHBondContact ND2-OE1 3Å
344	I	63	Low	67.8	Low	104 Å²	104	100.3 Å²	100.3	53%	0.533	57%	0.574	S	S	.	*			trans	-92.2	0	172.1	-66.3	169	0	0	0	109.4	Y104 K107 L137 F342	Y104-I344 WeakPolarHBondContact O-CG2 3.32Å; K107-I344 WeakPolarHBondContact CB-OXT 3.5Å; L137-I344 WeakPolarHBondContact CD1-O 3.45Å; F342-I344 HydrophobicContact CB-CD1 3.88Å; F342-I344 HydrophobicContact CB-CG1 3.6Å; F342-I344 HydrophobicContact CD2-CD1 4.47Å; F342-I344 PolarHBondContact O-N 3.14Å

Retrieved 344 of 344 residues in 103.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).