A0A077ZA90_TRITR Loading...

Differentially expressed in FDCP 8

AlphaFold DB , UniProt , Accession A0A077ZA90, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 408 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.7	Very low	36.6	Very low	236 Å²	236	151.1 Å²	151.1	100%	1.163	81%	0.813	S	S	*	*				0	95	0	-81.1	-176.8	167.1	0	0	107.1	L3	M1-L3 PolarHBondContact O-N 3.32Å; M1-L3 VanDerWaalsContact O-N 3.14Å
2	D	34.4	Very low	37.6	Very low	168 Å²	168	147.3 Å²	147.3	90%	0.898	79%	0.786	S	S	*	*			trans	-71	101.5	174.7	-74.6	-41.6	0	0	0	109.3	R4	D2-R4 VanDerWaalsContact C-N 3.31Å; D2-R4 PolarHBondContact O-N 3.21Å; D2-R4 VanDerWaalsContact O-N 3.09Å
3	L	36.2	Very low	38	Very low	163 Å²	163	141 Å²	141	85%	0.853	77%	0.767	S	S	*	*			trans	-79.1	89	166.7	-79.3	160.7	0	0	0	107.6	M1 V5	M1-L3 PolarHBondContact O-N 3.32Å; M1-L3 VanDerWaalsContact O-N 3.14Å; L3-V5 PolarHBondContact O-N 2.82Å
4	R	34.6	Very low	38.7	Very low	233 Å²	233	139.6 Å²	139.6	88%	0.879	76%	0.759	S	S	*	*			trans	-51	110.3	162	-88.9	177.3	169	168.8	-3.5	108.3	D2 S6	D2-R4 VanDerWaalsContact C-N 3.31Å; D2-R4 PolarHBondContact O-N 3.21Å; D2-R4 VanDerWaalsContact O-N 3.09Å; R4-S6 PolarHBondContact O-N 3.28Å
5	V	36.6	Very low	39.8	Very low	142 Å²	142	136 Å²	136	86%	0.861	74%	0.743	S	S	*	*			trans	-69.6	90.5	163	-179.4	0	0	0	0	106.3	L3 A7	L3-V5 PolarHBondContact O-N 2.82Å; V5-A7 PolarHBondContact O-N 3.25Å
6	S	36.6	Very low	40.4	Very low	92 Å²	92	129.8 Å²	129.8	64%	0.643	71%	0.708	S	S	*	*			trans	-63.1	130.7	172.2	41.2	0	0	0	0	109.8	R4 I8	R4-S6 PolarHBondContact O-N 3.28Å; S6-I8 PolarHBondContact O-N 3.05Å
7	A	33	Very low	41.2	Very low	94 Å²	94	128.9 Å²	128.9	78%	0.777	70%	0.702	S	S	*	*			trans	-50.7	117.2	179.2	0	0	0	0	0	112.3	V5	V5-A7 PolarHBondContact O-N 3.25Å
8	I	31.6	Very low	42	Very low	138 Å²	138	123.9 Å²	123.9	71%	0.708	69%	0.686	S	S	*	*			trans	-119	86.9	162.7	-56.7	170.6	0	0	0	105	S6	S6-I8 PolarHBondContact O-N 3.05Å
9	S	39.8	Very low	42.7	Very low	95 Å²	95	119.1 Å²	119.1	66%	0.664	66%	0.66	S	S	*	*			trans	-139.1	-6	177.5	61.9	0	0	0	0	116.7
10	E	36.8	Very low	43.3	Very low	167 Å²	167	114.9 Å²	114.9	78%	0.78	64%	0.639	S	S	*	*	S	Bend	trans	-105	-20.3	-176.6	-72.2	179.6	166.8	0	0	115.1
11	N	44.3	Very low	43.9	Very low	134 Å²	134	116.5 Å²	116.5	72%	0.717	64%	0.644	S	S	*	*	H	α-helix	trans	-88.1	-9.2	-179.7	-83.2	-9.6	0	0	0	115.7	V15	N11-V15 VanDerWaalsContact O-CG2 3.25Å; N11-V15 WeakPolarHBondContact O-CG2 3.38Å
12	H	48.6	Very low	44.7	Very low	106 Å²	106	109.9 Å²	109.9	49%	0.491	61%	0.613	S	S	.	*	H	α-helix	trans	-87.3	-32	-170.5	-102.5	-63.5	0	0	0	114.4	I16	H12-I16 VanDerWaalsContact O-CD1 3.22Å; H12-I16 WeakPolarHBondContact O-CD1 3.44Å; H12-I16 WeakPolarHBondContact O-CG1 3.38Å; H12-I16 PolarHBondContact O-N 3.09Å
13	A	43.3	Very low	46.1	Very low	65 Å²	65	102.1 Å²	102.1	54%	0.537	57%	0.571	S	S	.	*	H	α-helix	trans	-71.9	-45.2	-178.6	0	0	0	0	0	111.5	V15 I16 D17	A13-V15 VanDerWaalsContact C-N 3.33Å; A13-V15 PolarHBondContact O-N 2.89Å; A13-I16 WeakPolarHBondContact O-CB 3.41Å; A13-I16 PolarHBondContact O-N 3.39Å; A13-I16 VanDerWaalsContact O-N 3.08Å; A13-D17 PolarHBondContact O-N 3.01Å
14	D	47.7	Very low	47.3	Very low	122 Å²	122	98.8 Å²	98.8	65%	0.652	57%	0.567	S	S	*	*	H	α-helix	trans	-63.9	-36.3	-178.8	-64.5	-19.5	0	0	0	112.8	I16 G18	D14-I16 VanDerWaalsContact C-N 3.35Å; D14-G18 PolarHBondContact O-N 3.28Å
15	V	54.2	Low	49	Very low	85 Å²	85	89.9 Å²	89.9	52%	0.515	54%	0.539	S	S	.	.	H	α-helix	trans	-69.3	-34.3	175.3	176.9	0	0	0	0	111.4	N11 A13 V19	N11-V15 VanDerWaalsContact O-CG2 3.25Å; N11-V15 WeakPolarHBondContact O-CG2 3.38Å; A13-V15 VanDerWaalsContact C-N 3.33Å; A13-V15 PolarHBondContact O-N 2.89Å; V15-V19 WeakPolarHBondContact O-CB 3.09Å; V15-V19 WeakPolarHBondContact O-CG2 3.28Å; V15-V19 PolarHBondContact O-N 2.76Å
16	I	50.6	Low	50.9	Low	36 Å²	36	87.7 Å²	87.7	19%	0.185	52%	0.522	C	S	.	.	H	α-helix	trans	-69.7	-44.3	176.9	-68.4	164.5	0	0	0	110.1	H12 A13 D14 C20 A54 A55 Q58	H12-I16 VanDerWaalsContact O-CD1 3.22Å; H12-I16 WeakPolarHBondContact O-CD1 3.44Å; H12-I16 WeakPolarHBondContact O-CG1 3.38Å; H12-I16 PolarHBondContact O-N 3.09Å; A13-I16 WeakPolarHBondContact O-CB 3.41Å; A13-I16 PolarHBondContact O-N 3.39Å; A13-I16 VanDerWaalsContact O-N 3.08Å; D14-I16 VanDerWaalsContact C-N 3.35Å; I16-C20 WeakPolarHBondContact O-CB 3.32Å; I16-C20 PolarHBondContact O-N 2.72Å; I16-C20 VanDerWaalsContact O-N 3.15Å; I16-A54 HydrophobicContact CD1-CB 3.87Å; I16-A55 HydrophobicContact CG1-CB 4.06Å; I16-Q58 HydrophobicContact CG2-CG 4.41Å
17	D	53.5	Low	52.7	Low	115 Å²	115	84.7 Å²	84.7	62%	0.615	50%	0.5	S	S	*	.	H	α-helix	trans	-66.5	-41.9	-178.7	-127.4	12.3	0	0	0	111.4	A13 C20 M21	A13-D17 PolarHBondContact O-N 3.01Å; D17-C20 PolarHBondContact O-N 3.47Å; D17-M21 WeakPolarHBondContact O-CG 3.48Å; D17-M21 PolarHBondContact O-N 3.1Å
18	G	56.1	Low	54.5	Low	40 Å²	40	83.9 Å²	83.9	41%	0.412	48%	0.483	S	S	.	.	H	α-helix	trans	-62.6	-44.7	176.8	0	0	0	0	0	113.8	D14 C20 M21	D14-G18 PolarHBondContact O-N 3.28Å; G18-C20 VanDerWaalsContact C-N 3.33Å; G18-C20 PolarHBondContact O-N 3.43Å; G18-M21 PolarHBondContact O-N 3.37Å
19	V	54.9	Low	56.4	Low	32 Å²	32	83.3 Å²	83.3	19%	0.194	48%	0.481	C	S	.	.	H	α-helix	trans	-68.4	-32.7	179.8	173.2	0	0	0	0	112	V15 L45 L59	V15-V19 WeakPolarHBondContact O-CB 3.09Å; V15-V19 WeakPolarHBondContact O-CG2 3.28Å; V15-V19 PolarHBondContact O-N 2.76Å; V19-L45 HydrophobicContact CG1-CD1 4.45Å; V19-L45 HydrophobicContact CG1-CD2 4.45Å; V19-L59 HydrophobicContact CG1-CD1 3.96Å; V19-L59 HydrophobicContact CG1-CD2 4.04Å; V19-L59 HydrophobicContact CG1-CG 4.24Å
20	C	54.3	Low	58.4	Low	35 Å²	35	79.3 Å²	79.3	24%	0.236	45%	0.453	C	S	.	.	H	α-helix	trans	-75.9	-34.5	176.3	-81.5	0	0	0	0	112.8	I16 D17 G18 D22 L23	I16-C20 WeakPolarHBondContact O-CB 3.32Å; I16-C20 PolarHBondContact O-N 2.72Å; I16-C20 VanDerWaalsContact O-N 3.15Å; D17-C20 PolarHBondContact O-N 3.47Å; G18-C20 VanDerWaalsContact C-N 3.33Å; G18-C20 PolarHBondContact O-N 3.43Å; C20-D22 PolarHBondContact O-N 3.37Å; C20-L23 PolarHBondContact O-N 3.02Å; C20-L23 VanDerWaalsContact O-N 3.16Å
21	M	55.8	Low	60.6	Low	149 Å²	149	73.8 Å²	73.8	73%	0.734	43%	0.433	S	S	*	.	H	α-helix	trans	-59.5	-34.6	175.9	-80.1	-161.3	112.9	0	0	112.5	D17 G18 L23 A24	D17-M21 WeakPolarHBondContact O-CG 3.48Å; D17-M21 PolarHBondContact O-N 3.1Å; G18-M21 PolarHBondContact O-N 3.37Å; M21-L23 PolarHBondContact O-N 3.09Å; M21-L23 VanDerWaalsContact O-N 3.16Å; M21-A24 PolarHBondContact O-N 3.36Å
22	D	56.6	Low	62.5	Low	97 Å²	97	71.4 Å²	71.4	52%	0.519	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22	178.8	-87.7	-30	0	0	0	113.8	C20 K41	C20-D22 PolarHBondContact O-N 3.37Å; D22-K41 VanDerWaalsContact O-CE 3.32Å; D22-K41 WeakPolarHBondContact O-CE 3.49Å; D22-K41 PolarHBondContact O-NZ 3.49Å
23	L	63.1	Low	64.3	Low	5 Å²	5	73 Å²	73	3%	0.026	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	11.6	-176.3	-81.8	163.8	0	0	0	114	C20 M21 V25 K41 C42 L45 L59	C20-L23 PolarHBondContact O-N 3.02Å; C20-L23 VanDerWaalsContact O-N 3.16Å; M21-L23 PolarHBondContact O-N 3.09Å; M21-L23 VanDerWaalsContact O-N 3.16Å; L23-V25 VanDerWaalsContact C-N 3.3Å; L23-V25 WeakPolarHBondContact O-CB 3.45Å; L23-V25 WeakPolarHBondContact O-CG2 3.38Å; L23-V25 PolarHBondContact O-N 3.24Å; L23-K41 HydrophobicContact CD2-CB 3.92Å; L23-K41 HydrophobicContact CD2-CD 4.07Å; L23-K41 HydrophobicContact CD2-CG 3.88Å; L23-C42 HydrophobicContact CD1-CB 3.98Å; L23-C42 HydrophobicContact CD2-CB 3.86Å; L23-L45 HydrophobicContact CD1-CD1 3.58Å; L23-L45 HydrophobicContact CD2-CD1 4.32Å; L23-L45 HydrophobicContact CG-CD1 3.73Å; L23-L59 HydrophobicContact CD1-CD2 3.49Å; L23-L59 VanDerWaalsContact CD1-CD2 3.49Å
24	A	61.3	Low	66.5	Low	93 Å²	93	74.8 Å²	74.8	77%	0.769	42%	0.424	S	S	*	.			trans	-46.1	84.1	-173.5	0	0	0	0	0	114.3	M21	M21-A24 PolarHBondContact O-N 3.36Å
25	V	70.2	Confident	68.5	Low	46 Å²	46	69 Å²	69	28%	0.279	39%	0.393	S	S	.	.			trans	-130.4	119	178	174.1	0	0	0	0	105.7	L23 V27 A30 A38	L23-V25 VanDerWaalsContact C-N 3.3Å; L23-V25 WeakPolarHBondContact O-CB 3.45Å; L23-V25 WeakPolarHBondContact O-CG2 3.38Å; L23-V25 PolarHBondContact O-N 3.24Å; V25-V27 PolarHBondContact O-N 3.28Å; V25-A30 HydrophobicContact CG1-CB 3.64Å; V25-A38 HydrophobicContact CB-CB 4.38Å; V25-A38 HydrophobicContact CG1-CB 4.41Å; V25-A38 HydrophobicContact CG2-CB 3.96Å
26	N	76.1	Confident	70.2	Confident	96 Å²	96	68.5 Å²	68.5	51%	0.513	39%	0.39	S	S	.	.			trans	-70.7	96.5	170.7	-177.2	-18.4	0	0	0	108.3	D28 N29 A30	N26-D28 PolarHBondContact O-N 3.13Å; N26-D28 VanDerWaalsContact O-N 3.15Å; N26-D28 PolarHBondContact OD1-N 3.29Å; N26-N29 PolarHBondContact O-N 3.43Å; N26-N29 VanDerWaalsContact O-N 3.14Å; N26-A30 WeakPolarHBondContact O-CB 3.5Å; N26-A30 PolarHBondContact O-N 3.5Å
27	V	74.6	Confident	72.2	Confident	29 Å²	29	73.7 Å²	73.7	18%	0.176	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-34.6	-175	-175.8	0	0	0	0	112	V25 N29 L35 L66 R69	V25-V27 PolarHBondContact O-N 3.28Å; V27-N29 PolarHBondContact O-N 3.01Å; V27-L35 HydrophobicContact CG1-CD2 4.34Å; V27-L66 HydrophobicContact CG1-CD2 4.43Å; V27-L66 HydrophobicContact CG2-CD2 3.85Å; V27-R69 HydrophobicContact CG1-CB 3.74Å; V27-R69 HydrophobicContact CG1-CG 3.94Å; V27-R69 WeakPolarHBondContact O-CG 3.29Å; V27-R69 PolarHBondContact O-NE 3.38Å
28	D	70.7	Confident	74	Confident	77 Å²	77	68.5 Å²	68.5	41%	0.412	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-34.1	-176.7	-69.8	-42.6	0	0	0	112.6	N26 R69	N26-D28 PolarHBondContact O-N 3.13Å; N26-D28 VanDerWaalsContact O-N 3.15Å; N26-D28 PolarHBondContact OD1-N 3.29Å; D28-R69 PolarHBondContact O-NH2 3.31Å
29	N	71.9	Confident	75.7	Confident	126 Å²	126	67.1 Å²	67.1	67%	0.674	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-3.4	-174.5	-69.1	-12.1	0	0	0	114.5	N26 V27	N26-N29 PolarHBondContact O-N 3.43Å; N26-N29 VanDerWaalsContact O-N 3.14Å; V27-N29 PolarHBondContact O-N 3.01Å
30	A	81.2	Confident	77.4	Confident	10 Å²	10	67.9 Å²	67.9	8%	0.083	38%	0.377	C	S	.	.			trans	-67.9	137.7	-178.8	0	0	0	0	0	112.3	V25 N26 E34 L35	V25-A30 HydrophobicContact CG1-CB 3.64Å; N26-A30 WeakPolarHBondContact O-CB 3.5Å; N26-A30 PolarHBondContact O-N 3.5Å; A30-E34 WeakPolarHBondContact CA-OE2 3.42Å; A30-E34 HydrophobicContact CB-CB 4.11Å; A30-L35 HydrophobicContact CB-CD2 3.8Å; A30-L35 HydrophobicContact CB-CG 3.86Å
31	S	83.4	Confident	79.2	Confident	52 Å²	52	70.5 Å²	70.5	36%	0.364	38%	0.384	S	S	.	.			trans	-65.1	161.7	169.7	64.5	0	0	0	0	111.8	E33 E34 L35	S31-E33 PolarHBondContact O-N 3.4Å; S31-E34 WeakPolarHBondContact CB-OE2 3.41Å; S31-E34 PolarHBondContact N-OE2 3.44Å; S31-E34 PolarHBondContact O-N 3.42Å; S31-E34 WeakPolarHBondContact OG-CB 3.24Å; S31-E34 WeakPolarHBondContact OG-CG 3.32Å; S31-E34 PolarHBondContact OG-N 3.42Å; S31-E34 PolarHBondContact OG-OE2 3.15Å; S31-L35 WeakPolarHBondContact O-CG 3.32Å; S31-L35 PolarHBondContact O-N 3.46Å
32	M	84.7	Confident	80.8	Confident	84 Å²	84	63.4 Å²	63.4	41%	0.414	35%	0.349	S	S	.	.	H	α-helix	trans	-56.1	-38.5	177	-165.2	-179.8	-70	0	0	111.8	V36 L70 L73 K74	M32-V36 VanDerWaalsContact O-CG2 3.29Å; M32-V36 WeakPolarHBondContact O-CG2 3.35Å; M32-V36 PolarHBondContact O-N 2.75Å; M32-V36 VanDerWaalsContact O-N 3.11Å; M32-L70 HydrophobicContact CB-CD1 4.5Å; M32-L70 HydrophobicContact CG-CD1 3.41Å; M32-L70 VanDerWaalsContact CG-CD1 3.41Å; M32-L70 HydrophobicContact SD-CD1 4.46Å; M32-L73 HydrophobicContact CB-CD1 4.26Å; M32-L73 HydrophobicContact CE-CB 3.93Å; M32-K74 HydrophobicContact CE-CG 4.03Å; M32-K74 HydrophobicContact SD-CG 4.23Å
33	E	87.3	Confident	82.5	Confident	140 Å²	140	63.4 Å²	63.4	65%	0.654	34%	0.344	S	S	*	.	H	α-helix	trans	-69	-42.6	178.1	-65.4	-175.2	-177.7	0	0	112.8	S31 L35 V36 K37	S31-E33 PolarHBondContact O-N 3.4Å; E33-L35 VanDerWaalsContact C-N 3.34Å; E33-L35 PolarHBondContact O-N 3.44Å; E33-V36 PolarHBondContact O-N 3.25Å; E33-K37 WeakPolarHBondContact O-CG 3.45Å; E33-K37 PolarHBondContact O-N 2.92Å
34	E	88.9	Confident	83.8	Confident	101 Å²	101	67.4 Å²	67.4	47%	0.472	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-41.7	176.6	-74.2	164.1	151.4	0	0	111.3	A30 S31 K37 A38	A30-E34 WeakPolarHBondContact CA-OE2 3.42Å; A30-E34 HydrophobicContact CB-CB 4.11Å; S31-E34 WeakPolarHBondContact CB-OE2 3.41Å; S31-E34 PolarHBondContact N-OE2 3.44Å; S31-E34 PolarHBondContact O-N 3.42Å; S31-E34 WeakPolarHBondContact OG-CB 3.24Å; S31-E34 WeakPolarHBondContact OG-CG 3.32Å; S31-E34 PolarHBondContact OG-N 3.42Å; S31-E34 PolarHBondContact OG-OE2 3.15Å; E34-K37 PolarHBondContact O-N 3.14Å; E34-A38 VanDerWaalsContact O-CB 3.31Å; E34-A38 WeakPolarHBondContact O-CB 3.44Å; E34-A38 PolarHBondContact O-N 3.05Å
35	L	89.1	Confident	85.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-42	175.5	-69.2	172.7	0	0	0	112.1	V27 A30 S31 E33 K37 A38 I39 L66 R69 L70 L73	V27-L35 HydrophobicContact CG1-CD2 4.34Å; A30-L35 HydrophobicContact CB-CD2 3.8Å; A30-L35 HydrophobicContact CB-CG 3.86Å; S31-L35 WeakPolarHBondContact O-CG 3.32Å; S31-L35 PolarHBondContact O-N 3.46Å; E33-L35 VanDerWaalsContact C-N 3.34Å; E33-L35 PolarHBondContact O-N 3.44Å; L35-K37 VanDerWaalsContact C-N 3.34Å; L35-K37 PolarHBondContact O-N 3.48Å; L35-A38 PolarHBondContact O-N 2.95Å; L35-I39 WeakPolarHBondContact O-CB 3.45Å; L35-I39 WeakPolarHBondContact O-CD1 3.44Å; L35-I39 WeakPolarHBondContact O-CG1 3.5Å; L35-I39 PolarHBondContact O-N 2.87Å; L35-L66 HydrophobicContact CD2-CD2 3.62Å; L35-R69 HydrophobicContact CD1-CB 4.04Å; L35-R69 HydrophobicContact CD1-CG 3.56Å; L35-R69 HydrophobicContact CD2-CB 4.33Å; L35-R69 HydrophobicContact CD2-CG 4.18Å; L35-L70 HydrophobicContact CB-CB 4.38Å; L35-L70 HydrophobicContact CB-CD1 4.35Å; L35-L70 HydrophobicContact CD1-CB 4.35Å; L35-L73 HydrophobicContact CD1-CD1 3.56Å; L35-L73 HydrophobicContact CD1-CG 4.43Å
36	V	90.4	Very high	86	Confident	76 Å²	76	62.7 Å²	62.7	46%	0.461	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-44.9	176.4	170.3	0	0	0	0	110.8	M32 E33 I39 A40 L70	M32-V36 VanDerWaalsContact O-CG2 3.29Å; M32-V36 WeakPolarHBondContact O-CG2 3.35Å; M32-V36 PolarHBondContact O-N 2.75Å; M32-V36 VanDerWaalsContact O-N 3.11Å; E33-V36 PolarHBondContact O-N 3.25Å; V36-I39 PolarHBondContact O-N 3.19Å; V36-A40 PolarHBondContact O-N 3.26Å; V36-A40 VanDerWaalsContact O-N 3.1Å; V36-L70 HydrophobicContact CG2-CD1 3.98Å; V36-L70 HydrophobicContact CG2-CD2 3.83Å
37	K	91.7	Very high	86.5	Confident	144 Å²	144	64.5 Å²	64.5	63%	0.626	34%	0.336	S	S	*	.	H	α-helix	trans	-63.2	-44.6	176	-70.6	173.8	-175.9	170.6	0	111.8	E33 E34 L35 I39 A40 K41	E33-K37 WeakPolarHBondContact O-CG 3.45Å; E33-K37 PolarHBondContact O-N 2.92Å; E34-K37 PolarHBondContact O-N 3.14Å; L35-K37 VanDerWaalsContact C-N 3.34Å; L35-K37 PolarHBondContact O-N 3.48Å; K37-I39 PolarHBondContact O-N 2.89Å; K37-A40 PolarHBondContact O-N 3.38Å; K37-K41 PolarHBondContact O-N 3.4Å
38	A	91	Very high	87.1	Confident	6 Å²	6	70.7 Å²	70.7	5%	0.05	36%	0.363	C	S	.	.	H	α-helix	trans	-62.3	-41.3	177.8	0	0	0	0	0	112.3	V25 E34 L35 A40 K41 C42 L66	V25-A38 HydrophobicContact CB-CB 4.38Å; V25-A38 HydrophobicContact CG1-CB 4.41Å; V25-A38 HydrophobicContact CG2-CB 3.96Å; E34-A38 VanDerWaalsContact O-CB 3.31Å; E34-A38 WeakPolarHBondContact O-CB 3.44Å; E34-A38 PolarHBondContact O-N 3.05Å; L35-A38 PolarHBondContact O-N 2.95Å; A38-A40 VanDerWaalsContact C-N 3.34Å; A38-A40 PolarHBondContact O-N 3.39Å; A38-K41 PolarHBondContact O-N 3.1Å; A38-C42 WeakPolarHBondContact O-CB 3.28Å; A38-C42 PolarHBondContact O-N 3.41Å; A38-L66 HydrophobicContact CB-CD1 3.88Å; A38-L66 HydrophobicContact CB-CD2 3.86Å
39	I	91.7	Very high	87.8	Confident	12 Å²	12	68.2 Å²	68.2	6%	0.062	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-42.3	175.9	-72.9	164.7	0	0	0	110.9	L35 V36 K37 K43 L63 L66 R67 L70	L35-I39 WeakPolarHBondContact O-CB 3.45Å; L35-I39 WeakPolarHBondContact O-CD1 3.44Å; L35-I39 WeakPolarHBondContact O-CG1 3.5Å; L35-I39 PolarHBondContact O-N 2.87Å; V36-I39 PolarHBondContact O-N 3.19Å; K37-I39 PolarHBondContact O-N 2.89Å; I39-K43 HydrophobicContact CG2-CD 4.36Å; I39-K43 VanDerWaalsContact O-CG 3.28Å; I39-K43 WeakPolarHBondContact O-CG 3.38Å; I39-K43 PolarHBondContact O-N 2.66Å; I39-L63 HydrophobicContact CB-CD1 4.42Å; I39-L63 HydrophobicContact CG1-CD1 4.49Å; I39-L63 HydrophobicContact CG2-CD1 3.91Å; I39-L66 HydrophobicContact CD1-CB 4.25Å; I39-L66 HydrophobicContact CG1-CB 3.61Å; I39-L66 HydrophobicContact CG1-CD1 4.37Å; I39-R67 HydrophobicContact CD1-CG 3.98Å; I39-R67 HydrophobicContact CG1-CG 4.3Å; I39-L70 HydrophobicContact CD1-CB 4.05Å; I39-L70 HydrophobicContact CD1-CD2 3.57Å; I39-L70 HydrophobicContact CD1-CG 4.44Å
40	A	91.2	Very high	88.4	Confident	47 Å²	47	65.7 Å²	65.7	39%	0.388	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-52.8	176.7	0	0	0	0	0	110.8	V36 K37 A38 C42 K43 D44	V36-A40 PolarHBondContact O-N 3.26Å; V36-A40 VanDerWaalsContact O-N 3.1Å; K37-A40 PolarHBondContact O-N 3.38Å; A38-A40 VanDerWaalsContact C-N 3.34Å; A38-A40 PolarHBondContact O-N 3.39Å; A40-C42 VanDerWaalsContact C-N 3.31Å; A40-C42 PolarHBondContact O-N 3.27Å; A40-K43 WeakPolarHBondContact O-CB 3.08Å; A40-K43 PolarHBondContact O-N 2.86Å; A40-K43 VanDerWaalsContact O-N 3.12Å; A40-D44 PolarHBondContact O-N 3.21Å; A40-D44 VanDerWaalsContact O-N 3.11Å
41	K	91.6	Very high	88.4	Confident	91 Å²	91	70 Å²	70	40%	0.396	37%	0.37	S	S	.	.	H	α-helix	trans	-57.3	-42.8	177.8	-171.9	173.7	-176.4	176.4	0	112.4	D22 L23 K37 A38 D44 L45	D22-K41 VanDerWaalsContact O-CE 3.32Å; D22-K41 WeakPolarHBondContact O-CE 3.49Å; D22-K41 PolarHBondContact O-NZ 3.49Å; L23-K41 HydrophobicContact CD2-CB 3.92Å; L23-K41 HydrophobicContact CD2-CD 4.07Å; L23-K41 HydrophobicContact CD2-CG 3.88Å; K37-K41 PolarHBondContact O-N 3.4Å; A38-K41 PolarHBondContact O-N 3.1Å; K41-D44 PolarHBondContact O-N 3.46Å; K41-L45 HydrophobicContact CG-CD1 4.35Å; K41-L45 WeakPolarHBondContact O-CG 3.2Å; K41-L45 PolarHBondContact O-N 3.34Å
42	C	90.8	Very high	88.3	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-67.3	-37.3	179.4	-172.4	0	0	0	0	112.1	L23 A38 A40 D44 L45 V46 L59 L63 L66	L23-C42 HydrophobicContact CD1-CB 3.98Å; L23-C42 HydrophobicContact CD2-CB 3.86Å; A38-C42 WeakPolarHBondContact O-CB 3.28Å; A38-C42 PolarHBondContact O-N 3.41Å; A40-C42 VanDerWaalsContact C-N 3.31Å; A40-C42 PolarHBondContact O-N 3.27Å; C42-D44 VanDerWaalsContact C-N 3.34Å; C42-D44 PolarHBondContact O-N 3.29Å; C42-L45 PolarHBondContact O-N 3.19Å; C42-V46 VanDerWaalsContact O-CG2 3.28Å; C42-V46 WeakPolarHBondContact O-CG2 3.42Å; C42-V46 PolarHBondContact O-N 3.1Å; C42-L59 PolarHBondContact SG-O 3.3Å; C42-L59 VanDerWaalsContact SG-O 3.35Å; C42-L63 HydrophobicContact CB-CD1 4.31Å; C42-L66 HydrophobicContact CB-CD1 4.26Å
43	K	91.4	Very high	88.4	Confident	96 Å²	96	71.9 Å²	71.9	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-60.7	-43.6	172.6	-76.5	173	-179.2	178.7	0	111.8	I39 A40 V46 L47 L63	I39-K43 HydrophobicContact CG2-CD 4.36Å; I39-K43 VanDerWaalsContact O-CG 3.28Å; I39-K43 WeakPolarHBondContact O-CG 3.38Å; I39-K43 PolarHBondContact O-N 2.66Å; A40-K43 WeakPolarHBondContact O-CB 3.08Å; A40-K43 PolarHBondContact O-N 2.86Å; A40-K43 VanDerWaalsContact O-N 3.12Å; K43-V46 PolarHBondContact O-N 3.38Å; K43-L47 WeakPolarHBondContact O-CG 3.48Å; K43-L47 PolarHBondContact O-N 3.16Å; K43-L47 VanDerWaalsContact O-N 3.13Å; K43-L63 HydrophobicContact CG-CD1 4.08Å; K43-L63 HydrophobicContact CG-CD2 4.2Å
44	D	90.2	Very high	88.2	Confident	90 Å²	90	67.5 Å²	67.5	48%	0.481	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-44	-180	-65.3	-24	0	0	0	110.9	A40 K41 C42 V46 L47 Q48	A40-D44 PolarHBondContact O-N 3.21Å; A40-D44 VanDerWaalsContact O-N 3.11Å; K41-D44 PolarHBondContact O-N 3.46Å; C42-D44 VanDerWaalsContact C-N 3.34Å; C42-D44 PolarHBondContact O-N 3.29Å; D44-V46 VanDerWaalsContact C-N 3.35Å; D44-V46 PolarHBondContact O-N 3.13Å; D44-L47 PolarHBondContact O-N 3.47Å; D44-Q48 WeakPolarHBondContact O-CG 3.5Å; D44-Q48 PolarHBondContact O-N 3.42Å
45	L	90	Very high	87.9	Confident	23 Å²	23	63.1 Å²	63.1	12%	0.12	35%	0.346	C	S	.	.	H	α-helix	trans	-61.3	-40.4	174.7	-69.6	169.5	0	0	0	112.3	V19 L23 K41 C42 L47 Q48 T49 L59	V19-L45 HydrophobicContact CG1-CD1 4.45Å; V19-L45 HydrophobicContact CG1-CD2 4.45Å; L23-L45 HydrophobicContact CD1-CD1 3.58Å; L23-L45 HydrophobicContact CD2-CD1 4.32Å; L23-L45 HydrophobicContact CG-CD1 3.73Å; K41-L45 HydrophobicContact CG-CD1 4.35Å; K41-L45 WeakPolarHBondContact O-CG 3.2Å; K41-L45 PolarHBondContact O-N 3.34Å; C42-L45 PolarHBondContact O-N 3.19Å; L45-L47 VanDerWaalsContact C-N 3.28Å; L45-L47 PolarHBondContact O-N 3.44Å; L45-Q48 PolarHBondContact O-N 2.93Å; L45-T49 PolarHBondContact O-N 2.97Å; L45-T49 VanDerWaalsContact O-N 3.09Å; L45-T49 PolarHBondContact O-OG1 3.02Å; L45-L59 HydrophobicContact CB-CD1 3.78Å; L45-L59 HydrophobicContact CB-CD2 4.02Å; L45-L59 HydrophobicContact CD1-CD2 4.22Å
46	V	87.9	Confident	87.7	Confident	16 Å²	16	66 Å²	66	10%	0.097	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-36.3	176.5	169.2	0	0	0	0	111.9	C42 K43 D44 R56 L59 I60	C42-V46 VanDerWaalsContact O-CG2 3.28Å; C42-V46 WeakPolarHBondContact O-CG2 3.42Å; C42-V46 PolarHBondContact O-N 3.1Å; K43-V46 PolarHBondContact O-N 3.38Å; D44-V46 VanDerWaalsContact C-N 3.35Å; D44-V46 PolarHBondContact O-N 3.13Å; V46-R56 HydrophobicContact CG1-CG 4.23Å; V46-R56 PolarHBondContact O-NH1 3.11Å; V46-L59 HydrophobicContact CG2-CB 3.52Å; V46-L59 HydrophobicContact CG2-CD1 4.24Å; V46-L59 HydrophobicContact CG2-CG 4.48Å; V46-I60 HydrophobicContact CG2-CG1 4.48Å
47	L	87.2	Confident	87.4	Confident	134 Å²	134	69.1 Å²	69.1	70%	0.702	37%	0.365	S	S	*	.	H	α-helix	trans	-72.5	-35.2	178	-69.6	172.9	0	0	0	112.3	K43 D44 L45 T49	K43-L47 WeakPolarHBondContact O-CG 3.48Å; K43-L47 PolarHBondContact O-N 3.16Å; K43-L47 VanDerWaalsContact O-N 3.13Å; D44-L47 PolarHBondContact O-N 3.47Å; L45-L47 VanDerWaalsContact C-N 3.28Å; L45-L47 PolarHBondContact O-N 3.44Å; L47-T49 VanDerWaalsContact C-N 3.28Å; L47-T49 PolarHBondContact O-N 3.48Å
48	Q	86.7	Confident	87.1	Confident	159 Å²	159	66.9 Å²	66.9	74%	0.743	36%	0.356	S	S	*	.	H	α-helix	trans	-75.5	-16.5	177.3	-67	174	11.1	0	0	113.1	D44 L45	D44-Q48 WeakPolarHBondContact O-CG 3.5Å; D44-Q48 PolarHBondContact O-N 3.42Å; L45-Q48 PolarHBondContact O-N 2.93Å
49	T	86.4	Confident	86.9	Confident	25 Å²	25	66.6 Å²	66.6	15%	0.153	35%	0.354	C	S	.	.	S	Bend	trans	-97	140.6	-176.7	-45.2	0	0	0	0	112.5	L45 L47 S53 A55 R56	L45-T49 PolarHBondContact O-N 2.97Å; L45-T49 VanDerWaalsContact O-N 3.09Å; L45-T49 PolarHBondContact O-OG1 3.02Å; L47-T49 VanDerWaalsContact C-N 3.28Å; L47-T49 PolarHBondContact O-N 3.48Å; T49-S53 WeakPolarHBondContact CG2-OG 3.35Å; T49-A55 HydrophobicContact CG2-CB 3.92Å; T49-R56 HydrophobicContact CG2-CB 4Å; T49-R56 PolarHBondContact O-NH1 3.46Å
50	S	84.4	Confident	86.8	Confident	74 Å²	74	69.6 Å²	69.6	52%	0.517	37%	0.37	S	S	.	.			trans	-58.7	142.4	-179.2	71.5	0	0	0	0	112.9	L52 S53 R56	S50-L52 VanDerWaalsContact C-N 3.25Å; S50-L52 PolarHBondContact O-N 3.33Å; S50-L52 VanDerWaalsContact O-N 3.08Å; S50-S53 PolarHBondContact O-N 2.94Å; S50-S53 PolarHBondContact O-OG 3.33Å; S50-S53 WeakPolarHBondContact OG-CB 3.37Å; S50-R56 VanDerWaalsContact O-CD 3.27Å; S50-R56 WeakPolarHBondContact O-CD 3.37Å
51	P	80	Confident	86.5	Confident	100 Å²	100	73.8 Å²	73.8	65%	0.649	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-29.3	-169.6	-27.6	34.5	0	0	0	116.4
52	L	82.4	Confident	86.3	Confident	160 Å²	160	71.1 Å²	71.1	84%	0.838	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	5.1	-173.3	-66.4	168.5	0	0	0	113.4	S50	S50-L52 VanDerWaalsContact C-N 3.25Å; S50-L52 PolarHBondContact O-N 3.33Å; S50-L52 VanDerWaalsContact O-N 3.08Å
53	S	85.3	Confident	86.3	Confident	15 Å²	15	72 Å²	72	11%	0.105	37%	0.373	C	S	.	.			trans	-69.9	150.8	180	61.6	0	0	0	0	113.2	T49 S50 A55 R56 K57	T49-S53 WeakPolarHBondContact CG2-OG 3.35Å; S50-S53 PolarHBondContact O-N 2.94Å; S50-S53 PolarHBondContact O-OG 3.33Å; S50-S53 WeakPolarHBondContact OG-CB 3.37Å; S53-A55 VanDerWaalsContact C-N 3.3Å; S53-R56 PolarHBondContact O-N 3.38Å; S53-R56 WeakPolarHBondContact OG-CB 3.46Å; S53-R56 PolarHBondContact OG-N 3.08Å; S53-R56 VanDerWaalsContact OG-N 3.09Å; S53-K57 PolarHBondContact O-N 3.07Å
54	A	83.1	Confident	86.1	Confident	48 Å²	48	71.4 Å²	71.4	40%	0.397	37%	0.373	S	S	.	.	H	α-helix	trans	-62.4	-37.3	170.2	0	0	0	0	0	112.1	I16 R56 K57 Q58	I16-A54 HydrophobicContact CD1-CB 3.87Å; A54-R56 PolarHBondContact O-N 3.15Å; A54-K57 WeakPolarHBondContact O-CB 3.42Å; A54-K57 PolarHBondContact O-N 3.35Å; A54-Q58 PolarHBondContact O-N 2.76Å
55	A	83.1	Confident	85.9	Confident	9 Å²	9	72.1 Å²	72.1	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-57.7	-45.6	174.5	0	0	0	0	0	111.8	I16 T49 S53 K57 Q58 L59	I16-A55 HydrophobicContact CG1-CB 4.06Å; T49-A55 HydrophobicContact CG2-CB 3.92Å; S53-A55 VanDerWaalsContact C-N 3.3Å; A55-K57 VanDerWaalsContact C-N 3.34Å; A55-K57 PolarHBondContact O-N 3.19Å; A55-Q58 WeakPolarHBondContact O-CB 3.32Å; A55-Q58 PolarHBondContact O-N 3.48Å; A55-L59 WeakPolarHBondContact O-CG 3.43Å; A55-L59 PolarHBondContact O-N 2.89Å
56	R	86.3	Confident	85.9	Confident	61 Å²	61	71 Å²	71	23%	0.23	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-37.7	176.4	-170.9	173.7	-179.9	147.8	-4.2	112.5	V46 T49 S50 S53 A54 Q58 L59 I60	V46-R56 HydrophobicContact CG1-CG 4.23Å; V46-R56 PolarHBondContact O-NH1 3.11Å; T49-R56 HydrophobicContact CG2-CB 4Å; T49-R56 PolarHBondContact O-NH1 3.46Å; S50-R56 VanDerWaalsContact O-CD 3.27Å; S50-R56 WeakPolarHBondContact O-CD 3.37Å; S53-R56 PolarHBondContact O-N 3.38Å; S53-R56 WeakPolarHBondContact OG-CB 3.46Å; S53-R56 PolarHBondContact OG-N 3.08Å; S53-R56 VanDerWaalsContact OG-N 3.09Å; A54-R56 PolarHBondContact O-N 3.15Å; R56-Q58 VanDerWaalsContact C-N 3.33Å; R56-Q58 PolarHBondContact O-N 3.26Å; R56-L59 PolarHBondContact O-N 3.12Å; R56-I60 HydrophobicContact CG-CD1 4Å; R56-I60 HydrophobicContact CG-CG1 4.45Å; R56-I60 WeakPolarHBondContact O-CB 3.26Å; R56-I60 WeakPolarHBondContact O-CD1 3.39Å; R56-I60 WeakPolarHBondContact O-CG1 3.35Å; R56-I60 PolarHBondContact O-N 2.84Å
57	K	82.7	Confident	86	Confident	141 Å²	141	76.2 Å²	76.2	61%	0.613	39%	0.386	S	S	*	.	H	α-helix	trans	-61.9	-40.4	174.1	-70	177.2	-178.7	173	0	111.8	S53 A54 A55 K61	S53-K57 PolarHBondContact O-N 3.07Å; A54-K57 WeakPolarHBondContact O-CB 3.42Å; A54-K57 PolarHBondContact O-N 3.35Å; A55-K57 VanDerWaalsContact C-N 3.34Å; A55-K57 PolarHBondContact O-N 3.19Å; K57-K61 WeakPolarHBondContact O-CG 3.45Å; K57-K61 PolarHBondContact O-N 3.18Å; K57-K61 VanDerWaalsContact O-N 3.16Å
58	Q	84.9	Confident	85.8	Confident	97 Å²	97	75.2 Å²	75.2	45%	0.453	38%	0.378	S	S	.	.	H	α-helix	trans	-65.2	-50	175.4	-73.1	-116.3	-18	0	0	111.6	I16 A54 A55 R56 I60 K61 Q62	I16-Q58 HydrophobicContact CG2-CG 4.41Å; A54-Q58 PolarHBondContact O-N 2.76Å; A55-Q58 WeakPolarHBondContact O-CB 3.32Å; A55-Q58 PolarHBondContact O-N 3.48Å; R56-Q58 VanDerWaalsContact C-N 3.33Å; R56-Q58 PolarHBondContact O-N 3.26Å; Q58-I60 VanDerWaalsContact C-N 3.27Å; Q58-I60 PolarHBondContact O-N 3.16Å; Q58-K61 WeakPolarHBondContact O-CB 3.48Å; Q58-K61 PolarHBondContact O-N 3.09Å; Q58-Q62 PolarHBondContact O-N 3.08Å
59	L	88.7	Confident	85.5	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-58.1	-38.7	176.1	-72	169.6	0	0	0	112.4	V19 L23 C42 L45 V46 A55 R56 Q62 L63	V19-L59 HydrophobicContact CG1-CD1 3.96Å; V19-L59 HydrophobicContact CG1-CD2 4.04Å; V19-L59 HydrophobicContact CG1-CG 4.24Å; L23-L59 HydrophobicContact CD1-CD2 3.49Å; L23-L59 VanDerWaalsContact CD1-CD2 3.49Å; C42-L59 PolarHBondContact SG-O 3.3Å; C42-L59 VanDerWaalsContact SG-O 3.35Å; L45-L59 HydrophobicContact CB-CD1 3.78Å; L45-L59 HydrophobicContact CB-CD2 4.02Å; L45-L59 HydrophobicContact CD1-CD2 4.22Å; V46-L59 HydrophobicContact CG2-CB 3.52Å; V46-L59 HydrophobicContact CG2-CD1 4.24Å; V46-L59 HydrophobicContact CG2-CG 4.48Å; A55-L59 WeakPolarHBondContact O-CG 3.43Å; A55-L59 PolarHBondContact O-N 2.89Å; R56-L59 PolarHBondContact O-N 3.12Å; L59-Q62 PolarHBondContact O-N 3.28Å; L59-L63 VanDerWaalsContact O-CB 3.25Å; L59-L63 WeakPolarHBondContact O-CB 3.42Å; L59-L63 PolarHBondContact O-N 2.88Å
60	I	88.4	Confident	85.5	Confident	75 Å²	75	69 Å²	69	39%	0.385	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-43.5	175.1	-71.9	166.2	0	0	0	111.3	V46 R56 Q58 L63 I64	V46-I60 HydrophobicContact CG2-CG1 4.48Å; R56-I60 HydrophobicContact CG-CD1 4Å; R56-I60 HydrophobicContact CG-CG1 4.45Å; R56-I60 WeakPolarHBondContact O-CB 3.26Å; R56-I60 WeakPolarHBondContact O-CD1 3.39Å; R56-I60 WeakPolarHBondContact O-CG1 3.35Å; R56-I60 PolarHBondContact O-N 2.84Å; Q58-I60 VanDerWaalsContact C-N 3.27Å; Q58-I60 PolarHBondContact O-N 3.16Å; I60-L63 PolarHBondContact O-N 3.22Å; I60-I64 HydrophobicContact CG2-CD1 3.94Å; I60-I64 WeakPolarHBondContact O-CD1 3.28Å; I60-I64 VanDerWaalsContact O-CG1 3.25Å; I60-I64 WeakPolarHBondContact O-CG1 3.43Å; I60-I64 PolarHBondContact O-N 2.65Å
61	K	84.3	Confident	85.5	Confident	135 Å²	135	69.9 Å²	69.9	59%	0.587	34%	0.342	S	S	*	.	H	α-helix	trans	-59.7	-48.5	175.7	-72.5	179.7	179.4	-174.6	0	110.9	K57 Q58 L63 I64 E65	K57-K61 WeakPolarHBondContact O-CG 3.45Å; K57-K61 PolarHBondContact O-N 3.18Å; K57-K61 VanDerWaalsContact O-N 3.16Å; Q58-K61 WeakPolarHBondContact O-CB 3.48Å; Q58-K61 PolarHBondContact O-N 3.09Å; K61-L63 VanDerWaalsContact C-N 3.35Å; K61-L63 PolarHBondContact O-N 2.89Å; K61-I64 WeakPolarHBondContact O-CB 3.29Å; K61-I64 PolarHBondContact O-N 2.85Å; K61-I64 VanDerWaalsContact O-N 3.14Å; K61-E65 WeakPolarHBondContact O-CG 3.28Å; K61-E65 PolarHBondContact O-N 3.29Å
62	Q	87.9	Confident	85.4	Confident	34 Å²	34	68.4 Å²	68.4	16%	0.159	33%	0.326	C	S	.	.	H	α-helix	trans	-62.8	-40.1	178.7	-167.1	177.8	9.4	0	0	112.2	Q58 L59 I64 E65 L66	Q58-Q62 PolarHBondContact O-N 3.08Å; L59-Q62 PolarHBondContact O-N 3.28Å; Q62-I64 VanDerWaalsContact C-N 3.3Å; Q62-I64 PolarHBondContact O-N 3.47Å; Q62-E65 PolarHBondContact O-N 2.79Å; Q62-L66 HydrophobicContact CG-CD1 4.33Å; Q62-L66 WeakPolarHBondContact O-CB 3.37Å; Q62-L66 VanDerWaalsContact O-CG 3.31Å; Q62-L66 WeakPolarHBondContact O-CG 3.41Å; Q62-L66 PolarHBondContact O-N 3.38Å
63	L	90.9	Very high	85.3	Confident	19 Å²	19	62 Å²	62	10%	0.099	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-37	175.2	-176.9	60.3	0	0	0	112.1	I39 C42 K43 L59 I60 K61 R67	I39-L63 HydrophobicContact CB-CD1 4.42Å; I39-L63 HydrophobicContact CG1-CD1 4.49Å; I39-L63 HydrophobicContact CG2-CD1 3.91Å; C42-L63 HydrophobicContact CB-CD1 4.31Å; K43-L63 HydrophobicContact CG-CD1 4.08Å; K43-L63 HydrophobicContact CG-CD2 4.2Å; L59-L63 VanDerWaalsContact O-CB 3.25Å; L59-L63 WeakPolarHBondContact O-CB 3.42Å; L59-L63 PolarHBondContact O-N 2.88Å; I60-L63 PolarHBondContact O-N 3.22Å; K61-L63 VanDerWaalsContact C-N 3.35Å; K61-L63 PolarHBondContact O-N 2.89Å; L63-R67 WeakPolarHBondContact O-CB 3.47Å; L63-R67 VanDerWaalsContact O-CG 3.25Å; L63-R67 WeakPolarHBondContact O-CG 3.33Å; L63-R67 PolarHBondContact O-N 3.44Å; L63-R67 VanDerWaalsContact O-N 3.12Å
64	I	86.7	Confident	85.2	Confident	84 Å²	84	67.4 Å²	67.4	43%	0.431	31%	0.314	S	S	.	.	H	α-helix	trans	-65.2	-48.3	174.6	-68.8	163.1	0	0	0	109.8	I60 K61 Q62 R67 Q68	I60-I64 HydrophobicContact CG2-CD1 3.94Å; I60-I64 WeakPolarHBondContact O-CD1 3.28Å; I60-I64 VanDerWaalsContact O-CG1 3.25Å; I60-I64 WeakPolarHBondContact O-CG1 3.43Å; I60-I64 PolarHBondContact O-N 2.65Å; K61-I64 WeakPolarHBondContact O-CB 3.29Å; K61-I64 PolarHBondContact O-N 2.85Å; K61-I64 VanDerWaalsContact O-N 3.14Å; Q62-I64 VanDerWaalsContact C-N 3.3Å; Q62-I64 PolarHBondContact O-N 3.47Å; I64-R67 PolarHBondContact O-N 3.09Å; I64-Q68 HydrophobicContact CG2-CG 4.36Å; I64-Q68 WeakPolarHBondContact O-CB 3.49Å; I64-Q68 WeakPolarHBondContact O-CG 3.29Å; I64-Q68 PolarHBondContact O-N 3.07Å
65	E	86.3	Confident	84.9	Confident	104 Å²	104	70.4 Å²	70.4	49%	0.486	32%	0.32	S	S	.	.	H	α-helix	trans	-59.3	-48.8	178.5	-71.6	170	-170.7	0	0	112	K61 Q62 R67 Q68 R69	K61-E65 WeakPolarHBondContact O-CG 3.28Å; K61-E65 PolarHBondContact O-N 3.29Å; Q62-E65 PolarHBondContact O-N 2.79Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 2.88Å; E65-Q68 PolarHBondContact O-N 3.17Å; E65-R69 PolarHBondContact O-N 3.31Å
66	L	90.2	Very high	84.1	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-58.9	-42.6	177	-72.4	169.7	0	0	0	112.2	V27 L35 A38 I39 C42 Q62 L70	V27-L66 HydrophobicContact CG1-CD2 4.43Å; V27-L66 HydrophobicContact CG2-CD2 3.85Å; L35-L66 HydrophobicContact CD2-CD2 3.62Å; A38-L66 HydrophobicContact CB-CD1 3.88Å; A38-L66 HydrophobicContact CB-CD2 3.86Å; I39-L66 HydrophobicContact CD1-CB 4.25Å; I39-L66 HydrophobicContact CG1-CB 3.61Å; I39-L66 HydrophobicContact CG1-CD1 4.37Å; C42-L66 HydrophobicContact CB-CD1 4.26Å; Q62-L66 HydrophobicContact CG-CD1 4.33Å; Q62-L66 WeakPolarHBondContact O-CB 3.37Å; Q62-L66 VanDerWaalsContact O-CG 3.31Å; Q62-L66 WeakPolarHBondContact O-CG 3.41Å; Q62-L66 PolarHBondContact O-N 3.38Å; L66-L70 WeakPolarHBondContact O-CB 3.38Å; L66-L70 PolarHBondContact O-N 3.29Å
67	R	89.6	Confident	82.9	Confident	124 Å²	124	74.4 Å²	74.4	47%	0.468	36%	0.359	S	S	.	.	H	α-helix	trans	-68.8	-40.1	178.1	-76.1	179.4	-172.3	-171.4	6.7	112.4	I39 L63 I64 E65 R69 L70 Q71	I39-R67 HydrophobicContact CD1-CG 3.98Å; I39-R67 HydrophobicContact CG1-CG 4.3Å; L63-R67 WeakPolarHBondContact O-CB 3.47Å; L63-R67 VanDerWaalsContact O-CG 3.25Å; L63-R67 WeakPolarHBondContact O-CG 3.33Å; L63-R67 PolarHBondContact O-N 3.44Å; L63-R67 VanDerWaalsContact O-N 3.12Å; I64-R67 PolarHBondContact O-N 3.09Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 2.88Å; R67-R69 VanDerWaalsContact C-N 3.34Å; R67-L70 PolarHBondContact O-N 3.11Å; R67-Q71 WeakPolarHBondContact O-CB 3.33Å; R67-Q71 PolarHBondContact O-N 3.42Å
68	Q	82.6	Confident	81.7	Confident	114 Å²	114	72 Å²	72	53%	0.533	36%	0.356	S	S	.	.	H	α-helix	trans	-60.4	-47.6	175.3	-76.9	175.8	-3.3	0	0	110.1	I64 E65 L70 Q71 E72	I64-Q68 HydrophobicContact CG2-CG 4.36Å; I64-Q68 WeakPolarHBondContact O-CB 3.49Å; I64-Q68 WeakPolarHBondContact O-CG 3.29Å; I64-Q68 PolarHBondContact O-N 3.07Å; E65-Q68 PolarHBondContact O-N 3.17Å; Q68-L70 PolarHBondContact O-N 3.24Å; Q68-Q71 WeakPolarHBondContact O-CB 3.41Å; Q68-Q71 PolarHBondContact O-N 3.35Å; Q68-Q71 VanDerWaalsContact O-N 3.15Å; Q68-E72 WeakPolarHBondContact O-CG 3.41Å; Q68-E72 PolarHBondContact O-N 3.32Å
69	R	81.4	Confident	80.8	Confident	34 Å²	34	69.4 Å²	69.4	13%	0.128	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-44.3	176.9	-171.5	69.5	178.3	138.2	-2	112.8	V27 D28 L35 E65 R67 Q71 E72 L73	V27-R69 HydrophobicContact CG1-CB 3.74Å; V27-R69 HydrophobicContact CG1-CG 3.94Å; V27-R69 WeakPolarHBondContact O-CG 3.29Å; V27-R69 PolarHBondContact O-NE 3.38Å; D28-R69 PolarHBondContact O-NH2 3.31Å; L35-R69 HydrophobicContact CD1-CB 4.04Å; L35-R69 HydrophobicContact CD1-CG 3.56Å; L35-R69 HydrophobicContact CD2-CB 4.33Å; L35-R69 HydrophobicContact CD2-CG 4.18Å; E65-R69 PolarHBondContact O-N 3.31Å; R67-R69 VanDerWaalsContact C-N 3.34Å; R69-Q71 PolarHBondContact O-N 3.13Å; R69-E72 IonicContact CZ-OE2 3.93Å; R69-E72 IonicContact NH1-OE2 3.82Å; R69-E72 PolarHBondContact NH1-OE2 3.48Å; R69-E72 WeakPolarHBondContact O-CB 3.41Å; R69-E72 PolarHBondContact O-N 3.22Å; R69-L73 WeakPolarHBondContact O-CG 3.47Å; R69-L73 PolarHBondContact O-N 2.75Å
70	L	86.9	Confident	80	Confident	19 Å²	19	71.4 Å²	71.4	10%	0.099	37%	0.369	C	S	.	.	H	α-helix	trans	-60.5	-38.4	176.5	179.5	61.7	0	0	0	111.4	M32 L35 V36 I39 L66 R67 Q68 K74	M32-L70 HydrophobicContact CB-CD1 4.5Å; M32-L70 HydrophobicContact CG-CD1 3.41Å; M32-L70 VanDerWaalsContact CG-CD1 3.41Å; M32-L70 HydrophobicContact SD-CD1 4.46Å; L35-L70 HydrophobicContact CB-CB 4.38Å; L35-L70 HydrophobicContact CB-CD1 4.35Å; L35-L70 HydrophobicContact CD1-CB 4.35Å; V36-L70 HydrophobicContact CG2-CD1 3.98Å; V36-L70 HydrophobicContact CG2-CD2 3.83Å; I39-L70 HydrophobicContact CD1-CB 4.05Å; I39-L70 HydrophobicContact CD1-CD2 3.57Å; I39-L70 HydrophobicContact CD1-CG 4.44Å; L66-L70 WeakPolarHBondContact O-CB 3.38Å; L66-L70 PolarHBondContact O-N 3.29Å; R67-L70 PolarHBondContact O-N 3.11Å; Q68-L70 PolarHBondContact O-N 3.24Å; L70-K74 HydrophobicContact CG-CD 4.44Å; L70-K74 WeakPolarHBondContact O-CB 3.34Å; L70-K74 WeakPolarHBondContact O-CG 3.43Å; L70-K74 PolarHBondContact O-N 2.99Å
71	Q	83.6	Confident	79.6	Confident	93 Å²	93	72.4 Å²	72.4	44%	0.435	38%	0.381	S	S	.	.	H	α-helix	trans	-68	-42.8	177.1	-172.9	62.3	24.3	0	0	111.7	R67 Q68 R69 L73 K74 E75	R67-Q71 WeakPolarHBondContact O-CB 3.33Å; R67-Q71 PolarHBondContact O-N 3.42Å; Q68-Q71 WeakPolarHBondContact O-CB 3.41Å; Q68-Q71 PolarHBondContact O-N 3.35Å; Q68-Q71 VanDerWaalsContact O-N 3.15Å; R69-Q71 PolarHBondContact O-N 3.13Å; Q71-L73 VanDerWaalsContact C-N 3.34Å; Q71-L73 PolarHBondContact O-N 3.47Å; Q71-K74 PolarHBondContact O-N 3.24Å; Q71-K74 VanDerWaalsContact O-N 3.17Å; Q71-E75 HydrophobicContact CG-CG 4.47Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.41Å; Q71-E75 PolarHBondContact NE2-OE1 2.97Å; Q71-E75 WeakPolarHBondContact O-CG 3.21Å; Q71-E75 PolarHBondContact O-N 3.12Å
72	E	79.1	Confident	79.6	Confident	68 Å²	68	68.9 Å²	68.9	32%	0.318	37%	0.367	S	S	.	.	H	α-helix	trans	-56	-46.4	173.7	-71.9	175.4	177.9	0	0	111.9	Q68 R69 K74 E75 N77	Q68-E72 WeakPolarHBondContact O-CG 3.41Å; Q68-E72 PolarHBondContact O-N 3.32Å; R69-E72 IonicContact CZ-OE2 3.93Å; R69-E72 IonicContact NH1-OE2 3.82Å; R69-E72 PolarHBondContact NH1-OE2 3.48Å; R69-E72 WeakPolarHBondContact O-CB 3.41Å; R69-E72 PolarHBondContact O-N 3.22Å; E72-K74 PolarHBondContact O-N 3.43Å; E72-E75 PolarHBondContact O-N 3.49Å; E72-N77 CarbonylContact O-C 3.59Å; E72-N77 VanDerWaalsContact O-C 3.27Å; E72-N77 WeakPolarHBondContact O-CA 3.44Å; E72-N77 PolarHBondContact O-N 2.86Å
73	L	79.8	Confident	79.6	Confident	27 Å²	27	70.7 Å²	70.7	14%	0.141	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-39.7	176.6	-66.6	-175.5	0	0	0	112.1	M32 L35 R69 Q71 G76 V78	M32-L73 HydrophobicContact CB-CD1 4.26Å; M32-L73 HydrophobicContact CE-CB 3.93Å; L35-L73 HydrophobicContact CD1-CD1 3.56Å; L35-L73 HydrophobicContact CD1-CG 4.43Å; R69-L73 WeakPolarHBondContact O-CG 3.47Å; R69-L73 PolarHBondContact O-N 2.75Å; Q71-L73 VanDerWaalsContact C-N 3.34Å; Q71-L73 PolarHBondContact O-N 3.47Å; L73-G76 PolarHBondContact O-N 2.99Å; L73-V78 HydrophobicContact CD2-CG1 4.31Å; L73-V78 HydrophobicContact CD2-CG2 3.88Å
74	K	82	Confident	79.5	Confident	128 Å²	128	71 Å²	71	56%	0.557	38%	0.384	S	S	*	.	H	α-helix	trans	-67.4	-36	178.1	-79.6	-179.6	177	-174	0	113.2	M32 L70 Q71 E72 G76	M32-K74 HydrophobicContact CE-CG 4.03Å; M32-K74 HydrophobicContact SD-CG 4.23Å; L70-K74 HydrophobicContact CG-CD 4.44Å; L70-K74 WeakPolarHBondContact O-CB 3.34Å; L70-K74 WeakPolarHBondContact O-CG 3.43Å; L70-K74 PolarHBondContact O-N 2.99Å; Q71-K74 PolarHBondContact O-N 3.24Å; Q71-K74 VanDerWaalsContact O-N 3.17Å; E72-K74 PolarHBondContact O-N 3.43Å; K74-G76 PolarHBondContact O-N 3.3Å
75	E	78.6	Confident	79.7	Confident	110 Å²	110	71.2 Å²	71.2	51%	0.514	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-0.8	177.7	-72.4	176.8	-173.3	0	0	112.8	Q71 E72 N77	Q71-E75 HydrophobicContact CG-CG 4.47Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.41Å; Q71-E75 PolarHBondContact NE2-OE1 2.97Å; Q71-E75 WeakPolarHBondContact O-CG 3.21Å; Q71-E75 PolarHBondContact O-N 3.12Å; E72-E75 PolarHBondContact O-N 3.49Å; E75-N77 HydrophobicContact CB-CB 4.23Å; E75-N77 PolarHBondContact O-N 3.32Å; E75-N77 VanDerWaalsContact O-N 3.11Å; E75-N77 PolarHBondContact OE2-ND2 3.1Å
76	G	65	Low	80	Confident	59 Å²	59	68.8 Å²	68.8	61%	0.608	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	5.2	-170.4	0	0	0	0	0	112.7	L73 K74 V78	L73-G76 PolarHBondContact O-N 2.99Å; K74-G76 PolarHBondContact O-N 3.3Å; G76-V78 PolarHBondContact O-N 3.03Å
77	N	62	Low	80	Confident	96 Å²	96	72.6 Å²	72.6	51%	0.513	40%	0.399	S	S	.	.			trans	-77.7	54	170.7	-77.4	-29.5	0	0	0	109	E72 E75 G79	E72-N77 CarbonylContact O-C 3.59Å; E72-N77 VanDerWaalsContact O-C 3.27Å; E72-N77 WeakPolarHBondContact O-CA 3.44Å; E72-N77 PolarHBondContact O-N 2.86Å; E75-N77 HydrophobicContact CB-CB 4.23Å; E75-N77 PolarHBondContact O-N 3.32Å; E75-N77 VanDerWaalsContact O-N 3.11Å; E75-N77 PolarHBondContact OE2-ND2 3.1Å; N77-G79 PolarHBondContact O-N 3.48Å
78	V	58	Low	80.1	Confident	90 Å²	90	68.1 Å²	68.1	55%	0.545	39%	0.392	S	S	.	.			trans	-68.4	88	164.4	-169.8	0	0	0	0	105.3	L73 G76 S80	L73-V78 HydrophobicContact CD2-CG1 4.31Å; L73-V78 HydrophobicContact CD2-CG2 3.88Å; G76-V78 PolarHBondContact O-N 3.03Å; V78-S80 PolarHBondContact O-N 3.33Å
79	G	64.4	Low	80.7	Confident	42 Å²	42	62.7 Å²	62.7	43%	0.433	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-48.7	130.8	168.9	0	0	0	0	0	107.8	N77	N77-G79 PolarHBondContact O-N 3.48Å
80	S	72	Confident	81.2	Confident	44 Å²	44	63.5 Å²	63.5	31%	0.308	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-46.6	138.5	177.6	-61.7	0	0	0	0	110.1	V78 V92 N93	V78-S80 PolarHBondContact O-N 3.33Å; S80-V92 VanDerWaalsContact O-CG1 3.28Å; S80-V92 WeakPolarHBondContact O-CG1 3.36Å; S80-N93 WeakPolarHBondContact CB-O 3.48Å; S80-N93 PolarHBondContact OG-O 3.41Å
81	P	80.3	Confident	81.5	Confident	96 Å²	96	62.6 Å²	62.6	62%	0.623	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-57.5	149.2	-178.2	24.5	-34	0	0	0	110.9	V83	P81-V83 PolarHBondContact O-N 3.3Å
82	I	85.1	Confident	81.9	Confident	60 Å²	60	58.4 Å²	58.4	31%	0.308	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	117.2	175.3	-59.9	171	0	0	0	107.6	Q90 F91 V92	I82-Q90 HydrophobicContact CD1-CB 4.19Å; I82-Q90 HydrophobicContact CD1-CG 4.18Å; I82-Q90 HydrophobicContact CG1-CB 4.41Å; I82-Q90 HydrophobicContact CG2-CB 4.43Å; I82-F91 WeakPolarHBondContact CA-O 3.27Å; I82-V92 HydrophobicContact CG1-CG1 4.39Å
83	V	86.8	Confident	82.1	Confident	72 Å²	72	58.4 Å²	58.4	44%	0.436	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-33.8	-178.9	179.9	0	0	0	0	110.4	P81 F91 N93	P81-V83 PolarHBondContact O-N 3.3Å; V83-F91 PolarHBondContact N-O 3.11Å; V83-N93 HydrophobicContact CG2-CB 4.27Å
84	S	88.9	Confident	81.6	Confident	25 Å²	25	62.8 Å²	62.8	18%	0.175	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	159.6	179.3	63.3	0	0	0	0	112	F91 L133	S84-F91 WeakPolarHBondContact O-CB 3.34Å; S84-F91 PolarHBondContact O-N 3.5Å; S84-F91 WeakPolarHBondContact OG-CB 3.46Å; S84-L133 WeakPolarHBondContact OG-CD1 3.4Å; S84-L133 VanDerWaalsContact OG-CD2 3.3Å; S84-L133 WeakPolarHBondContact OG-CD2 3.26Å
85	T	91.4	Very high	80.6	Confident	89 Å²	89	59.3 Å²	59.3	55%	0.546	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.4	174.5	-60.5	0	0	0	0	109.2	H89	T85-H89 WeakPolarHBondContact CA-O 3.38Å; T85-H89 WeakPolarHBondContact CG2-O 3.28Å
86	M	92	Very high	79.8	Confident	53 Å²	53	59.5 Å²	59.5	26%	0.261	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	128.3	178.6	-62.5	-70.9	-69.9	0	0	110	G88 H89 F91	M86-G88 PolarHBondContact O-N 3.35Å; M86-H89 PolarHBondContact N-O 2.91Å; M86-H89 WeakPolarHBondContact O-CB 3.49Å; M86-H89 PolarHBondContact O-CD2 3.44Å; M86-H89 VanDerWaalsContact O-CD2 3.23Å; M86-H89 PolarHBondContact O-N 3.24Å; M86-F91 HydrophobicContact CB-CE2 4.04Å; M86-F91 HydrophobicContact CG-CE2 4.47Å
87	N	91.3	Very high	79.5	Confident	81 Å²	81	61.5 Å²	61.5	43%	0.433	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	39.6	178.2	-73.8	-45.6	0	0	0	113.8	H89 V136 T139 C140	N87-H89 VanDerWaalsContact C-N 3.34Å; N87-H89 PolarHBondContact O-N 3.21Å; N87-V136 PolarHBondContact ND2-O 2.96Å; N87-T139 HydrophobicContact CB-CG2 4.43Å; N87-T139 CarbonylContact O-C 3.49Å; N87-T139 WeakPolarHBondContact O-CA 3.49Å; N87-C140 PolarHBondContact O-N 3.1Å
88	G	91.1	Very high	79.6	Confident	30 Å²	30	58.5 Å²	58.5	31%	0.309	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	-2	-179.7	0	0	0	0	0	115.9	M86 C140 V143	M86-G88 PolarHBondContact O-N 3.35Å; G88-C140 VanDerWaalsContact O-CB 3.28Å; G88-C140 WeakPolarHBondContact O-CB 3.2Å; G88-V143 WeakPolarHBondContact O-CG2 3.46Å
89	H	94.1	Very high	79.7	Confident	0 Å²	0	60 Å²	60	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	138.6	173.7	-66.3	-81.9	0	0	0	110.6	T85 M86 N87 F91 C121 C124 F126 R138 C140	T85-H89 WeakPolarHBondContact CA-O 3.38Å; T85-H89 WeakPolarHBondContact CG2-O 3.28Å; M86-H89 PolarHBondContact N-O 2.91Å; M86-H89 WeakPolarHBondContact O-CB 3.49Å; M86-H89 PolarHBondContact O-CD2 3.44Å; M86-H89 VanDerWaalsContact O-CD2 3.23Å; M86-H89 PolarHBondContact O-N 3.24Å; N87-H89 VanDerWaalsContact C-N 3.34Å; N87-H89 PolarHBondContact O-N 3.21Å; H89-F91 HydrophobicContact CB-CD2 3.9Å; H89-F91 HydrophobicContact CB-CE1 4.39Å; H89-F91 HydrophobicContact CB-CE2 3.33Å; H89-F91 HydrophobicContact CB-CZ 3.61Å; H89-F91 AromaticContact CG-CZ 3.89Å; H89-C121 HydrophobicContact CB-CB 3.95Å; H89-C121 WeakPolarHBondContact ND1-CB 3.41Å; H89-C121 PolarHBondContact ND1-SG 3.28Å; H89-C121 VanDerWaalsContact ND1-SG 3.35Å; H89-C124 PolarHBondContact CE1-SG 3.29Å; H89-C124 PolarHBondContact ND1-SG 3.47Å; H89-C124 VanDerWaalsContact ND1-SG 3.41Å; H89-F126 AromaticContact CE1-CD2 3.59Å; H89-F126 AromaticContact CE1-CG 3.65Å; H89-F126 AromaticContact NE2-CD2 3.96Å; H89-R138 PolarHBondContact CD2-O 3.46Å; H89-R138 PolarHBondContact NE2-O 2.86Å; H89-C140 HydrophobicContact CB-CB 4.45Å; H89-C140 VanDerWaalsContact CE1-CA 3.42Å; H89-C140 WeakPolarHBondContact CE1-CA 3.43Å; H89-C140 PolarHBondContact NE2-N 2.83Å
90	Q	93.1	Very high	80.3	Confident	51 Å²	51	63.3 Å²	63.3	24%	0.238	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	99.2	170.2	-68	179	-4.4	0	0	108.9	I82 C121 R122 L123	I82-Q90 HydrophobicContact CD1-CB 4.19Å; I82-Q90 HydrophobicContact CD1-CG 4.18Å; I82-Q90 HydrophobicContact CG1-CB 4.41Å; I82-Q90 HydrophobicContact CG2-CB 4.43Å; Q90-C121 WeakPolarHBondContact O-CA 3.4Å; Q90-R122 HydrophobicContact CB-CG 4.17Å; Q90-R122 PolarHBondContact O-N 2.78Å; Q90-R122 VanDerWaalsContact OE1-CZ 3.24Å; Q90-L123 HydrophobicContact CB-CD1 4.33Å; Q90-L123 HydrophobicContact CB-CG 4.41Å; Q90-L123 HydrophobicContact CG-CD1 4Å
91	F	93.6	Very high	80.9	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	132.1	-175	-73	-75.1	0	0	0	111.5	I82 V83 S84 M86 H89 H119 F120 C121 F126 V128 L133 V136	I82-F91 WeakPolarHBondContact CA-O 3.27Å; V83-F91 PolarHBondContact N-O 3.11Å; S84-F91 WeakPolarHBondContact O-CB 3.34Å; S84-F91 PolarHBondContact O-N 3.5Å; S84-F91 WeakPolarHBondContact OG-CB 3.46Å; M86-F91 HydrophobicContact CB-CE2 4.04Å; M86-F91 HydrophobicContact CG-CE2 4.47Å; H89-F91 HydrophobicContact CB-CD2 3.9Å; H89-F91 HydrophobicContact CB-CE1 4.39Å; H89-F91 HydrophobicContact CB-CE2 3.33Å; H89-F91 HydrophobicContact CB-CZ 3.61Å; H89-F91 AromaticContact CG-CZ 3.89Å; F91-H119 HydrophobicContact CB-CB 4.11Å; F91-H119 HydrophobicContact CD1-CB 3.84Å; F91-H119 HydrophobicContact CG-CB 4.29Å; F91-F120 WeakPolarHBondContact CA-O 3.36Å; F91-C121 HydrophobicContact CD1-CB 4.46Å; F91-C121 HydrophobicContact CE1-CB 4.23Å; F91-F126 HydrophobicContact CE1-CD1 4.03Å; F91-F126 HydrophobicContact CZ-CD1 4.06Å; F91-V128 HydrophobicContact CD1-CG1 4.03Å; F91-V128 HydrophobicContact CE1-CB 4.48Å; F91-V128 HydrophobicContact CE1-CG1 3.61Å; F91-V128 HydrophobicContact CZ-CG1 4.16Å; F91-L133 HydrophobicContact CB-CD1 4.3Å; F91-L133 HydrophobicContact CD1-CD1 4.13Å; F91-L133 HydrophobicContact CD2-CD1 3.51Å; F91-L133 HydrophobicContact CE1-CD1 4.37Å; F91-L133 HydrophobicContact CE2-CD1 3.76Å; F91-L133 HydrophobicContact CG-CD1 3.71Å; F91-L133 HydrophobicContact CZ-CD1 4.2Å; F91-V136 HydrophobicContact CZ-CG1 4.45Å; F91-V136 HydrophobicContact CZ-CG2 4.19Å
92	V	90.6	Very high	81.3	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.03	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	151	174.7	-53.7	0	0	0	0	109.7	S80 I82 F120 R122	S80-V92 VanDerWaalsContact O-CG1 3.28Å; S80-V92 WeakPolarHBondContact O-CG1 3.36Å; I82-V92 HydrophobicContact CG1-CG1 4.39Å; V92-F120 HydrophobicContact CG2-CD1 4.03Å; V92-F120 HydrophobicContact CG2-CE1 3.31Å; V92-F120 HydrophobicContact CG2-CE2 4.03Å; V92-F120 HydrophobicContact CG2-CZ 3.31Å; V92-F120 PolarHBondContact N-O 3.25Å; V92-F120 PolarHBondContact O-N 2.91Å; V92-R122 HydrophobicContact CG1-CB 4.33Å; V92-R122 HydrophobicContact CG2-CB 4.39Å
93	N	83.3	Confident	81.7	Confident	69 Å²	69	71.5 Å²	71.5	37%	0.369	39%	0.387	S	S	.	.			trans	-84.9	132.1	170.7	-78.2	-23.1	0	0	0	109.7	S80 V83 W118 H119	S80-N93 WeakPolarHBondContact CB-O 3.48Å; S80-N93 PolarHBondContact OG-O 3.41Å; V83-N93 HydrophobicContact CG2-CB 4.27Å; N93-W118 PolarHBondContact OD1-O 2.81Å; N93-H119 PolarHBondContact OD1-CD2 2.89Å; N93-H119 PolarHBondContact OD1-NE2 3.25Å
94	K	69.4	Low	82	Confident	118 Å²	118	68.1 Å²	68.1	51%	0.513	37%	0.367	S	S	.	.			trans	-112.2	142.6	160	-95.8	-178.7	-178.2	-172	0	108.3	W118 F120	K94-W118 HydrophobicContact CB-CH2 3.74Å; K94-W118 HydrophobicContact CB-CZ2 4.07Å; K94-W118 WeakPolarHBondContact O-CZ2 3.2Å; K94-F120 HydrophobicContact CB-CD1 4.48Å; K94-F120 HydrophobicContact CB-CE1 3.87Å; K94-F120 HydrophobicContact CD-CE1 3.51Å; K94-F120 HydrophobicContact CD-CZ 3.72Å; K94-F120 HydrophobicContact CG-CE1 3.57Å; K94-F120 HydrophobicContact CG-CZ 4.14Å
95	G	62.5	Low	82.2	Confident	55 Å²	55	67.1 Å²	67.1	57%	0.567	36%	0.359	S	S	*	.			trans	-58.8	-177.8	-178.7	0	0	0	0	0	113.4	S97	G95-S97 PolarHBondContact O-N 3.16Å
96	N	60.3	Low	82.3	Confident	115 Å²	115	63.9 Å²	63.9	62%	0.615	34%	0.34	S	S	*	.	S	Bend	trans	-67.2	9.9	-163.3	-62.1	-11.1	0	0	0	116.6	T113	N96-T113 WeakPolarHBondContact CA-O 3.28Å; N96-T113 PolarHBondContact O-OG1 2.93Å
97	S	58.9	Low	82.3	Confident	100 Å²	100	63.8 Å²	63.8	70%	0.699	34%	0.344	S	S	*	.			trans	-118.7	110.1	-176.9	176.5	0	0	0	0	111.7	G95	G95-S97 PolarHBondContact O-N 3.16Å
98	L	63.7	Low	82.3	Confident	33 Å²	33	61.2 Å²	61.2	17%	0.173	34%	0.337	C	S	.	.			trans	-112.1	137.2	156	-77.8	166.8	0	0	0	108.2	E100 R102 T113 W118 Y127	L98-E100 PolarHBondContact O-N 3.25Å; L98-R102 HydrophobicContact CD1-CB 4.1Å; L98-R102 HydrophobicContact CD1-CG 3.54Å; L98-T113 HydrophobicContact CB-CG2 3.99Å; L98-T113 HydrophobicContact CD1-CG2 3.41Å; L98-T113 VanDerWaalsContact CD1-CG2 3.41Å; L98-T113 HydrophobicContact CG-CG2 3.94Å; L98-W118 HydrophobicContact CD1-CD2 4.4Å; L98-W118 HydrophobicContact CD1-CE3 4.2Å; L98-W118 HydrophobicContact CD1-CH2 3.4Å; L98-W118 HydrophobicContact CD1-CZ2 3.61Å; L98-W118 HydrophobicContact CD1-CZ3 3.71Å; L98-W118 HydrophobicContact CD2-CH2 3.69Å; L98-W118 HydrophobicContact CD2-CZ2 4.31Å; L98-W118 HydrophobicContact CD2-CZ3 4.38Å; L98-W118 HydrophobicContact CG-CH2 3.5Å; L98-W118 HydrophobicContact CG-CZ2 3.65Å; L98-W118 HydrophobicContact CG-CZ3 4.29Å; L98-Y127 HydrophobicContact CD1-CE1 4.31Å; L98-Y127 HydrophobicContact CD2-CE1 4.46Å
99	P	61.7	Low	82.3	Confident	121 Å²	121	61.2 Å²	61.2	79%	0.786	34%	0.337	S	S	*	.	S	Bend	trans	-68.7	-17.2	176.3	24.7	-31.5	0	0	0	113.4
100	E	76.4	Confident	82.2	Confident	112 Å²	112	63.4 Å²	63.4	52%	0.523	35%	0.348	S	S	.	.	S	Bend	trans	-133.2	149.8	-173.2	-69	173.6	-176.6	0	0	112	L98 R102	L98-E100 PolarHBondContact O-N 3.25Å; E100-R102 PolarHBondContact O-N 3.19Å; E100-R102 IonicContact OE2-CZ 2.79Å; E100-R102 IonicContact OE2-NH1 2.97Å; E100-R102 PolarHBondContact OE2-NH1 2.93Å; E100-R102 IonicContact OE2-NH2 3.96Å; E100-R102 PolarHBondContact OE2-NH2 3.21Å
101	R	85.1	Confident	82.1	Confident	212 Å²	212	61.3 Å²	61.3	80%	0.8	34%	0.339	S	S	*	.			trans	-59.6	125.9	170.8	-67	-176.9	-177.8	-178.7	0	110	L110	R101-L110 HydrophobicContact CB-CD1 4.08Å
102	R	88.5	Confident	81.8	Confident	72 Å²	72	68.6 Å²	68.6	27%	0.272	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	146.1	177.5	-64.4	-61.7	-173.7	-141.4	-8.7	110.8	L98 E100 L110 I111 Y127	L98-R102 HydrophobicContact CD1-CB 4.1Å; L98-R102 HydrophobicContact CD1-CG 3.54Å; E100-R102 PolarHBondContact O-N 3.19Å; E100-R102 IonicContact OE2-CZ 2.79Å; E100-R102 IonicContact OE2-NH1 2.97Å; E100-R102 PolarHBondContact OE2-NH1 2.93Å; E100-R102 IonicContact OE2-NH2 3.96Å; E100-R102 PolarHBondContact OE2-NH2 3.21Å; R102-L110 WeakPolarHBondContact O-CD1 3.32Å; R102-I111 WeakPolarHBondContact O-CB 3.18Å; R102-I111 PolarHBondContact O-N 2.99Å; R102-Y127 HydrophobicContact CB-CD1 4.33Å; R102-Y127 HydrophobicContact CG-CD1 4.23Å; R102-Y127 HydrophobicContact CG-CE1 4.05Å
103	F	92.5	Very high	81.3	Confident	89 Å²	89	69.6 Å²	69.6	39%	0.39	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	145.8	177.4	-60.9	-95.6	0	0	0	109.8	E105 G109 L110 W205	F103-E105 PolarHBondContact O-N 2.97Å; F103-G109 WeakPolarHBondContact CA-O 3.27Å; F103-L110 HydrophobicContact CD1-CB 4.16Å; F103-L110 HydrophobicContact CD1-CD1 4.2Å; F103-L110 HydrophobicContact CE1-CB 4.07Å; F103-L110 HydrophobicContact CE1-CD1 3.86Å; F103-L110 HydrophobicContact CE2-CD1 4.39Å; F103-L110 HydrophobicContact CZ-CD1 3.96Å; F103-W205 HydrophobicContact CB-CH2 3.71Å; F103-W205 HydrophobicContact CB-CZ2 4.05Å; F103-W205 HydrophobicContact CB-CZ3 4.5Å
104	C	93.7	Very high	81.2	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.387	C	S	.	.			trans	-71.4	123.6	175.8	173.7	0	0	0	0	109.9	C106 G108 G109 I111 H129	C104-C106 PolarHBondContact O-N 2.8Å; C104-G108 WeakPolarHBondContact O-CA 3.43Å; C104-G108 PolarHBondContact O-N 3.33Å; C104-G109 PolarHBondContact N-O 3.06Å; C104-I111 HydrophobicContact CB-CD1 4.15Å; C104-I111 HydrophobicContact CB-CG1 3.99Å; C104-H129 WeakPolarHBondContact CB-CE1 3.25Å; C104-H129 WeakPolarHBondContact CB-ND1 3.17Å; C104-H129 PolarHBondContact SG-ND1 3.19Å; C104-H129 VanDerWaalsContact SG-ND1 3.41Å
105	E	93.5	Very high	81.9	Confident	5 Å²	5	72 Å²	72	2%	0.023	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-2.1	-178.4	-62	-156.5	-147.5	0	0	113.3	F103 F126 Y127 R138 W205 R228 Q232	F103-E105 PolarHBondContact O-N 2.97Å; E105-F126 HydrophobicContact CB-CD1 4.47Å; E105-F126 HydrophobicContact CB-CD2 4.27Å; E105-F126 HydrophobicContact CB-CE1 4.02Å; E105-F126 HydrophobicContact CB-CE2 3.77Å; E105-F126 HydrophobicContact CB-CZ 3.62Å; E105-Y127 PolarHBondContact N-O 2.89Å; E105-R138 IonicContact OE2-CZ 3.64Å; E105-R138 IonicContact OE2-NH1 2.7Å; E105-R138 PolarHBondContact OE2-NH1 3.21Å; E105-R138 IonicContact OE2-NH2 2.7Å; E105-R138 PolarHBondContact OE2-NH2 3.08Å; E105-W205 HydrophobicContact CG-CH2 4.04Å; E105-W205 HydrophobicContact CG-CZ2 4.1Å; E105-R228 IonicContact OE1-CZ 3.35Å; E105-R228 IonicContact OE1-NE 3.6Å; E105-R228 IonicContact OE1-NH2 3.58Å; E105-R228 PolarHBondContact OE1-NH2 3.21Å; E105-R228 WeakPolarHBondContact OE2-CB 3.24Å; E105-R228 IonicContact OE2-NE 2.8Å; E105-R228 PolarHBondContact OE2-NE 3.4Å; E105-R228 IonicContact OE2-NH2 3.47Å; E105-Q232 PolarHBondContact OE1-NE2 3.49Å
106	C	93	Very high	82.9	Confident	21 Å²	21	72.8 Å²	72.8	14%	0.142	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-48.8	173.3	178.7	0	0	0	0	112.4	C104 V128 C132 S135	C104-C106 PolarHBondContact O-N 2.8Å; C106-V128 HydrophobicContact CB-CG2 4.16Å; C106-C132 HydrophobicContact CB-CB 4.12Å; C106-S135 PolarHBondContact SG-O 3.26Å; C106-S135 VanDerWaalsContact SG-O 3.34Å
107	C	92.1	Very high	84.2	Confident	50 Å²	50	71.8 Å²	71.8	34%	0.338	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-15	-175.9	75	0	0	0	0	114.3	G109 H129	C107-G109 PolarHBondContact O-N 3.02Å; C107-G109 PolarHBondContact SG-N 2.98Å; C107-H129 PolarHBondContact SG-CE1 2.91Å; C107-H129 PolarHBondContact SG-ND1 2.82Å
108	G	90.8	Very high	85.7	Confident	28 Å²	28	67.4 Å²	67.4	29%	0.289	35%	0.35	S	S	.	.			trans	79.9	-6.4	-175.4	0	0	0	0	0	114.6	C104	C104-G108 WeakPolarHBondContact O-CA 3.43Å; C104-G108 PolarHBondContact O-N 3.33Å
109	G	92	Very high	87	Confident	30 Å²	30	66.5 Å²	66.5	31%	0.309	35%	0.345	S	S	.	.			trans	-74.6	152.6	-178.7	0	0	0	0	0	113.4	F103 C104 C107	F103-G109 WeakPolarHBondContact CA-O 3.27Å; C104-G109 PolarHBondContact N-O 3.06Å; C107-G109 PolarHBondContact O-N 3.02Å; C107-G109 PolarHBondContact SG-N 2.98Å
110	L	92.4	Very high	88.5	Confident	46 Å²	46	62 Å²	62	24%	0.241	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	135.6	173.7	-175.6	68	0	0	0	110.7	R101 R102 F103 W112 H129	R101-L110 HydrophobicContact CB-CD1 4.08Å; R102-L110 WeakPolarHBondContact O-CD1 3.32Å; F103-L110 HydrophobicContact CD1-CB 4.16Å; F103-L110 HydrophobicContact CD1-CD1 4.2Å; F103-L110 HydrophobicContact CE1-CB 4.07Å; F103-L110 HydrophobicContact CE1-CD1 3.86Å; F103-L110 HydrophobicContact CE2-CD1 4.39Å; F103-L110 HydrophobicContact CZ-CD1 3.96Å; L110-W112 HydrophobicContact CD2-CD2 4.22Å; L110-W112 HydrophobicContact CD2-CH2 4.19Å; L110-W112 HydrophobicContact CD2-CZ2 3.83Å; L110-H129 PolarHBondContact O-NE2 3.18Å
111	I	90.9	Very high	89.2	Confident	6 Å²	6	56.6 Å²	56.6	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	110.8	172.8	-63	172.9	0	0	0	108.1	R102 C104 T113 W118	R102-I111 WeakPolarHBondContact O-CB 3.18Å; R102-I111 PolarHBondContact O-N 2.99Å; C104-I111 HydrophobicContact CB-CD1 4.15Å; C104-I111 HydrophobicContact CB-CG1 3.99Å; I111-T113 HydrophobicContact CG2-CG2 4.27Å; I111-T113 PolarHBondContact O-N 3.39Å; I111-W118 HydrophobicContact CG2-CB 3.38Å; I111-W118 HydrophobicContact CG2-CD2 4.16Å; I111-W118 HydrophobicContact CG2-CG 3.54Å
112	W	86.7	Confident	89.4	Confident	154 Å²	154	51.7 Å²	51.7	58%	0.583	27%	0.269	S	S	*	.			trans	-85.8	93.1	175.6	-61.7	91.6	0	0	0	110.2	L110 I114 V115 Q116	L110-W112 HydrophobicContact CD2-CD2 4.22Å; L110-W112 HydrophobicContact CD2-CH2 4.19Å; L110-W112 HydrophobicContact CD2-CZ2 3.83Å; W112-I114 PolarHBondContact O-N 3.2Å; W112-V115 HydrophobicContact CB-CG2 3.31Å; W112-V115 HydrophobicContact CG-CG2 4.09Å; W112-V115 PolarHBondContact O-N 3.4Å; W112-V115 VanDerWaalsContact O-N 3.16Å; W112-Q116 PolarHBondContact O-N 3.31Å
113	T	79.9	Confident	89.5	Confident	26 Å²	26	51 Å²	51	16%	0.16	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-19.9	-167.7	59.2	0	0	0	0	115.5	N96 L98 I111 W118	N96-T113 WeakPolarHBondContact CA-O 3.28Å; N96-T113 PolarHBondContact O-OG1 2.93Å; L98-T113 HydrophobicContact CB-CG2 3.99Å; L98-T113 HydrophobicContact CD1-CG2 3.41Å; L98-T113 VanDerWaalsContact CD1-CG2 3.41Å; L98-T113 HydrophobicContact CG-CG2 3.94Å; I111-T113 HydrophobicContact CG2-CG2 4.27Å; I111-T113 PolarHBondContact O-N 3.39Å; T113-W118 HydrophobicContact CG2-CZ2 4.32Å
114	I	81.3	Confident	89.5	Confident	131 Å²	131	47.4 Å²	47.4	67%	0.672	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-35.9	-180	-58.7	174.4	0	0	0	111.5	W112	W112-I114 PolarHBondContact O-N 3.2Å
115	V	83.4	Confident	89.3	Confident	107 Å²	107	48.8 Å²	48.8	65%	0.648	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-16.1	-165.8	-66	0	0	0	0	114	W112	W112-V115 HydrophobicContact CB-CG2 3.31Å; W112-V115 HydrophobicContact CG-CG2 4.09Å; W112-V115 PolarHBondContact O-N 3.4Å; W112-V115 VanDerWaalsContact O-N 3.16Å
116	Q	83.9	Confident	89.3	Confident	71 Å²	71	48.7 Å²	48.7	33%	0.332	27%	0.27	S	S	.	.	S	Bend	trans	-127.2	138.5	-176.6	-72.8	171.4	0.4	0	0	110.4	W112	W112-Q116 PolarHBondContact O-N 3.31Å
117	P	88.2	Confident	89.3	Confident	93 Å²	93	49.8 Å²	49.8	60%	0.604	27%	0.272	S	S	*	.			trans	-63.4	141.8	171.1	27.6	-33.8	0	0	0	109.7	G130	P117-G130 PolarHBondContact O-N 2.79Å
118	W	90.2	Very high	89.3	Confident	8 Å²	8	47.4 Å²	47.4	3%	0.03	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	152.3	-179.6	65	-81.6	0	0	0	110.3	N93 K94 L98 I111 T113 F120 Y127 V128	N93-W118 PolarHBondContact OD1-O 2.81Å; K94-W118 HydrophobicContact CB-CH2 3.74Å; K94-W118 HydrophobicContact CB-CZ2 4.07Å; K94-W118 WeakPolarHBondContact O-CZ2 3.2Å; L98-W118 HydrophobicContact CD1-CD2 4.4Å; L98-W118 HydrophobicContact CD1-CE3 4.2Å; L98-W118 HydrophobicContact CD1-CH2 3.4Å; L98-W118 HydrophobicContact CD1-CZ2 3.61Å; L98-W118 HydrophobicContact CD1-CZ3 3.71Å; L98-W118 HydrophobicContact CD2-CH2 3.69Å; L98-W118 HydrophobicContact CD2-CZ2 4.31Å; L98-W118 HydrophobicContact CD2-CZ3 4.38Å; L98-W118 HydrophobicContact CG-CH2 3.5Å; L98-W118 HydrophobicContact CG-CZ2 3.65Å; L98-W118 HydrophobicContact CG-CZ3 4.29Å; I111-W118 HydrophobicContact CG2-CB 3.38Å; I111-W118 HydrophobicContact CG2-CD2 4.16Å; I111-W118 HydrophobicContact CG2-CG 3.54Å; T113-W118 HydrophobicContact CG2-CZ2 4.32Å; W118-F120 HydrophobicContact CH2-CD1 4.4Å; W118-F120 HydrophobicContact CZ3-CB 4.34Å; W118-F120 AromaticContact CZ3-CD1 3.83Å; W118-F120 HydrophobicContact CZ3-CD1 3.83Å; W118-F120 HydrophobicContact CZ3-CG 4.44Å; W118-Y127 HydrophobicContact CE3-CD1 4.14Å; W118-Y127 AromaticContact CZ3-CD1 3.91Å; W118-Y127 HydrophobicContact CZ3-CD1 3.91Å; W118-Y127 AromaticContact CZ3-CE1 3.82Å; W118-Y127 HydrophobicContact CZ3-CE1 3.82Å; W118-V128 WeakPolarHBondContact CA-O 3.46Å
119	H	91.8	Very high	89.5	Confident	15 Å²	15	46.5 Å²	46.5	7%	0.069	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	153.8	-175.4	-52.1	70.2	0	0	0	108.9	F91 N93 V128 G130	F91-H119 HydrophobicContact CB-CB 4.11Å; F91-H119 HydrophobicContact CD1-CB 3.84Å; F91-H119 HydrophobicContact CG-CB 4.29Å; N93-H119 PolarHBondContact OD1-CD2 2.89Å; N93-H119 PolarHBondContact OD1-NE2 3.25Å; H119-V128 HydrophobicContact CB-CG1 3.95Å; H119-V128 PolarHBondContact N-O 3.33Å; H119-V128 PolarHBondContact O-N 3.17Å; H119-G130 WeakPolarHBondContact ND1-CA 3.49Å
120	F	91.4	Very high	89.4	Confident	25 Å²	25	45.9 Å²	45.9	11%	0.11	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.8	167.9	77.1	-76.2	0	0	0	111.8	F91 V92 K94 W118 R122 F126 Y127	F91-F120 WeakPolarHBondContact CA-O 3.36Å; V92-F120 HydrophobicContact CG2-CD1 4.03Å; V92-F120 HydrophobicContact CG2-CE1 3.31Å; V92-F120 HydrophobicContact CG2-CE2 4.03Å; V92-F120 HydrophobicContact CG2-CZ 3.31Å; V92-F120 PolarHBondContact N-O 3.25Å; V92-F120 PolarHBondContact O-N 2.91Å; K94-F120 HydrophobicContact CB-CD1 4.48Å; K94-F120 HydrophobicContact CB-CE1 3.87Å; K94-F120 HydrophobicContact CD-CE1 3.51Å; K94-F120 HydrophobicContact CD-CZ 3.72Å; K94-F120 HydrophobicContact CG-CE1 3.57Å; K94-F120 HydrophobicContact CG-CZ 4.14Å; W118-F120 HydrophobicContact CH2-CD1 4.4Å; W118-F120 HydrophobicContact CZ3-CB 4.34Å; W118-F120 AromaticContact CZ3-CD1 3.83Å; W118-F120 HydrophobicContact CZ3-CD1 3.83Å; W118-F120 HydrophobicContact CZ3-CG 4.44Å; F120-R122 PolarHBondContact O-N 3.04Å; F120-F126 CarbonylContact C-O 3.6Å; F120-F126 WeakPolarHBondContact CA-O 3.45Å; F120-Y127 HydrophobicContact CB-CD1 3.73Å; F120-Y127 HydrophobicContact CB-CE1 3.83Å; F120-Y127 HydrophobicContact CB-CG 4.17Å; F120-Y127 HydrophobicContact CG-CE1 4.3Å
121	C	92.8	Very high	89.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	119.9	175.2	178.1	0	0	0	0	109.9	H89 Q90 F91 L123 G125 F126	H89-C121 HydrophobicContact CB-CB 3.95Å; H89-C121 WeakPolarHBondContact ND1-CB 3.41Å; H89-C121 PolarHBondContact ND1-SG 3.28Å; H89-C121 VanDerWaalsContact ND1-SG 3.35Å; Q90-C121 WeakPolarHBondContact O-CA 3.4Å; F91-C121 HydrophobicContact CD1-CB 4.46Å; F91-C121 HydrophobicContact CE1-CB 4.23Å; C121-L123 PolarHBondContact O-N 3.16Å; C121-G125 VanDerWaalsContact O-CA 3.31Å; C121-G125 WeakPolarHBondContact O-CA 3.2Å; C121-G125 PolarHBondContact O-N 3.19Å; C121-F126 HydrophobicContact CB-CB 3.87Å; C121-F126 PolarHBondContact N-O 3.17Å
122	R	89.4	Confident	89.6	Confident	108 Å²	108	52.1 Å²	52.1	41%	0.408	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.4	179.9	72	174.9	-171.5	149.2	-3.9	113.9	Q90 V92 F120	Q90-R122 HydrophobicContact CB-CG 4.17Å; Q90-R122 PolarHBondContact O-N 2.78Å; Q90-R122 VanDerWaalsContact OE1-CZ 3.24Å; V92-R122 HydrophobicContact CG1-CB 4.33Å; V92-R122 HydrophobicContact CG2-CB 4.39Å; F120-R122 PolarHBondContact O-N 3.04Å
123	L	90.4	Very high	89.9	Confident	57 Å²	57	45.6 Å²	45.6	30%	0.298	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-47.8	-174.6	-55.1	177.1	0	0	0	112.8	Q90 C121	Q90-L123 HydrophobicContact CB-CD1 4.33Å; Q90-L123 HydrophobicContact CB-CG 4.41Å; Q90-L123 HydrophobicContact CG-CD1 4Å; C121-L123 PolarHBondContact O-N 3.16Å
124	C	91.6	Very high	90.5	Very high	15 Å²	15	50.5 Å²	50.5	10%	0.101	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-3.2	-175.2	78.5	0	0	0	0	114.9	H89 A141 L236	H89-C124 PolarHBondContact CE1-SG 3.29Å; H89-C124 PolarHBondContact ND1-SG 3.47Å; H89-C124 VanDerWaalsContact ND1-SG 3.41Å; C124-A141 HydrophobicContact CB-CB 4.05Å; C124-L236 HydrophobicContact CB-CD1 4.15Å
125	G	89.6	Confident	91.1	Very high	29 Å²	29	47.7 Å²	47.7	30%	0.299	26%	0.258	S	S	.	.			trans	70.8	32.5	-179.7	0	0	0	0	0	114.6	C121 Y127	C121-G125 VanDerWaalsContact O-CA 3.31Å; C121-G125 WeakPolarHBondContact O-CA 3.2Å; C121-G125 PolarHBondContact O-N 3.19Å; G125-Y127 WeakPolarHBondContact O-CD2 3.44Å; G125-Y127 VanDerWaalsContact O-CE2 3.31Å; G125-Y127 WeakPolarHBondContact O-CE2 3.31Å
126	F	93	Very high	91.5	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.013	23%	0.228	C	C	.	.			trans	-76.3	126.3	173	-172.8	-75.3	0	0	0	110.5	H89 F91 E105 F120 C121 V128 V136 R138	H89-F126 AromaticContact CE1-CD2 3.59Å; H89-F126 AromaticContact CE1-CG 3.65Å; H89-F126 AromaticContact NE2-CD2 3.96Å; F91-F126 HydrophobicContact CE1-CD1 4.03Å; F91-F126 HydrophobicContact CZ-CD1 4.06Å; E105-F126 HydrophobicContact CB-CD1 4.47Å; E105-F126 HydrophobicContact CB-CD2 4.27Å; E105-F126 HydrophobicContact CB-CE1 4.02Å; E105-F126 HydrophobicContact CB-CE2 3.77Å; E105-F126 HydrophobicContact CB-CZ 3.62Å; F120-F126 CarbonylContact C-O 3.6Å; F120-F126 WeakPolarHBondContact CA-O 3.45Å; C121-F126 HydrophobicContact CB-CB 3.87Å; C121-F126 PolarHBondContact N-O 3.17Å; F126-V128 HydrophobicContact CD1-CB 4.42Å; F126-V128 HydrophobicContact CE1-CB 4.1Å; F126-V136 HydrophobicContact CE1-CG1 4.08Å; F126-V136 HydrophobicContact CE1-CG2 3.94Å; F126-V136 HydrophobicContact CZ-CG1 4.02Å; F126-V136 HydrophobicContact CZ-CG2 4.41Å; F126-R138 HydrophobicContact CE2-CB 4.24Å
127	Y	92.7	Very high	91.9	Very high	43 Å²	43	45.7 Å²	45.7	17%	0.169	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	139.3	-179.7	-69.3	-97.3	0	0	0	112.4	L98 R102 E105 W118 F120 G125	L98-Y127 HydrophobicContact CD1-CE1 4.31Å; L98-Y127 HydrophobicContact CD2-CE1 4.46Å; R102-Y127 HydrophobicContact CB-CD1 4.33Å; R102-Y127 HydrophobicContact CG-CD1 4.23Å; R102-Y127 HydrophobicContact CG-CE1 4.05Å; E105-Y127 PolarHBondContact N-O 2.89Å; W118-Y127 HydrophobicContact CE3-CD1 4.14Å; W118-Y127 AromaticContact CZ3-CD1 3.91Å; W118-Y127 HydrophobicContact CZ3-CD1 3.91Å; W118-Y127 AromaticContact CZ3-CE1 3.82Å; W118-Y127 HydrophobicContact CZ3-CE1 3.82Å; F120-Y127 HydrophobicContact CB-CD1 3.73Å; F120-Y127 HydrophobicContact CB-CE1 3.83Å; F120-Y127 HydrophobicContact CB-CG 4.17Å; F120-Y127 HydrophobicContact CG-CE1 4.3Å; G125-Y127 WeakPolarHBondContact O-CD2 3.44Å; G125-Y127 VanDerWaalsContact O-CE2 3.31Å; G125-Y127 WeakPolarHBondContact O-CE2 3.31Å
128	V	93.6	Very high	92	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	145	-178.7	71.5	0	0	0	0	111.9	F91 C106 W118 H119 F126 C132 L133 V136	F91-V128 HydrophobicContact CD1-CG1 4.03Å; F91-V128 HydrophobicContact CE1-CB 4.48Å; F91-V128 HydrophobicContact CE1-CG1 3.61Å; F91-V128 HydrophobicContact CZ-CG1 4.16Å; C106-V128 HydrophobicContact CB-CG2 4.16Å; W118-V128 WeakPolarHBondContact CA-O 3.46Å; H119-V128 HydrophobicContact CB-CG1 3.95Å; H119-V128 PolarHBondContact N-O 3.33Å; H119-V128 PolarHBondContact O-N 3.17Å; F126-V128 HydrophobicContact CD1-CB 4.42Å; F126-V128 HydrophobicContact CE1-CB 4.1Å; V128-C132 VanDerWaalsContact CG2-C 3.49Å; V128-C132 HydrophobicContact CG2-CB 3.44Å; V128-C132 VanDerWaalsContact CG2-CB 3.44Å; V128-C132 WeakPolarHBondContact CG2-O 3.42Å; V128-L133 HydrophobicContact CG1-CD1 3.92Å; V128-V136 HydrophobicContact CB-CG2 4.38Å; V128-V136 HydrophobicContact CG2-CG2 3.82Å
129	H	93.5	Very high	92.1	Very high	9 Å²	9	44.2 Å²	44.2	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	152.9	166.2	-61	112.6	0	0	0	110.2	C104 C107 L110 K131 C132 L133	C104-H129 WeakPolarHBondContact CB-CE1 3.25Å; C104-H129 WeakPolarHBondContact CB-ND1 3.17Å; C104-H129 PolarHBondContact SG-ND1 3.19Å; C104-H129 VanDerWaalsContact SG-ND1 3.41Å; C107-H129 PolarHBondContact SG-CE1 2.91Å; C107-H129 PolarHBondContact SG-ND1 2.82Å; L110-H129 PolarHBondContact O-NE2 3.18Å; H129-K131 VanDerWaalsContact C-N 3.29Å; H129-K131 HydrophobicContact CB-CG 4.04Å; H129-K131 PolarHBondContact O-N 3.25Å; H129-C132 HydrophobicContact CB-CB 4.06Å; H129-C132 PolarHBondContact O-N 3.21Å; H129-L133 PolarHBondContact O-N 3.25Å
130	G	91.4	Very high	92.2	Very high	18 Å²	18	43.5 Å²	43.5	19%	0.186	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-53.8	-46	173	0	0	0	0	0	112.5	P117 H119 C132 L133	P117-G130 PolarHBondContact O-N 2.79Å; H119-G130 WeakPolarHBondContact ND1-CA 3.49Å; G130-C132 PolarHBondContact O-N 3.05Å; G130-L133 VanDerWaalsContact O-CB 3.25Å; G130-L133 WeakPolarHBondContact O-CB 3.4Å; G130-L133 PolarHBondContact O-N 3.49Å
131	K	93.2	Very high	92.4	Very high	169 Å²	169	42.3 Å²	42.3	74%	0.735	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-67.1	-16.5	176.2	69	177.3	-178.7	179.9	0	115.4	H129	H129-K131 VanDerWaalsContact C-N 3.29Å; H129-K131 HydrophobicContact CB-CG 4.04Å; H129-K131 PolarHBondContact O-N 3.25Å
132	C	94.2	Very high	92.4	Very high	13 Å²	13	43.4 Å²	43.4	9%	0.088	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-98.7	-2.4	-178.2	-68.2	0	0	0	0	112.3	C106 V128 H129 G130 D134 S135	C106-C132 HydrophobicContact CB-CB 4.12Å; V128-C132 VanDerWaalsContact CG2-C 3.49Å; V128-C132 HydrophobicContact CG2-CB 3.44Å; V128-C132 VanDerWaalsContact CG2-CB 3.44Å; V128-C132 WeakPolarHBondContact CG2-O 3.42Å; H129-C132 HydrophobicContact CB-CB 4.06Å; H129-C132 PolarHBondContact O-N 3.21Å; G130-C132 PolarHBondContact O-N 3.05Å; C132-D134 PolarHBondContact O-N 3.06Å; C132-S135 PolarHBondContact O-N 2.98Å; C132-S135 VanDerWaalsContact O-N 3.09Å
133	L	92.9	Very high	92.5	Very high	17 Å²	17	40.2 Å²	40.2	9%	0.089	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-58.6	-47	-174.2	-176.5	60.6	0	0	0	112.1	S84 F91 V128 H129 G130 S135 V136	S84-L133 WeakPolarHBondContact OG-CD1 3.4Å; S84-L133 VanDerWaalsContact OG-CD2 3.3Å; S84-L133 WeakPolarHBondContact OG-CD2 3.26Å; F91-L133 HydrophobicContact CB-CD1 4.3Å; F91-L133 HydrophobicContact CD1-CD1 4.13Å; F91-L133 HydrophobicContact CD2-CD1 3.51Å; F91-L133 HydrophobicContact CE1-CD1 4.37Å; F91-L133 HydrophobicContact CE2-CD1 3.76Å; F91-L133 HydrophobicContact CG-CD1 3.71Å; F91-L133 HydrophobicContact CZ-CD1 4.2Å; V128-L133 HydrophobicContact CG1-CD1 3.92Å; H129-L133 PolarHBondContact O-N 3.25Å; G130-L133 VanDerWaalsContact O-CB 3.25Å; G130-L133 WeakPolarHBondContact O-CB 3.4Å; G130-L133 PolarHBondContact O-N 3.49Å; L133-S135 PolarHBondContact O-N 3.09Å; L133-V136 VanDerWaalsContact O-CG2 3.31Å; L133-V136 WeakPolarHBondContact O-CG2 3.43Å; L133-V136 PolarHBondContact O-N 2.66Å
134	D	92.6	Very high	92.5	Very high	130 Å²	130	38.7 Å²	38.7	70%	0.695	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-71.4	-14.5	179.9	-55.9	-34.6	0	0	0	113	C132	C132-D134 PolarHBondContact O-N 3.06Å
135	S	92.6	Very high	92.5	Very high	71 Å²	71	38.4 Å²	38.4	50%	0.497	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-95.4	6.8	-179.8	-61.9	0	0	0	0	113.6	C106 C132 L133 K137	C106-S135 PolarHBondContact SG-O 3.26Å; C106-S135 VanDerWaalsContact SG-O 3.34Å; C132-S135 PolarHBondContact O-N 2.98Å; C132-S135 VanDerWaalsContact O-N 3.09Å; L133-S135 PolarHBondContact O-N 3.09Å; S135-K137 PolarHBondContact O-N 2.69Å; S135-K137 VanDerWaalsContact O-N 3.14Å
136	V	92.5	Very high	92.5	Very high	4 Å²	4	42 Å²	42	2%	0.024	23%	0.23	C	C	.	.			trans	-72.4	105.1	178.4	176.7	0	0	0	0	109.7	N87 F91 F126 V128 L133	N87-V136 PolarHBondContact ND2-O 2.96Å; F91-V136 HydrophobicContact CZ-CG1 4.45Å; F91-V136 HydrophobicContact CZ-CG2 4.19Å; F126-V136 HydrophobicContact CE1-CG1 4.08Å; F126-V136 HydrophobicContact CE1-CG2 3.94Å; F126-V136 HydrophobicContact CZ-CG1 4.02Å; F126-V136 HydrophobicContact CZ-CG2 4.41Å; V128-V136 HydrophobicContact CB-CG2 4.38Å; V128-V136 HydrophobicContact CG2-CG2 3.82Å; L133-V136 VanDerWaalsContact O-CG2 3.31Å; L133-V136 WeakPolarHBondContact O-CG2 3.43Å; L133-V136 PolarHBondContact O-N 2.66Å
137	K	91.2	Very high	92.3	Very high	132 Å²	132	49 Å²	49	57%	0.574	26%	0.263	S	S	*	.			trans	-89.2	-29.3	176.1	-62.9	-173.9	-179.8	-175.7	0	114.2	S135 T139 C171	S135-K137 PolarHBondContact O-N 2.69Å; S135-K137 VanDerWaalsContact O-N 3.14Å; K137-T139 PolarHBondContact O-N 3.42Å; K137-C171 PolarHBondContact NZ-O 2.93Å
138	R	91.6	Very high	92	Very high	13 Å²	13	52.6 Å²	52.6	5%	0.049	28%	0.284	C	S	.	.	S	Bend	trans	-74	126.9	-172.8	-172.5	173.5	87.7	-155	6.8	110.8	H89 E105 F126 D170 R229 Q232	H89-R138 PolarHBondContact CD2-O 3.46Å; H89-R138 PolarHBondContact NE2-O 2.86Å; E105-R138 IonicContact OE2-CZ 3.64Å; E105-R138 IonicContact OE2-NH1 2.7Å; E105-R138 PolarHBondContact OE2-NH1 3.21Å; E105-R138 IonicContact OE2-NH2 2.7Å; E105-R138 PolarHBondContact OE2-NH2 3.08Å; F126-R138 HydrophobicContact CE2-CB 4.24Å; R138-D170 VanDerWaalsContact CD-CG 3.5Å; R138-D170 WeakPolarHBondContact CD-OD2 3.49Å; R138-R229 HydrophobicContact CG-CG 4.47Å; R138-Q232 VanDerWaalsContact NH2-NE2 3.16Å
139	T	92.2	Very high	91.8	Very high	57 Å²	57	54.7 Å²	54.7	35%	0.35	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-64.5	150.6	175.1	54.8	0	0	0	0	112.4	N87 K137 A141 R229	N87-T139 HydrophobicContact CB-CG2 4.43Å; N87-T139 CarbonylContact O-C 3.49Å; N87-T139 WeakPolarHBondContact O-CA 3.49Å; K137-T139 PolarHBondContact O-N 3.42Å; T139-A141 PolarHBondContact O-N 3.35Å; T139-R229 PolarHBondContact OG1-NH2 2.85Å
140	C	94.4	Very high	91.7	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-65.8	127.3	179.5	-173.9	0	0	0	0	111.5	N87 G88 H89 S142 V143 A144	N87-C140 PolarHBondContact O-N 3.1Å; G88-C140 VanDerWaalsContact O-CB 3.28Å; G88-C140 WeakPolarHBondContact O-CB 3.2Å; H89-C140 HydrophobicContact CB-CB 4.45Å; H89-C140 VanDerWaalsContact CE1-CA 3.42Å; H89-C140 WeakPolarHBondContact CE1-CA 3.43Å; H89-C140 PolarHBondContact NE2-N 2.83Å; C140-S142 PolarHBondContact O-N 2.8Å; C140-S142 PolarHBondContact SG-N 2.74Å; C140-V143 HydrophobicContact CB-CB 4.28Å; C140-V143 HydrophobicContact CB-CG2 3.96Å; C140-V143 PolarHBondContact O-N 3.26Å; C140-V143 VanDerWaalsContact O-N 3.1Å; C140-A144 PolarHBondContact O-N 3.19Å; C140-A144 VanDerWaalsContact O-N 3.15Å
141	A	94.2	Very high	91.9	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-29.2	177.1	0	0	0	0	0	112.3	C124 T139 V143 A144 V145 Q232 L236	C124-A141 HydrophobicContact CB-CB 4.05Å; T139-A141 PolarHBondContact O-N 3.35Å; A141-V143 VanDerWaalsContact C-N 3.35Å; A141-A144 PolarHBondContact O-N 2.85Å; A141-V145 WeakPolarHBondContact O-CB 3.43Å; A141-V145 VanDerWaalsContact O-CG2 3.28Å; A141-V145 WeakPolarHBondContact O-CG2 3.41Å; A141-V145 PolarHBondContact O-N 3.34Å; A141-Q232 HydrophobicContact CB-CB 3.57Å; A141-L236 HydrophobicContact CB-CD1 4.15Å
142	S	93.5	Very high	91.9	Very high	23 Å²	23	53.8 Å²	53.8	16%	0.161	30%	0.297	C	S	.	.	H	α-helix	trans	-67.7	-36	176	-168.7	0	0	0	0	112.6	C140 V145 T146	C140-S142 PolarHBondContact O-N 2.8Å; C140-S142 PolarHBondContact SG-N 2.74Å; S142-V145 PolarHBondContact O-N 3Å; S142-T146 WeakPolarHBondContact O-CB 3.48Å; S142-T146 PolarHBondContact O-N 3.12Å; S142-T146 PolarHBondContact O-OG1 3.45Å
143	V	91.4	Very high	91.8	Very high	41 Å²	41	56.9 Å²	56.9	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-66.2	-47.1	174.3	173.5	0	0	0	0	109.3	G88 C140 A141 V145 T146 E147	G88-V143 WeakPolarHBondContact O-CG2 3.46Å; C140-V143 HydrophobicContact CB-CB 4.28Å; C140-V143 HydrophobicContact CB-CG2 3.96Å; C140-V143 PolarHBondContact O-N 3.26Å; C140-V143 VanDerWaalsContact O-N 3.1Å; A141-V143 VanDerWaalsContact C-N 3.35Å; V143-V145 VanDerWaalsContact C-N 3.3Å; V143-V145 PolarHBondContact O-N 2.87Å; V143-T146 PolarHBondContact O-N 3.41Å; V143-E147 HydrophobicContact CG1-CG 4.17Å; V143-E147 WeakPolarHBondContact CG1-OE1 3.46Å; V143-E147 WeakPolarHBondContact O-CG 3.5Å; V143-E147 PolarHBondContact O-N 2.97Å
144	A	90	Very high	91.8	Very high	25 Å²	25	61.8 Å²	61.8	21%	0.207	34%	0.341	C	S	.	.	H	α-helix	trans	-56.2	-42.4	175.8	0	0	0	0	0	112.9	C140 A141 T146 L148 F233	C140-A144 PolarHBondContact O-N 3.19Å; C140-A144 VanDerWaalsContact O-N 3.15Å; A141-A144 PolarHBondContact O-N 2.85Å; A144-T146 VanDerWaalsContact C-N 3.3Å; A144-T146 PolarHBondContact O-N 2.96Å; A144-L148 CarbonylContact O-C 3.54Å; A144-L148 PolarHBondContact O-N 3.37Å; A144-F233 HydrophobicContact CB-CD2 4.29Å
145	V	91.5	Very high	91.7	Very high	8 Å²	8	58.3 Å²	58.3	5%	0.048	32%	0.322	C	S	.	.	H	α-helix	trans	-69.4	-25.8	176.5	168.3	0	0	0	0	113.1	A141 S142 V143 P149 F233 L236 M237 R240	A141-V145 WeakPolarHBondContact O-CB 3.43Å; A141-V145 VanDerWaalsContact O-CG2 3.28Å; A141-V145 WeakPolarHBondContact O-CG2 3.41Å; A141-V145 PolarHBondContact O-N 3.34Å; S142-V145 PolarHBondContact O-N 3Å; V143-V145 VanDerWaalsContact C-N 3.3Å; V143-V145 PolarHBondContact O-N 2.87Å; V145-P149 WeakPolarHBondContact O-CB 3.47Å; V145-F233 HydrophobicContact CG2-CD2 3.37Å; V145-F233 HydrophobicContact CG2-CE2 3.53Å; V145-F233 HydrophobicContact CG2-CG 4.1Å; V145-F233 HydrophobicContact CG2-CZ 4.35Å; V145-L236 HydrophobicContact CG1-CB 4.4Å; V145-L236 HydrophobicContact CG2-CB 3.98Å; V145-L236 HydrophobicContact CG2-CD1 4.43Å; V145-M237 HydrophobicContact CG1-CG 4.09Å; V145-M237 HydrophobicContact CG1-SD 3.72Å; V145-M237 HydrophobicContact CG2-CG 3.71Å; V145-M237 HydrophobicContact CG2-SD 4.3Å; V145-R240 PolarHBondContact O-NH1 3.15Å
146	T	89.9	Confident	91.1	Very high	106 Å²	106	57.5 Å²	57.5	65%	0.65	32%	0.316	S	S	*	.	H	α-helix	trans	-82.1	-42.2	179	-57	0	0	0	0	110.9	S142 V143 A144	S142-T146 WeakPolarHBondContact O-CB 3.48Å; S142-T146 PolarHBondContact O-N 3.12Å; S142-T146 PolarHBondContact O-OG1 3.45Å; V143-T146 PolarHBondContact O-N 3.41Å; A144-T146 VanDerWaalsContact C-N 3.3Å; A144-T146 PolarHBondContact O-N 2.96Å
147	E	88.4	Confident	90.8	Very high	150 Å²	150	58.2 Å²	58.2	70%	0.701	32%	0.321	S	S	*	.	H	α-helix	trans	-74.8	-46.2	-179.4	-68.2	174.2	174.5	0	0	112.4	V143	V143-E147 HydrophobicContact CG1-CG 4.17Å; V143-E147 WeakPolarHBondContact CG1-OE1 3.46Å; V143-E147 WeakPolarHBondContact O-CG 3.5Å; V143-E147 PolarHBondContact O-N 2.97Å
148	L	87.5	Confident	90.6	Very high	118 Å²	118	55.8 Å²	55.8	62%	0.618	31%	0.312	S	S	*	.			trans	-138.2	82.6	-177	-169.9	64	0	0	0	110.9	A144 V150	A144-L148 CarbonylContact O-C 3.54Å; A144-L148 PolarHBondContact O-N 3.37Å; L148-V150 HydrophobicContact CD1-CB 4.4Å; L148-V150 HydrophobicContact CD1-CG2 3.86Å; L148-V150 HydrophobicContact CG-CB 4.29Å; L148-V150 HydrophobicContact CG-CG2 4.24Å; L148-V150 PolarHBondContact O-N 3.29Å
149	P	88.8	Confident	90.4	Very high	44 Å²	44	63.6 Å²	63.6	29%	0.286	35%	0.346	S	S	.	.			trans	-76.9	53.2	178.3	32.6	-36	0	0	0	112.3	V145 M237	V145-P149 WeakPolarHBondContact O-CB 3.47Å; P149-M237 HydrophobicContact CB-CE 4.07Å; P149-M237 HydrophobicContact CB-SD 3.83Å; P149-M237 VanDerWaalsContact O-CE 3.23Å; P149-M237 WeakPolarHBondContact O-CE 3.44Å
150	V	92.5	Very high	90.4	Very high	92 Å²	92	62 Å²	62	56%	0.558	34%	0.34	S	S	*	.			trans	-119	133.6	-179.6	-178	0	0	0	0	108.9	L148 F233	L148-V150 HydrophobicContact CD1-CB 4.4Å; L148-V150 HydrophobicContact CD1-CG2 3.86Å; L148-V150 HydrophobicContact CG-CB 4.29Å; L148-V150 HydrophobicContact CG-CG2 4.24Å; L148-V150 PolarHBondContact O-N 3.29Å; V150-F233 WeakPolarHBondContact O-CZ 3.25Å
151	Y	95.1	Very high	90.2	Very high	18 Å²	18	62.4 Å²	62.4	7%	0.071	34%	0.343	C	S	.	.			trans	-81.7	148.7	173.5	-69.8	-75.8	0	0	0	110.9	S153 Y194 P212 F233 L234 M237 Q238 V242 F243	Y151-S153 PolarHBondContact O-N 2.89Å; Y151-Y194 WeakPolarHBondContact CA-OH 3.45Å; Y151-Y194 HydrophobicContact CD1-CE2 4.43Å; Y151-P212 HydrophobicContact CD1-CB 4.08Å; Y151-P212 HydrophobicContact CD1-CG 3.47Å; Y151-P212 VanDerWaalsContact CD1-CG 3.47Å; Y151-P212 HydrophobicContact CE1-CB 4.46Å; Y151-P212 HydrophobicContact CE1-CG 3.58Å; Y151-P212 HydrophobicContact CG-CB 4.08Å; Y151-P212 HydrophobicContact CG-CG 4Å; Y151-F233 HydrophobicContact CD1-CE1 4.05Å; Y151-F233 HydrophobicContact CE1-CE1 4.42Å; Y151-L234 HydrophobicContact CD1-CD2 4Å; Y151-L234 HydrophobicContact CE1-CD2 3.78Å; Y151-M237 HydrophobicContact CD2-CE 4Å; Y151-M237 HydrophobicContact CE1-CB 3.56Å; Y151-M237 HydrophobicContact CE1-CG 4.31Å; Y151-M237 HydrophobicContact CE2-CB 4.27Å; Y151-M237 HydrophobicContact CE2-CE 3.73Å; Y151-M237 VanDerWaalsContact CZ-CB 3.44Å; Y151-M237 VanDerWaalsContact OH-CB 3.24Å; Y151-M237 WeakPolarHBondContact OH-CB 3.49Å; Y151-M237 PolarHBondContact OH-O 3.25Å; Y151-Q238 PolarHBondContact OH-N 2.98Å; Y151-V242 HydrophobicContact CD2-CG2 3.83Å; Y151-V242 HydrophobicContact CE2-CG2 3.52Å; Y151-F243 HydrophobicContact CD2-CD1 4.41Å; Y151-F243 AromaticContact CD2-CE1 3.26Å; Y151-F243 HydrophobicContact CD2-CE1 3.26Å; Y151-F243 HydrophobicContact CD2-CE2 4.38Å; Y151-F243 AromaticContact CD2-CZ 3.24Å; Y151-F243 HydrophobicContact CD2-CZ 3.24Å; Y151-F243 AromaticContact CE2-CE1 3.61Å; Y151-F243 HydrophobicContact CE2-CE1 3.61Å; Y151-F243 AromaticContact CE2-CE2 3.9Å; Y151-F243 HydrophobicContact CE2-CE2 3.9Å; Y151-F243 AromaticContact CE2-CZ 3.13Å; Y151-F243 HydrophobicContact CE2-CZ 3.13Å; Y151-F243 HydrophobicContact CG-CE1 4.14Å; Y151-F243 HydrophobicContact CG-CZ 4.09Å; Y151-F243 AromaticContact CZ-CZ 3.91Å
152	E	94	Very high	90.2	Very high	67 Å²	67	65.5 Å²	65.5	31%	0.313	37%	0.368	S	S	.	.			trans	-53.5	125.9	160.8	-173.2	50.1	-100.7	0	0	110.8	E154 P157 Y194	E152-E154 PolarHBondContact OE1-N 3.25Å; E152-P157 HydrophobicContact CG-CG 3.93Å; E152-Y194 HydrophobicContact CB-CD2 4.38Å; E152-Y194 HydrophobicContact CB-CE2 3.74Å; E152-Y194 PolarHBondContact N-OH 3.26Å
153	S	91.3	Very high	90.2	Very high	77 Å²	77	67.4 Å²	67.4	54%	0.538	39%	0.385	S	S	.	.			trans	-95.5	-20.5	-173.6	51.4	0	0	0	0	113.3	Y151 H217	Y151-S153 PolarHBondContact O-N 2.89Å; S153-H217 PolarHBondContact O-NE2 2.89Å
154	E	93.1	Very high	90.3	Very high	120 Å²	120	66.7 Å²	66.7	56%	0.561	38%	0.379	S	S	*	.	S	Bend	trans	-85.7	141.8	-178.8	-67.9	-178.6	-173.7	0	0	112	E152 S156 P157 A213	E152-E154 PolarHBondContact OE1-N 3.25Å; E154-S156 PolarHBondContact O-N 3.3Å; E154-P157 HydrophobicContact CB-CB 4.05Å; E154-A213 WeakPolarHBondContact O-CB 3.21Å
155	I	89.5	Confident	90.6	Very high	58 Å²	58	72.6 Å²	72.6	30%	0.297	40%	0.402	S	S	.	.	S	Bend	trans	-81.4	117.4	170.9	-58.9	171.1	0	0	0	107.9	A213 R214 H217 N218	I155-A213 HydrophobicContact CG1-CB 4.13Å; I155-R214 HydrophobicContact CG1-CG 4.44Å; I155-R214 HydrophobicContact CG2-CG 3.93Å; I155-H217 HydrophobicContact CD1-CB 3.55Å; I155-H217 HydrophobicContact CG1-CB 4.3Å; I155-N218 WeakPolarHBondContact CD1-ND2 3.46Å
156	S	81.6	Confident	90.6	Very high	54 Å²	54	77.8 Å²	77.8	38%	0.378	42%	0.424	S	S	.	.	S	Bend	trans	58.4	64.7	176.5	-163.3	0	0	0	0	113.1	E154 E158	E154-S156 PolarHBondContact O-N 3.3Å; S156-E158 PolarHBondContact O-N 3.17Å
157	P	85.3	Confident	90.8	Very high	18 Å²	18	75.2 Å²	75.2	12%	0.117	41%	0.406	C	S	.	.			trans	-74.4	37.4	-177.1	34.3	-38.4	0	0	0	113.1	E152 E154 K159	E152-P157 HydrophobicContact CG-CG 3.93Å; E154-P157 HydrophobicContact CB-CB 4.05Å; P157-K159 PolarHBondContact O-N 3.5Å
158	E	87	Confident	91.1	Very high	82 Å²	82	68.1 Å²	68.1	38%	0.383	37%	0.373	S	S	.	.			trans	-66.5	125	-175.7	-172.8	-170.8	158.9	0	0	111.1	S156 L191 Y198	S156-E158 PolarHBondContact O-N 3.17Å; E158-L191 HydrophobicContact CB-CD1 4.47Å; E158-L191 HydrophobicContact CG-CD1 4Å; E158-L191 VanDerWaalsContact OE2-CD2 3.29Å; E158-L191 WeakPolarHBondContact OE2-CD2 3.49Å; E158-Y198 HydrophobicContact CG-CE2 4.05Å; E158-Y198 WeakPolarHBondContact OE1-CE2 3.4Å; E158-Y198 PolarHBondContact OE1-OH 3.31Å
159	K	87	Confident	91.4	Very high	176 Å²	176	63.7 Å²	63.7	77%	0.765	35%	0.353	S	S	*	.			trans	-99.9	-7.3	174.8	-60.9	-179.6	-178.8	179	0	113.3	P157 A163	P157-K159 PolarHBondContact O-N 3.5Å; K159-A163 HydrophobicContact CB-CB 3.89Å
160	G	91.7	Very high	91.6	Very high	23 Å²	23	62.1 Å²	62.1	24%	0.237	34%	0.343	C	S	.	.			trans	89.3	154.9	-174.7	0	0	0	0	0	113.7	A162 A163	G160-A162 VanDerWaalsContact C-N 3.28Å; G160-A162 PolarHBondContact O-N 3.03Å; G160-A163 WeakPolarHBondContact O-CB 3.3Å; G160-A163 PolarHBondContact O-N 3.42Å
161	L	91.6	Very high	91.5	Very high	10 Å²	10	58.4 Å²	58.4	5%	0.052	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-63.5	-30.5	-175.8	-179.9	61.3	0	0	0	113.6	A163 Q164 F166 I175 I177 A189 Y198	L161-A163 VanDerWaalsContact C-N 3.27Å; L161-A163 PolarHBondContact O-N 3.04Å; L161-Q164 HydrophobicContact CD1-CG 3.91Å; L161-Q164 WeakPolarHBondContact O-CG 3.05Å; L161-Q164 PolarHBondContact O-N 3.26Å; L161-F166 HydrophobicContact CD2-CD1 3.74Å; L161-F166 HydrophobicContact CD2-CE1 4.29Å; L161-F166 HydrophobicContact CG-CD1 3.81Å; L161-F166 HydrophobicContact CG-CE1 4.33Å; L161-F166 HydrophobicContact CG-CG 4.46Å; L161-F166 PolarHBondContact O-N 2.59Å; L161-I175 HydrophobicContact CD1-CD1 3.89Å; L161-I175 HydrophobicContact CD1-CG1 3.91Å; L161-I177 HydrophobicContact CB-CD1 4.48Å; L161-I177 HydrophobicContact CD2-CD1 4.4Å; L161-I177 HydrophobicContact CD2-CG1 3.82Å; L161-A189 HydrophobicContact CD1-CB 4.41Å; L161-A189 HydrophobicContact CD2-CB 4.08Å; L161-Y198 HydrophobicContact CB-CD2 4.09Å; L161-Y198 HydrophobicContact CB-CE2 4.19Å; L161-Y198 HydrophobicContact CB-CG 4.36Å; L161-Y198 HydrophobicContact CD1-CD2 4.28Å; L161-Y198 HydrophobicContact CD1-CG 3.97Å
162	A	93	Very high	91.3	Very high	66 Å²	66	62.4 Å²	62.4	55%	0.545	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-62.9	-33.3	177.6	0	0	0	0	0	112.4	G160 Q164 H165 F166	G160-A162 VanDerWaalsContact C-N 3.28Å; G160-A162 PolarHBondContact O-N 3.03Å; A162-Q164 PolarHBondContact O-N 2.92Å; A162-Q164 VanDerWaalsContact O-N 3.16Å; A162-H165 PolarHBondContact O-N 3.15Å; A162-F166 HydrophobicContact CB-CE2 4.32Å; A162-F166 HydrophobicContact CB-CZ 4.17Å
163	A	94.2	Very high	91.1	Very high	62 Å²	62	63 Å²	63	51%	0.512	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-65.4	-18	179.5	0	0	0	0	0	113.4	K159 G160 L161	K159-A163 HydrophobicContact CB-CB 3.89Å; G160-A163 WeakPolarHBondContact O-CB 3.3Å; G160-A163 PolarHBondContact O-N 3.42Å; L161-A163 VanDerWaalsContact C-N 3.27Å; L161-A163 PolarHBondContact O-N 3.04Å
164	Q	94.1	Very high	91.2	Very high	26 Å²	26	63 Å²	63	12%	0.121	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-109.2	23.7	173.7	58.9	-179.8	72.8	0	0	112.4	L161 A162 F166 L167 Y198	L161-Q164 HydrophobicContact CD1-CG 3.91Å; L161-Q164 WeakPolarHBondContact O-CG 3.05Å; L161-Q164 PolarHBondContact O-N 3.26Å; A162-Q164 PolarHBondContact O-N 2.92Å; A162-Q164 VanDerWaalsContact O-N 3.16Å; Q164-F166 PolarHBondContact O-N 2.79Å; Q164-F166 VanDerWaalsContact O-N 3.1Å; Q164-L167 PolarHBondContact NE2-O 3.04Å; Q164-L167 PolarHBondContact O-N 3.31Å; Q164-Y198 VanDerWaalsContact NE2-CB 3.33Å; Q164-Y198 PolarHBondContact NE2-O 3.35Å
165	H	94.7	Very high	91.2	Very high	150 Å²	150	57.4 Å²	57.4	69%	0.694	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	32.2	175.5	-50.8	99.6	0	0	0	113.7	A162 L167	A162-H165 PolarHBondContact O-N 3.15Å; H165-L167 HydrophobicContact CB-CG 4.43Å; H165-L167 WeakPolarHBondContact O-CG 2.99Å; H165-L167 PolarHBondContact O-N 2.97Å
166	F	93	Very high	91.2	Very high	117 Å²	117	55.6 Å²	55.6	51%	0.513	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	25.7	-176	-54.3	-91.4	0	0	0	114	L161 A162 Q164 P174 I175	L161-F166 HydrophobicContact CD2-CD1 3.74Å; L161-F166 HydrophobicContact CD2-CE1 4.29Å; L161-F166 HydrophobicContact CG-CD1 3.81Å; L161-F166 HydrophobicContact CG-CE1 4.33Å; L161-F166 HydrophobicContact CG-CG 4.46Å; L161-F166 PolarHBondContact O-N 2.59Å; A162-F166 HydrophobicContact CB-CE2 4.32Å; A162-F166 HydrophobicContact CB-CZ 4.17Å; Q164-F166 PolarHBondContact O-N 2.79Å; Q164-F166 VanDerWaalsContact O-N 3.1Å; F166-P174 CarbonylContact O-C 3.55Å; F166-P174 WeakPolarHBondContact O-CA 3.38Å; F166-I175 PolarHBondContact O-N 3.44Å
167	L	93.8	Very high	91.4	Very high	52 Å²	52	58 Å²	58	27%	0.272	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-108.6	142.8	177.9	-57.7	-179.6	0	0	0	110.9	Q164 H165 A169 R173 P174	Q164-L167 PolarHBondContact NE2-O 3.04Å; Q164-L167 PolarHBondContact O-N 3.31Å; H165-L167 HydrophobicContact CB-CG 4.43Å; H165-L167 WeakPolarHBondContact O-CG 2.99Å; H165-L167 PolarHBondContact O-N 2.97Å; L167-A169 PolarHBondContact O-N 3.01Å; L167-R173 CarbonylContact C-O 3.59Å; L167-R173 WeakPolarHBondContact CA-O 3.43Å; L167-P174 HydrophobicContact CD2-CG 4.25Å
168	C	93.7	Very high	91.2	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.328	C	S	.	.			trans	-59.9	127.9	171.2	173.7	0	0	0	0	111.1	D170 C171 Q172 R173 I175 C200	C168-D170 PolarHBondContact O-N 3.29Å; C168-D170 VanDerWaalsContact O-N 3.08Å; C168-C171 PolarHBondContact SG-SG 3.18Å; C168-Q172 VanDerWaalsContact O-CA 3.27Å; C168-Q172 WeakPolarHBondContact O-CA 3.39Å; C168-Q172 PolarHBondContact O-N 3.09Å; C168-Q172 PolarHBondContact O-NE2 3.41Å; C168-R173 PolarHBondContact N-O 3.05Å; C168-I175 HydrophobicContact CB-CD1 4.2Å; C168-I175 HydrophobicContact CB-CG2 4.06Å; C168-C200 HydrophobicContact CB-CB 4.22Å; C168-C200 PolarHBondContact SG-N 3.36Å
169	A	94.2	Very high	90.2	Very high	25 Å²	25	60.4 Å²	60.4	21%	0.207	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28	-176.4	0	0	0	0	0	114.3	L167 Q172 L197 Y198 F199	L167-A169 PolarHBondContact O-N 3.01Å; A169-Q172 PolarHBondContact O-NE2 3.11Å; A169-L197 HydrophobicContact CB-CB 4.04Å; A169-L197 HydrophobicContact CB-CD1 4.07Å; A169-Y198 PolarHBondContact N-O 3.04Å; A169-Y198 VanDerWaalsContact N-O 3.13Å; A169-F199 HydrophobicContact CB-CD1 4.23Å; A169-F199 HydrophobicContact CB-CE1 3.78Å; A169-F199 HydrophobicContact CB-CE2 4.41Å; A169-F199 HydrophobicContact CB-CZ 3.87Å
170	D	92.6	Very high	89.4	Confident	12 Å²	12	56.4 Å²	56.4	6%	0.064	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-55	178.9	-85.7	-9.5	0	0	0	113.4	R138 C168 F199 C203 R229	R138-D170 VanDerWaalsContact CD-CG 3.5Å; R138-D170 WeakPolarHBondContact CD-OD2 3.49Å; C168-D170 PolarHBondContact O-N 3.29Å; C168-D170 VanDerWaalsContact O-N 3.08Å; D170-F199 HydrophobicContact CB-CD1 4.19Å; D170-F199 HydrophobicContact CB-CE1 4.2Å; D170-C203 HydrophobicContact CB-CB 4.12Å; D170-R229 VanDerWaalsContact OD1-CD 3.25Å; D170-R229 WeakPolarHBondContact OD1-CD 3.28Å; D170-R229 IonicContact OD1-NH1 3.98Å
171	C	91.2	Very high	88.2	Confident	14 Å²	14	59.6 Å²	59.6	10%	0.095	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-8.1	-170.1	71.5	0	0	0	0	114.5	K137 C168 R173 C200	K137-C171 PolarHBondContact NZ-O 2.93Å; C168-C171 PolarHBondContact SG-SG 3.18Å; C171-R173 PolarHBondContact O-N 3.2Å; C171-C200 VanDerWaalsContact SG-SG 3.63Å
172	Q	91.8	Very high	86.7	Confident	101 Å²	101	61.8 Å²	61.8	47%	0.472	36%	0.36	S	S	.	.			trans	61.5	19.9	-179.6	-56.6	-64.5	-43.5	0	0	114.3	C168 A169	C168-Q172 VanDerWaalsContact O-CA 3.27Å; C168-Q172 WeakPolarHBondContact O-CA 3.39Å; C168-Q172 PolarHBondContact O-N 3.09Å; C168-Q172 PolarHBondContact O-NE2 3.41Å; A169-Q172 PolarHBondContact O-NE2 3.11Å
173	R	89.7	Confident	85.3	Confident	79 Å²	79	67.4 Å²	67.4	30%	0.298	38%	0.379	S	S	.	.			trans	-77.7	145.2	171.9	-65.7	-177.5	-171.8	142.1	1.9	110.1	L167 C168 C171 F187	L167-R173 CarbonylContact C-O 3.59Å; L167-R173 WeakPolarHBondContact CA-O 3.43Å; C168-R173 PolarHBondContact N-O 3.05Å; C171-R173 PolarHBondContact O-N 3.2Å; R173-F187 HydrophobicContact CB-CE1 4.32Å
174	P	91.7	Very high	83.9	Confident	79 Å²	79	70.4 Å²	70.4	51%	0.513	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-56.3	137.9	171.7	-23.9	34	0	0	0	111.8	F166 L167 M182 F187	F166-P174 CarbonylContact O-C 3.55Å; F166-P174 WeakPolarHBondContact O-CA 3.38Å; L167-P174 HydrophobicContact CD2-CG 4.25Å; P174-M182 HydrophobicContact CB-CE 4.47Å; P174-F187 WeakPolarHBondContact O-CD1 3.33Å
175	I	92.9	Very high	82.5	Confident	2 Å²	2	74 Å²	74	1%	0.01	40%	0.403	C	S	.	.			trans	-141.1	153.9	178.2	58.9	174.2	0	0	0	111.2	L161 F166 C168 F187 A189 C200	L161-I175 HydrophobicContact CD1-CD1 3.89Å; L161-I175 HydrophobicContact CD1-CG1 3.91Å; F166-I175 PolarHBondContact O-N 3.44Å; C168-I175 HydrophobicContact CB-CD1 4.2Å; C168-I175 HydrophobicContact CB-CG2 4.06Å; I175-F187 CarbonylContact C-O 3.6Å; I175-F187 WeakPolarHBondContact CA-O 3.25Å; I175-F187 VanDerWaalsContact CB-O 3.28Å; I175-F187 WeakPolarHBondContact CB-O 3.48Å; I175-A189 HydrophobicContact CB-CB 4.11Å; I175-A189 HydrophobicContact CD1-CB 3.83Å; I175-A189 HydrophobicContact CG1-CB 4.08Å; I175-C200 HydrophobicContact CG2-CB 3.57Å
176	A	90.6	Very high	81.3	Confident	19 Å²	19	67.9 Å²	67.9	16%	0.157	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-141.2	150.2	179.5	0	0	0	0	0	110.3	M182 F187 S188 A189	A176-M182 HydrophobicContact CB-CE 3.51Å; A176-M182 HydrophobicContact CB-CG 3.87Å; A176-F187 PolarHBondContact N-O 3.39Å; A176-S188 CarbonylContact O-C 3.54Å; A176-S188 WeakPolarHBondContact O-CA 3.37Å; A176-A189 WeakPolarHBondContact O-CB 3.49Å; A176-A189 PolarHBondContact O-N 3.49Å
177	I	86.3	Confident	80.7	Confident	106 Å²	106	64.4 Å²	64.4	54%	0.544	36%	0.361	S	S	.	.	S	Bend	trans	-67.5	-47.2	178.3	-61	175.7	0	0	0	109.8	L161 P179 A189 Y198	L161-I177 HydrophobicContact CB-CD1 4.48Å; L161-I177 HydrophobicContact CD2-CD1 4.4Å; L161-I177 HydrophobicContact CD2-CG1 3.82Å; I177-P179 WeakPolarHBondContact O-CD 3.49Å; I177-A189 HydrophobicContact CG1-CB 4.37Å; I177-Y198 HydrophobicContact CD1-CE1 4.48Å; I177-Y198 HydrophobicContact CG1-CE1 4.47Å
178	D	79.8	Confident	80.4	Confident	81 Å²	81	63 Å²	63	43%	0.433	36%	0.356	S	S	.	.			trans	-82.9	116.2	178.5	176.5	23.3	0	0	0	111.5	A180 S181	D178-A180 PolarHBondContact O-N 3.1Å; D178-A180 WeakPolarHBondContact OD1-CB 3.42Å; D178-A180 PolarHBondContact OD1-N 3.17Å; D178-S181 PolarHBondContact O-N 2.91Å; D178-S181 PolarHBondContact OD2-OG 3.23Å; D178-S181 VanDerWaalsContact OD2-OG 3.07Å
179	P	65.7	Low	80.3	Confident	69 Å²	69	63.5 Å²	63.5	45%	0.448	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-63.1	-28.5	175.4	-17	30.4	0	0	0	113.1	I177 S181 M182	I177-P179 WeakPolarHBondContact O-CD 3.49Å; P179-S181 PolarHBondContact O-N 3.36Å; P179-M182 PolarHBondContact O-N 3.36Å; P179-M182 VanDerWaalsContact O-N 3.08Å
180	A	70.8	Confident	80.3	Confident	91 Å²	91	64.1 Å²	64.1	75%	0.752	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24.2	-178	0	0	0	0	0	112.2	D178 M182	D178-A180 PolarHBondContact O-N 3.1Å; D178-A180 WeakPolarHBondContact OD1-CB 3.42Å; D178-A180 PolarHBondContact OD1-N 3.17Å; A180-M182 VanDerWaalsContact C-N 3.27Å; A180-M182 PolarHBondContact O-N 2.91Å
181	S	66.2	Low	80.4	Confident	91 Å²	91	65.8 Å²	65.8	64%	0.636	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-78.5	-2.5	176.3	-62.3	0	0	0	0	114.1	D178 P179	D178-S181 PolarHBondContact O-N 2.91Å; D178-S181 PolarHBondContact OD2-OG 3.23Å; D178-S181 VanDerWaalsContact OD2-OG 3.07Å; P179-S181 PolarHBondContact O-N 3.36Å
182	M	60.9	Low	80.7	Confident	55 Å²	55	65.1 Å²	65.1	27%	0.271	36%	0.364	S	S	.	.	S	Bend	trans	-126.2	139.9	-172	-77.7	-89.6	-175.2	0	0	112.9	P174 A176 P179 A180 R184 F187	P174-M182 HydrophobicContact CB-CE 4.47Å; A176-M182 HydrophobicContact CB-CE 3.51Å; A176-M182 HydrophobicContact CB-CG 3.87Å; P179-M182 PolarHBondContact O-N 3.36Å; P179-M182 VanDerWaalsContact O-N 3.08Å; A180-M182 VanDerWaalsContact C-N 3.27Å; A180-M182 PolarHBondContact O-N 2.91Å; M182-R184 PolarHBondContact O-N 3.09Å; M182-R184 VanDerWaalsContact O-N 3.15Å; M182-F187 HydrophobicContact CE-CB 4.35Å; M182-F187 HydrophobicContact CG-CB 4.32Å; M182-F187 HydrophobicContact SD-CB 3.75Å; M182-F187 HydrophobicContact SD-CD2 4.45Å; M182-F187 HydrophobicContact SD-CG 4.4Å
183	I	62.4	Low	80.9	Confident	185 Å²	185	63.1 Å²	63.1	95%	0.949	35%	0.354	S	S	*	.	S	Bend	trans	-62.6	-22.1	177.1	-61.5	170.2	0	0	0	112.4
184	R	66.3	Low	81.3	Confident	125 Å²	125	60.2 Å²	60.2	47%	0.472	34%	0.343	S	S	.	.	S	Bend	trans	-140.3	129.8	-175.5	-157.8	169.3	76.7	168.8	6.2	112.6	M182 C186 F187	M182-R184 PolarHBondContact O-N 3.09Å; M182-R184 VanDerWaalsContact O-N 3.15Å; R184-C186 VanDerWaalsContact CZ-SG 3.56Å; R184-C186 PolarHBondContact NE-SG 2.73Å; R184-C186 PolarHBondContact NH2-SG 2.92Å; R184-C186 PolarHBondContact O-N 3.37Å; R184-F187 HydrophobicContact CB-CD2 3.64Å; R184-F187 HydrophobicContact CB-CE2 3.6Å; R184-F187 HydrophobicContact CG-CE2 4.37Å; R184-F187 WeakPolarHBondContact O-CD2 3.33Å; R184-F187 PolarHBondContact O-N 3.09Å; R184-F187 VanDerWaalsContact O-N 3.16Å
185	P	64.2	Low	81.5	Confident	102 Å²	102	57.8 Å²	57.8	66%	0.662	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-63.3	-19.5	-177.1	22	-32.1	0	0	0	113.7	F187 S188	P185-F187 PolarHBondContact O-N 3.49Å; P185-S188 PolarHBondContact O-N 2.86Å; P185-S188 VanDerWaalsContact O-N 3.16Å
186	C	69.4	Low	81.6	Confident	21 Å²	21	57.9 Å²	57.9	14%	0.142	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-65.6	-11.6	178.7	92.4	0	0	0	0	113.8	R184 T201 I202	R184-C186 VanDerWaalsContact CZ-SG 3.56Å; R184-C186 PolarHBondContact NE-SG 2.73Å; R184-C186 PolarHBondContact NH2-SG 2.92Å; R184-C186 PolarHBondContact O-N 3.37Å; C186-T201 VanDerWaalsContact C-OG1 3.29Å; C186-T201 WeakPolarHBondContact CA-OG1 3.35Å; C186-T201 PolarHBondContact O-N 3.22Å; C186-T201 PolarHBondContact O-OG1 2.91Å; C186-I202 HydrophobicContact CB-CD1 4.47Å
187	F	79.5	Confident	81.8	Confident	44 Å²	44	60.3 Å²	60.3	19%	0.193	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-98.1	8.8	-179.7	-56.3	-57.8	0	0	0	113.4	R173 P174 I175 A176 M182 R184 P185 A189	R173-F187 HydrophobicContact CB-CE1 4.32Å; P174-F187 WeakPolarHBondContact O-CD1 3.33Å; I175-F187 CarbonylContact C-O 3.6Å; I175-F187 WeakPolarHBondContact CA-O 3.25Å; I175-F187 VanDerWaalsContact CB-O 3.28Å; I175-F187 WeakPolarHBondContact CB-O 3.48Å; A176-F187 PolarHBondContact N-O 3.39Å; M182-F187 HydrophobicContact CE-CB 4.35Å; M182-F187 HydrophobicContact CG-CB 4.32Å; M182-F187 HydrophobicContact SD-CB 3.75Å; M182-F187 HydrophobicContact SD-CD2 4.45Å; M182-F187 HydrophobicContact SD-CG 4.4Å; R184-F187 HydrophobicContact CB-CD2 3.64Å; R184-F187 HydrophobicContact CB-CE2 3.6Å; R184-F187 HydrophobicContact CG-CE2 4.37Å; R184-F187 WeakPolarHBondContact O-CD2 3.33Å; R184-F187 PolarHBondContact O-N 3.09Å; R184-F187 VanDerWaalsContact O-N 3.16Å; P185-F187 PolarHBondContact O-N 3.49Å; F187-A189 PolarHBondContact O-N 3.49Å
188	S	88.4	Confident	82.3	Confident	23 Å²	23	56.3 Å²	56.3	16%	0.161	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-61.8	133.5	168.1	-179.3	0	0	0	0	110.4	A176 P185	A176-S188 CarbonylContact O-C 3.54Å; A176-S188 WeakPolarHBondContact O-CA 3.37Å; P185-S188 PolarHBondContact O-N 2.86Å; P185-S188 VanDerWaalsContact O-N 3.16Å
189	A	92.3	Very high	83	Confident	10 Å²	10	52.7 Å²	52.7	8%	0.083	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	119.1	-179.8	0	0	0	0	0	110.3	L161 I175 A176 I177 F187 Y198	L161-A189 HydrophobicContact CD1-CB 4.41Å; L161-A189 HydrophobicContact CD2-CB 4.08Å; I175-A189 HydrophobicContact CB-CB 4.11Å; I175-A189 HydrophobicContact CD1-CB 3.83Å; I175-A189 HydrophobicContact CG1-CB 4.08Å; A176-A189 WeakPolarHBondContact O-CB 3.49Å; A176-A189 PolarHBondContact O-N 3.49Å; I177-A189 HydrophobicContact CG1-CB 4.37Å; F187-A189 PolarHBondContact O-N 3.49Å; A189-Y198 HydrophobicContact CB-CD1 3.93Å
190	L	94.1	Very high	84.3	Confident	38 Å²	38	49.4 Å²	49.4	20%	0.199	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.5	175.7	-59.8	179.6	0	0	0	109.9	Y198 F199 T201 H204	L190-Y198 CarbonylContact O-C 3.59Å; L190-Y198 WeakPolarHBondContact O-CA 3.42Å; L190-F199 PolarHBondContact N-O 3.09Å; L190-F199 PolarHBondContact O-N 3.46Å; L190-T201 HydrophobicContact CD1-CG2 4.25Å; L190-H204 HydrophobicContact CB-CB 4.11Å; L190-H204 HydrophobicContact CD1-CB 4.1Å; L190-H204 WeakPolarHBondContact CD1-O 3.35Å
191	L	95.3	Very high	85.4	Confident	47 Å²	47	47.3 Å²	47.3	25%	0.246	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	124	178.4	178	64.3	0	0	0	110.7	E158 Q193 Y198 H204	E158-L191 HydrophobicContact CB-CD1 4.47Å; E158-L191 HydrophobicContact CG-CD1 4Å; E158-L191 VanDerWaalsContact OE2-CD2 3.29Å; E158-L191 WeakPolarHBondContact OE2-CD2 3.49Å; L191-Q193 PolarHBondContact O-N 2.98Å; L191-Y198 HydrophobicContact CB-CD1 4.19Å; L191-Y198 HydrophobicContact CB-CE1 3.93Å; L191-Y198 HydrophobicContact CD1-CD2 4.21Å; L191-Y198 HydrophobicContact CD1-CE1 4.39Å; L191-Y198 HydrophobicContact CD1-CE2 3.92Å; L191-H204 PolarHBondContact O-NE2 2.98Å
192	C	96.6	Very high	86.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.229	C	C	.	.			trans	-80.5	114.2	166.8	178.9	0	0	0	0	109.6	Y194 S195 G196 L197 F199 S227 S230	C192-Y194 PolarHBondContact O-N 2.79Å; C192-S195 PolarHBondContact O-N 3.09Å; C192-G196 WeakPolarHBondContact O-CA 3.45Å; C192-G196 PolarHBondContact O-N 3.32Å; C192-L197 PolarHBondContact N-O 3.16Å; C192-F199 HydrophobicContact CB-CD2 3.78Å; C192-F199 HydrophobicContact CB-CE2 3.43Å; C192-F199 VanDerWaalsContact CB-CE2 3.43Å; C192-F199 HydrophobicContact CB-CZ 4.47Å; C192-S227 PolarHBondContact SG-N 3.31Å; C192-S230 PolarHBondContact SG-OG 3.22Å
193	Q	96.8	Very high	88.2	Confident	58 Å²	58	41.4 Å²	41.4	27%	0.271	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-15.9	-177.1	-64.5	-161.9	14.2	0	0	114.4	L191 I211 A225	L191-Q193 PolarHBondContact O-N 2.98Å; Q193-I211 HydrophobicContact CB-CD1 3.5Å; Q193-I211 WeakPolarHBondContact O-CD1 3.46Å; Q193-A225 WeakPolarHBondContact CB-O 3.32Å; Q193-A225 PolarHBondContact N-O 2.95Å
194	Y	97.3	Very high	89.8	Confident	18 Å²	18	32.7 Å²	32.7	7%	0.071	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-51.9	174.2	174.7	-114.5	0	0	0	112.4	Y151 E152 C192 I211 P212 F233 L234	Y151-Y194 WeakPolarHBondContact CA-OH 3.45Å; Y151-Y194 HydrophobicContact CD1-CE2 4.43Å; E152-Y194 HydrophobicContact CB-CD2 4.38Å; E152-Y194 HydrophobicContact CB-CE2 3.74Å; E152-Y194 PolarHBondContact N-OH 3.26Å; C192-Y194 PolarHBondContact O-N 2.79Å; Y194-I211 HydrophobicContact CD2-CG2 4.33Å; Y194-P212 HydrophobicContact CE2-CG 4.37Å; Y194-F233 HydrophobicContact CE1-CD1 4.04Å; Y194-F233 HydrophobicContact CE1-CE1 4.35Å; Y194-F233 VanDerWaalsContact OH-CE1 3.3Å; Y194-F233 WeakPolarHBondContact OH-CE1 3.39Å; Y194-L234 HydrophobicContact CD1-CD1 4.38Å; Y194-L234 HydrophobicContact CD1-CD2 4.43Å; Y194-L234 HydrophobicContact CD1-CG 4.37Å; Y194-L234 HydrophobicContact CD2-CD1 4.32Å; Y194-L234 HydrophobicContact CD2-CD2 3.96Å; Y194-L234 HydrophobicContact CE1-CD2 4.18Å; Y194-L234 HydrophobicContact CE1-CG 4.4Å; Y194-L234 HydrophobicContact CE2-CD2 3.71Å; Y194-L234 HydrophobicContact CG-CD1 4.07Å; Y194-L234 HydrophobicContact CG-CD2 4.32Å; Y194-L234 HydrophobicContact CG-CG 4.42Å
195	S	95.2	Very high	91.1	Very high	28 Å²	28	30.8 Å²	30.8	20%	0.196	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-9.1	-173.5	70.4	0	0	0	0	114.2	C192 L197	C192-S195 PolarHBondContact O-N 3.09Å; S195-L197 PolarHBondContact O-N 3.16Å
196	G	95.7	Very high	92.6	Very high	4 Å²	4	30.5 Å²	30.5	4%	0.041	16%	0.159	C	C	.	.			trans	68	11.9	-176.4	0	0	0	0	0	115	C192	C192-G196 WeakPolarHBondContact O-CA 3.45Å; C192-G196 PolarHBondContact O-N 3.32Å
197	L	95.8	Very high	93.8	Very high	70 Å²	70	30.7 Å²	30.7	37%	0.366	16%	0.158	S	C	.	.			trans	-104.9	156.2	-177.7	-61.5	173.9	0	0	0	111.1	A169 C192 S195 F199	A169-L197 HydrophobicContact CB-CB 4.04Å; A169-L197 HydrophobicContact CB-CD1 4.07Å; C192-L197 PolarHBondContact N-O 3.16Å; S195-L197 PolarHBondContact O-N 3.16Å; L197-F199 HydrophobicContact CB-CE2 3.77Å; L197-F199 HydrophobicContact CB-CZ 4.16Å; L197-F199 VanDerWaalsContact O-CD2 3.27Å; L197-F199 WeakPolarHBondContact O-CD2 3.47Å; L197-F199 VanDerWaalsContact O-CE2 3.27Å; L197-F199 WeakPolarHBondContact O-CE2 3.41Å
198	Y	95.5	Very high	94.7	Very high	23 Å²	23	34.5 Å²	34.5	9%	0.09	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	142.1	178.9	-68.2	-99.3	0	0	0	112.7	E158 L161 Q164 A169 I177 A189 L190 L191	E158-Y198 HydrophobicContact CG-CE2 4.05Å; E158-Y198 WeakPolarHBondContact OE1-CE2 3.4Å; E158-Y198 PolarHBondContact OE1-OH 3.31Å; L161-Y198 HydrophobicContact CB-CD2 4.09Å; L161-Y198 HydrophobicContact CB-CE2 4.19Å; L161-Y198 HydrophobicContact CB-CG 4.36Å; L161-Y198 HydrophobicContact CD1-CD2 4.28Å; L161-Y198 HydrophobicContact CD1-CG 3.97Å; Q164-Y198 VanDerWaalsContact NE2-CB 3.33Å; Q164-Y198 PolarHBondContact NE2-O 3.35Å; A169-Y198 PolarHBondContact N-O 3.04Å; A169-Y198 VanDerWaalsContact N-O 3.13Å; I177-Y198 HydrophobicContact CD1-CE1 4.48Å; I177-Y198 HydrophobicContact CG1-CE1 4.47Å; A189-Y198 HydrophobicContact CB-CD1 3.93Å; L190-Y198 CarbonylContact O-C 3.59Å; L190-Y198 WeakPolarHBondContact O-CA 3.42Å; L191-Y198 HydrophobicContact CB-CD1 4.19Å; L191-Y198 HydrophobicContact CB-CE1 3.93Å; L191-Y198 HydrophobicContact CD1-CD2 4.21Å; L191-Y198 HydrophobicContact CD1-CE1 4.39Å; L191-Y198 HydrophobicContact CD1-CE2 3.92Å
199	F	95.1	Very high	95.2	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	150.3	-174.6	-64	-97.2	0	0	0	110.7	A169 D170 L190 C192 L197 C203 H204 S227	A169-F199 HydrophobicContact CB-CD1 4.23Å; A169-F199 HydrophobicContact CB-CE1 3.78Å; A169-F199 HydrophobicContact CB-CE2 4.41Å; A169-F199 HydrophobicContact CB-CZ 3.87Å; D170-F199 HydrophobicContact CB-CD1 4.19Å; D170-F199 HydrophobicContact CB-CE1 4.2Å; L190-F199 PolarHBondContact N-O 3.09Å; L190-F199 PolarHBondContact O-N 3.46Å; C192-F199 HydrophobicContact CB-CD2 3.78Å; C192-F199 HydrophobicContact CB-CE2 3.43Å; C192-F199 VanDerWaalsContact CB-CE2 3.43Å; C192-F199 HydrophobicContact CB-CZ 4.47Å; L197-F199 HydrophobicContact CB-CE2 3.77Å; L197-F199 HydrophobicContact CB-CZ 4.16Å; L197-F199 VanDerWaalsContact O-CD2 3.27Å; L197-F199 WeakPolarHBondContact O-CD2 3.47Å; L197-F199 VanDerWaalsContact O-CE2 3.27Å; L197-F199 WeakPolarHBondContact O-CE2 3.41Å; F199-C203 HydrophobicContact CB-CB 4.3Å; F199-C203 HydrophobicContact CD1-CB 4.12Å; F199-H204 HydrophobicContact CB-CB 3.67Å; F199-H204 HydrophobicContact CG-CB 4.48Å; F199-S227 WeakPolarHBondContact CZ-OG 2.95Å
200	C	93.7	Very high	95.4	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	160.2	168.9	74.5	0	0	0	0	111.3	C168 C171 I175 I202 C203 H204	C168-C200 HydrophobicContact CB-CB 4.22Å; C168-C200 PolarHBondContact SG-N 3.36Å; C171-C200 VanDerWaalsContact SG-SG 3.63Å; I175-C200 HydrophobicContact CG2-CB 3.57Å; C200-I202 PolarHBondContact O-N 3.17Å; C200-C203 PolarHBondContact O-N 3.26Å; C200-C203 VanDerWaalsContact SG-SG 3.66Å; C200-H204 PolarHBondContact O-N 2.66Å
201	T	92.7	Very high	95.6	Very high	46 Å²	46	33 Å²	33	28%	0.282	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-19.7	176.7	62.4	0	0	0	0	115.1	C186 L190 H204	C186-T201 VanDerWaalsContact C-OG1 3.29Å; C186-T201 WeakPolarHBondContact CA-OG1 3.35Å; C186-T201 PolarHBondContact O-N 3.22Å; C186-T201 PolarHBondContact O-OG1 2.91Å; L190-T201 HydrophobicContact CD1-CG2 4.25Å; T201-H204 CarbonylContact C-O 3.48Å; T201-H204 VanDerWaalsContact O-O 3.09Å
202	I	91.8	Very high	95.7	Very high	16 Å²	16	30.7 Å²	30.7	8%	0.082	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-33.6	174.6	-64.9	165.3	0	0	0	111.3	C186 C200 W205	C186-I202 HydrophobicContact CB-CD1 4.47Å; C200-I202 PolarHBondContact O-N 3.17Å; I202-W205 PolarHBondContact O-NE1 3.4Å
203	C	94.5	Very high	95.7	Very high	6 Å²	6	30.8 Å²	30.8	4%	0.041	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-7.6	-179	-60	0	0	0	0	112.9	D170 F199 C200 R228	D170-C203 HydrophobicContact CB-CB 4.12Å; F199-C203 HydrophobicContact CB-CB 4.3Å; F199-C203 HydrophobicContact CD1-CB 4.12Å; C200-C203 PolarHBondContact O-N 3.26Å; C200-C203 VanDerWaalsContact SG-SG 3.66Å; C203-R228 WeakPolarHBondContact O-CB 3.47Å; C203-R228 WeakPolarHBondContact O-CG 3.32Å; C203-R228 PolarHBondContact O-N 3.2Å
204	H	95.2	Very high	95.7	Very high	3 Å²	3	30 Å²	30	1%	0.014	15%	0.149	C	C	.	.			trans	-139.7	113.2	-179.3	-172.2	-66.7	0	0	0	110.4	L190 L191 F199 C200 T201 N206 V226 S227	L190-H204 HydrophobicContact CB-CB 4.11Å; L190-H204 HydrophobicContact CD1-CB 4.1Å; L190-H204 WeakPolarHBondContact CD1-O 3.35Å; L191-H204 PolarHBondContact O-NE2 2.98Å; F199-H204 HydrophobicContact CB-CB 3.67Å; F199-H204 HydrophobicContact CG-CB 4.48Å; C200-H204 PolarHBondContact O-N 2.66Å; T201-H204 CarbonylContact C-O 3.48Å; T201-H204 VanDerWaalsContact O-O 3.09Å; H204-N206 PolarHBondContact CE1-OD1 3.41Å; H204-N206 VanDerWaalsContact CE1-OD1 3.25Å; H204-N206 PolarHBondContact ND1-N 3.06Å; H204-N206 PolarHBondContact ND1-OD1 2.82Å; H204-V226 VanDerWaalsContact CD2-C 3.44Å; H204-V226 PolarHBondContact NE2-O 2.91Å; H204-S227 WeakPolarHBondContact CD2-CA 3.42Å; H204-S227 PolarHBondContact CD2-N 3Å; H204-S227 VanDerWaalsContact CD2-N 3.26Å; H204-S227 PolarHBondContact NE2-N 2.76Å
205	W	94.1	Very high	95.7	Very high	85 Å²	85	29.2 Å²	29.2	32%	0.322	15%	0.146	S	C	.	.			trans	-105.8	20.8	-174.5	-59.1	-7.6	0	0	0	112.9	F103 E105 I202 D207 R228	F103-W205 HydrophobicContact CB-CH2 3.71Å; F103-W205 HydrophobicContact CB-CZ2 4.05Å; F103-W205 HydrophobicContact CB-CZ3 4.5Å; E105-W205 HydrophobicContact CG-CH2 4.04Å; E105-W205 HydrophobicContact CG-CZ2 4.1Å; I202-W205 PolarHBondContact O-NE1 3.4Å; W205-D207 PolarHBondContact O-N 3.29Å; W205-R228 HydrophobicContact CD2-CG 4.23Å; W205-R228 HydrophobicContact CG-CG 4.24Å
206	N	94.8	Very high	95.7	Very high	96 Å²	96	28.5 Å²	28.5	51%	0.513	14%	0.14	S	C	.	.			trans	55.2	31.9	-171	-64.7	-29.4	0	0	0	112.7	H204 Q208	H204-N206 PolarHBondContact CE1-OD1 3.41Å; H204-N206 VanDerWaalsContact CE1-OD1 3.25Å; H204-N206 PolarHBondContact ND1-N 3.06Å; H204-N206 PolarHBondContact ND1-OD1 2.82Å; N206-Q208 PolarHBondContact O-N 3.45Å
207	D	96.6	Very high	95.6	Very high	24 Å²	24	32.5 Å²	32.5	13%	0.128	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	135.9	172.4	-74.3	-68.6	0	0	0	109.6	W205 A225 V226 R228 K231	W205-D207 PolarHBondContact O-N 3.29Å; D207-A225 CarbonylContact O-C 3.52Å; D207-A225 WeakPolarHBondContact O-CA 3.21Å; D207-V226 HydrophobicContact CB-CG2 4.45Å; D207-V226 WeakPolarHBondContact O-CG2 3.47Å; D207-V226 PolarHBondContact O-N 2.91Å; D207-R228 IonicContact OD1-NH1 2.84Å; D207-R228 PolarHBondContact OD1-NH1 3.22Å; D207-R228 WeakPolarHBondContact OD2-CD 3.22Å; D207-R228 IonicContact OD2-CZ 3.14Å; D207-R228 IonicContact OD2-NE 2.76Å; D207-R228 IonicContact OD2-NH1 3.96Å; D207-R228 PolarHBondContact OD2-NH1 3.47Å; D207-K231 HydrophobicContact CB-CB 4.5Å; D207-K231 HydrophobicContact CB-CD 3.71Å; D207-K231 HydrophobicContact CB-CG 4.39Å; D207-K231 IonicContact OD1-NZ 2.73Å; D207-K231 PolarHBondContact OD1-NZ 2.96Å; D207-K231 IonicContact OD2-NZ 3.85Å
208	Q	97.8	Very high	95.5	Very high	125 Å²	125	33.9 Å²	33.9	58%	0.584	17%	0.165	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	130.3	-176.2	-61.4	-171.7	-44	0	0	111.2	N206 K223 Y224	N206-Q208 PolarHBondContact O-N 3.45Å; Q208-K223 HydrophobicContact CB-CB 3.83Å; Q208-Y224 VanDerWaalsContact CA-O 3.31Å; Q208-Y224 WeakPolarHBondContact CA-O 3.42Å
209	M	97.9	Very high	95.5	Very high	21 Å²	21	35.3 Å²	35.3	10%	0.103	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	152.1	177.3	-66	-65.7	-64.1	0	0	110.3	K223 Y224 V226 K231 L234 R235	M209-K223 WeakPolarHBondContact O-CA 3.36Å; M209-Y224 PolarHBondContact N-O 2.97Å; M209-Y224 PolarHBondContact O-N 3.16Å; M209-V226 HydrophobicContact CB-CG1 4.38Å; M209-V226 HydrophobicContact CB-CG2 3.89Å; M209-V226 HydrophobicContact CG-CG2 3.55Å; M209-K231 HydrophobicContact CG-CB 4.43Å; M209-K231 HydrophobicContact CG-CG 4.07Å; M209-K231 HydrophobicContact SD-CG 4.03Å; M209-L234 HydrophobicContact CB-CD1 3.82Å; M209-L234 HydrophobicContact CE-CB 3.95Å; M209-L234 HydrophobicContact CG-CD1 4.23Å; M209-R235 HydrophobicContact CE-CG 3.75Å; M209-R235 HydrophobicContact SD-CG 4.3Å
210	V	97.9	Very high	95.6	Very high	15 Å²	15	36.1 Å²	36.1	9%	0.091	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136	166.9	179.1	0	0	0	0	108.6	V215 F221 K223 L306 I310	V210-V215 HydrophobicContact CG1-CG2 3.36Å; V210-F221 HydrophobicContact CG1-CD1 4.45Å; V210-F221 WeakPolarHBondContact CG2-O 3.35Å; V210-K223 HydrophobicContact CG2-CG 4.07Å; V210-L306 HydrophobicContact CG1-CD1 4.31Å; V210-I310 HydrophobicContact CB-CD1 4.41Å; V210-I310 HydrophobicContact CG2-CD1 4.21Å
211	I	97.8	Very high	95.7	Very high	2 Å²	2	38 Å²	38	1%	0.01	18%	0.183	C	C	.	.			trans	-98.7	118.2	-177.2	-66.4	177.4	0	0	0	109.9	Q193 Y194 A213 R214 V215 Y224	Q193-I211 HydrophobicContact CB-CD1 3.5Å; Q193-I211 WeakPolarHBondContact O-CD1 3.46Å; Y194-I211 HydrophobicContact CD2-CG2 4.33Å; I211-A213 HydrophobicContact CG2-CB 4.4Å; I211-A213 PolarHBondContact O-N 2.95Å; I211-R214 HydrophobicContact CB-CB 4.28Å; I211-R214 HydrophobicContact CB-CG 4.12Å; I211-R214 HydrophobicContact CG2-CB 4.39Å; I211-R214 HydrophobicContact CG2-CG 3.97Å; I211-R214 PolarHBondContact O-N 3.42Å; I211-R214 VanDerWaalsContact O-N 3.1Å; I211-V215 PolarHBondContact O-N 3.02Å; I211-V215 VanDerWaalsContact O-N 3.14Å; I211-Y224 VanDerWaalsContact CD1-CB 3.43Å; I211-Y224 HydrophobicContact CD1-CD2 3.87Å; I211-Y224 HydrophobicContact CD1-CG 3.88Å; I211-Y224 HydrophobicContact CG1-CD2 4.15Å
212	P	97.3	Very high	96	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-51.4	-48.9	-179.2	-31.5	36.3	0	0	0	115.2	Y151 Y194 R214 V215 L216 L234 F243 L306	Y151-P212 HydrophobicContact CD1-CB 4.08Å; Y151-P212 HydrophobicContact CD1-CG 3.47Å; Y151-P212 VanDerWaalsContact CD1-CG 3.47Å; Y151-P212 HydrophobicContact CE1-CB 4.46Å; Y151-P212 HydrophobicContact CE1-CG 3.58Å; Y151-P212 HydrophobicContact CG-CB 4.08Å; Y151-P212 HydrophobicContact CG-CG 4Å; Y194-P212 HydrophobicContact CE2-CG 4.37Å; P212-R214 VanDerWaalsContact C-N 3.25Å; P212-R214 PolarHBondContact O-N 3.49Å; P212-V215 PolarHBondContact O-N 3.14Å; P212-V215 VanDerWaalsContact O-N 3.14Å; P212-L216 VanDerWaalsContact O-CG 3.28Å; P212-L216 WeakPolarHBondContact O-CG 3.42Å; P212-L216 PolarHBondContact O-N 3.15Å; P212-L234 HydrophobicContact CG-CD2 3.82Å; P212-F243 HydrophobicContact CB-CE1 4.49Å; P212-F243 HydrophobicContact CB-CZ 3.93Å; P212-L306 HydrophobicContact CG-CD1 4.38Å; P212-L306 HydrophobicContact CG-CD2 4.09Å
213	A	97	Very high	96.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-57.6	-39.2	179.9	0	0	0	0	0	112.2	E154 I155 I211 L216 H217	E154-A213 WeakPolarHBondContact O-CB 3.21Å; I155-A213 HydrophobicContact CG1-CB 4.13Å; I211-A213 HydrophobicContact CG2-CB 4.4Å; I211-A213 PolarHBondContact O-N 2.95Å; A213-L216 PolarHBondContact O-N 3.43Å; A213-H217 WeakPolarHBondContact O-CB 3.46Å; A213-H217 PolarHBondContact O-CD2 3.27Å; A213-H217 PolarHBondContact O-N 2.98Å
214	R	96.9	Very high	96.4	Very high	43 Å²	43	48.3 Å²	48.3	16%	0.162	23%	0.226	C	C	.	.	H	α-helix	trans	-68.8	-39	177.9	-66.4	-177.4	179	-88.4	-4.1	112.1	I155 I211 P212 N218 W219 D220	I155-R214 HydrophobicContact CG1-CG 4.44Å; I155-R214 HydrophobicContact CG2-CG 3.93Å; I211-R214 HydrophobicContact CB-CB 4.28Å; I211-R214 HydrophobicContact CB-CG 4.12Å; I211-R214 HydrophobicContact CG2-CB 4.39Å; I211-R214 HydrophobicContact CG2-CG 3.97Å; I211-R214 PolarHBondContact O-N 3.42Å; I211-R214 VanDerWaalsContact O-N 3.1Å; P212-R214 VanDerWaalsContact C-N 3.25Å; P212-R214 PolarHBondContact O-N 3.49Å; R214-N218 CarbonylContact O-C 3.53Å; R214-N218 WeakPolarHBondContact O-CA 3.46Å; R214-N218 WeakPolarHBondContact O-CB 3.1Å; R214-N218 PolarHBondContact O-N 3.01Å; R214-W219 PolarHBondContact O-N 3.48Å; R214-D220 HydrophobicContact CB-CB 4.12Å; R214-D220 PolarHBondContact O-N 3.14Å
215	V	96.5	Very high	96.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-47	173.4	175.9	0	0	0	0	110.9	V210 I211 P212 W219 D220 F221 L306 L309	V210-V215 HydrophobicContact CG1-CG2 3.36Å; I211-V215 PolarHBondContact O-N 3.02Å; I211-V215 VanDerWaalsContact O-N 3.14Å; P212-V215 PolarHBondContact O-N 3.14Å; P212-V215 VanDerWaalsContact O-N 3.14Å; V215-W219 WeakPolarHBondContact O-CA 3.42Å; V215-W219 PolarHBondContact O-N 3.38Å; V215-D220 VanDerWaalsContact CG2-O 3.22Å; V215-D220 WeakPolarHBondContact CG2-O 3.49Å; V215-F221 HydrophobicContact CG1-CD1 4.33Å; V215-F221 HydrophobicContact CG1-CE1 3.61Å; V215-F221 HydrophobicContact CG1-CE2 4.41Å; V215-F221 HydrophobicContact CG1-CZ 3.66Å; V215-F221 HydrophobicContact CG2-CD1 3.94Å; V215-F221 HydrophobicContact CG2-CE1 4.04Å; V215-F221 HydrophobicContact CG2-CG 4.44Å; V215-L306 HydrophobicContact CG2-CD1 4.14Å; V215-L309 HydrophobicContact CG1-CB 4.17Å; V215-L309 HydrophobicContact CG1-CD1 3.67Å
216	L	95.4	Very high	96.7	Very high	14 Å²	14	45.2 Å²	45.2	7%	0.073	22%	0.219	C	C	.	.	H	α-helix	trans	-71.1	-35.7	-174.2	-66.7	172.5	0	0	0	113.4	P212 A213 F243 L245 L248 N249 L252 L309	P212-L216 VanDerWaalsContact O-CG 3.28Å; P212-L216 WeakPolarHBondContact O-CG 3.42Å; P212-L216 PolarHBondContact O-N 3.15Å; A213-L216 PolarHBondContact O-N 3.43Å; L216-F243 HydrophobicContact CD1-CD1 3.79Å; L216-F243 HydrophobicContact CD1-CE1 3.68Å; L216-F243 HydrophobicContact CD1-CZ 4.36Å; L216-F243 HydrophobicContact CD2-CB 4.33Å; L216-F243 HydrophobicContact CD2-CD1 4.1Å; L216-F243 HydrophobicContact CD2-CD2 4.42Å; L216-F243 HydrophobicContact CD2-CG 4.04Å; L216-F243 HydrophobicContact CG-CD1 4.49Å; L216-F243 HydrophobicContact CG-CE1 4.49Å; L216-L245 HydrophobicContact CD2-CD2 3.49Å; L216-L245 VanDerWaalsContact CD2-CD2 3.49Å; L216-L248 HydrophobicContact CD1-CD1 4.24Å; L216-L248 HydrophobicContact CD2-CD1 4.22Å; L216-N249 WeakPolarHBondContact O-CB 3.1Å; L216-N249 PolarHBondContact O-ND2 3.38Å; L216-L252 WeakPolarHBondContact O-CD1 3.25Å; L216-L309 HydrophobicContact CD2-CD1 4.26Å
217	H	94.4	Very high	96.7	Very high	88 Å²	88	40.6 Å²	40.6	41%	0.407	20%	0.195	S	C	.	.	H	α-helix	trans	-93.5	-39	-177.1	-66.7	-58.4	0	0	0	112.6	S153 I155 A213	S153-H217 PolarHBondContact O-NE2 2.89Å; I155-H217 HydrophobicContact CD1-CB 3.55Å; I155-H217 HydrophobicContact CG1-CB 4.3Å; A213-H217 WeakPolarHBondContact O-CB 3.46Å; A213-H217 PolarHBondContact O-CD2 3.27Å; A213-H217 PolarHBondContact O-N 2.98Å
218	N	93.6	Very high	96.7	Very high	98 Å²	98	40.9 Å²	40.9	52%	0.524	19%	0.194	S	C	.	.	H	α-helix	trans	-120	4.4	-169.7	-62.4	-9.2	0	0	0	113.8	I155 R214 D220	I155-N218 WeakPolarHBondContact CD1-ND2 3.46Å; R214-N218 CarbonylContact O-C 3.53Å; R214-N218 WeakPolarHBondContact O-CA 3.46Å; R214-N218 WeakPolarHBondContact O-CB 3.1Å; R214-N218 PolarHBondContact O-N 3.01Å; N218-D220 HydrophobicContact CB-CB 4.14Å; N218-D220 PolarHBondContact O-N 2.93Å; N218-D220 VanDerWaalsContact O-N 3.13Å
219	W	94.9	Very high	96.5	Very high	53 Å²	53	39.3 Å²	39.3	20%	0.201	18%	0.182	C	C	.	.			trans	51.8	33.3	-173.7	-154.4	-115	0	0	0	113	R214 V215 F221 L252 L259 L309	R214-W219 PolarHBondContact O-N 3.48Å; V215-W219 WeakPolarHBondContact O-CA 3.42Å; V215-W219 PolarHBondContact O-N 3.38Å; W219-F221 AromaticContact CD1-CE2 3.83Å; W219-F221 AromaticContact CD2-CE2 3.69Å; W219-F221 HydrophobicContact CD2-CE2 3.69Å; W219-F221 HydrophobicContact CD2-CZ 4.04Å; W219-F221 AromaticContact CE2-CE2 3.62Å; W219-F221 AromaticContact CE2-CZ 3.91Å; W219-F221 HydrophobicContact CE3-CE2 4.27Å; W219-F221 HydrophobicContact CE3-CZ 4.21Å; W219-F221 AromaticContact CG-CE2 3.86Å; W219-F221 HydrophobicContact CG-CE2 3.86Å; W219-F221 HydrophobicContact CH2-CZ 4.19Å; W219-F221 HydrophobicContact CZ2-CE2 4.16Å; W219-F221 AromaticContact CZ2-CZ 4Å; W219-F221 HydrophobicContact CZ2-CZ 4Å; W219-F221 HydrophobicContact CZ3-CZ 4.29Å; W219-F221 AromaticContact NE1-CE2 3.7Å; W219-F221 VanDerWaalsContact O-CD2 3.27Å; W219-F221 WeakPolarHBondContact O-CD2 3.31Å; W219-F221 WeakPolarHBondContact O-CE2 3.5Å; W219-L252 HydrophobicContact CB-CD2 4.07Å; W219-L252 HydrophobicContact CD2-CD2 4.32Å; W219-L252 HydrophobicContact CE3-CD1 3.85Å; W219-L252 HydrophobicContact CE3-CD2 3.8Å; W219-L252 HydrophobicContact CE3-CG 4.31Å; W219-L252 HydrophobicContact CG-CD2 4.48Å; W219-L252 HydrophobicContact CZ3-CD1 3.98Å; W219-L259 HydrophobicContact CH2-CB 4.29Å; W219-L259 HydrophobicContact CH2-CD1 4.26Å; W219-L259 HydrophobicContact CH2-CD2 4Å; W219-L259 HydrophobicContact CH2-CG 4.4Å; W219-L259 HydrophobicContact CZ2-CB 4.39Å; W219-L259 HydrophobicContact CZ3-CD2 4.23Å; W219-L309 HydrophobicContact CH2-CD2 4.31Å; W219-L309 HydrophobicContact CZ3-CD2 4.43Å
220	D	95.9	Very high	96.4	Very high	22 Å²	22	38.7 Å²	38.7	12%	0.118	18%	0.181	C	C	.	.			trans	-98.3	111.4	-173.1	170	23.6	0	0	0	111.2	R214 V215 N218 N222 Y224	R214-D220 HydrophobicContact CB-CB 4.12Å; R214-D220 PolarHBondContact O-N 3.14Å; V215-D220 VanDerWaalsContact CG2-O 3.22Å; V215-D220 WeakPolarHBondContact CG2-O 3.49Å; N218-D220 HydrophobicContact CB-CB 4.14Å; N218-D220 PolarHBondContact O-N 2.93Å; N218-D220 VanDerWaalsContact O-N 3.13Å; D220-N222 VanDerWaalsContact OD1-CB 3.26Å; D220-N222 WeakPolarHBondContact OD1-CB 3.44Å; D220-N222 PolarHBondContact OD1-N 3.14Å; D220-N222 PolarHBondContact OD1-ND2 2.97Å; D220-Y224 WeakPolarHBondContact OD2-CE2 3.25Å; D220-Y224 PolarHBondContact OD2-OH 3.22Å
221	F	97.1	Very high	96.3	Very high	39 Å²	39	39.9 Å²	39.9	17%	0.171	18%	0.184	C	C	.	.			trans	-100.4	10.4	-178.5	-63.8	-90.8	0	0	0	113.4	V210 V215 W219 L309 I310 V313	V210-F221 HydrophobicContact CG1-CD1 4.45Å; V210-F221 WeakPolarHBondContact CG2-O 3.35Å; V215-F221 HydrophobicContact CG1-CD1 4.33Å; V215-F221 HydrophobicContact CG1-CE1 3.61Å; V215-F221 HydrophobicContact CG1-CE2 4.41Å; V215-F221 HydrophobicContact CG1-CZ 3.66Å; V215-F221 HydrophobicContact CG2-CD1 3.94Å; V215-F221 HydrophobicContact CG2-CE1 4.04Å; V215-F221 HydrophobicContact CG2-CG 4.44Å; W219-F221 AromaticContact CD1-CE2 3.83Å; W219-F221 AromaticContact CD2-CE2 3.69Å; W219-F221 HydrophobicContact CD2-CE2 3.69Å; W219-F221 HydrophobicContact CD2-CZ 4.04Å; W219-F221 AromaticContact CE2-CE2 3.62Å; W219-F221 AromaticContact CE2-CZ 3.91Å; W219-F221 HydrophobicContact CE3-CE2 4.27Å; W219-F221 HydrophobicContact CE3-CZ 4.21Å; W219-F221 AromaticContact CG-CE2 3.86Å; W219-F221 HydrophobicContact CG-CE2 3.86Å; W219-F221 HydrophobicContact CH2-CZ 4.19Å; W219-F221 HydrophobicContact CZ2-CE2 4.16Å; W219-F221 AromaticContact CZ2-CZ 4Å; W219-F221 HydrophobicContact CZ2-CZ 4Å; W219-F221 HydrophobicContact CZ3-CZ 4.29Å; W219-F221 AromaticContact NE1-CE2 3.7Å; W219-F221 VanDerWaalsContact O-CD2 3.27Å; W219-F221 WeakPolarHBondContact O-CD2 3.31Å; W219-F221 WeakPolarHBondContact O-CE2 3.5Å; F221-L309 HydrophobicContact CE1-CB 3.92Å; F221-L309 WeakPolarHBondContact CE1-O 3.31Å; F221-L309 HydrophobicContact CZ-CB 4.2Å; F221-I310 HydrophobicContact CD1-CG1 4Å; F221-I310 HydrophobicContact CE1-CG1 4.27Å; F221-V313 HydrophobicContact CD1-CG1 3.86Å; F221-V313 HydrophobicContact CD2-CB 4.21Å; F221-V313 HydrophobicContact CD2-CG1 3.93Å; F221-V313 HydrophobicContact CD2-CG2 4.12Å; F221-V313 HydrophobicContact CE1-CG1 3.92Å; F221-V313 HydrophobicContact CE2-CB 3.94Å; F221-V313 HydrophobicContact CE2-CG1 4Å; F221-V313 HydrophobicContact CE2-CG2 4.12Å; F221-V313 HydrophobicContact CG-CG1 3.85Å; F221-V313 HydrophobicContact CZ-CB 4.09Å; F221-V313 HydrophobicContact CZ-CG1 3.99Å
222	N	97.7	Very high	96.2	Very high	102 Å²	102	40.3 Å²	40.3	55%	0.545	19%	0.186	S	C	.	.			trans	-61.5	150	174.5	-68.3	-59.1	0	0	0	110.6	D220 Y224	D220-N222 VanDerWaalsContact OD1-CB 3.26Å; D220-N222 WeakPolarHBondContact OD1-CB 3.44Å; D220-N222 PolarHBondContact OD1-N 3.14Å; D220-N222 PolarHBondContact OD1-ND2 2.97Å; N222-Y224 HydrophobicContact CB-CD2 4.47Å; N222-Y224 HydrophobicContact CB-CE2 3.66Å; N222-Y224 WeakPolarHBondContact O-CD2 3.48Å; N222-Y224 WeakPolarHBondContact O-CE2 3.37Å
223	K	97.8	Very high	96.1	Very high	135 Å²	135	41.3 Å²	41.3	59%	0.587	19%	0.191	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	136	176.8	-58.2	-179.9	-178.6	168.7	0	109.8	Q208 M209 V210	Q208-K223 HydrophobicContact CB-CB 3.83Å; M209-K223 WeakPolarHBondContact O-CA 3.36Å; V210-K223 HydrophobicContact CG2-CG 4.07Å
224	Y	97.6	Very high	96.1	Very high	49 Å²	49	41.3 Å²	41.3	19%	0.192	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151.4	-173.5	-68.9	-72.3	0	0	0	111.1	Q208 M209 I211 D220 N222 V226	Q208-Y224 VanDerWaalsContact CA-O 3.31Å; Q208-Y224 WeakPolarHBondContact CA-O 3.42Å; M209-Y224 PolarHBondContact N-O 2.97Å; M209-Y224 PolarHBondContact O-N 3.16Å; I211-Y224 VanDerWaalsContact CD1-CB 3.43Å; I211-Y224 HydrophobicContact CD1-CD2 3.87Å; I211-Y224 HydrophobicContact CD1-CG 3.88Å; I211-Y224 HydrophobicContact CG1-CD2 4.15Å; D220-Y224 WeakPolarHBondContact OD2-CE2 3.25Å; D220-Y224 PolarHBondContact OD2-OH 3.22Å; N222-Y224 HydrophobicContact CB-CD2 4.47Å; N222-Y224 HydrophobicContact CB-CE2 3.66Å; N222-Y224 WeakPolarHBondContact O-CD2 3.48Å; N222-Y224 WeakPolarHBondContact O-CE2 3.37Å; Y224-V226 PolarHBondContact O-N 2.78Å
225	A	97.7	Very high	96.1	Very high	22 Å²	22	47.1 Å²	47.1	18%	0.182	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	127.9	-177	0	0	0	0	0	111.2	Q193 D207	Q193-A225 WeakPolarHBondContact CB-O 3.32Å; Q193-A225 PolarHBondContact N-O 2.95Å; D207-A225 CarbonylContact O-C 3.52Å; D207-A225 WeakPolarHBondContact O-CA 3.21Å
226	V	97.7	Very high	96.1	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.9	-179.5	-62.8	0	0	0	0	111.9	H204 D207 M209 Y224 K231 L234	H204-V226 VanDerWaalsContact CD2-C 3.44Å; H204-V226 PolarHBondContact NE2-O 2.91Å; D207-V226 HydrophobicContact CB-CG2 4.45Å; D207-V226 WeakPolarHBondContact O-CG2 3.47Å; D207-V226 PolarHBondContact O-N 2.91Å; M209-V226 HydrophobicContact CB-CG1 4.38Å; M209-V226 HydrophobicContact CB-CG2 3.89Å; M209-V226 HydrophobicContact CG-CG2 3.55Å; Y224-V226 PolarHBondContact O-N 2.78Å; V226-K231 HydrophobicContact CG2-CB 4.04Å; V226-L234 HydrophobicContact CG1-CD1 4.35Å
227	S	96	Very high	96.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.224	C	C	.	.			trans	-65.7	161.5	173.5	72.2	0	0	0	0	111.3	C192 F199 H204 R229 S230 K231	C192-S227 PolarHBondContact SG-N 3.31Å; F199-S227 WeakPolarHBondContact CZ-OG 2.95Å; H204-S227 WeakPolarHBondContact CD2-CA 3.42Å; H204-S227 PolarHBondContact CD2-N 3Å; H204-S227 VanDerWaalsContact CD2-N 3.26Å; H204-S227 PolarHBondContact NE2-N 2.76Å; S227-R229 VanDerWaalsContact C-N 3.26Å; S227-R229 PolarHBondContact O-N 3.05Å; S227-S230 PolarHBondContact O-N 3.34Å; S227-S230 WeakPolarHBondContact OG-CB 3.45Å; S227-S230 PolarHBondContact OG-N 2.82Å; S227-S230 PolarHBondContact OG-OG 2.97Å; S227-S230 VanDerWaalsContact OG-OG 3.05Å; S227-K231 WeakPolarHBondContact O-CB 3.32Å; S227-K231 PolarHBondContact O-N 3.45Å
228	R	95	Very high	96.2	Very high	29 Å²	29	47 Å²	47	11%	0.109	21%	0.214	C	C	.	.	H	α-helix	trans	-58.5	-39.7	176	-69.4	-57.9	-61.9	-172.3	-10.1	112.5	E105 C203 W205 D207 K231 Q232	E105-R228 IonicContact OE1-CZ 3.35Å; E105-R228 IonicContact OE1-NE 3.6Å; E105-R228 IonicContact OE1-NH2 3.58Å; E105-R228 PolarHBondContact OE1-NH2 3.21Å; E105-R228 WeakPolarHBondContact OE2-CB 3.24Å; E105-R228 IonicContact OE2-NE 2.8Å; E105-R228 PolarHBondContact OE2-NE 3.4Å; E105-R228 IonicContact OE2-NH2 3.47Å; C203-R228 WeakPolarHBondContact O-CB 3.47Å; C203-R228 WeakPolarHBondContact O-CG 3.32Å; C203-R228 PolarHBondContact O-N 3.2Å; W205-R228 HydrophobicContact CD2-CG 4.23Å; W205-R228 HydrophobicContact CG-CG 4.24Å; D207-R228 IonicContact OD1-NH1 2.84Å; D207-R228 PolarHBondContact OD1-NH1 3.22Å; D207-R228 WeakPolarHBondContact OD2-CD 3.22Å; D207-R228 IonicContact OD2-CZ 3.14Å; D207-R228 IonicContact OD2-NE 2.76Å; D207-R228 IonicContact OD2-NH1 3.96Å; D207-R228 PolarHBondContact OD2-NH1 3.47Å; R228-K231 PolarHBondContact O-N 2.9Å; R228-Q232 WeakPolarHBondContact O-CG 3.49Å; R228-Q232 PolarHBondContact O-N 3.26Å
229	R	94.1	Very high	96.2	Very high	92 Å²	92	50.2 Å²	50.2	35%	0.347	22%	0.223	S	C	.	.	H	α-helix	trans	-59.1	-53.2	174.9	-167.3	172.6	175.6	176	-4.1	111.3	R138 T139 D170 S227 K231 Q232 F233	R138-R229 HydrophobicContact CG-CG 4.47Å; T139-R229 PolarHBondContact OG1-NH2 2.85Å; D170-R229 VanDerWaalsContact OD1-CD 3.25Å; D170-R229 WeakPolarHBondContact OD1-CD 3.28Å; D170-R229 IonicContact OD1-NH1 3.98Å; S227-R229 VanDerWaalsContact C-N 3.26Å; S227-R229 PolarHBondContact O-N 3.05Å; R229-K231 VanDerWaalsContact C-N 3.34Å; R229-K231 PolarHBondContact O-N 3.43Å; R229-Q232 PolarHBondContact O-N 2.63Å; R229-F233 PolarHBondContact O-N 3.43Å
230	S	95.6	Very high	96.2	Very high	9 Å²	9	52.3 Å²	52.3	6%	0.063	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-41.4	-179.1	-64	0	0	0	0	111.3	C192 S227 Q232 F233 L234	C192-S230 PolarHBondContact SG-OG 3.22Å; S227-S230 PolarHBondContact O-N 3.34Å; S227-S230 WeakPolarHBondContact OG-CB 3.45Å; S227-S230 PolarHBondContact OG-N 2.82Å; S227-S230 PolarHBondContact OG-OG 2.97Å; S227-S230 VanDerWaalsContact OG-OG 3.05Å; S230-Q232 PolarHBondContact O-N 3.14Å; S230-F233 PolarHBondContact O-N 2.96Å; S230-L234 VanDerWaalsContact O-CB 3.28Å; S230-L234 WeakPolarHBondContact O-CB 3.5Å; S230-L234 WeakPolarHBondContact O-CG 3.19Å; S230-L234 PolarHBondContact O-N 2.92Å
231	K	96.8	Very high	96.1	Very high	39 Å²	39	53.7 Å²	53.7	17%	0.17	24%	0.241	C	C	.	.	H	α-helix	trans	-56.2	-50.1	173.3	-174.3	-170.5	-165.5	170.7	0	111.9	D207 M209 V226 S227 R228 R229 L234 R235	D207-K231 HydrophobicContact CB-CB 4.5Å; D207-K231 HydrophobicContact CB-CD 3.71Å; D207-K231 HydrophobicContact CB-CG 4.39Å; D207-K231 IonicContact OD1-NZ 2.73Å; D207-K231 PolarHBondContact OD1-NZ 2.96Å; D207-K231 IonicContact OD2-NZ 3.85Å; M209-K231 HydrophobicContact CG-CB 4.43Å; M209-K231 HydrophobicContact CG-CG 4.07Å; M209-K231 HydrophobicContact SD-CG 4.03Å; V226-K231 HydrophobicContact CG2-CB 4.04Å; S227-K231 WeakPolarHBondContact O-CB 3.32Å; S227-K231 PolarHBondContact O-N 3.45Å; R228-K231 PolarHBondContact O-N 2.9Å; R229-K231 VanDerWaalsContact C-N 3.34Å; R229-K231 PolarHBondContact O-N 3.43Å; K231-L234 PolarHBondContact O-N 2.92Å; K231-R235 HydrophobicContact CG-CG 4.48Å; K231-R235 WeakPolarHBondContact O-CB 3.22Å; K231-R235 VanDerWaalsContact O-CG 3.23Å; K231-R235 WeakPolarHBondContact O-CG 3.17Å; K231-R235 PolarHBondContact O-N 2.97Å
232	Q	95.3	Very high	96	Very high	11 Å²	11	54.7 Å²	54.7	5%	0.051	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-44.9	-179.6	-73.2	174.8	-17.5	0	0	111.3	E105 R138 A141 R228 R229 S230 R235 L236	E105-Q232 PolarHBondContact OE1-NE2 3.49Å; R138-Q232 VanDerWaalsContact NH2-NE2 3.16Å; A141-Q232 HydrophobicContact CB-CB 3.57Å; R228-Q232 WeakPolarHBondContact O-CG 3.49Å; R228-Q232 PolarHBondContact O-N 3.26Å; R229-Q232 PolarHBondContact O-N 2.63Å; S230-Q232 PolarHBondContact O-N 3.14Å; Q232-R235 PolarHBondContact O-N 3.31Å; Q232-L236 VanDerWaalsContact O-CG 3.32Å; Q232-L236 WeakPolarHBondContact O-CG 3.4Å; Q232-L236 PolarHBondContact O-N 2.98Å; Q232-L236 VanDerWaalsContact O-N 3.15Å
233	F	95.8	Very high	95.8	Very high	22 Å²	22	50.2 Å²	50.2	10%	0.096	23%	0.226	C	C	.	.	H	α-helix	trans	-58.7	-53.1	175.9	178.9	-88.4	0	0	0	111.8	A144 V145 V150 Y151 Y194 R229 S230 R235 L236 M237	A144-F233 HydrophobicContact CB-CD2 4.29Å; V145-F233 HydrophobicContact CG2-CD2 3.37Å; V145-F233 HydrophobicContact CG2-CE2 3.53Å; V145-F233 HydrophobicContact CG2-CG 4.1Å; V145-F233 HydrophobicContact CG2-CZ 4.35Å; V150-F233 WeakPolarHBondContact O-CZ 3.25Å; Y151-F233 HydrophobicContact CD1-CE1 4.05Å; Y151-F233 HydrophobicContact CE1-CE1 4.42Å; Y194-F233 HydrophobicContact CE1-CD1 4.04Å; Y194-F233 HydrophobicContact CE1-CE1 4.35Å; Y194-F233 VanDerWaalsContact OH-CE1 3.3Å; Y194-F233 WeakPolarHBondContact OH-CE1 3.39Å; R229-F233 PolarHBondContact O-N 3.43Å; S230-F233 PolarHBondContact O-N 2.96Å; F233-R235 VanDerWaalsContact C-N 3.35Å; F233-R235 PolarHBondContact O-N 3.07Å; F233-L236 PolarHBondContact O-N 3.41Å; F233-L236 VanDerWaalsContact O-N 3.17Å; F233-M237 HydrophobicContact CD1-CG 4.29Å; F233-M237 HydrophobicContact CE1-CG 3.81Å; F233-M237 HydrophobicContact CE2-CG 4.27Å; F233-M237 HydrophobicContact CZ-CG 3.8Å; F233-M237 PolarHBondContact O-N 3.46Å
234	L	97.3	Very high	95.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-45.1	-179.6	-71.8	173.7	0	0	0	111.3	Y151 Y194 M209 P212 V226 S230 K231 L236 M237 Q238	Y151-L234 HydrophobicContact CD1-CD2 4Å; Y151-L234 HydrophobicContact CE1-CD2 3.78Å; Y194-L234 HydrophobicContact CD1-CD1 4.38Å; Y194-L234 HydrophobicContact CD1-CD2 4.43Å; Y194-L234 HydrophobicContact CD1-CG 4.37Å; Y194-L234 HydrophobicContact CD2-CD1 4.32Å; Y194-L234 HydrophobicContact CD2-CD2 3.96Å; Y194-L234 HydrophobicContact CE1-CD2 4.18Å; Y194-L234 HydrophobicContact CE1-CG 4.4Å; Y194-L234 HydrophobicContact CE2-CD2 3.71Å; Y194-L234 HydrophobicContact CG-CD1 4.07Å; Y194-L234 HydrophobicContact CG-CD2 4.32Å; Y194-L234 HydrophobicContact CG-CG 4.42Å; M209-L234 HydrophobicContact CB-CD1 3.82Å; M209-L234 HydrophobicContact CE-CB 3.95Å; M209-L234 HydrophobicContact CG-CD1 4.23Å; P212-L234 HydrophobicContact CG-CD2 3.82Å; V226-L234 HydrophobicContact CG1-CD1 4.35Å; S230-L234 VanDerWaalsContact O-CB 3.28Å; S230-L234 WeakPolarHBondContact O-CB 3.5Å; S230-L234 WeakPolarHBondContact O-CG 3.19Å; S230-L234 PolarHBondContact O-N 2.92Å; K231-L234 PolarHBondContact O-N 2.92Å; L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 3.4Å; L234-M237 PolarHBondContact O-N 3.03Å; L234-Q238 WeakPolarHBondContact O-CA 3.44Å; L234-Q238 VanDerWaalsContact O-CB 3.26Å; L234-Q238 WeakPolarHBondContact O-CB 3.07Å; L234-Q238 PolarHBondContact O-N 3.08Å
235	R	96.8	Very high	95.4	Very high	165 Å²	165	48.9 Å²	48.9	62%	0.623	22%	0.217	S	C	*	.	H	α-helix	trans	-60.8	-38.9	178.1	-73.2	178.2	96.3	-175.3	9.3	112.9	M209 K231 Q232 F233	M209-R235 HydrophobicContact CE-CG 3.75Å; M209-R235 HydrophobicContact SD-CG 4.3Å; K231-R235 HydrophobicContact CG-CG 4.48Å; K231-R235 WeakPolarHBondContact O-CB 3.22Å; K231-R235 VanDerWaalsContact O-CG 3.23Å; K231-R235 WeakPolarHBondContact O-CG 3.17Å; K231-R235 PolarHBondContact O-N 2.97Å; Q232-R235 PolarHBondContact O-N 3.31Å; F233-R235 VanDerWaalsContact C-N 3.35Å; F233-R235 PolarHBondContact O-N 3.07Å
236	L	95	Very high	95.1	Very high	62 Å²	62	49.5 Å²	49.5	33%	0.325	22%	0.216	S	C	.	.	H	α-helix	trans	-72.9	-33.3	178.5	-71	171.5	0	0	0	112.2	C124 A141 V145 Q232 F233 L234	C124-L236 HydrophobicContact CB-CD1 4.15Å; A141-L236 HydrophobicContact CB-CD1 4.15Å; V145-L236 HydrophobicContact CG1-CB 4.4Å; V145-L236 HydrophobicContact CG2-CB 3.98Å; V145-L236 HydrophobicContact CG2-CD1 4.43Å; Q232-L236 VanDerWaalsContact O-CG 3.32Å; Q232-L236 WeakPolarHBondContact O-CG 3.4Å; Q232-L236 PolarHBondContact O-N 2.98Å; Q232-L236 VanDerWaalsContact O-N 3.15Å; F233-L236 PolarHBondContact O-N 3.41Å; F233-L236 VanDerWaalsContact O-N 3.17Å; L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 3.4Å
237	M	95.6	Very high	94.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-82.7	-23.7	177.8	-77	-69.6	-66.3	0	0	113.8	V145 P149 Y151 F233 L234 K239 R240 V242	V145-M237 HydrophobicContact CG1-CG 4.09Å; V145-M237 HydrophobicContact CG1-SD 3.72Å; V145-M237 HydrophobicContact CG2-CG 3.71Å; V145-M237 HydrophobicContact CG2-SD 4.3Å; P149-M237 HydrophobicContact CB-CE 4.07Å; P149-M237 HydrophobicContact CB-SD 3.83Å; P149-M237 VanDerWaalsContact O-CE 3.23Å; P149-M237 WeakPolarHBondContact O-CE 3.44Å; Y151-M237 HydrophobicContact CD2-CE 4Å; Y151-M237 HydrophobicContact CE1-CB 3.56Å; Y151-M237 HydrophobicContact CE1-CG 4.31Å; Y151-M237 HydrophobicContact CE2-CB 4.27Å; Y151-M237 HydrophobicContact CE2-CE 3.73Å; Y151-M237 VanDerWaalsContact CZ-CB 3.44Å; Y151-M237 VanDerWaalsContact OH-CB 3.24Å; Y151-M237 WeakPolarHBondContact OH-CB 3.49Å; Y151-M237 PolarHBondContact OH-O 3.25Å; F233-M237 HydrophobicContact CD1-CG 4.29Å; F233-M237 HydrophobicContact CE1-CG 3.81Å; F233-M237 HydrophobicContact CE2-CG 4.27Å; F233-M237 HydrophobicContact CZ-CG 3.8Å; F233-M237 PolarHBondContact O-N 3.46Å; L234-M237 PolarHBondContact O-N 3.03Å; M237-K239 VanDerWaalsContact C-N 3.25Å; M237-K239 PolarHBondContact O-N 3.37Å; M237-R240 WeakPolarHBondContact O-CB 3.28Å; M237-R240 PolarHBondContact O-N 2.98Å; M237-V242 HydrophobicContact CE-CG1 4.28Å; M237-V242 HydrophobicContact CE-CG2 4.11Å
238	Q	96.7	Very high	94.6	Very high	39 Å²	39	58 Å²	58	18%	0.182	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-36.9	-166.6	-179.7	166.7	-15.2	0	0	114.6	Y151 L234 S305 L306 Q307	Y151-Q238 PolarHBondContact OH-N 2.98Å; L234-Q238 WeakPolarHBondContact O-CA 3.44Å; L234-Q238 VanDerWaalsContact O-CB 3.26Å; L234-Q238 WeakPolarHBondContact O-CB 3.07Å; L234-Q238 PolarHBondContact O-N 3.08Å; Q238-S305 WeakPolarHBondContact O-CB 3.5Å; Q238-L306 HydrophobicContact CG-CB 4.35Å; Q238-L306 HydrophobicContact CG-CD2 4.36Å; Q238-L306 PolarHBondContact O-N 3.07Å; Q238-L306 VanDerWaalsContact O-N 3.15Å; Q238-Q307 HydrophobicContact CG-CB 4.14Å; Q238-Q307 PolarHBondContact O-N 3.38Å
239	K	94.9	Very high	94.5	Very high	165 Å²	165	58 Å²	58	72%	0.717	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.1	-178.5	-64.8	-175.7	177.9	-177	0	114.4	M237 Q307	M237-K239 VanDerWaalsContact C-N 3.25Å; M237-K239 PolarHBondContact O-N 3.37Å; K239-Q307 HydrophobicContact CG-CB 4.39Å
240	R	94.2	Very high	94.4	Very high	96 Å²	96	62.2 Å²	62.2	36%	0.362	29%	0.286	S	S	.	.	S	Bend	trans	-85.4	123	-179.1	-62.3	-178.9	69.6	170.2	-0.1	109.8	V145 M237 V242 S305	V145-R240 PolarHBondContact O-NH1 3.15Å; M237-R240 WeakPolarHBondContact O-CB 3.28Å; M237-R240 PolarHBondContact O-N 2.98Å; R240-V242 HydrophobicContact CB-CG1 4.01Å; R240-V242 PolarHBondContact O-N 3.39Å; R240-S305 VanDerWaalsContact C-CB 3.48Å; R240-S305 WeakPolarHBondContact O-CA 3.39Å; R240-S305 VanDerWaalsContact O-CB 3.27Å; R240-S305 WeakPolarHBondContact O-CB 3.31Å
241	P	94.5	Very high	94.2	Very high	52 Å²	52	64.2 Å²	64.2	34%	0.338	30%	0.3	S	S	.	.			trans	-79.4	85	-178.9	31.8	-34.6	0	0	0	111.3	H296 A303 Y304	P241-H296 VanDerWaalsContact CB-CD2 3.42Å; P241-H296 WeakPolarHBondContact CB-CD2 3.44Å; P241-H296 HydrophobicContact CG-CB 4.27Å; P241-A303 HydrophobicContact CB-CB 4.25Å; P241-Y304 CarbonylContact C-O 3.57Å; P241-Y304 WeakPolarHBondContact CA-O 3.42Å
242	V	93.2	Very high	94.1	Very high	59 Å²	59	63 Å²	63	36%	0.358	30%	0.295	S	S	.	.			trans	-110.8	-13.6	-174.1	-61.3	0	0	0	0	113.7	Y151 M237 R240 Y304	Y151-V242 HydrophobicContact CD2-CG2 3.83Å; Y151-V242 HydrophobicContact CE2-CG2 3.52Å; M237-V242 HydrophobicContact CE-CG1 4.28Å; M237-V242 HydrophobicContact CE-CG2 4.11Å; R240-V242 HydrophobicContact CB-CG1 4.01Å; R240-V242 PolarHBondContact O-N 3.39Å; V242-Y304 PolarHBondContact N-O 2.89Å; V242-Y304 VanDerWaalsContact N-O 3.11Å
243	F	94.7	Very high	93.9	Very high	8 Å²	8	63.1 Å²	63.1	4%	0.035	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	119.9	-178.3	-55.6	-54	0	0	0	111.1	Y151 P212 L216 L245 L248 A303 Y304 L306 L309	Y151-F243 HydrophobicContact CD2-CD1 4.41Å; Y151-F243 AromaticContact CD2-CE1 3.26Å; Y151-F243 HydrophobicContact CD2-CE1 3.26Å; Y151-F243 HydrophobicContact CD2-CE2 4.38Å; Y151-F243 AromaticContact CD2-CZ 3.24Å; Y151-F243 HydrophobicContact CD2-CZ 3.24Å; Y151-F243 AromaticContact CE2-CE1 3.61Å; Y151-F243 HydrophobicContact CE2-CE1 3.61Å; Y151-F243 AromaticContact CE2-CE2 3.9Å; Y151-F243 HydrophobicContact CE2-CE2 3.9Å; Y151-F243 AromaticContact CE2-CZ 3.13Å; Y151-F243 HydrophobicContact CE2-CZ 3.13Å; Y151-F243 HydrophobicContact CG-CE1 4.14Å; Y151-F243 HydrophobicContact CG-CZ 4.09Å; Y151-F243 AromaticContact CZ-CZ 3.91Å; P212-F243 HydrophobicContact CB-CE1 4.49Å; P212-F243 HydrophobicContact CB-CZ 3.93Å; L216-F243 HydrophobicContact CD1-CD1 3.79Å; L216-F243 HydrophobicContact CD1-CE1 3.68Å; L216-F243 HydrophobicContact CD1-CZ 4.36Å; L216-F243 HydrophobicContact CD2-CB 4.33Å; L216-F243 HydrophobicContact CD2-CD1 4.1Å; L216-F243 HydrophobicContact CD2-CD2 4.42Å; L216-F243 HydrophobicContact CD2-CG 4.04Å; L216-F243 HydrophobicContact CG-CD1 4.49Å; L216-F243 HydrophobicContact CG-CE1 4.49Å; F243-L245 HydrophobicContact CB-CD2 4.41Å; F243-L245 PolarHBondContact O-N 3.01Å; F243-L248 HydrophobicContact CB-CD1 4.03Å; F243-L248 HydrophobicContact CD1-CD1 4.11Å; F243-A303 CarbonylContact O-C 3.48Å; F243-A303 VanDerWaalsContact O-CA 3.31Å; F243-A303 WeakPolarHBondContact O-CA 3.24Å; F243-Y304 WeakPolarHBondContact CB-O 3.42Å; F243-Y304 WeakPolarHBondContact CD2-O 3.41Å; F243-Y304 PolarHBondContact N-O 2.94Å; F243-Y304 PolarHBondContact O-N 2.86Å; F243-L306 HydrophobicContact CE2-CB 4.01Å; F243-L309 HydrophobicContact CD2-CD1 4.16Å
244	R	94.1	Very high	93.7	Very high	157 Å²	157	67 Å²	67	59%	0.592	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	85	165.9	-68.9	-173.5	-172.4	150.8	1.4	109.2	E246 S247 L248 D302	R244-E246 VanDerWaalsContact C-N 3.34Å; R244-E246 PolarHBondContact O-N 3.24Å; R244-S247 VanDerWaalsContact CB-OG 3.23Å; R244-S247 WeakPolarHBondContact CB-OG 3.47Å; R244-S247 PolarHBondContact O-N 3.17Å; R244-S247 PolarHBondContact O-OG 3.32Å; R244-L248 WeakPolarHBondContact O-CG 3.44Å; R244-L248 PolarHBondContact O-N 2.72Å; R244-D302 WeakPolarHBondContact CA-O 3.41Å; R244-D302 WeakPolarHBondContact CB-OD2 3.28Å; R244-D302 WeakPolarHBondContact CG-OD2 3.49Å
245	L	92.5	Very high	93.4	Very high	0 Å²	0	74.4 Å²	74.4	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-58.2	-42.1	-166.8	-78.6	-176.5	0	0	0	113.4	L216 F243 S247 L248 N249 L252 F253 L259 Y304 L309	L216-L245 HydrophobicContact CD2-CD2 3.49Å; L216-L245 VanDerWaalsContact CD2-CD2 3.49Å; F243-L245 HydrophobicContact CB-CD2 4.41Å; F243-L245 PolarHBondContact O-N 3.01Å; L245-S247 PolarHBondContact O-N 3.13Å; L245-L248 PolarHBondContact O-N 3.48Å; L245-L248 VanDerWaalsContact O-N 3.15Å; L245-N249 CarbonylContact O-C 3.27Å; L245-N249 PolarHBondContact O-N 2.87Å; L245-L252 HydrophobicContact CD2-CD1 4.3Å; L245-F253 HydrophobicContact CB-CE2 3.82Å; L245-F253 HydrophobicContact CB-CZ 3.87Å; L245-F253 HydrophobicContact CD1-CZ 4.24Å; L245-L259 HydrophobicContact CD1-CD1 3.86Å; L245-L259 HydrophobicContact CD1-CD2 4.16Å; L245-Y304 HydrophobicContact CB-CD2 4.18Å; L245-Y304 HydrophobicContact CB-CE2 4.3Å; L245-Y304 HydrophobicContact CD1-CD1 4.4Å; L245-Y304 HydrophobicContact CD1-CD2 3.62Å; L245-Y304 HydrophobicContact CD1-CE2 3.85Å; L245-Y304 HydrophobicContact CD1-CG 3.92Å; L245-Y304 HydrophobicContact CG-CD2 3.72Å; L245-Y304 HydrophobicContact CG-CE2 4.22Å; L245-Y304 HydrophobicContact CG-CG 4.27Å; L245-L309 HydrophobicContact CD1-CD2 3.54Å; L245-L309 HydrophobicContact CD2-CD1 4.22Å; L245-L309 HydrophobicContact CD2-CD2 4.46Å; L245-L309 HydrophobicContact CG-CD2 4.38Å
246	E	91.3	Very high	93.3	Very high	34 Å²	34	66.8 Å²	66.8	16%	0.159	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-28.8	179.5	-76.9	79.7	173.7	0	0	113.3	R244 F253 K263 D302	R244-E246 VanDerWaalsContact C-N 3.34Å; R244-E246 PolarHBondContact O-N 3.24Å; E246-F253 HydrophobicContact CB-CE2 4.41Å; E246-F253 HydrophobicContact CG-CD2 4.24Å; E246-F253 HydrophobicContact CG-CE2 3.63Å; E246-F253 HydrophobicContact CG-CZ 4.07Å; E246-F253 WeakPolarHBondContact OE1-CE2 3.4Å; E246-F253 WeakPolarHBondContact OE1-CZ 3.43Å; E246-K263 VanDerWaalsContact OE1-CE 3.27Å; E246-K263 WeakPolarHBondContact OE1-CE 3.35Å; E246-K263 IonicContact OE1-NZ 2.74Å; E246-K263 PolarHBondContact OE1-NZ 2.87Å; E246-D302 WeakPolarHBondContact OE2-CB 3.46Å
247	S	92.2	Very high	93.2	Very high	88 Å²	88	69.6 Å²	69.6	62%	0.615	34%	0.335	S	S	*	.	H	α-helix	trans	-86.2	-30.8	177	72.1	0	0	0	0	112.9	R244 L245	R244-S247 VanDerWaalsContact CB-OG 3.23Å; R244-S247 WeakPolarHBondContact CB-OG 3.47Å; R244-S247 PolarHBondContact O-N 3.17Å; R244-S247 PolarHBondContact O-OG 3.32Å; L245-S247 PolarHBondContact O-N 3.13Å
248	L	91.9	Very high	93.1	Very high	91 Å²	91	73.2 Å²	73.2	48%	0.476	35%	0.352	S	S	.	.	H	α-helix	trans	-82	-48.1	-177.8	-69.6	169.1	0	0	0	111.7	L216 F243 R244 L245	L216-L248 HydrophobicContact CD1-CD1 4.24Å; L216-L248 HydrophobicContact CD2-CD1 4.22Å; F243-L248 HydrophobicContact CB-CD1 4.03Å; F243-L248 HydrophobicContact CD1-CD1 4.11Å; R244-L248 WeakPolarHBondContact O-CG 3.44Å; R244-L248 PolarHBondContact O-N 2.72Å; L245-L248 PolarHBondContact O-N 3.48Å; L245-L248 VanDerWaalsContact O-N 3.15Å
249	N	92.1	Very high	93	Very high	28 Å²	28	71.4 Å²	71.4	15%	0.15	34%	0.343	C	S	.	.			trans	-156.5	89.8	-178.9	-170.1	-3.4	0	0	0	110.9	L216 L245 S251 L252	L216-N249 WeakPolarHBondContact O-CB 3.1Å; L216-N249 PolarHBondContact O-ND2 3.38Å; L245-N249 CarbonylContact O-C 3.27Å; L245-N249 PolarHBondContact O-N 2.87Å; N249-S251 VanDerWaalsContact C-N 3.27Å; N249-S251 PolarHBondContact O-N 3.07Å; N249-S251 PolarHBondContact OD1-N 3.3Å; N249-S251 PolarHBondContact OD1-OG 3.02Å; N249-L252 HydrophobicContact CB-CD1 4.03Å; N249-L252 HydrophobicContact CB-CG 4.02Å; N249-L252 PolarHBondContact O-N 3.11Å
250	R	92	Very high	93	Very high	181 Å²	181	67 Å²	67	68%	0.683	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-33.5	-179.9	-179.8	177.6	-68	-120.5	0.9	112.9	L252 F253	R250-L252 PolarHBondContact O-N 2.73Å; R250-F253 PolarHBondContact O-N 2.73Å; R250-F253 VanDerWaalsContact O-N 3.12Å
251	S	92.5	Very high	93	Very high	52 Å²	52	64.6 Å²	64.6	36%	0.364	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.5	-173.6	70	0	0	0	0	112.9	N249 F253 D254 H255	N249-S251 VanDerWaalsContact C-N 3.27Å; N249-S251 PolarHBondContact O-N 3.07Å; N249-S251 PolarHBondContact OD1-N 3.3Å; N249-S251 PolarHBondContact OD1-OG 3.02Å; S251-F253 PolarHBondContact O-N 3.49Å; S251-D254 WeakPolarHBondContact O-CB 3.49Å; S251-D254 PolarHBondContact O-N 2.73Å; S251-H255 PolarHBondContact O-N 3.25Å; S251-H255 PolarHBondContact O-ND1 3.39Å
252	L	92.8	Very high	93.1	Very high	12 Å²	12	62.1 Å²	62.1	6%	0.063	31%	0.308	C	S	.	.	H	α-helix	trans	-56	-37.3	171.5	-68.8	179.3	0	0	0	112	L216 W219 L245 N249 R250 D254 H255 S256 L259	L216-L252 WeakPolarHBondContact O-CD1 3.25Å; W219-L252 HydrophobicContact CB-CD2 4.07Å; W219-L252 HydrophobicContact CD2-CD2 4.32Å; W219-L252 HydrophobicContact CE3-CD1 3.85Å; W219-L252 HydrophobicContact CE3-CD2 3.8Å; W219-L252 HydrophobicContact CE3-CG 4.31Å; W219-L252 HydrophobicContact CG-CD2 4.48Å; W219-L252 HydrophobicContact CZ3-CD1 3.98Å; L245-L252 HydrophobicContact CD2-CD1 4.3Å; N249-L252 HydrophobicContact CB-CD1 4.03Å; N249-L252 HydrophobicContact CB-CG 4.02Å; N249-L252 PolarHBondContact O-N 3.11Å; R250-L252 PolarHBondContact O-N 2.73Å; L252-D254 PolarHBondContact O-N 2.9Å; L252-H255 PolarHBondContact O-N 3.49Å; L252-S256 PolarHBondContact O-N 2.78Å; L252-L259 HydrophobicContact CB-CD2 4Å
253	F	91.7	Very high	93.1	Very high	14 Å²	14	62.7 Å²	62.7	6%	0.061	31%	0.306	C	S	.	.	H	α-helix	trans	-70.5	-14.1	177.4	-68.3	-81.7	0	0	0	113	L245 E246 R250 S251 L259 K260 K263	L245-F253 HydrophobicContact CB-CE2 3.82Å; L245-F253 HydrophobicContact CB-CZ 3.87Å; L245-F253 HydrophobicContact CD1-CZ 4.24Å; E246-F253 HydrophobicContact CB-CE2 4.41Å; E246-F253 HydrophobicContact CG-CD2 4.24Å; E246-F253 HydrophobicContact CG-CE2 3.63Å; E246-F253 HydrophobicContact CG-CZ 4.07Å; E246-F253 WeakPolarHBondContact OE1-CE2 3.4Å; E246-F253 WeakPolarHBondContact OE1-CZ 3.43Å; R250-F253 PolarHBondContact O-N 2.73Å; R250-F253 VanDerWaalsContact O-N 3.12Å; S251-F253 PolarHBondContact O-N 3.49Å; F253-L259 HydrophobicContact CD1-CD2 3.69Å; F253-L259 HydrophobicContact CD1-CG 3.65Å; F253-L259 HydrophobicContact CD2-CD2 4.34Å; F253-L259 HydrophobicContact CE1-CD1 3.91Å; F253-L259 HydrophobicContact CE1-CD2 3.61Å; F253-L259 HydrophobicContact CE1-CG 3.45Å; F253-L259 VanDerWaalsContact CE1-CG 3.45Å; F253-L259 HydrophobicContact CE2-CD2 4.27Å; F253-L259 HydrophobicContact CG-CD2 4.06Å; F253-L259 HydrophobicContact CG-CG 4.49Å; F253-L259 HydrophobicContact CZ-CD1 4.38Å; F253-L259 HydrophobicContact CZ-CD2 3.93Å; F253-L259 HydrophobicContact CZ-CG 4.16Å; F253-K260 WeakPolarHBondContact O-CD 3.44Å; F253-K260 WeakPolarHBondContact O-CE 3.2Å; F253-K260 WeakPolarHBondContact O-CG 3.11Å; F253-K263 HydrophobicContact CD1-CD 3.68Å; F253-K263 HydrophobicContact CE1-CB 4.25Å; F253-K263 HydrophobicContact CE1-CD 3.58Å; F253-K263 HydrophobicContact CE1-CG 4.44Å; F253-K263 HydrophobicContact CZ-CD 4.43Å
254	D	92.1	Very high	93.1	Very high	104 Å²	104	67.2 Å²	67.2	56%	0.556	33%	0.326	S	S	*	.	H	α-helix	trans	-86.8	-30	175.2	-59.3	-41.2	0	0	0	110.9	S251 L252 K260	S251-D254 WeakPolarHBondContact O-CB 3.49Å; S251-D254 PolarHBondContact O-N 2.73Å; L252-D254 PolarHBondContact O-N 2.9Å; D254-K260 WeakPolarHBondContact O-CE 3.36Å; D254-K260 PolarHBondContact O-NZ 3.15Å
255	H	91.4	Very high	93.2	Very high	155 Å²	155	60.8 Å²	60.8	72%	0.718	30%	0.303	S	S	*	.	H	α-helix	trans	-103.4	-17.2	-171.7	-60	91	0	0	0	115.5	S251 L252	S251-H255 PolarHBondContact O-N 3.25Å; S251-H255 PolarHBondContact O-ND1 3.39Å; L252-H255 PolarHBondContact O-N 3.49Å
256	S	93	Very high	93.3	Very high	6 Å²	6	61.1 Å²	61.1	4%	0.042	30%	0.304	C	S	.	.			trans	-111	114	175.4	171.8	0	0	0	0	111.8	L252 E258 L259 K260	L252-S256 PolarHBondContact O-N 2.78Å; S256-E258 VanDerWaalsContact C-N 3.35Å; S256-E258 PolarHBondContact OG-OE2 2.85Å; S256-L259 PolarHBondContact O-N 3.48Å; S256-L259 WeakPolarHBondContact OG-CB 3.44Å; S256-L259 PolarHBondContact OG-N 2.9Å; S256-L259 VanDerWaalsContact OG-N 3.13Å; S256-K260 WeakPolarHBondContact O-CG 3.42Å; S256-K260 PolarHBondContact O-N 3.35Å; S256-K260 VanDerWaalsContact O-N 3.15Å
257	E	93.6	Very high	93.4	Very high	120 Å²	120	62.9 Å²	62.9	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-69.2	-33.8	175	-66.7	-55.4	133	0	0	112	L259 K260 A261	E257-L259 VanDerWaalsContact C-N 3.34Å; E257-L259 PolarHBondContact O-N 3.26Å; E257-K260 PolarHBondContact O-N 2.88Å; E257-K260 IonicContact OE1-NZ 2.95Å; E257-K260 PolarHBondContact OE1-NZ 3.34Å; E257-A261 WeakPolarHBondContact O-CB 3.48Å; E257-A261 PolarHBondContact O-N 3.49Å
258	E	94.2	Very high	93.6	Very high	77 Å²	77	60.5 Å²	60.5	36%	0.36	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-44.3	176.5	-54.7	77.4	-170.4	0	0	110.6	S256 A261 V262 I312	S256-E258 VanDerWaalsContact C-N 3.35Å; S256-E258 PolarHBondContact OG-OE2 2.85Å; E258-A261 PolarHBondContact O-N 3.13Å; E258-V262 VanDerWaalsContact O-CG2 3.32Å; E258-V262 WeakPolarHBondContact O-CG2 3.44Å; E258-V262 PolarHBondContact O-N 3.49Å; E258-I312 HydrophobicContact CB-CG2 3.83Å
259	L	94.6	Very high	93.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.1	-41	178.1	-174.4	62.6	0	0	0	111.5	W219 L245 L252 F253 S256 E257 V262 K263 Y304 I312	W219-L259 HydrophobicContact CH2-CB 4.29Å; W219-L259 HydrophobicContact CH2-CD1 4.26Å; W219-L259 HydrophobicContact CH2-CD2 4Å; W219-L259 HydrophobicContact CH2-CG 4.4Å; W219-L259 HydrophobicContact CZ2-CB 4.39Å; W219-L259 HydrophobicContact CZ3-CD2 4.23Å; L245-L259 HydrophobicContact CD1-CD1 3.86Å; L245-L259 HydrophobicContact CD1-CD2 4.16Å; L252-L259 HydrophobicContact CB-CD2 4Å; F253-L259 HydrophobicContact CD1-CD2 3.69Å; F253-L259 HydrophobicContact CD1-CG 3.65Å; F253-L259 HydrophobicContact CD2-CD2 4.34Å; F253-L259 HydrophobicContact CE1-CD1 3.91Å; F253-L259 HydrophobicContact CE1-CD2 3.61Å; F253-L259 HydrophobicContact CE1-CG 3.45Å; F253-L259 VanDerWaalsContact CE1-CG 3.45Å; F253-L259 HydrophobicContact CE2-CD2 4.27Å; F253-L259 HydrophobicContact CG-CD2 4.06Å; F253-L259 HydrophobicContact CG-CG 4.49Å; F253-L259 HydrophobicContact CZ-CD1 4.38Å; F253-L259 HydrophobicContact CZ-CD2 3.93Å; F253-L259 HydrophobicContact CZ-CG 4.16Å; S256-L259 PolarHBondContact O-N 3.48Å; S256-L259 WeakPolarHBondContact OG-CB 3.44Å; S256-L259 PolarHBondContact OG-N 2.9Å; S256-L259 VanDerWaalsContact OG-N 3.13Å; E257-L259 VanDerWaalsContact C-N 3.34Å; E257-L259 PolarHBondContact O-N 3.26Å; L259-V262 PolarHBondContact O-N 3.27Å; L259-K263 WeakPolarHBondContact O-CB 3.35Å; L259-K263 PolarHBondContact O-N 3.01Å; L259-Y304 HydrophobicContact CD1-CE1 4.37Å; L259-I312 HydrophobicContact CD1-CD1 4.15Å
260	K	94	Very high	93.9	Very high	74 Å²	74	58.3 Å²	58.3	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-58.7	-46.8	172.3	-72	175.5	-168	166.2	0	111.4	F253 D254 S256 E257 V262 K263 K264	F253-K260 WeakPolarHBondContact O-CD 3.44Å; F253-K260 WeakPolarHBondContact O-CE 3.2Å; F253-K260 WeakPolarHBondContact O-CG 3.11Å; D254-K260 WeakPolarHBondContact O-CE 3.36Å; D254-K260 PolarHBondContact O-NZ 3.15Å; S256-K260 WeakPolarHBondContact O-CG 3.42Å; S256-K260 PolarHBondContact O-N 3.35Å; S256-K260 VanDerWaalsContact O-N 3.15Å; E257-K260 PolarHBondContact O-N 2.88Å; E257-K260 IonicContact OE1-NZ 2.95Å; E257-K260 PolarHBondContact OE1-NZ 3.34Å; K260-V262 PolarHBondContact O-N 3.29Å; K260-K263 PolarHBondContact O-N 3.02Å; K260-K264 PolarHBondContact O-N 3.33Å
261	A	94.7	Very high	94	Very high	44 Å²	44	52 Å²	52	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-60.9	-46.3	179.7	0	0	0	0	0	111.4	E257 E258 K263 K264 M265	E257-A261 WeakPolarHBondContact O-CB 3.48Å; E257-A261 PolarHBondContact O-N 3.49Å; E258-A261 PolarHBondContact O-N 3.13Å; A261-K263 PolarHBondContact O-N 3.42Å; A261-K264 WeakPolarHBondContact O-CB 3.49Å; A261-K264 PolarHBondContact O-N 3.28Å; A261-M265 HydrophobicContact CB-CE 4.43Å; A261-M265 WeakPolarHBondContact O-CG 3.27Å; A261-M265 PolarHBondContact O-N 3.09Å
262	V	95.8	Very high	94.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-40.9	177.7	169.8	0	0	0	0	111.2	E258 L259 K260 K264 M265 R266 F297 Y304 I312 S318 L321	E258-V262 VanDerWaalsContact O-CG2 3.32Å; E258-V262 WeakPolarHBondContact O-CG2 3.44Å; E258-V262 PolarHBondContact O-N 3.49Å; L259-V262 PolarHBondContact O-N 3.27Å; K260-V262 PolarHBondContact O-N 3.29Å; V262-K264 PolarHBondContact O-N 2.94Å; V262-M265 HydrophobicContact CG2-CE 3.95Å; V262-M265 PolarHBondContact O-N 3.05Å; V262-R266 HydrophobicContact CG1-CG 4.34Å; V262-R266 WeakPolarHBondContact O-CG 3.43Å; V262-R266 PolarHBondContact O-N 3.26Å; V262-F297 HydrophobicContact CG1-CE2 3.94Å; V262-Y304 HydrophobicContact CG1-CE1 4.48Å; V262-I312 HydrophobicContact CB-CD1 4.36Å; V262-I312 HydrophobicContact CB-CG1 4.38Å; V262-I312 HydrophobicContact CG1-CD1 3.91Å; V262-I312 HydrophobicContact CG1-CG1 4.17Å; V262-I312 HydrophobicContact CG2-CD1 4.46Å; V262-I312 HydrophobicContact CG2-CG1 3.95Å; V262-I312 HydrophobicContact CG2-CG2 4.23Å; V262-S318 WeakPolarHBondContact CG2-OG 3.4Å; V262-L321 HydrophobicContact CG1-CD1 3.88Å; V262-L321 HydrophobicContact CG2-CD1 4.34Å
263	K	94.6	Very high	94.2	Very high	71 Å²	71	51.1 Å²	51.1	31%	0.309	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-44.6	174	-178.2	171.7	-177.4	159.3	0	112.1	E246 F253 L259 K260 A261 R266 C267	E246-K263 VanDerWaalsContact OE1-CE 3.27Å; E246-K263 WeakPolarHBondContact OE1-CE 3.35Å; E246-K263 IonicContact OE1-NZ 2.74Å; E246-K263 PolarHBondContact OE1-NZ 2.87Å; F253-K263 HydrophobicContact CD1-CD 3.68Å; F253-K263 HydrophobicContact CE1-CB 4.25Å; F253-K263 HydrophobicContact CE1-CD 3.58Å; F253-K263 HydrophobicContact CE1-CG 4.44Å; F253-K263 HydrophobicContact CZ-CD 4.43Å; L259-K263 WeakPolarHBondContact O-CB 3.35Å; L259-K263 PolarHBondContact O-N 3.01Å; K260-K263 PolarHBondContact O-N 3.02Å; A261-K263 PolarHBondContact O-N 3.42Å; K263-R266 PolarHBondContact O-N 3.23Å; K263-C267 PolarHBondContact O-N 2.98Å; K263-C267 PolarHBondContact O-SG 3.24Å; K263-C267 VanDerWaalsContact O-SG 3.4Å
264	K	94.3	Very high	94.2	Very high	104 Å²	104	54.2 Å²	54.2	45%	0.452	28%	0.276	S	S	.	.	H	α-helix	trans	-58.6	-48.7	174.2	-176.8	-177.3	175.4	-173.7	0	111	K260 A261 V262 R266 C267 Q268 D360	K260-K264 PolarHBondContact O-N 3.33Å; A261-K264 WeakPolarHBondContact O-CB 3.49Å; A261-K264 PolarHBondContact O-N 3.28Å; V262-K264 PolarHBondContact O-N 2.94Å; K264-R266 VanDerWaalsContact C-N 3.35Å; K264-R266 PolarHBondContact O-N 2.84Å; K264-C267 WeakPolarHBondContact O-CB 3.37Å; K264-C267 PolarHBondContact O-N 3.02Å; K264-Q268 PolarHBondContact O-N 3.46Å; K264-Q268 VanDerWaalsContact O-N 3.09Å; K264-D360 WeakPolarHBondContact CE-OD1 3Å; K264-D360 IonicContact NZ-OD1 3.58Å; K264-D360 PolarHBondContact NZ-OD1 3.46Å; K264-D360 IonicContact NZ-OD2 3.54Å; K264-D360 PolarHBondContact NZ-OD2 3.34Å
265	M	95.5	Very high	94.4	Very high	22 Å²	22	50.1 Å²	50.1	11%	0.108	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-40.6	178.5	-71.8	-172.3	-78.8	0	0	112.3	A261 V262 C267 Q268 L269 L321 K322 L325	A261-M265 HydrophobicContact CB-CE 4.43Å; A261-M265 WeakPolarHBondContact O-CG 3.27Å; A261-M265 PolarHBondContact O-N 3.09Å; V262-M265 HydrophobicContact CG2-CE 3.95Å; V262-M265 PolarHBondContact O-N 3.05Å; M265-C267 PolarHBondContact O-N 3.14Å; M265-Q268 PolarHBondContact O-N 2.98Å; M265-L269 WeakPolarHBondContact O-CG 3.18Å; M265-L269 PolarHBondContact O-N 2.91Å; M265-L321 HydrophobicContact CB-CB 4.36Å; M265-L321 HydrophobicContact CB-CD1 4.42Å; M265-L321 HydrophobicContact CE-CB 4.32Å; M265-L321 HydrophobicContact CE-CD1 4.41Å; M265-L321 HydrophobicContact SD-CB 3.82Å; M265-K322 HydrophobicContact SD-CB 4.17Å; M265-L325 HydrophobicContact CB-CD1 3.6Å; M265-L325 HydrophobicContact CG-CD1 3.45Å; M265-L325 VanDerWaalsContact CG-CD1 3.45Å; M265-L325 HydrophobicContact SD-CD1 4.01Å
266	R	95.5	Very high	94.5	Very high	7 Å²	7	43 Å²	43	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-47.1	173.9	-73.6	-178.1	69	146.6	0.1	111.5	V262 K263 K264 Q268 L269 M270 F297 T300 A303 Y304	V262-R266 HydrophobicContact CG1-CG 4.34Å; V262-R266 WeakPolarHBondContact O-CG 3.43Å; V262-R266 PolarHBondContact O-N 3.26Å; K263-R266 PolarHBondContact O-N 3.23Å; K264-R266 VanDerWaalsContact C-N 3.35Å; K264-R266 PolarHBondContact O-N 2.84Å; R266-Q268 VanDerWaalsContact C-N 3.3Å; R266-Q268 PolarHBondContact O-N 2.72Å; R266-L269 PolarHBondContact O-N 3.03Å; R266-M270 VanDerWaalsContact O-CG 3.25Å; R266-M270 WeakPolarHBondContact O-CG 3.38Å; R266-M270 PolarHBondContact O-N 3.11Å; R266-F297 HydrophobicContact CG-CB 4Å; R266-F297 HydrophobicContact CG-CD2 3.51Å; R266-F297 HydrophobicContact CG-CE2 4.13Å; R266-F297 HydrophobicContact CG-CG 3.88Å; R266-T300 PolarHBondContact NH2-O 3.05Å; R266-T300 PolarHBondContact NH2-OG1 3.15Å; R266-A303 PolarHBondContact NH1-O 3.06Å; R266-A303 PolarHBondContact NH2-O 3.21Å; R266-A303 VanDerWaalsContact NH2-O 3.13Å; R266-Y304 WeakPolarHBondContact CD-OH 3.41Å; R266-Y304 VanDerWaalsContact NH1-CD1 3.32Å
267	C	93.5	Very high	94.6	Very high	70 Å²	70	52 Å²	52	47%	0.473	25%	0.253	S	S	.	.	H	α-helix	trans	-57.4	-42.9	176.1	-70.7	0	0	0	0	112	K263 K264 M265 M270 L271	K263-C267 PolarHBondContact O-N 2.98Å; K263-C267 PolarHBondContact O-SG 3.24Å; K263-C267 VanDerWaalsContact O-SG 3.4Å; K264-C267 WeakPolarHBondContact O-CB 3.37Å; K264-C267 PolarHBondContact O-N 3.02Å; M265-C267 PolarHBondContact O-N 3.14Å; C267-M270 PolarHBondContact O-N 2.86Å; C267-L271 VanDerWaalsContact O-CG 3.28Å; C267-L271 WeakPolarHBondContact O-CG 3.03Å; C267-L271 PolarHBondContact O-N 2.7Å
268	Q	95.2	Very high	94.5	Very high	38 Å²	38	50.3 Å²	50.3	18%	0.178	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-45.8	176.7	-68.2	176.7	-54.8	0	0	111.9	K264 M265 R266 M270 L271 M272 L325 F358	K264-Q268 PolarHBondContact O-N 3.46Å; K264-Q268 VanDerWaalsContact O-N 3.09Å; M265-Q268 PolarHBondContact O-N 2.98Å; R266-Q268 VanDerWaalsContact C-N 3.3Å; R266-Q268 PolarHBondContact O-N 2.72Å; Q268-M270 VanDerWaalsContact C-N 3.34Å; Q268-M270 PolarHBondContact O-N 3.47Å; Q268-L271 WeakPolarHBondContact O-CB 3.41Å; Q268-L271 PolarHBondContact O-N 3.3Å; Q268-L271 VanDerWaalsContact O-N 3.1Å; Q268-M272 WeakPolarHBondContact O-CG 3.44Å; Q268-M272 PolarHBondContact O-N 3.19Å; Q268-L325 HydrophobicContact CB-CD2 3.71Å; Q268-F358 HydrophobicContact CB-CB 4.27Å; Q268-F358 HydrophobicContact CG-CB 4.43Å; Q268-F358 PolarHBondContact NE2-O 3.25Å
269	L	95.5	Very high	94.5	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-60.7	-41.4	177.3	-70	170.7	0	0	0	112.3	M265 R266 L271 M272 K273 L291 I298 L321 L325 F328	M265-L269 WeakPolarHBondContact O-CG 3.18Å; M265-L269 PolarHBondContact O-N 2.91Å; R266-L269 PolarHBondContact O-N 3.03Å; L269-L271 VanDerWaalsContact C-N 3.25Å; L269-L271 PolarHBondContact O-N 2.92Å; L269-M272 PolarHBondContact O-N 2.96Å; L269-K273 PolarHBondContact O-N 3.32Å; L269-L291 HydrophobicContact CD1-CD2 3.75Å; L269-L291 HydrophobicContact CD2-CD2 3.9Å; L269-L291 HydrophobicContact CG-CD2 4.47Å; L269-I298 HydrophobicContact CB-CG2 3.67Å; L269-L321 HydrophobicContact CD1-CD2 3.72Å; L269-L325 HydrophobicContact CD2-CD2 3.55Å; L269-L325 HydrophobicContact CD2-CG 3.86Å; L269-L325 HydrophobicContact CG-CD2 3.72Å; L269-L325 HydrophobicContact CG-CG 4.06Å; L269-F328 HydrophobicContact CD2-CD2 3.66Å; L269-F328 HydrophobicContact CD2-CE2 3.72Å
270	M	94.5	Very high	94.5	Very high	72 Å²	72	55 Å²	55	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-58.7	-38.3	174.5	-71.3	-69.6	-69.1	0	0	112	R266 C267 Q268 I298	R266-M270 VanDerWaalsContact O-CG 3.25Å; R266-M270 WeakPolarHBondContact O-CG 3.38Å; R266-M270 PolarHBondContact O-N 3.11Å; C267-M270 PolarHBondContact O-N 2.86Å; Q268-M270 VanDerWaalsContact C-N 3.34Å; Q268-M270 PolarHBondContact O-N 3.47Å; M270-I298 WeakPolarHBondContact SD-CA 3.36Å; M270-I298 HydrophobicContact SD-CB 4.45Å
271	L	94	Very high	94.5	Very high	48 Å²	48	54.2 Å²	54.2	25%	0.251	27%	0.267	S	S	.	.	H	α-helix	trans	-77.5	-27.8	178.8	-68.3	168.5	0	0	0	113	C267 Q268 L269 P274 P357 F358	C267-L271 VanDerWaalsContact O-CG 3.28Å; C267-L271 WeakPolarHBondContact O-CG 3.03Å; C267-L271 PolarHBondContact O-N 2.7Å; Q268-L271 WeakPolarHBondContact O-CB 3.41Å; Q268-L271 PolarHBondContact O-N 3.3Å; Q268-L271 VanDerWaalsContact O-N 3.1Å; L269-L271 VanDerWaalsContact C-N 3.25Å; L269-L271 PolarHBondContact O-N 2.92Å; L271-P274 WeakPolarHBondContact O-CD 3.27Å; L271-P357 HydrophobicContact CB-CB 4.45Å; L271-P357 WeakPolarHBondContact CD1-O 3.19Å; L271-P357 HydrophobicContact CD2-CB 4.18Å; L271-F358 HydrophobicContact CB-CB 3.96Å; L271-F358 HydrophobicContact CD1-CB 4.39Å
272	M	95.5	Very high	94.5	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.02	25%	0.251	C	S	.	.	H	α-helix	trans	-76.2	-29.6	173.6	-71.2	177.4	172.9	0	0	112.7	Q268 L269 P274 Y275 L276 L325 F328 A329 I332 F358	Q268-M272 WeakPolarHBondContact O-CG 3.44Å; Q268-M272 PolarHBondContact O-N 3.19Å; L269-M272 PolarHBondContact O-N 2.96Å; M272-P274 VanDerWaalsContact C-CD 3.48Å; M272-Y275 WeakPolarHBondContact O-CB 3.31Å; M272-Y275 PolarHBondContact O-N 3.15Å; M272-Y275 VanDerWaalsContact O-N 3.08Å; M272-L276 PolarHBondContact O-N 3.17Å; M272-L325 HydrophobicContact CE-CD2 3.83Å; M272-L325 HydrophobicContact SD-CD2 3.65Å; M272-F328 HydrophobicContact CE-CB 4.45Å; M272-F328 HydrophobicContact SD-CB 3.49Å; M272-F328 WeakPolarHBondContact SD-CB 3.42Å; M272-F328 HydrophobicContact SD-CD2 4.04Å; M272-F328 HydrophobicContact SD-CG 4.31Å; M272-A329 HydrophobicContact CE-CB 4.05Å; M272-I332 HydrophobicContact CB-CD1 3.88Å; M272-I332 HydrophobicContact CG-CD1 3.83Å; M272-I332 HydrophobicContact SD-CD1 4.45Å; M272-F358 HydrophobicContact CB-CD1 4.47Å; M272-F358 HydrophobicContact CE-CB 4.45Å; M272-F358 HydrophobicContact CE-CD1 4.31Å; M272-F358 HydrophobicContact CE-CD2 3.35Å; M272-F358 HydrophobicContact CE-CE1 4.41Å; M272-F358 HydrophobicContact CE-CE2 3.45Å; M272-F358 VanDerWaalsContact CE-CE2 3.45Å; M272-F358 HydrophobicContact CE-CG 3.8Å; M272-F358 HydrophobicContact CE-CZ 4.01Å; M272-F358 HydrophobicContact CG-CB 4.27Å; M272-F358 HydrophobicContact CG-CD1 3.46Å; M272-F358 VanDerWaalsContact CG-CD1 3.46Å; M272-F358 HydrophobicContact CG-CD2 4.25Å; M272-F358 HydrophobicContact CG-CE1 3.74Å; M272-F358 HydrophobicContact CG-CE2 4.45Å; M272-F358 HydrophobicContact CG-CG 3.74Å; M272-F358 HydrophobicContact CG-CZ 4.23Å
273	K	94.2	Very high	94.3	Very high	43 Å²	43	55.4 Å²	55.4	19%	0.187	28%	0.276	C	S	.	.	H	α-helix	trans	-49.3	-45.2	-176.3	-179.5	-170.2	-169.1	175.1	0	114.9	L269 Y275 L276 R277 I298 D299	L269-K273 PolarHBondContact O-N 3.32Å; K273-Y275 VanDerWaalsContact C-N 3.31Å; K273-Y275 PolarHBondContact O-N 3.37Å; K273-L276 PolarHBondContact O-N 3.23Å; K273-R277 VanDerWaalsContact O-CB 3.29Å; K273-R277 WeakPolarHBondContact O-CB 3.48Å; K273-R277 PolarHBondContact O-N 3.04Å; K273-I298 HydrophobicContact CD-CB 4.25Å; K273-I298 HydrophobicContact CD-CD1 4.25Å; K273-I298 VanDerWaalsContact CD-O 3.3Å; K273-I298 WeakPolarHBondContact CD-O 3.23Å; K273-I298 WeakPolarHBondContact CE-O 3.48Å; K273-I298 HydrophobicContact CG-CD1 4.24Å; K273-I298 PolarHBondContact NZ-O 2.93Å; K273-D299 WeakPolarHBondContact CE-OD1 3.3Å; K273-D299 IonicContact NZ-OD1 3.64Å; K273-D299 PolarHBondContact NZ-OD1 3.49Å
274	P	93.4	Very high	94.2	Very high	79 Å²	79	59 Å²	59	51%	0.513	29%	0.292	S	S	.	.	H	α-helix	trans	-60.7	-37.1	179.7	-24.5	36.1	0	0	0	113.7	L271 M272 S278	L271-P274 WeakPolarHBondContact O-CD 3.27Å; M272-P274 VanDerWaalsContact C-CD 3.48Å; P274-S278 WeakPolarHBondContact O-CB 3.44Å; P274-S278 PolarHBondContact O-N 3.42Å; P274-S278 PolarHBondContact O-OG 3.02Å
275	Y	95.3	Very high	94.1	Very high	18 Å²	18	58.6 Å²	58.6	7%	0.071	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-48.6	176.5	-62.6	-94.8	0	0	0	110.4	M272 K273 R277 S278 C279 I332 N342 F356 P357 F358	M272-Y275 WeakPolarHBondContact O-CB 3.31Å; M272-Y275 PolarHBondContact O-N 3.15Å; M272-Y275 VanDerWaalsContact O-N 3.08Å; K273-Y275 VanDerWaalsContact C-N 3.31Å; K273-Y275 PolarHBondContact O-N 3.37Å; Y275-R277 PolarHBondContact O-N 2.83Å; Y275-S278 PolarHBondContact O-OG 3.24Å; Y275-C279 WeakPolarHBondContact O-CB 3.46Å; Y275-C279 PolarHBondContact O-N 2.97Å; Y275-I332 HydrophobicContact CD1-CG2 4.2Å; Y275-I332 HydrophobicContact CG-CD1 4.33Å; Y275-I332 HydrophobicContact CG-CG2 4.4Å; Y275-N342 HydrophobicContact CD1-CB 4.04Å; Y275-N342 HydrophobicContact CE1-CB 3.71Å; Y275-F356 HydrophobicContact CE1-CD1 4.03Å; Y275-F356 HydrophobicContact CE1-CE1 4.2Å; Y275-P357 HydrophobicContact CE2-CG 4.41Å; Y275-P357 WeakPolarHBondContact OH-CD 3.32Å; Y275-F358 HydrophobicContact CD2-CE1 4.47Å; Y275-F358 HydrophobicContact CE2-CE1 4.32Å
276	L	94.4	Very high	94	Very high	5 Å²	5	61.3 Å²	61.3	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-36	-178.2	-58.8	175.7	0	0	0	112.6	M272 K273 A282 L287 I288 F328 I332	M272-L276 PolarHBondContact O-N 3.17Å; K273-L276 PolarHBondContact O-N 3.23Å; L276-A282 HydrophobicContact CB-CB 4.3Å; L276-A282 HydrophobicContact CD2-CB 3.99Å; L276-A282 WeakPolarHBondContact O-CB 3.26Å; L276-L287 HydrophobicContact CD2-CB 4.5Å; L276-L287 HydrophobicContact CD2-CD1 3.88Å; L276-I288 HydrophobicContact CB-CD1 4.31Å; L276-I288 HydrophobicContact CB-CG1 4.18Å; L276-I288 HydrophobicContact CD1-CG1 4.42Å; L276-F328 HydrophobicContact CD1-CB 4.41Å; L276-F328 HydrophobicContact CD1-CD1 3.98Å; L276-F328 HydrophobicContact CD1-CD2 3.42Å; L276-F328 VanDerWaalsContact CD1-CD2 3.42Å; L276-F328 HydrophobicContact CD1-CE1 4.02Å; L276-F328 HydrophobicContact CD1-CE2 3.43Å; L276-F328 VanDerWaalsContact CD1-CE2 3.43Å; L276-F328 HydrophobicContact CD1-CG 3.69Å; L276-F328 HydrophobicContact CD1-CZ 3.75Å; L276-I332 HydrophobicContact CD2-CD1 4.27Å; L276-I332 HydrophobicContact CD2-CG1 4.21Å; L276-I332 HydrophobicContact CG-CD1 4.44Å
277	R	93.6	Very high	93.9	Very high	195 Å²	195	61.1 Å²	61.1	74%	0.736	31%	0.312	S	S	*	.	H	α-helix	trans	-70.9	-34.7	-179.3	-176.1	175.5	177.9	162.5	0.5	112.9	K273 Y275	K273-R277 VanDerWaalsContact O-CB 3.29Å; K273-R277 WeakPolarHBondContact O-CB 3.48Å; K273-R277 PolarHBondContact O-N 3.04Å; Y275-R277 PolarHBondContact O-N 2.83Å
278	S	91.7	Very high	93.8	Very high	85 Å²	85	60.2 Å²	60.2	59%	0.594	30%	0.302	S	S	*	.	H	α-helix	trans	-89.1	-14.6	179.6	57.3	0	0	0	0	113.3	P274 Y275	P274-S278 WeakPolarHBondContact O-CB 3.44Å; P274-S278 PolarHBondContact O-N 3.42Å; P274-S278 PolarHBondContact O-OG 3.02Å; Y275-S278 PolarHBondContact O-OG 3.24Å
279	C	95.2	Very high	93.7	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.014	31%	0.309	C	S	.	.			trans	-84.7	118.5	-179.5	178.1	0	0	0	0	112.4	Y275 E281 A282 A283 H331 C336 C339	Y275-C279 WeakPolarHBondContact O-CB 3.46Å; Y275-C279 PolarHBondContact O-N 2.97Å; C279-E281 VanDerWaalsContact C-N 3.3Å; C279-E281 PolarHBondContact O-N 3.15Å; C279-E281 PolarHBondContact SG-N 3.14Å; C279-E281 VanDerWaalsContact SG-N 3.44Å; C279-A282 HydrophobicContact CB-CB 3.75Å; C279-A282 PolarHBondContact O-N 2.93Å; C279-A282 PolarHBondContact SG-N 3.14Å; C279-A283 PolarHBondContact O-N 3.24Å; C279-A283 VanDerWaalsContact O-N 3.09Å; C279-H331 PolarHBondContact SG-NE2 3.4Å; C279-H331 VanDerWaalsContact SG-NE2 3.42Å; C279-C336 PolarHBondContact SG-SG 2.85Å; C279-C339 VanDerWaalsContact CB-SG 3.52Å
280	R	94	Very high	93.6	Very high	172 Å²	172	66.8 Å²	66.8	65%	0.649	33%	0.333	S	S	*	.	H	α-helix	trans	-61.6	-34.1	175.1	65.2	-177.7	-176.3	-159.1	-3.8	113.7	A283 K284 I338	R280-A283 PolarHBondContact O-N 3.38Å; R280-K284 WeakPolarHBondContact O-CG 3.42Å; R280-K284 PolarHBondContact O-N 3.14Å; R280-K284 VanDerWaalsContact O-N 3.1Å; R280-I338 HydrophobicContact CG-CD1 3.97Å
281	E	94.3	Very high	93.6	Very high	59 Å²	59	63.3 Å²	63.3	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-74.1	-39	179.4	-59.9	-50.5	130.7	0	0	111.4	C279 A283 K284 Q285	C279-E281 VanDerWaalsContact C-N 3.3Å; C279-E281 PolarHBondContact O-N 3.15Å; C279-E281 PolarHBondContact SG-N 3.14Å; C279-E281 VanDerWaalsContact SG-N 3.44Å; E281-A283 VanDerWaalsContact C-N 3.28Å; E281-A283 PolarHBondContact O-N 3.35Å; E281-K284 PolarHBondContact O-N 3.35Å; E281-K284 IonicContact OE1-NZ 2.82Å; E281-K284 PolarHBondContact OE1-NZ 2.97Å; E281-K284 IonicContact OE2-NZ 3.32Å; E281-K284 PolarHBondContact OE2-NZ 3.26Å; E281-Q285 WeakPolarHBondContact O-CG 3.37Å; E281-Q285 PolarHBondContact O-N 3.29Å
282	A	93.6	Very high	93.6	Very high	3 Å²	3	69.7 Å²	69.7	3%	0.025	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-38	172.5	0	0	0	0	0	112.1	L276 C279 Q285 C286 L287	L276-A282 HydrophobicContact CB-CB 4.3Å; L276-A282 HydrophobicContact CD2-CB 3.99Å; L276-A282 WeakPolarHBondContact O-CB 3.26Å; C279-A282 HydrophobicContact CB-CB 3.75Å; C279-A282 PolarHBondContact O-N 2.93Å; C279-A282 PolarHBondContact SG-N 3.14Å; A282-Q285 PolarHBondContact O-N 2.93Å; A282-C286 PolarHBondContact O-N 2.93Å; A282-C286 VanDerWaalsContact O-N 3.12Å; A282-L287 HydrophobicContact CB-CD1 3.84Å; A282-L287 HydrophobicContact CB-CG 4.35Å; A282-L287 PolarHBondContact O-N 3.45Å; A282-L287 VanDerWaalsContact O-N 3.09Å
283	A	92.6	Very high	93.5	Very high	65 Å²	65	73.8 Å²	73.8	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-65.2	-45.5	175.6	0	0	0	0	0	112	C279 R280 E281 Q285 C286	C279-A283 PolarHBondContact O-N 3.24Å; C279-A283 VanDerWaalsContact O-N 3.09Å; R280-A283 PolarHBondContact O-N 3.38Å; E281-A283 VanDerWaalsContact C-N 3.28Å; E281-A283 PolarHBondContact O-N 3.35Å; A283-Q285 VanDerWaalsContact C-N 3.32Å; A283-Q285 PolarHBondContact O-N 2.7Å; A283-C286 PolarHBondContact O-N 3.07Å; A283-C286 VanDerWaalsContact O-N 3.08Å
284	K	92.7	Very high	93.6	Very high	146 Å²	146	72 Å²	72	64%	0.635	36%	0.356	S	S	*	.	H	α-helix	trans	-60.4	-40.4	175.5	-72.1	172.6	-174.1	167.4	0	112.5	R280 E281 C286	R280-K284 WeakPolarHBondContact O-CG 3.42Å; R280-K284 PolarHBondContact O-N 3.14Å; R280-K284 VanDerWaalsContact O-N 3.1Å; E281-K284 PolarHBondContact O-N 3.35Å; E281-K284 IonicContact OE1-NZ 2.82Å; E281-K284 PolarHBondContact OE1-NZ 2.97Å; E281-K284 IonicContact OE2-NZ 3.32Å; E281-K284 PolarHBondContact OE2-NZ 3.26Å; K284-C286 PolarHBondContact O-N 3.26Å
285	Q	91.5	Very high	93.6	Very high	96 Å²	96	70.1 Å²	70.1	45%	0.449	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.4	178	-66.1	179.6	25.4	0	0	113.3	E281 A282 A283 L287	E281-Q285 WeakPolarHBondContact O-CG 3.37Å; E281-Q285 PolarHBondContact O-N 3.29Å; A282-Q285 PolarHBondContact O-N 2.93Å; A283-Q285 VanDerWaalsContact C-N 3.32Å; A283-Q285 PolarHBondContact O-N 2.7Å; Q285-L287 HydrophobicContact CB-CD2 3.94Å; Q285-L287 HydrophobicContact CB-CG 3.91Å; Q285-L287 PolarHBondContact O-N 3.34Å; Q285-L287 VanDerWaalsContact O-N 3.16Å
286	C	92.8	Very high	93.5	Very high	79 Å²	79	70.9 Å²	70.9	53%	0.534	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	38.4	-176.8	-66.7	0	0	0	0	113.1	A282 A283 K284 I288 A289	A282-C286 PolarHBondContact O-N 2.93Å; A282-C286 VanDerWaalsContact O-N 3.12Å; A283-C286 PolarHBondContact O-N 3.07Å; A283-C286 VanDerWaalsContact O-N 3.08Å; K284-C286 PolarHBondContact O-N 3.26Å; C286-I288 VanDerWaalsContact C-N 3.3Å; C286-I288 PolarHBondContact O-N 3.29Å; C286-A289 HydrophobicContact CB-CB 4.18Å; C286-A289 WeakPolarHBondContact O-CA 3.43Å; C286-A289 VanDerWaalsContact O-CB 3.29Å; C286-A289 WeakPolarHBondContact O-CB 3.44Å; C286-A289 PolarHBondContact O-N 2.82Å
287	L	93.6	Very high	93.5	Very high	3 Å²	3	70.6 Å²	70.6	2%	0.016	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-56.5	-41.7	-170.3	-70.8	-176.1	0	0	0	112.9	L276 A282 Q285 A289 R290 T327 F328 H331	L276-L287 HydrophobicContact CD2-CB 4.5Å; L276-L287 HydrophobicContact CD2-CD1 3.88Å; A282-L287 HydrophobicContact CB-CD1 3.84Å; A282-L287 HydrophobicContact CB-CG 4.35Å; A282-L287 PolarHBondContact O-N 3.45Å; A282-L287 VanDerWaalsContact O-N 3.09Å; Q285-L287 HydrophobicContact CB-CD2 3.94Å; Q285-L287 HydrophobicContact CB-CG 3.91Å; Q285-L287 PolarHBondContact O-N 3.34Å; Q285-L287 VanDerWaalsContact O-N 3.16Å; L287-A289 PolarHBondContact O-N 3.5Å; L287-R290 VanDerWaalsContact O-CB 3.27Å; L287-R290 WeakPolarHBondContact O-CB 3.44Å; L287-R290 PolarHBondContact O-N 3.2Å; L287-T327 HydrophobicContact CD2-CG2 4.31Å; L287-F328 HydrophobicContact CB-CD1 4.38Å; L287-F328 HydrophobicContact CB-CE1 3.86Å; L287-F328 VanDerWaalsContact O-CE1 3.26Å; L287-F328 WeakPolarHBondContact O-CE1 3.19Å; L287-F328 WeakPolarHBondContact O-CZ 3.43Å; L287-H331 HydrophobicContact CD1-CB 3.85Å; L287-H331 VanDerWaalsContact CD1-CG 3.45Å
288	I	92.8	Very high	93.4	Very high	52 Å²	52	61.6 Å²	61.6	27%	0.267	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-60.2	-33.6	177.3	-64.7	175.2	0	0	0	111.8	L276 C286 R290 L291 V295 I298	L276-I288 HydrophobicContact CB-CD1 4.31Å; L276-I288 HydrophobicContact CB-CG1 4.18Å; L276-I288 HydrophobicContact CD1-CG1 4.42Å; C286-I288 VanDerWaalsContact C-N 3.3Å; C286-I288 PolarHBondContact O-N 3.29Å; I288-R290 PolarHBondContact O-N 2.8Å; I288-L291 WeakPolarHBondContact O-CB 3.4Å; I288-L291 PolarHBondContact O-N 2.76Å; I288-L291 VanDerWaalsContact O-N 3.16Å; I288-V295 HydrophobicContact CG2-CG1 4.44Å; I288-I298 HydrophobicContact CG2-CD1 3.65Å
289	A	92.6	Very high	93.2	Very high	40 Å²	40	62.2 Å²	62.2	33%	0.331	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-67.1	-21	179	0	0	0	0	0	112.8	C286 L287 L291 R292	C286-A289 HydrophobicContact CB-CB 4.18Å; C286-A289 WeakPolarHBondContact O-CA 3.43Å; C286-A289 VanDerWaalsContact O-CB 3.29Å; C286-A289 WeakPolarHBondContact O-CB 3.44Å; C286-A289 PolarHBondContact O-N 2.82Å; L287-A289 PolarHBondContact O-N 3.5Å; A289-L291 PolarHBondContact O-N 3.1Å; A289-R292 WeakPolarHBondContact O-CB 2.65Å; A289-R292 WeakPolarHBondContact O-CG 3.49Å; A289-R292 PolarHBondContact O-N 2.87Å; A289-R292 VanDerWaalsContact O-N 3.16Å
290	R	93.6	Very high	92.8	Very high	136 Å²	136	64.2 Å²	64.2	51%	0.513	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-65.8	-19.3	174.9	-61.8	-178.5	63.5	145.6	-5	113	L287 I288 R292 H320	L287-R290 VanDerWaalsContact O-CB 3.27Å; L287-R290 WeakPolarHBondContact O-CB 3.44Å; L287-R290 PolarHBondContact O-N 3.2Å; I288-R290 PolarHBondContact O-N 2.8Å; R290-R292 PolarHBondContact O-N 2.95Å; R290-H320 PolarHBondContact O-CE1 3.48Å; R290-H320 PolarHBondContact O-NE2 2.88Å
291	L	93.9	Very high	92.1	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-72	-10.2	173.8	-76.6	168	0	0	0	113.8	L269 I288 A289 Y294 V295 I298 L321 T324 F328	L269-L291 HydrophobicContact CD1-CD2 3.75Å; L269-L291 HydrophobicContact CD2-CD2 3.9Å; L269-L291 HydrophobicContact CG-CD2 4.47Å; I288-L291 WeakPolarHBondContact O-CB 3.4Å; I288-L291 PolarHBondContact O-N 2.76Å; I288-L291 VanDerWaalsContact O-N 3.16Å; A289-L291 PolarHBondContact O-N 3.1Å; L291-Y294 CarbonylContact O-C 3.49Å; L291-Y294 WeakPolarHBondContact O-CA 3.19Å; L291-Y294 WeakPolarHBondContact O-CB 3.5Å; L291-Y294 PolarHBondContact O-N 2.89Å; L291-V295 HydrophobicContact CB-CG2 4.18Å; L291-I298 HydrophobicContact CD1-CD1 4.17Å; L291-I298 HydrophobicContact CD1-CG1 4.22Å; L291-I298 HydrophobicContact CD1-CG2 3.59Å; L291-L321 HydrophobicContact CD2-CD2 4.29Å; L291-T324 HydrophobicContact CD2-CG2 3.45Å; L291-T324 VanDerWaalsContact CD2-CG2 3.45Å; L291-T324 HydrophobicContact CG-CG2 3.77Å; L291-F328 HydrophobicContact CD1-CE2 3.82Å; L291-F328 HydrophobicContact CD1-CZ 3.97Å; L291-F328 HydrophobicContact CD2-CE2 4.37Å; L291-F328 HydrophobicContact CG-CE2 4.02Å; L291-F328 HydrophobicContact CG-CZ 3.86Å
292	R	94.2	Very high	91.8	Very high	181 Å²	181	63.3 Å²	63.3	68%	0.683	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	135.2	179.9	-73.5	179.7	-171.2	169.7	4.1	110.3	A289 R290 V295 H320	A289-R292 WeakPolarHBondContact O-CB 2.65Å; A289-R292 WeakPolarHBondContact O-CG 3.49Å; A289-R292 PolarHBondContact O-N 2.87Å; A289-R292 VanDerWaalsContact O-N 3.16Å; R290-R292 PolarHBondContact O-N 2.95Å; R292-V295 HydrophobicContact CB-CG2 4.4Å; R292-V295 HydrophobicContact CG-CG2 3.59Å; R292-H320 PolarHBondContact O-CE1 3.45Å
293	P	93.9	Very high	91.8	Very high	91 Å²	91	63.7 Å²	63.7	59%	0.591	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.4	-1.5	9.7	34.5	-36.6	0	0	0	116	V295	P293-V295 VanDerWaalsContact C-N 3.31Å; P293-V295 PolarHBondContact O-N 3.45Å
294	Y	96.1	Very high	91.9	Very high	5 Å²	5	60.7 Å²	60.7	2%	0.02	30%	0.303	C	S	.	.			trans	-87.2	27.7	-171.9	-45	-70.7	0	0	0	115	L291 H296 F297 D311 A317 H320 L321	L291-Y294 CarbonylContact O-C 3.49Å; L291-Y294 WeakPolarHBondContact O-CA 3.19Å; L291-Y294 WeakPolarHBondContact O-CB 3.5Å; L291-Y294 PolarHBondContact O-N 2.89Å; Y294-H296 PolarHBondContact O-N 2.96Å; Y294-F297 HydrophobicContact CD1-CE2 4.22Å; Y294-F297 HydrophobicContact CD1-CZ 4.12Å; Y294-F297 HydrophobicContact CG-CE2 4.41Å; Y294-F297 VanDerWaalsContact O-CB 3.24Å; Y294-F297 WeakPolarHBondContact O-CB 3.42Å; Y294-F297 PolarHBondContact O-N 2.72Å; Y294-D311 HydrophobicContact CE1-CB 4.4Å; Y294-D311 WeakPolarHBondContact CE1-OD2 3.28Å; Y294-D311 PolarHBondContact OH-OD2 3.03Å; Y294-A317 HydrophobicContact CE1-CB 4.11Å; Y294-H320 AromaticContact CD2-CD2 3.45Å; Y294-H320 VanDerWaalsContact CD2-CD2 3.45Å; Y294-H320 WeakPolarHBondContact CD2-CD2 3.49Å; Y294-H320 AromaticContact CD2-NE2 3.97Å; Y294-H320 HydrophobicContact CE2-CB 4.03Å; Y294-H320 AromaticContact CE2-CD2 3.63Å; Y294-H320 AromaticContact CE2-CG 3.85Å; Y294-L321 HydrophobicContact CD2-CD2 4.32Å; Y294-L321 HydrophobicContact CG-CD2 4.45Å
295	V	93.2	Very high	92.1	Very high	40 Å²	40	53.8 Å²	53.8	24%	0.242	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-60.3	-32.2	-177.3	179.3	0	0	0	0	111.5	I288 L291 R292 P293 F297 I298	I288-V295 HydrophobicContact CG2-CG1 4.44Å; L291-V295 HydrophobicContact CB-CG2 4.18Å; R292-V295 HydrophobicContact CB-CG2 4.4Å; R292-V295 HydrophobicContact CG-CG2 3.59Å; P293-V295 VanDerWaalsContact C-N 3.31Å; P293-V295 PolarHBondContact O-N 3.45Å; V295-F297 PolarHBondContact O-N 3.27Å; V295-F297 VanDerWaalsContact O-N 3.09Å; V295-I298 WeakPolarHBondContact O-CG1 3.23Å; V295-I298 PolarHBondContact O-N 3.48Å
296	H	93.4	Very high	92.4	Very high	33 Å²	33	49.3 Å²	49.3	15%	0.153	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.6	-17.3	176.8	58.7	-71.9	0	0	0	113.8	P241 Y294 I298 D299 T300 D308	P241-H296 VanDerWaalsContact CB-CD2 3.42Å; P241-H296 WeakPolarHBondContact CB-CD2 3.44Å; P241-H296 HydrophobicContact CG-CB 4.27Å; Y294-H296 PolarHBondContact O-N 2.96Å; H296-I298 PolarHBondContact O-N 3.35Å; H296-D299 PolarHBondContact O-N 3.41Å; H296-D299 VanDerWaalsContact O-N 3.14Å; H296-T300 PolarHBondContact O-N 3.24Å; H296-T300 PolarHBondContact O-OG1 2.96Å; H296-D308 IonicContact CD2-OD2 3.91Å; H296-D308 IonicContact CE1-OD1 2.59Å; H296-D308 IonicContact CE1-OD2 2.65Å; H296-D308 PolarHBondContact CE1-OD2 2.86Å; H296-D308 IonicContact NE2-OD1 3.64Å; H296-D308 IonicContact NE2-OD2 3.25Å; H296-D308 PolarHBondContact NE2-OD2 3.42Å
297	F	94.9	Very high	92.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-65.8	-24	176.9	-76.7	13.2	0	0	0	113.1	V262 R266 Y294 V295 Y304 D308 L321	V262-F297 HydrophobicContact CG1-CE2 3.94Å; R266-F297 HydrophobicContact CG-CB 4Å; R266-F297 HydrophobicContact CG-CD2 3.51Å; R266-F297 HydrophobicContact CG-CE2 4.13Å; R266-F297 HydrophobicContact CG-CG 3.88Å; Y294-F297 HydrophobicContact CD1-CE2 4.22Å; Y294-F297 HydrophobicContact CD1-CZ 4.12Å; Y294-F297 HydrophobicContact CG-CE2 4.41Å; Y294-F297 VanDerWaalsContact O-CB 3.24Å; Y294-F297 WeakPolarHBondContact O-CB 3.42Å; Y294-F297 PolarHBondContact O-N 2.72Å; V295-F297 PolarHBondContact O-N 3.27Å; V295-F297 VanDerWaalsContact O-N 3.09Å; F297-Y304 HydrophobicContact CE1-CD1 4.18Å; F297-Y304 HydrophobicContact CE1-CE1 4.45Å; F297-Y304 HydrophobicContact CZ-CD1 4.08Å; F297-Y304 HydrophobicContact CZ-CE1 4.17Å; F297-D308 HydrophobicContact CE1-CB 4.29Å; F297-D308 HydrophobicContact CZ-CB 4.06Å; F297-L321 HydrophobicContact CD2-CD1 4Å; F297-L321 HydrophobicContact CD2-CD2 3.98Å; F297-L321 HydrophobicContact CE2-CD1 3.9Å; F297-L321 HydrophobicContact CE2-CD2 4.46Å
298	I	91.4	Very high	92.9	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.026	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-93.7	-7.2	175	60.5	155.5	0	0	0	113.6	L269 M270 K273 I288 L291 V295 H296	L269-I298 HydrophobicContact CB-CG2 3.67Å; M270-I298 WeakPolarHBondContact SD-CA 3.36Å; M270-I298 HydrophobicContact SD-CB 4.45Å; K273-I298 HydrophobicContact CD-CB 4.25Å; K273-I298 HydrophobicContact CD-CD1 4.25Å; K273-I298 VanDerWaalsContact CD-O 3.3Å; K273-I298 WeakPolarHBondContact CD-O 3.23Å; K273-I298 WeakPolarHBondContact CE-O 3.48Å; K273-I298 HydrophobicContact CG-CD1 4.24Å; K273-I298 PolarHBondContact NZ-O 2.93Å; I288-I298 HydrophobicContact CG2-CD1 3.65Å; L291-I298 HydrophobicContact CD1-CD1 4.17Å; L291-I298 HydrophobicContact CD1-CG1 4.22Å; L291-I298 HydrophobicContact CD1-CG2 3.59Å; V295-I298 WeakPolarHBondContact O-CG1 3.23Å; V295-I298 PolarHBondContact O-N 3.48Å; H296-I298 PolarHBondContact O-N 3.35Å
299	D	87.8	Confident	93.1	Very high	98 Å²	98	45.3 Å²	45.3	52%	0.524	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-25.3	-179.3	-68.5	-42.4	0	0	0	112.3	K273 H296	K273-D299 WeakPolarHBondContact CE-OD1 3.3Å; K273-D299 IonicContact NZ-OD1 3.64Å; K273-D299 PolarHBondContact NZ-OD1 3.49Å; H296-D299 PolarHBondContact O-N 3.41Å; H296-D299 VanDerWaalsContact O-N 3.14Å
300	T	86.2	Confident	93.3	Very high	44 Å²	44	44.3 Å²	44.3	27%	0.27	21%	0.214	S	C	.	.			trans	-125.9	139.2	-174.8	63.8	0	0	0	0	111.2	R266 H296 A303	R266-T300 PolarHBondContact NH2-O 3.05Å; R266-T300 PolarHBondContact NH2-OG1 3.15Å; H296-T300 PolarHBondContact O-N 3.24Å; H296-T300 PolarHBondContact O-OG1 2.96Å; T300-A303 HydrophobicContact CG2-CB 4.23Å
301	Q	79.6	Confident	93.6	Very high	170 Å²	170	38.6 Å²	38.6	79%	0.794	19%	0.194	S	C	*	.	S	Bend	trans	-73.5	-40.3	-176.8	-173.7	172.2	-14	0	0	112.6
302	D	87.5	Confident	93.7	Very high	43 Å²	43	38.6 Å²	38.6	23%	0.23	19%	0.194	C	C	.	.	S	Bend	trans	-137.9	6.4	-164.6	66.1	-21.6	0	0	0	114.4	R244 E246 Y304	R244-D302 WeakPolarHBondContact CA-O 3.41Å; R244-D302 WeakPolarHBondContact CB-OD2 3.28Å; R244-D302 WeakPolarHBondContact CG-OD2 3.49Å; E246-D302 WeakPolarHBondContact OE2-CB 3.46Å; D302-Y304 WeakPolarHBondContact O-CD2 3.41Å; D302-Y304 WeakPolarHBondContact O-CE2 3.42Å
303	A	93.3	Very high	93.8	Very high	11 Å²	11	32.6 Å²	32.6	9%	0.091	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.2	-177.6	0	0	0	0	0	112.3	P241 F243 R266 T300	P241-A303 HydrophobicContact CB-CB 4.25Å; F243-A303 CarbonylContact O-C 3.48Å; F243-A303 VanDerWaalsContact O-CA 3.31Å; F243-A303 WeakPolarHBondContact O-CA 3.24Å; R266-A303 PolarHBondContact NH1-O 3.06Å; R266-A303 PolarHBondContact NH2-O 3.21Å; R266-A303 VanDerWaalsContact NH2-O 3.13Å; T300-A303 HydrophobicContact CG2-CB 4.23Å
304	Y	96.1	Very high	93.9	Very high	1 Å²	1	34 Å²	34	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	147.1	176.5	-61.4	-98.8	0	0	0	110.9	P241 V242 F243 L245 L259 V262 R266 F297 D302 D308 L309 I312	P241-Y304 CarbonylContact C-O 3.57Å; P241-Y304 WeakPolarHBondContact CA-O 3.42Å; V242-Y304 PolarHBondContact N-O 2.89Å; V242-Y304 VanDerWaalsContact N-O 3.11Å; F243-Y304 WeakPolarHBondContact CB-O 3.42Å; F243-Y304 WeakPolarHBondContact CD2-O 3.41Å; F243-Y304 PolarHBondContact N-O 2.94Å; F243-Y304 PolarHBondContact O-N 2.86Å; L245-Y304 HydrophobicContact CB-CD2 4.18Å; L245-Y304 HydrophobicContact CB-CE2 4.3Å; L245-Y304 HydrophobicContact CD1-CD1 4.4Å; L245-Y304 HydrophobicContact CD1-CD2 3.62Å; L245-Y304 HydrophobicContact CD1-CE2 3.85Å; L245-Y304 HydrophobicContact CD1-CG 3.92Å; L245-Y304 HydrophobicContact CG-CD2 3.72Å; L245-Y304 HydrophobicContact CG-CE2 4.22Å; L245-Y304 HydrophobicContact CG-CG 4.27Å; L259-Y304 HydrophobicContact CD1-CE1 4.37Å; V262-Y304 HydrophobicContact CG1-CE1 4.48Å; R266-Y304 WeakPolarHBondContact CD-OH 3.41Å; R266-Y304 VanDerWaalsContact NH1-CD1 3.32Å; F297-Y304 HydrophobicContact CE1-CD1 4.18Å; F297-Y304 HydrophobicContact CE1-CE1 4.45Å; F297-Y304 HydrophobicContact CZ-CD1 4.08Å; F297-Y304 HydrophobicContact CZ-CE1 4.17Å; D302-Y304 WeakPolarHBondContact O-CD2 3.41Å; D302-Y304 WeakPolarHBondContact O-CE2 3.42Å; Y304-D308 HydrophobicContact CD1-CB 4.32Å; Y304-L309 HydrophobicContact CD1-CD2 4.14Å; Y304-L309 HydrophobicContact CG-CD2 4.16Å; Y304-I312 HydrophobicContact CD1-CD1 4.04Å; Y304-I312 HydrophobicContact CE1-CD1 3.99Å
305	S	96.6	Very high	93.9	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.014	19%	0.192	C	C	.	.			trans	-94	163.7	169.4	77.7	0	0	0	0	110.5	Q238 R240 Q307 D308 L309	Q238-S305 WeakPolarHBondContact O-CB 3.5Å; R240-S305 VanDerWaalsContact C-CB 3.48Å; R240-S305 WeakPolarHBondContact O-CA 3.39Å; R240-S305 VanDerWaalsContact O-CB 3.27Å; R240-S305 WeakPolarHBondContact O-CB 3.31Å; S305-Q307 PolarHBondContact O-N 2.83Å; S305-Q307 PolarHBondContact OG-N 2.96Å; S305-D308 PolarHBondContact N-OD2 3.02Å; S305-D308 WeakPolarHBondContact O-CB 3.42Å; S305-D308 PolarHBondContact O-N 3.39Å; S305-D308 VanDerWaalsContact O-N 3.14Å; S305-D308 PolarHBondContact OG-N 3.48Å; S305-D308 PolarHBondContact OG-OD1 3.44Å; S305-D308 PolarHBondContact OG-OD2 3.21Å; S305-D308 VanDerWaalsContact OG-OD2 3.11Å; S305-L309 PolarHBondContact O-N 3.35Å
306	L	97.8	Very high	94	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-37.3	174.3	-177.8	65.6	0	0	0	110.7	V210 P212 V215 Q238 F243 D308 L309 I310	V210-L306 HydrophobicContact CG1-CD1 4.31Å; P212-L306 HydrophobicContact CG-CD1 4.38Å; P212-L306 HydrophobicContact CG-CD2 4.09Å; V215-L306 HydrophobicContact CG2-CD1 4.14Å; Q238-L306 HydrophobicContact CG-CB 4.35Å; Q238-L306 HydrophobicContact CG-CD2 4.36Å; Q238-L306 PolarHBondContact O-N 3.07Å; Q238-L306 VanDerWaalsContact O-N 3.15Å; F243-L306 HydrophobicContact CE2-CB 4.01Å; L306-D308 VanDerWaalsContact C-N 3.31Å; L306-D308 PolarHBondContact O-N 3.37Å; L306-L309 PolarHBondContact O-N 3.38Å; L306-I310 HydrophobicContact CG-CD1 4.16Å; L306-I310 WeakPolarHBondContact O-CG1 3.22Å; L306-I310 PolarHBondContact O-N 2.97Å; L306-I310 VanDerWaalsContact O-N 3.14Å
307	Q	98	Very high	94.2	Very high	44 Å²	44	36 Å²	36	21%	0.206	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-40.7	175.1	-170.8	62.7	55.6	0	0	111.4	Q238 K239 S305 L309 I310 D311	Q238-Q307 HydrophobicContact CG-CB 4.14Å; Q238-Q307 PolarHBondContact O-N 3.38Å; K239-Q307 HydrophobicContact CG-CB 4.39Å; S305-Q307 PolarHBondContact O-N 2.83Å; S305-Q307 PolarHBondContact OG-N 2.96Å; Q307-L309 VanDerWaalsContact C-N 3.3Å; Q307-L309 PolarHBondContact O-N 2.83Å; Q307-I310 PolarHBondContact O-N 3.5Å; Q307-D311 PolarHBondContact NE2-OD1 3.35Å; Q307-D311 WeakPolarHBondContact O-CB 3.12Å; Q307-D311 PolarHBondContact O-N 3.44Å
308	D	97.7	Very high	94.3	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.032	20%	0.198	C	C	.	.	H	α-helix	trans	-59.5	-44.7	178.9	-59.6	-22.6	0	0	0	110.4	H296 F297 Y304 S305 L306 I310 D311 I312	H296-D308 IonicContact CD2-OD2 3.91Å; H296-D308 IonicContact CE1-OD1 2.59Å; H296-D308 IonicContact CE1-OD2 2.65Å; H296-D308 PolarHBondContact CE1-OD2 2.86Å; H296-D308 IonicContact NE2-OD1 3.64Å; H296-D308 IonicContact NE2-OD2 3.25Å; H296-D308 PolarHBondContact NE2-OD2 3.42Å; F297-D308 HydrophobicContact CE1-CB 4.29Å; F297-D308 HydrophobicContact CZ-CB 4.06Å; Y304-D308 HydrophobicContact CD1-CB 4.32Å; S305-D308 PolarHBondContact N-OD2 3.02Å; S305-D308 WeakPolarHBondContact O-CB 3.42Å; S305-D308 PolarHBondContact O-N 3.39Å; S305-D308 VanDerWaalsContact O-N 3.14Å; S305-D308 PolarHBondContact OG-N 3.48Å; S305-D308 PolarHBondContact OG-OD1 3.44Å; S305-D308 PolarHBondContact OG-OD2 3.21Å; S305-D308 VanDerWaalsContact OG-OD2 3.11Å; L306-D308 VanDerWaalsContact C-N 3.31Å; L306-D308 PolarHBondContact O-N 3.37Å; D308-I310 PolarHBondContact O-N 3.21Å; D308-D311 PolarHBondContact O-N 3.12Å; D308-I312 WeakPolarHBondContact O-CB 3.28Å; D308-I312 WeakPolarHBondContact O-CD1 3.44Å; D308-I312 WeakPolarHBondContact O-CG1 3.28Å; D308-I312 PolarHBondContact O-N 2.84Å
309	L	97.5	Very high	94.5	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-39.6	179.6	-56	-178.3	0	0	0	112.3	V215 L216 W219 F221 F243 L245 Y304 S305 L306 Q307 I312 V313	V215-L309 HydrophobicContact CG1-CB 4.17Å; V215-L309 HydrophobicContact CG1-CD1 3.67Å; L216-L309 HydrophobicContact CD2-CD1 4.26Å; W219-L309 HydrophobicContact CH2-CD2 4.31Å; W219-L309 HydrophobicContact CZ3-CD2 4.43Å; F221-L309 HydrophobicContact CE1-CB 3.92Å; F221-L309 WeakPolarHBondContact CE1-O 3.31Å; F221-L309 HydrophobicContact CZ-CB 4.2Å; F243-L309 HydrophobicContact CD2-CD1 4.16Å; L245-L309 HydrophobicContact CD1-CD2 3.54Å; L245-L309 HydrophobicContact CD2-CD1 4.22Å; L245-L309 HydrophobicContact CD2-CD2 4.46Å; L245-L309 HydrophobicContact CG-CD2 4.38Å; Y304-L309 HydrophobicContact CD1-CD2 4.14Å; Y304-L309 HydrophobicContact CG-CD2 4.16Å; S305-L309 PolarHBondContact O-N 3.35Å; L306-L309 PolarHBondContact O-N 3.38Å; Q307-L309 VanDerWaalsContact C-N 3.3Å; Q307-L309 PolarHBondContact O-N 2.83Å; L309-I312 HydrophobicContact CD2-CD1 4.31Å; L309-I312 PolarHBondContact O-N 3.27Å; L309-V313 PolarHBondContact O-N 2.79Å; L309-V313 VanDerWaalsContact O-N 3.14Å
310	I	97.8	Very high	95	Very high	19 Å²	19	39 Å²	39	10%	0.097	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-47.5	173.4	-66.9	165.1	0	0	0	110.1	V210 F221 L306 Q307 D308 I312 V313 E314	V210-I310 HydrophobicContact CB-CD1 4.41Å; V210-I310 HydrophobicContact CG2-CD1 4.21Å; F221-I310 HydrophobicContact CD1-CG1 4Å; F221-I310 HydrophobicContact CE1-CG1 4.27Å; L306-I310 HydrophobicContact CG-CD1 4.16Å; L306-I310 WeakPolarHBondContact O-CG1 3.22Å; L306-I310 PolarHBondContact O-N 2.97Å; L306-I310 VanDerWaalsContact O-N 3.14Å; Q307-I310 PolarHBondContact O-N 3.5Å; D308-I310 PolarHBondContact O-N 3.21Å; I310-I312 PolarHBondContact O-N 3.33Å; I310-V313 WeakPolarHBondContact O-CG1 3.2Å; I310-V313 PolarHBondContact O-N 3.01Å; I310-E314 HydrophobicContact CG2-CG 4.46Å; I310-E314 WeakPolarHBondContact O-CB 3.21Å; I310-E314 WeakPolarHBondContact O-CG 3.23Å; I310-E314 PolarHBondContact O-N 3.16Å
311	D	98.1	Very high	95.5	Very high	16 Å²	16	36.9 Å²	36.9	9%	0.086	20%	0.196	C	C	.	.	H	α-helix	trans	-65.7	-27.9	-179.9	-65.9	-8.5	0	0	0	112.3	Y294 Q307 D308 S315 T316 A317	Y294-D311 HydrophobicContact CE1-CB 4.4Å; Y294-D311 WeakPolarHBondContact CE1-OD2 3.28Å; Y294-D311 PolarHBondContact OH-OD2 3.03Å; Q307-D311 PolarHBondContact NE2-OD1 3.35Å; Q307-D311 WeakPolarHBondContact O-CB 3.12Å; Q307-D311 PolarHBondContact O-N 3.44Å; D308-D311 PolarHBondContact O-N 3.12Å; D311-S315 CarbonylContact O-C 3.59Å; D311-S315 PolarHBondContact O-N 2.82Å; D311-T316 PolarHBondContact O-N 3.23Å; D311-A317 HydrophobicContact CB-CB 3.78Å; D311-A317 PolarHBondContact O-N 3.15Å
312	I	96.7	Very high	96.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.3	-49.9	176.2	-70.7	166.4	0	0	0	110.5	E258 L259 V262 Y304 D308 L309 I310 E314 S315 A317	E258-I312 HydrophobicContact CB-CG2 3.83Å; L259-I312 HydrophobicContact CD1-CD1 4.15Å; V262-I312 HydrophobicContact CB-CD1 4.36Å; V262-I312 HydrophobicContact CB-CG1 4.38Å; V262-I312 HydrophobicContact CG1-CD1 3.91Å; V262-I312 HydrophobicContact CG1-CG1 4.17Å; V262-I312 HydrophobicContact CG2-CD1 4.46Å; V262-I312 HydrophobicContact CG2-CG1 3.95Å; V262-I312 HydrophobicContact CG2-CG2 4.23Å; Y304-I312 HydrophobicContact CD1-CD1 4.04Å; Y304-I312 HydrophobicContact CE1-CD1 3.99Å; D308-I312 WeakPolarHBondContact O-CB 3.28Å; D308-I312 WeakPolarHBondContact O-CD1 3.44Å; D308-I312 WeakPolarHBondContact O-CG1 3.28Å; D308-I312 PolarHBondContact O-N 2.84Å; L309-I312 HydrophobicContact CD2-CD1 4.31Å; L309-I312 PolarHBondContact O-N 3.27Å; I310-I312 PolarHBondContact O-N 3.33Å; I312-E314 VanDerWaalsContact C-N 3.28Å; I312-E314 PolarHBondContact O-N 3.27Å; I312-S315 PolarHBondContact O-N 2.65Å; I312-A317 HydrophobicContact CG1-CB 3.93Å
313	V	95.6	Very high	96.8	Very high	55 Å²	55	39.9 Å²	39.9	33%	0.333	20%	0.204	S	C	.	.	H	α-helix	trans	-66.2	-33.5	179.3	70.2	0	0	0	0	111.7	F221 L309 I310 S315	F221-V313 HydrophobicContact CD1-CG1 3.86Å; F221-V313 HydrophobicContact CD2-CB 4.21Å; F221-V313 HydrophobicContact CD2-CG1 3.93Å; F221-V313 HydrophobicContact CD2-CG2 4.12Å; F221-V313 HydrophobicContact CE1-CG1 3.92Å; F221-V313 HydrophobicContact CE2-CB 3.94Å; F221-V313 HydrophobicContact CE2-CG1 4Å; F221-V313 HydrophobicContact CE2-CG2 4.12Å; F221-V313 HydrophobicContact CG-CG1 3.85Å; F221-V313 HydrophobicContact CZ-CB 4.09Å; F221-V313 HydrophobicContact CZ-CG1 3.99Å; L309-V313 PolarHBondContact O-N 2.79Å; L309-V313 VanDerWaalsContact O-N 3.14Å; I310-V313 WeakPolarHBondContact O-CG1 3.2Å; I310-V313 PolarHBondContact O-N 3.01Å; V313-S315 PolarHBondContact O-N 3Å
314	E	95.9	Very high	97	Very high	122 Å²	122	39.6 Å²	39.6	57%	0.57	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	0.7	173.9	-66.8	177.7	175.8	0	0	113.2	I310 I312 T316	I310-E314 HydrophobicContact CG2-CG 4.46Å; I310-E314 WeakPolarHBondContact O-CB 3.21Å; I310-E314 WeakPolarHBondContact O-CG 3.23Å; I310-E314 PolarHBondContact O-N 3.16Å; I312-E314 VanDerWaalsContact C-N 3.28Å; I312-E314 PolarHBondContact O-N 3.27Å; E314-T316 PolarHBondContact O-N 3.38Å
315	S	96	Very high	97	Very high	50 Å²	50	40.1 Å²	40.1	35%	0.35	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	2.7	-174.8	-62.5	0	0	0	0	115.7	D311 I312 V313 S318 N319	D311-S315 CarbonylContact O-C 3.59Å; D311-S315 PolarHBondContact O-N 2.82Å; I312-S315 PolarHBondContact O-N 2.65Å; V313-S315 PolarHBondContact O-N 3Å; S315-S318 PolarHBondContact O-N 3.13Å; S315-N319 WeakPolarHBondContact O-CB 3.44Å; S315-N319 VanDerWaalsContact O-CG 3.22Å; S315-N319 PolarHBondContact O-N 3.07Å; S315-N319 PolarHBondContact O-ND2 2.93Å; S315-N319 VanDerWaalsContact O-ND2 3.07Å
316	T	97.2	Very high	97	Very high	68 Å²	68	44.5 Å²	44.5	42%	0.417	23%	0.227	S	C	.	.	H	α-helix	trans	-58.8	-47.9	176.2	-60.6	0	0	0	0	111.2	D311 E314 H320	D311-T316 PolarHBondContact O-N 3.23Å; E314-T316 PolarHBondContact O-N 3.38Å; T316-H320 WeakPolarHBondContact O-CB 3.47Å; T316-H320 PolarHBondContact O-N 2.87Å; T316-H320 VanDerWaalsContact O-N 3.09Å
317	A	96.6	Very high	97	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-50	177.7	0	0	0	0	0	110.8	Y294 D311 I312 N319 H320 L321	Y294-A317 HydrophobicContact CE1-CB 4.11Å; D311-A317 HydrophobicContact CB-CB 3.78Å; D311-A317 PolarHBondContact O-N 3.15Å; I312-A317 HydrophobicContact CG1-CB 3.93Å; A317-N319 VanDerWaalsContact C-N 3.32Å; A317-N319 PolarHBondContact O-N 3.32Å; A317-H320 PolarHBondContact O-N 3.22Å; A317-H320 VanDerWaalsContact O-N 3.14Å; A317-L321 WeakPolarHBondContact O-CB 3.46Å; A317-L321 WeakPolarHBondContact O-CG 3.43Å; A317-L321 PolarHBondContact O-N 3.47Å
318	S	96	Very high	96.9	Very high	17 Å²	17	43.7 Å²	43.7	12%	0.119	23%	0.225	C	C	.	.	H	α-helix	trans	-55.7	-45.7	-179.7	-60.9	0	0	0	0	112.5	V262 S315 L321 K322	V262-S318 WeakPolarHBondContact CG2-OG 3.4Å; S315-S318 PolarHBondContact O-N 3.13Å; S318-L321 PolarHBondContact O-N 3.37Å; S318-K322 WeakPolarHBondContact O-CB 3.27Å; S318-K322 PolarHBondContact O-N 3.06Å
319	N	97.3	Very high	96.9	Very high	94 Å²	94	44.6 Å²	44.6	50%	0.503	23%	0.234	S	C	.	.	H	α-helix	trans	-64.7	-41.7	178.1	-73.8	-32.4	0	0	0	112.5	S315 A317 K323	S315-N319 WeakPolarHBondContact O-CB 3.44Å; S315-N319 VanDerWaalsContact O-CG 3.22Å; S315-N319 PolarHBondContact O-N 3.07Å; S315-N319 PolarHBondContact O-ND2 2.93Å; S315-N319 VanDerWaalsContact O-ND2 3.07Å; A317-N319 VanDerWaalsContact C-N 3.32Å; A317-N319 PolarHBondContact O-N 3.32Å; N319-K323 WeakPolarHBondContact O-CG 3.2Å; N319-K323 PolarHBondContact O-N 3.31Å
320	H	97.4	Very high	96.8	Very high	55 Å²	55	48.9 Å²	48.9	26%	0.255	25%	0.254	S	S	.	.	H	α-helix	trans	-67	-44.8	177.8	-179.9	93	0	0	0	112	R290 R292 Y294 T316 A317 K323 T324	R290-H320 PolarHBondContact O-CE1 3.48Å; R290-H320 PolarHBondContact O-NE2 2.88Å; R292-H320 PolarHBondContact O-CE1 3.45Å; Y294-H320 AromaticContact CD2-CD2 3.45Å; Y294-H320 VanDerWaalsContact CD2-CD2 3.45Å; Y294-H320 WeakPolarHBondContact CD2-CD2 3.49Å; Y294-H320 AromaticContact CD2-NE2 3.97Å; Y294-H320 HydrophobicContact CE2-CB 4.03Å; Y294-H320 AromaticContact CE2-CD2 3.63Å; Y294-H320 AromaticContact CE2-CG 3.85Å; T316-H320 WeakPolarHBondContact O-CB 3.47Å; T316-H320 PolarHBondContact O-N 2.87Å; T316-H320 VanDerWaalsContact O-N 3.09Å; A317-H320 PolarHBondContact O-N 3.22Å; A317-H320 VanDerWaalsContact O-N 3.14Å; H320-K323 PolarHBondContact O-N 3.47Å; H320-T324 WeakPolarHBondContact O-CB 3.48Å; H320-T324 PolarHBondContact O-N 3.31Å; H320-T324 PolarHBondContact O-OG1 3.22Å
321	L	97.3	Very high	96.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-42	179.4	-64.7	174	0	0	0	111.5	V262 M265 L269 L291 Y294 F297 A317 S318 T324 L325	V262-L321 HydrophobicContact CG1-CD1 3.88Å; V262-L321 HydrophobicContact CG2-CD1 4.34Å; M265-L321 HydrophobicContact CB-CB 4.36Å; M265-L321 HydrophobicContact CB-CD1 4.42Å; M265-L321 HydrophobicContact CE-CB 4.32Å; M265-L321 HydrophobicContact CE-CD1 4.41Å; M265-L321 HydrophobicContact SD-CB 3.82Å; L269-L321 HydrophobicContact CD1-CD2 3.72Å; L291-L321 HydrophobicContact CD2-CD2 4.29Å; Y294-L321 HydrophobicContact CD2-CD2 4.32Å; Y294-L321 HydrophobicContact CG-CD2 4.45Å; F297-L321 HydrophobicContact CD2-CD1 4Å; F297-L321 HydrophobicContact CD2-CD2 3.98Å; F297-L321 HydrophobicContact CE2-CD1 3.9Å; F297-L321 HydrophobicContact CE2-CD2 4.46Å; A317-L321 WeakPolarHBondContact O-CB 3.46Å; A317-L321 WeakPolarHBondContact O-CG 3.43Å; A317-L321 PolarHBondContact O-N 3.47Å; S318-L321 PolarHBondContact O-N 3.37Å; L321-T324 PolarHBondContact O-N 3.29Å; L321-L325 WeakPolarHBondContact O-CB 3.33Å; L321-L325 WeakPolarHBondContact O-CG 3.25Å; L321-L325 PolarHBondContact O-N 2.96Å
322	K	97.3	Very high	96.7	Very high	128 Å²	128	47.3 Å²	47.3	56%	0.557	25%	0.245	S	C	*	.	H	α-helix	trans	-59.2	-51	176.7	-175.2	175.3	179.5	179.5	0	112	M265 S318 T324 L325 D326	M265-K322 HydrophobicContact SD-CB 4.17Å; S318-K322 WeakPolarHBondContact O-CB 3.27Å; S318-K322 PolarHBondContact O-N 3.06Å; K322-T324 PolarHBondContact O-N 3.29Å; K322-L325 WeakPolarHBondContact O-CB 3.33Å; K322-L325 PolarHBondContact O-N 2.79Å; K322-D326 VanDerWaalsContact O-CG 3.26Å; K322-D326 PolarHBondContact O-N 3.33Å
323	K	97.2	Very high	96.7	Very high	148 Å²	148	51.3 Å²	51.3	64%	0.643	26%	0.263	S	S	*	.	H	α-helix	trans	-57.9	-37.6	176.2	-70.9	175.3	-178	-179.7	0	112.4	N319 H320 T327	N319-K323 WeakPolarHBondContact O-CG 3.2Å; N319-K323 PolarHBondContact O-N 3.31Å; H320-K323 PolarHBondContact O-N 3.47Å; K323-T327 PolarHBondContact O-N 3.05Å; K323-T327 VanDerWaalsContact O-N 3.09Å; K323-T327 PolarHBondContact O-OG1 3.45Å
324	T	96.6	Very high	96.6	Very high	6 Å²	6	56 Å²	56	4%	0.037	28%	0.281	C	S	.	.	H	α-helix	trans	-73.2	-39.7	179.6	-53.8	0	0	0	0	111.7	L291 H320 L321 K322 T327 F328	L291-T324 HydrophobicContact CD2-CG2 3.45Å; L291-T324 VanDerWaalsContact CD2-CG2 3.45Å; L291-T324 HydrophobicContact CG-CG2 3.77Å; H320-T324 WeakPolarHBondContact O-CB 3.48Å; H320-T324 PolarHBondContact O-N 3.31Å; H320-T324 PolarHBondContact O-OG1 3.22Å; L321-T324 PolarHBondContact O-N 3.29Å; K322-T324 PolarHBondContact O-N 3.29Å; T324-T327 WeakPolarHBondContact O-CB 3.31Å; T324-T327 PolarHBondContact O-N 3.2Å; T324-F328 HydrophobicContact CG2-CD1 4.17Å; T324-F328 HydrophobicContact CG2-CD2 4.34Å; T324-F328 HydrophobicContact CG2-CE1 3.67Å; T324-F328 HydrophobicContact CG2-CE2 3.9Å; T324-F328 HydrophobicContact CG2-CG 4.49Å; T324-F328 HydrophobicContact CG2-CZ 3.53Å; T324-F328 WeakPolarHBondContact O-CB 3.44Å; T324-F328 WeakPolarHBondContact O-CD1 3.47Å; T324-F328 VanDerWaalsContact O-CG 3.28Å; T324-F328 WeakPolarHBondContact O-CG 3.41Å; T324-F328 PolarHBondContact O-N 3.33Å
325	L	96.9	Very high	96.5	Very high	12 Å²	12	55 Å²	55	6%	0.063	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-44.4	171.7	-82.1	168.9	0	0	0	111.6	M265 Q268 L269 M272 L321 K322 T327 F328 A329	M265-L325 HydrophobicContact CB-CD1 3.6Å; M265-L325 HydrophobicContact CG-CD1 3.45Å; M265-L325 VanDerWaalsContact CG-CD1 3.45Å; M265-L325 HydrophobicContact SD-CD1 4.01Å; Q268-L325 HydrophobicContact CB-CD2 3.71Å; L269-L325 HydrophobicContact CD2-CD2 3.55Å; L269-L325 HydrophobicContact CD2-CG 3.86Å; L269-L325 HydrophobicContact CG-CD2 3.72Å; L269-L325 HydrophobicContact CG-CG 4.06Å; M272-L325 HydrophobicContact CE-CD2 3.83Å; M272-L325 HydrophobicContact SD-CD2 3.65Å; L321-L325 WeakPolarHBondContact O-CB 3.33Å; L321-L325 WeakPolarHBondContact O-CG 3.25Å; L321-L325 PolarHBondContact O-N 2.96Å; K322-L325 WeakPolarHBondContact O-CB 3.33Å; K322-L325 PolarHBondContact O-N 2.79Å; L325-T327 VanDerWaalsContact C-N 3.33Å; L325-T327 PolarHBondContact O-N 3.22Å; L325-F328 PolarHBondContact O-N 3.14Å; L325-A329 VanDerWaalsContact O-CB 3.26Å; L325-A329 WeakPolarHBondContact O-CB 3.32Å; L325-A329 PolarHBondContact O-N 2.91Å
326	D	97	Very high	96.5	Very high	94 Å²	94	53 Å²	53	50%	0.503	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-44.8	177	-64.8	-27.7	0	0	0	110.7	K322 F328 A329 Q330	K322-D326 VanDerWaalsContact O-CG 3.26Å; K322-D326 PolarHBondContact O-N 3.33Å; D326-F328 VanDerWaalsContact C-N 3.35Å; D326-F328 PolarHBondContact O-N 3.27Å; D326-A329 PolarHBondContact O-N 2.91Å; D326-Q330 VanDerWaalsContact O-CB 3.32Å; D326-Q330 WeakPolarHBondContact O-CB 3.43Å; D326-Q330 PolarHBondContact O-N 2.69Å
327	T	96.6	Very high	96.3	Very high	26 Å²	26	55.6 Å²	55.6	16%	0.16	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-44.3	175.3	-55.1	0	0	0	0	111.5	L287 K323 T324 L325 H331	L287-T327 HydrophobicContact CD2-CG2 4.31Å; K323-T327 PolarHBondContact O-N 3.05Å; K323-T327 VanDerWaalsContact O-N 3.09Å; K323-T327 PolarHBondContact O-OG1 3.45Å; T324-T327 WeakPolarHBondContact O-CB 3.31Å; T324-T327 PolarHBondContact O-N 3.2Å; L325-T327 VanDerWaalsContact C-N 3.33Å; L325-T327 PolarHBondContact O-N 3.22Å; T327-H331 PolarHBondContact O-N 2.88Å
328	F	97.1	Very high	96	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.009	29%	0.294	C	S	.	.	H	α-helix	trans	-69.9	-40.7	-179.4	-70.8	0.6	0	0	0	111.8	L269 M272 L276 L287 L291 T324 L325 D326 H331 I332	L269-F328 HydrophobicContact CD2-CD2 3.66Å; L269-F328 HydrophobicContact CD2-CE2 3.72Å; M272-F328 HydrophobicContact CE-CB 4.45Å; M272-F328 HydrophobicContact SD-CB 3.49Å; M272-F328 WeakPolarHBondContact SD-CB 3.42Å; M272-F328 HydrophobicContact SD-CD2 4.04Å; M272-F328 HydrophobicContact SD-CG 4.31Å; L276-F328 HydrophobicContact CD1-CB 4.41Å; L276-F328 HydrophobicContact CD1-CD1 3.98Å; L276-F328 HydrophobicContact CD1-CD2 3.42Å; L276-F328 VanDerWaalsContact CD1-CD2 3.42Å; L276-F328 HydrophobicContact CD1-CE1 4.02Å; L276-F328 HydrophobicContact CD1-CE2 3.43Å; L276-F328 VanDerWaalsContact CD1-CE2 3.43Å; L276-F328 HydrophobicContact CD1-CG 3.69Å; L276-F328 HydrophobicContact CD1-CZ 3.75Å; L287-F328 HydrophobicContact CB-CD1 4.38Å; L287-F328 HydrophobicContact CB-CE1 3.86Å; L287-F328 VanDerWaalsContact O-CE1 3.26Å; L287-F328 WeakPolarHBondContact O-CE1 3.19Å; L287-F328 WeakPolarHBondContact O-CZ 3.43Å; L291-F328 HydrophobicContact CD1-CE2 3.82Å; L291-F328 HydrophobicContact CD1-CZ 3.97Å; L291-F328 HydrophobicContact CD2-CE2 4.37Å; L291-F328 HydrophobicContact CG-CE2 4.02Å; L291-F328 HydrophobicContact CG-CZ 3.86Å; T324-F328 HydrophobicContact CG2-CD1 4.17Å; T324-F328 HydrophobicContact CG2-CD2 4.34Å; T324-F328 HydrophobicContact CG2-CE1 3.67Å; T324-F328 HydrophobicContact CG2-CE2 3.9Å; T324-F328 HydrophobicContact CG2-CG 4.49Å; T324-F328 HydrophobicContact CG2-CZ 3.53Å; T324-F328 WeakPolarHBondContact O-CB 3.44Å; T324-F328 WeakPolarHBondContact O-CD1 3.47Å; T324-F328 VanDerWaalsContact O-CG 3.28Å; T324-F328 WeakPolarHBondContact O-CG 3.41Å; T324-F328 PolarHBondContact O-N 3.33Å; L325-F328 PolarHBondContact O-N 3.14Å; D326-F328 VanDerWaalsContact C-N 3.35Å; D326-F328 PolarHBondContact O-N 3.27Å; F328-H331 PolarHBondContact O-N 2.83Å; F328-I332 WeakPolarHBondContact O-CB 3.3Å; F328-I332 WeakPolarHBondContact O-CD1 2.94Å; F328-I332 WeakPolarHBondContact O-CG1 3.2Å; F328-I332 PolarHBondContact O-N 3.29Å
329	A	96.6	Very high	96	Very high	25 Å²	25	58 Å²	58	21%	0.207	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-43.8	176.1	0	0	0	0	0	111.1	M272 L325 D326 I332 K333	M272-A329 HydrophobicContact CE-CB 4.05Å; L325-A329 VanDerWaalsContact O-CB 3.26Å; L325-A329 WeakPolarHBondContact O-CB 3.32Å; L325-A329 PolarHBondContact O-N 2.91Å; D326-A329 PolarHBondContact O-N 2.91Å; A329-I332 PolarHBondContact O-N 3.41Å; A329-K333 VanDerWaalsContact O-CB 3.24Å; A329-K333 WeakPolarHBondContact O-CB 3.34Å; A329-K333 WeakPolarHBondContact O-CG 3.42Å; A329-K333 PolarHBondContact O-N 2.82Å
330	Q	96.4	Very high	95.8	Very high	90 Å²	90	55.4 Å²	55.4	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-58.7	-48.9	175.2	-172.8	177.9	11.8	0	0	111.1	D326 I332 Q334 E335	D326-Q330 VanDerWaalsContact O-CB 3.32Å; D326-Q330 WeakPolarHBondContact O-CB 3.43Å; D326-Q330 PolarHBondContact O-N 2.69Å; Q330-I332 PolarHBondContact O-N 2.89Å; Q330-Q334 WeakPolarHBondContact O-CA 3.29Å; Q330-Q334 WeakPolarHBondContact O-CB 3.17Å; Q330-Q334 PolarHBondContact O-N 3.08Å; Q330-E335 HydrophobicContact CG-CG 4.15Å; Q330-E335 WeakPolarHBondContact CG-OE1 3.39Å; Q330-E335 PolarHBondContact NE2-OE1 2.83Å; Q330-E335 PolarHBondContact O-N 3.26Å; Q330-E335 VanDerWaalsContact O-N 3.14Å
331	H	97	Very high	95.5	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.009	30%	0.297	C	S	.	.	I	π-helix	trans	-59.3	-49.8	176.5	178.7	81.2	0	0	0	112.5	C279 L287 T327 F328 E335 C336	C279-H331 PolarHBondContact SG-NE2 3.4Å; C279-H331 VanDerWaalsContact SG-NE2 3.42Å; L287-H331 HydrophobicContact CD1-CB 3.85Å; L287-H331 VanDerWaalsContact CD1-CG 3.45Å; T327-H331 PolarHBondContact O-N 2.88Å; F328-H331 PolarHBondContact O-N 2.83Å; H331-E335 IonicContact ND1-OE2 2.65Å; H331-C336 VanDerWaalsContact O-CB 3.28Å; H331-C336 WeakPolarHBondContact O-CB 3.48Å; H331-C336 PolarHBondContact O-N 3.46Å
332	I	96.8	Very high	95.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.317	C	S	.	.	I	π-helix	trans	-69.2	-41.3	-173.6	-68.9	166.6	0	0	0	111.5	M272 Y275 L276 F328 A329 Q330 C339 S340 F356 F358	M272-I332 HydrophobicContact CB-CD1 3.88Å; M272-I332 HydrophobicContact CG-CD1 3.83Å; M272-I332 HydrophobicContact SD-CD1 4.45Å; Y275-I332 HydrophobicContact CD1-CG2 4.2Å; Y275-I332 HydrophobicContact CG-CD1 4.33Å; Y275-I332 HydrophobicContact CG-CG2 4.4Å; L276-I332 HydrophobicContact CD2-CD1 4.27Å; L276-I332 HydrophobicContact CD2-CG1 4.21Å; L276-I332 HydrophobicContact CG-CD1 4.44Å; F328-I332 WeakPolarHBondContact O-CB 3.3Å; F328-I332 WeakPolarHBondContact O-CD1 2.94Å; F328-I332 WeakPolarHBondContact O-CG1 3.2Å; F328-I332 PolarHBondContact O-N 3.29Å; A329-I332 PolarHBondContact O-N 3.41Å; Q330-I332 PolarHBondContact O-N 2.89Å; I332-C339 HydrophobicContact CB-CB 4.24Å; I332-C339 HydrophobicContact CG1-CB 4.3Å; I332-C339 HydrophobicContact CG2-CB 4.16Å; I332-C339 CarbonylContact O-C 3.45Å; I332-S340 WeakPolarHBondContact O-CA 3.38Å; I332-S340 PolarHBondContact O-N 3.1Å; I332-S340 VanDerWaalsContact O-N 3.15Å; I332-F356 HydrophobicContact CG2-CD1 3.72Å; I332-F356 HydrophobicContact CG2-CE1 3.53Å; I332-F356 HydrophobicContact CG2-CZ 4.21Å; I332-F358 HydrophobicContact CB-CZ 4.28Å; I332-F358 HydrophobicContact CD1-CE1 4Å; I332-F358 HydrophobicContact CD1-CZ 4.14Å; I332-F358 HydrophobicContact CG2-CE1 4.04Å; I332-F358 HydrophobicContact CG2-CZ 3.77Å
333	K	95.5	Very high	95.1	Very high	84 Å²	84	54.6 Å²	54.6	37%	0.365	30%	0.302	S	S	.	.	I	π-helix	trans	-91.1	-32.9	-171.8	-63.7	-172.8	173.5	-177.7	0	113.9	A329 F356 D359	A329-K333 VanDerWaalsContact O-CB 3.24Å; A329-K333 WeakPolarHBondContact O-CB 3.34Å; A329-K333 WeakPolarHBondContact O-CG 3.42Å; A329-K333 PolarHBondContact O-N 2.82Å; K333-F356 HydrophobicContact CB-CE2 4.5Å; K333-F356 HydrophobicContact CD-CD2 4.28Å; K333-F356 HydrophobicContact CD-CE2 4.36Å; K333-F356 HydrophobicContact CG-CD2 3.97Å; K333-F356 HydrophobicContact CG-CE2 3.73Å; K333-F356 HydrophobicContact CG-CZ 4.24Å; K333-D359 WeakPolarHBondContact CE-OD1 3.26Å; K333-D359 IonicContact NZ-OD1 3.05Å; K333-D359 PolarHBondContact NZ-OD1 3.42Å; K333-D359 IonicContact NZ-OD2 2.69Å
334	Q	93.7	Very high	94.9	Very high	153 Å²	153	50.2 Å²	50.2	72%	0.715	28%	0.281	S	S	*	.	I	π-helix	trans	-120.3	-43.7	-165	-58.9	173.4	3	0	0	113	Q330	Q330-Q334 WeakPolarHBondContact O-CA 3.29Å; Q330-Q334 WeakPolarHBondContact O-CB 3.17Å; Q330-Q334 PolarHBondContact O-N 3.08Å
335	E	94.4	Very high	94.7	Very high	101 Å²	101	54 Å²	54	47%	0.472	30%	0.3	S	S	.	.	I	π-helix	trans	-89.9	-36.3	-169.7	-58.1	175.5	169	0	0	113.6	Q330 H331	Q330-E335 HydrophobicContact CG-CG 4.15Å; Q330-E335 WeakPolarHBondContact CG-OE1 3.39Å; Q330-E335 PolarHBondContact NE2-OE1 2.83Å; Q330-E335 PolarHBondContact O-N 3.26Å; Q330-E335 VanDerWaalsContact O-N 3.14Å; H331-E335 IonicContact ND1-OE2 2.65Å
336	C	95.3	Very high	94.6	Very high	8 Å²	8	53.5 Å²	53.5	5%	0.054	30%	0.298	C	S	.	.			trans	-108.4	109.3	-170.8	-175.2	0	0	0	0	112.5	C279 H331 I338 C339 S340	C279-C336 PolarHBondContact SG-SG 2.85Å; H331-C336 VanDerWaalsContact O-CB 3.28Å; H331-C336 WeakPolarHBondContact O-CB 3.48Å; H331-C336 PolarHBondContact O-N 3.46Å; C336-I338 PolarHBondContact O-N 3.14Å; C336-C339 HydrophobicContact CB-CB 3.99Å; C336-C339 PolarHBondContact O-N 3.25Å; C336-C339 VanDerWaalsContact O-N 3.09Å; C336-S340 PolarHBondContact O-N 3.49Å; C336-S340 PolarHBondContact O-OG 3Å
337	V	92.9	Very high	94.3	Very high	123 Å²	123	51.7 Å²	51.7	75%	0.745	29%	0.286	S	S	*	.	H	α-helix	trans	-57.5	-33	177	-176.1	0	0	0	0	112.6	S340 G341	V337-S340 WeakPolarHBondContact CA-OG 3.46Å; V337-S340 PolarHBondContact O-OG 2.9Å; V337-G341 PolarHBondContact O-N 3.01Å
338	I	91.7	Very high	94.1	Very high	67 Å²	67	53.5 Å²	53.5	34%	0.344	29%	0.292	S	S	.	.	H	α-helix	trans	-67.9	-44.6	178.1	-56	170.8	0	0	0	110.3	R280 C336 N342	R280-I338 HydrophobicContact CG-CD1 3.97Å; C336-I338 PolarHBondContact O-N 3.14Å; I338-N342 PolarHBondContact O-ND2 3.35Å
339	C	95	Very high	93.8	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.007	31%	0.311	C	S	.	.	H	α-helix	trans	-71.9	-43.4	179.9	-68.8	0	0	0	0	111.3	C279 I332 C336 G341 N342	C279-C339 VanDerWaalsContact CB-SG 3.52Å; I332-C339 HydrophobicContact CB-CB 4.24Å; I332-C339 HydrophobicContact CG1-CB 4.3Å; I332-C339 HydrophobicContact CG2-CB 4.16Å; I332-C339 CarbonylContact O-C 3.45Å; C336-C339 HydrophobicContact CB-CB 3.99Å; C336-C339 PolarHBondContact O-N 3.25Å; C336-C339 VanDerWaalsContact O-N 3.09Å; C339-G341 VanDerWaalsContact C-N 3.31Å; C339-G341 PolarHBondContact O-N 3.25Å; C339-N342 PolarHBondContact O-N 2.89Å; C339-N342 VanDerWaalsContact O-N 3.13Å
340	S	93.2	Very high	92.9	Very high	39 Å²	39	62.7 Å²	62.7	27%	0.273	34%	0.337	S	S	.	.	H	α-helix	trans	-66.5	-34.9	-177.9	65.9	0	0	0	0	112	I332 C336 V337 N342 G343	I332-S340 WeakPolarHBondContact O-CA 3.38Å; I332-S340 PolarHBondContact O-N 3.1Å; I332-S340 VanDerWaalsContact O-N 3.15Å; C336-S340 PolarHBondContact O-N 3.49Å; C336-S340 PolarHBondContact O-OG 3Å; V337-S340 WeakPolarHBondContact CA-OG 3.46Å; V337-S340 PolarHBondContact O-OG 2.9Å; S340-N342 PolarHBondContact O-N 2.74Å; S340-G343 PolarHBondContact O-N 3.42Å
341	G	91.4	Very high	92.4	Very high	63 Å²	63	61.8 Å²	61.8	65%	0.649	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.8	173.7	0	0	0	0	0	115.1	V337 C339 G343	V337-G341 PolarHBondContact O-N 3.01Å; C339-G341 VanDerWaalsContact C-N 3.31Å; C339-G341 PolarHBondContact O-N 3.25Å; G341-G343 VanDerWaalsContact C-N 3.32Å
342	N	91.9	Very high	92	Very high	81 Å²	81	69.9 Å²	69.9	43%	0.433	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	7.6	176.3	-73.3	-42.3	0	0	0	113.4	Y275 I338 C339 S340	Y275-N342 HydrophobicContact CD1-CB 4.04Å; Y275-N342 HydrophobicContact CE1-CB 3.71Å; I338-N342 PolarHBondContact O-ND2 3.35Å; C339-N342 PolarHBondContact O-N 2.89Å; C339-N342 VanDerWaalsContact O-N 3.13Å; S340-N342 PolarHBondContact O-N 2.74Å
343	G	93	Very high	91.7	Very high	22 Å²	22	73 Å²	73	23%	0.227	39%	0.391	C	S	.	.			trans	-73.1	177.8	172.4	0	0	0	0	0	113.2	S340 G341	S340-G343 PolarHBondContact O-N 3.42Å; G341-G343 VanDerWaalsContact C-N 3.32Å
344	Y	93.9	Very high	91.7	Very high	56 Å²	56	72.4 Å²	72.4	22%	0.22	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-120.1	147.7	-175.7	-60.6	-93.1	0	0	0	111.1	L355 P357 W370 V371	Y344-L355 PolarHBondContact N-O 3.2Å; Y344-L355 WeakPolarHBondContact O-CB 3.39Å; Y344-L355 PolarHBondContact O-N 2.79Å; Y344-P357 HydrophobicContact CE2-CG 3.93Å; Y344-W370 AromaticContact CD1-CD2 3.71Å; Y344-W370 HydrophobicContact CD1-CD2 3.71Å; Y344-W370 AromaticContact CD1-CE2 3.96Å; Y344-W370 AromaticContact CD1-CE3 3.8Å; Y344-W370 HydrophobicContact CD1-CE3 3.8Å; Y344-W370 HydrophobicContact CD1-CG 4.1Å; Y344-W370 HydrophobicContact CD1-CH2 4.49Å; Y344-W370 HydrophobicContact CD1-CZ2 4.36Å; Y344-W370 HydrophobicContact CD1-CZ3 4.21Å; Y344-W370 HydrophobicContact CE1-CD2 4.2Å; Y344-W370 AromaticContact CE1-CE3 3.92Å; Y344-W370 HydrophobicContact CE1-CE3 3.92Å; Y344-W370 HydrophobicContact CE1-CZ3 4.38Å; Y344-V371 HydrophobicContact CD1-CB 4.39Å; Y344-V371 HydrophobicContact CD1-CG2 4.45Å; Y344-V371 HydrophobicContact CD2-CB 3.74Å; Y344-V371 HydrophobicContact CD2-CG2 3.51Å; Y344-V371 HydrophobicContact CE2-CB 4.4Å; Y344-V371 HydrophobicContact CE2-CG2 3.68Å; Y344-V371 HydrophobicContact CG-CB 3.74Å; Y344-V371 HydrophobicContact CG-CG2 3.93Å
345	I	93.1	Very high	91.7	Very high	85 Å²	85	65.6 Å²	65.6	44%	0.436	36%	0.363	S	S	.	.			trans	-105.5	137	168.8	-63.1	174.6	0	0	0	108.2	E347 D351 W370	I345-E347 PolarHBondContact O-N 2.98Å; I345-D351 WeakPolarHBondContact CG2-O 3.42Å; I345-W370 PolarHBondContact O-NE1 3.45Å; I345-W370 VanDerWaalsContact O-NE1 3.15Å
346	C	94.2	Very high	91.8	Very high	1 Å²	1	61 Å²	61	1%	0.007	34%	0.342	C	S	.	.			trans	-72.1	113.1	177.7	-173.6	0	0	0	0	110.8	F348 C349 Q350 L355 H373	C346-F348 PolarHBondContact O-N 3.42Å; C346-C349 VanDerWaalsContact SG-SG 3.7Å; C346-Q350 PolarHBondContact O-N 3.21Å; C346-L355 HydrophobicContact CB-CD1 3.88Å; C346-H373 WeakPolarHBondContact CB-ND1 3.37Å
347	E	91	Very high	91.7	Very high	56 Å²	56	61.6 Å²	61.6	26%	0.262	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-13.3	-178.6	-57.9	-172.8	164.6	0	0	114.2	I345 F372 P385 R389	I345-E347 PolarHBondContact O-N 2.98Å; E347-F372 HydrophobicContact CB-CE1 4.14Å; E347-F372 HydrophobicContact CG-CE1 4.2Å; E347-P385 HydrophobicContact CB-CG 4.38Å; E347-R389 IonicContact OE1-NH2 2.76Å; E347-R389 PolarHBondContact OE1-NH2 3.35Å; E347-R389 IonicContact OE2-CZ 3.6Å; E347-R389 IonicContact OE2-NH2 2.72Å; E347-R389 PolarHBondContact OE2-NH2 2.82Å
348	F	91.7	Very high	91.8	Very high	64 Å²	64	56.1 Å²	56.1	28%	0.281	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-49.1	-178.1	-67.6	-69.5	0	0	0	113.4	C346 F372 C376 F377 N380 P385	C346-F348 PolarHBondContact O-N 3.42Å; F348-F372 HydrophobicContact CD2-CB 4.28Å; F348-F372 AromaticContact CD2-CD1 3.61Å; F348-F372 HydrophobicContact CD2-CD1 3.61Å; F348-F372 HydrophobicContact CD2-CE1 4.27Å; F348-F372 HydrophobicContact CD2-CG 4.16Å; F348-F372 HydrophobicContact CE2-CB 4.23Å; F348-F372 AromaticContact CE2-CD1 3.54Å; F348-F372 HydrophobicContact CE2-CD1 3.54Å; F348-F372 AromaticContact CE2-CE1 3.98Å; F348-F372 HydrophobicContact CE2-CE1 3.98Å; F348-F372 AromaticContact CE2-CG 3.86Å; F348-F372 HydrophobicContact CE2-CG 3.86Å; F348-C376 HydrophobicContact CB-CB 3.71Å; F348-C376 HydrophobicContact CD2-CB 3.77Å; F348-C376 HydrophobicContact CG-CB 4.01Å; F348-F377 HydrophobicContact CE2-CB 4.5Å; F348-F377 HydrophobicContact CE2-CD2 4.09Å; F348-F377 HydrophobicContact CZ-CD2 4.44Å; F348-N380 HydrophobicContact CD1-CB 4.45Å; F348-N380 HydrophobicContact CE1-CB 3.63Å; F348-N380 WeakPolarHBondContact CE1-ND2 3.4Å; F348-N380 HydrophobicContact CZ-CB 3.8Å; F348-P385 HydrophobicContact CD1-CG 4.47Å; F348-P385 HydrophobicContact CE1-CG 3.85Å; F348-P385 HydrophobicContact CE2-CG 4.3Å; F348-P385 HydrophobicContact CZ-CG 3.78Å
349	C	90.5	Very high	92	Very high	59 Å²	59	54.7 Å²	54.7	40%	0.399	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-10.6	-176.5	59.7	0	0	0	0	113	C346 D351 H373	C346-C349 VanDerWaalsContact SG-SG 3.7Å; C349-D351 PolarHBondContact O-N 2.77Å; C349-D351 VanDerWaalsContact SG-CB 3.57Å; C349-H373 PolarHBondContact SG-ND1 2.87Å
350	Q	78	Confident	91.8	Very high	161 Å²	161	59.1 Å²	59.1	75%	0.752	33%	0.329	S	S	*	.			trans	50.7	19.1	-174.3	-59.1	-174.4	0.1	0	0	114.1	C346 Q352	C346-Q350 PolarHBondContact O-N 3.21Å; Q350-Q352 PolarHBondContact O-N 2.88Å
351	D	86.2	Confident	91.7	Very high	72 Å²	72	63.1 Å²	63.1	39%	0.385	35%	0.347	S	S	.	.			trans	-61.2	130.3	169.9	-177.6	10.1	0	0	0	108.3	I345 C349 T353 H373	I345-D351 WeakPolarHBondContact CG2-O 3.42Å; C349-D351 PolarHBondContact O-N 2.77Å; C349-D351 VanDerWaalsContact SG-CB 3.57Å; D351-T353 PolarHBondContact O-N 2.72Å; D351-T353 WeakPolarHBondContact OD1-CG2 3.38Å; D351-T353 PolarHBondContact OD1-N 3.45Å; D351-T353 VanDerWaalsContact OD2-CG2 3.32Å; D351-T353 WeakPolarHBondContact OD2-CG2 3.31Å; D351-T353 PolarHBondContact OD2-OG1 3.14Å; D351-H373 IonicContact OD2-CE1 3.33Å
352	Q	88.1	Confident	91.8	Very high	172 Å²	172	61.2 Å²	61.2	80%	0.804	32%	0.323	S	S	*	.			trans	-77.8	2.7	-177.9	-65.2	-165.3	-8.5	0	0	112.7	Q350 V354	Q350-Q352 PolarHBondContact O-N 2.88Å; Q352-V354 PolarHBondContact O-N 3.09Å
353	T	91.8	Very high	91.9	Very high	64 Å²	64	59 Å²	59	39%	0.393	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-61.1	123.2	171.3	57.3	0	0	0	0	111	D351 L355	D351-T353 PolarHBondContact O-N 2.72Å; D351-T353 WeakPolarHBondContact OD1-CG2 3.38Å; D351-T353 PolarHBondContact OD1-N 3.45Å; D351-T353 VanDerWaalsContact OD2-CG2 3.32Å; D351-T353 WeakPolarHBondContact OD2-CG2 3.31Å; D351-T353 PolarHBondContact OD2-OG1 3.14Å; T353-L355 PolarHBondContact O-N 3.48Å
354	V	93.8	Very high	92	Very high	72 Å²	72	63.9 Å²	63.9	44%	0.436	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-77.8	121.6	177.7	-177.3	0	0	0	0	109.3	Q352 F356	Q352-V354 PolarHBondContact O-N 3.09Å; V354-F356 HydrophobicContact CB-CE2 4.33Å; V354-F356 HydrophobicContact CG1-CD2 4.5Å; V354-F356 HydrophobicContact CG1-CE2 3.71Å; V354-F356 HydrophobicContact CG1-CZ 3.79Å
355	L	95.1	Very high	92	Very high	10 Å²	10	61.7 Å²	61.7	5%	0.052	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-98.7	142.1	-179.2	-53.4	-176.5	0	0	0	111.2	Y344 C346 T353 V362 V371 H373	Y344-L355 PolarHBondContact N-O 3.2Å; Y344-L355 WeakPolarHBondContact O-CB 3.39Å; Y344-L355 PolarHBondContact O-N 2.79Å; C346-L355 HydrophobicContact CB-CD1 3.88Å; T353-L355 PolarHBondContact O-N 3.48Å; L355-V362 HydrophobicContact CB-CG1 4.31Å; L355-V362 HydrophobicContact CD1-CG1 4.34Å; L355-V362 HydrophobicContact CD2-CG1 4.34Å; L355-V371 HydrophobicContact CB-CG1 4.11Å; L355-H373 VanDerWaalsContact CD2-NE2 3.32Å; L355-H373 WeakPolarHBondContact CD2-NE2 3.46Å
356	F	95.7	Very high	91.9	Very high	6 Å²	6	65.8 Å²	65.8	3%	0.026	34%	0.338	C	S	.	.			trans	-119.1	146.4	173.2	-64.9	-90.7	0	0	0	110.5	Y275 I332 K333 V354 F358 D359 V362	Y275-F356 HydrophobicContact CE1-CD1 4.03Å; Y275-F356 HydrophobicContact CE1-CE1 4.2Å; I332-F356 HydrophobicContact CG2-CD1 3.72Å; I332-F356 HydrophobicContact CG2-CE1 3.53Å; I332-F356 HydrophobicContact CG2-CZ 4.21Å; K333-F356 HydrophobicContact CB-CE2 4.5Å; K333-F356 HydrophobicContact CD-CD2 4.28Å; K333-F356 HydrophobicContact CD-CE2 4.36Å; K333-F356 HydrophobicContact CG-CD2 3.97Å; K333-F356 HydrophobicContact CG-CE2 3.73Å; K333-F356 HydrophobicContact CG-CZ 4.24Å; V354-F356 HydrophobicContact CB-CE2 4.33Å; V354-F356 HydrophobicContact CG1-CD2 4.5Å; V354-F356 HydrophobicContact CG1-CE2 3.71Å; V354-F356 HydrophobicContact CG1-CZ 3.79Å; F356-F358 HydrophobicContact CB-CD1 3.92Å; F356-F358 HydrophobicContact CB-CD2 4.22Å; F356-F358 HydrophobicContact CB-CE1 3.49Å; F356-F358 VanDerWaalsContact CB-CE1 3.49Å; F356-F358 HydrophobicContact CB-CE2 3.84Å; F356-F358 HydrophobicContact CB-CG 4.27Å; F356-F358 HydrophobicContact CB-CZ 3.44Å; F356-F358 VanDerWaalsContact CB-CZ 3.44Å; F356-F358 AromaticContact CD1-CE1 3.95Å; F356-F358 HydrophobicContact CD1-CE1 3.95Å; F356-F358 AromaticContact CD1-CZ 3.95Å; F356-F358 HydrophobicContact CD1-CZ 3.95Å; F356-F358 HydrophobicContact CD2-CZ 4.45Å; F356-F358 AromaticContact CG-CE1 3.96Å; F356-F358 HydrophobicContact CG-CE1 3.96Å; F356-F358 HydrophobicContact CG-CE2 4.35Å; F356-F358 AromaticContact CG-CZ 3.68Å; F356-F358 HydrophobicContact CG-CZ 3.68Å; F356-F358 PolarHBondContact O-N 3.05Å; F356-D359 PolarHBondContact N-OD2 3.22Å; F356-D359 WeakPolarHBondContact O-CB 3.34Å; F356-D359 PolarHBondContact O-N 3.34Å; F356-V362 WeakPolarHBondContact O-CG2 3.41Å
357	P	94.5	Very high	91.8	Very high	20 Å²	20	75.2 Å²	75.2	13%	0.13	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-23.1	-178.4	-22.8	28.4	0	0	0	115.2	L271 Y275 Y344 V371	L271-P357 HydrophobicContact CB-CB 4.45Å; L271-P357 WeakPolarHBondContact CD1-O 3.19Å; L271-P357 HydrophobicContact CD2-CB 4.18Å; Y275-P357 HydrophobicContact CE2-CG 4.41Å; Y275-P357 WeakPolarHBondContact OH-CD 3.32Å; Y344-P357 HydrophobicContact CE2-CG 3.93Å; P357-V371 HydrophobicContact CB-CG2 4.11Å; P357-V371 HydrophobicContact CG-CG2 3.76Å
358	F	94.4	Very high	91.8	Very high	7 Å²	7	74.1 Å²	74.1	3%	0.031	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	3	-176.6	54	-102.4	0	0	0	114.2	Q268 L271 M272 Y275 I332 F356	Q268-F358 HydrophobicContact CB-CB 4.27Å; Q268-F358 HydrophobicContact CG-CB 4.43Å; Q268-F358 PolarHBondContact NE2-O 3.25Å; L271-F358 HydrophobicContact CB-CB 3.96Å; L271-F358 HydrophobicContact CD1-CB 4.39Å; M272-F358 HydrophobicContact CB-CD1 4.47Å; M272-F358 HydrophobicContact CE-CB 4.45Å; M272-F358 HydrophobicContact CE-CD1 4.31Å; M272-F358 HydrophobicContact CE-CD2 3.35Å; M272-F358 HydrophobicContact CE-CE1 4.41Å; M272-F358 HydrophobicContact CE-CE2 3.45Å; M272-F358 VanDerWaalsContact CE-CE2 3.45Å; M272-F358 HydrophobicContact CE-CG 3.8Å; M272-F358 HydrophobicContact CE-CZ 4.01Å; M272-F358 HydrophobicContact CG-CB 4.27Å; M272-F358 HydrophobicContact CG-CD1 3.46Å; M272-F358 VanDerWaalsContact CG-CD1 3.46Å; M272-F358 HydrophobicContact CG-CD2 4.25Å; M272-F358 HydrophobicContact CG-CE1 3.74Å; M272-F358 HydrophobicContact CG-CE2 4.45Å; M272-F358 HydrophobicContact CG-CG 3.74Å; M272-F358 HydrophobicContact CG-CZ 4.23Å; Y275-F358 HydrophobicContact CD2-CE1 4.47Å; Y275-F358 HydrophobicContact CE2-CE1 4.32Å; I332-F358 HydrophobicContact CB-CZ 4.28Å; I332-F358 HydrophobicContact CD1-CE1 4Å; I332-F358 HydrophobicContact CD1-CZ 4.14Å; I332-F358 HydrophobicContact CG2-CE1 4.04Å; I332-F358 HydrophobicContact CG2-CZ 3.77Å; F356-F358 HydrophobicContact CB-CD1 3.92Å; F356-F358 HydrophobicContact CB-CD2 4.22Å; F356-F358 HydrophobicContact CB-CE1 3.49Å; F356-F358 VanDerWaalsContact CB-CE1 3.49Å; F356-F358 HydrophobicContact CB-CE2 3.84Å; F356-F358 HydrophobicContact CB-CG 4.27Å; F356-F358 HydrophobicContact CB-CZ 3.44Å; F356-F358 VanDerWaalsContact CB-CZ 3.44Å; F356-F358 AromaticContact CD1-CE1 3.95Å; F356-F358 HydrophobicContact CD1-CE1 3.95Å; F356-F358 AromaticContact CD1-CZ 3.95Å; F356-F358 HydrophobicContact CD1-CZ 3.95Å; F356-F358 HydrophobicContact CD2-CZ 4.45Å; F356-F358 AromaticContact CG-CE1 3.96Å; F356-F358 HydrophobicContact CG-CE1 3.96Å; F356-F358 HydrophobicContact CG-CE2 4.35Å; F356-F358 AromaticContact CG-CZ 3.68Å; F356-F358 HydrophobicContact CG-CZ 3.68Å; F356-F358 PolarHBondContact O-N 3.05Å
359	D	94.8	Very high	91.8	Very high	37 Å²	37	72.2 Å²	72.2	20%	0.198	37%	0.37	C	S	.	.	S	Bend	trans	-72.7	152.8	173.9	-67	-31.7	0	0	0	111.6	K333 F356 V362	K333-D359 WeakPolarHBondContact CE-OD1 3.26Å; K333-D359 IonicContact NZ-OD1 3.05Å; K333-D359 PolarHBondContact NZ-OD1 3.42Å; K333-D359 IonicContact NZ-OD2 2.69Å; F356-D359 PolarHBondContact N-OD2 3.22Å; F356-D359 WeakPolarHBondContact O-CB 3.34Å; F356-D359 PolarHBondContact O-N 3.34Å; D359-V362 HydrophobicContact CB-CG1 3.74Å; D359-V362 HydrophobicContact CB-CG2 4.13Å; D359-V362 WeakPolarHBondContact O-CG2 3.36Å
360	D	90.5	Very high	92	Very high	95 Å²	95	72 Å²	72	51%	0.508	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-32.7	-172.4	-81.4	-19.8	0	0	0	114	K264	K264-D360 WeakPolarHBondContact CE-OD1 3Å; K264-D360 IonicContact NZ-OD1 3.58Å; K264-D360 PolarHBondContact NZ-OD1 3.46Å; K264-D360 IonicContact NZ-OD2 3.54Å; K264-D360 PolarHBondContact NZ-OD2 3.34Å
361	N	91.8	Very high	92.8	Very high	123 Å²	123	64.3 Å²	64.3	66%	0.658	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	33	-171.6	-68.9	-37.5	0	0	0	113.1	R374	N361-R374 PolarHBondContact O-N 3.25Å
362	V	94.6	Very high	93.2	Very high	23 Å²	23	60.9 Å²	60.9	14%	0.139	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	154	-179.4	-52.4	0	0	0	0	111.7	L355 F356 D359 V371 F372	L355-V362 HydrophobicContact CB-CG1 4.31Å; L355-V362 HydrophobicContact CD1-CG1 4.34Å; L355-V362 HydrophobicContact CD2-CG1 4.34Å; F356-V362 WeakPolarHBondContact O-CG2 3.41Å; D359-V362 HydrophobicContact CB-CG1 3.74Å; D359-V362 HydrophobicContact CB-CG2 4.13Å; D359-V362 WeakPolarHBondContact O-CG2 3.36Å; V362-V371 HydrophobicContact CB-CG1 3.63Å; V362-V371 HydrophobicContact CG1-CG1 4.17Å; V362-V371 HydrophobicContact CG2-CG1 3.81Å; V362-F372 CarbonylContact C-O 3.41Å; V362-F372 WeakPolarHBondContact CA-O 3.25Å; V362-F372 WeakPolarHBondContact CB-O 3.46Å
363	T	94	Very high	93.6	Very high	33 Å²	33	54.6 Å²	54.6	20%	0.202	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.6	175	-60.2	0	0	0	0	109	F372 R374 F377	T363-F372 PolarHBondContact N-O 2.82Å; T363-F372 PolarHBondContact O-N 2.97Å; T363-R374 WeakPolarHBondContact OG1-CA 3.27Å; T363-R374 WeakPolarHBondContact OG1-CB 3.48Å; T363-R374 WeakPolarHBondContact OG1-CG 3.44Å; T363-F377 HydrophobicContact CG2-CD1 3.59Å; T363-F377 HydrophobicContact CG2-CE1 3.89Å; T363-F377 HydrophobicContact CG2-CG 4.24Å
364	R	93.7	Very high	93.7	Very high	126 Å²	126	58.2 Å²	58.2	48%	0.475	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.5	174.6	-172	177.4	66.4	-162.4	-2.4	110.4	L366 G369 W370 V371	R364-L366 PolarHBondContact O-N 2.9Å; R364-G369 WeakPolarHBondContact CG-O 3.27Å; R364-W370 CarbonylContact C-O 3.53Å; R364-W370 WeakPolarHBondContact CA-O 3.46Å; R364-V371 HydrophobicContact CG-CG2 4.41Å
365	C	94.3	Very high	93.7	Very high	9 Å²	9	59.2 Å²	59.2	6%	0.061	29%	0.29	C	S	.	.			trans	-63.4	124.6	171.3	177.2	0	0	0	0	110.6	R367 C368 G369 W370 F372 C384 C387	C365-R367 PolarHBondContact O-N 3.47Å; C365-R367 PolarHBondContact SG-N 3.01Å; C365-C368 VanDerWaalsContact SG-SG 3.68Å; C365-G369 VanDerWaalsContact O-CA 3.28Å; C365-G369 WeakPolarHBondContact O-CA 3.42Å; C365-G369 PolarHBondContact O-N 3.26Å; C365-W370 PolarHBondContact N-O 3.18Å; C365-F372 HydrophobicContact CB-CE2 4.13Å; C365-C384 HydrophobicContact CB-CB 4.29Å; C365-C384 VanDerWaalsContact SG-CB 3.59Å; C365-C387 VanDerWaalsContact SG-SG 3.61Å
366	L	91.3	Very high	93.7	Very high	171 Å²	171	59.9 Å²	59.9	90%	0.895	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-21.2	-179.7	-60	179.8	0	0	0	113.7	R364	R364-L366 PolarHBondContact O-N 2.9Å
367	R	91.5	Very high	93.6	Very high	200 Å²	200	60.7 Å²	60.7	76%	0.755	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-50.4	-178.7	-172.2	-177.1	-64.4	-168.2	0.3	113	C365	C365-R367 PolarHBondContact O-N 3.47Å; C365-R367 PolarHBondContact SG-N 3.01Å
368	C	92.8	Very high	93.6	Very high	32 Å²	32	63.9 Å²	63.9	22%	0.216	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-6.1	-174.1	71.7	0	0	0	0	114.8	C365 W370 C384 C387	C365-C368 VanDerWaalsContact SG-SG 3.68Å; C368-W370 PolarHBondContact O-N 3.26Å; C368-W370 VanDerWaalsContact SG-CB 3.56Å; C368-C384 VanDerWaalsContact SG-SG 3.68Å; C368-C387 VanDerWaalsContact CB-SG 3.6Å
369	G	91.4	Very high	93.5	Very high	25 Å²	25	71.5 Å²	71.5	26%	0.258	35%	0.347	S	S	.	.			trans	72.6	2.3	-178.9	0	0	0	0	0	115.5	R364 C365	R364-G369 WeakPolarHBondContact CG-O 3.27Å; C365-G369 VanDerWaalsContact O-CA 3.28Å; C365-G369 WeakPolarHBondContact O-CA 3.42Å; C365-G369 PolarHBondContact O-N 3.26Å
370	W	93.6	Very high	93.3	Very high	54 Å²	54	72.7 Å²	72.7	21%	0.205	35%	0.354	C	S	.	.			trans	-67.6	145.1	177.2	-157.6	-88.9	0	0	0	111.6	Y344 I345 R364 C365 C368 F372 R386	Y344-W370 AromaticContact CD1-CD2 3.71Å; Y344-W370 HydrophobicContact CD1-CD2 3.71Å; Y344-W370 AromaticContact CD1-CE2 3.96Å; Y344-W370 AromaticContact CD1-CE3 3.8Å; Y344-W370 HydrophobicContact CD1-CE3 3.8Å; Y344-W370 HydrophobicContact CD1-CG 4.1Å; Y344-W370 HydrophobicContact CD1-CH2 4.49Å; Y344-W370 HydrophobicContact CD1-CZ2 4.36Å; Y344-W370 HydrophobicContact CD1-CZ3 4.21Å; Y344-W370 HydrophobicContact CE1-CD2 4.2Å; Y344-W370 AromaticContact CE1-CE3 3.92Å; Y344-W370 HydrophobicContact CE1-CE3 3.92Å; Y344-W370 HydrophobicContact CE1-CZ3 4.38Å; I345-W370 PolarHBondContact O-NE1 3.45Å; I345-W370 VanDerWaalsContact O-NE1 3.15Å; R364-W370 CarbonylContact C-O 3.53Å; R364-W370 WeakPolarHBondContact CA-O 3.46Å; C365-W370 PolarHBondContact N-O 3.18Å; C368-W370 PolarHBondContact O-N 3.26Å; C368-W370 VanDerWaalsContact SG-CB 3.56Å; W370-F372 HydrophobicContact CB-CE2 3.8Å; W370-F372 HydrophobicContact CB-CZ 3.88Å; W370-F372 AromaticContact CD1-CD1 3.97Å; W370-F372 AromaticContact CD1-CE1 3.41Å; W370-F372 VanDerWaalsContact CD1-CE1 3.41Å; W370-F372 AromaticContact CD1-CE2 3.71Å; W370-F372 AromaticContact CD1-CZ 3.26Å; W370-F372 HydrophobicContact CG-CE1 4.35Å; W370-F372 HydrophobicContact CG-CE2 4.11Å; W370-F372 AromaticContact CG-CZ 3.8Å; W370-F372 HydrophobicContact CG-CZ 3.8Å; W370-R386 VanDerWaalsContact CE3-NH1 3.35Å
371	V	94.8	Very high	93.3	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	135.7	-177.8	-178.4	0	0	0	0	110.2	Y344 L355 P357 V362 R364	Y344-V371 HydrophobicContact CD1-CB 4.39Å; Y344-V371 HydrophobicContact CD1-CG2 4.45Å; Y344-V371 HydrophobicContact CD2-CB 3.74Å; Y344-V371 HydrophobicContact CD2-CG2 3.51Å; Y344-V371 HydrophobicContact CE2-CB 4.4Å; Y344-V371 HydrophobicContact CE2-CG2 3.68Å; Y344-V371 HydrophobicContact CG-CB 3.74Å; Y344-V371 HydrophobicContact CG-CG2 3.93Å; L355-V371 HydrophobicContact CB-CG1 4.11Å; P357-V371 HydrophobicContact CB-CG2 4.11Å; P357-V371 HydrophobicContact CG-CG2 3.76Å; V362-V371 HydrophobicContact CB-CG1 3.63Å; V362-V371 HydrophobicContact CG1-CG1 4.17Å; V362-V371 HydrophobicContact CG2-CG1 3.81Å; R364-V371 HydrophobicContact CG-CG2 4.41Å
372	F	95.2	Very high	93.2	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	159.2	178.5	-55.7	-84.9	0	0	0	109.7	E347 F348 V362 T363 C365 W370 R374 F377 P385	E347-F372 HydrophobicContact CB-CE1 4.14Å; E347-F372 HydrophobicContact CG-CE1 4.2Å; F348-F372 HydrophobicContact CD2-CB 4.28Å; F348-F372 AromaticContact CD2-CD1 3.61Å; F348-F372 HydrophobicContact CD2-CD1 3.61Å; F348-F372 HydrophobicContact CD2-CE1 4.27Å; F348-F372 HydrophobicContact CD2-CG 4.16Å; F348-F372 HydrophobicContact CE2-CB 4.23Å; F348-F372 AromaticContact CE2-CD1 3.54Å; F348-F372 HydrophobicContact CE2-CD1 3.54Å; F348-F372 AromaticContact CE2-CE1 3.98Å; F348-F372 HydrophobicContact CE2-CE1 3.98Å; F348-F372 AromaticContact CE2-CG 3.86Å; F348-F372 HydrophobicContact CE2-CG 3.86Å; V362-F372 CarbonylContact C-O 3.41Å; V362-F372 WeakPolarHBondContact CA-O 3.25Å; V362-F372 WeakPolarHBondContact CB-O 3.46Å; T363-F372 PolarHBondContact N-O 2.82Å; T363-F372 PolarHBondContact O-N 2.97Å; C365-F372 HydrophobicContact CB-CE2 4.13Å; W370-F372 HydrophobicContact CB-CE2 3.8Å; W370-F372 HydrophobicContact CB-CZ 3.88Å; W370-F372 AromaticContact CD1-CD1 3.97Å; W370-F372 AromaticContact CD1-CE1 3.41Å; W370-F372 VanDerWaalsContact CD1-CE1 3.41Å; W370-F372 AromaticContact CD1-CE2 3.71Å; W370-F372 AromaticContact CD1-CZ 3.26Å; W370-F372 HydrophobicContact CG-CE1 4.35Å; W370-F372 HydrophobicContact CG-CE2 4.11Å; W370-F372 AromaticContact CG-CZ 3.8Å; W370-F372 HydrophobicContact CG-CZ 3.8Å; F372-R374 PolarHBondContact O-N 3.41Å; F372-F377 HydrophobicContact CB-CB 4.22Å; F372-F377 HydrophobicContact CB-CD2 4.46Å; F372-F377 AromaticContact CD2-CD2 3.86Å; F372-F377 HydrophobicContact CD2-CD2 3.86Å; F372-F377 HydrophobicContact CD2-CE2 4.26Å; F372-F377 HydrophobicContact CE2-CD2 4.44Å; F372-F377 HydrophobicContact CE2-CE2 4.47Å; F372-F377 HydrophobicContact CG-CD2 4.28Å; F372-P385 HydrophobicContact CE1-CG 4.14Å; F372-P385 HydrophobicContact CZ-CG 4.38Å
373	H	96	Very high	93	Very high	40 Å²	40	73.4 Å²	73.4	19%	0.185	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	133.3	163.8	-69.5	121.6	0	0	0	109.9	C346 C349 D351 L355 V375 C376 F377	C346-H373 WeakPolarHBondContact CB-ND1 3.37Å; C349-H373 PolarHBondContact SG-ND1 2.87Å; D351-H373 IonicContact OD2-CE1 3.33Å; L355-H373 VanDerWaalsContact CD2-NE2 3.32Å; L355-H373 WeakPolarHBondContact CD2-NE2 3.46Å; H373-V375 VanDerWaalsContact C-N 3.31Å; H373-V375 PolarHBondContact O-N 3.36Å; H373-C376 HydrophobicContact CB-CB 3.96Å; H373-C376 WeakPolarHBondContact O-CB 3.27Å; H373-C376 PolarHBondContact O-N 3.23Å; H373-F377 PolarHBondContact O-N 3.49Å
374	R	94.2	Very high	93	Very high	140 Å²	140	72.3 Å²	72.3	53%	0.528	36%	0.361	S	S	.	.	H	α-helix	trans	-54.6	-48.7	-178.7	179.4	168.9	-178.1	173.1	0.9	111.7	N361 T363 F372 C376 F377 D378	N361-R374 PolarHBondContact O-N 3.25Å; T363-R374 WeakPolarHBondContact OG1-CA 3.27Å; T363-R374 WeakPolarHBondContact OG1-CB 3.48Å; T363-R374 WeakPolarHBondContact OG1-CG 3.44Å; F372-R374 PolarHBondContact O-N 3.41Å; R374-C376 VanDerWaalsContact C-N 3.3Å; R374-C376 PolarHBondContact O-N 3.32Å; R374-F377 PolarHBondContact O-N 3.27Å; R374-D378 WeakPolarHBondContact CG-OD2 3.39Å; R374-D378 IonicContact NE-OD2 3.94Å; R374-D378 WeakPolarHBondContact O-CB 3.14Å; R374-D378 PolarHBondContact O-N 2.91Å
375	V	94.5	Very high	92.9	Very high	92 Å²	92	67.6 Å²	67.6	56%	0.558	35%	0.346	S	S	*	.	H	α-helix	trans	-59.2	-38.7	177.2	-179.8	0	0	0	0	112.4	H373 K379	H373-V375 VanDerWaalsContact C-N 3.31Å; H373-V375 PolarHBondContact O-N 3.36Å; V375-K379 HydrophobicContact CG1-CD 4.21Å; V375-K379 WeakPolarHBondContact O-CB 3.42Å; V375-K379 WeakPolarHBondContact O-CG 3.1Å; V375-K379 PolarHBondContact O-N 3.49Å; V375-K379 VanDerWaalsContact O-N 3.09Å
376	C	94.8	Very high	92.8	Very high	24 Å²	24	71 Å²	71	16%	0.162	36%	0.358	C	S	.	.	H	α-helix	trans	-70.4	-40.6	179	-68.3	0	0	0	0	111.9	F348 H373 R374 N380	F348-C376 HydrophobicContact CB-CB 3.71Å; F348-C376 HydrophobicContact CD2-CB 3.77Å; F348-C376 HydrophobicContact CG-CB 4.01Å; H373-C376 HydrophobicContact CB-CB 3.96Å; H373-C376 WeakPolarHBondContact O-CB 3.27Å; H373-C376 PolarHBondContact O-N 3.23Å; R374-C376 VanDerWaalsContact C-N 3.3Å; R374-C376 PolarHBondContact O-N 3.32Å; C376-N380 PolarHBondContact O-N 3.24Å
377	F	94	Very high	92.9	Very high	24 Å²	24	63.5 Å²	63.5	11%	0.105	32%	0.32	C	S	.	.	H	α-helix	trans	-68.5	-41.8	179.2	-168.4	-106.2	0	0	0	111.9	F348 T363 F372 H373 R374 N380 G382 C384	F348-F377 HydrophobicContact CE2-CB 4.5Å; F348-F377 HydrophobicContact CE2-CD2 4.09Å; F348-F377 HydrophobicContact CZ-CD2 4.44Å; T363-F377 HydrophobicContact CG2-CD1 3.59Å; T363-F377 HydrophobicContact CG2-CE1 3.89Å; T363-F377 HydrophobicContact CG2-CG 4.24Å; F372-F377 HydrophobicContact CB-CB 4.22Å; F372-F377 HydrophobicContact CB-CD2 4.46Å; F372-F377 AromaticContact CD2-CD2 3.86Å; F372-F377 HydrophobicContact CD2-CD2 3.86Å; F372-F377 HydrophobicContact CD2-CE2 4.26Å; F372-F377 HydrophobicContact CE2-CD2 4.44Å; F372-F377 HydrophobicContact CE2-CE2 4.47Å; F372-F377 HydrophobicContact CG-CD2 4.28Å; H373-F377 PolarHBondContact O-N 3.49Å; R374-F377 PolarHBondContact O-N 3.27Å; F377-N380 CarbonylContact O-C 3.45Å; F377-N380 PolarHBondContact O-N 3.25Å; F377-G382 VanDerWaalsContact CE1-CA 3.46Å; F377-G382 WeakPolarHBondContact CZ-O 3.48Å; F377-G382 PolarHBondContact O-N 3.13Å; F377-C384 HydrophobicContact CE2-CB 4.22Å
378	D	93	Very high	92.9	Very high	86 Å²	86	60.1 Å²	60.1	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-67.5	-40.7	178.9	-65.6	-15.9	0	0	0	111.3	R374 N380 N381	R374-D378 WeakPolarHBondContact CG-OD2 3.39Å; R374-D378 IonicContact NE-OD2 3.94Å; R374-D378 WeakPolarHBondContact O-CB 3.14Å; R374-D378 PolarHBondContact O-N 2.91Å; D378-N380 PolarHBondContact O-N 3.08Å; D378-N381 PolarHBondContact O-N 3.36Å
379	K	93.1	Very high	92.8	Very high	167 Å²	167	64.8 Å²	64.8	73%	0.726	33%	0.326	S	S	*	.	H	α-helix	trans	-58.1	-26.8	172.6	-80.1	177.1	180	-176.1	0	113.4	V375 N381	V375-K379 HydrophobicContact CG1-CD 4.21Å; V375-K379 WeakPolarHBondContact O-CB 3.42Å; V375-K379 WeakPolarHBondContact O-CG 3.1Å; V375-K379 PolarHBondContact O-N 3.49Å; V375-K379 VanDerWaalsContact O-N 3.09Å; K379-N381 VanDerWaalsContact C-N 3.33Å
380	N	90	Very high	92.7	Very high	62 Å²	62	67.4 Å²	67.4	33%	0.332	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	24.5	177.1	-160.5	51.8	0	0	0	112.8	F348 C376 F377 D378 G382 V383	F348-N380 HydrophobicContact CD1-CB 4.45Å; F348-N380 HydrophobicContact CE1-CB 3.63Å; F348-N380 WeakPolarHBondContact CE1-ND2 3.4Å; F348-N380 HydrophobicContact CZ-CB 3.8Å; C376-N380 PolarHBondContact O-N 3.24Å; F377-N380 CarbonylContact O-C 3.45Å; F377-N380 PolarHBondContact O-N 3.25Å; D378-N380 PolarHBondContact O-N 3.08Å; N380-G382 PolarHBondContact O-N 3.2Å; N380-V383 PolarHBondContact ND2-O 3.32Å; N380-V383 WeakPolarHBondContact O-CB 3.44Å; N380-V383 PolarHBondContact O-N 2.89Å
381	N	91	Very high	92.5	Very high	152 Å²	152	67.3 Å²	67.3	81%	0.813	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	29.2	-179.3	-62.8	-22.8	0	0	0	113.8	D378 K379 V383	D378-N381 PolarHBondContact O-N 3.36Å; K379-N381 VanDerWaalsContact C-N 3.33Å; N381-V383 PolarHBondContact O-N 2.78Å
382	G	89.2	Confident	92.1	Very high	34 Å²	34	68.6 Å²	68.6	35%	0.351	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	12.2	-177.8	0	0	0	0	0	115.3	F377 N380	F377-G382 VanDerWaalsContact CE1-CA 3.46Å; F377-G382 WeakPolarHBondContact CZ-O 3.48Å; F377-G382 PolarHBondContact O-N 3.13Å; N380-G382 PolarHBondContact O-N 3.2Å
383	V	91.4	Very high	91.6	Very high	71 Å²	71	74.5 Å²	74.5	43%	0.43	38%	0.379	S	S	.	.			trans	-79.9	125.7	176.1	-178.9	0	0	0	0	109.5	N380 N381 P385	N380-V383 PolarHBondContact ND2-O 3.32Å; N380-V383 WeakPolarHBondContact O-CB 3.44Å; N380-V383 PolarHBondContact O-N 2.89Å; N381-V383 PolarHBondContact O-N 2.78Å; V383-P385 WeakPolarHBondContact O-CD 3.28Å
384	C	94.3	Very high	90.9	Very high	10 Å²	10	75.4 Å²	75.4	7%	0.068	39%	0.394	C	S	.	.			trans	-89.7	117	-179.5	178.6	0	0	0	0	111.7	C365 C368 F377 R386 C387 Q388	C365-C384 HydrophobicContact CB-CB 4.29Å; C365-C384 VanDerWaalsContact SG-CB 3.59Å; C368-C384 VanDerWaalsContact SG-SG 3.68Å; F377-C384 HydrophobicContact CE2-CB 4.22Å; C384-R386 VanDerWaalsContact C-N 3.3Å; C384-R386 PolarHBondContact O-N 3.01Å; C384-C387 HydrophobicContact CB-CB 3.9Å; C384-C387 PolarHBondContact O-N 2.85Å; C384-C387 VanDerWaalsContact O-N 3.1Å; C384-C387 VanDerWaalsContact SG-SG 3.63Å; C384-Q388 PolarHBondContact O-N 2.9Å
385	P	91.7	Very high	90.1	Very high	26 Å²	26	71.8 Å²	71.8	17%	0.169	39%	0.39	C	S	.	.	H	α-helix	trans	-63.9	-35.3	-178.1	24.3	-34.4	0	0	0	112.1	E347 F348 F372 V383 Q388 R389	E347-P385 HydrophobicContact CB-CG 4.38Å; F348-P385 HydrophobicContact CD1-CG 4.47Å; F348-P385 HydrophobicContact CE1-CG 3.85Å; F348-P385 HydrophobicContact CE2-CG 4.3Å; F348-P385 HydrophobicContact CZ-CG 3.78Å; F372-P385 HydrophobicContact CE1-CG 4.14Å; F372-P385 HydrophobicContact CZ-CG 4.38Å; V383-P385 WeakPolarHBondContact O-CD 3.28Å; P385-Q388 PolarHBondContact O-N 2.81Å; P385-R389 WeakPolarHBondContact O-CG 3.15Å; P385-R389 PolarHBondContact O-N 3.43Å
386	R	90.4	Very high	89.2	Confident	82 Å²	82	73.5 Å²	73.5	31%	0.309	39%	0.392	S	S	.	.	H	α-helix	trans	-62.5	-43.1	173.8	-167.5	177.1	-171.9	-130.7	5.4	112.3	W370 C384 R389 L390	W370-R386 VanDerWaalsContact CE3-NH1 3.35Å; C384-R386 VanDerWaalsContact C-N 3.3Å; C384-R386 PolarHBondContact O-N 3.01Å; R386-R389 PolarHBondContact O-N 3.33Å; R386-L390 HydrophobicContact CG-CD1 4.26Å; R386-L390 WeakPolarHBondContact O-CB 3.47Å; R386-L390 VanDerWaalsContact O-CG 3.28Å; R386-L390 WeakPolarHBondContact O-CG 3.29Å; R386-L390 PolarHBondContact O-N 2.81Å
387	C	93.4	Very high	88.3	Confident	13 Å²	13	80 Å²	80	9%	0.088	42%	0.418	C	S	.	.	H	α-helix	trans	-68.1	-37.9	176.6	-66.9	0	0	0	0	111.9	C365 C368 C384 L390 A391	C365-C387 VanDerWaalsContact SG-SG 3.61Å; C368-C387 VanDerWaalsContact CB-SG 3.6Å; C384-C387 HydrophobicContact CB-CB 3.9Å; C384-C387 PolarHBondContact O-N 2.85Å; C384-C387 VanDerWaalsContact O-N 3.1Å; C384-C387 VanDerWaalsContact SG-SG 3.63Å; C387-L390 PolarHBondContact O-N 2.66Å; C387-A391 WeakPolarHBondContact O-CB 3.4Å; C387-A391 PolarHBondContact O-N 3.19Å
388	Q	91.5	Very high	87.2	Confident	129 Å²	129	83 Å²	83	60%	0.603	45%	0.446	S	S	*	.	H	α-helix	trans	-62.1	-46.2	175.5	-170.6	176.3	5.9	0	0	111.1	C384 P385 L390 A391 G392	C384-Q388 PolarHBondContact O-N 2.9Å; P385-Q388 PolarHBondContact O-N 2.81Å; Q388-L390 PolarHBondContact O-N 2.85Å; Q388-A391 PolarHBondContact O-N 3.3Å; Q388-G392 PolarHBondContact O-N 2.5Å
389	R	91	Very high	85.9	Confident	130 Å²	130	86 Å²	86	49%	0.491	46%	0.461	S	S	.	.	H	α-helix	trans	-62.5	-39.5	174.4	-71.3	-175	-62.9	179.8	6.3	112.8	E347 P385 R386 R393	E347-R389 IonicContact OE1-NH2 2.76Å; E347-R389 PolarHBondContact OE1-NH2 3.35Å; E347-R389 IonicContact OE2-CZ 3.6Å; E347-R389 IonicContact OE2-NH2 2.72Å; E347-R389 PolarHBondContact OE2-NH2 2.82Å; P385-R389 WeakPolarHBondContact O-CG 3.15Å; P385-R389 PolarHBondContact O-N 3.43Å; R386-R389 PolarHBondContact O-N 3.33Å; R389-R393 WeakPolarHBondContact O-CG 3.37Å; R389-R393 PolarHBondContact O-N 3.14Å; R389-R393 VanDerWaalsContact O-N 3.16Å
390	L	89.2	Confident	84.4	Confident	80 Å²	80	83.7 Å²	83.7	42%	0.419	46%	0.457	S	S	.	.	H	α-helix	trans	-66.6	-41.2	176.5	-76.1	165.5	0	0	0	112.1	R386 C387 Q388 A394	R386-L390 HydrophobicContact CG-CD1 4.26Å; R386-L390 WeakPolarHBondContact O-CB 3.47Å; R386-L390 VanDerWaalsContact O-CG 3.28Å; R386-L390 WeakPolarHBondContact O-CG 3.29Å; R386-L390 PolarHBondContact O-N 2.81Å; C387-L390 PolarHBondContact O-N 2.66Å; Q388-L390 PolarHBondContact O-N 2.85Å; L390-A394 PolarHBondContact O-N 3.16Å; L390-A394 VanDerWaalsContact O-N 3.11Å
391	A	89.3	Confident	82.8	Confident	51 Å²	51	85 Å²	85	42%	0.421	47%	0.469	S	S	.	.	H	α-helix	trans	-65.4	-44.5	176.6	0	0	0	0	0	111.6	C387 Q388 R393 A394 S395	C387-A391 WeakPolarHBondContact O-CB 3.4Å; C387-A391 PolarHBondContact O-N 3.19Å; Q388-A391 PolarHBondContact O-N 3.3Å; A391-R393 PolarHBondContact O-N 3.17Å; A391-A394 WeakPolarHBondContact O-CB 3.42Å; A391-A394 PolarHBondContact O-N 3.04Å; A391-A394 VanDerWaalsContact O-N 3.1Å; A391-S395 PolarHBondContact O-N 3.42Å; A391-S395 PolarHBondContact O-OG 3.16Å
392	G	86.8	Confident	81.1	Confident	27 Å²	27	81.1 Å²	81.1	28%	0.278	45%	0.453	S	S	.	.	H	α-helix	trans	-58.3	-45.2	176.5	0	0	0	0	0	113	Q388 A394 S395 E396	Q388-G392 PolarHBondContact O-N 2.5Å; G392-A394 VanDerWaalsContact C-N 3.3Å; G392-A394 PolarHBondContact O-N 3.06Å; G392-S395 WeakPolarHBondContact CA-OG 3.49Å; G392-S395 PolarHBondContact O-N 2.8Å; G392-S395 PolarHBondContact O-OG 3.05Å; G392-E396 WeakPolarHBondContact O-CG 3.37Å; G392-E396 PolarHBondContact O-N 3.19Å
393	R	85.5	Confident	79.6	Confident	124 Å²	124	88.8 Å²	88.8	47%	0.468	48%	0.477	S	S	.	.	H	α-helix	trans	-64.9	-31.9	174.9	-72.4	-171.2	-65.7	-105.6	4.1	113.4	R389 A391 K397	R389-R393 WeakPolarHBondContact O-CG 3.37Å; R389-R393 PolarHBondContact O-N 3.14Å; R389-R393 VanDerWaalsContact O-N 3.16Å; A391-R393 PolarHBondContact O-N 3.17Å; R393-K397 WeakPolarHBondContact O-CG 3.36Å; R393-K397 PolarHBondContact O-N 2.95Å
394	A	80.2	Confident	77.8	Confident	60 Å²	60	92.1 Å²	92.1	50%	0.496	49%	0.493	S	S	.	.	H	α-helix	trans	-71.7	-40.1	177.1	0	0	0	0	0	111.4	L390 A391 G392 K397 A398	L390-A394 PolarHBondContact O-N 3.16Å; L390-A394 VanDerWaalsContact O-N 3.11Å; A391-A394 WeakPolarHBondContact O-CB 3.42Å; A391-A394 PolarHBondContact O-N 3.04Å; A391-A394 VanDerWaalsContact O-N 3.1Å; G392-A394 VanDerWaalsContact C-N 3.3Å; G392-A394 PolarHBondContact O-N 3.06Å; A394-K397 PolarHBondContact O-N 3.1Å; A394-A398 PolarHBondContact O-N 2.97Å; A394-A398 VanDerWaalsContact O-N 3.13Å
395	S	77.7	Confident	75.8	Confident	63 Å²	63	97.6 Å²	97.6	44%	0.441	52%	0.521	S	S	.	.	H	α-helix	trans	-65.8	-39.4	173.9	46	0	0	0	0	112.6	A391 G392 K397 A398 L399	A391-S395 PolarHBondContact O-N 3.42Å; A391-S395 PolarHBondContact O-OG 3.16Å; G392-S395 WeakPolarHBondContact CA-OG 3.49Å; G392-S395 PolarHBondContact O-N 2.8Å; G392-S395 PolarHBondContact O-OG 3.05Å; S395-K397 PolarHBondContact O-N 3.31Å; S395-A398 PolarHBondContact O-N 3.16Å; S395-L399 WeakPolarHBondContact O-CG 3.35Å; S395-L399 PolarHBondContact O-N 3.37Å
396	E	76.1	Confident	73.9	Confident	128 Å²	128	103.5 Å²	103.5	60%	0.598	54%	0.544	S	S	*	.	H	α-helix	trans	-61.6	-42.4	175.1	-75.5	169.7	-176.1	0	0	111.8	G392 A398 L399 L400	G392-E396 WeakPolarHBondContact O-CG 3.37Å; G392-E396 PolarHBondContact O-N 3.19Å; E396-A398 VanDerWaalsContact C-N 3.34Å; E396-A398 PolarHBondContact O-N 3.23Å; E396-L399 PolarHBondContact O-N 2.82Å; E396-L400 PolarHBondContact O-N 3.15Å
397	K	75	Confident	71.8	Confident	162 Å²	162	105.8 Å²	105.8	70%	0.704	57%	0.568	S	S	*	*	H	α-helix	trans	-66.3	-32.8	176.7	-76.4	-174.2	179	-169.7	0	113.8	R393 A394 S395 L399 L400	R393-K397 WeakPolarHBondContact O-CG 3.36Å; R393-K397 PolarHBondContact O-N 2.95Å; A394-K397 PolarHBondContact O-N 3.1Å; S395-K397 PolarHBondContact O-N 3.31Å; K397-L399 VanDerWaalsContact C-N 3.31Å; K397-L400 PolarHBondContact O-N 3.41Å
398	A	71.4	Confident	70.1	Confident	86 Å²	86	118.9 Å²	118.9	71%	0.711	62%	0.618	S	S	*	*	H	α-helix	trans	-74.8	-21	177.7	0	0	0	0	0	113.2	A394 S395 E396	A394-A398 PolarHBondContact O-N 2.97Å; A394-A398 VanDerWaalsContact O-N 3.13Å; S395-A398 PolarHBondContact O-N 3.16Å; E396-A398 VanDerWaalsContact C-N 3.34Å; E396-A398 PolarHBondContact O-N 3.23Å
399	L	66.4	Low	69	Low	148 Å²	148	118.4 Å²	118.4	78%	0.775	62%	0.618	S	S	*	*	H	α-helix	trans	-85.9	-12.7	175.7	-69	168	0	0	0	113	S395 E396 K397	S395-L399 WeakPolarHBondContact O-CG 3.35Å; S395-L399 PolarHBondContact O-N 3.37Å; E396-L399 PolarHBondContact O-N 2.82Å; K397-L399 VanDerWaalsContact C-N 3.31Å
400	L	61.2	Low	67.9	Low	120 Å²	120	117.8 Å²	117.8	63%	0.628	63%	0.625	S	S	*	*	S	Bend	trans	-77.2	124.7	172.4	-67.7	169.7	0	0	0	108.2	E396 K397 S402	E396-L400 PolarHBondContact O-N 3.15Å; K397-L400 PolarHBondContact O-N 3.41Å; L400-S402 PolarHBondContact O-N 3.08Å
401	P	56.3	Low	66.7	Low	90 Å²	90	119.9 Å²	119.9	58%	0.584	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-54.9	133.1	177.6	-15.9	23.5	0	0	0	110.3	F403	P401-F403 PolarHBondContact O-N 3.35Å
402	S	56.1	Low	65.3	Low	70 Å²	70	123.9 Å²	123.9	49%	0.49	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-58.9	131.3	168	36	0	0	0	0	108.7	L400 D404 D405	L400-S402 PolarHBondContact O-N 3.08Å; S402-D404 PolarHBondContact O-N 2.94Å; S402-D405 PolarHBondContact O-N 3.34Å; S402-D405 VanDerWaalsContact O-N 3.1Å
403	F	57.7	Low	64	Low	195 Å²	195	130 Å²	130	86%	0.855	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-4.3	-179.2	-90.6	-89.5	0	0	0	114.5	P401	P401-F403 PolarHBondContact O-N 3.35Å
404	D	53.6	Low	62.6	Low	140 Å²	140	130.4 Å²	130.4	75%	0.749	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-9	176.4	-66.8	-27.3	0	0	0	114.2	S402 F406	S402-D404 PolarHBondContact O-N 2.94Å; D404-F406 PolarHBondContact O-N 3.24Å
405	D	51.5	Low	61.3	Low	125 Å²	125	135.4 Å²	135.4	67%	0.668	70%	0.699	S	S	*	*	S	Bend	trans	-83.2	12	177	-78	-25.9	0	0	0	113.9	S402	S402-D405 PolarHBondContact O-N 3.34Å; S402-D405 VanDerWaalsContact O-N 3.1Å
406	F	50.9	Low	60.1	Low	150 Å²	150	141 Å²	141	66%	0.658	72%	0.719	S	S	*	*			trans	-113.1	58.8	169.5	-67.2	-79.8	0	0	0	111.2	D404 Y408	D404-F406 PolarHBondContact O-N 3.24Å; F406-Y408 PolarHBondContact O-N 3.07Å
407	T	47.9	Very low	58.7	Low	130 Å²	130	142.1 Å²	142.1	80%	0.798	73%	0.729	S	S	*	*			trans	-80.8	104.1	152.7	52.5	0	0	0	0	107.9
408	Y	56.8	Low	57.2	Low	289 Å²	289	140.3 Å²	140.3	100%	1.133	73%	0.732	S	S	*	*			trans	-66.5	0	172.8	-108.1	-86.5	0	0	0	112.5	F406	F406-Y408 PolarHBondContact O-N 3.07Å

Retrieved 408 of 408 residues in 835.4 ms (Link to these results)

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