A0A077YZC7_TRITR Loading...

DNA repair protein RAD51 homolog 3

AlphaFold DB , UniProt , Accession A0A077YZC7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 292 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.9	Very low	60.2	Low	230 Å²	230	121.9 Å²	121.9	100%	1.133	65%	0.648	S	S	*	*				0	6.4	0	-75.7	-178.3	172.2	0	0	114
2	T	52.6	Low	61.6	Low	122 Å²	122	116.4 Å²	116.4	75%	0.748	62%	0.623	S	S	*	*			trans	-92.8	-18.9	-173.6	44.2	0	0	0	0	115.5	N4 S5	T2-N4 VanDerWaalsContact C-N 3.27Å; T2-N4 PolarHBondContact O-N 3Å; T2-S5 PolarHBondContact O-OG 2.85Å
3	S	54.5	Low	63.4	Low	100 Å²	100	113.8 Å²	113.8	70%	0.699	61%	0.614	S	S	*	*	H	α-helix	trans	-70.9	-22	-179.9	65.9	0	0	0	0	113.6
4	N	60.5	Low	65	Low	90 Å²	90	111.7 Å²	111.7	48%	0.481	62%	0.62	S	S	.	*	H	α-helix	trans	-87.8	-13.6	-175	-134.3	-11.1	0	0	0	113.2	T2 R8	T2-N4 VanDerWaalsContact C-N 3.27Å; T2-N4 PolarHBondContact O-N 3Å; N4-R8 WeakPolarHBondContact O-CD 3.25Å; N4-R8 VanDerWaalsContact O-CG 3.3Å; N4-R8 WeakPolarHBondContact O-CG 3.41Å
5	S	57.8	Low	66.5	Low	62 Å²	62	109.3 Å²	109.3	43%	0.434	61%	0.614	S	S	.	*	H	α-helix	trans	-82.5	-35	178.6	23.4	0	0	0	0	113	T2 R8 L9	T2-S5 PolarHBondContact O-OG 2.85Å; S5-R8 PolarHBondContact O-N 3Å; S5-L9 PolarHBondContact O-N 3.38Å
6	A	59.7	Low	67.6	Low	66 Å²	66	104.8 Å²	104.8	55%	0.545	59%	0.591	S	S	.	*	H	α-helix	trans	-67.6	-38.6	175.5	0	0	0	0	0	111.6	R8 L9	A6-R8 PolarHBondContact O-N 3.27Å; A6-L9 PolarHBondContact O-N 3.31Å
7	Q	57.2	Low	68.3	Low	145 Å²	145	104 Å²	104	68%	0.678	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-12.7	174	-75.3	-176.6	-20.4	0	0	114.2	T11	Q7-T11 WeakPolarHBondContact O-CG2 2.89Å
8	R	57.7	Low	69.1	Low	154 Å²	154	104.1 Å²	104.1	58%	0.581	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-21.2	174.6	-72.2	171.9	-175.3	-170.7	-1	112.9	N4 S5 A6	N4-R8 WeakPolarHBondContact O-CD 3.25Å; N4-R8 VanDerWaalsContact O-CG 3.3Å; N4-R8 WeakPolarHBondContact O-CG 3.41Å; S5-R8 PolarHBondContact O-N 3Å; A6-R8 PolarHBondContact O-N 3.27Å
9	L	65.1	Low	69.7	Low	112 Å²	112	103.3 Å²	103.3	59%	0.586	58%	0.577	S	S	*	*	S	Bend	trans	-87.6	146	169.7	-65.5	167.9	0	0	0	107.5	S5 A6 T11	S5-L9 PolarHBondContact O-N 3.38Å; A6-L9 PolarHBondContact O-N 3.31Å; L9-T11 PolarHBondContact O-N 3.25Å
10	F	74.5	Confident	69.9	Low	200 Å²	200	101.6 Å²	101.6	88%	0.877	56%	0.564	S	S	*	*	S	Bend	trans	68.1	27.7	175.6	-38	-70	0	0	0	116.2
11	T	74.5	Confident	70.1	Confident	60 Å²	60	102.9 Å²	102.9	37%	0.368	56%	0.562	S	S	.	*			trans	-80	-18	178.5	55.2	0	0	0	0	114.2	Q7 L9 W209	Q7-T11 WeakPolarHBondContact O-CG2 2.89Å; L9-T11 PolarHBondContact O-N 3.25Å; T11-W209 HydrophobicContact CG2-CH2 3.67Å; T11-W209 HydrophobicContact CG2-CZ2 3.59Å
12	V	77.3	Confident	71.4	Confident	56 Å²	56	96.4 Å²	96.4	34%	0.339	54%	0.535	S	S	.	.			trans	-94.4	118.8	-176.6	-177.2	0	0	0	0	108.1	S16 L17 F213	V12-S16 VanDerWaalsContact CG1-OG 3.3Å; V12-S16 WeakPolarHBondContact CG1-OG 3.45Å; V12-L17 HydrophobicContact CG1-CD1 4.23Å; V12-L17 HydrophobicContact CG1-CD2 3.59Å; V12-L17 HydrophobicContact CG1-CG 3.6Å; V12-F213 HydrophobicContact CG2-CE1 4.3Å
13	T	85.2	Confident	72.3	Confident	83 Å²	83	97.3 Å²	97.3	51%	0.509	54%	0.536	S	S	.	.			trans	-87.4	157.6	178.8	67.8	0	0	0	0	110.8	S15 S16 L17	T13-S15 PolarHBondContact O-N 3.26Å; T13-S16 PolarHBondContact N-OG 3.19Å; T13-S16 PolarHBondContact O-N 3.28Å; T13-S16 VanDerWaalsContact O-N 3.1Å; T13-S16 PolarHBondContact O-OG 3.37Å; T13-S16 PolarHBondContact OG1-N 3.28Å; T13-S16 PolarHBondContact OG1-OG 2.7Å; T13-L17 PolarHBondContact O-N 3.46Å; T13-L17 VanDerWaalsContact O-N 3.07Å
14	A	86	Confident	73	Confident	84 Å²	84	95.1 Å²	95.1	69%	0.694	52%	0.52	S	S	*	.	H	α-helix	trans	-57	-36.6	174.8	0	0	0	0	0	112.4	L17 L18	A14-L17 PolarHBondContact O-N 2.9Å; A14-L18 PolarHBondContact O-N 3.12Å
15	S	87.6	Confident	73.7	Confident	76 Å²	76	93.7 Å²	93.7	53%	0.531	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-47.3	174.7	-167.7	0	0	0	0	111.7	T13 L17 L18 D19	T13-S15 PolarHBondContact O-N 3.26Å; S15-L17 PolarHBondContact O-N 3.45Å; S15-L18 WeakPolarHBondContact O-CB 3.42Å; S15-L18 PolarHBondContact O-N 3.36Å; S15-L18 VanDerWaalsContact O-N 3.09Å; S15-D19 PolarHBondContact O-N 3.43Å
16	S	83.6	Confident	75.2	Confident	36 Å²	36	93.5 Å²	93.5	25%	0.252	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-30.8	178.9	67.6	0	0	0	0	112.8	V12 T13 Q20	V12-S16 VanDerWaalsContact CG1-OG 3.3Å; V12-S16 WeakPolarHBondContact CG1-OG 3.45Å; T13-S16 PolarHBondContact N-OG 3.19Å; T13-S16 PolarHBondContact O-N 3.28Å; T13-S16 VanDerWaalsContact O-N 3.1Å; T13-S16 PolarHBondContact O-OG 3.37Å; T13-S16 PolarHBondContact OG1-N 3.28Å; T13-S16 PolarHBondContact OG1-OG 2.7Å; S16-Q20 WeakPolarHBondContact O-CB 3.39Å; S16-Q20 VanDerWaalsContact O-CG 3.27Å; S16-Q20 WeakPolarHBondContact O-CG 3.28Å; S16-Q20 PolarHBondContact O-N 2.93Å; S16-Q20 VanDerWaalsContact O-N 3.13Å
17	L	80.2	Confident	76.8	Confident	92 Å²	92	91.8 Å²	91.8	48%	0.482	49%	0.491	S	S	.	.	H	α-helix	trans	-71.7	-38.2	173.2	-70.6	173.9	0	0	0	112.1	V12 T13 A14 S15 Q20 Y21	V12-L17 HydrophobicContact CG1-CD1 4.23Å; V12-L17 HydrophobicContact CG1-CD2 3.59Å; V12-L17 HydrophobicContact CG1-CG 3.6Å; T13-L17 PolarHBondContact O-N 3.46Å; T13-L17 VanDerWaalsContact O-N 3.07Å; A14-L17 PolarHBondContact O-N 2.9Å; S15-L17 PolarHBondContact O-N 3.45Å; L17-Q20 PolarHBondContact O-N 3.39Å; L17-Y21 VanDerWaalsContact O-CB 3.23Å; L17-Y21 WeakPolarHBondContact O-CB 3.26Å; L17-Y21 PolarHBondContact O-N 3.06Å
18	L	81.4	Confident	78.7	Confident	105 Å²	105	85 Å²	85	55%	0.55	46%	0.459	S	S	.	.	H	α-helix	trans	-64.2	-43.2	176.9	179.8	62.1	0	0	0	111.2	A14 S15 Q20 Y21 T22	A14-L18 PolarHBondContact O-N 3.12Å; S15-L18 WeakPolarHBondContact O-CB 3.42Å; S15-L18 PolarHBondContact O-N 3.36Å; S15-L18 VanDerWaalsContact O-N 3.09Å; L18-Q20 VanDerWaalsContact C-N 3.31Å; L18-Q20 PolarHBondContact O-N 3.26Å; L18-Y21 PolarHBondContact O-N 3.18Å; L18-T22 WeakPolarHBondContact O-CB 3.4Å; L18-T22 PolarHBondContact O-N 3.25Å; L18-T22 PolarHBondContact O-OG1 3.48Å
19	D	80.3	Confident	80.5	Confident	89 Å²	89	79.1 Å²	79.1	48%	0.476	44%	0.441	S	S	.	.	H	α-helix	trans	-62.9	-41.4	176.5	-63.5	-29.1	0	0	0	110.8	S15 N23	S15-D19 PolarHBondContact O-N 3.43Å; D19-N23 WeakPolarHBondContact O-CB 3.37Å; D19-N23 PolarHBondContact O-N 3.19Å; D19-N23 PolarHBondContact O-ND2 3.44Å
20	Q	74	Confident	81.9	Confident	69 Å²	69	73.8 Å²	73.8	32%	0.322	41%	0.413	S	S	.	.	H	α-helix	trans	-64.3	-46.2	174.4	-76.2	177.2	7.1	0	0	111.8	S16 L17 L18 N23 S24 F213	S16-Q20 WeakPolarHBondContact O-CB 3.39Å; S16-Q20 VanDerWaalsContact O-CG 3.27Å; S16-Q20 WeakPolarHBondContact O-CG 3.28Å; S16-Q20 PolarHBondContact O-N 2.93Å; S16-Q20 VanDerWaalsContact O-N 3.13Å; L17-Q20 PolarHBondContact O-N 3.39Å; L18-Q20 VanDerWaalsContact C-N 3.31Å; L18-Q20 PolarHBondContact O-N 3.26Å; Q20-N23 PolarHBondContact O-N 3.47Å; Q20-S24 VanDerWaalsContact O-CB 3.28Å; Q20-S24 WeakPolarHBondContact O-CB 3.43Å; Q20-S24 PolarHBondContact O-N 2.93Å; Q20-S24 PolarHBondContact O-OG 3.24Å; Q20-F213 VanDerWaalsContact NE2-CE1 3.3Å
21	Y	74.9	Confident	82.8	Confident	129 Å²	129	66 Å²	66	51%	0.506	38%	0.378	S	S	.	.	H	α-helix	trans	-59.4	-54.4	-179.5	-178	-94.4	0	0	0	110.7	L17 L18 N23 S24 T25	L17-Y21 VanDerWaalsContact O-CB 3.23Å; L17-Y21 WeakPolarHBondContact O-CB 3.26Å; L17-Y21 PolarHBondContact O-N 3.06Å; L18-Y21 PolarHBondContact O-N 3.18Å; Y21-N23 PolarHBondContact O-N 2.8Å; Y21-N23 VanDerWaalsContact O-N 3.13Å; Y21-S24 PolarHBondContact O-N 3.32Å; Y21-T25 HydrophobicContact CD1-CG2 3.79Å; Y21-T25 HydrophobicContact CD2-CG2 3.38Å; Y21-T25 HydrophobicContact CE1-CG2 3.66Å; Y21-T25 HydrophobicContact CE2-CG2 3.24Å; Y21-T25 HydrophobicContact CG-CG2 3.65Å; Y21-T25 WeakPolarHBondContact O-CB 3.26Å; Y21-T25 WeakPolarHBondContact O-CG2 3.5Å; Y21-T25 PolarHBondContact O-N 3.07Å; Y21-T25 PolarHBondContact O-OG1 3.37Å; Y21-T25 VanDerWaalsContact O-OG1 3.1Å
22	T	75.6	Confident	83.8	Confident	94 Å²	94	63.1 Å²	63.1	58%	0.577	36%	0.361	S	S	*	.	H	α-helix	trans	-57.4	-34	-178.2	-49.9	0	0	0	0	112.5	L18	L18-T22 WeakPolarHBondContact O-CB 3.4Å; L18-T22 PolarHBondContact O-N 3.25Å; L18-T22 PolarHBondContact O-OG1 3.48Å
23	N	69.7	Low	84.6	Confident	142 Å²	142	67.9 Å²	67.9	76%	0.759	38%	0.379	S	S	*	.	H	α-helix	trans	-90.1	-11.5	-178.4	-68.2	-46.5	0	0	0	114.4	D19 Q20 Y21	D19-N23 WeakPolarHBondContact O-CB 3.37Å; D19-N23 PolarHBondContact O-N 3.19Å; D19-N23 PolarHBondContact O-ND2 3.44Å; Q20-N23 PolarHBondContact O-N 3.47Å; Y21-N23 PolarHBondContact O-N 2.8Å; Y21-N23 VanDerWaalsContact O-N 3.13Å
24	S	70.9	Confident	85	Confident	54 Å²	54	66.8 Å²	66.8	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-125.7	-7.1	-171.6	66.3	0	0	0	0	115	Q20 Y21 Q26	Q20-S24 VanDerWaalsContact O-CB 3.28Å; Q20-S24 WeakPolarHBondContact O-CB 3.43Å; Q20-S24 PolarHBondContact O-N 2.93Å; Q20-S24 PolarHBondContact O-OG 3.24Å; Y21-S24 PolarHBondContact O-N 3.32Å; S24-Q26 PolarHBondContact O-N 3.01Å
25	T	74.6	Confident	85.4	Confident	60 Å²	60	62.9 Å²	62.9	37%	0.368	34%	0.342	S	S	.	.			trans	-72.8	104.1	177.4	48.7	0	0	0	0	110.4	Y21	Y21-T25 HydrophobicContact CD1-CG2 3.79Å; Y21-T25 HydrophobicContact CD2-CG2 3.38Å; Y21-T25 HydrophobicContact CE1-CG2 3.66Å; Y21-T25 HydrophobicContact CE2-CG2 3.24Å; Y21-T25 HydrophobicContact CG-CG2 3.65Å; Y21-T25 WeakPolarHBondContact O-CB 3.26Å; Y21-T25 WeakPolarHBondContact O-CG2 3.5Å; Y21-T25 PolarHBondContact O-N 3.07Å; Y21-T25 PolarHBondContact O-OG1 3.37Å; Y21-T25 VanDerWaalsContact O-OG1 3.1Å
26	Q	88.2	Confident	85.8	Confident	58 Å²	58	60.1 Å²	60.1	27%	0.271	32%	0.322	S	S	.	.			trans	-107.9	151.4	165.6	-62.9	178.1	-60.4	0	0	108.6	S24 L45 E74 V79	S24-Q26 PolarHBondContact O-N 3.01Å; Q26-L45 HydrophobicContact CB-CD1 3.86Å; Q26-L45 HydrophobicContact CB-CG 4.24Å; Q26-L45 WeakPolarHBondContact O-CB 3.19Å; Q26-L45 WeakPolarHBondContact O-CG 3.35Å; Q26-L45 PolarHBondContact O-N 2.94Å; Q26-E74 PolarHBondContact NE2-OE1 2.77Å; Q26-V79 HydrophobicContact CB-CG1 4.04Å
27	S	93.8	Very high	86.3	Confident	29 Å²	29	62 Å²	62	20%	0.203	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.9	175.6	-68.1	0	0	0	0	109.3	G41 V43 V79	S27-G41 WeakPolarHBondContact CB-O 3.33Å; S27-V43 CarbonylContact C-O 3.44Å; S27-V43 WeakPolarHBondContact CA-O 3.33Å; S27-V79 WeakPolarHBondContact O-CG1 3.32Å
28	I	96.9	Very high	87	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	113.5	171.7	-59.1	163.6	0	0	0	107	G42 V43 L45 L66 D69 A70 V79 L163 Q219	I28-G42 CarbonylContact O-C 3.59Å; I28-G42 WeakPolarHBondContact O-CA 3.48Å; I28-V43 HydrophobicContact CB-CB 4.45Å; I28-V43 PolarHBondContact N-O 3.08Å; I28-V43 PolarHBondContact O-N 3.25Å; I28-L45 HydrophobicContact CD1-CD2 4.03Å; I28-L45 HydrophobicContact CG1-CD2 4.08Å; I28-L66 HydrophobicContact CG2-CD2 4Å; I28-D69 HydrophobicContact CG2-CB 4.03Å; I28-A70 HydrophobicContact CD1-CB 4.16Å; I28-A70 HydrophobicContact CG1-CB 4.45Å; I28-A70 HydrophobicContact CG2-CB 4.26Å; I28-V79 HydrophobicContact CG1-CG1 4.39Å; I28-V79 HydrophobicContact CG1-CG2 3.94Å; I28-L163 HydrophobicContact CD1-CB 3.85Å; I28-L163 HydrophobicContact CD1-CD1 3.91Å; I28-L163 HydrophobicContact CD1-CD2 4.28Å; I28-L163 HydrophobicContact CD1-CG 4.22Å; I28-Q219 HydrophobicContact CD1-CB 4.11Å
29	V	96.1	Very high	87.6	Confident	32 Å²	32	53.5 Å²	53.5	19%	0.194	30%	0.297	C	S	.	.			trans	-59.7	150.4	173.6	-63.8	0	0	0	0	110.8	F31 D69 I72	V29-F31 HydrophobicContact CG2-CD1 4.31Å; V29-F31 HydrophobicContact CG2-CE1 4.18Å; V29-D69 HydrophobicContact CG2-CB 4.5Å; V29-D69 VanDerWaalsContact O-CB 3.22Å; V29-D69 WeakPolarHBondContact O-CB 3.27Å; V29-I72 HydrophobicContact CG2-CD1 4.12Å
30	T	94.9	Very high	88.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.3	C	S	.	.			trans	-109.3	-2.7	-179.5	66.4	0	0	0	0	113.8	C32 L35 D36 V43 L66	T30-C32 PolarHBondContact O-N 3.31Å; T30-C32 VanDerWaalsContact O-N 3.07Å; T30-C32 PolarHBondContact OG1-N 3.24Å; T30-C32 PolarHBondContact OG1-O 2.85Å; T30-L35 HydrophobicContact CG2-CD2 3.82Å; T30-L35 HydrophobicContact CG2-CG 4.33Å; T30-D36 VanDerWaalsContact CB-OD1 3.24Å; T30-D36 WeakPolarHBondContact CB-OD1 3.38Å; T30-D36 WeakPolarHBondContact CG2-OD1 3.17Å; T30-D36 PolarHBondContact N-OD1 3.4Å; T30-D36 PolarHBondContact N-OD2 2.89Å; T30-D36 VanDerWaalsContact OG1-CG 3.28Å; T30-D36 PolarHBondContact OG1-OD1 3.46Å; T30-V43 HydrophobicContact CG2-CG2 3.69Å; T30-L66 HydrophobicContact CG2-CD2 3.73Å
31	F	93.4	Very high	88.9	Confident	36 Å²	36	50.6 Å²	50.6	16%	0.158	31%	0.307	C	S	.	.	S	Bend	trans	54.1	19.3	-166.9	-66.1	-24.5	0	0	0	114.1	V29 I72 A104 H107 R289	V29-F31 HydrophobicContact CG2-CD1 4.31Å; V29-F31 HydrophobicContact CG2-CE1 4.18Å; F31-I72 HydrophobicContact CE1-CD1 3.81Å; F31-I72 HydrophobicContact CE2-CD1 3.96Å; F31-I72 HydrophobicContact CZ-CD1 3.31Å; F31-A104 HydrophobicContact CE2-CB 4Å; F31-H107 AromaticContact CE1-CD2 3.98Å; F31-H107 AromaticContact CZ-CD2 3.83Å; F31-R289 VanDerWaalsContact O-CD 3.25Å; F31-R289 WeakPolarHBondContact O-CD 3.29Å
32	C	94.3	Very high	89.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	28%	0.282	C	S	.	.			trans	-118	97.5	164.7	178.4	0	0	0	0	106.6	T30 S34 L35 D36 D290	T30-C32 PolarHBondContact O-N 3.31Å; T30-C32 VanDerWaalsContact O-N 3.07Å; T30-C32 PolarHBondContact OG1-N 3.24Å; T30-C32 PolarHBondContact OG1-O 2.85Å; C32-S34 PolarHBondContact O-N 3.46Å; C32-L35 HydrophobicContact CB-CB 3.86Å; C32-L35 WeakPolarHBondContact O-CA 2.79Å; C32-L35 WeakPolarHBondContact O-CB 3.48Å; C32-L35 PolarHBondContact O-N 2.87Å; C32-D36 PolarHBondContact O-N 3.19Å; C32-D290 VanDerWaalsContact CA-OD2 3.23Å; C32-D290 WeakPolarHBondContact CA-OD2 3.09Å; C32-D290 PolarHBondContact SG-OD1 3.31Å
33	E	94.2	Very high	90.8	Very high	155 Å²	155	40 Å²	40	72%	0.724	26%	0.256	S	S	*	.	H	α-helix	trans	-56.2	-40.6	-175.2	-173.3	-179.2	179.8	0	0	110.9	L35 D36 A37 D290	E33-L35 VanDerWaalsContact C-N 3.31Å; E33-L35 PolarHBondContact O-N 3.21Å; E33-D36 PolarHBondContact O-N 3.07Å; E33-A37 VanDerWaalsContact O-CB 3.25Å; E33-A37 WeakPolarHBondContact O-CB 3.3Å; E33-A37 PolarHBondContact O-N 2.99Å; E33-D290 PolarHBondContact N-OD1 2.97Å; E33-D290 PolarHBondContact N-OD2 3.08Å
34	S	94.6	Very high	91.9	Very high	60 Å²	60	34 Å²	34	42%	0.42	22%	0.224	S	C	.	.	H	α-helix	trans	-63.3	-37.4	176.9	-53.2	0	0	0	0	112.5	C32 A38 D290	C32-S34 PolarHBondContact O-N 3.46Å; S34-A38 WeakPolarHBondContact O-CB 3.28Å; S34-A38 PolarHBondContact O-N 3.4Å; S34-D290 WeakPolarHBondContact CB-OD1 3.43Å; S34-D290 PolarHBondContact N-OD1 3.08Å; S34-D290 PolarHBondContact OG-OD1 3.12Å
35	L	95.1	Very high	92.9	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-71.7	-49.1	176.1	172.6	61	0	0	0	110.2	T30 C32 E33 A37 A38 I39 L254 I266 I279	T30-L35 HydrophobicContact CG2-CD2 3.82Å; T30-L35 HydrophobicContact CG2-CG 4.33Å; C32-L35 HydrophobicContact CB-CB 3.86Å; C32-L35 WeakPolarHBondContact O-CA 2.79Å; C32-L35 WeakPolarHBondContact O-CB 3.48Å; C32-L35 PolarHBondContact O-N 2.87Å; E33-L35 VanDerWaalsContact C-N 3.31Å; E33-L35 PolarHBondContact O-N 3.21Å; L35-A37 VanDerWaalsContact C-N 3.33Å; L35-A37 PolarHBondContact O-N 2.62Å; L35-A38 WeakPolarHBondContact O-CB 3.46Å; L35-A38 PolarHBondContact O-N 3.23Å; L35-A38 VanDerWaalsContact O-N 3.08Å; L35-I39 HydrophobicContact CD1-CD1 4.36Å; L35-I39 HydrophobicContact CD1-CG2 4.27Å; L35-I39 HydrophobicContact CG-CD1 4.4Å; L35-I39 WeakPolarHBondContact O-CG1 3.32Å; L35-I39 PolarHBondContact O-N 2.71Å; L35-I39 VanDerWaalsContact O-N 3.15Å; L35-L254 HydrophobicContact CD1-CD1 3.96Å; L35-L254 HydrophobicContact CD1-CD2 3.92Å; L35-I266 HydrophobicContact CD2-CD1 4.31Å; L35-I279 HydrophobicContact CB-CD1 4.41Å; L35-I279 HydrophobicContact CB-CG2 4.43Å; L35-I279 HydrophobicContact CD1-CD1 3.91Å
36	D	95.3	Very high	93.6	Very high	19 Å²	19	29.1 Å²	29.1	10%	0.102	19%	0.193	C	C	.	.	H	α-helix	trans	-56.5	-48.5	180	-71.4	-15	0	0	0	110.5	T30 C32 E33 A38 I39 G40 G41 G42	T30-D36 VanDerWaalsContact CB-OD1 3.24Å; T30-D36 WeakPolarHBondContact CB-OD1 3.38Å; T30-D36 WeakPolarHBondContact CG2-OD1 3.17Å; T30-D36 PolarHBondContact N-OD1 3.4Å; T30-D36 PolarHBondContact N-OD2 2.89Å; T30-D36 VanDerWaalsContact OG1-CG 3.28Å; T30-D36 PolarHBondContact OG1-OD1 3.46Å; C32-D36 PolarHBondContact O-N 3.19Å; E33-D36 PolarHBondContact O-N 3.07Å; D36-A38 VanDerWaalsContact C-N 3.32Å; D36-A38 PolarHBondContact O-N 3.16Å; D36-I39 PolarHBondContact O-N 3.49Å; D36-G40 PolarHBondContact O-N 2.91Å; D36-G41 WeakPolarHBondContact O-CA 3.39Å; D36-G41 PolarHBondContact O-N 3.17Å; D36-G42 PolarHBondContact O-N 3.24Å; D36-G42 WeakPolarHBondContact OD1-CA 3.42Å
37	A	94.7	Very high	93.7	Very high	76 Å²	76	28.6 Å²	28.6	63%	0.628	19%	0.19	S	C	*	.	H	α-helix	trans	-58	-42	175.9	0	0	0	0	0	112.6	E33 L35 I39 G40	E33-A37 VanDerWaalsContact O-CB 3.25Å; E33-A37 WeakPolarHBondContact O-CB 3.3Å; E33-A37 PolarHBondContact O-N 2.99Å; L35-A37 VanDerWaalsContact C-N 3.33Å; L35-A37 PolarHBondContact O-N 2.62Å; A37-I39 VanDerWaalsContact C-N 3.3Å; A37-I39 PolarHBondContact O-N 3.16Å; A37-G40 PolarHBondContact O-N 3.23Å
38	A	93.9	Very high	93.8	Very high	15 Å²	15	27.3 Å²	27.3	12%	0.124	18%	0.181	C	C	.	.	H	α-helix	trans	-67.7	-27.3	-178.2	0	0	0	0	0	114.1	S34 L35 D36 L268 C277 I279	S34-A38 WeakPolarHBondContact O-CB 3.28Å; S34-A38 PolarHBondContact O-N 3.4Å; L35-A38 WeakPolarHBondContact O-CB 3.46Å; L35-A38 PolarHBondContact O-N 3.23Å; L35-A38 VanDerWaalsContact O-N 3.08Å; D36-A38 VanDerWaalsContact C-N 3.32Å; D36-A38 PolarHBondContact O-N 3.16Å; A38-L268 HydrophobicContact CB-CD2 4.23Å; A38-L268 WeakPolarHBondContact O-CD2 3.46Å; A38-C277 VanDerWaalsContact CB-SG 3.59Å; A38-I279 HydrophobicContact CB-CD1 3.67Å; A38-I279 HydrophobicContact CB-CG1 4.26Å
39	I	93.2	Very high	93.8	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-105.9	7.1	179.9	66.1	179.3	0	0	0	113.7	L35 D36 A37 G42 V43 L254 L268 A273	L35-I39 HydrophobicContact CD1-CD1 4.36Å; L35-I39 HydrophobicContact CD1-CG2 4.27Å; L35-I39 HydrophobicContact CG-CD1 4.4Å; L35-I39 WeakPolarHBondContact O-CG1 3.32Å; L35-I39 PolarHBondContact O-N 2.71Å; L35-I39 VanDerWaalsContact O-N 3.15Å; D36-I39 PolarHBondContact O-N 3.49Å; A37-I39 VanDerWaalsContact C-N 3.3Å; A37-I39 PolarHBondContact O-N 3.16Å; I39-G42 WeakPolarHBondContact CD1-O 3.45Å; I39-G42 WeakPolarHBondContact CG1-O 3.46Å; I39-V43 HydrophobicContact CD1-CB 4.41Å; I39-V43 HydrophobicContact CD1-CG2 3.8Å; I39-L254 HydrophobicContact CG2-CD2 4.37Å; I39-L268 HydrophobicContact CG2-CD1 4.06Å; I39-L268 HydrophobicContact CG2-CD2 4.48Å; I39-A273 WeakPolarHBondContact O-CB 3.38Å
40	G	90.7	Very high	93.9	Very high	52 Å²	52	25.7 Å²	25.7	54%	0.536	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	39.5	173	0	0	0	0	0	114.6	D36 A37	D36-G40 PolarHBondContact O-N 2.91Å; A37-G40 PolarHBondContact O-N 3.23Å
41	G	92.1	Very high	94	Very high	44 Å²	44	25.7 Å²	25.7	45%	0.454	17%	0.172	S	C	.	.	S	Bend	trans	97	19.4	176.8	0	0	0	0	0	114.8	S27 D36	S27-G41 WeakPolarHBondContact CB-O 3.33Å; D36-G41 WeakPolarHBondContact O-CA 3.39Å; D36-G41 PolarHBondContact O-N 3.17Å
42	G	94.9	Very high	94.2	Very high	0 Å²	0	24 Å²	24	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	114.9	-176.5	-178.3	0	0	0	0	0	113.2	I28 D36 I39 P44	I28-G42 CarbonylContact O-C 3.59Å; I28-G42 WeakPolarHBondContact O-CA 3.48Å; D36-G42 PolarHBondContact O-N 3.24Å; D36-G42 WeakPolarHBondContact OD1-CA 3.42Å; I39-G42 WeakPolarHBondContact CD1-O 3.45Å; I39-G42 WeakPolarHBondContact CG1-O 3.46Å; G42-P44 VanDerWaalsContact O-CD 3.31Å; G42-P44 WeakPolarHBondContact O-CD 3.35Å
43	V	95.4	Very high	94.3	Very high	2 Å²	2	24 Å²	24	1%	0.012	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	112.1	-173	-168.7	0	0	0	0	110	S27 I28 T30 I39 T49 L66 Q219 F221	S27-V43 CarbonylContact C-O 3.44Å; S27-V43 WeakPolarHBondContact CA-O 3.33Å; I28-V43 HydrophobicContact CB-CB 4.45Å; I28-V43 PolarHBondContact N-O 3.08Å; I28-V43 PolarHBondContact O-N 3.25Å; T30-V43 HydrophobicContact CG2-CG2 3.69Å; I39-V43 HydrophobicContact CD1-CB 4.41Å; I39-V43 HydrophobicContact CD1-CG2 3.8Å; V43-T49 HydrophobicContact CG1-CG2 4.35Å; V43-L66 HydrophobicContact CG2-CD1 4.26Å; V43-L66 HydrophobicContact CG2-CD2 3.8Å; V43-Q219 VanDerWaalsContact CG1-CD 3.46Å; V43-Q219 HydrophobicContact CG1-CG 3.56Å; V43-Q219 VanDerWaalsContact CG1-OE1 3.29Å; V43-F221 HydrophobicContact CG1-CD2 4.05Å
44	P	92.6	Very high	94.3	Very high	14 Å²	14	18.3 Å²	18.3	9%	0.091	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	132.6	-161.7	30.8	-36.6	0	0	0	115	G42 Q47 Q219	G42-P44 VanDerWaalsContact O-CD 3.31Å; G42-P44 WeakPolarHBondContact O-CD 3.35Å; P44-Q47 HydrophobicContact CG-CB 4.3Å; P44-Q47 HydrophobicContact CG-CG 4.22Å; P44-Q47 VanDerWaalsContact CG-OE1 3.28Å; P44-Q219 PolarHBondContact O-OE1 3.22Å
45	L	92.3	Very high	94.2	Very high	6 Å²	6	19.5 Å²	19.5	3%	0.031	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	152.6	176.3	-60.2	-168.7	0	0	0	113.2	Q26 I28 Q47 K162 Q219	Q26-L45 HydrophobicContact CB-CD1 3.86Å; Q26-L45 HydrophobicContact CB-CG 4.24Å; Q26-L45 WeakPolarHBondContact O-CB 3.19Å; Q26-L45 WeakPolarHBondContact O-CG 3.35Å; Q26-L45 PolarHBondContact O-N 2.94Å; I28-L45 HydrophobicContact CD1-CD2 4.03Å; I28-L45 HydrophobicContact CG1-CD2 4.08Å; L45-Q47 VanDerWaalsContact C-N 3.28Å; L45-Q47 PolarHBondContact O-N 3.37Å; L45-K162 HydrophobicContact CD1-CD 3.97Å; L45-K162 HydrophobicContact CD2-CB 4.27Å; L45-K162 WeakPolarHBondContact CD2-O 3.35Å; L45-Q219 HydrophobicContact CD2-CB 3.95Å
46	G	88.9	Confident	94.1	Very high	7 Å²	7	22.6 Å²	22.6	7%	0.072	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	11.6	179.6	0	0	0	0	0	114.4	L199 L218	G46-L199 WeakPolarHBondContact O-CD2 3.48Å; G46-L218 VanDerWaalsContact CA-O 3.23Å; G46-L218 WeakPolarHBondContact CA-O 3.38Å; G46-L218 PolarHBondContact N-O 2.81Å
47	Q	90.7	Very high	94.1	Very high	46 Å²	46	23 Å²	23	22%	0.215	18%	0.183	C	C	.	.	S	Bend	trans	-126.4	177.4	-178.2	-54.5	-172.3	13.2	0	0	112	P44 L45 Q219 I220 S251	P44-Q47 HydrophobicContact CG-CB 4.3Å; P44-Q47 HydrophobicContact CG-CG 4.22Å; P44-Q47 VanDerWaalsContact CG-OE1 3.28Å; L45-Q47 VanDerWaalsContact C-N 3.28Å; L45-Q47 PolarHBondContact O-N 3.37Å; Q47-Q219 PolarHBondContact O-NE2 2.72Å; Q47-I220 PolarHBondContact O-N 3.14Å; Q47-S251 WeakPolarHBondContact CB-OG 3.48Å; Q47-S251 PolarHBondContact OE1-OG 3.01Å
48	M	95.1	Very high	94.1	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.9	171.4	-178.1	169.1	49.2	0	0	109.9	I191 L195 I220 V222 L246 N249 C250 S251	M48-I191 HydrophobicContact CE-CG2 4.08Å; M48-L195 HydrophobicContact CB-CD2 4.03Å; M48-L195 HydrophobicContact CE-CD1 4.27Å; M48-L195 HydrophobicContact CE-CD2 3.81Å; M48-L195 HydrophobicContact CE-CG 3.87Å; M48-I220 CarbonylContact C-O 3.52Å; M48-I220 VanDerWaalsContact CA-O 3.26Å; M48-I220 WeakPolarHBondContact CA-O 3.17Å; M48-I220 HydrophobicContact CB-CB 4.13Å; M48-I220 HydrophobicContact CG-CB 4.03Å; M48-I220 HydrophobicContact CG-CG2 4.05Å; M48-I220 HydrophobicContact SD-CG2 4.16Å; M48-V222 HydrophobicContact SD-CG1 4.35Å; M48-L246 HydrophobicContact CE-CD1 4.31Å; M48-L246 HydrophobicContact SD-CD1 4.25Å; M48-N249 HydrophobicContact CE-CB 3.62Å; M48-N249 VanDerWaalsContact CE-O 3.24Å; M48-N249 WeakPolarHBondContact CE-O 3.36Å; M48-C250 CarbonylContact O-C 3.49Å; M48-C250 WeakPolarHBondContact O-CA 3.47Å; M48-C250 WeakPolarHBondContact O-CB 3.31Å; M48-S251 PolarHBondContact O-N 2.96Å; M48-S251 PolarHBondContact O-OG 3.37Å
49	T	96.7	Very high	94.2	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.2	-178.1	-67.3	0	0	0	0	109.1	V43 Q219 I220 F221 V222 H252 L254	V43-T49 HydrophobicContact CG1-CG2 4.35Å; T49-Q219 VanDerWaalsContact N-NE2 3.11Å; T49-Q219 PolarHBondContact OG1-NE2 3.42Å; T49-I220 PolarHBondContact N-O 3.26Å; T49-F221 HydrophobicContact CG2-CD2 3.84Å; T49-F221 HydrophobicContact CG2-CE2 3.68Å; T49-V222 PolarHBondContact O-N 2.87Å; T49-H252 HydrophobicContact CG2-CB 3.99Å; T49-L254 HydrophobicContact CG2-CD1 4.3Å
50	E	98	Very high	94.4	Very high	0 Å²	0	21 Å²	21	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.8	180	-171.3	-170.6	-168.7	0	0	111.1	V52 V222 N224 L246 C250 H252 Q253 L254	E50-V52 HydrophobicContact CG-CG2 3.53Å; E50-V52 WeakPolarHBondContact OE1-CG2 3.49Å; E50-V222 WeakPolarHBondContact CA-O 3.38Å; E50-V222 HydrophobicContact CB-CG2 4.06Å; E50-V222 HydrophobicContact CG-CG2 4.05Å; E50-N224 HydrophobicContact CG-CB 4.16Å; E50-N224 WeakPolarHBondContact OE1-CB 3.46Å; E50-N224 PolarHBondContact OE1-ND2 2.91Å; E50-L246 HydrophobicContact CG-CD2 4.21Å; E50-L246 VanDerWaalsContact OE1-CD2 3.31Å; E50-L246 WeakPolarHBondContact OE1-CD2 3.33Å; E50-C250 HydrophobicContact CB-CB 4.1Å; E50-H252 PolarHBondContact N-O 3.18Å; E50-Q253 PolarHBondContact OE2-NE2 2.71Å; E50-L254 PolarHBondContact O-N 2.97Å
51	F	97.9	Very high	94.7	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	105.8	173.3	-163.8	-106.4	0	0	0	110.8	K59 L62 F221 V222 T223 N224 L254 V256 I266 M281	F51-K59 HydrophobicContact CD1-CB 4.03Å; F51-K59 HydrophobicContact CD1-CG 3.85Å; F51-K59 HydrophobicContact CE1-CB 4.37Å; F51-K59 HydrophobicContact CE1-CG 4.07Å; F51-L62 HydrophobicContact CD1-CD2 3.98Å; F51-L62 HydrophobicContact CD2-CD2 3.54Å; F51-L62 HydrophobicContact CE1-CB 4.4Å; F51-L62 HydrophobicContact CE1-CD2 3.87Å; F51-L62 HydrophobicContact CE2-CD2 3.46Å; F51-L62 VanDerWaalsContact CE2-CD2 3.46Å; F51-L62 HydrophobicContact CG-CD2 3.83Å; F51-L62 HydrophobicContact CZ-CD2 3.61Å; F51-F221 HydrophobicContact CB-CE1 3.88Å; F51-F221 HydrophobicContact CB-CE2 4.42Å; F51-F221 HydrophobicContact CB-CZ 3.53Å; F51-F221 HydrophobicContact CD2-CZ 4.45Å; F51-F221 HydrophobicContact CG-CZ 4.09Å; F51-V222 PolarHBondContact N-O 3.32Å; F51-T223 WeakPolarHBondContact O-CA 3.21Å; F51-N224 PolarHBondContact O-N 2.82Å; F51-L254 HydrophobicContact CD2-CB 3.54Å; F51-L254 HydrophobicContact CD2-CD1 3.95Å; F51-L254 HydrophobicContact CD2-CG 4.41Å; F51-L254 HydrophobicContact CE2-CB 4.02Å; F51-L254 HydrophobicContact CE2-CD1 4.45Å; F51-V256 HydrophobicContact CD1-CG1 4.23Å; F51-V256 HydrophobicContact CE1-CB 3.8Å; F51-V256 HydrophobicContact CE1-CG1 3.52Å; F51-V256 HydrophobicContact CE1-CG2 4.34Å; F51-V256 HydrophobicContact CE2-CB 4.25Å; F51-V256 HydrophobicContact CZ-CB 3.51Å; F51-V256 HydrophobicContact CZ-CG1 3.81Å; F51-V256 HydrophobicContact CZ-CG2 3.96Å; F51-I266 HydrophobicContact CE2-CD1 4Å; F51-I266 HydrophobicContact CE2-CG1 4.02Å; F51-I266 HydrophobicContact CE2-CG2 4.08Å; F51-I266 HydrophobicContact CZ-CD1 4.24Å; F51-I266 HydrophobicContact CZ-CG1 4.15Å; F51-M281 HydrophobicContact CZ-SD 4.46Å
52	V	97.9	Very high	94.9	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	138	-169.3	-168.3	0	0	0	0	110.7	E50 N224 V226 P240 Q253 L254 F255 V256	E50-V52 HydrophobicContact CG-CG2 3.53Å; E50-V52 WeakPolarHBondContact OE1-CG2 3.49Å; V52-N224 WeakPolarHBondContact CA-O 3.34Å; V52-N224 HydrophobicContact CG1-CB 4.43Å; V52-N224 HydrophobicContact CG2-CB 4.17Å; V52-V226 HydrophobicContact CG1-CG1 3.77Å; V52-P240 HydrophobicContact CG1-CB 3.87Å; V52-P240 HydrophobicContact CG1-CG 4.19Å; V52-P240 HydrophobicContact CG2-CB 4.14Å; V52-P240 HydrophobicContact CG2-CG 4.26Å; V52-Q253 HydrophobicContact CG2-CG 4.22Å; V52-L254 PolarHBondContact N-O 2.97Å; V52-F255 HydrophobicContact CB-CD1 4.1Å; V52-F255 HydrophobicContact CB-CD2 4.07Å; V52-F255 HydrophobicContact CB-CE1 4.07Å; V52-F255 HydrophobicContact CB-CE2 4.04Å; V52-F255 HydrophobicContact CB-CG 4.15Å; V52-F255 HydrophobicContact CB-CZ 4.07Å; V52-F255 HydrophobicContact CG1-CD1 4.14Å; V52-F255 HydrophobicContact CG1-CE1 3.67Å; V52-F255 HydrophobicContact CG1-CE2 4.23Å; V52-F255 HydrophobicContact CG1-CZ 3.76Å; V52-F255 HydrophobicContact CG2-CD2 4.34Å; V52-F255 HydrophobicContact CG2-CE2 4.13Å; V52-F255 HydrophobicContact CG2-CZ 4.47Å; V52-F255 CarbonylContact O-C 3.54Å; V52-F255 VanDerWaalsContact O-CA 3.31Å; V52-F255 WeakPolarHBondContact O-CA 3.37Å; V52-V256 WeakPolarHBondContact O-CG1 3.49Å; V52-V256 PolarHBondContact O-N 3.31Å
53	G	96.6	Very high	95.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	13%	0.127	C	C	.	.			trans	177.6	167.7	166.4	0	0	0	0	0	114.1	K59 N224	G53-K59 PolarHBondContact O-NZ 3.38Å; G53-N224 PolarHBondContact N-O 2.73Å; G53-N224 VanDerWaalsContact N-O 3.14Å
54	P	94.5	Very high	95.2	Very high	37 Å²	37	18.9 Å²	18.9	24%	0.24	13%	0.127	C	C	.	.			trans	-52.2	163.6	171.1	-24.6	30.3	0	0	0	113.9	M57 K59 V226	P54-M57 HydrophobicContact CB-CG 3.8Å; P54-M57 HydrophobicContact CB-SD 4.5Å; P54-M57 HydrophobicContact CG-CG 4.12Å; P54-M57 WeakPolarHBondContact O-CB 3.31Å; P54-M57 WeakPolarHBondContact O-CG 3.33Å; P54-M57 PolarHBondContact O-N 2.8Å; P54-K59 PolarHBondContact O-NZ 3.05Å; P54-V226 HydrophobicContact CB-CG2 4.36Å; P54-V226 HydrophobicContact CG-CG2 3.98Å
55	S	92.7	Very high	95.5	Very high	84 Å²	84	18.2 Å²	18.2	59%	0.587	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	145	172.5	-59.5	0	0	0	0	111.1	M57	S55-M57 VanDerWaalsContact C-N 3.26Å; S55-M57 WeakPolarHBondContact O-CE 3.24Å; S55-M57 PolarHBondContact O-N 2.9Å
56	G	92.2	Very high	95.8	Very high	67 Å²	67	18 Å²	18	69%	0.691	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.6	5.9	179.9	0	0	0	0	0	115.8	G58	G56-G58 VanDerWaalsContact C-N 3.33Å; G56-G58 PolarHBondContact O-N 2.74Å
57	M	94.4	Very high	96.3	Very high	28 Å²	28	17.6 Å²	17.6	14%	0.138	12%	0.118	C	C	.	.	S	Bend	trans	-79.8	-10.7	-179.8	-63.8	-60.2	102.2	0	0	114.6	P54 S55 V256 K258 R264	P54-M57 HydrophobicContact CB-CG 3.8Å; P54-M57 HydrophobicContact CB-SD 4.5Å; P54-M57 HydrophobicContact CG-CG 4.12Å; P54-M57 WeakPolarHBondContact O-CB 3.31Å; P54-M57 WeakPolarHBondContact O-CG 3.33Å; P54-M57 PolarHBondContact O-N 2.8Å; S55-M57 VanDerWaalsContact C-N 3.26Å; S55-M57 WeakPolarHBondContact O-CE 3.24Å; S55-M57 PolarHBondContact O-N 2.9Å; M57-V256 HydrophobicContact CB-CB 4.5Å; M57-V256 HydrophobicContact CB-CG1 3.64Å; M57-V256 HydrophobicContact CB-CG2 4.2Å; M57-V256 HydrophobicContact CG-CG1 4.5Å; M57-K258 HydrophobicContact CE-CB 4.07Å; M57-K258 HydrophobicContact SD-CB 3.69Å; M57-K258 PolarHBondContact SD-N 3.38Å; M57-K258 VanDerWaalsContact SD-N 3.43Å; M57-R264 WeakPolarHBondContact O-CD 3.48Å; M57-R264 WeakPolarHBondContact O-CG 3.34Å; M57-R264 PolarHBondContact O-NE 2.84Å
58	G	94.6	Very high	96.6	Very high	11 Å²	11	15.4 Å²	15.4	11%	0.113	11%	0.108	C	C	.	.	S	Bend	trans	106.7	12.9	179.3	0	0	0	0	0	116	G56 T60 Q61 L62	G56-G58 VanDerWaalsContact C-N 3.33Å; G56-G58 PolarHBondContact O-N 2.74Å; G58-T60 PolarHBondContact O-N 3.32Å; G58-Q61 WeakPolarHBondContact O-CA 3.47Å; G58-Q61 VanDerWaalsContact O-CB 3.28Å; G58-Q61 WeakPolarHBondContact O-CB 3.13Å; G58-Q61 PolarHBondContact O-N 3.38Å; G58-L62 PolarHBondContact O-N 3.07Å; G58-L62 VanDerWaalsContact O-N 3.13Å
59	K	96.9	Very high	96.8	Very high	15 Å²	15	15.4 Å²	15.4	7%	0.065	11%	0.107	C	C	.	.	H	α-helix	trans	-54.4	-52.1	179.4	-55	-171.2	-63.7	-76.7	0	112.9	F51 G53 P54 Q61 L62 C63 T223 N224 V256	F51-K59 HydrophobicContact CD1-CB 4.03Å; F51-K59 HydrophobicContact CD1-CG 3.85Å; F51-K59 HydrophobicContact CE1-CB 4.37Å; F51-K59 HydrophobicContact CE1-CG 4.07Å; G53-K59 PolarHBondContact O-NZ 3.38Å; P54-K59 PolarHBondContact O-NZ 3.05Å; K59-Q61 PolarHBondContact O-N 3.33Å; K59-L62 PolarHBondContact O-N 3.34Å; K59-L62 VanDerWaalsContact O-N 3.15Å; K59-C63 PolarHBondContact O-N 3.12Å; K59-T223 HydrophobicContact CB-CG2 3.9Å; K59-N224 WeakPolarHBondContact CD-O 3.45Å; K59-N224 WeakPolarHBondContact CE-O 3.38Å; K59-V256 HydrophobicContact CG-CG1 4.12Å
60	T	97.2	Very high	96.8	Very high	27 Å²	27	15.4 Å²	15.4	17%	0.166	11%	0.107	C	C	.	.	H	α-helix	trans	-60	-31.1	174.7	-54.4	0	0	0	0	112.4	G58 C63 L64 D167	G58-T60 PolarHBondContact O-N 3.32Å; T60-C63 WeakPolarHBondContact O-CB 3.49Å; T60-C63 PolarHBondContact O-N 3.17Å; T60-L64 HydrophobicContact CG2-CD1 4.27Å; T60-L64 HydrophobicContact CG2-CG 4.36Å; T60-L64 VanDerWaalsContact O-CG 3.27Å; T60-L64 WeakPolarHBondContact O-CG 3.2Å; T60-L64 PolarHBondContact O-N 3.15Å; T60-D167 WeakPolarHBondContact CB-OD2 3.46Å; T60-D167 WeakPolarHBondContact CG2-OD2 3.48Å; T60-D167 PolarHBondContact OG1-OD2 2.59Å
61	Q	97.1	Very high	96.8	Very high	49 Å²	49	16.1 Å²	16.1	23%	0.229	11%	0.11	C	C	.	.	H	α-helix	trans	-66.5	-42	177.6	-60.2	-66.4	-47.3	0	0	111.2	G58 K59 L64 Q65 I283 V288	G58-Q61 WeakPolarHBondContact O-CA 3.47Å; G58-Q61 VanDerWaalsContact O-CB 3.28Å; G58-Q61 WeakPolarHBondContact O-CB 3.13Å; G58-Q61 PolarHBondContact O-N 3.38Å; K59-Q61 PolarHBondContact O-N 3.33Å; Q61-L64 PolarHBondContact O-N 3.2Å; Q61-Q65 WeakPolarHBondContact O-CB 3.22Å; Q61-Q65 PolarHBondContact O-N 2.8Å; Q61-I283 HydrophobicContact CB-CG2 3.96Å; Q61-I283 HydrophobicContact CG-CG2 3.8Å; Q61-V288 HydrophobicContact CB-CG2 4.42Å
62	L	97.2	Very high	96.8	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-67.3	-36.6	174.2	-176.5	58.2	0	0	0	112	F51 G58 K59 Q65 L66 F221 V288	F51-L62 HydrophobicContact CD1-CD2 3.98Å; F51-L62 HydrophobicContact CD2-CD2 3.54Å; F51-L62 HydrophobicContact CE1-CB 4.4Å; F51-L62 HydrophobicContact CE1-CD2 3.87Å; F51-L62 HydrophobicContact CE2-CD2 3.46Å; F51-L62 VanDerWaalsContact CE2-CD2 3.46Å; F51-L62 HydrophobicContact CG-CD2 3.83Å; F51-L62 HydrophobicContact CZ-CD2 3.61Å; G58-L62 PolarHBondContact O-N 3.07Å; G58-L62 VanDerWaalsContact O-N 3.13Å; K59-L62 PolarHBondContact O-N 3.34Å; K59-L62 VanDerWaalsContact O-N 3.15Å; L62-Q65 WeakPolarHBondContact O-CB 3.45Å; L62-Q65 PolarHBondContact O-N 3.33Å; L62-L66 HydrophobicContact CD1-CD1 4.38Å; L62-L66 HydrophobicContact CD1-CG 4.21Å; L62-L66 HydrophobicContact CG-CD1 4.18Å; L62-L66 HydrophobicContact CG-CG 4.46Å; L62-L66 WeakPolarHBondContact O-CB 3.07Å; L62-L66 WeakPolarHBondContact O-CG 3.48Å; L62-L66 PolarHBondContact O-N 2.85Å; L62-F221 HydrophobicContact CD2-CE1 4.49Å; L62-F221 HydrophobicContact CD2-CZ 3.72Å; L62-F221 HydrophobicContact CG-CE1 4.47Å; L62-F221 HydrophobicContact CG-CZ 4.02Å; L62-V288 HydrophobicContact CB-CG2 4.3Å; L62-V288 HydrophobicContact CD1-CB 4.46Å; L62-V288 HydrophobicContact CD1-CG1 4.31Å; L62-V288 HydrophobicContact CD1-CG2 4.29Å
63	C	98.3	Very high	96.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-45.1	173.5	-75.8	0	0	0	0	113.3	K59 T60 Q65 A67 Y85 V165 T223	K59-C63 PolarHBondContact O-N 3.12Å; T60-C63 WeakPolarHBondContact O-CB 3.49Å; T60-C63 PolarHBondContact O-N 3.17Å; C63-Q65 VanDerWaalsContact C-N 3.34Å; C63-A67 WeakPolarHBondContact O-CB 3.28Å; C63-A67 PolarHBondContact O-N 3.05Å; C63-Y85 HydrophobicContact CB-CE2 3.75Å; C63-Y85 WeakPolarHBondContact CB-OH 3.4Å; C63-V165 HydrophobicContact CB-CG1 3.78Å; C63-V165 VanDerWaalsContact SG-CG1 3.53Å; C63-T223 WeakPolarHBondContact SG-CG2 3.11Å
64	L	98.5	Very high	96.6	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-66.1	-39	176.4	-64.8	174.4	0	0	0	111.2	T60 Q61 A67 V68 Y85 F92 R96 L97 I100	T60-L64 HydrophobicContact CG2-CD1 4.27Å; T60-L64 HydrophobicContact CG2-CG 4.36Å; T60-L64 VanDerWaalsContact O-CG 3.27Å; T60-L64 WeakPolarHBondContact O-CG 3.2Å; T60-L64 PolarHBondContact O-N 3.15Å; Q61-L64 PolarHBondContact O-N 3.2Å; L64-A67 PolarHBondContact O-N 2.89Å; L64-V68 PolarHBondContact O-N 3.11Å; L64-Y85 HydrophobicContact CD2-CE2 4.06Å; L64-F92 HydrophobicContact CD2-CD2 3.61Å; L64-F92 HydrophobicContact CD2-CE2 3.67Å; L64-F92 HydrophobicContact CD2-CG 4.48Å; L64-R96 HydrophobicContact CD1-CB 4.13Å; L64-R96 HydrophobicContact CD1-CG 3.77Å; L64-L97 HydrophobicContact CB-CD1 4.24Å; L64-L97 HydrophobicContact CD2-CB 4.31Å; L64-L97 HydrophobicContact CD2-CD1 4.04Å; L64-I100 HydrophobicContact CB-CD1 3.8Å
65	Q	98.2	Very high	96.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.4	-55.2	174	-176	65.9	62.7	0	0	111.1	Q61 L62 C63 A67 V68 D69 V288	Q61-Q65 WeakPolarHBondContact O-CB 3.22Å; Q61-Q65 PolarHBondContact O-N 2.8Å; L62-Q65 WeakPolarHBondContact O-CB 3.45Å; L62-Q65 PolarHBondContact O-N 3.33Å; C63-Q65 VanDerWaalsContact C-N 3.34Å; Q65-A67 PolarHBondContact O-N 3.12Å; Q65-V68 WeakPolarHBondContact O-CB 3.43Å; Q65-V68 PolarHBondContact O-N 3.01Å; Q65-D69 VanDerWaalsContact CG-OD2 3.3Å; Q65-D69 WeakPolarHBondContact CG-OD2 3.42Å; Q65-D69 VanDerWaalsContact NE2-CG 3.33Å; Q65-D69 PolarHBondContact NE2-OD1 3.03Å; Q65-D69 PolarHBondContact NE2-OD2 2.79Å; Q65-D69 PolarHBondContact O-N 3.42Å; Q65-V288 HydrophobicContact CB-CB 4.4Å; Q65-V288 HydrophobicContact CB-CG2 4.31Å; Q65-V288 HydrophobicContact CG-CB 4.14Å
66	L	98.4	Very high	96.7	Very high	1 Å²	1	21 Å²	21	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-61.5	-32.3	179.2	-70.4	173	0	0	0	113.2	I28 T30 V43 L62 V68 D69 A70 L163 F221	I28-L66 HydrophobicContact CG2-CD2 4Å; T30-L66 HydrophobicContact CG2-CD2 3.73Å; V43-L66 HydrophobicContact CG2-CD1 4.26Å; V43-L66 HydrophobicContact CG2-CD2 3.8Å; L62-L66 HydrophobicContact CD1-CD1 4.38Å; L62-L66 HydrophobicContact CD1-CG 4.21Å; L62-L66 HydrophobicContact CG-CD1 4.18Å; L62-L66 HydrophobicContact CG-CG 4.46Å; L62-L66 WeakPolarHBondContact O-CB 3.07Å; L62-L66 WeakPolarHBondContact O-CG 3.48Å; L62-L66 PolarHBondContact O-N 2.85Å; L66-V68 VanDerWaalsContact C-N 3.29Å; L66-V68 PolarHBondContact O-N 2.91Å; L66-D69 PolarHBondContact O-N 3.05Å; L66-A70 WeakPolarHBondContact O-CB 3.34Å; L66-A70 PolarHBondContact O-N 3.34Å; L66-L163 HydrophobicContact CB-CD2 3.97Å; L66-L163 VanDerWaalsContact O-CD2 3.3Å; L66-L163 WeakPolarHBondContact O-CD2 3.41Å; L66-F221 HydrophobicContact CD1-CD1 3.89Å; L66-F221 HydrophobicContact CD1-CD2 3.45Å; L66-F221 VanDerWaalsContact CD1-CD2 3.45Å; L66-F221 HydrophobicContact CD1-CE1 3.84Å; L66-F221 HydrophobicContact CD1-CE2 3.4Å; L66-F221 HydrophobicContact CD1-CG 3.69Å; L66-F221 HydrophobicContact CD1-CZ 3.59Å
67	A	98.5	Very high	96.6	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.6	-35.2	175.1	0	0	0	0	0	112.3	C63 L64 Q65 V83 Y85 L97 I133	C63-A67 WeakPolarHBondContact O-CB 3.28Å; C63-A67 PolarHBondContact O-N 3.05Å; L64-A67 PolarHBondContact O-N 2.89Å; Q65-A67 PolarHBondContact O-N 3.12Å; A67-V83 HydrophobicContact CB-CG1 4.04Å; A67-V83 WeakPolarHBondContact O-CG2 3.41Å; A67-Y85 HydrophobicContact CB-CD2 4.43Å; A67-L97 HydrophobicContact CB-CD1 4.3Å; A67-I133 HydrophobicContact CB-CD1 4.34Å
68	V	98.5	Very high	96.6	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-74.7	-46.3	172.2	172.8	0	0	0	0	110.6	L64 Q65 L66 A70 R71 L97 I100 A101 A104 I129	L64-V68 PolarHBondContact O-N 3.11Å; Q65-V68 WeakPolarHBondContact O-CB 3.43Å; Q65-V68 PolarHBondContact O-N 3.01Å; L66-V68 VanDerWaalsContact C-N 3.29Å; L66-V68 PolarHBondContact O-N 2.91Å; V68-A70 VanDerWaalsContact C-N 3.28Å; V68-A70 PolarHBondContact O-N 3.25Å; V68-R71 WeakPolarHBondContact O-CB 3.48Å; V68-R71 PolarHBondContact O-N 3.44Å; V68-L97 HydrophobicContact CG2-CD1 3.63Å; V68-L97 HydrophobicContact CG2-CG 4.35Å; V68-I100 HydrophobicContact CB-CG2 4.19Å; V68-I100 HydrophobicContact CG1-CG2 4.46Å; V68-I100 HydrophobicContact CG2-CB 4.36Å; V68-I100 HydrophobicContact CG2-CG2 3.96Å; V68-A101 HydrophobicContact CG1-CB 4.27Å; V68-A101 HydrophobicContact CG2-CB 4Å; V68-A104 HydrophobicContact CG1-CB 3.52Å; V68-I129 HydrophobicContact CG1-CG2 4.48Å; V68-I129 HydrophobicContact CG2-CG2 4.45Å
69	D	97.9	Very high	96.7	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-65.3	-33.2	-173.3	-61.2	-15.6	0	0	0	112.4	I28 V29 Q65 L66 R71 I72	I28-D69 HydrophobicContact CG2-CB 4.03Å; V29-D69 HydrophobicContact CG2-CB 4.5Å; V29-D69 VanDerWaalsContact O-CB 3.22Å; V29-D69 WeakPolarHBondContact O-CB 3.27Å; Q65-D69 VanDerWaalsContact CG-OD2 3.3Å; Q65-D69 WeakPolarHBondContact CG-OD2 3.42Å; Q65-D69 VanDerWaalsContact NE2-CG 3.33Å; Q65-D69 PolarHBondContact NE2-OD1 3.03Å; Q65-D69 PolarHBondContact NE2-OD2 2.79Å; Q65-D69 PolarHBondContact O-N 3.42Å; L66-D69 PolarHBondContact O-N 3.05Å; D69-R71 PolarHBondContact O-N 2.91Å; D69-I72 HydrophobicContact CB-CD1 4.03Å; D69-I72 WeakPolarHBondContact O-CB 3.04Å; D69-I72 WeakPolarHBondContact O-CG1 3.46Å; D69-I72 PolarHBondContact O-N 3.5Å
70	A	97.8	Very high	96.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.8	173.1	0	0	0	0	0	112.9	I28 L66 V68 I72 V79 G81 V83 L163	I28-A70 HydrophobicContact CD1-CB 4.16Å; I28-A70 HydrophobicContact CG1-CB 4.45Å; I28-A70 HydrophobicContact CG2-CB 4.26Å; L66-A70 WeakPolarHBondContact O-CB 3.34Å; L66-A70 PolarHBondContact O-N 3.34Å; V68-A70 VanDerWaalsContact C-N 3.28Å; V68-A70 PolarHBondContact O-N 3.25Å; A70-I72 VanDerWaalsContact C-N 3.34Å; A70-V79 HydrophobicContact CB-CG2 4.49Å; A70-V79 WeakPolarHBondContact O-CG2 3.39Å; A70-G81 CarbonylContact C-O 3.56Å; A70-G81 PolarHBondContact O-N 3.37Å; A70-G81 VanDerWaalsContact O-O 3.08Å; A70-V83 HydrophobicContact CB-CG2 3.67Å; A70-L163 HydrophobicContact CB-CB 4.04Å; A70-L163 HydrophobicContact CB-CD2 3.98Å
71	R	97.8	Very high	96.5	Very high	16 Å²	16	20 Å²	20	6%	0.06	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.4	177.5	-62	-59.6	-57.6	113.6	5.6	113.7	V68 D69 D80 G81 F124 K128 I129 I133	V68-R71 WeakPolarHBondContact O-CB 3.48Å; V68-R71 PolarHBondContact O-N 3.44Å; D69-R71 PolarHBondContact O-N 2.91Å; R71-D80 IonicContact CZ-OD1 2.9Å; R71-D80 VanDerWaalsContact NH1-C 3.26Å; R71-D80 PolarHBondContact NH1-O 3.46Å; R71-D80 IonicContact NH1-OD1 3.99Å; R71-D80 PolarHBondContact NH1-OD1 3.23Å; R71-D80 IonicContact NH2-OD1 3.24Å; R71-D80 PolarHBondContact NH2-OD1 3.24Å; R71-G81 WeakPolarHBondContact CD-O 3.38Å; R71-G81 PolarHBondContact NH1-O 3.4Å; R71-F124 HydrophobicContact CB-CE2 4.5Å; R71-K128 PolarHBondContact NE-O 2.88Å; R71-K128 PolarHBondContact NH2-O 3.1Å; R71-I129 HydrophobicContact CB-CB 4.42Å; R71-I129 HydrophobicContact CB-CG1 4.17Å; R71-I129 HydrophobicContact CB-CG2 4.2Å; R71-I129 HydrophobicContact CG-CG2 4.08Å; R71-I133 HydrophobicContact CG-CD1 4.42Å; R71-I133 HydrophobicContact CG-CG1 4.26Å
72	I	97.3	Very high	96.6	Very high	1 Å²	1	19 Å²	19	1%	0.005	11%	0.113	C	C	.	.	S	Bend	trans	-63.8	131.5	179.6	-63.3	166.9	0	0	0	109.4	V29 F31 D69 A70 L76 G78 V79 D80 F124	V29-I72 HydrophobicContact CG2-CD1 4.12Å; F31-I72 HydrophobicContact CE1-CD1 3.81Å; F31-I72 HydrophobicContact CE2-CD1 3.96Å; F31-I72 HydrophobicContact CZ-CD1 3.31Å; D69-I72 HydrophobicContact CB-CD1 4.03Å; D69-I72 WeakPolarHBondContact O-CB 3.04Å; D69-I72 WeakPolarHBondContact O-CG1 3.46Å; D69-I72 PolarHBondContact O-N 3.5Å; A70-I72 VanDerWaalsContact C-N 3.34Å; I72-L76 HydrophobicContact CG2-CB 3.76Å; I72-G78 CarbonylContact O-C 3.57Å; I72-G78 VanDerWaalsContact O-CA 3.24Å; I72-G78 WeakPolarHBondContact O-CA 3.33Å; I72-V79 PolarHBondContact O-N 3.12Å; I72-D80 WeakPolarHBondContact O-CA 3.44Å; I72-D80 PolarHBondContact O-N 2.88Å; I72-F124 HydrophobicContact CB-CZ 4.44Å; I72-F124 HydrophobicContact CG1-CE1 4.47Å; I72-F124 HydrophobicContact CG1-CE2 4.15Å; I72-F124 HydrophobicContact CG1-CZ 3.7Å
73	P	96.4	Very high	96.6	Very high	13 Å²	13	19 Å²	19	8%	0.084	11%	0.113	C	C	.	.			trans	-60.1	149.5	177	-27.3	34.2	0	0	0	114.5	L76 G77 G78 A120 F124	P73-L76 HydrophobicContact CB-CD1 4.28Å; P73-L76 HydrophobicContact CG-CD1 4.03Å; P73-L76 CarbonylContact O-C 3.57Å; P73-L76 WeakPolarHBondContact O-CA 3.45Å; P73-L76 WeakPolarHBondContact O-CB 3.44Å; P73-L76 PolarHBondContact O-N 3.21Å; P73-G77 PolarHBondContact O-N 3.2Å; P73-G78 PolarHBondContact O-N 2.87Å; P73-A120 HydrophobicContact CB-CB 3.97Å; P73-A120 HydrophobicContact CG-CB 4.41Å; P73-F124 VanDerWaalsContact CD-CD2 3.44Å; P73-F124 HydrophobicContact CG-CB 4.03Å; P73-F124 HydrophobicContact CG-CD2 4.11Å; P73-F124 HydrophobicContact CG-CG 4.25Å
74	E	94.5	Very high	96.6	Very high	112 Å²	112	19.3 Å²	19.3	52%	0.523	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	-57	-41.7	178.2	-62.9	-172.4	158.8	0	0	114.1	Q26 L76 G77 G78	Q26-E74 PolarHBondContact NE2-OE1 2.77Å; E74-L76 PolarHBondContact O-N 3.45Å; E74-L76 VanDerWaalsContact O-N 3.12Å; E74-G77 PolarHBondContact O-N 3.48Å; E74-G78 WeakPolarHBondContact CA-O 3.47Å
75	P	94.8	Very high	96.6	Very high	65 Å²	65	19.2 Å²	19.2	42%	0.422	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	-61.5	-22.1	176.1	-25.4	36.9	0	0	0	113.9	G77 Q117 A120	P75-G77 VanDerWaalsContact C-N 3.35Å; P75-Q117 WeakPolarHBondContact O-CG 3.25Å; P75-Q117 PolarHBondContact O-NE2 3.46Å; P75-A120 HydrophobicContact CB-CB 3.95Å; P75-A120 HydrophobicContact CG-CB 3.97Å
76	L	94.3	Very high	96.7	Very high	31 Å²	31	19.2 Å²	19.2	16%	0.162	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-93.6	8.7	175.9	-66	167.4	0	0	0	112.5	I72 P73 E74 C108 A112 Q117 A120 L121	I72-L76 HydrophobicContact CG2-CB 3.76Å; P73-L76 HydrophobicContact CB-CD1 4.28Å; P73-L76 HydrophobicContact CG-CD1 4.03Å; P73-L76 CarbonylContact O-C 3.57Å; P73-L76 WeakPolarHBondContact O-CA 3.45Å; P73-L76 WeakPolarHBondContact O-CB 3.44Å; P73-L76 PolarHBondContact O-N 3.21Å; E74-L76 PolarHBondContact O-N 3.45Å; E74-L76 VanDerWaalsContact O-N 3.12Å; L76-C108 HydrophobicContact CD1-CB 4.18Å; L76-C108 HydrophobicContact CD2-CB 4.49Å; L76-A112 HydrophobicContact CD2-CB 4.39Å; L76-Q117 HydrophobicContact CD2-CB 3.77Å; L76-Q117 HydrophobicContact CD2-CG 3.87Å; L76-A120 HydrophobicContact CD1-CB 4.36Å; L76-A120 HydrophobicContact CG-CB 4.38Å; L76-L121 HydrophobicContact CD1-CD2 3.7Å; L76-L121 HydrophobicContact CD1-CG 4.06Å; L76-L121 HydrophobicContact CD2-CD2 4.34Å; L76-L121 HydrophobicContact CD2-CG 4.3Å
77	G	91.2	Very high	96.7	Very high	47 Å²	47	19.2 Å²	19.2	49%	0.485	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	8.2	178.9	0	0	0	0	0	115	P73 E74 P75	P73-G77 PolarHBondContact O-N 3.2Å; E74-G77 PolarHBondContact O-N 3.48Å; P75-G77 VanDerWaalsContact C-N 3.35Å
78	G	94.4	Very high	96.6	Very high	8 Å²	8	19.5 Å²	19.5	8%	0.082	12%	0.116	C	C	.	.	S	Bend	trans	-91.3	-162.1	174.2	0	0	0	0	0	113.6	I72 P73 E74	I72-G78 CarbonylContact O-C 3.57Å; I72-G78 VanDerWaalsContact O-CA 3.24Å; I72-G78 WeakPolarHBondContact O-CA 3.33Å; P73-G78 PolarHBondContact O-N 2.87Å; E74-G78 WeakPolarHBondContact CA-O 3.47Å
79	V	94.8	Very high	96.3	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.024	13%	0.13	C	C	.	.			trans	-120.9	2.4	-177.5	-58.5	0	0	0	0	114.2	Q26 S27 I28 A70 I72 G81 K162	Q26-V79 HydrophobicContact CB-CG1 4.04Å; S27-V79 WeakPolarHBondContact O-CG1 3.32Å; I28-V79 HydrophobicContact CG1-CG1 4.39Å; I28-V79 HydrophobicContact CG1-CG2 3.94Å; A70-V79 HydrophobicContact CB-CG2 4.49Å; A70-V79 WeakPolarHBondContact O-CG2 3.39Å; I72-V79 PolarHBondContact O-N 3.12Å; V79-G81 PolarHBondContact O-N 2.9Å; V79-K162 HydrophobicContact CG2-CB 4.09Å; V79-K162 HydrophobicContact CG2-CG 4.3Å
80	D	95.5	Very high	96.1	Very high	69 Å²	69	25.3 Å²	25.3	37%	0.369	15%	0.15	S	C	.	.			trans	37.6	45.3	-172.6	-167.5	17.6	0	0	0	113.7	R71 I72	R71-D80 IonicContact CZ-OD1 2.9Å; R71-D80 VanDerWaalsContact NH1-C 3.26Å; R71-D80 PolarHBondContact NH1-O 3.46Å; R71-D80 IonicContact NH1-OD1 3.99Å; R71-D80 PolarHBondContact NH1-OD1 3.23Å; R71-D80 IonicContact NH2-OD1 3.24Å; R71-D80 PolarHBondContact NH2-OD1 3.24Å; I72-D80 WeakPolarHBondContact O-CA 3.44Å; I72-D80 PolarHBondContact O-N 2.88Å
81	G	96	Very high	95.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.162	C	C	.	.			trans	-106.5	134.3	-169.3	0	0	0	0	0	113	A70 R71 V79 K160	A70-G81 CarbonylContact C-O 3.56Å; A70-G81 PolarHBondContact O-N 3.37Å; A70-G81 VanDerWaalsContact O-O 3.08Å; R71-G81 WeakPolarHBondContact CD-O 3.38Å; R71-G81 PolarHBondContact NH1-O 3.4Å; V79-G81 PolarHBondContact O-N 2.9Å; G81-K160 CarbonylContact C-O 3.59Å; G81-K160 WeakPolarHBondContact CA-O 3.49Å
82	E	97.7	Very high	95.9	Very high	28 Å²	28	27.4 Å²	27.4	13%	0.131	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	159.5	171.3	-67.5	175.4	-172.4	0	0	111.3	G132 Y134 K160 V161 K162 L163	E82-G132 CarbonylContact C-O 3.55Å; E82-G132 WeakPolarHBondContact CA-O 3.22Å; E82-G132 WeakPolarHBondContact CB-O 3.21Å; E82-Y134 HydrophobicContact CB-CE2 4.03Å; E82-Y134 HydrophobicContact CG-CE2 4.43Å; E82-Y134 VanDerWaalsContact OE2-CE2 3.26Å; E82-Y134 WeakPolarHBondContact OE2-CE2 3.21Å; E82-Y134 PolarHBondContact OE2-OH 3.29Å; E82-K160 HydrophobicContact CB-CB 4.36Å; E82-K160 HydrophobicContact CG-CB 3.89Å; E82-K160 PolarHBondContact N-O 3.38Å; E82-V161 HydrophobicContact CB-CG2 4.04Å; E82-V161 CarbonylContact O-C 3.51Å; E82-V161 VanDerWaalsContact O-CA 3.31Å; E82-V161 WeakPolarHBondContact O-CA 3.25Å; E82-K162 PolarHBondContact O-N 3.47Å; E82-L163 PolarHBondContact O-N 2.84Å
83	V	98.6	Very high	95.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	135	-171.1	-174.4	0	0	0	0	110.9	A67 A70 G132 I133 Y134 L163 V165	A67-V83 HydrophobicContact CB-CG1 4.04Å; A67-V83 WeakPolarHBondContact O-CG2 3.41Å; A70-V83 HydrophobicContact CB-CG2 3.67Å; V83-G132 PolarHBondContact N-O 3.13Å; V83-I133 HydrophobicContact CB-CG1 4.12Å; V83-I133 HydrophobicContact CB-CG2 4.37Å; V83-I133 HydrophobicContact CG2-CG1 4.27Å; V83-Y134 WeakPolarHBondContact O-CD2 3.42Å; V83-Y134 PolarHBondContact O-N 3.07Å; V83-L163 CarbonylContact C-O 3.56Å; V83-L163 WeakPolarHBondContact CA-O 3.49Å; V83-L163 HydrophobicContact CG1-CB 4.19Å; V83-L163 HydrophobicContact CG1-CD2 3.96Å; V83-L163 HydrophobicContact CG1-CG 4.08Å; V83-L163 HydrophobicContact CG2-CB 4.17Å; V83-L163 HydrophobicContact CG2-CD2 4.31Å; V83-V165 HydrophobicContact CG1-CG2 4.47Å
84	V	98.5	Very high	95.9	Very high	8 Å²	8	39.7 Å²	39.7	5%	0.048	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	117.7	164.5	-179.7	0	0	0	0	108.7	I86 Y134 L151 F154 V161 L163 I164 V165	V84-I86 HydrophobicContact CG1-CG1 4.19Å; V84-Y134 CarbonylContact C-O 3.04Å; V84-Y134 WeakPolarHBondContact CA-O 3.27Å; V84-Y134 HydrophobicContact CG2-CD2 4.32Å; V84-L151 HydrophobicContact CG1-CD2 3.98Å; V84-F154 HydrophobicContact CG2-CD1 3.97Å; V84-F154 HydrophobicContact CG2-CE1 3.62Å; V84-V161 HydrophobicContact CG2-CG1 4.05Å; V84-V161 HydrophobicContact CG2-CG2 4.27Å; V84-L163 PolarHBondContact N-O 3.12Å; V84-I164 HydrophobicContact CB-CG1 4.24Å; V84-I164 CarbonylContact O-C 3.51Å; V84-I164 VanDerWaalsContact O-CA 3.31Å; V84-I164 WeakPolarHBondContact O-CA 3.37Å; V84-V165 PolarHBondContact O-N 3.24Å
85	Y	98.7	Very high	96.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	109.7	177	-161.1	-68.1	0	0	0	110.1	C63 L64 A67 D87 F92 Y134 V135 Q136 V165 D167	C63-Y85 HydrophobicContact CB-CE2 3.75Å; C63-Y85 WeakPolarHBondContact CB-OH 3.4Å; L64-Y85 HydrophobicContact CD2-CE2 4.06Å; A67-Y85 HydrophobicContact CB-CD2 4.43Å; Y85-D87 HydrophobicContact CD1-CB 4.05Å; Y85-D87 HydrophobicContact CE1-CB 4.06Å; Y85-F92 AromaticContact CD1-CD2 3.88Å; Y85-F92 HydrophobicContact CD1-CD2 3.88Å; Y85-F92 HydrophobicContact CD2-CD2 4.04Å; Y85-F92 HydrophobicContact CD2-CE2 4.17Å; Y85-F92 HydrophobicContact CE1-CB 4.3Å; Y85-F92 AromaticContact CE1-CD2 3.93Å; Y85-F92 HydrophobicContact CE1-CD2 3.93Å; Y85-F92 HydrophobicContact CE2-CD2 4.04Å; Y85-F92 HydrophobicContact CE2-CE2 4.46Å; Y85-F92 AromaticContact CG-CD2 3.95Å; Y85-F92 HydrophobicContact CG-CD2 3.95Å; Y85-F92 HydrophobicContact CG-CE2 4.24Å; Y85-Y134 PolarHBondContact N-O 3.28Å; Y85-V135 WeakPolarHBondContact O-CA 3.43Å; Y85-Q136 PolarHBondContact O-N 2.71Å; Y85-V165 HydrophobicContact CD2-CB 3.94Å; Y85-V165 HydrophobicContact CD2-CG1 3.95Å; Y85-V165 HydrophobicContact CD2-CG2 4.29Å; Y85-V165 HydrophobicContact CE1-CG1 4.43Å; Y85-V165 HydrophobicContact CE2-CB 4.26Å; Y85-V165 HydrophobicContact CE2-CG1 3.75Å; Y85-V165 HydrophobicContact CG-CB 4.28Å; Y85-V165 HydrophobicContact CG-CG1 4.39Å; Y85-D167 HydrophobicContact CE1-CB 3.86Å; Y85-D167 WeakPolarHBondContact OH-CB 3.31Å; Y85-D167 PolarHBondContact OH-OD2 2.88Å
86	I	98.6	Very high	96.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	104.9	175.1	-55.8	178.2	0	0	0	108.4	V84 T88 Q136 F144 L151 I164 V165 V166 D167	V84-I86 HydrophobicContact CG1-CG1 4.19Å; I86-T88 HydrophobicContact CG2-CG2 4.14Å; I86-Q136 WeakPolarHBondContact CA-O 3.34Å; I86-F144 HydrophobicContact CG2-CD2 3.95Å; I86-F144 HydrophobicContact CG2-CE2 3.97Å; I86-L151 HydrophobicContact CD1-CD1 4Å; I86-L151 HydrophobicContact CD1-CD2 4.32Å; I86-I164 HydrophobicContact CD1-CG2 4.24Å; I86-V165 WeakPolarHBondContact CB-O 3.42Å; I86-V165 PolarHBondContact N-O 3.44Å; I86-V166 HydrophobicContact CD1-CG2 4.28Å; I86-D167 PolarHBondContact O-N 2.92Å
87	D	98.2	Very high	96.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	103.1	-179.3	-177.3	9.2	0	0	0	109.7	Y85 E89 C90 T91 F92 Q136 R137 C138	Y85-D87 HydrophobicContact CD1-CB 4.05Å; Y85-D87 HydrophobicContact CE1-CB 4.06Å; D87-E89 PolarHBondContact OD1-N 3.46Å; D87-C90 WeakPolarHBondContact OD1-CA 3.33Å; D87-C90 PolarHBondContact OD1-N 3.5Å; D87-C90 VanDerWaalsContact OD2-CA 3.22Å; D87-C90 WeakPolarHBondContact OD2-CA 3.32Å; D87-T91 PolarHBondContact OD1-N 3.32Å; D87-T91 PolarHBondContact OD2-N 3.19Å; D87-F92 HydrophobicContact CB-CB 4.27Å; D87-F92 WeakPolarHBondContact OD2-CB 3.3Å; D87-F92 PolarHBondContact OD2-N 2.97Å; D87-F92 VanDerWaalsContact OD2-N 3.12Å; D87-Q136 PolarHBondContact N-O 3.4Å; D87-R137 HydrophobicContact CB-CG 4.25Å; D87-R137 CarbonylContact O-C 3.53Å; D87-R137 WeakPolarHBondContact O-CA 3.45Å; D87-R137 IonicContact OD2-NE 3.63Å; D87-C138 PolarHBondContact O-N 3.05Å
88	T	97.2	Very high	96.8	Very high	6 Å²	6	34.7 Å²	34.7	4%	0.037	18%	0.182	C	C	.	.	S	Bend	trans	-93.5	-20.8	-179.5	73.3	0	0	0	0	112.8	I86 C138 F144 V166 D167 S168 T171	I86-T88 HydrophobicContact CG2-CG2 4.14Å; T88-C138 WeakPolarHBondContact CA-O 3.27Å; T88-C138 HydrophobicContact CG2-CB 4.47Å; T88-F144 HydrophobicContact CG2-CD2 4.07Å; T88-F144 HydrophobicContact CG2-CE2 4.25Å; T88-V166 HydrophobicContact CG2-CG1 4.37Å; T88-D167 PolarHBondContact N-O 3.45Å; T88-D167 PolarHBondContact OG1-O 2.9Å; T88-S168 PolarHBondContact OG1-N 3.38Å; T88-S168 PolarHBondContact OG1-O 3.45Å; T88-T171 WeakPolarHBondContact OG1-CB 3.34Å; T88-T171 PolarHBondContact OG1-OG1 2.99Å
89	E	92.6	Very high	97	Very high	63 Å²	63	37.5 Å²	37.5	29%	0.294	19%	0.193	S	C	.	.	S	Bend	trans	-103.9	-0.2	-178	-65.3	-171.6	-177.3	0	0	113.2	D87 T91 S168 T171 Q225	D87-E89 PolarHBondContact OD1-N 3.46Å; E89-T91 VanDerWaalsContact C-N 3.25Å; E89-T91 HydrophobicContact CB-CG2 3.65Å; E89-T91 PolarHBondContact O-N 3.21Å; E89-S168 VanDerWaalsContact OE1-CB 3.26Å; E89-S168 WeakPolarHBondContact OE1-CB 3.34Å; E89-T171 HydrophobicContact CG-CG2 3.94Å; E89-T171 VanDerWaalsContact CG-OG1 3.25Å; E89-T171 WeakPolarHBondContact CG-OG1 3.39Å; E89-T171 PolarHBondContact OE1-OG1 2.95Å; E89-Q225 PolarHBondContact OE1-NE2 3.28Å
90	C	93.6	Very high	97.2	Very high	61 Å²	61	37.3 Å²	37.3	41%	0.412	19%	0.192	S	C	.	.	S	Bend	trans	57.9	36.7	-173.3	-63.7	0	0	0	0	112.9	D87	D87-C90 WeakPolarHBondContact OD1-CA 3.33Å; D87-C90 PolarHBondContact OD1-N 3.5Å; D87-C90 VanDerWaalsContact OD2-CA 3.22Å; D87-C90 WeakPolarHBondContact OD2-CA 3.32Å
91	T	93.6	Very high	97.3	Very high	41 Å²	41	34 Å²	34	25%	0.252	17%	0.174	S	C	.	.			trans	-95.6	-10.7	-176.2	55.5	0	0	0	0	113.1	D87 E89 R93 D167	D87-T91 PolarHBondContact OD1-N 3.32Å; D87-T91 PolarHBondContact OD2-N 3.19Å; E89-T91 VanDerWaalsContact C-N 3.25Å; E89-T91 HydrophobicContact CB-CG2 3.65Å; E89-T91 PolarHBondContact O-N 3.21Å; T91-R93 PolarHBondContact O-N 3.49Å; T91-D167 PolarHBondContact OG1-OD2 3.38Å
92	F	97.2	Very high	97.4	Very high	18 Å²	18	39.9 Å²	39.9	8%	0.079	20%	0.196	C	C	.	.			trans	-64.1	125	-179.9	-177.4	-83.7	0	0	0	111.4	L64 Y85 D87 I94 L97 V135	L64-F92 HydrophobicContact CD2-CD2 3.61Å; L64-F92 HydrophobicContact CD2-CE2 3.67Å; L64-F92 HydrophobicContact CD2-CG 4.48Å; Y85-F92 AromaticContact CD1-CD2 3.88Å; Y85-F92 HydrophobicContact CD1-CD2 3.88Å; Y85-F92 HydrophobicContact CD2-CD2 4.04Å; Y85-F92 HydrophobicContact CD2-CE2 4.17Å; Y85-F92 HydrophobicContact CE1-CB 4.3Å; Y85-F92 AromaticContact CE1-CD2 3.93Å; Y85-F92 HydrophobicContact CE1-CD2 3.93Å; Y85-F92 HydrophobicContact CE2-CD2 4.04Å; Y85-F92 HydrophobicContact CE2-CE2 4.46Å; Y85-F92 AromaticContact CG-CD2 3.95Å; Y85-F92 HydrophobicContact CG-CD2 3.95Å; Y85-F92 HydrophobicContact CG-CE2 4.24Å; D87-F92 HydrophobicContact CB-CB 4.27Å; D87-F92 WeakPolarHBondContact OD2-CB 3.3Å; D87-F92 PolarHBondContact OD2-N 2.97Å; D87-F92 VanDerWaalsContact OD2-N 3.12Å; F92-I94 HydrophobicContact CE1-CB 4.34Å; F92-I94 HydrophobicContact CE1-CD1 4.39Å; F92-L97 HydrophobicContact CE2-CD2 4.03Å; F92-L97 HydrophobicContact CZ-CB 4.37Å; F92-L97 HydrophobicContact CZ-CD2 3.55Å; F92-L97 HydrophobicContact CZ-CG 4.49Å; F92-V135 HydrophobicContact CD1-CG1 4.32Å; F92-V135 HydrophobicContact CD1-CG2 4.47Å; F92-V135 HydrophobicContact CD2-CG1 4.4Å; F92-V135 HydrophobicContact CD2-CG2 4.33Å; F92-V135 HydrophobicContact CE1-CG2 3.98Å; F92-V135 HydrophobicContact CE2-CG2 3.81Å; F92-V135 HydrophobicContact CG-CG1 4.2Å; F92-V135 HydrophobicContact CZ-CG2 3.6Å
93	R	97.4	Very high	97.4	Very high	172 Å²	172	42 Å²	42	65%	0.649	21%	0.205	S	C	*	.			trans	-122.1	112.3	179	-61.5	-59.3	178.2	137.5	-3.2	110.6	T91 G95 R96 L97	T91-R93 PolarHBondContact O-N 3.49Å; R93-G95 PolarHBondContact O-N 3.01Å; R93-R96 HydrophobicContact CB-CB 4.12Å; R93-R96 PolarHBondContact O-N 3.39Å; R93-R96 VanDerWaalsContact O-N 3.1Å; R93-L97 PolarHBondContact O-N 2.89Å; R93-L97 VanDerWaalsContact O-N 3.07Å
94	I	97.6	Very high	97.3	Very high	100 Å²	100	42 Å²	42	51%	0.513	21%	0.205	S	C	.	.	H	α-helix	trans	-58.8	-43	-178.5	-172.7	58.4	0	0	0	112.7	F92 R96 L97 E98 L130	F92-I94 HydrophobicContact CE1-CB 4.34Å; F92-I94 HydrophobicContact CE1-CD1 4.39Å; I94-R96 PolarHBondContact O-N 2.99Å; I94-L97 HydrophobicContact CD1-CD2 4.29Å; I94-L97 WeakPolarHBondContact O-CB 3.43Å; I94-L97 PolarHBondContact O-N 3.35Å; I94-L97 VanDerWaalsContact O-N 3.12Å; I94-E98 WeakPolarHBondContact O-CB 3.42Å; I94-E98 PolarHBondContact O-N 2.85Å; I94-L130 HydrophobicContact CD1-CD2 4.21Å
95	G	98	Very high	97.2	Very high	46 Å²	46	43.1 Å²	43.1	47%	0.474	21%	0.211	S	C	.	.	H	α-helix	trans	-62.8	-30.6	178.9	0	0	0	0	0	113.2	R93 Q99	R93-G95 PolarHBondContact O-N 3.01Å; G95-Q99 WeakPolarHBondContact O-CB 3.38Å; G95-Q99 PolarHBondContact O-N 3.24Å; G95-Q99 VanDerWaalsContact O-N 3.11Å
96	R	98	Very high	97.1	Very high	37 Å²	37	48 Å²	48	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-75.6	-40	174.4	-177.6	55.4	175.7	155.7	6	111.8	L64 R93 I94 E98 Q99 I100 G284 E285	L64-R96 HydrophobicContact CD1-CB 4.13Å; L64-R96 HydrophobicContact CD1-CG 3.77Å; R93-R96 HydrophobicContact CB-CB 4.12Å; R93-R96 PolarHBondContact O-N 3.39Å; R93-R96 VanDerWaalsContact O-N 3.1Å; I94-R96 PolarHBondContact O-N 2.99Å; R96-E98 VanDerWaalsContact C-N 3.33Å; R96-Q99 PolarHBondContact O-N 3.4Å; R96-I100 HydrophobicContact CG-CD1 4.2Å; R96-I100 WeakPolarHBondContact O-CG1 3.39Å; R96-I100 PolarHBondContact O-N 3.18Å; R96-I100 VanDerWaalsContact O-N 3.1Å; R96-G284 PolarHBondContact NH1-O 2.87Å; R96-G284 PolarHBondContact NH2-O 3.12Å; R96-E285 PolarHBondContact NH1-O 2.86Å
97	L	98.5	Very high	96.9	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-46	173.7	-175.1	72	0	0	0	110.8	L64 A67 V68 F92 R93 I94 Q99 I100 A101 L130 I133	L64-L97 HydrophobicContact CB-CD1 4.24Å; L64-L97 HydrophobicContact CD2-CB 4.31Å; L64-L97 HydrophobicContact CD2-CD1 4.04Å; A67-L97 HydrophobicContact CB-CD1 4.3Å; V68-L97 HydrophobicContact CG2-CD1 3.63Å; V68-L97 HydrophobicContact CG2-CG 4.35Å; F92-L97 HydrophobicContact CE2-CD2 4.03Å; F92-L97 HydrophobicContact CZ-CB 4.37Å; F92-L97 HydrophobicContact CZ-CD2 3.55Å; F92-L97 HydrophobicContact CZ-CG 4.49Å; R93-L97 PolarHBondContact O-N 2.89Å; R93-L97 VanDerWaalsContact O-N 3.07Å; I94-L97 HydrophobicContact CD1-CD2 4.29Å; I94-L97 WeakPolarHBondContact O-CB 3.43Å; I94-L97 PolarHBondContact O-N 3.35Å; I94-L97 VanDerWaalsContact O-N 3.12Å; L97-Q99 VanDerWaalsContact C-N 3.34Å; L97-Q99 PolarHBondContact O-N 2.91Å; L97-I100 PolarHBondContact O-N 2.91Å; L97-A101 WeakPolarHBondContact O-CB 3.46Å; L97-A101 PolarHBondContact O-N 3.38Å; L97-L130 HydrophobicContact CD2-CD2 3.71Å; L97-L130 HydrophobicContact CG-CD2 4.15Å; L97-I133 HydrophobicContact CD1-CD1 4.3Å; L97-I133 HydrophobicContact CD2-CD1 3.86Å; L97-I133 HydrophobicContact CD2-CG2 4.46Å
98	E	98.4	Very high	96.8	Very high	66 Å²	66	51.6 Å²	51.6	31%	0.308	25%	0.254	S	S	.	.	H	α-helix	trans	-57.9	-46.5	177	-172	-165.9	153.9	0	0	111.5	I94 R96 I100 A101 R102 L126	I94-E98 WeakPolarHBondContact O-CB 3.42Å; I94-E98 PolarHBondContact O-N 2.85Å; R96-E98 VanDerWaalsContact C-N 3.33Å; E98-I100 PolarHBondContact O-N 2.88Å; E98-A101 PolarHBondContact O-N 3.34Å; E98-R102 WeakPolarHBondContact O-CG 3.42Å; E98-R102 PolarHBondContact O-N 3.3Å; E98-R102 IonicContact OE1-CZ 2.85Å; E98-R102 VanDerWaalsContact OE1-CZ 3.24Å; E98-R102 IonicContact OE1-NE 3.44Å; E98-R102 PolarHBondContact OE1-NE 2.75Å; E98-R102 IonicContact OE1-NH2 3Å; E98-R102 PolarHBondContact OE1-NH2 3Å; E98-L126 HydrophobicContact CG-CD1 4.07Å; E98-L126 HydrophobicContact CG-CD2 3.94Å
99	Q	98.4	Very high	96.7	Very high	67 Å²	67	55 Å²	55	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-57.3	-49.9	177.2	-173.7	-179.2	30.2	0	0	111.3	G95 R96 L97 A101 R102 F103	G95-Q99 WeakPolarHBondContact O-CB 3.38Å; G95-Q99 PolarHBondContact O-N 3.24Å; G95-Q99 VanDerWaalsContact O-N 3.11Å; R96-Q99 PolarHBondContact O-N 3.4Å; L97-Q99 VanDerWaalsContact C-N 3.34Å; L97-Q99 PolarHBondContact O-N 2.91Å; Q99-A101 VanDerWaalsContact C-N 3.32Å; Q99-A101 PolarHBondContact O-N 3.37Å; Q99-R102 PolarHBondContact O-N 3.1Å; Q99-F103 HydrophobicContact CG-CD2 4.13Å; Q99-F103 HydrophobicContact CG-CE2 4.01Å; Q99-F103 VanDerWaalsContact O-CD2 3.27Å; Q99-F103 WeakPolarHBondContact O-CD2 3.48Å; Q99-F103 PolarHBondContact O-N 3.47Å
100	I	98.3	Very high	96.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-41.6	178.6	-64.9	168	0	0	0	110.8	L64 V68 R96 L97 E98 R102 F103 A104	L64-I100 HydrophobicContact CB-CD1 3.8Å; V68-I100 HydrophobicContact CB-CG2 4.19Å; V68-I100 HydrophobicContact CG1-CG2 4.46Å; V68-I100 HydrophobicContact CG2-CB 4.36Å; V68-I100 HydrophobicContact CG2-CG2 3.96Å; R96-I100 HydrophobicContact CG-CD1 4.2Å; R96-I100 WeakPolarHBondContact O-CG1 3.39Å; R96-I100 PolarHBondContact O-N 3.18Å; R96-I100 VanDerWaalsContact O-N 3.1Å; L97-I100 PolarHBondContact O-N 2.91Å; E98-I100 PolarHBondContact O-N 2.88Å; I100-R102 PolarHBondContact O-N 3.23Å; I100-F103 PolarHBondContact O-N 3.41Å; I100-A104 PolarHBondContact O-N 3.4Å
101	A	98.3	Very high	96.7	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-43.7	178.4	0	0	0	0	0	112.5	V68 L97 E98 Q99 F103 A104 I105 L126 I129	V68-A101 HydrophobicContact CG1-CB 4.27Å; V68-A101 HydrophobicContact CG2-CB 4Å; L97-A101 WeakPolarHBondContact O-CB 3.46Å; L97-A101 PolarHBondContact O-N 3.38Å; E98-A101 PolarHBondContact O-N 3.34Å; Q99-A101 VanDerWaalsContact C-N 3.32Å; Q99-A101 PolarHBondContact O-N 3.37Å; A101-F103 PolarHBondContact O-N 2.9Å; A101-A104 PolarHBondContact O-N 3.34Å; A101-I105 VanDerWaalsContact O-CG1 3.32Å; A101-I105 WeakPolarHBondContact O-CG1 3.39Å; A101-I105 PolarHBondContact O-N 3.18Å; A101-L126 HydrophobicContact CB-CD1 3.62Å; A101-I129 HydrophobicContact CB-CD1 4.19Å; A101-I129 HydrophobicContact CB-CG2 4.08Å
102	R	98.1	Very high	96.7	Very high	122 Å²	122	57.9 Å²	57.9	46%	0.46	29%	0.294	S	S	.	.	H	α-helix	trans	-60.4	-46.9	176	-70.3	178.1	-176.9	-73.5	1	111.6	E98 Q99 I100 A104 I105 D106 L126	E98-R102 WeakPolarHBondContact O-CG 3.42Å; E98-R102 PolarHBondContact O-N 3.3Å; E98-R102 IonicContact OE1-CZ 2.85Å; E98-R102 VanDerWaalsContact OE1-CZ 3.24Å; E98-R102 IonicContact OE1-NE 3.44Å; E98-R102 PolarHBondContact OE1-NE 2.75Å; E98-R102 IonicContact OE1-NH2 3Å; E98-R102 PolarHBondContact OE1-NH2 3Å; Q99-R102 PolarHBondContact O-N 3.1Å; I100-R102 PolarHBondContact O-N 3.23Å; R102-A104 VanDerWaalsContact C-N 3.3Å; R102-A104 PolarHBondContact O-N 2.69Å; R102-I105 PolarHBondContact O-N 3.04Å; R102-D106 PolarHBondContact O-N 2.98Å; R102-L126 VanDerWaalsContact NH2-CD2 3.34Å
103	F	97.5	Very high	96.5	Very high	72 Å²	72	64.9 Å²	64.9	32%	0.316	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-35.8	176.3	-83.6	-72.5	0	0	0	113.1	Q99 I100 A101 H107 E285 A286	Q99-F103 HydrophobicContact CG-CD2 4.13Å; Q99-F103 HydrophobicContact CG-CE2 4.01Å; Q99-F103 VanDerWaalsContact O-CD2 3.27Å; Q99-F103 WeakPolarHBondContact O-CD2 3.48Å; Q99-F103 PolarHBondContact O-N 3.47Å; I100-F103 PolarHBondContact O-N 3.41Å; A101-F103 PolarHBondContact O-N 2.9Å; F103-H107 WeakPolarHBondContact O-CB 3.5Å; F103-H107 PolarHBondContact O-N 3.4Å; F103-E285 WeakPolarHBondContact CD2-O 3.23Å; F103-E285 HydrophobicContact CE2-CB 3.93Å; F103-E285 WeakPolarHBondContact CE2-O 3.35Å; F103-E285 HydrophobicContact CZ-CB 4.1Å; F103-A286 HydrophobicContact CB-CB 4.27Å; F103-A286 HydrophobicContact CD1-CB 3.94Å; F103-A286 HydrophobicContact CD2-CB 4.38Å; F103-A286 HydrophobicContact CE1-CB 4.34Å; F103-A286 HydrophobicContact CG-CB 3.96Å
104	A	96.7	Very high	96.3	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.7	-43	175	0	0	0	0	0	111.6	F31 V68 I100 A101 R102 H107 C108 F124	F31-A104 HydrophobicContact CE2-CB 4Å; V68-A104 HydrophobicContact CG1-CB 3.52Å; I100-A104 PolarHBondContact O-N 3.4Å; A101-A104 PolarHBondContact O-N 3.34Å; R102-A104 VanDerWaalsContact C-N 3.3Å; R102-A104 PolarHBondContact O-N 2.69Å; A104-H107 PolarHBondContact O-N 2.93Å; A104-C108 WeakPolarHBondContact O-CB 3.42Å; A104-C108 PolarHBondContact O-N 3.07Å; A104-C108 PolarHBondContact O-SG 2.79Å; A104-C108 VanDerWaalsContact O-SG 3.34Å; A104-F124 HydrophobicContact CB-CZ 4.44Å
105	I	97.3	Very high	96.1	Very high	32 Å²	32	60.8 Å²	60.8	16%	0.164	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-50.2	175.4	-65.2	165.4	0	0	0	110.5	A101 R102 H107 C108 T109 F124 L126 I129	A101-I105 VanDerWaalsContact O-CG1 3.32Å; A101-I105 WeakPolarHBondContact O-CG1 3.39Å; A101-I105 PolarHBondContact O-N 3.18Å; R102-I105 PolarHBondContact O-N 3.04Å; I105-H107 VanDerWaalsContact C-N 3.3Å; I105-H107 PolarHBondContact O-N 3.3Å; I105-C108 PolarHBondContact O-N 3.4Å; I105-T109 VanDerWaalsContact O-CB 3.32Å; I105-T109 WeakPolarHBondContact O-CB 3.2Å; I105-T109 PolarHBondContact O-N 3.48Å; I105-T109 PolarHBondContact O-OG1 2.99Å; I105-F124 HydrophobicContact CB-CD1 4.47Å; I105-F124 HydrophobicContact CB-CE1 4.41Å; I105-F124 HydrophobicContact CG1-CD1 3.96Å; I105-F124 HydrophobicContact CG1-CE1 3.87Å; I105-F124 HydrophobicContact CG1-CZ 4.46Å; I105-L126 HydrophobicContact CD1-CB 4.13Å; I105-I129 HydrophobicContact CD1-CD1 3.82Å; I105-I129 HydrophobicContact CG1-CD1 3.73Å
106	D	96.5	Very high	95.9	Very high	103 Å²	103	61.4 Å²	61.4	55%	0.551	32%	0.32	S	S	*	.	H	α-helix	trans	-60.4	-42.7	179.8	-66.9	-20.8	0	0	0	111.1	R102 T109 S110	R102-D106 PolarHBondContact O-N 2.98Å; D106-T109 PolarHBondContact O-N 2.79Å; D106-S110 PolarHBondContact O-N 3.19Å
107	H	94.6	Very high	95.8	Very high	68 Å²	68	61.8 Å²	61.8	32%	0.315	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-52.5	178	-175.1	62.6	0	0	0	111.9	F31 F103 A104 I105 T109 S110 M111	F31-H107 AromaticContact CE1-CD2 3.98Å; F31-H107 AromaticContact CZ-CD2 3.83Å; F103-H107 WeakPolarHBondContact O-CB 3.5Å; F103-H107 PolarHBondContact O-N 3.4Å; A104-H107 PolarHBondContact O-N 2.93Å; I105-H107 VanDerWaalsContact C-N 3.3Å; I105-H107 PolarHBondContact O-N 3.3Å; H107-T109 PolarHBondContact O-N 3Å; H107-S110 PolarHBondContact O-N 3.25Å; H107-S110 VanDerWaalsContact O-N 3.1Å; H107-S110 PolarHBondContact O-OG 2.96Å; H107-M111 VanDerWaalsContact CE1-SD 3.55Å; H107-M111 PolarHBondContact O-N 2.92Å
108	C	95.2	Very high	95.5	Very high	7 Å²	7	67.9 Å²	67.9	5%	0.047	35%	0.346	C	S	.	.	H	α-helix	trans	-60.6	-35.6	177.5	-69.4	0	0	0	0	112.1	L76 A104 I105 M111 A112 L121 F124	L76-C108 HydrophobicContact CD1-CB 4.18Å; L76-C108 HydrophobicContact CD2-CB 4.49Å; A104-C108 WeakPolarHBondContact O-CB 3.42Å; A104-C108 PolarHBondContact O-N 3.07Å; A104-C108 PolarHBondContact O-SG 2.79Å; A104-C108 VanDerWaalsContact O-SG 3.34Å; I105-C108 PolarHBondContact O-N 3.4Å; C108-M111 PolarHBondContact O-N 3.42Å; C108-A112 PolarHBondContact O-N 2.87Å; C108-L121 HydrophobicContact CB-CD2 3.89Å; C108-F124 HydrophobicContact CB-CD1 4.25Å; C108-F124 HydrophobicContact CB-CE1 4.12Å
109	T	95.2	Very high	95.3	Very high	77 Å²	77	68 Å²	68	47%	0.472	35%	0.354	S	S	.	.	H	α-helix	trans	-62.8	-43.5	175.2	-57.2	0	0	0	0	111.4	I105 D106 H107 M111 L121	I105-T109 VanDerWaalsContact O-CB 3.32Å; I105-T109 WeakPolarHBondContact O-CB 3.2Å; I105-T109 PolarHBondContact O-N 3.48Å; I105-T109 PolarHBondContact O-OG1 2.99Å; D106-T109 PolarHBondContact O-N 2.79Å; H107-T109 PolarHBondContact O-N 3Å; T109-M111 VanDerWaalsContact C-N 3.27Å; T109-M111 PolarHBondContact O-N 2.95Å; T109-L121 HydrophobicContact CG2-CD1 4.47Å
110	S	94.3	Very high	95.2	Very high	93 Å²	93	65.4 Å²	65.4	65%	0.65	34%	0.344	S	S	*	.	H	α-helix	trans	-67.3	-25	179	73.4	0	0	0	0	114.2	D106 H107	D106-S110 PolarHBondContact O-N 3.19Å; H107-S110 PolarHBondContact O-N 3.25Å; H107-S110 VanDerWaalsContact O-N 3.1Å; H107-S110 PolarHBondContact O-OG 2.96Å
111	M	92.3	Very high	95	Very high	117 Å²	117	66.8 Å²	66.8	58%	0.576	35%	0.351	S	S	*	.	H	α-helix	trans	-98.6	-4.6	-176.5	-63.8	-155.1	77	0	0	114.3	H107 C108 T109 E113	H107-M111 VanDerWaalsContact CE1-SD 3.55Å; H107-M111 PolarHBondContact O-N 2.92Å; C108-M111 PolarHBondContact O-N 3.42Å; T109-M111 VanDerWaalsContact C-N 3.27Å; T109-M111 PolarHBondContact O-N 2.95Å; M111-E113 PolarHBondContact O-N 3.42Å
112	A	92.8	Very high	94.7	Very high	17 Å²	17	74.2 Å²	74.2	14%	0.14	39%	0.386	C	S	.	.			trans	-76.4	110.5	-177.8	0	0	0	0	0	112.3	L76 C108 Q117 R118 L121	L76-A112 HydrophobicContact CD2-CB 4.39Å; C108-A112 PolarHBondContact O-N 2.87Å; A112-Q117 HydrophobicContact CB-CB 3.79Å; A112-R118 HydrophobicContact CB-CG 4.41Å; A112-L121 HydrophobicContact CB-CD1 3.37Å; A112-L121 HydrophobicContact CB-CG 4.39Å
113	E	93.4	Very high	94.3	Very high	165 Å²	165	73 Å²	73	77%	0.771	39%	0.388	S	S	*	.			trans	-103.6	-37.4	-179.4	-63.7	-175.5	162.9	0	0	112.1	M111 R118	M111-E113 PolarHBondContact O-N 3.42Å; E113-R118 PolarHBondContact O-NH2 2.95Å
114	S	94	Very high	94.3	Very high	51 Å²	51	69.9 Å²	69.9	36%	0.357	38%	0.375	S	S	.	.	S	Bend	trans	-89.9	156.5	-176	69.6	0	0	0	0	113.2	A116 Q117 R118	S114-A116 VanDerWaalsContact C-N 3.29Å; S114-A116 PolarHBondContact O-N 3.4Å; S114-Q117 WeakPolarHBondContact O-CB 3.37Å; S114-Q117 PolarHBondContact O-N 3.22Å; S114-Q117 WeakPolarHBondContact OG-CB 3.5Å; S114-Q117 VanDerWaalsContact OG-CD 3.26Å; S114-Q117 WeakPolarHBondContact OG-CG 3.42Å; S114-Q117 PolarHBondContact OG-N 2.85Å; S114-Q117 PolarHBondContact OG-OE1 3.2Å; S114-R118 PolarHBondContact O-N 3.45Å
115	E	93.2	Very high	94.3	Very high	134 Å²	134	72.8 Å²	72.8	63%	0.626	39%	0.393	S	S	*	.	H	α-helix	trans	-61.9	-37.5	177.1	-168.3	58.4	-156.5	0	0	112.4	Q117 R118 S119	E115-Q117 VanDerWaalsContact C-N 3.31Å; E115-Q117 PolarHBondContact O-N 2.89Å; E115-R118 PolarHBondContact O-N 2.96Å; E115-R118 IonicContact OE2-NH1 3.78Å; E115-S119 PolarHBondContact O-N 2.82Å
116	A	93.8	Very high	94.3	Very high	60 Å²	60	72.9 Å²	72.9	50%	0.496	39%	0.393	S	S	.	.	H	α-helix	trans	-62	-38.4	176.1	0	0	0	0	0	112.2	S114 A120	S114-A116 VanDerWaalsContact C-N 3.29Å; S114-A116 PolarHBondContact O-N 3.4Å; A116-A120 WeakPolarHBondContact O-CB 3.41Å; A116-A120 PolarHBondContact O-N 2.81Å
117	Q	94.4	Very high	94.4	Very high	45 Å²	45	75.6 Å²	75.6	21%	0.21	40%	0.403	C	S	.	.	H	α-helix	trans	-68.6	-42	175.3	-74.4	167.8	-32.5	0	0	111.7	P75 L76 A112 S114 E115 A120 L121	P75-Q117 WeakPolarHBondContact O-CG 3.25Å; P75-Q117 PolarHBondContact O-NE2 3.46Å; L76-Q117 HydrophobicContact CD2-CB 3.77Å; L76-Q117 HydrophobicContact CD2-CG 3.87Å; A112-Q117 HydrophobicContact CB-CB 3.79Å; S114-Q117 WeakPolarHBondContact O-CB 3.37Å; S114-Q117 PolarHBondContact O-N 3.22Å; S114-Q117 WeakPolarHBondContact OG-CB 3.5Å; S114-Q117 VanDerWaalsContact OG-CD 3.26Å; S114-Q117 WeakPolarHBondContact OG-CG 3.42Å; S114-Q117 PolarHBondContact OG-N 2.85Å; S114-Q117 PolarHBondContact OG-OE1 3.2Å; E115-Q117 VanDerWaalsContact C-N 3.31Å; E115-Q117 PolarHBondContact O-N 2.89Å; Q117-A120 PolarHBondContact O-N 2.96Å; Q117-L121 WeakPolarHBondContact O-CG 3.14Å; Q117-L121 PolarHBondContact O-N 3.3Å
118	R	93.6	Very high	94.5	Very high	130 Å²	130	75.7 Å²	75.7	49%	0.491	40%	0.402	S	S	.	.	H	α-helix	trans	-63	-43.9	177.5	-68.9	-179.3	-169.5	145.2	3.9	112.2	A112 E113 S114 E115 A120 L121 E122	A112-R118 HydrophobicContact CB-CG 4.41Å; E113-R118 PolarHBondContact O-NH2 2.95Å; S114-R118 PolarHBondContact O-N 3.45Å; E115-R118 PolarHBondContact O-N 2.96Å; E115-R118 IonicContact OE2-NH1 3.78Å; R118-A120 VanDerWaalsContact C-N 3.33Å; R118-A120 PolarHBondContact O-N 3.17Å; R118-L121 WeakPolarHBondContact O-CB 3.44Å; R118-L121 PolarHBondContact O-N 3.38Å; R118-E122 PolarHBondContact O-N 3.1Å
119	S	94.6	Very high	94.7	Very high	67 Å²	67	75.4 Å²	75.4	47%	0.469	40%	0.4	S	S	.	.	H	α-helix	trans	-63	-40.2	174.5	-179.8	0	0	0	0	111.7	E115 L121 E122	E115-S119 PolarHBondContact O-N 2.82Å; S119-L121 VanDerWaalsContact C-N 3.26Å; S119-L121 PolarHBondContact O-N 3.33Å; S119-E122 WeakPolarHBondContact O-CB 3.49Å; S119-E122 PolarHBondContact O-N 2.67Å
120	A	94.8	Very high	94.8	Very high	13 Å²	13	74.2 Å²	74.2	11%	0.107	39%	0.391	C	S	.	.	H	α-helix	trans	-64.3	-28.7	175.9	0	0	0	0	0	113.4	P73 P75 L76 A116 Q117 R118 D123 F124	P73-A120 HydrophobicContact CB-CB 3.97Å; P73-A120 HydrophobicContact CG-CB 4.41Å; P75-A120 HydrophobicContact CB-CB 3.95Å; P75-A120 HydrophobicContact CG-CB 3.97Å; L76-A120 HydrophobicContact CD1-CB 4.36Å; L76-A120 HydrophobicContact CG-CB 4.38Å; A116-A120 WeakPolarHBondContact O-CB 3.41Å; A116-A120 PolarHBondContact O-N 2.81Å; Q117-A120 PolarHBondContact O-N 2.96Å; R118-A120 VanDerWaalsContact C-N 3.33Å; R118-A120 PolarHBondContact O-N 3.17Å; A120-D123 PolarHBondContact O-N 3.12Å; A120-F124 PolarHBondContact O-N 3.39Å
121	L	94.4	Very high	95	Very high	30 Å²	30	73.6 Å²	73.6	16%	0.157	39%	0.386	C	S	.	.	H	α-helix	trans	-69.7	-29.2	176.7	-75	169.3	0	0	0	113.4	L76 C108 T109 A112 Q117 R118 S119 D123 F124	L76-L121 HydrophobicContact CD1-CD2 3.7Å; L76-L121 HydrophobicContact CD1-CG 4.06Å; L76-L121 HydrophobicContact CD2-CD2 4.34Å; L76-L121 HydrophobicContact CD2-CG 4.3Å; C108-L121 HydrophobicContact CB-CD2 3.89Å; T109-L121 HydrophobicContact CG2-CD1 4.47Å; A112-L121 HydrophobicContact CB-CD1 3.37Å; A112-L121 HydrophobicContact CB-CG 4.39Å; Q117-L121 WeakPolarHBondContact O-CG 3.14Å; Q117-L121 PolarHBondContact O-N 3.3Å; R118-L121 WeakPolarHBondContact O-CB 3.44Å; R118-L121 PolarHBondContact O-N 3.38Å; S119-L121 VanDerWaalsContact C-N 3.26Å; S119-L121 PolarHBondContact O-N 3.33Å; L121-D123 PolarHBondContact O-N 2.92Å; L121-F124 HydrophobicContact CD2-CD1 4.42Å; L121-F124 PolarHBondContact O-N 3.06Å
122	E	92.4	Very high	95.2	Very high	156 Å²	156	68.1 Å²	68.1	73%	0.729	36%	0.36	S	S	*	.	H	α-helix	trans	-57.3	-33.2	175.5	-61.6	-176.7	165.8	0	0	111.2	R118 S119	R118-E122 PolarHBondContact O-N 3.1Å; S119-E122 WeakPolarHBondContact O-CB 3.49Å; S119-E122 PolarHBondContact O-N 2.67Å
123	D	90	Very high	95.5	Very high	95 Å²	95	68.1 Å²	68.1	51%	0.508	36%	0.357	S	S	.	.	H	α-helix	trans	-89.6	-19.5	179.2	-99.9	-31.1	0	0	0	113.3	A120 L121 T125 K128	A120-D123 PolarHBondContact O-N 3.12Å; L121-D123 PolarHBondContact O-N 2.92Å; D123-T125 VanDerWaalsContact C-N 3.25Å; D123-T125 PolarHBondContact O-N 2.97Å; D123-K128 HydrophobicContact CB-CD 4.38Å; D123-K128 VanDerWaalsContact CB-NZ 3.27Å; D123-K128 WeakPolarHBondContact O-CD 3.23Å; D123-K128 IonicContact OD1-NZ 2.72Å; D123-K128 PolarHBondContact OD1-NZ 3.01Å; D123-K128 IonicContact OD2-NZ 3.65Å; D123-K128 PolarHBondContact OD2-NZ 3.18Å
124	F	96.3	Very high	95.7	Very high	7 Å²	7	64 Å²	64	3%	0.031	34%	0.336	C	S	.	.			trans	-83.7	64.9	-176.6	-168.8	-128	0	0	0	112.1	R71 I72 P73 A104 I105 C108 A120 L121 I129	R71-F124 HydrophobicContact CB-CE2 4.5Å; I72-F124 HydrophobicContact CB-CZ 4.44Å; I72-F124 HydrophobicContact CG1-CE1 4.47Å; I72-F124 HydrophobicContact CG1-CE2 4.15Å; I72-F124 HydrophobicContact CG1-CZ 3.7Å; P73-F124 VanDerWaalsContact CD-CD2 3.44Å; P73-F124 HydrophobicContact CG-CB 4.03Å; P73-F124 HydrophobicContact CG-CD2 4.11Å; P73-F124 HydrophobicContact CG-CG 4.25Å; A104-F124 HydrophobicContact CB-CZ 4.44Å; I105-F124 HydrophobicContact CB-CD1 4.47Å; I105-F124 HydrophobicContact CB-CE1 4.41Å; I105-F124 HydrophobicContact CG1-CD1 3.96Å; I105-F124 HydrophobicContact CG1-CE1 3.87Å; I105-F124 HydrophobicContact CG1-CZ 4.46Å; C108-F124 HydrophobicContact CB-CD1 4.25Å; C108-F124 HydrophobicContact CB-CE1 4.12Å; A120-F124 PolarHBondContact O-N 3.39Å; L121-F124 HydrophobicContact CD2-CD1 4.42Å; L121-F124 PolarHBondContact O-N 3.06Å; F124-I129 HydrophobicContact CD2-CD1 4.04Å; F124-I129 HydrophobicContact CD2-CG1 3.98Å; F124-I129 HydrophobicContact CE1-CD1 4.27Å; F124-I129 HydrophobicContact CE2-CD1 3.45Å; F124-I129 VanDerWaalsContact CE2-CD1 3.45Å; F124-I129 HydrophobicContact CE2-CG1 3.55Å; F124-I129 HydrophobicContact CZ-CD1 3.58Å; F124-I129 HydrophobicContact CZ-CG1 4.21Å
125	T	97.2	Very high	95.9	Very high	62 Å²	62	64.4 Å²	64.4	38%	0.38	34%	0.336	S	S	.	.			trans	-97.8	158.9	-179	66.7	0	0	0	0	112.5	D123 E127 K128 I129	D123-T125 VanDerWaalsContact C-N 3.25Å; D123-T125 PolarHBondContact O-N 2.97Å; T125-E127 VanDerWaalsContact C-N 3.25Å; T125-E127 PolarHBondContact O-N 3.07Å; T125-K128 PolarHBondContact O-N 3.38Å; T125-K128 VanDerWaalsContact O-N 3.12Å; T125-K128 PolarHBondContact OG1-N 3.3Å; T125-I129 WeakPolarHBondContact O-CG1 3.3Å; T125-I129 PolarHBondContact O-N 2.79Å
126	L	98.2	Very high	96.2	Very high	34 Å²	34	62.4 Å²	62.4	18%	0.178	33%	0.327	C	S	.	.	H	α-helix	trans	-55.7	-41.7	176.9	179.8	64.7	0	0	0	111.9	E98 A101 R102 I105 I129 L130	E98-L126 HydrophobicContact CG-CD1 4.07Å; E98-L126 HydrophobicContact CG-CD2 3.94Å; A101-L126 HydrophobicContact CB-CD1 3.62Å; R102-L126 VanDerWaalsContact NH2-CD2 3.34Å; I105-L126 HydrophobicContact CD1-CB 4.13Å; L126-I129 PolarHBondContact O-N 2.61Å; L126-L130 HydrophobicContact CD1-CD1 3.9Å; L126-L130 HydrophobicContact CD1-CG 3.99Å; L126-L130 HydrophobicContact CG-CD1 3.91Å; L126-L130 HydrophobicContact CG-CG 4.31Å; L126-L130 WeakPolarHBondContact O-CB 3.49Å; L126-L130 VanDerWaalsContact O-CG 3.28Å; L126-L130 WeakPolarHBondContact O-CG 3.48Å; L126-L130 PolarHBondContact O-N 3.06Å
127	E	97.6	Very high	96.4	Very high	160 Å²	160	66.3 Å²	66.3	75%	0.748	33%	0.328	S	S	*	.	H	α-helix	trans	-62.2	-43.6	178.1	-173.6	176.9	178.6	0	0	111.7	T125 L130 S131	T125-E127 VanDerWaalsContact C-N 3.25Å; T125-E127 PolarHBondContact O-N 3.07Å; E127-L130 PolarHBondContact O-N 3.13Å; E127-S131 VanDerWaalsContact O-CB 3.25Å; E127-S131 WeakPolarHBondContact O-CB 3.45Å; E127-S131 PolarHBondContact O-N 3.28Å; E127-S131 PolarHBondContact O-OG 3.09Å
128	K	96.9	Very high	96.5	Very high	69 Å²	69	64.1 Å²	64.1	30%	0.3	32%	0.318	S	S	.	.	H	α-helix	trans	-69.8	-31.2	178.6	-158.3	178.6	-167.3	171.8	0	113.4	R71 D123 T125 S131	R71-K128 PolarHBondContact NE-O 2.88Å; R71-K128 PolarHBondContact NH2-O 3.1Å; D123-K128 HydrophobicContact CB-CD 4.38Å; D123-K128 VanDerWaalsContact CB-NZ 3.27Å; D123-K128 WeakPolarHBondContact O-CD 3.23Å; D123-K128 IonicContact OD1-NZ 2.72Å; D123-K128 PolarHBondContact OD1-NZ 3.01Å; D123-K128 IonicContact OD2-NZ 3.65Å; D123-K128 PolarHBondContact OD2-NZ 3.18Å; T125-K128 PolarHBondContact O-N 3.38Å; T125-K128 VanDerWaalsContact O-N 3.12Å; T125-K128 PolarHBondContact OG1-N 3.3Å; K128-S131 WeakPolarHBondContact CA-OG 3.22Å; K128-S131 PolarHBondContact O-OG 3.35Å
129	I	98.3	Very high	96.5	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-66	-56.6	171.2	-65.6	171.1	0	0	0	109.2	V68 R71 A101 I105 F124 T125 L126 S131 G132 I133	V68-I129 HydrophobicContact CG1-CG2 4.48Å; V68-I129 HydrophobicContact CG2-CG2 4.45Å; R71-I129 HydrophobicContact CB-CB 4.42Å; R71-I129 HydrophobicContact CB-CG1 4.17Å; R71-I129 HydrophobicContact CB-CG2 4.2Å; R71-I129 HydrophobicContact CG-CG2 4.08Å; A101-I129 HydrophobicContact CB-CD1 4.19Å; A101-I129 HydrophobicContact CB-CG2 4.08Å; I105-I129 HydrophobicContact CD1-CD1 3.82Å; I105-I129 HydrophobicContact CG1-CD1 3.73Å; F124-I129 HydrophobicContact CD2-CD1 4.04Å; F124-I129 HydrophobicContact CD2-CG1 3.98Å; F124-I129 HydrophobicContact CE1-CD1 4.27Å; F124-I129 HydrophobicContact CE2-CD1 3.45Å; F124-I129 VanDerWaalsContact CE2-CD1 3.45Å; F124-I129 HydrophobicContact CE2-CG1 3.55Å; F124-I129 HydrophobicContact CZ-CD1 3.58Å; F124-I129 HydrophobicContact CZ-CG1 4.21Å; T125-I129 WeakPolarHBondContact O-CG1 3.3Å; T125-I129 PolarHBondContact O-N 2.79Å; L126-I129 PolarHBondContact O-N 2.61Å; I129-S131 PolarHBondContact O-N 2.96Å; I129-G132 PolarHBondContact O-N 2.76Å; I129-I133 HydrophobicContact CG2-CD1 4.08Å; I129-I133 WeakPolarHBondContact O-CG1 3.37Å
130	L	98.2	Very high	96.5	Very high	52 Å²	52	62.1 Å²	62.1	27%	0.272	32%	0.316	S	S	.	.	H	α-helix	trans	-66.4	-39.4	-172.6	-66	-179.2	0	0	0	112.9	I94 L97 L126 E127 G132 I133	I94-L130 HydrophobicContact CD1-CD2 4.21Å; L97-L130 HydrophobicContact CD2-CD2 3.71Å; L97-L130 HydrophobicContact CG-CD2 4.15Å; L126-L130 HydrophobicContact CD1-CD1 3.9Å; L126-L130 HydrophobicContact CD1-CG 3.99Å; L126-L130 HydrophobicContact CG-CD1 3.91Å; L126-L130 HydrophobicContact CG-CG 4.31Å; L126-L130 WeakPolarHBondContact O-CB 3.49Å; L126-L130 VanDerWaalsContact O-CG 3.28Å; L126-L130 WeakPolarHBondContact O-CG 3.48Å; L126-L130 PolarHBondContact O-N 3.06Å; E127-L130 PolarHBondContact O-N 3.13Å; L130-G132 PolarHBondContact O-N 3.46Å; L130-I133 PolarHBondContact O-N 3.01Å
131	S	97.6	Very high	96.5	Very high	80 Å²	80	62.1 Å²	62.1	56%	0.559	31%	0.314	S	S	*	.	H	α-helix	trans	-63.9	-23.5	176.9	53.4	0	0	0	0	113.5	E127 K128 I129 I133	E127-S131 VanDerWaalsContact O-CB 3.25Å; E127-S131 WeakPolarHBondContact O-CB 3.45Å; E127-S131 PolarHBondContact O-N 3.28Å; E127-S131 PolarHBondContact O-OG 3.09Å; K128-S131 WeakPolarHBondContact CA-OG 3.22Å; K128-S131 PolarHBondContact O-OG 3.35Å; I129-S131 PolarHBondContact O-N 2.96Å; S131-I133 VanDerWaalsContact C-N 3.34Å
132	G	97.8	Very high	96.6	Very high	3 Å²	3	66.3 Å²	66.3	3%	0.031	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6.3	177.3	0	0	0	0	0	114.6	E82 V83 I129 L130	E82-G132 CarbonylContact C-O 3.55Å; E82-G132 WeakPolarHBondContact CA-O 3.22Å; E82-G132 WeakPolarHBondContact CB-O 3.21Å; V83-G132 PolarHBondContact N-O 3.13Å; I129-G132 PolarHBondContact O-N 2.76Å; L130-G132 PolarHBondContact O-N 3.46Å
133	I	98.6	Very high	96.8	Very high	16 Å²	16	61.2 Å²	61.2	8%	0.082	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	103.6	-178.2	-59.5	168.4	0	0	0	109.5	A67 R71 V83 L97 I129 L130 S131 V135	A67-I133 HydrophobicContact CB-CD1 4.34Å; R71-I133 HydrophobicContact CG-CD1 4.42Å; R71-I133 HydrophobicContact CG-CG1 4.26Å; V83-I133 HydrophobicContact CB-CG1 4.12Å; V83-I133 HydrophobicContact CB-CG2 4.37Å; V83-I133 HydrophobicContact CG2-CG1 4.27Å; L97-I133 HydrophobicContact CD1-CD1 4.3Å; L97-I133 HydrophobicContact CD2-CD1 3.86Å; L97-I133 HydrophobicContact CD2-CG2 4.46Å; I129-I133 HydrophobicContact CG2-CD1 4.08Å; I129-I133 WeakPolarHBondContact O-CG1 3.37Å; L130-I133 PolarHBondContact O-N 3.01Å; S131-I133 VanDerWaalsContact C-N 3.34Å; I133-V135 HydrophobicContact CG2-CG2 4.27Å
134	Y	98.5	Very high	97.1	Very high	79 Å²	79	56.7 Å²	56.7	31%	0.31	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.7	176.7	-50.8	-80.4	0	0	0	110.2	E82 V83 V84 Y85 F154 V161	E82-Y134 HydrophobicContact CB-CE2 4.03Å; E82-Y134 HydrophobicContact CG-CE2 4.43Å; E82-Y134 VanDerWaalsContact OE2-CE2 3.26Å; E82-Y134 WeakPolarHBondContact OE2-CE2 3.21Å; E82-Y134 PolarHBondContact OE2-OH 3.29Å; V83-Y134 WeakPolarHBondContact O-CD2 3.42Å; V83-Y134 PolarHBondContact O-N 3.07Å; V84-Y134 CarbonylContact C-O 3.04Å; V84-Y134 WeakPolarHBondContact CA-O 3.27Å; V84-Y134 HydrophobicContact CG2-CD2 4.32Å; Y85-Y134 PolarHBondContact N-O 3.28Å; Y134-F154 HydrophobicContact CD1-CZ 4.02Å; Y134-F154 AromaticContact CD2-CE1 3.98Å; Y134-F154 HydrophobicContact CD2-CE1 3.98Å; Y134-F154 AromaticContact CD2-CZ 3.81Å; Y134-F154 HydrophobicContact CD2-CZ 3.81Å; Y134-F154 HydrophobicContact CE1-CZ 4.17Å; Y134-F154 HydrophobicContact CE2-CE1 4.23Å; Y134-F154 AromaticContact CE2-CZ 3.97Å; Y134-F154 HydrophobicContact CE2-CZ 3.97Å; Y134-F154 HydrophobicContact CG-CE1 4.35Å; Y134-F154 AromaticContact CG-CZ 3.84Å; Y134-F154 HydrophobicContact CG-CZ 3.84Å; Y134-V161 HydrophobicContact CE2-CG2 4.42Å
135	V	98.3	Very high	97.1	Very high	60 Å²	60	61.3 Å²	61.3	36%	0.364	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.8	-178.9	-174.1	0	0	0	0	110.4	Y85 F92 I133	Y85-V135 WeakPolarHBondContact O-CA 3.43Å; F92-V135 HydrophobicContact CD1-CG1 4.32Å; F92-V135 HydrophobicContact CD1-CG2 4.47Å; F92-V135 HydrophobicContact CD2-CG1 4.4Å; F92-V135 HydrophobicContact CD2-CG2 4.33Å; F92-V135 HydrophobicContact CE1-CG2 3.98Å; F92-V135 HydrophobicContact CE2-CG2 3.81Å; F92-V135 HydrophobicContact CG-CG1 4.2Å; F92-V135 HydrophobicContact CZ-CG2 3.6Å; I133-V135 HydrophobicContact CG2-CG2 4.27Å
136	Q	97.9	Very high	97.1	Very high	92 Å²	92	67.1 Å²	67.1	43%	0.43	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	116.4	173.6	-179.8	59.8	54.2	0	0	110.4	Y85 I86 D87 C147	Y85-Q136 PolarHBondContact O-N 2.71Å; I86-Q136 WeakPolarHBondContact CA-O 3.34Å; D87-Q136 PolarHBondContact N-O 3.4Å; Q136-C147 HydrophobicContact CG-CB 4.37Å
137	R	97.9	Very high	97.1	Very high	141 Å²	141	66.5 Å²	66.5	53%	0.532	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	130.1	171.2	-69.6	-177.7	179.1	153.5	2.6	110.3	D87	D87-R137 HydrophobicContact CB-CG 4.25Å; D87-R137 CarbonylContact O-C 3.53Å; D87-R137 WeakPolarHBondContact O-CA 3.45Å; D87-R137 IonicContact OD2-NE 3.63Å
138	C	97	Very high	97.1	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.287	C	S	.	.			trans	-118.6	106	175.1	-62.8	0	0	0	0	108.3	D87 T88 T143 F144 H172	D87-C138 PolarHBondContact O-N 3.05Å; T88-C138 WeakPolarHBondContact CA-O 3.27Å; T88-C138 HydrophobicContact CG2-CB 4.47Å; C138-T143 HydrophobicContact CB-CG2 4.26Å; C138-F144 HydrophobicContact CB-CB 3.87Å; C138-F144 HydrophobicContact CB-CD2 4.35Å; C138-H172 PolarHBondContact O-CE1 3.1Å; C138-H172 PolarHBondContact O-NE2 3.22Å
139	T	94.3	Very high	97	Very high	100 Å²	100	61.7 Å²	61.7	61%	0.613	30%	0.301	S	S	*	.			trans	-86.4	-14	-174	47.2	0	0	0	0	114.4	H172	T139-H172 PolarHBondContact O-CE1 3.27Å
140	D	94.8	Very high	96.9	Very high	54 Å²	54	65 Å²	65	29%	0.289	32%	0.318	S	S	.	.	S	Bend	trans	-150.6	167.2	-177.8	57.3	67.7	0	0	0	111	N142 T143 F144 H172	D140-N142 VanDerWaalsContact C-N 3.29Å; D140-N142 PolarHBondContact O-N 3.41Å; D140-N142 WeakPolarHBondContact OD1-CA 3.49Å; D140-N142 WeakPolarHBondContact OD1-CB 3.27Å; D140-N142 PolarHBondContact OD1-N 3.24Å; D140-T143 PolarHBondContact O-N 3.32Å; D140-T143 WeakPolarHBondContact OD1-CB 3.3Å; D140-T143 PolarHBondContact OD1-N 3.11Å; D140-T143 PolarHBondContact OD1-OG1 3.12Å; D140-T143 PolarHBondContact OD2-OG1 3.3Å; D140-F144 WeakPolarHBondContact O-CB 3.36Å; D140-F144 PolarHBondContact O-N 3.18Å; D140-H172 PolarHBondContact N-CE1 3.1Å
141	L	95.5	Very high	96.7	Very high	14 Å²	14	62.8 Å²	62.8	7%	0.073	31%	0.306	C	S	.	.	H	α-helix	trans	-56.7	-37.6	178.8	-177.8	60.9	0	0	0	113.8	F144 R145 H172 F173 E175 F177 V186	L141-F144 PolarHBondContact O-N 2.94Å; L141-R145 HydrophobicContact CD1-CG 4.05Å; L141-R145 HydrophobicContact CG-CG 4.35Å; L141-R145 WeakPolarHBondContact O-CB 3.49Å; L141-R145 VanDerWaalsContact O-CG 3.23Å; L141-R145 WeakPolarHBondContact O-CG 3.23Å; L141-R145 PolarHBondContact O-N 2.93Å; L141-H172 HydrophobicContact CB-CB 3.96Å; L141-H172 HydrophobicContact CD1-CB 4.08Å; L141-F173 HydrophobicContact CD1-CD1 3.91Å; L141-F173 HydrophobicContact CD1-CE1 3.74Å; L141-E175 VanDerWaalsContact CB-OE2 3.27Å; L141-E175 WeakPolarHBondContact CB-OE2 3.39Å; L141-E175 PolarHBondContact N-OE1 2.98Å; L141-F177 HydrophobicContact CD2-CE1 3.84Å; L141-F177 HydrophobicContact CD2-CE2 4.49Å; L141-F177 HydrophobicContact CD2-CZ 3.52Å; L141-V186 HydrophobicContact CD1-CG1 4.44Å
142	N	95.4	Very high	96.4	Very high	118 Å²	118	64.5 Å²	64.5	63%	0.631	31%	0.305	S	S	*	.	H	α-helix	trans	-69.1	-45.5	-177	-71.9	-38.6	0	0	0	111.2	D140 F144 R145 R146	D140-N142 VanDerWaalsContact C-N 3.29Å; D140-N142 PolarHBondContact O-N 3.41Å; D140-N142 WeakPolarHBondContact OD1-CA 3.49Å; D140-N142 WeakPolarHBondContact OD1-CB 3.27Å; D140-N142 PolarHBondContact OD1-N 3.24Å; N142-F144 VanDerWaalsContact C-N 3.33Å; N142-R145 PolarHBondContact O-N 2.92Å; N142-R146 WeakPolarHBondContact O-CB 3.28Å; N142-R146 PolarHBondContact O-N 2.73Å
143	T	96.2	Very high	96.1	Very high	48 Å²	48	71.2 Å²	71.2	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-43.4	175.6	-57.8	0	0	0	0	110.3	C138 D140 R146 C147	C138-T143 HydrophobicContact CB-CG2 4.26Å; D140-T143 PolarHBondContact O-N 3.32Å; D140-T143 WeakPolarHBondContact OD1-CB 3.3Å; D140-T143 PolarHBondContact OD1-N 3.11Å; D140-T143 PolarHBondContact OD1-OG1 3.12Å; D140-T143 PolarHBondContact OD2-OG1 3.3Å; T143-R146 PolarHBondContact O-N 3.07Å; T143-C147 WeakPolarHBondContact O-CB 3.48Å; T143-C147 PolarHBondContact O-N 3.1Å
144	F	97.5	Very high	95.9	Very high	1 Å²	1	73.8 Å²	73.8	0%	0.004	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-48.5	176.3	179.5	-129.1	0	0	0	112.5	I86 T88 C138 D140 L141 N142 R146 C147 V148 V166 I169 F173 V190	I86-F144 HydrophobicContact CG2-CD2 3.95Å; I86-F144 HydrophobicContact CG2-CE2 3.97Å; T88-F144 HydrophobicContact CG2-CD2 4.07Å; T88-F144 HydrophobicContact CG2-CE2 4.25Å; C138-F144 HydrophobicContact CB-CB 3.87Å; C138-F144 HydrophobicContact CB-CD2 4.35Å; D140-F144 WeakPolarHBondContact O-CB 3.36Å; D140-F144 PolarHBondContact O-N 3.18Å; L141-F144 PolarHBondContact O-N 2.94Å; N142-F144 VanDerWaalsContact C-N 3.33Å; F144-R146 VanDerWaalsContact C-N 3.33Å; F144-R146 PolarHBondContact O-N 3.45Å; F144-C147 WeakPolarHBondContact O-CB 3.45Å; F144-C147 PolarHBondContact O-N 2.83Å; F144-V148 HydrophobicContact CD2-CG2 4.11Å; F144-V148 HydrophobicContact CE2-CG2 3.62Å; F144-V148 HydrophobicContact CZ-CG2 3.88Å; F144-V148 WeakPolarHBondContact O-CG2 3.5Å; F144-V148 PolarHBondContact O-N 3.38Å; F144-V166 HydrophobicContact CE2-CG1 3.78Å; F144-V166 HydrophobicContact CZ-CG1 3.88Å; F144-I169 HydrophobicContact CE1-CD1 4.24Å; F144-I169 HydrophobicContact CZ-CD1 3.76Å; F144-F173 HydrophobicContact CD1-CZ 4.45Å; F144-F173 HydrophobicContact CE1-CE2 4.08Å; F144-F173 AromaticContact CE1-CZ 3.9Å; F144-F173 HydrophobicContact CE1-CZ 3.9Å; F144-V190 HydrophobicContact CE1-CG1 3.89Å; F144-V190 HydrophobicContact CZ-CG1 4.01Å
145	R	96.5	Very high	95.5	Very high	103 Å²	103	70 Å²	70	39%	0.389	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-41.6	177.4	-73.9	176.7	70.5	-174.5	2.5	112.2	L141 N142 V148 H149 V190	L141-R145 HydrophobicContact CD1-CG 4.05Å; L141-R145 HydrophobicContact CG-CG 4.35Å; L141-R145 WeakPolarHBondContact O-CB 3.49Å; L141-R145 VanDerWaalsContact O-CG 3.23Å; L141-R145 WeakPolarHBondContact O-CG 3.23Å; L141-R145 PolarHBondContact O-N 2.93Å; N142-R145 PolarHBondContact O-N 2.92Å; R145-V148 PolarHBondContact O-N 3.5Å; R145-H149 WeakPolarHBondContact O-CB 3.22Å; R145-H149 PolarHBondContact O-N 3.37Å; R145-V190 HydrophobicContact CG-CG2 4.12Å
146	R	97.2	Very high	95.1	Very high	185 Å²	185	69.9 Å²	69.9	70%	0.698	33%	0.333	S	S	*	.	H	α-helix	trans	-63.7	-43.1	176.2	-175.3	178.6	179.7	-175.8	0.1	111.3	N142 T143 F144 H149 L150	N142-R146 WeakPolarHBondContact O-CB 3.28Å; N142-R146 PolarHBondContact O-N 2.73Å; T143-R146 PolarHBondContact O-N 3.07Å; F144-R146 VanDerWaalsContact C-N 3.33Å; F144-R146 PolarHBondContact O-N 3.45Å; R146-H149 PolarHBondContact O-N 2.79Å; R146-L150 HydrophobicContact CG-CD1 4Å; R146-L150 WeakPolarHBondContact O-CG 3.43Å; R146-L150 PolarHBondContact O-N 3.43Å; R146-L150 VanDerWaalsContact O-N 3.07Å
147	C	97.3	Very high	94.8	Very high	20 Å²	20	69.3 Å²	69.3	14%	0.135	34%	0.344	C	S	.	.	H	α-helix	trans	-57.3	-51.9	175.2	179	0	0	0	0	110.8	Q136 T143 F144 H149 L150 L151	Q136-C147 HydrophobicContact CG-CB 4.37Å; T143-C147 WeakPolarHBondContact O-CB 3.48Å; T143-C147 PolarHBondContact O-N 3.1Å; F144-C147 WeakPolarHBondContact O-CB 3.45Å; F144-C147 PolarHBondContact O-N 2.83Å; C147-H149 VanDerWaalsContact C-N 3.31Å; C147-H149 PolarHBondContact O-N 2.84Å; C147-L150 PolarHBondContact O-N 2.96Å; C147-L150 VanDerWaalsContact O-N 3.15Å; C147-L151 WeakPolarHBondContact O-CG 3.45Å; C147-L151 PolarHBondContact O-N 3.33Å; C147-L151 VanDerWaalsContact O-N 3.12Å
148	V	96.6	Very high	94.6	Very high	2 Å²	2	64.7 Å²	64.7	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-59.9	-40.5	178.9	174.7	0	0	0	0	112.1	F144 R145 L150 L151 V190 Q193 L194	F144-V148 HydrophobicContact CD2-CG2 4.11Å; F144-V148 HydrophobicContact CE2-CG2 3.62Å; F144-V148 HydrophobicContact CZ-CG2 3.88Å; F144-V148 WeakPolarHBondContact O-CG2 3.5Å; F144-V148 PolarHBondContact O-N 3.38Å; R145-V148 PolarHBondContact O-N 3.5Å; V148-L150 VanDerWaalsContact C-N 3.33Å; V148-L150 PolarHBondContact O-N 3.21Å; V148-L151 WeakPolarHBondContact O-CB 3.46Å; V148-L151 PolarHBondContact O-N 2.96Å; V148-V190 HydrophobicContact CG1-CG1 4.32Å; V148-V190 HydrophobicContact CG2-CG1 4.21Å; V148-Q193 HydrophobicContact CG1-CB 3.72Å; V148-L194 HydrophobicContact CG1-CD2 4.08Å; V148-L194 HydrophobicContact CG1-CG 4.02Å; V148-L194 HydrophobicContact CG2-CD2 4.18Å
149	H	95.6	Very high	94.2	Very high	127 Å²	127	72.4 Å²	72.4	59%	0.588	36%	0.364	S	S	*	.	H	α-helix	trans	-62.1	-39.6	177.5	-179	64.6	0	0	0	112.8	R145 R146 C147	R145-H149 WeakPolarHBondContact O-CB 3.22Å; R145-H149 PolarHBondContact O-N 3.37Å; R146-H149 PolarHBondContact O-N 2.79Å; C147-H149 VanDerWaalsContact C-N 3.31Å; C147-H149 PolarHBondContact O-N 2.84Å
150	L	96.2	Very high	94.2	Very high	70 Å²	70	74 Å²	74	37%	0.366	36%	0.363	S	S	.	.	H	α-helix	trans	-81.5	-12	-178.6	-66.3	173	0	0	0	113.7	R146 C147 V148 Q152 E153 F154	R146-L150 HydrophobicContact CG-CD1 4Å; R146-L150 WeakPolarHBondContact O-CG 3.43Å; R146-L150 PolarHBondContact O-N 3.43Å; R146-L150 VanDerWaalsContact O-N 3.07Å; C147-L150 PolarHBondContact O-N 2.96Å; C147-L150 VanDerWaalsContact O-N 3.15Å; V148-L150 VanDerWaalsContact C-N 3.33Å; V148-L150 PolarHBondContact O-N 3.21Å; L150-Q152 PolarHBondContact O-N 3.44Å; L150-E153 PolarHBondContact O-N 3.31Å; L150-F154 PolarHBondContact O-N 3Å
151	L	94.2	Very high	94.2	Very high	5 Å²	5	71.5 Å²	71.5	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-55.8	-40	178.9	-77.9	174.9	0	0	0	112.1	V84 I86 C147 V148 E153 F154 V155 I164 L194 V197	V84-L151 HydrophobicContact CG1-CD2 3.98Å; I86-L151 HydrophobicContact CD1-CD1 4Å; I86-L151 HydrophobicContact CD1-CD2 4.32Å; C147-L151 WeakPolarHBondContact O-CG 3.45Å; C147-L151 PolarHBondContact O-N 3.33Å; C147-L151 VanDerWaalsContact O-N 3.12Å; V148-L151 WeakPolarHBondContact O-CB 3.46Å; V148-L151 PolarHBondContact O-N 2.96Å; L151-E153 VanDerWaalsContact C-N 3.33Å; L151-E153 PolarHBondContact O-N 2.96Å; L151-F154 PolarHBondContact O-N 3.24Å; L151-V155 WeakPolarHBondContact O-CB 3.26Å; L151-V155 WeakPolarHBondContact O-CG2 3.41Å; L151-V155 PolarHBondContact O-N 3.01Å; L151-I164 HydrophobicContact CD1-CD1 4.2Å; L151-I164 HydrophobicContact CD1-CG2 4.29Å; L151-I164 HydrophobicContact CD2-CD1 4.14Å; L151-L194 HydrophobicContact CD1-CD2 3.7Å; L151-V197 HydrophobicContact CB-CG1 4.29Å; L151-V197 HydrophobicContact CB-CG2 3.9Å
152	Q	90.5	Very high	94.2	Very high	117 Å²	117	72.8 Å²	72.8	55%	0.547	35%	0.354	S	S	.	.	H	α-helix	trans	-62.4	-42.4	-177.9	-171.3	173.5	12.8	0	0	111.8	L150 S156 V197	L150-Q152 PolarHBondContact O-N 3.44Å; Q152-S156 VanDerWaalsContact O-CB 3.26Å; Q152-S156 WeakPolarHBondContact O-CB 3.37Å; Q152-S156 PolarHBondContact O-N 3.19Å; Q152-S156 PolarHBondContact O-OG 2.73Å; Q152-V197 HydrophobicContact CB-CG2 4.09Å
153	E	91.6	Very high	94.3	Very high	143 Å²	143	67.2 Å²	67.2	67%	0.668	32%	0.324	S	S	*	.	H	α-helix	trans	-66.2	-49.4	175.3	-175.3	-179	169.8	0	0	110.7	L150 L151 V155 S156 A157	L150-E153 PolarHBondContact O-N 3.31Å; L151-E153 VanDerWaalsContact C-N 3.33Å; L151-E153 PolarHBondContact O-N 2.96Å; E153-V155 PolarHBondContact O-N 2.98Å; E153-S156 WeakPolarHBondContact O-CA 3.43Å; E153-S156 WeakPolarHBondContact O-CB 3.46Å; E153-S156 PolarHBondContact O-N 3.23Å; E153-A157 PolarHBondContact O-N 2.91Å; E153-A157 VanDerWaalsContact O-N 3.08Å
154	F	94.3	Very high	94.4	Very high	70 Å²	70	64.9 Å²	64.9	31%	0.307	31%	0.31	S	S	.	.	H	α-helix	trans	-59	-50.8	-177.7	-178.9	-94.1	0	0	0	112.4	V84 Y134 L150 L151 S156 A157 N158 V161	V84-F154 HydrophobicContact CG2-CD1 3.97Å; V84-F154 HydrophobicContact CG2-CE1 3.62Å; Y134-F154 HydrophobicContact CD1-CZ 4.02Å; Y134-F154 AromaticContact CD2-CE1 3.98Å; Y134-F154 HydrophobicContact CD2-CE1 3.98Å; Y134-F154 AromaticContact CD2-CZ 3.81Å; Y134-F154 HydrophobicContact CD2-CZ 3.81Å; Y134-F154 HydrophobicContact CE1-CZ 4.17Å; Y134-F154 HydrophobicContact CE2-CE1 4.23Å; Y134-F154 AromaticContact CE2-CZ 3.97Å; Y134-F154 HydrophobicContact CE2-CZ 3.97Å; Y134-F154 HydrophobicContact CG-CE1 4.35Å; Y134-F154 AromaticContact CG-CZ 3.84Å; Y134-F154 HydrophobicContact CG-CZ 3.84Å; L150-F154 PolarHBondContact O-N 3Å; L151-F154 PolarHBondContact O-N 3.24Å; F154-S156 PolarHBondContact O-N 2.89Å; F154-A157 PolarHBondContact O-N 2.86Å; F154-N158 WeakPolarHBondContact CD2-ND2 3.3Å; F154-N158 HydrophobicContact CE1-CB 4.2Å; F154-N158 VanDerWaalsContact CE2-ND2 3.28Å; F154-N158 WeakPolarHBondContact CE2-ND2 3.44Å; F154-N158 HydrophobicContact CZ-CB 4.46Å; F154-N158 WeakPolarHBondContact CZ-ND2 3.41Å; F154-N158 WeakPolarHBondContact O-CB 3.43Å; F154-N158 PolarHBondContact O-N 2.78Å; F154-N158 PolarHBondContact O-ND2 2.79Å; F154-V161 HydrophobicContact CE1-CG2 4.12Å
155	V	91.8	Very high	94.5	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-31.6	178.6	-178.3	0	0	0	0	108.8	L151 E153 A157 N158 K159 V161 I164 V197 R200 L218	L151-V155 WeakPolarHBondContact O-CB 3.26Å; L151-V155 WeakPolarHBondContact O-CG2 3.41Å; L151-V155 PolarHBondContact O-N 3.01Å; E153-V155 PolarHBondContact O-N 2.98Å; V155-A157 VanDerWaalsContact C-N 3.35Å; V155-N158 CarbonylContact O-C 3.52Å; V155-N158 PolarHBondContact O-N 3.03Å; V155-N158 VanDerWaalsContact O-N 3.16Å; V155-K159 PolarHBondContact O-N 3.47Å; V155-V161 HydrophobicContact CG1-CB 4.28Å; V155-V161 HydrophobicContact CG2-CG1 4.29Å; V155-I164 HydrophobicContact CG2-CD1 4.1Å; V155-V197 HydrophobicContact CB-CG1 4.48Å; V155-V197 HydrophobicContact CG2-CG1 3.9Å; V155-R200 PolarHBondContact O-NH1 3.28Å; V155-R200 PolarHBondContact O-NH2 3.25Å; V155-L218 HydrophobicContact CB-CD2 4.39Å; V155-L218 HydrophobicContact CG1-CD2 3.4Å; V155-L218 VanDerWaalsContact CG1-CD2 3.4Å; V155-L218 HydrophobicContact CG2-CD2 4.07Å
156	S	89	Confident	94.6	Very high	57 Å²	57	60 Å²	60	40%	0.399	29%	0.291	S	S	.	.	H	α-helix	trans	-70.7	-33.7	-176.2	-62.9	0	0	0	0	112.4	Q152 E153 F154 R200	Q152-S156 VanDerWaalsContact O-CB 3.26Å; Q152-S156 WeakPolarHBondContact O-CB 3.37Å; Q152-S156 PolarHBondContact O-N 3.19Å; Q152-S156 PolarHBondContact O-OG 2.73Å; E153-S156 WeakPolarHBondContact O-CA 3.43Å; E153-S156 WeakPolarHBondContact O-CB 3.46Å; E153-S156 PolarHBondContact O-N 3.23Å; F154-S156 PolarHBondContact O-N 2.89Å; S156-R200 PolarHBondContact OG-NH2 3.35Å
157	A	91.8	Very high	94.6	Very high	80 Å²	80	51.2 Å²	51.2	66%	0.661	26%	0.258	S	S	*	.	H	α-helix	trans	-71	-40.2	164.9	0	0	0	0	0	111.8	E153 F154 V155	E153-A157 PolarHBondContact O-N 2.91Å; E153-A157 VanDerWaalsContact O-N 3.08Å; F154-A157 PolarHBondContact O-N 2.86Å; V155-A157 VanDerWaalsContact C-N 3.35Å
158	N	92.8	Very high	94.5	Very high	44 Å²	44	50.3 Å²	50.3	24%	0.235	25%	0.252	C	S	.	.			trans	-105.4	75.8	-173.9	-58.9	-70.7	0	0	0	112	F154 V155 K160 V161	F154-N158 WeakPolarHBondContact CD2-ND2 3.3Å; F154-N158 HydrophobicContact CE1-CB 4.2Å; F154-N158 VanDerWaalsContact CE2-ND2 3.28Å; F154-N158 WeakPolarHBondContact CE2-ND2 3.44Å; F154-N158 HydrophobicContact CZ-CB 4.46Å; F154-N158 WeakPolarHBondContact CZ-ND2 3.41Å; F154-N158 WeakPolarHBondContact O-CB 3.43Å; F154-N158 PolarHBondContact O-N 2.78Å; F154-N158 PolarHBondContact O-ND2 2.79Å; V155-N158 CarbonylContact O-C 3.52Å; V155-N158 PolarHBondContact O-N 3.03Å; V155-N158 VanDerWaalsContact O-N 3.16Å; N158-K160 PolarHBondContact O-N 3.01Å; N158-V161 HydrophobicContact CB-CG2 3.92Å; N158-V161 WeakPolarHBondContact O-CG2 3.26Å; N158-V161 PolarHBondContact O-N 3.25Å; N158-V161 VanDerWaalsContact O-N 3.11Å
159	K	89.9	Confident	94.5	Very high	162 Å²	162	50.2 Å²	50.2	70%	0.704	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-15.1	-176.1	-64.7	-178.5	-178.4	175.2	0	114.7	V155 V161	V155-K159 PolarHBondContact O-N 3.47Å; K159-V161 VanDerWaalsContact C-N 3.32Å
160	K	93.6	Very high	94.5	Very high	135 Å²	135	44.2 Å²	44.2	59%	0.587	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-12.8	177.6	-66.1	-174	178.5	-174.4	0	113.2	G81 E82 N158 K162	G81-K160 CarbonylContact C-O 3.59Å; G81-K160 WeakPolarHBondContact CA-O 3.49Å; E82-K160 HydrophobicContact CB-CB 4.36Å; E82-K160 HydrophobicContact CG-CB 3.89Å; E82-K160 PolarHBondContact N-O 3.38Å; N158-K160 PolarHBondContact O-N 3.01Å; K160-K162 PolarHBondContact O-N 3.29Å
161	V	95.5	Very high	94.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	120.3	177.9	176.1	0	0	0	0	110.1	E82 V84 Y134 F154 V155 N158 K159 I164 L218	E82-V161 HydrophobicContact CB-CG2 4.04Å; E82-V161 CarbonylContact O-C 3.51Å; E82-V161 VanDerWaalsContact O-CA 3.31Å; E82-V161 WeakPolarHBondContact O-CA 3.25Å; V84-V161 HydrophobicContact CG2-CG1 4.05Å; V84-V161 HydrophobicContact CG2-CG2 4.27Å; Y134-V161 HydrophobicContact CE2-CG2 4.42Å; F154-V161 HydrophobicContact CE1-CG2 4.12Å; V155-V161 HydrophobicContact CG1-CB 4.28Å; V155-V161 HydrophobicContact CG2-CG1 4.29Å; N158-V161 HydrophobicContact CB-CG2 3.92Å; N158-V161 WeakPolarHBondContact O-CG2 3.26Å; N158-V161 PolarHBondContact O-N 3.25Å; N158-V161 VanDerWaalsContact O-N 3.11Å; K159-V161 VanDerWaalsContact C-N 3.32Å; V161-I164 HydrophobicContact CG1-CG1 4.3Å; V161-L218 HydrophobicContact CG1-CD2 4.4Å
162	K	95.4	Very high	94.5	Very high	41 Å²	41	42.9 Å²	42.9	18%	0.178	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	-12.1	177.3	-59.7	-64.6	-166.6	142.1	0	113.3	L45 V79 E82 K160 V217 L218 Q219	L45-K162 HydrophobicContact CD1-CD 3.97Å; L45-K162 HydrophobicContact CD2-CB 4.27Å; L45-K162 WeakPolarHBondContact CD2-O 3.35Å; V79-K162 HydrophobicContact CG2-CB 4.09Å; V79-K162 HydrophobicContact CG2-CG 4.3Å; E82-K162 PolarHBondContact O-N 3.47Å; K160-K162 PolarHBondContact O-N 3.29Å; K162-V217 WeakPolarHBondContact CD-O 3.24Å; K162-L218 CarbonylContact O-C 3.59Å; K162-L218 WeakPolarHBondContact O-CA 3.34Å; K162-L218 WeakPolarHBondContact O-CB 3.48Å; K162-Q219 PolarHBondContact O-N 3.38Å
163	L	97.8	Very high	94.7	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	133.8	178.6	178.9	62.7	0	0	0	111.2	I28 L66 A70 E82 V83 V84 V165 Q219 F221	I28-L163 HydrophobicContact CD1-CB 3.85Å; I28-L163 HydrophobicContact CD1-CD1 3.91Å; I28-L163 HydrophobicContact CD1-CD2 4.28Å; I28-L163 HydrophobicContact CD1-CG 4.22Å; L66-L163 HydrophobicContact CB-CD2 3.97Å; L66-L163 VanDerWaalsContact O-CD2 3.3Å; L66-L163 WeakPolarHBondContact O-CD2 3.41Å; A70-L163 HydrophobicContact CB-CB 4.04Å; A70-L163 HydrophobicContact CB-CD2 3.98Å; E82-L163 PolarHBondContact O-N 2.84Å; V83-L163 CarbonylContact C-O 3.56Å; V83-L163 WeakPolarHBondContact CA-O 3.49Å; V83-L163 HydrophobicContact CG1-CB 4.19Å; V83-L163 HydrophobicContact CG1-CD2 3.96Å; V83-L163 HydrophobicContact CG1-CG 4.08Å; V83-L163 HydrophobicContact CG2-CB 4.17Å; V83-L163 HydrophobicContact CG2-CD2 4.31Å; V84-L163 PolarHBondContact N-O 3.12Å; L163-V165 HydrophobicContact CD1-CG2 4.25Å; L163-V165 HydrophobicContact CD2-CG2 3.83Å; L163-V165 HydrophobicContact CG-CG2 3.9Å; L163-Q219 WeakPolarHBondContact CA-O 3.35Å; L163-Q219 HydrophobicContact CD1-CB 4.13Å; L163-Q219 HydrophobicContact CD1-CG 3.95Å; L163-F221 HydrophobicContact CD1-CB 3.93Å
164	I	98.2	Very high	94.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.5	165	-58.3	177.3	0	0	0	107.6	V84 I86 L151 V155 V161 V197 L218 Q219 I220 F221	V84-I164 HydrophobicContact CB-CG1 4.24Å; V84-I164 CarbonylContact O-C 3.51Å; V84-I164 VanDerWaalsContact O-CA 3.31Å; V84-I164 WeakPolarHBondContact O-CA 3.37Å; I86-I164 HydrophobicContact CD1-CG2 4.24Å; L151-I164 HydrophobicContact CD1-CD1 4.2Å; L151-I164 HydrophobicContact CD1-CG2 4.29Å; L151-I164 HydrophobicContact CD2-CD1 4.14Å; V155-I164 HydrophobicContact CG2-CD1 4.1Å; V161-I164 HydrophobicContact CG1-CG1 4.3Å; I164-V197 HydrophobicContact CD1-CG1 3.58Å; I164-L218 HydrophobicContact CD1-CD1 3.8Å; I164-L218 HydrophobicContact CD1-CD2 4.1Å; I164-L218 HydrophobicContact CG1-CD1 4.02Å; I164-Q219 PolarHBondContact N-O 3.44Å; I164-I220 HydrophobicContact CB-CD1 3.72Å; I164-I220 HydrophobicContact CD1-CD1 3.7Å; I164-I220 HydrophobicContact CG1-CD1 4.08Å; I164-I220 HydrophobicContact CG2-CD1 4.29Å; I164-I220 CarbonylContact O-C 3.56Å; I164-I220 WeakPolarHBondContact O-CA 3.28Å; I164-F221 PolarHBondContact O-N 2.65Å
165	V	98.6	Very high	93.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	134.9	174	177.3	0	0	0	0	109.5	C63 V83 V84 Y85 I86 L163 D167 F221	C63-V165 HydrophobicContact CB-CG1 3.78Å; C63-V165 VanDerWaalsContact SG-CG1 3.53Å; V83-V165 HydrophobicContact CG1-CG2 4.47Å; V84-V165 PolarHBondContact O-N 3.24Å; Y85-V165 HydrophobicContact CD2-CB 3.94Å; Y85-V165 HydrophobicContact CD2-CG1 3.95Å; Y85-V165 HydrophobicContact CD2-CG2 4.29Å; Y85-V165 HydrophobicContact CE1-CG1 4.43Å; Y85-V165 HydrophobicContact CE2-CB 4.26Å; Y85-V165 HydrophobicContact CE2-CG1 3.75Å; Y85-V165 HydrophobicContact CG-CB 4.28Å; Y85-V165 HydrophobicContact CG-CG1 4.39Å; I86-V165 WeakPolarHBondContact CB-O 3.42Å; I86-V165 PolarHBondContact N-O 3.44Å; L163-V165 HydrophobicContact CD1-CG2 4.25Å; L163-V165 HydrophobicContact CD2-CG2 3.83Å; L163-V165 HydrophobicContact CG-CG2 3.9Å; V165-D167 HydrophobicContact CG1-CB 4.3Å; V165-F221 CarbonylContact C-O 3.6Å; V165-F221 VanDerWaalsContact CA-O 3.28Å; V165-F221 WeakPolarHBondContact CA-O 3.48Å
166	V	98.4	Very high	93.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	105.9	168	-170.1	0	0	0	0	109.5	I86 T88 F144 I169 L194 F221 V222 T223	I86-V166 HydrophobicContact CD1-CG2 4.28Å; T88-V166 HydrophobicContact CG2-CG1 4.37Å; F144-V166 HydrophobicContact CE2-CG1 3.78Å; F144-V166 HydrophobicContact CZ-CG1 3.88Å; V166-I169 HydrophobicContact CG1-CB 4.32Å; V166-I169 HydrophobicContact CG1-CD1 3.94Å; V166-L194 HydrophobicContact CG2-CD1 4.35Å; V166-L194 HydrophobicContact CG2-CD2 4.34Å; V166-F221 PolarHBondContact N-O 2.99Å; V166-V222 HydrophobicContact CB-CB 4.45Å; V166-V222 HydrophobicContact CB-CG1 3.98Å; V166-V222 HydrophobicContact CG2-CG1 4.11Å; V166-T223 PolarHBondContact O-N 2.93Å
167	D	97.6	Very high	93.6	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	97.7	-176.5	-169.4	28.6	0	0	0	110.8	T60 Y85 I86 T88 T91 V165 T223	T60-D167 WeakPolarHBondContact CB-OD2 3.46Å; T60-D167 WeakPolarHBondContact CG2-OD2 3.48Å; T60-D167 PolarHBondContact OG1-OD2 2.59Å; Y85-D167 HydrophobicContact CE1-CB 3.86Å; Y85-D167 WeakPolarHBondContact OH-CB 3.31Å; Y85-D167 PolarHBondContact OH-OD2 2.88Å; I86-D167 PolarHBondContact O-N 2.92Å; T88-D167 PolarHBondContact N-O 3.45Å; T88-D167 PolarHBondContact OG1-O 2.9Å; T91-D167 PolarHBondContact OG1-OD2 3.38Å; V165-D167 HydrophobicContact CG1-CB 4.3Å; D167-T223 WeakPolarHBondContact CA-OG1 3.46Å; D167-T223 HydrophobicContact CB-CG2 4.4Å; D167-T223 WeakPolarHBondContact OD1-CB 3.24Å; D167-T223 WeakPolarHBondContact OD1-CG2 3.48Å; D167-T223 PolarHBondContact OD1-OG1 2.94Å
168	S	95.8	Very high	93.6	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.007	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	cis	-107.8	149.7	-5.9	-179.2	0	0	0	0	112.6	T88 E89 A170 T171 T223	T88-S168 PolarHBondContact OG1-N 3.38Å; T88-S168 PolarHBondContact OG1-O 3.45Å; E89-S168 VanDerWaalsContact OE1-CB 3.26Å; E89-S168 WeakPolarHBondContact OE1-CB 3.34Å; S168-A170 VanDerWaalsContact C-N 3.26Å; S168-A170 PolarHBondContact O-N 2.84Å; S168-T171 PolarHBondContact O-OG1 3.48Å; S168-T223 WeakPolarHBondContact CA-O 3.46Å; S168-T223 VanDerWaalsContact CA-OG1 3.27Å; S168-T223 WeakPolarHBondContact CA-OG1 3.37Å; S168-T223 WeakPolarHBondContact CB-OG1 3.25Å; S168-T223 PolarHBondContact OG-O 2.91Å
169	I	96.6	Very high	93.6	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.5	-179.9	-168.4	57.7	0	0	0	113.5	F144 V166 F173 V190 L194 V222 T223 N224 L242 L246	F144-I169 HydrophobicContact CE1-CD1 4.24Å; F144-I169 HydrophobicContact CZ-CD1 3.76Å; V166-I169 HydrophobicContact CG1-CB 4.32Å; V166-I169 HydrophobicContact CG1-CD1 3.94Å; I169-F173 HydrophobicContact CD1-CE2 4.42Å; I169-F173 HydrophobicContact CG1-CE2 4.48Å; I169-F173 WeakPolarHBondContact O-CD2 3.46Å; I169-F173 WeakPolarHBondContact O-CE2 3.41Å; I169-V190 HydrophobicContact CD1-CG1 4.43Å; I169-L194 HydrophobicContact CD1-CD1 3.94Å; I169-V222 HydrophobicContact CB-CB 4.16Å; I169-V222 HydrophobicContact CG2-CB 4.41Å; I169-T223 WeakPolarHBondContact CG2-O 3.43Å; I169-T223 PolarHBondContact N-O 3.04Å; I169-N224 HydrophobicContact CG2-CB 4.05Å; I169-L242 HydrophobicContact CG1-CD1 4.07Å; I169-L242 HydrophobicContact CG2-CD1 4.13Å; I169-L246 HydrophobicContact CG2-CD2 3.69Å
170	A	95.7	Very high	93.7	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-12.8	-170.5	0	0	0	0	0	114.9	S168 H172 F173 N224 C241 L242	S168-A170 VanDerWaalsContact C-N 3.26Å; S168-A170 PolarHBondContact O-N 2.84Å; A170-H172 PolarHBondContact O-N 3.13Å; A170-F173 PolarHBondContact O-N 3.48Å; A170-N224 VanDerWaalsContact CB-OD1 3.25Å; A170-N224 WeakPolarHBondContact CB-OD1 3.25Å; A170-C241 HydrophobicContact CB-CB 3.63Å; A170-L242 HydrophobicContact CB-CD1 4.43Å; A170-L242 HydrophobicContact CB-CD2 4.5Å; A170-L242 HydrophobicContact CB-CG 4.24Å
171	T	94.8	Very high	93.6	Very high	32 Å²	32	42 Å²	42	20%	0.196	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-52.1	-56.9	-168	-52.9	0	0	0	0	112.5	T88 E89 S168 F173 R174	T88-T171 WeakPolarHBondContact OG1-CB 3.34Å; T88-T171 PolarHBondContact OG1-OG1 2.99Å; E89-T171 HydrophobicContact CG-CG2 3.94Å; E89-T171 VanDerWaalsContact CG-OG1 3.25Å; E89-T171 WeakPolarHBondContact CG-OG1 3.39Å; E89-T171 PolarHBondContact OE1-OG1 2.95Å; S168-T171 PolarHBondContact O-OG1 3.48Å; T171-F173 VanDerWaalsContact C-N 3.33Å; T171-F173 PolarHBondContact O-N 3.49Å; T171-R174 PolarHBondContact O-N 2.96Å
172	H	94.9	Very high	93.6	Very high	14 Å²	14	46.2 Å²	46.2	7%	0.065	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-83.9	-7.5	-173.2	-60.5	-43	0	0	0	114	C138 T139 D140 L141 A170 R174 E175	C138-H172 PolarHBondContact O-CE1 3.1Å; C138-H172 PolarHBondContact O-NE2 3.22Å; T139-H172 PolarHBondContact O-CE1 3.27Å; D140-H172 PolarHBondContact N-CE1 3.1Å; L141-H172 HydrophobicContact CB-CB 3.96Å; L141-H172 HydrophobicContact CD1-CB 4.08Å; A170-H172 PolarHBondContact O-N 3.13Å; H172-R174 PolarHBondContact O-N 3.09Å; H172-E175 IonicContact CG-OE1 2.93Å; H172-E175 IonicContact ND1-OE1 3.44Å; H172-E175 PolarHBondContact ND1-OE1 3.44Å; H172-E175 WeakPolarHBondContact O-CB 3.36Å; H172-E175 WeakPolarHBondContact O-CG 3.45Å
173	F	94.3	Very high	93.6	Very high	7 Å²	7	49 Å²	49	3%	0.031	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-84.6	-1.1	173	-59.4	-55.1	0	0	0	113.1	L141 F144 I169 A170 T171 F177 R183 V186 V187 V190 L242	L141-F173 HydrophobicContact CD1-CD1 3.91Å; L141-F173 HydrophobicContact CD1-CE1 3.74Å; F144-F173 HydrophobicContact CD1-CZ 4.45Å; F144-F173 HydrophobicContact CE1-CE2 4.08Å; F144-F173 AromaticContact CE1-CZ 3.9Å; F144-F173 HydrophobicContact CE1-CZ 3.9Å; I169-F173 HydrophobicContact CD1-CE2 4.42Å; I169-F173 HydrophobicContact CG1-CE2 4.48Å; I169-F173 WeakPolarHBondContact O-CD2 3.46Å; I169-F173 WeakPolarHBondContact O-CE2 3.41Å; A170-F173 PolarHBondContact O-N 3.48Å; T171-F173 VanDerWaalsContact C-N 3.33Å; T171-F173 PolarHBondContact O-N 3.49Å; F173-F177 HydrophobicContact CD1-CZ 4.24Å; F173-F177 WeakPolarHBondContact O-CE2 3.46Å; F173-R183 WeakPolarHBondContact O-CD 3.23Å; F173-V186 HydrophobicContact CE1-CG1 4.07Å; F173-V187 HydrophobicContact CB-CG2 4.06Å; F173-V187 HydrophobicContact CD1-CG2 3.51Å; F173-V187 HydrophobicContact CD2-CG2 3.91Å; F173-V187 HydrophobicContact CE1-CG2 3.83Å; F173-V187 HydrophobicContact CE2-CG2 4.19Å; F173-V187 HydrophobicContact CG-CG2 3.55Å; F173-V187 HydrophobicContact CZ-CG2 4.15Å; F173-V190 HydrophobicContact CE1-CG2 4.33Å; F173-V190 HydrophobicContact CZ-CB 3.96Å; F173-V190 HydrophobicContact CZ-CG1 4.04Å; F173-V190 HydrophobicContact CZ-CG2 3.96Å; F173-L242 HydrophobicContact CB-CD2 3.78Å; F173-L242 HydrophobicContact CD2-CD1 3.72Å; F173-L242 HydrophobicContact CD2-CD2 3.76Å; F173-L242 HydrophobicContact CD2-CG 4.39Å; F173-L242 HydrophobicContact CE2-CD1 4Å; F173-L242 HydrophobicContact CG-CD2 4.07Å
174	R	86.1	Confident	93.4	Very high	133 Å²	133	51.8 Å²	51.8	50%	0.502	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-87.5	-8.9	170.5	-64.6	176.5	176.8	175.4	-2.4	113.1	T171 H172 Q225 C241	T171-R174 PolarHBondContact O-N 2.96Å; H172-R174 PolarHBondContact O-N 3.09Å; R174-Q225 VanDerWaalsContact NH2-CD 3.32Å; R174-C241 PolarHBondContact NH2-SG 2.79Å; R174-C241 VanDerWaalsContact NH2-SG 3.42Å
175	E	83.5	Confident	93.3	Very high	80 Å²	80	57.5 Å²	57.5	37%	0.374	30%	0.297	S	S	.	.	S	Bend	trans	-59.4	168.7	173	-65.5	178.6	-159.3	0	0	111.6	L141 H172 F177	L141-E175 VanDerWaalsContact CB-OE2 3.27Å; L141-E175 WeakPolarHBondContact CB-OE2 3.39Å; L141-E175 PolarHBondContact N-OE1 2.98Å; H172-E175 IonicContact CG-OE1 2.93Å; H172-E175 IonicContact ND1-OE1 3.44Å; H172-E175 PolarHBondContact ND1-OE1 3.44Å; H172-E175 WeakPolarHBondContact O-CB 3.36Å; H172-E175 WeakPolarHBondContact O-CG 3.45Å; E175-F177 WeakPolarHBondContact O-CD2 3.27Å; E175-F177 PolarHBondContact O-N 2.73Å
176	Q	83.3	Confident	93.1	Very high	201 Å²	201	58.2 Å²	58.2	94%	0.939	30%	0.302	S	S	*	.			trans	-72.7	123.1	179.2	-72.1	-176.4	-2.1	0	0	110.9
177	F	91.8	Very high	93.1	Very high	46 Å²	46	58.3 Å²	58.3	20%	0.202	30%	0.302	C	S	.	.			trans	-112.3	151.4	168.7	-67.8	-96.4	0	0	0	109	L141 F173 E175 S179 E182 R183 V186	L141-F177 HydrophobicContact CD2-CE1 3.84Å; L141-F177 HydrophobicContact CD2-CE2 4.49Å; L141-F177 HydrophobicContact CD2-CZ 3.52Å; F173-F177 HydrophobicContact CD1-CZ 4.24Å; F173-F177 WeakPolarHBondContact O-CE2 3.46Å; E175-F177 WeakPolarHBondContact O-CD2 3.27Å; E175-F177 PolarHBondContact O-N 2.73Å; F177-S179 PolarHBondContact O-N 3.37Å; F177-E182 HydrophobicContact CD1-CG 4.31Å; F177-R183 HydrophobicContact CB-CB 4Å; F177-R183 HydrophobicContact CD1-CB 3.82Å; F177-R183 HydrophobicContact CD1-CG 4.26Å; F177-R183 HydrophobicContact CD2-CB 3.8Å; F177-R183 HydrophobicContact CD2-CG 3.64Å; F177-R183 HydrophobicContact CE1-CB 4.24Å; F177-R183 HydrophobicContact CE1-CG 4.26Å; F177-R183 HydrophobicContact CE2-CB 4.25Å; F177-R183 HydrophobicContact CE2-CG 3.68Å; F177-R183 HydrophobicContact CG-CB 3.58Å; F177-R183 HydrophobicContact CG-CG 3.97Å; F177-R183 HydrophobicContact CZ-CB 4.45Å; F177-R183 HydrophobicContact CZ-CG 3.99Å; F177-V186 HydrophobicContact CE1-CB 4.15Å; F177-V186 HydrophobicContact CE1-CG1 4.43Å; F177-V186 HydrophobicContact CE1-CG2 4.12Å
178	A	91	Very high	93	Very high	98 Å²	98	62.6 Å²	62.6	81%	0.81	32%	0.322	S	S	*	.	S	Bend	trans	-66.9	-27	177.6	0	0	0	0	0	111.7	E182	A178-E182 WeakPolarHBondContact CA-OE2 3.38Å; A178-E182 WeakPolarHBondContact CB-OE2 3.35Å; A178-E182 PolarHBondContact N-OE2 3.26Å
179	S	93.9	Very high	93	Very high	52 Å²	52	64.7 Å²	64.7	36%	0.364	34%	0.336	S	S	.	.			trans	-152.9	162.3	174.3	69.2	0	0	0	0	113.1	F177 I181 E182 R183	F177-S179 PolarHBondContact O-N 3.37Å; S179-I181 PolarHBondContact O-N 2.68Å; S179-I181 PolarHBondContact OG-N 2.75Å; S179-E182 PolarHBondContact O-N 3.27Å; S179-E182 WeakPolarHBondContact OG-CB 3.47Å; S179-E182 PolarHBondContact OG-N 3.43Å; S179-R183 PolarHBondContact O-N 3.31Å; S179-R183 VanDerWaalsContact O-N 3.09Å
180	A	90.3	Very high	93	Very high	57 Å²	57	64.7 Å²	64.7	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-29.7	170.6	0	0	0	0	0	112.5	N184	A180-N184 WeakPolarHBondContact O-CB 3.09Å; A180-N184 PolarHBondContact O-N 3.37Å; A180-N184 PolarHBondContact O-ND2 3.13Å; A180-N184 PolarHBondContact O-OD1 3.15Å
181	I	93.3	Very high	93	Very high	117 Å²	117	64.7 Å²	64.7	60%	0.6	34%	0.337	S	S	*	.	H	α-helix	trans	-66.8	-49.5	177.6	-65.6	170	0	0	0	109.7	S179 R183 N184 H185	S179-I181 PolarHBondContact O-N 2.68Å; S179-I181 PolarHBondContact OG-N 2.75Å; I181-R183 PolarHBondContact O-N 3.44Å; I181-N184 PolarHBondContact O-N 3.41Å; I181-H185 PolarHBondContact O-CD2 3.22Å; I181-H185 PolarHBondContact O-N 3.43Å
182	E	94.5	Very high	93	Very high	88 Å²	88	67.3 Å²	67.3	41%	0.411	35%	0.349	S	S	.	.	H	α-helix	trans	-57.7	-49.2	176.5	-176	-172.9	-168.6	0	0	111	F177 A178 S179 N184 H185 V186	F177-E182 HydrophobicContact CD1-CG 4.31Å; A178-E182 WeakPolarHBondContact CA-OE2 3.38Å; A178-E182 WeakPolarHBondContact CB-OE2 3.35Å; A178-E182 PolarHBondContact N-OE2 3.26Å; S179-E182 PolarHBondContact O-N 3.27Å; S179-E182 WeakPolarHBondContact OG-CB 3.47Å; S179-E182 PolarHBondContact OG-N 3.43Å; E182-N184 VanDerWaalsContact C-N 3.3Å; E182-N184 PolarHBondContact O-N 2.98Å; E182-H185 PolarHBondContact O-N 3.25Å; E182-H185 VanDerWaalsContact O-N 3.16Å; E182-V186 WeakPolarHBondContact O-CG2 3.48Å; E182-V186 PolarHBondContact O-N 2.93Å
183	R	95.1	Very high	92.9	Very high	99 Å²	99	69.3 Å²	69.3	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-53.9	-48.6	175.4	-173.3	-170.6	67.9	-151.7	-4.2	111.4	F173 F177 S179 I181 H185 V186 V187	F173-R183 WeakPolarHBondContact O-CD 3.23Å; F177-R183 HydrophobicContact CB-CB 4Å; F177-R183 HydrophobicContact CD1-CB 3.82Å; F177-R183 HydrophobicContact CD1-CG 4.26Å; F177-R183 HydrophobicContact CD2-CB 3.8Å; F177-R183 HydrophobicContact CD2-CG 3.64Å; F177-R183 HydrophobicContact CE1-CB 4.24Å; F177-R183 HydrophobicContact CE1-CG 4.26Å; F177-R183 HydrophobicContact CE2-CB 4.25Å; F177-R183 HydrophobicContact CE2-CG 3.68Å; F177-R183 HydrophobicContact CG-CB 3.58Å; F177-R183 HydrophobicContact CG-CG 3.97Å; F177-R183 HydrophobicContact CZ-CB 4.45Å; F177-R183 HydrophobicContact CZ-CG 3.99Å; S179-R183 PolarHBondContact O-N 3.31Å; S179-R183 VanDerWaalsContact O-N 3.09Å; I181-R183 PolarHBondContact O-N 3.44Å; R183-H185 VanDerWaalsContact C-N 3.32Å; R183-H185 PolarHBondContact O-N 3.49Å; R183-V186 PolarHBondContact O-N 2.67Å; R183-V187 HydrophobicContact CG-CG2 4.29Å; R183-V187 WeakPolarHBondContact O-CB 3.09Å; R183-V187 VanDerWaalsContact O-CG2 3.22Å; R183-V187 WeakPolarHBondContact O-CG2 3.08Å; R183-V187 PolarHBondContact O-N 2.95Å
184	N	94.4	Very high	93	Very high	60 Å²	60	69 Å²	69	32%	0.321	36%	0.357	S	S	.	.	H	α-helix	trans	-63.7	-37.6	-178.2	-70.6	-6.5	0	0	0	112	A180 I181 E182 Q188 I245	A180-N184 WeakPolarHBondContact O-CB 3.09Å; A180-N184 PolarHBondContact O-N 3.37Å; A180-N184 PolarHBondContact O-ND2 3.13Å; A180-N184 PolarHBondContact O-OD1 3.15Å; I181-N184 PolarHBondContact O-N 3.41Å; E182-N184 VanDerWaalsContact C-N 3.3Å; E182-N184 PolarHBondContact O-N 2.98Å; N184-Q188 VanDerWaalsContact O-CB 3.27Å; N184-Q188 WeakPolarHBondContact O-CB 3.33Å; N184-Q188 PolarHBondContact O-N 2.94Å; N184-I245 HydrophobicContact CB-CD1 3.73Å
185	H	95.1	Very high	93.2	Very high	119 Å²	119	64.1 Å²	64.1	55%	0.551	34%	0.341	S	S	*	.	H	α-helix	trans	-63.9	-43.9	174.1	-79.8	-61.5	0	0	0	112.4	I181 E182 R183 Q188 S189	I181-H185 PolarHBondContact O-CD2 3.22Å; I181-H185 PolarHBondContact O-N 3.43Å; E182-H185 PolarHBondContact O-N 3.25Å; E182-H185 VanDerWaalsContact O-N 3.16Å; R183-H185 VanDerWaalsContact C-N 3.32Å; R183-H185 PolarHBondContact O-N 3.49Å; H185-Q188 PolarHBondContact O-N 3.04Å; H185-S189 WeakPolarHBondContact O-CB 3.48Å; H185-S189 PolarHBondContact O-N 3.07Å
186	V	96	Very high	93.5	Very high	16 Å²	16	62.7 Å²	62.7	10%	0.097	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-45.6	177.9	179.7	0	0	0	0	110.7	L141 F173 F177 E182 R183 Q188 S189 V190	L141-V186 HydrophobicContact CD1-CG1 4.44Å; F173-V186 HydrophobicContact CE1-CG1 4.07Å; F177-V186 HydrophobicContact CE1-CB 4.15Å; F177-V186 HydrophobicContact CE1-CG1 4.43Å; F177-V186 HydrophobicContact CE1-CG2 4.12Å; E182-V186 WeakPolarHBondContact O-CG2 3.48Å; E182-V186 PolarHBondContact O-N 2.93Å; R183-V186 PolarHBondContact O-N 2.67Å; V186-Q188 PolarHBondContact O-N 3.29Å; V186-S189 PolarHBondContact O-N 2.81Å; V186-V190 WeakPolarHBondContact O-CG2 3.24Å; V186-V190 PolarHBondContact O-N 2.6Å
187	V	96.6	Very high	93.8	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-57.4	-48.8	175.7	169.4	0	0	0	0	110.8	F173 R183 S189 V190 I191 L242 I245	F173-V187 HydrophobicContact CB-CG2 4.06Å; F173-V187 HydrophobicContact CD1-CG2 3.51Å; F173-V187 HydrophobicContact CD2-CG2 3.91Å; F173-V187 HydrophobicContact CE1-CG2 3.83Å; F173-V187 HydrophobicContact CE2-CG2 4.19Å; F173-V187 HydrophobicContact CG-CG2 3.55Å; F173-V187 HydrophobicContact CZ-CG2 4.15Å; R183-V187 HydrophobicContact CG-CG2 4.29Å; R183-V187 WeakPolarHBondContact O-CB 3.09Å; R183-V187 VanDerWaalsContact O-CG2 3.22Å; R183-V187 WeakPolarHBondContact O-CG2 3.08Å; R183-V187 PolarHBondContact O-N 2.95Å; V187-S189 PolarHBondContact O-N 2.71Å; V187-V190 PolarHBondContact O-N 3.29Å; V187-I191 HydrophobicContact CG1-CD1 3.56Å; V187-I191 WeakPolarHBondContact O-CD1 3.45Å; V187-I191 WeakPolarHBondContact O-CG1 3.38Å; V187-I191 PolarHBondContact O-N 2.91Å; V187-L242 HydrophobicContact CG1-CB 4.25Å; V187-L242 HydrophobicContact CG1-CD1 4.15Å; V187-L242 HydrophobicContact CG1-CD2 4.28Å; V187-L242 HydrophobicContact CG1-CG 4.46Å; V187-L242 HydrophobicContact CG2-CD2 3.94Å; V187-I245 HydrophobicContact CG1-CB 4.38Å; V187-I245 HydrophobicContact CG1-CG2 3.96Å
188	Q	96.2	Very high	93.5	Very high	91 Å²	91	51.2 Å²	51.2	43%	0.425	29%	0.287	S	S	.	.	H	α-helix	trans	-61.7	-43	178.8	-175	175.2	14.3	0	0	111.8	N184 H185 V186 V190 I191 L192 I245	N184-Q188 VanDerWaalsContact O-CB 3.27Å; N184-Q188 WeakPolarHBondContact O-CB 3.33Å; N184-Q188 PolarHBondContact O-N 2.94Å; H185-Q188 PolarHBondContact O-N 3.04Å; V186-Q188 PolarHBondContact O-N 3.29Å; Q188-V190 VanDerWaalsContact C-N 3.34Å; Q188-V190 PolarHBondContact O-N 2.73Å; Q188-I191 PolarHBondContact O-N 2.6Å; Q188-L192 HydrophobicContact CG-CD1 3.97Å; Q188-L192 HydrophobicContact CG-CG 4.35Å; Q188-L192 WeakPolarHBondContact O-CB 3.46Å; Q188-L192 VanDerWaalsContact O-CG 3.3Å; Q188-L192 WeakPolarHBondContact O-CG 3.17Å; Q188-L192 PolarHBondContact O-N 2.84Å; Q188-I245 HydrophobicContact CB-CG2 4Å; Q188-I245 HydrophobicContact CG-CG2 4.46Å
189	S	95.9	Very high	92.8	Very high	45 Å²	45	49.3 Å²	49.3	32%	0.315	26%	0.263	S	S	.	.	H	α-helix	trans	-59.4	-44.4	176.8	-178.3	0	0	0	0	111.9	H185 V186 V187 Q193	H185-S189 WeakPolarHBondContact O-CB 3.48Å; H185-S189 PolarHBondContact O-N 3.07Å; V186-S189 PolarHBondContact O-N 2.81Å; V187-S189 PolarHBondContact O-N 2.71Å; S189-Q193 WeakPolarHBondContact O-CB 3.47Å; S189-Q193 VanDerWaalsContact O-CG 3.25Å; S189-Q193 WeakPolarHBondContact O-CG 3.22Å; S189-Q193 PolarHBondContact O-N 3.33Å; S189-Q193 PolarHBondContact OG-NE2 3.02Å
190	V	96.8	Very high	91.6	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-65.2	-45.9	179.3	167.3	0	0	0	0	111.1	F144 R145 V148 I169 F173 V186 V187 Q188 L192 Q193 L194	F144-V190 HydrophobicContact CE1-CG1 3.89Å; F144-V190 HydrophobicContact CZ-CG1 4.01Å; R145-V190 HydrophobicContact CG-CG2 4.12Å; V148-V190 HydrophobicContact CG1-CG1 4.32Å; V148-V190 HydrophobicContact CG2-CG1 4.21Å; I169-V190 HydrophobicContact CD1-CG1 4.43Å; F173-V190 HydrophobicContact CE1-CG2 4.33Å; F173-V190 HydrophobicContact CZ-CB 3.96Å; F173-V190 HydrophobicContact CZ-CG1 4.04Å; F173-V190 HydrophobicContact CZ-CG2 3.96Å; V186-V190 WeakPolarHBondContact O-CG2 3.24Å; V186-V190 PolarHBondContact O-N 2.6Å; V187-V190 PolarHBondContact O-N 3.29Å; Q188-V190 VanDerWaalsContact C-N 3.34Å; Q188-V190 PolarHBondContact O-N 2.73Å; V190-L192 PolarHBondContact O-N 3.49Å; V190-Q193 PolarHBondContact O-N 2.89Å; V190-L194 HydrophobicContact CG1-CD1 4.14Å; V190-L194 WeakPolarHBondContact O-CG 3.2Å; V190-L194 PolarHBondContact O-N 3.26Å
191	I	95.9	Very high	89.9	Confident	1 Å²	1	52 Å²	52	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-44.8	179.9	-72.3	162.3	0	0	0	111.3	M48 V187 Q188 Q193 L194 L195 I245 L246 N249	M48-I191 HydrophobicContact CE-CG2 4.08Å; V187-I191 HydrophobicContact CG1-CD1 3.56Å; V187-I191 WeakPolarHBondContact O-CD1 3.45Å; V187-I191 WeakPolarHBondContact O-CG1 3.38Å; V187-I191 PolarHBondContact O-N 2.91Å; Q188-I191 PolarHBondContact O-N 2.6Å; I191-Q193 VanDerWaalsContact C-N 3.33Å; I191-Q193 PolarHBondContact O-N 2.96Å; I191-L194 PolarHBondContact O-N 3.09Å; I191-L195 HydrophobicContact CG2-CD1 4.39Å; I191-L195 PolarHBondContact O-N 2.92Å; I191-I245 HydrophobicContact CD1-CG2 3.83Å; I191-L246 HydrophobicContact CD1-CB 3.91Å; I191-L246 HydrophobicContact CD1-CD1 4.04Å; I191-L246 HydrophobicContact CG1-CD1 4.08Å; I191-N249 HydrophobicContact CG2-CB 3.82Å
192	L	94.1	Very high	87.9	Confident	87 Å²	87	50.1 Å²	50.1	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-66	-35.9	177.8	-69.5	177.3	0	0	0	112.3	Q188 V190 L195 S196	Q188-L192 HydrophobicContact CG-CD1 3.97Å; Q188-L192 HydrophobicContact CG-CG 4.35Å; Q188-L192 WeakPolarHBondContact O-CB 3.46Å; Q188-L192 VanDerWaalsContact O-CG 3.3Å; Q188-L192 WeakPolarHBondContact O-CG 3.17Å; Q188-L192 PolarHBondContact O-N 2.84Å; V190-L192 PolarHBondContact O-N 3.49Å; L192-L195 PolarHBondContact O-N 3.37Å; L192-S196 WeakPolarHBondContact O-CB 3.36Å; L192-S196 PolarHBondContact O-N 3.28Å
193	Q	93.7	Very high	85.4	Confident	56 Å²	56	50 Å²	50	26%	0.262	25%	0.253	S	S	.	.	H	α-helix	trans	-65	-47.3	174.2	-75.9	173.7	20.7	0	0	111.5	V148 S189 V190 I191 L195 S196 V197	V148-Q193 HydrophobicContact CG1-CB 3.72Å; S189-Q193 WeakPolarHBondContact O-CB 3.47Å; S189-Q193 VanDerWaalsContact O-CG 3.25Å; S189-Q193 WeakPolarHBondContact O-CG 3.22Å; S189-Q193 PolarHBondContact O-N 3.33Å; S189-Q193 PolarHBondContact OG-NE2 3.02Å; V190-Q193 PolarHBondContact O-N 2.89Å; I191-Q193 VanDerWaalsContact C-N 3.33Å; I191-Q193 PolarHBondContact O-N 2.96Å; Q193-L195 VanDerWaalsContact C-N 3.32Å; Q193-L195 PolarHBondContact O-N 3.25Å; Q193-S196 PolarHBondContact O-N 2.93Å; Q193-S196 VanDerWaalsContact O-N 3.12Å; Q193-S196 PolarHBondContact O-OG 2.84Å; Q193-V197 WeakPolarHBondContact O-CG2 3.2Å; Q193-V197 PolarHBondContact O-N 3.21Å; Q193-V197 VanDerWaalsContact O-N 3.1Å
194	L	94.7	Very high	82.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.7	-45.8	175.1	-72.8	172.2	0	0	0	111.8	V148 L151 V166 I169 V190 I191 S196 V197 A198 I220	V148-L194 HydrophobicContact CG1-CD2 4.08Å; V148-L194 HydrophobicContact CG1-CG 4.02Å; V148-L194 HydrophobicContact CG2-CD2 4.18Å; L151-L194 HydrophobicContact CD1-CD2 3.7Å; V166-L194 HydrophobicContact CG2-CD1 4.35Å; V166-L194 HydrophobicContact CG2-CD2 4.34Å; I169-L194 HydrophobicContact CD1-CD1 3.94Å; V190-L194 HydrophobicContact CG1-CD1 4.14Å; V190-L194 WeakPolarHBondContact O-CG 3.2Å; V190-L194 PolarHBondContact O-N 3.26Å; I191-L194 PolarHBondContact O-N 3.09Å; L194-S196 VanDerWaalsContact C-N 3.34Å; L194-S196 PolarHBondContact O-N 3.46Å; L194-V197 WeakPolarHBondContact O-CB 3.48Å; L194-V197 PolarHBondContact O-N 3.32Å; L194-A198 PolarHBondContact O-N 3.16Å; L194-I220 HydrophobicContact CB-CG2 4.36Å; L194-I220 HydrophobicContact CD2-CG2 4.48Å
195	L	91.6	Very high	80.3	Confident	30 Å²	30	49.5 Å²	49.5	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-39.9	175.6	-79.7	176.7	0	0	0	113	M48 I191 L192 Q193 V197 A198 L199 N249	M48-L195 HydrophobicContact CB-CD2 4.03Å; M48-L195 HydrophobicContact CE-CD1 4.27Å; M48-L195 HydrophobicContact CE-CD2 3.81Å; M48-L195 HydrophobicContact CE-CG 3.87Å; I191-L195 HydrophobicContact CG2-CD1 4.39Å; I191-L195 PolarHBondContact O-N 2.92Å; L192-L195 PolarHBondContact O-N 3.37Å; Q193-L195 VanDerWaalsContact C-N 3.32Å; Q193-L195 PolarHBondContact O-N 3.25Å; L195-V197 PolarHBondContact O-N 3.24Å; L195-A198 WeakPolarHBondContact O-CB 3.45Å; L195-A198 PolarHBondContact O-N 3.42Å; L195-L199 PolarHBondContact O-N 3.45Å; L195-N249 HydrophobicContact CD1-CB 3.84Å; L195-N249 WeakPolarHBondContact CD1-OD1 3.47Å
196	S	88.9	Confident	77.6	Confident	50 Å²	50	53.6 Å²	53.6	35%	0.35	28%	0.278	S	S	.	.	H	α-helix	trans	-64.9	-27.6	177.7	76.2	0	0	0	0	113	L192 Q193 L194 L199	L192-S196 WeakPolarHBondContact O-CB 3.36Å; L192-S196 PolarHBondContact O-N 3.28Å; Q193-S196 PolarHBondContact O-N 2.93Å; Q193-S196 VanDerWaalsContact O-N 3.12Å; Q193-S196 PolarHBondContact O-OG 2.84Å; L194-S196 VanDerWaalsContact C-N 3.34Å; L194-S196 PolarHBondContact O-N 3.46Å; S196-L199 CarbonylContact O-C 3.34Å; S196-L199 VanDerWaalsContact O-O 3.11Å
197	V	89.4	Confident	74.9	Confident	6 Å²	6	60 Å²	60	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-74.4	-38.3	174.3	175.6	0	0	0	0	110.8	L151 Q152 V155 I164 Q193 L194 L195 L218	L151-V197 HydrophobicContact CB-CG1 4.29Å; L151-V197 HydrophobicContact CB-CG2 3.9Å; Q152-V197 HydrophobicContact CB-CG2 4.09Å; V155-V197 HydrophobicContact CB-CG1 4.48Å; V155-V197 HydrophobicContact CG2-CG1 3.9Å; I164-V197 HydrophobicContact CD1-CG1 3.58Å; Q193-V197 WeakPolarHBondContact O-CG2 3.2Å; Q193-V197 PolarHBondContact O-N 3.21Å; Q193-V197 VanDerWaalsContact O-N 3.1Å; L194-V197 WeakPolarHBondContact O-CB 3.48Å; L194-V197 PolarHBondContact O-N 3.32Å; L195-V197 PolarHBondContact O-N 3.24Å; V197-L218 HydrophobicContact CG1-CD1 4.44Å; V197-L218 HydrophobicContact CG1-CD2 4.04Å
198	A	86.2	Confident	72.5	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-42.2	175.6	0	0	0	0	0	112.5	L194 L195 R200 L218 I220	L194-A198 PolarHBondContact O-N 3.16Å; L195-A198 WeakPolarHBondContact O-CB 3.45Å; L195-A198 PolarHBondContact O-N 3.42Å; A198-R200 PolarHBondContact O-N 2.74Å; A198-L218 HydrophobicContact CB-CD1 4.17Å; A198-I220 HydrophobicContact CB-CD1 4.32Å; A198-I220 HydrophobicContact CB-CG1 3.75Å
199	L	76.2	Confident	70.2	Confident	58 Å²	58	70.3 Å²	70.3	30%	0.304	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	82.9	-177.8	-61.2	173.8	0	0	0	110	G46 L195 S196 F201 V214 L216	G46-L199 WeakPolarHBondContact O-CD2 3.48Å; L195-L199 PolarHBondContact O-N 3.45Å; S196-L199 CarbonylContact O-C 3.34Å; S196-L199 VanDerWaalsContact O-O 3.11Å; L199-F201 PolarHBondContact O-N 3.22Å; L199-V214 HydrophobicContact CB-CG1 4.43Å; L199-V214 HydrophobicContact CD2-CG1 4.04Å; L199-L216 HydrophobicContact CD2-CD2 4.05Å
200	R	68	Low	67.6	Low	38 Å²	38	73.8 Å²	73.8	14%	0.143	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	118	171.7	-90	-163.2	170.4	122.7	18.2	110.8	V155 S156 A198 N202 V214 S215 V217	V155-R200 PolarHBondContact O-NH1 3.28Å; V155-R200 PolarHBondContact O-NH2 3.25Å; S156-R200 PolarHBondContact OG-NH2 3.35Å; A198-R200 PolarHBondContact O-N 2.74Å; R200-N202 PolarHBondContact O-N 3.42Å; R200-N202 VanDerWaalsContact O-N 3.16Å; R200-V214 WeakPolarHBondContact O-CA 3.31Å; R200-S215 PolarHBondContact N-O 3.07Å; R200-S215 PolarHBondContact O-N 3.41Å; R200-V217 HydrophobicContact CB-CG2 3.76Å; R200-V217 HydrophobicContact CG-CG2 4.08Å
201	F	55	Low	65.3	Low	129 Å²	129	74.2 Å²	74.2	57%	0.566	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	93.7	160.7	-66	-83.1	0	0	0	108.8	L199 T203 V214	L199-F201 PolarHBondContact O-N 3.22Å; F201-T203 PolarHBondContact O-N 2.95Å; F201-V214 HydrophobicContact CD1-CG2 3.81Å; F201-V214 HydrophobicContact CE1-CG2 3.53Å; F201-V214 HydrophobicContact CZ-CG2 4.3Å
202	N	51.3	Low	63.1	Low	77 Å²	77	80.9 Å²	80.9	41%	0.412	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	112.3	169.2	-80.3	-22.4	0	0	0	108.1	R200 A204 F213 S215	R200-N202 PolarHBondContact O-N 3.42Å; R200-N202 VanDerWaalsContact O-N 3.16Å; N202-A204 PolarHBondContact O-N 3Å; N202-F213 PolarHBondContact N-O 2.89Å; N202-F213 PolarHBondContact O-N 2.79Å; N202-F213 VanDerWaalsContact O-N 3.08Å; N202-S215 WeakPolarHBondContact ND2-CB 3.45Å
203	T	42.5	Very low	61.3	Low	86 Å²	86	80.5 Å²	80.5	53%	0.528	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	93.8	165.6	48.6	0	0	0	0	108.1	F201 K212	F201-T203 PolarHBondContact O-N 2.95Å; T203-K212 HydrophobicContact CG2-CD 4.36Å; T203-K212 HydrophobicContact CG2-CG 3.77Å
204	A	42.7	Very low	59.6	Low	49 Å²	49	81 Å²	81	41%	0.405	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	109.8	166.9	0	0	0	0	0	107.9	N202 R206 S211	N202-A204 PolarHBondContact O-N 3Å; A204-R206 PolarHBondContact O-N 3.37Å; A204-S211 PolarHBondContact N-O 2.89Å; A204-S211 VanDerWaalsContact N-O 3.17Å; A204-S211 PolarHBondContact O-N 2.66Å
205	V	39.3	Very low	58.2	Low	99 Å²	99	83 Å²	83	60%	0.6	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	102.8	164.8	-178.9	0	0	0	0	106.5	L210	V205-L210 HydrophobicContact CG2-CD2 3.67Å; V205-L210 HydrophobicContact CG2-CG 4.24Å
206	R	39.1	Very low	57.1	Low	204 Å²	204	83.9 Å²	83.9	77%	0.77	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	118.4	171.8	-159.5	171.2	164.2	132	-2.5	107.4	A204 W209	A204-R206 PolarHBondContact O-N 3.37Å; R206-W209 PolarHBondContact N-O 3.44Å; R206-W209 PolarHBondContact O-N 3.17Å
207	N	39.6	Very low	56.5	Low	151 Å²	151	82.1 Å²	82.1	81%	0.807	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	60.3	177.6	-58	-16.2	0	0	0	115	W209	N207-W209 PolarHBondContact O-N 3.03Å
208	H	45.3	Very low	56.7	Low	193 Å²	193	81.8 Å²	81.8	89%	0.894	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	8.6	-179.1	-84.2	-80.7	0	0	0	116.1
209	W	47.2	Very low	57.1	Low	115 Å²	115	81.8 Å²	81.8	44%	0.436	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.3	177.3	-149	77.7	0	0	0	110.1	T11 R206 N207 S211	T11-W209 HydrophobicContact CG2-CH2 3.67Å; T11-W209 HydrophobicContact CG2-CZ2 3.59Å; R206-W209 PolarHBondContact N-O 3.44Å; R206-W209 PolarHBondContact O-N 3.17Å; N207-W209 PolarHBondContact O-N 3.03Å; W209-S211 PolarHBondContact O-N 2.86Å
210	L	42.7	Very low	58.1	Low	118 Å²	118	79 Å²	79	62%	0.618	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	96.9	172.8	-89	161	0	0	0	108.1	V205	V205-L210 HydrophobicContact CG2-CD2 3.67Å; V205-L210 HydrophobicContact CG2-CG 4.24Å
211	S	47.6	Very low	59.5	Low	12 Å²	12	77.3 Å²	77.3	8%	0.084	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.4	163	-165.4	0	0	0	0	109.1	A204 W209 F213	A204-S211 PolarHBondContact N-O 2.89Å; A204-S211 VanDerWaalsContact N-O 3.17Å; A204-S211 PolarHBondContact O-N 2.66Å; W209-S211 PolarHBondContact O-N 2.86Å; S211-F213 WeakPolarHBondContact OG-CD2 3.35Å; S211-F213 WeakPolarHBondContact OG-CE2 3.44Å; S211-F213 WeakPolarHBondContact OG-CZ 3.27Å
212	K	49.6	Very low	61.6	Low	141 Å²	141	71.1 Å²	71.1	61%	0.613	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	108.5	163.9	-82.2	-174.9	178.3	-175.1	0	107.2	T203	T203-K212 HydrophobicContact CG2-CD 4.36Å; T203-K212 HydrophobicContact CG2-CG 3.77Å
213	F	56.6	Low	63.8	Low	78 Å²	78	67.5 Å²	67.5	34%	0.342	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	138	168.3	-71.4	-71.6	0	0	0	109.3	V12 Q20 N202 S211 S215	V12-F213 HydrophobicContact CG2-CE1 4.3Å; Q20-F213 VanDerWaalsContact NE2-CE1 3.3Å; N202-F213 PolarHBondContact N-O 2.89Å; N202-F213 PolarHBondContact O-N 2.79Å; N202-F213 VanDerWaalsContact O-N 3.08Å; S211-F213 WeakPolarHBondContact OG-CD2 3.35Å; S211-F213 WeakPolarHBondContact OG-CE2 3.44Å; S211-F213 WeakPolarHBondContact OG-CZ 3.27Å; F213-S215 PolarHBondContact O-N 3.04Å
214	V	58.7	Low	66.4	Low	67 Å²	67	63.4 Å²	63.4	41%	0.406	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.3	171.2	-179.2	0	0	0	0	106.8	L199 R200 F201 L216	L199-V214 HydrophobicContact CB-CG1 4.43Å; L199-V214 HydrophobicContact CD2-CG1 4.04Å; R200-V214 WeakPolarHBondContact O-CA 3.31Å; F201-V214 HydrophobicContact CD1-CG2 3.81Å; F201-V214 HydrophobicContact CE1-CG2 3.53Å; F201-V214 HydrophobicContact CZ-CG2 4.3Å; V214-L216 HydrophobicContact CG1-CD2 4.46Å
215	S	65.7	Low	68.9	Low	43 Å²	43	62.2 Å²	62.2	30%	0.301	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.2	169.1	-169.4	0	0	0	0	107.2	R200 N202 F213 V217	R200-S215 PolarHBondContact N-O 3.07Å; R200-S215 PolarHBondContact O-N 3.41Å; N202-S215 WeakPolarHBondContact ND2-CB 3.45Å; F213-S215 PolarHBondContact O-N 3.04Å; S215-V217 WeakPolarHBondContact O-CG2 3.46Å; S215-V217 PolarHBondContact O-N 3.05Å; S215-V217 VanDerWaalsContact O-N 3.12Å; S215-V217 WeakPolarHBondContact OG-CG2 3.3Å
216	L	66.8	Low	71.5	Confident	48 Å²	48	59 Å²	59	25%	0.251	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	91	171.2	-59.5	177.1	0	0	0	107	L199 V214	L199-L216 HydrophobicContact CD2-CD2 4.05Å; V214-L216 HydrophobicContact CG1-CD2 4.46Å
217	V	77.5	Confident	74.1	Confident	12 Å²	12	52.2 Å²	52.2	7%	0.073	26%	0.262	C	S	.	.			trans	-93.2	-39.3	-165.6	179.8	0	0	0	0	112.1	K162 R200 S215	K162-V217 WeakPolarHBondContact CD-O 3.24Å; R200-V217 HydrophobicContact CB-CG2 3.76Å; R200-V217 HydrophobicContact CG-CG2 4.08Å; S215-V217 WeakPolarHBondContact O-CG2 3.46Å; S215-V217 PolarHBondContact O-N 3.05Å; S215-V217 VanDerWaalsContact O-N 3.12Å; S215-V217 WeakPolarHBondContact OG-CG2 3.3Å
218	L	92.3	Very high	76.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.247	C	C	.	.			trans	-152.9	157.6	-171.1	62.7	87.1	0	0	0	112.3	G46 V155 V161 K162 I164 V197 A198 I220	G46-L218 VanDerWaalsContact CA-O 3.23Å; G46-L218 WeakPolarHBondContact CA-O 3.38Å; G46-L218 PolarHBondContact N-O 2.81Å; V155-L218 HydrophobicContact CB-CD2 4.39Å; V155-L218 HydrophobicContact CG1-CD2 3.4Å; V155-L218 VanDerWaalsContact CG1-CD2 3.4Å; V155-L218 HydrophobicContact CG2-CD2 4.07Å; V161-L218 HydrophobicContact CG1-CD2 4.4Å; K162-L218 CarbonylContact O-C 3.59Å; K162-L218 WeakPolarHBondContact O-CA 3.34Å; K162-L218 WeakPolarHBondContact O-CB 3.48Å; I164-L218 HydrophobicContact CD1-CD1 3.8Å; I164-L218 HydrophobicContact CD1-CD2 4.1Å; I164-L218 HydrophobicContact CG1-CD1 4.02Å; V197-L218 HydrophobicContact CG1-CD1 4.44Å; V197-L218 HydrophobicContact CG1-CD2 4.04Å; A198-L218 HydrophobicContact CB-CD1 4.17Å; L218-I220 HydrophobicContact CD1-CD1 3.38Å; L218-I220 HydrophobicContact CD1-CG1 4.12Å
219	Q	95.4	Very high	78.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	139.2	172.9	170.4	64.7	71.7	0	0	110.5	I28 V43 P44 L45 Q47 T49 K162 L163 I164	I28-Q219 HydrophobicContact CD1-CB 4.11Å; V43-Q219 VanDerWaalsContact CG1-CD 3.46Å; V43-Q219 HydrophobicContact CG1-CG 3.56Å; V43-Q219 VanDerWaalsContact CG1-OE1 3.29Å; P44-Q219 PolarHBondContact O-OE1 3.22Å; L45-Q219 HydrophobicContact CD2-CB 3.95Å; Q47-Q219 PolarHBondContact O-NE2 2.72Å; T49-Q219 VanDerWaalsContact N-NE2 3.11Å; T49-Q219 PolarHBondContact OG1-NE2 3.42Å; K162-Q219 PolarHBondContact O-N 3.38Å; L163-Q219 WeakPolarHBondContact CA-O 3.35Å; L163-Q219 HydrophobicContact CD1-CB 4.13Å; L163-Q219 HydrophobicContact CD1-CG 3.95Å; I164-Q219 PolarHBondContact N-O 3.44Å
220	I	97.1	Very high	81.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	108	166.6	-51.9	-64.1	0	0	0	109.4	Q47 M48 T49 I164 L194 A198 L218 V222	Q47-I220 PolarHBondContact O-N 3.14Å; M48-I220 CarbonylContact C-O 3.52Å; M48-I220 VanDerWaalsContact CA-O 3.26Å; M48-I220 WeakPolarHBondContact CA-O 3.17Å; M48-I220 HydrophobicContact CB-CB 4.13Å; M48-I220 HydrophobicContact CG-CB 4.03Å; M48-I220 HydrophobicContact CG-CG2 4.05Å; M48-I220 HydrophobicContact SD-CG2 4.16Å; T49-I220 PolarHBondContact N-O 3.26Å; I164-I220 HydrophobicContact CB-CD1 3.72Å; I164-I220 HydrophobicContact CD1-CD1 3.7Å; I164-I220 HydrophobicContact CG1-CD1 4.08Å; I164-I220 HydrophobicContact CG2-CD1 4.29Å; I164-I220 CarbonylContact O-C 3.56Å; I164-I220 WeakPolarHBondContact O-CA 3.28Å; L194-I220 HydrophobicContact CB-CG2 4.36Å; L194-I220 HydrophobicContact CD2-CG2 4.48Å; A198-I220 HydrophobicContact CB-CD1 4.32Å; A198-I220 HydrophobicContact CB-CG1 3.75Å; L218-I220 HydrophobicContact CD1-CD1 3.38Å; L218-I220 HydrophobicContact CD1-CG1 4.12Å; I220-V222 HydrophobicContact CG2-CG1 3.86Å
221	F	98.1	Very high	83.5	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118.9	176.9	-167.3	-90.7	0	0	0	110	V43 T49 F51 L62 L66 L163 I164 V165 V166 T223	V43-F221 HydrophobicContact CG1-CD2 4.05Å; T49-F221 HydrophobicContact CG2-CD2 3.84Å; T49-F221 HydrophobicContact CG2-CE2 3.68Å; F51-F221 HydrophobicContact CB-CE1 3.88Å; F51-F221 HydrophobicContact CB-CE2 4.42Å; F51-F221 HydrophobicContact CB-CZ 3.53Å; F51-F221 HydrophobicContact CD2-CZ 4.45Å; F51-F221 HydrophobicContact CG-CZ 4.09Å; L62-F221 HydrophobicContact CD2-CE1 4.49Å; L62-F221 HydrophobicContact CD2-CZ 3.72Å; L62-F221 HydrophobicContact CG-CE1 4.47Å; L62-F221 HydrophobicContact CG-CZ 4.02Å; L66-F221 HydrophobicContact CD1-CD1 3.89Å; L66-F221 HydrophobicContact CD1-CD2 3.45Å; L66-F221 VanDerWaalsContact CD1-CD2 3.45Å; L66-F221 HydrophobicContact CD1-CE1 3.84Å; L66-F221 HydrophobicContact CD1-CE2 3.4Å; L66-F221 HydrophobicContact CD1-CG 3.69Å; L66-F221 HydrophobicContact CD1-CZ 3.59Å; L163-F221 HydrophobicContact CD1-CB 3.93Å; I164-F221 PolarHBondContact O-N 2.65Å; V165-F221 CarbonylContact C-O 3.6Å; V165-F221 VanDerWaalsContact CA-O 3.28Å; V165-F221 WeakPolarHBondContact CA-O 3.48Å; V166-F221 PolarHBondContact N-O 2.99Å; F221-T223 HydrophobicContact CE1-CG2 4.39Å
222	V	98.1	Very high	85.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	133.8	-179	-55.5	0	0	0	0	110.8	M48 T49 E50 F51 V166 I169 I220 L246	M48-V222 HydrophobicContact SD-CG1 4.35Å; T49-V222 PolarHBondContact O-N 2.87Å; E50-V222 WeakPolarHBondContact CA-O 3.38Å; E50-V222 HydrophobicContact CB-CG2 4.06Å; E50-V222 HydrophobicContact CG-CG2 4.05Å; F51-V222 PolarHBondContact N-O 3.32Å; V166-V222 HydrophobicContact CB-CB 4.45Å; V166-V222 HydrophobicContact CB-CG1 3.98Å; V166-V222 HydrophobicContact CG2-CG1 4.11Å; I169-V222 HydrophobicContact CB-CB 4.16Å; I169-V222 HydrophobicContact CG2-CB 4.41Å; I220-V222 HydrophobicContact CG2-CG1 3.86Å; V222-L246 HydrophobicContact CG2-CD1 4.37Å; V222-L246 HydrophobicContact CG2-CD2 4.46Å
223	T	98.1	Very high	87.7	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	142.9	165.6	74.1	0	0	0	0	109.5	F51 K59 C63 V166 D167 S168 I169 F221	F51-T223 WeakPolarHBondContact O-CA 3.21Å; K59-T223 HydrophobicContact CB-CG2 3.9Å; C63-T223 WeakPolarHBondContact SG-CG2 3.11Å; V166-T223 PolarHBondContact O-N 2.93Å; D167-T223 WeakPolarHBondContact CA-OG1 3.46Å; D167-T223 HydrophobicContact CB-CG2 4.4Å; D167-T223 WeakPolarHBondContact OD1-CB 3.24Å; D167-T223 WeakPolarHBondContact OD1-CG2 3.48Å; D167-T223 PolarHBondContact OD1-OG1 2.94Å; S168-T223 WeakPolarHBondContact CA-O 3.46Å; S168-T223 VanDerWaalsContact CA-OG1 3.27Å; S168-T223 WeakPolarHBondContact CA-OG1 3.37Å; S168-T223 WeakPolarHBondContact CB-OG1 3.25Å; S168-T223 PolarHBondContact OG-O 2.91Å; I169-T223 WeakPolarHBondContact CG2-O 3.43Å; I169-T223 PolarHBondContact N-O 3.04Å; F221-T223 HydrophobicContact CE1-CG2 4.39Å
224	N	97	Very high	89.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151.1	176.8	-160.7	5.4	0	0	0	111.1	E50 F51 V52 G53 K59 I169 A170 C241	E50-N224 HydrophobicContact CG-CB 4.16Å; E50-N224 WeakPolarHBondContact OE1-CB 3.46Å; E50-N224 PolarHBondContact OE1-ND2 2.91Å; F51-N224 PolarHBondContact O-N 2.82Å; V52-N224 WeakPolarHBondContact CA-O 3.34Å; V52-N224 HydrophobicContact CG1-CB 4.43Å; V52-N224 HydrophobicContact CG2-CB 4.17Å; G53-N224 PolarHBondContact N-O 2.73Å; G53-N224 VanDerWaalsContact N-O 3.14Å; K59-N224 WeakPolarHBondContact CD-O 3.45Å; K59-N224 WeakPolarHBondContact CE-O 3.38Å; I169-N224 HydrophobicContact CG2-CB 4.05Å; A170-N224 VanDerWaalsContact CB-OD1 3.25Å; A170-N224 WeakPolarHBondContact CB-OD1 3.25Å; N224-C241 PolarHBondContact ND2-O 3.18Å; N224-C241 WeakPolarHBondContact OD1-CB 3.28Å
225	Q	95.1	Very high	91	Very high	25 Å²	25	56.7 Å²	56.7	12%	0.117	28%	0.28	C	S	.	.			trans	-90.2	166.1	170.4	-64.4	-165.7	24.7	0	0	110.3	E89 R174 C241	E89-Q225 PolarHBondContact OE1-NE2 3.28Å; R174-Q225 VanDerWaalsContact NH2-CD 3.32Å; Q225-C241 PolarHBondContact O-N 2.98Å; Q225-C241 PolarHBondContact O-SG 3.27Å
226	V	95	Very high	92.4	Very high	32 Å²	32	58.2 Å²	58.2	19%	0.194	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	153.4	171.9	-63.4	0	0	0	0	111.4	V52 P54 I238 A239 F255	V52-V226 HydrophobicContact CG1-CG1 3.77Å; P54-V226 HydrophobicContact CB-CG2 4.36Å; P54-V226 HydrophobicContact CG-CG2 3.98Å; V226-I238 HydrophobicContact CB-CG2 3.41Å; V226-I238 VanDerWaalsContact CB-CG2 3.41Å; V226-I238 HydrophobicContact CG1-CG2 3.56Å; V226-I238 HydrophobicContact CG2-CG2 3.83Å; V226-A239 CarbonylContact C-O 3.54Å; V226-A239 VanDerWaalsContact CA-O 3.31Å; V226-A239 WeakPolarHBondContact CA-O 3.35Å; V226-F255 HydrophobicContact CG1-CE1 4.06Å
227	T	93.8	Very high	93.6	Very high	60 Å²	60	61.2 Å²	61.2	37%	0.368	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	156.2	169.4	-173.7	0	0	0	0	109.4	A239	T227-A239 PolarHBondContact N-O 2.78Å; T227-A239 PolarHBondContact O-N 2.89Å
228	T	93.3	Very high	94.3	Very high	78 Å²	78	65 Å²	65	48%	0.479	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	133.1	171.4	-52.5	0	0	0	0	109.7
229	K	91.7	Very high	94.4	Very high	78 Å²	78	65.4 Å²	65.4	34%	0.339	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	160.6	168.4	-73.3	-168.5	176.7	-175.6	0	109.5	S236 Y237 A239	K229-S236 CarbonylContact O-C 3.56Å; K229-S236 VanDerWaalsContact O-CA 3.31Å; K229-S236 WeakPolarHBondContact O-CA 3.31Å; K229-Y237 HydrophobicContact CB-CD1 4.17Å; K229-Y237 HydrophobicContact CB-CD2 4.35Å; K229-Y237 HydrophobicContact CB-CE1 3.58Å; K229-Y237 HydrophobicContact CB-CE2 3.8Å; K229-Y237 HydrophobicContact CD-CE2 4.16Å; K229-Y237 WeakPolarHBondContact CD-OH 3.29Å; K229-Y237 HydrophobicContact CG-CE2 4.48Å; K229-Y237 PolarHBondContact N-O 3.15Å; K229-Y237 PolarHBondContact O-N 3.08Å; K229-A239 HydrophobicContact CD-CB 3.94Å; K229-A239 HydrophobicContact CG-CB 4.13Å
230	W	93.2	Very high	94.4	Very high	178 Å²	178	66.1 Å²	66.1	67%	0.674	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.8	-177.5	-63.7	80.7	0	0	0	109.7	G234 E235	W230-G234 VanDerWaalsContact CE3-O 3.27Å; W230-G234 VanDerWaalsContact CZ3-O 3.29Å; W230-G234 WeakPolarHBondContact CZ3-O 3.35Å; W230-E235 CarbonylContact C-O 3.53Å; W230-E235 WeakPolarHBondContact CA-O 3.25Å
231	T	93.1	Very high	94.3	Very high	47 Å²	47	66.7 Å²	66.7	29%	0.288	33%	0.33	S	S	.	.			trans	-76.3	166.5	171.7	71.1	0	0	0	0	110.2	Y233 G234 E235 Y237	T231-Y233 PolarHBondContact O-N 3.4Å; T231-Y233 VanDerWaalsContact O-N 3.12Å; T231-Y233 PolarHBondContact OG1-N 3.41Å; T231-G234 PolarHBondContact O-N 3.26Å; T231-G234 VanDerWaalsContact O-N 3.08Å; T231-E235 HydrophobicContact CG2-CB 4.17Å; T231-E235 PolarHBondContact N-O 3.06Å; T231-E235 WeakPolarHBondContact OG1-CB 3.43Å; T231-E235 PolarHBondContact OG1-N 2.86Å; T231-E235 VanDerWaalsContact OG1-N 3.11Å; T231-E235 PolarHBondContact OG1-O 3.46Å; T231-Y237 HydrophobicContact CG2-CD1 3.89Å; T231-Y237 HydrophobicContact CG2-CE1 4.01Å
232	K	92.7	Very high	94.2	Very high	210 Å²	210	68.4 Å²	68.4	91%	0.913	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.1	172.9	-64.7	-176.5	-179.9	-179	0	112.8
233	Y	92.5	Very high	93.9	Very high	206 Å²	206	68.9 Å²	68.9	81%	0.808	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	4.7	179.9	-52.2	-64.7	0	0	0	113.1	T231	T231-Y233 PolarHBondContact O-N 3.4Å; T231-Y233 VanDerWaalsContact O-N 3.12Å; T231-Y233 PolarHBondContact OG1-N 3.41Å
234	G	91.7	Very high	93.6	Very high	46 Å²	46	73.1 Å²	73.1	47%	0.474	37%	0.371	S	S	.	.	S	Bend	trans	81.8	10.8	179.3	0	0	0	0	0	114.7	W230 T231	W230-G234 VanDerWaalsContact CE3-O 3.27Å; W230-G234 VanDerWaalsContact CZ3-O 3.29Å; W230-G234 WeakPolarHBondContact CZ3-O 3.35Å; T231-G234 PolarHBondContact O-N 3.26Å; T231-G234 VanDerWaalsContact O-N 3.08Å
235	E	93.6	Very high	93.5	Very high	127 Å²	127	75.1 Å²	75.1	59%	0.593	38%	0.381	S	S	*	.			trans	-83.8	131.9	174.9	-58.2	173.1	136.9	0	0	110.2	W230 T231	W230-E235 CarbonylContact C-O 3.53Å; W230-E235 WeakPolarHBondContact CA-O 3.25Å; T231-E235 HydrophobicContact CG2-CB 4.17Å; T231-E235 PolarHBondContact N-O 3.06Å; T231-E235 WeakPolarHBondContact OG1-CB 3.43Å; T231-E235 PolarHBondContact OG1-N 2.86Å; T231-E235 VanDerWaalsContact OG1-N 3.11Å; T231-E235 PolarHBondContact OG1-O 3.46Å
236	S	93.5	Very high	93.5	Very high	75 Å²	75	74 Å²	74	52%	0.524	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	138.6	176.3	66.4	0	0	0	0	111.5	K229	K229-S236 CarbonylContact O-C 3.56Å; K229-S236 VanDerWaalsContact O-CA 3.31Å; K229-S236 WeakPolarHBondContact O-CA 3.31Å
237	Y	93.2	Very high	93.4	Very high	111 Å²	111	73.8 Å²	73.8	44%	0.435	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	155.7	171	68	-83.3	0	0	0	111.6	K229 T231 A239	K229-Y237 HydrophobicContact CB-CD1 4.17Å; K229-Y237 HydrophobicContact CB-CD2 4.35Å; K229-Y237 HydrophobicContact CB-CE1 3.58Å; K229-Y237 HydrophobicContact CB-CE2 3.8Å; K229-Y237 HydrophobicContact CD-CE2 4.16Å; K229-Y237 WeakPolarHBondContact CD-OH 3.29Å; K229-Y237 HydrophobicContact CG-CE2 4.48Å; K229-Y237 PolarHBondContact N-O 3.15Å; K229-Y237 PolarHBondContact O-N 3.08Å; T231-Y237 HydrophobicContact CG2-CD1 3.89Å; T231-Y237 HydrophobicContact CG2-CE1 4.01Å; Y237-A239 HydrophobicContact CD2-CB 4.42Å; Y237-A239 HydrophobicContact CE2-CB 4.08Å
238	I	92.7	Very high	93.3	Very high	91 Å²	91	74.4 Å²	74.4	47%	0.467	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	134.6	179.2	-58.6	-178.9	0	0	0	109	V226	V226-I238 HydrophobicContact CB-CG2 3.41Å; V226-I238 VanDerWaalsContact CB-CG2 3.41Å; V226-I238 HydrophobicContact CG1-CG2 3.56Å; V226-I238 HydrophobicContact CG2-CG2 3.83Å
239	A	94	Very high	93.3	Very high	9 Å²	9	73.3 Å²	73.3	7%	0.074	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	157.7	176.5	0	0	0	0	0	110.9	V226 T227 K229 Y237	V226-A239 CarbonylContact C-O 3.54Å; V226-A239 VanDerWaalsContact CA-O 3.31Å; V226-A239 WeakPolarHBondContact CA-O 3.35Å; T227-A239 PolarHBondContact N-O 2.78Å; T227-A239 PolarHBondContact O-N 2.89Å; K229-A239 HydrophobicContact CD-CB 3.94Å; K229-A239 HydrophobicContact CG-CB 4.13Å; Y237-A239 HydrophobicContact CD2-CB 4.42Å; Y237-A239 HydrophobicContact CE2-CB 4.08Å
240	P	95.6	Very high	93.5	Very high	15 Å²	15	69.8 Å²	69.8	10%	0.097	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	145.4	171.8	-13.4	27.7	0	0	0	110.9	V52 T247 F255	V52-P240 HydrophobicContact CG1-CB 3.87Å; V52-P240 HydrophobicContact CG1-CG 4.19Å; V52-P240 HydrophobicContact CG2-CB 4.14Å; V52-P240 HydrophobicContact CG2-CG 4.26Å; P240-T247 HydrophobicContact CB-CG2 4.26Å; P240-T247 HydrophobicContact CG-CG2 4.02Å; P240-F255 HydrophobicContact CG-CE2 3.77Å; P240-F255 HydrophobicContact CG-CZ 3.5Å; P240-F255 VanDerWaalsContact CG-CZ 3.5Å
241	C	95.1	Very high	93.5	Very high	11 Å²	11	62 Å²	62	7%	0.074	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	158.9	166.2	-66.3	0	0	0	0	110.4	A170 R174 N224 Q225 G243	A170-C241 HydrophobicContact CB-CB 3.63Å; R174-C241 PolarHBondContact NH2-SG 2.79Å; R174-C241 VanDerWaalsContact NH2-SG 3.42Å; N224-C241 PolarHBondContact ND2-O 3.18Å; N224-C241 WeakPolarHBondContact OD1-CB 3.28Å; Q225-C241 PolarHBondContact O-N 2.98Å; Q225-C241 PolarHBondContact O-SG 3.27Å; C241-G243 PolarHBondContact O-N 3.39Å
242	L	94.7	Very high	93.6	Very high	38 Å²	38	59.8 Å²	59.8	20%	0.199	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	-16.7	-177.2	-45	-177.4	0	0	0	115.9	I169 A170 F173 V187 L246	I169-L242 HydrophobicContact CG1-CD1 4.07Å; I169-L242 HydrophobicContact CG2-CD1 4.13Å; A170-L242 HydrophobicContact CB-CD1 4.43Å; A170-L242 HydrophobicContact CB-CD2 4.5Å; A170-L242 HydrophobicContact CB-CG 4.24Å; F173-L242 HydrophobicContact CB-CD2 3.78Å; F173-L242 HydrophobicContact CD2-CD1 3.72Å; F173-L242 HydrophobicContact CD2-CD2 3.76Å; F173-L242 HydrophobicContact CD2-CG 4.39Å; F173-L242 HydrophobicContact CE2-CD1 4Å; F173-L242 HydrophobicContact CG-CD2 4.07Å; V187-L242 HydrophobicContact CG1-CB 4.25Å; V187-L242 HydrophobicContact CG1-CD1 4.15Å; V187-L242 HydrophobicContact CG1-CD2 4.28Å; V187-L242 HydrophobicContact CG1-CG 4.46Å; V187-L242 HydrophobicContact CG2-CD2 3.94Å; L242-L246 HydrophobicContact CB-CB 4.1Å; L242-L246 HydrophobicContact CD1-CD2 4.24Å
243	G	92.1	Very high	93.8	Very high	10 Å²	10	50.6 Å²	50.6	10%	0.103	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	-150.9	170.6	0	0	0	0	0	113.6	C241 I245 L246 T247	C241-G243 PolarHBondContact O-N 3.39Å; G243-I245 PolarHBondContact O-N 3.37Å; G243-L246 PolarHBondContact O-N 3.35Å; G243-T247 WeakPolarHBondContact O-CG2 3.34Å; G243-T247 PolarHBondContact O-N 3.05Å
244	P	92.6	Very high	94	Very high	89 Å²	89	40.8 Å²	40.8	58%	0.578	24%	0.239	S	C	*	.	H	α-helix	trans	-56.1	-25.3	-171.5	-28.1	36.1	0	0	0	115.6	L246 T247 S248	P244-L246 VanDerWaalsContact C-N 3.25Å; P244-L246 PolarHBondContact O-N 3.18Å; P244-T247 WeakPolarHBondContact CA-OG1 3.18Å; P244-S248 WeakPolarHBondContact O-CB 3.35Å; P244-S248 PolarHBondContact O-N 2.74Å; P244-S248 PolarHBondContact O-OG 3.37Å
245	I	93.7	Very high	94.3	Very high	41 Å²	41	39.2 Å²	39.2	21%	0.21	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-39.9	179	-54.9	176.4	0	0	0	110.3	N184 V187 Q188 I191 G243 N249	N184-I245 HydrophobicContact CB-CD1 3.73Å; V187-I245 HydrophobicContact CG1-CB 4.38Å; V187-I245 HydrophobicContact CG1-CG2 3.96Å; Q188-I245 HydrophobicContact CB-CG2 4Å; Q188-I245 HydrophobicContact CG-CG2 4.46Å; I191-I245 HydrophobicContact CD1-CG2 3.83Å; G243-I245 PolarHBondContact O-N 3.37Å; I245-N249 PolarHBondContact O-ND2 2.99Å
246	L	95.3	Very high	94.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-84.5	-51.2	174.1	179.3	61.4	0	0	0	111.7	M48 E50 I169 I191 V222 L242 G243 P244 S248 N249 C250	M48-L246 HydrophobicContact CE-CD1 4.31Å; M48-L246 HydrophobicContact SD-CD1 4.25Å; E50-L246 HydrophobicContact CG-CD2 4.21Å; E50-L246 VanDerWaalsContact OE1-CD2 3.31Å; E50-L246 WeakPolarHBondContact OE1-CD2 3.33Å; I169-L246 HydrophobicContact CG2-CD2 3.69Å; I191-L246 HydrophobicContact CD1-CB 3.91Å; I191-L246 HydrophobicContact CD1-CD1 4.04Å; I191-L246 HydrophobicContact CG1-CD1 4.08Å; V222-L246 HydrophobicContact CG2-CD1 4.37Å; V222-L246 HydrophobicContact CG2-CD2 4.46Å; L242-L246 HydrophobicContact CB-CB 4.1Å; L242-L246 HydrophobicContact CD1-CD2 4.24Å; G243-L246 PolarHBondContact O-N 3.35Å; P244-L246 VanDerWaalsContact C-N 3.25Å; P244-L246 PolarHBondContact O-N 3.18Å; L246-S248 VanDerWaalsContact C-N 3.27Å; L246-S248 PolarHBondContact O-N 2.84Å; L246-N249 PolarHBondContact O-N 3.35Å; L246-C250 PolarHBondContact O-N 2.61Å; L246-C250 PolarHBondContact O-SG 3.21Å
247	T	92.9	Very high	94.5	Very high	29 Å²	29	33.7 Å²	33.7	18%	0.178	18%	0.182	C	C	.	.	H	α-helix	trans	-66.5	-28.4	-167.8	70.6	0	0	0	0	113.2	P240 G243 P244 N249 K270	P240-T247 HydrophobicContact CB-CG2 4.26Å; P240-T247 HydrophobicContact CG-CG2 4.02Å; G243-T247 WeakPolarHBondContact O-CG2 3.34Å; G243-T247 PolarHBondContact O-N 3.05Å; P244-T247 WeakPolarHBondContact CA-OG1 3.18Å; T247-N249 VanDerWaalsContact C-N 3.31Å; T247-K270 PolarHBondContact O-NZ 2.83Å
248	S	92.9	Very high	94.4	Very high	73 Å²	73	34.1 Å²	34.1	51%	0.51	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-31.2	174.7	61	0	0	0	0	112.7	P244 L246 K270	P244-S248 WeakPolarHBondContact O-CB 3.35Å; P244-S248 PolarHBondContact O-N 2.74Å; P244-S248 PolarHBondContact O-OG 3.37Å; L246-S248 VanDerWaalsContact C-N 3.27Å; L246-S248 PolarHBondContact O-N 2.84Å; S248-K270 PolarHBondContact O-NZ 2.81Å
249	N	93.6	Very high	94.4	Very high	55 Å²	55	34.4 Å²	34.4	29%	0.294	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-6.9	-176.3	-77.9	-65.3	0	0	0	114	M48 I191 L195 I245 L246 T247	M48-N249 HydrophobicContact CE-CB 3.62Å; M48-N249 VanDerWaalsContact CE-O 3.24Å; M48-N249 WeakPolarHBondContact CE-O 3.36Å; I191-N249 HydrophobicContact CG2-CB 3.82Å; L195-N249 HydrophobicContact CD1-CB 3.84Å; L195-N249 WeakPolarHBondContact CD1-OD1 3.47Å; I245-N249 PolarHBondContact O-ND2 2.99Å; L246-N249 PolarHBondContact O-N 3.35Å; T247-N249 VanDerWaalsContact C-N 3.31Å
250	C	94.7	Very high	94.2	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.02	20%	0.203	C	C	.	.			trans	-94.2	137.1	176.1	-56.3	0	0	0	0	110.7	M48 E50 L246 K270	M48-C250 CarbonylContact O-C 3.49Å; M48-C250 WeakPolarHBondContact O-CA 3.47Å; M48-C250 WeakPolarHBondContact O-CB 3.31Å; E50-C250 HydrophobicContact CB-CB 4.1Å; L246-C250 PolarHBondContact O-N 2.61Å; L246-C250 PolarHBondContact O-SG 3.21Å; C250-K270 WeakPolarHBondContact O-CE 3.37Å; C250-K270 PolarHBondContact O-NZ 3.26Å
251	S	93	Very high	94.1	Very high	14 Å²	14	39.3 Å²	39.3	10%	0.098	23%	0.227	C	C	.	.	S	Bend	trans	-74.6	-42.9	175.3	53.2	0	0	0	0	111.5	Q47 M48 S271 T272	Q47-S251 WeakPolarHBondContact CB-OG 3.48Å; Q47-S251 PolarHBondContact OE1-OG 3.01Å; M48-S251 PolarHBondContact O-N 2.96Å; M48-S251 PolarHBondContact O-OG 3.37Å; S251-S271 CarbonylContact O-C 3.54Å; S251-S271 WeakPolarHBondContact O-CA 3.4Å; S251-T272 PolarHBondContact O-N 2.82Å
252	H	95.9	Very high	94	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.9	175.2	-55.1	-78.3	0	0	0	110.8	T49 E50 K270 S271	T49-H252 HydrophobicContact CG2-CB 3.99Å; E50-H252 PolarHBondContact N-O 3.18Å; H252-K270 CarbonylContact C-O 3.49Å; H252-K270 VanDerWaalsContact CA-O 3.29Å; H252-K270 WeakPolarHBondContact CA-O 3.15Å; H252-S271 PolarHBondContact CE1-OG 2.72Å; H252-S271 PolarHBondContact ND1-OG 3.28Å
253	Q	96.9	Very high	94.1	Very high	16 Å²	16	40.5 Å²	40.5	8%	0.075	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	115.6	170.1	-175.2	179.2	63.1	0	0	109.2	E50 V52 F255 I269 K270	E50-Q253 PolarHBondContact OE2-NE2 2.71Å; V52-Q253 HydrophobicContact CG2-CG 4.22Å; Q253-F255 HydrophobicContact CG-CD2 4.26Å; Q253-F255 HydrophobicContact CG-CE2 4.22Å; Q253-I269 PolarHBondContact O-N 3.32Å; Q253-K270 HydrophobicContact CB-CB 3.76Å; Q253-K270 PolarHBondContact N-O 2.82Å; Q253-K270 PolarHBondContact O-N 3.49Å
254	L	97	Very high	94.3	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.2	-177.5	-65.9	165.6	0	0	0	108.9	L35 I39 T49 E50 F51 V52 I266 R267 L268	L35-L254 HydrophobicContact CD1-CD1 3.96Å; L35-L254 HydrophobicContact CD1-CD2 3.92Å; I39-L254 HydrophobicContact CG2-CD2 4.37Å; T49-L254 HydrophobicContact CG2-CD1 4.3Å; E50-L254 PolarHBondContact O-N 2.97Å; F51-L254 HydrophobicContact CD2-CB 3.54Å; F51-L254 HydrophobicContact CD2-CD1 3.95Å; F51-L254 HydrophobicContact CD2-CG 4.41Å; F51-L254 HydrophobicContact CE2-CB 4.02Å; F51-L254 HydrophobicContact CE2-CD1 4.45Å; V52-L254 PolarHBondContact N-O 2.97Å; L254-I266 HydrophobicContact CB-CG2 3.9Å; L254-I266 HydrophobicContact CD2-CG2 3.69Å; L254-I266 HydrophobicContact CG-CG2 4.32Å; L254-R267 CarbonylContact C-O 3.44Å; L254-L268 HydrophobicContact CD2-CB 4.08Å; L254-L268 HydrophobicContact CD2-CD1 3.46Å; L254-L268 VanDerWaalsContact CD2-CD1 3.46Å; L254-L268 HydrophobicContact CD2-CG 4.37Å; L254-L268 HydrophobicContact CG-CD1 4.21Å
255	F	97	Very high	94.4	Very high	12 Å²	12	41.4 Å²	41.4	5%	0.053	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.4	177.5	-99.9	-96.9	0	0	0	111.2	V52 V226 P240 Q253 Y257 I266 R267 I269	V52-F255 HydrophobicContact CB-CD1 4.1Å; V52-F255 HydrophobicContact CB-CD2 4.07Å; V52-F255 HydrophobicContact CB-CE1 4.07Å; V52-F255 HydrophobicContact CB-CE2 4.04Å; V52-F255 HydrophobicContact CB-CG 4.15Å; V52-F255 HydrophobicContact CB-CZ 4.07Å; V52-F255 HydrophobicContact CG1-CD1 4.14Å; V52-F255 HydrophobicContact CG1-CE1 3.67Å; V52-F255 HydrophobicContact CG1-CE2 4.23Å; V52-F255 HydrophobicContact CG1-CZ 3.76Å; V52-F255 HydrophobicContact CG2-CD2 4.34Å; V52-F255 HydrophobicContact CG2-CE2 4.13Å; V52-F255 HydrophobicContact CG2-CZ 4.47Å; V52-F255 CarbonylContact O-C 3.54Å; V52-F255 VanDerWaalsContact O-CA 3.31Å; V52-F255 WeakPolarHBondContact O-CA 3.37Å; V226-F255 HydrophobicContact CG1-CE1 4.06Å; P240-F255 HydrophobicContact CG-CE2 3.77Å; P240-F255 HydrophobicContact CG-CZ 3.5Å; P240-F255 VanDerWaalsContact CG-CZ 3.5Å; Q253-F255 HydrophobicContact CG-CD2 4.26Å; Q253-F255 HydrophobicContact CG-CE2 4.22Å; F255-Y257 HydrophobicContact CB-CE2 3.69Å; F255-Y257 HydrophobicContact CD1-CE1 4.49Å; F255-Y257 HydrophobicContact CD1-CE2 4.3Å; F255-Y257 AromaticContact CD1-CZ 3.77Å; F255-Y257 WeakPolarHBondContact CD1-OH 3.21Å; F255-Y257 HydrophobicContact CG-CE2 4.44Å; F255-I266 CarbonylContact O-C 3.56Å; F255-I266 WeakPolarHBondContact O-CA 3.49Å; F255-R267 HydrophobicContact CB-CB 4.28Å; F255-R267 PolarHBondContact N-O 3.31Å; F255-R267 PolarHBondContact O-N 3.3Å; F255-I269 HydrophobicContact CB-CG1 4.22Å; F255-I269 HydrophobicContact CD2-CB 4.43Å; F255-I269 HydrophobicContact CD2-CG1 3.52Å; F255-I269 HydrophobicContact CE2-CG1 4.19Å; F255-I269 HydrophobicContact CG-CG1 4.2Å
256	V	97.1	Very high	94.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	134.3	179.5	64.5	0	0	0	0	112.4	F51 V52 M57 K59 R264 Y265 I266 M281	F51-V256 HydrophobicContact CD1-CG1 4.23Å; F51-V256 HydrophobicContact CE1-CB 3.8Å; F51-V256 HydrophobicContact CE1-CG1 3.52Å; F51-V256 HydrophobicContact CE1-CG2 4.34Å; F51-V256 HydrophobicContact CE2-CB 4.25Å; F51-V256 HydrophobicContact CZ-CB 3.51Å; F51-V256 HydrophobicContact CZ-CG1 3.81Å; F51-V256 HydrophobicContact CZ-CG2 3.96Å; V52-V256 WeakPolarHBondContact O-CG1 3.49Å; V52-V256 PolarHBondContact O-N 3.31Å; M57-V256 HydrophobicContact CB-CB 4.5Å; M57-V256 HydrophobicContact CB-CG1 3.64Å; M57-V256 HydrophobicContact CB-CG2 4.2Å; M57-V256 HydrophobicContact CG-CG1 4.5Å; K59-V256 HydrophobicContact CG-CG1 4.12Å; V256-R264 HydrophobicContact CG2-CB 3.76Å; V256-R264 HydrophobicContact CG2-CG 4.08Å; V256-Y265 CarbonylContact C-O 3.58Å; V256-Y265 WeakPolarHBondContact CA-O 3.31Å; V256-I266 HydrophobicContact CG2-CG1 4.43Å; V256-M281 HydrophobicContact CG2-SD 4.26Å
257	Y	94	Very high	94.6	Very high	86 Å²	86	43.7 Å²	43.7	34%	0.337	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.8	176.8	-55.9	-82.7	0	0	0	110.8	F255 R264 Y265 R267	F255-Y257 HydrophobicContact CB-CE2 3.69Å; F255-Y257 HydrophobicContact CD1-CE1 4.49Å; F255-Y257 HydrophobicContact CD1-CE2 4.3Å; F255-Y257 AromaticContact CD1-CZ 3.77Å; F255-Y257 WeakPolarHBondContact CD1-OH 3.21Å; F255-Y257 HydrophobicContact CG-CE2 4.44Å; Y257-R264 CarbonylContact O-C 3.51Å; Y257-R264 VanDerWaalsContact O-CA 3.24Å; Y257-R264 WeakPolarHBondContact O-CA 3.48Å; Y257-R264 WeakPolarHBondContact O-CB 3.36Å; Y257-Y265 PolarHBondContact N-O 3.25Å; Y257-Y265 PolarHBondContact O-N 3.4Å; Y257-R267 HydrophobicContact CE2-CB 4.32Å
258	K	91.8	Very high	94.8	Very high	121 Å²	121	42.3 Å²	42.3	53%	0.526	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.2	174.6	-172	171.6	-178.7	-179	0	110.7	M57	M57-K258 HydrophobicContact CE-CB 4.07Å; M57-K258 HydrophobicContact SD-CB 3.69Å; M57-K258 PolarHBondContact SD-N 3.38Å; M57-K258 VanDerWaalsContact SD-N 3.43Å
259	K	91.9	Very high	94.9	Very high	97 Å²	97	42.5 Å²	42.5	42%	0.422	22%	0.219	S	C	.	.			trans	-92.4	-76.2	167.1	179.3	-178	178.1	-172.5	0	109.7	T263 Y265 L280	K259-T263 HydrophobicContact CB-CG2 4.4Å; K259-T263 HydrophobicContact CD-CG2 3.94Å; K259-T263 PolarHBondContact N-O 2.8Å; K259-Y265 HydrophobicContact CB-CD2 3.72Å; K259-Y265 HydrophobicContact CB-CE2 3.48Å; K259-Y265 VanDerWaalsContact CB-CE2 3.48Å; K259-Y265 HydrophobicContact CD-CE1 4.19Å; K259-Y265 HydrophobicContact CD-CE2 3.77Å; K259-Y265 WeakPolarHBondContact CD-OH 3.24Å; K259-Y265 WeakPolarHBondContact CE-OH 3.37Å; K259-Y265 HydrophobicContact CG-CD2 4.24Å; K259-Y265 HydrophobicContact CG-CE2 3.46Å; K259-Y265 VanDerWaalsContact CG-CE2 3.46Å; K259-L280 HydrophobicContact CD-CD1 3.61Å
260	S	91.6	Very high	94.9	Very high	67 Å²	67	43.3 Å²	43.3	47%	0.469	22%	0.22	S	C	.	.	S	Bend	trans	-158.4	146.6	-179.3	52.6	0	0	0	0	108.5	S262 T263	S260-S262 PolarHBondContact O-N 3.12Å; S260-T263 WeakPolarHBondContact O-CB 3.4Å; S260-T263 PolarHBondContact O-N 3.49Å
261	G	91.8	Very high	94.8	Very high	59 Å²	59	44.5 Å²	44.5	61%	0.608	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	-127.3	177.5	0	0	0	0	0	114.1	R264	G261-R264 PolarHBondContact O-NH1 3.25Å
262	S	93.8	Very high	94.7	Very high	50 Å²	50	48.5 Å²	48.5	35%	0.35	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-18.7	174.9	47	0	0	0	0	113.7	S260 R264 D282 I283	S260-S262 PolarHBondContact O-N 3.12Å; S262-R264 VanDerWaalsContact C-NH1 3.28Å; S262-R264 PolarHBondContact O-NH1 2.62Å; S262-D282 WeakPolarHBondContact CB-OD1 3.31Å; S262-D282 PolarHBondContact OG-OD1 2.9Å; S262-D282 PolarHBondContact OG-OD2 3.37Å; S262-I283 VanDerWaalsContact CB-O 3.3Å; S262-I283 WeakPolarHBondContact CB-O 3.36Å; S262-I283 PolarHBondContact O-N 3.26Å
263	T	96	Very high	94.2	Very high	24 Å²	24	51.6 Å²	51.6	15%	0.147	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	141.7	-174.2	-43.1	0	0	0	0	112.6	K259 S260 L280 M281 D282 A291	K259-T263 HydrophobicContact CB-CG2 4.4Å; K259-T263 HydrophobicContact CD-CG2 3.94Å; K259-T263 PolarHBondContact N-O 2.8Å; S260-T263 WeakPolarHBondContact O-CB 3.4Å; S260-T263 PolarHBondContact O-N 3.49Å; T263-L280 HydrophobicContact CG2-CD1 3.78Å; T263-L280 HydrophobicContact CG2-CD2 4Å; T263-L280 HydrophobicContact CG2-CG 3.68Å; T263-M281 CarbonylContact C-O 3.53Å; T263-M281 WeakPolarHBondContact CA-O 3.38Å; T263-M281 WeakPolarHBondContact CG2-O 3.33Å; T263-D282 PolarHBondContact N-OD1 3.17Å; T263-D282 PolarHBondContact OG1-OD1 2.77Å; T263-A291 HydrophobicContact CG2-CB 3.81Å
264	R	96.2	Very high	93.6	Very high	26 Å²	26	52.2 Å²	52.2	10%	0.098	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.9	176.3	-52.5	-67.5	178.7	-92.3	-1.7	110.8	M57 V256 Y257 G261 S262 M281 I283	M57-R264 WeakPolarHBondContact O-CD 3.48Å; M57-R264 WeakPolarHBondContact O-CG 3.34Å; M57-R264 PolarHBondContact O-NE 2.84Å; V256-R264 HydrophobicContact CG2-CB 3.76Å; V256-R264 HydrophobicContact CG2-CG 4.08Å; Y257-R264 CarbonylContact O-C 3.51Å; Y257-R264 VanDerWaalsContact O-CA 3.24Å; Y257-R264 WeakPolarHBondContact O-CA 3.48Å; Y257-R264 WeakPolarHBondContact O-CB 3.36Å; G261-R264 PolarHBondContact O-NH1 3.25Å; S262-R264 VanDerWaalsContact C-NH1 3.28Å; S262-R264 PolarHBondContact O-NH1 2.62Å; R264-M281 HydrophobicContact CB-CG 3.59Å; R264-M281 HydrophobicContact CB-SD 3.82Å; R264-M281 HydrophobicContact CG-CG 4.29Å; R264-M281 HydrophobicContact CG-SD 4.26Å; R264-M281 PolarHBondContact N-O 3.36Å; R264-M281 PolarHBondContact O-N 2.96Å; R264-I283 HydrophobicContact CG-CD1 3.82Å; R264-I283 HydrophobicContact CG-CG1 4.34Å
265	Y	96.5	Very high	93.3	Very high	92 Å²	92	60.1 Å²	60.1	36%	0.361	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	130.5	163.1	-70.5	-66.1	0	0	0	108.9	V256 Y257 K259 T278 I279 L280	V256-Y265 CarbonylContact C-O 3.58Å; V256-Y265 WeakPolarHBondContact CA-O 3.31Å; Y257-Y265 PolarHBondContact N-O 3.25Å; Y257-Y265 PolarHBondContact O-N 3.4Å; K259-Y265 HydrophobicContact CB-CD2 3.72Å; K259-Y265 HydrophobicContact CB-CE2 3.48Å; K259-Y265 VanDerWaalsContact CB-CE2 3.48Å; K259-Y265 HydrophobicContact CD-CE1 4.19Å; K259-Y265 HydrophobicContact CD-CE2 3.77Å; K259-Y265 WeakPolarHBondContact CD-OH 3.24Å; K259-Y265 WeakPolarHBondContact CE-OH 3.37Å; K259-Y265 HydrophobicContact CG-CD2 4.24Å; K259-Y265 HydrophobicContact CG-CE2 3.46Å; K259-Y265 VanDerWaalsContact CG-CE2 3.46Å; Y265-T278 HydrophobicContact CD1-CG2 3.74Å; Y265-T278 HydrophobicContact CG-CG2 4.34Å; Y265-I279 CarbonylContact C-O 3.6Å; Y265-I279 WeakPolarHBondContact CA-O 3.39Å; Y265-L280 HydrophobicContact CD1-CD1 3.56Å; Y265-L280 HydrophobicContact CE1-CD1 3.31Å; Y265-L280 HydrophobicContact CG-CD1 4.44Å
266	I	96.7	Very high	93.2	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.6	164.2	-58.7	165.6	0	0	0	108.1	L35 F51 L254 F255 V256 T278 I279 M281	L35-I266 HydrophobicContact CD2-CD1 4.31Å; F51-I266 HydrophobicContact CE2-CD1 4Å; F51-I266 HydrophobicContact CE2-CG1 4.02Å; F51-I266 HydrophobicContact CE2-CG2 4.08Å; F51-I266 HydrophobicContact CZ-CD1 4.24Å; F51-I266 HydrophobicContact CZ-CG1 4.15Å; L254-I266 HydrophobicContact CB-CG2 3.9Å; L254-I266 HydrophobicContact CD2-CG2 3.69Å; L254-I266 HydrophobicContact CG-CG2 4.32Å; F255-I266 CarbonylContact O-C 3.56Å; F255-I266 WeakPolarHBondContact O-CA 3.49Å; V256-I266 HydrophobicContact CG2-CG1 4.43Å; I266-T278 CarbonylContact O-C 3.54Å; I266-T278 WeakPolarHBondContact O-CA 3.48Å; I266-I279 HydrophobicContact CB-CB 4.34Å; I266-I279 PolarHBondContact N-O 2.8Å; I266-I279 PolarHBondContact O-N 2.77Å; I266-M281 HydrophobicContact CD1-CB 4.09Å; I266-M281 HydrophobicContact CD1-CG 3.93Å; I266-M281 HydrophobicContact CD1-SD 3.24Å; I266-M281 WeakPolarHBondContact CD1-SD 3.39Å; I266-M281 HydrophobicContact CG1-CG 4.08Å; I266-M281 HydrophobicContact CG1-SD 3.43Å; I266-M281 WeakPolarHBondContact CG1-SD 3.19Å
267	R	96.5	Very high	93.1	Very high	91 Å²	91	65.3 Å²	65.3	34%	0.343	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118.3	171.5	-175.1	72.8	-175.1	163.1	4.2	109.2	L254 F255 Y257 I269 C277 T278	L254-R267 CarbonylContact C-O 3.44Å; F255-R267 HydrophobicContact CB-CB 4.28Å; F255-R267 PolarHBondContact N-O 3.31Å; F255-R267 PolarHBondContact O-N 3.3Å; Y257-R267 HydrophobicContact CE2-CB 4.32Å; R267-I269 HydrophobicContact CB-CD1 4.25Å; R267-I269 HydrophobicContact CG-CD1 3.41Å; R267-I269 VanDerWaalsContact CG-CD1 3.41Å; R267-I269 HydrophobicContact CG-CG1 4.21Å; R267-I269 PolarHBondContact O-N 3.43Å; R267-C277 WeakPolarHBondContact CD-O 3.34Å; R267-C277 VanDerWaalsContact NH1-C 3.31Å; R267-T278 WeakPolarHBondContact CD-OG1 3.41Å; R267-T278 PolarHBondContact NH1-OG1 2.93Å
268	L	96.2	Very high	93.2	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	111.2	167.9	-177.3	65.1	0	0	0	108.5	A38 I39 L254 K270 P276 C277	A38-L268 HydrophobicContact CB-CD2 4.23Å; A38-L268 WeakPolarHBondContact O-CD2 3.46Å; I39-L268 HydrophobicContact CG2-CD1 4.06Å; I39-L268 HydrophobicContact CG2-CD2 4.48Å; L254-L268 HydrophobicContact CD2-CB 4.08Å; L254-L268 HydrophobicContact CD2-CD1 3.46Å; L254-L268 VanDerWaalsContact CD2-CD1 3.46Å; L254-L268 HydrophobicContact CD2-CG 4.37Å; L254-L268 HydrophobicContact CG-CD1 4.21Å; L268-K270 VanDerWaalsContact CD1-O 3.28Å; L268-K270 WeakPolarHBondContact CD1-O 3.33Å; L268-P276 VanDerWaalsContact O-CA 3.25Å; L268-P276 WeakPolarHBondContact O-CA 3.42Å; L268-P276 WeakPolarHBondContact O-CB 3.15Å; L268-C277 PolarHBondContact N-O 3.44Å
269	I	93.9	Very high	93.4	Very high	76 Å²	76	59.5 Å²	59.5	39%	0.39	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-43	-177.2	-60.1	-65.3	0	0	0	110.9	Q253 F255 R267	Q253-I269 PolarHBondContact O-N 3.32Å; F255-I269 HydrophobicContact CB-CG1 4.22Å; F255-I269 HydrophobicContact CD2-CB 4.43Å; F255-I269 HydrophobicContact CD2-CG1 3.52Å; F255-I269 HydrophobicContact CE2-CG1 4.19Å; F255-I269 HydrophobicContact CG-CG1 4.2Å; R267-I269 HydrophobicContact CB-CD1 4.25Å; R267-I269 HydrophobicContact CG-CD1 3.41Å; R267-I269 VanDerWaalsContact CG-CD1 3.41Å; R267-I269 HydrophobicContact CG-CG1 4.21Å; R267-I269 PolarHBondContact O-N 3.43Å
270	K	94.4	Very high	93.6	Very high	72 Å²	72	56.9 Å²	56.9	31%	0.313	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.9	178.9	-171.6	-170.4	-179.1	-165.7	0	108.3	T247 S248 C250 H252 Q253 L268	T247-K270 PolarHBondContact O-NZ 2.83Å; S248-K270 PolarHBondContact O-NZ 2.81Å; C250-K270 WeakPolarHBondContact O-CE 3.37Å; C250-K270 PolarHBondContact O-NZ 3.26Å; H252-K270 CarbonylContact C-O 3.49Å; H252-K270 VanDerWaalsContact CA-O 3.29Å; H252-K270 WeakPolarHBondContact CA-O 3.15Å; Q253-K270 HydrophobicContact CB-CB 3.76Å; Q253-K270 PolarHBondContact N-O 2.82Å; Q253-K270 PolarHBondContact O-N 3.49Å; L268-K270 VanDerWaalsContact CD1-O 3.28Å; L268-K270 WeakPolarHBondContact CD1-O 3.33Å
271	S	93.6	Very high	93.7	Very high	29 Å²	29	53.7 Å²	53.7	20%	0.203	32%	0.315	C	S	.	.			trans	-155.1	146.6	177.3	-170.1	0	0	0	0	109.6	S251 H252 A273 G274	S251-S271 CarbonylContact O-C 3.54Å; S251-S271 WeakPolarHBondContact O-CA 3.4Å; H252-S271 PolarHBondContact CE1-OG 2.72Å; H252-S271 PolarHBondContact ND1-OG 3.28Å; S271-A273 PolarHBondContact OG-N 2.83Å; S271-G274 VanDerWaalsContact CB-O 3.31Å; S271-G274 WeakPolarHBondContact CB-O 3.25Å; S271-G274 PolarHBondContact OG-N 2.85Å; S271-G274 VanDerWaalsContact OG-N 3.12Å
272	T	89.2	Confident	93.9	Very high	98 Å²	98	52.7 Å²	52.7	60%	0.601	30%	0.296	S	S	*	.	S	Bend	trans	-89.6	-11.5	168.8	46.5	0	0	0	0	112.9	S251	S251-T272 PolarHBondContact O-N 2.82Å
273	A	87.1	Confident	94	Very high	66 Å²	66	51.6 Å²	51.6	55%	0.545	29%	0.286	S	S	.	.	S	Bend	trans	-111.3	-39.8	-174.3	0	0	0	0	0	113.5	I39 S271	I39-A273 WeakPolarHBondContact O-CB 3.38Å; S271-A273 PolarHBondContact OG-N 2.83Å
274	G	83.8	Confident	94	Very high	30 Å²	30	51.8 Å²	51.8	31%	0.309	29%	0.292	S	S	.	.	S	Bend	trans	-125.3	163.4	-169	0	0	0	0	0	113.8	S271	S271-G274 VanDerWaalsContact CB-O 3.31Å; S271-G274 WeakPolarHBondContact CB-O 3.25Å; S271-G274 PolarHBondContact OG-N 2.85Å; S271-G274 VanDerWaalsContact OG-N 3.12Å
275	M	91.2	Very high	93.8	Very high	166 Å²	166	57 Å²	57	82%	0.818	32%	0.318	S	S	*	.			trans	-76.9	154.9	170.8	-71	-168.5	-75.4	0	0	111.4	C277	M275-C277 PolarHBondContact O-N 2.95Å; M275-C277 VanDerWaalsContact O-N 3.12Å
276	P	93.6	Very high	93.7	Very high	81 Å²	81	53.9 Å²	53.9	53%	0.526	31%	0.312	S	S	.	.	S	Bend	trans	-54.6	118.2	174.8	-27.5	35.8	0	0	0	112.8	L268	L268-P276 VanDerWaalsContact O-CA 3.25Å; L268-P276 WeakPolarHBondContact O-CA 3.42Å; L268-P276 WeakPolarHBondContact O-CB 3.15Å
277	C	95.9	Very high	93.7	Very high	40 Å²	40	54 Å²	54	27%	0.27	31%	0.312	S	S	.	.			trans	-136	168.4	-176.9	68.3	0	0	0	0	111.3	A38 R267 L268 M275	A38-C277 VanDerWaalsContact CB-SG 3.59Å; R267-C277 WeakPolarHBondContact CD-O 3.34Å; R267-C277 VanDerWaalsContact NH1-C 3.31Å; L268-C277 PolarHBondContact N-O 3.44Å; M275-C277 PolarHBondContact O-N 2.95Å; M275-C277 VanDerWaalsContact O-N 3.12Å
278	T	96.3	Very high	93.6	Very high	77 Å²	77	49.6 Å²	49.6	47%	0.472	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.1	172.9	-56.3	0	0	0	0	108.7	Y265 I266 R267	Y265-T278 HydrophobicContact CD1-CG2 3.74Å; Y265-T278 HydrophobicContact CG-CG2 4.34Å; I266-T278 CarbonylContact O-C 3.54Å; I266-T278 WeakPolarHBondContact O-CA 3.48Å; R267-T278 WeakPolarHBondContact CD-OG1 3.41Å; R267-T278 PolarHBondContact NH1-OG1 2.93Å
279	I	95.5	Very high	93.6	Very high	9 Å²	9	52 Å²	52	5%	0.046	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	147.2	179.6	-60.5	139.1	0	0	0	108.5	L35 A38 Y265 I266	L35-I279 HydrophobicContact CB-CD1 4.41Å; L35-I279 HydrophobicContact CB-CG2 4.43Å; L35-I279 HydrophobicContact CD1-CD1 3.91Å; A38-I279 HydrophobicContact CB-CD1 3.67Å; A38-I279 HydrophobicContact CB-CG1 4.26Å; Y265-I279 CarbonylContact C-O 3.6Å; Y265-I279 WeakPolarHBondContact CA-O 3.39Å; I266-I279 HydrophobicContact CB-CB 4.34Å; I266-I279 PolarHBondContact N-O 2.8Å; I266-I279 PolarHBondContact O-N 2.77Å
280	L	95.5	Very high	93.6	Very high	41 Å²	41	50.8 Å²	50.8	22%	0.215	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118	173.2	-159	80.2	0	0	0	108.8	K259 T263 Y265 A291	K259-L280 HydrophobicContact CD-CD1 3.61Å; T263-L280 HydrophobicContact CG2-CD1 3.78Å; T263-L280 HydrophobicContact CG2-CD2 4Å; T263-L280 HydrophobicContact CG2-CG 3.68Å; Y265-L280 HydrophobicContact CD1-CD1 3.56Å; Y265-L280 HydrophobicContact CE1-CD1 3.31Å; Y265-L280 HydrophobicContact CG-CD1 4.44Å; L280-A291 HydrophobicContact CB-CB 4.13Å; L280-A291 HydrophobicContact CD2-CB 3.42Å; L280-A291 VanDerWaalsContact CD2-CB 3.42Å; L280-A291 HydrophobicContact CG-CB 3.55Å; L280-A291 PolarHBondContact O-N 3.31Å
281	M	94.9	Very high	93.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	152	175.4	70	-179.7	-72.1	0	0	109.9	F51 V256 T263 R264 I266 I283 V288 R289	F51-M281 HydrophobicContact CZ-SD 4.46Å; V256-M281 HydrophobicContact CG2-SD 4.26Å; T263-M281 CarbonylContact C-O 3.53Å; T263-M281 WeakPolarHBondContact CA-O 3.38Å; T263-M281 WeakPolarHBondContact CG2-O 3.33Å; R264-M281 HydrophobicContact CB-CG 3.59Å; R264-M281 HydrophobicContact CB-SD 3.82Å; R264-M281 HydrophobicContact CG-CG 4.29Å; R264-M281 HydrophobicContact CG-SD 4.26Å; R264-M281 PolarHBondContact N-O 3.36Å; R264-M281 PolarHBondContact O-N 2.96Å; I266-M281 HydrophobicContact CD1-CB 4.09Å; I266-M281 HydrophobicContact CD1-CG 3.93Å; I266-M281 HydrophobicContact CD1-SD 3.24Å; I266-M281 WeakPolarHBondContact CD1-SD 3.39Å; I266-M281 HydrophobicContact CG1-CG 4.08Å; I266-M281 HydrophobicContact CG1-SD 3.43Å; I266-M281 WeakPolarHBondContact CG1-SD 3.19Å; M281-I283 HydrophobicContact CE-CD1 3.74Å; M281-I283 HydrophobicContact CE-CG1 3.49Å; M281-I283 VanDerWaalsContact CE-CG1 3.49Å; M281-V288 HydrophobicContact CB-CG1 4.4Å; M281-V288 HydrophobicContact CE-CB 4.15Å; M281-V288 HydrophobicContact CE-CG1 3.43Å; M281-V288 VanDerWaalsContact CE-CG1 3.43Å; M281-V288 HydrophobicContact CE-CG2 3.68Å; M281-R289 CarbonylContact C-O 3.57Å; M281-R289 WeakPolarHBondContact CA-O 3.38Å
282	D	96	Very high	92.8	Very high	39 Å²	39	59.5 Å²	59.5	21%	0.209	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.4	166.2	-161.6	59.9	0	0	0	111	S262 T263 V288 R289 A291	S262-D282 WeakPolarHBondContact CB-OD1 3.31Å; S262-D282 PolarHBondContact OG-OD1 2.9Å; S262-D282 PolarHBondContact OG-OD2 3.37Å; T263-D282 PolarHBondContact N-OD1 3.17Å; T263-D282 PolarHBondContact OG1-OD1 2.77Å; D282-V288 WeakPolarHBondContact O-CA 3.31Å; D282-R289 PolarHBondContact N-O 3.11Å; D282-R289 PolarHBondContact O-N 2.75Å; D282-A291 HydrophobicContact CB-CB 4.07Å
283	I	95.6	Very high	92.9	Very high	26 Å²	26	57.6 Å²	57.6	13%	0.133	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	94.4	175.6	-55.8	179.1	0	0	0	107.5	Q61 S262 R264 M281	Q61-I283 HydrophobicContact CB-CG2 3.96Å; Q61-I283 HydrophobicContact CG-CG2 3.8Å; S262-I283 VanDerWaalsContact CB-O 3.3Å; S262-I283 WeakPolarHBondContact CB-O 3.36Å; S262-I283 PolarHBondContact O-N 3.26Å; R264-I283 HydrophobicContact CG-CD1 3.82Å; R264-I283 HydrophobicContact CG-CG1 4.34Å; M281-I283 HydrophobicContact CE-CD1 3.74Å; M281-I283 HydrophobicContact CE-CG1 3.49Å; M281-I283 VanDerWaalsContact CE-CG1 3.49Å
284	G	94.8	Very high	93.2	Very high	28 Å²	28	57.1 Å²	57.1	29%	0.289	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	-167.7	-177.9	0	0	0	0	0	112.8	R96 A286 G287	R96-G284 PolarHBondContact NH1-O 2.87Å; R96-G284 PolarHBondContact NH2-O 3.12Å; G284-A286 VanDerWaalsContact C-N 3.27Å; G284-A286 PolarHBondContact O-N 2.84Å; G284-G287 PolarHBondContact N-O 2.87Å; G284-G287 PolarHBondContact O-N 3.48Å; G284-G287 VanDerWaalsContact O-N 3.09Å
285	E	93.6	Very high	93.8	Very high	135 Å²	135	58.6 Å²	58.6	63%	0.631	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.3	177.7	-66.1	-171.1	170.5	0	0	112.4	R96 F103 G287	R96-E285 PolarHBondContact NH1-O 2.86Å; F103-E285 WeakPolarHBondContact CD2-O 3.23Å; F103-E285 HydrophobicContact CE2-CB 3.93Å; F103-E285 WeakPolarHBondContact CE2-O 3.35Å; F103-E285 HydrophobicContact CZ-CB 4.1Å; E285-G287 PolarHBondContact O-N 2.83Å; E285-G287 VanDerWaalsContact O-N 3.13Å
286	A	94.4	Very high	93.9	Very high	28 Å²	28	52.3 Å²	52.3	23%	0.231	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.5	176.3	0	0	0	0	0	114.8	F103 G284 R289	F103-A286 HydrophobicContact CB-CB 4.27Å; F103-A286 HydrophobicContact CD1-CB 3.94Å; F103-A286 HydrophobicContact CD2-CB 4.38Å; F103-A286 HydrophobicContact CE1-CB 4.34Å; F103-A286 HydrophobicContact CG-CB 3.96Å; G284-A286 VanDerWaalsContact C-N 3.27Å; G284-A286 PolarHBondContact O-N 2.84Å; A286-R289 VanDerWaalsContact O-CZ 3.26Å; A286-R289 PolarHBondContact O-NH1 2.89Å; A286-R289 PolarHBondContact O-NH2 2.85Å
287	G	95.4	Very high	93.9	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	102.7	-140.3	-174.2	0	0	0	0	0	111.8	G284 E285	G284-G287 PolarHBondContact N-O 2.87Å; G284-G287 PolarHBondContact O-N 3.48Å; G284-G287 VanDerWaalsContact O-N 3.09Å; E285-G287 PolarHBondContact O-N 2.83Å; E285-G287 VanDerWaalsContact O-N 3.13Å
288	V	95.6	Very high	93.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	125.3	178.6	174	0	0	0	0	109.7	Q61 L62 Q65 M281 D282	Q61-V288 HydrophobicContact CB-CG2 4.42Å; L62-V288 HydrophobicContact CB-CG2 4.3Å; L62-V288 HydrophobicContact CD1-CB 4.46Å; L62-V288 HydrophobicContact CD1-CG1 4.31Å; L62-V288 HydrophobicContact CD1-CG2 4.29Å; Q65-V288 HydrophobicContact CB-CB 4.4Å; Q65-V288 HydrophobicContact CB-CG2 4.31Å; Q65-V288 HydrophobicContact CG-CB 4.14Å; M281-V288 HydrophobicContact CB-CG1 4.4Å; M281-V288 HydrophobicContact CE-CB 4.15Å; M281-V288 HydrophobicContact CE-CG1 3.43Å; M281-V288 VanDerWaalsContact CE-CG1 3.43Å; M281-V288 HydrophobicContact CE-CG2 3.68Å; D282-V288 WeakPolarHBondContact O-CA 3.31Å
289	R	96.2	Very high	93.6	Very high	49 Å²	49	49.4 Å²	49.4	19%	0.185	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	170	178	-64.2	-62.8	-179.6	-79.9	-4.8	111.1	F31 M281 D282 A286	F31-R289 VanDerWaalsContact O-CD 3.25Å; F31-R289 WeakPolarHBondContact O-CD 3.29Å; M281-R289 CarbonylContact C-O 3.57Å; M281-R289 WeakPolarHBondContact CA-O 3.38Å; D282-R289 PolarHBondContact N-O 3.11Å; D282-R289 PolarHBondContact O-N 2.75Å; A286-R289 VanDerWaalsContact O-CZ 3.26Å; A286-R289 PolarHBondContact O-NH1 2.89Å; A286-R289 PolarHBondContact O-NH2 2.85Å
290	D	93.7	Very high	93.5	Very high	52 Å²	52	52.5 Å²	52.5	28%	0.278	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	138.2	165.7	-64.2	-81.7	0	0	0	110.4	C32 E33 S34	C32-D290 VanDerWaalsContact CA-OD2 3.23Å; C32-D290 WeakPolarHBondContact CA-OD2 3.09Å; C32-D290 PolarHBondContact SG-OD1 3.31Å; E33-D290 PolarHBondContact N-OD1 2.97Å; E33-D290 PolarHBondContact N-OD2 3.08Å; S34-D290 WeakPolarHBondContact CB-OD1 3.43Å; S34-D290 PolarHBondContact N-OD1 3.08Å; S34-D290 PolarHBondContact OG-OD1 3.12Å
291	A	90.7	Very high	93.3	Very high	21 Å²	21	53.4 Å²	53.4	17%	0.174	28%	0.28	C	S	.	.			trans	-84	136.1	171.5	0	0	0	0	0	110.2	T263 L280 D282	T263-A291 HydrophobicContact CG2-CB 3.81Å; L280-A291 HydrophobicContact CB-CB 4.13Å; L280-A291 HydrophobicContact CD2-CB 3.42Å; L280-A291 VanDerWaalsContact CD2-CB 3.42Å; L280-A291 HydrophobicContact CG-CB 3.55Å; L280-A291 PolarHBondContact O-N 3.31Å; D282-A291 HydrophobicContact CB-CB 4.07Å
292	Q	79.1	Confident	93.2	Very high	262 Å²	262	58.3 Å²	58.3	100%	1.224	31%	0.306	S	S	*	.			trans	-70.8	0	173.6	-64.1	-172.9	-11.3	0	0	112.5

Retrieved 292 of 292 residues in 503.7 ms (Link to these results)

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