A0A096MGL2_POEFO Loading...

Xyloside xylosyltransferase 1

AlphaFold DB , UniProt , Accession A0A096MGL2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 402 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	55.2	Low	54.1	Low	224 Å²	224	126.5 Å²	126.5	100%	1.103	66%	0.659	S	S	*	*				0	8.3	0	-78.8	-79.3	-99.7	0	0	114.7
2	G	54.4	Low	53.7	Low	59 Å²	59	119.7 Å²	119.7	61%	0.608	64%	0.642	S	S	*	*			trans	-99.7	-29.2	178.9	0	0	0	0	0	115.7
3	F	52.7	Low	53.3	Low	176 Å²	176	126.4 Å²	126.4	77%	0.772	65%	0.653	S	S	*	*	H	α-helix	trans	-76.3	-35	-175	-121.8	-96	0	0	0	113.4	V5 L6 V7	F3-V5 VanDerWaalsContact C-N 3.34Å; F3-V5 PolarHBondContact O-N 2.63Å; F3-L6 PolarHBondContact O-N 2.83Å; F3-V7 PolarHBondContact O-N 3.36Å
4	L	50.9	Low	53.2	Low	142 Å²	142	126 Å²	126	74%	0.743	65%	0.651	S	S	*	*	H	α-helix	trans	-69.2	-31.9	-179.5	-139.4	84.4	0	0	0	112.4	V8	L4-V8 VanDerWaalsContact O-CG2 3.3Å; L4-V8 WeakPolarHBondContact O-CG2 3.46Å; L4-V8 PolarHBondContact O-N 2.73Å
5	V	54.8	Low	53	Low	84 Å²	84	124.7 Å²	124.7	51%	0.509	66%	0.657	S	S	.	*	H	α-helix	trans	-74.3	-30	179.9	179.6	0	0	0	0	111.7	F3 R9	F3-V5 VanDerWaalsContact C-N 3.34Å; F3-V5 PolarHBondContact O-N 2.63Å; V5-R9 PolarHBondContact O-N 2.73Å
6	L	54.3	Low	53.1	Low	104 Å²	104	123.4 Å²	123.4	55%	0.545	66%	0.655	S	S	.	*	H	α-helix	trans	-72.9	-41.1	178.1	-161.6	76.4	0	0	0	111.7	F3 R9 I10	F3-L6 PolarHBondContact O-N 2.83Å; L6-R9 PolarHBondContact O-N 3.24Å; L6-I10 HydrophobicContact CG-CD1 4.38Å; L6-I10 WeakPolarHBondContact O-CG1 3.25Å; L6-I10 PolarHBondContact O-N 3.29Å; L6-I10 VanDerWaalsContact O-N 3.13Å
7	V	57.9	Low	53.1	Low	77 Å²	77	123 Å²	123	47%	0.467	65%	0.647	S	S	.	*	H	α-helix	trans	-67.6	-40.1	178.6	178.4	0	0	0	0	111.2	F3 R9 I10 M11	F3-V7 PolarHBondContact O-N 3.36Å; V7-R9 PolarHBondContact O-N 3Å; V7-I10 PolarHBondContact O-N 2.8Å; V7-M11 HydrophobicContact CG1-SD 4.28Å; V7-M11 WeakPolarHBondContact O-CG 3.21Å; V7-M11 PolarHBondContact O-N 3.06Å
8	V	57.2	Low	53.8	Low	101 Å²	101	127.4 Å²	127.4	61%	0.612	65%	0.654	S	S	*	*	H	α-helix	trans	-66.6	-34.7	176.9	174	0	0	0	0	112.1	L4 G12	L4-V8 VanDerWaalsContact O-CG2 3.3Å; L4-V8 WeakPolarHBondContact O-CG2 3.46Å; L4-V8 PolarHBondContact O-N 2.73Å; V8-G12 PolarHBondContact O-N 3.16Å
9	R	52.9	Low	54.2	Low	192 Å²	192	125.8 Å²	125.8	73%	0.725	66%	0.655	S	S	*	*	H	α-helix	trans	-71.8	-31.2	174.9	-84.2	-176.4	173.7	-179.3	-0.7	113.8	V5 L6 V7 R13	V5-R9 PolarHBondContact O-N 2.73Å; L6-R9 PolarHBondContact O-N 3.24Å; V7-R9 PolarHBondContact O-N 3Å; R9-R13 PolarHBondContact O-N 3.48Å
10	I	54.8	Low	54.7	Low	101 Å²	101	127.4 Å²	127.4	52%	0.518	65%	0.653	S	S	.	*	H	α-helix	trans	-74.8	-42.6	175.5	-66.7	168.2	0	0	0	110.2	L6 V7 G12 R13 I14	L6-I10 HydrophobicContact CG-CD1 4.38Å; L6-I10 WeakPolarHBondContact O-CG1 3.25Å; L6-I10 PolarHBondContact O-N 3.29Å; L6-I10 VanDerWaalsContact O-N 3.13Å; V7-I10 PolarHBondContact O-N 2.8Å; I10-G12 VanDerWaalsContact C-N 3.32Å; I10-G12 PolarHBondContact O-N 3.5Å; I10-R13 PolarHBondContact O-N 3.01Å; I10-I14 HydrophobicContact CG2-CD1 4.39Å; I10-I14 PolarHBondContact O-N 3.08Å
11	M	50	Low	55.5	Low	132 Å²	132	125.8 Å²	125.8	65%	0.65	64%	0.642	S	S	*	*	H	α-helix	trans	-67.2	-30.7	176.1	-70	-171.9	74.8	0	0	112.9	V7 I14	V7-M11 HydrophobicContact CG1-SD 4.28Å; V7-M11 WeakPolarHBondContact O-CG 3.21Å; V7-M11 PolarHBondContact O-N 3.06Å; M11-I14 PolarHBondContact O-N 2.88Å
12	G	49.2	Very low	56.2	Low	44 Å²	44	121.5 Å²	121.5	45%	0.454	62%	0.618	S	S	.	*	H	α-helix	trans	-69.6	-26.5	174	0	0	0	0	0	114.6	V8 I10	V8-G12 PolarHBondContact O-N 3.16Å; I10-G12 VanDerWaalsContact C-N 3.32Å; I10-G12 PolarHBondContact O-N 3.5Å
13	R	48.9	Very low	57.1	Low	207 Å²	207	124 Å²	124	78%	0.781	62%	0.617	S	S	*	*	H	α-helix	trans	-81.4	-21.9	175.9	-98.6	-176.7	173.2	178.6	-2	113.7	R9 I10 T16	R9-R13 PolarHBondContact O-N 3.48Å; I10-R13 PolarHBondContact O-N 3.01Å; R13-T16 PolarHBondContact O-OG1 3.43Å
14	I	51.4	Low	58.2	Low	121 Å²	121	119.8 Å²	119.8	62%	0.621	60%	0.602	S	S	*	*	H	α-helix	trans	-79.7	-23.4	176.2	-63	168.6	0	0	0	111.1	I10 M11 T16	I10-I14 HydrophobicContact CG2-CD1 4.39Å; I10-I14 PolarHBondContact O-N 3.08Å; M11-I14 PolarHBondContact O-N 2.88Å; I14-T16 VanDerWaalsContact C-N 3.25Å; I14-T16 PolarHBondContact O-N 2.84Å
15	S	50.9	Low	59.4	Low	106 Å²	106	117.8 Å²	117.8	74%	0.741	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	2.2	179.8	-155.1	0	0	0	0	115
16	T	53.7	Low	60.5	Low	104 Å²	104	117.8 Å²	117.8	64%	0.638	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	8	177.5	46.4	0	0	0	0	114.1	R13 I14 R18	R13-T16 PolarHBondContact O-OG1 3.43Å; I14-T16 VanDerWaalsContact C-N 3.25Å; I14-T16 PolarHBondContact O-N 2.84Å; T16-R18 PolarHBondContact O-N 2.79Å; T16-R18 VanDerWaalsContact O-N 3.13Å
17	F	53.2	Low	61.8	Low	117 Å²	117	115.6 Å²	115.6	51%	0.513	59%	0.585	S	S	.	*	S	Bend	trans	-76.6	99	162.6	-99.2	-93.8	0	0	0	108.3	S19 Q21	F17-S19 PolarHBondContact O-N 3.4Å; F17-Q21 HydrophobicContact CD1-CB 4.02Å; F17-Q21 HydrophobicContact CE1-CB 4.37Å
18	R	66.5	Low	62.6	Low	203 Å²	203	114.5 Å²	114.5	77%	0.766	58%	0.584	S	S	*	*			trans	-55.5	130.8	171.8	-71.6	-176.9	174.8	-178.8	-1.5	107.6	T16 Y20 Q21	T16-R18 PolarHBondContact O-N 2.79Å; T16-R18 VanDerWaalsContact O-N 3.13Å; R18-Y20 PolarHBondContact O-N 3.5Å; R18-Q21 WeakPolarHBondContact O-CB 3.36Å; R18-Q21 PolarHBondContact O-N 3.11Å
19	S	61.3	Low	63.6	Low	96 Å²	96	113.2 Å²	113.2	67%	0.671	58%	0.576	S	S	*	*	H	α-helix	trans	-45.2	-31.2	-179.3	53.1	0	0	0	0	114	F17 Q21 F22 L23	F17-S19 PolarHBondContact O-N 3.4Å; S19-Q21 PolarHBondContact O-N 3Å; S19-F22 PolarHBondContact O-N 3.25Å; S19-L23 PolarHBondContact O-N 3.34Å; S19-L23 VanDerWaalsContact O-N 3.1Å
20	Y	64.2	Low	64.8	Low	157 Å²	157	110.2 Å²	110.2	62%	0.616	57%	0.569	S	S	*	*	H	α-helix	trans	-63.6	-33.5	175.2	-171.2	-105.8	0	0	0	114.9	R18 F22 L23 L24	R18-Y20 PolarHBondContact O-N 3.5Å; Y20-F22 VanDerWaalsContact C-N 3.34Å; Y20-L23 PolarHBondContact O-N 2.8Å; Y20-L24 HydrophobicContact CD1-CD1 3.66Å; Y20-L24 HydrophobicContact CD1-CG 4.31Å; Y20-L24 HydrophobicContact CE1-CD1 3.31Å; Y20-L24 HydrophobicContact CE1-CG 3.91Å; Y20-L24 WeakPolarHBondContact O-CB 3.25Å; Y20-L24 PolarHBondContact O-N 3.31Å
21	Q	70.3	Confident	65.7	Low	94 Å²	94	108.3 Å²	108.3	44%	0.439	57%	0.568	S	S	.	*	H	α-helix	trans	-70.1	-33.1	175.9	-71.6	-179.9	-37.4	0	0	111.8	F17 R18 S19 L24 L25	F17-Q21 HydrophobicContact CD1-CB 4.02Å; F17-Q21 HydrophobicContact CE1-CB 4.37Å; R18-Q21 WeakPolarHBondContact O-CB 3.36Å; R18-Q21 PolarHBondContact O-N 3.11Å; S19-Q21 PolarHBondContact O-N 3Å; Q21-L24 PolarHBondContact O-N 3.08Å; Q21-L25 PolarHBondContact O-N 2.85Å
22	F	71.6	Confident	66.7	Low	134 Å²	134	106.6 Å²	106.6	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-69.8	-40.9	173.7	-129.6	-86.9	0	0	0	111.3	S19 Y20 L25 L26	S19-F22 PolarHBondContact O-N 3.25Å; Y20-F22 VanDerWaalsContact C-N 3.34Å; F22-L25 PolarHBondContact O-N 3.09Å; F22-L26 HydrophobicContact CD1-CD1 4.24Å; F22-L26 WeakPolarHBondContact O-CB 3.23Å; F22-L26 PolarHBondContact O-N 3.43Å
23	L	72.9	Confident	67.7	Low	111 Å²	111	108.6 Å²	108.6	58%	0.581	56%	0.564	S	S	*	*	H	α-helix	trans	-62.2	-40.3	172.8	-80.9	158.6	0	0	0	112.3	S19 Y20 L26 A27	S19-L23 PolarHBondContact O-N 3.34Å; S19-L23 VanDerWaalsContact O-N 3.1Å; Y20-L23 PolarHBondContact O-N 2.8Å; L23-L26 PolarHBondContact O-N 3.08Å; L23-A27 VanDerWaalsContact O-CB 3.29Å; L23-A27 WeakPolarHBondContact O-CB 3.39Å; L23-A27 PolarHBondContact O-N 2.84Å
24	L	75.8	Confident	68.7	Low	88 Å²	88	100.7 Å²	100.7	46%	0.461	54%	0.543	S	S	.	.	H	α-helix	trans	-65	-41.5	175	-86.8	167	0	0	0	112.6	Y20 Q21 A27 A28	Y20-L24 HydrophobicContact CD1-CD1 3.66Å; Y20-L24 HydrophobicContact CD1-CG 4.31Å; Y20-L24 HydrophobicContact CE1-CD1 3.31Å; Y20-L24 HydrophobicContact CE1-CG 3.91Å; Y20-L24 WeakPolarHBondContact O-CB 3.25Å; Y20-L24 PolarHBondContact O-N 3.31Å; Q21-L24 PolarHBondContact O-N 3.08Å; L24-A27 PolarHBondContact O-N 3.04Å; L24-A28 WeakPolarHBondContact O-CB 3.43Å; L24-A28 PolarHBondContact O-N 3.06Å
25	L	75.9	Confident	69.4	Low	101 Å²	101	102.6 Å²	102.6	53%	0.529	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-42.7	174.9	-96.5	151.6	0	0	0	111.5	Q21 F22 A28 T29	Q21-L25 PolarHBondContact O-N 2.85Å; F22-L25 PolarHBondContact O-N 3.09Å; L25-A28 PolarHBondContact O-N 3.43Å; L25-T29 WeakPolarHBondContact O-CB 3.43Å; L25-T29 PolarHBondContact O-N 3.46Å; L25-T29 PolarHBondContact O-OG1 3.17Å
26	L	78.1	Confident	69.7	Low	84 Å²	84	106.3 Å²	106.3	44%	0.44	55%	0.547	S	S	.	.	H	α-helix	trans	-63	-45.4	174.1	-101.5	147.3	0	0	0	111.7	F22 L23 A28 T29 F30	F22-L26 HydrophobicContact CD1-CD1 4.24Å; F22-L26 WeakPolarHBondContact O-CB 3.23Å; F22-L26 PolarHBondContact O-N 3.43Å; L23-L26 PolarHBondContact O-N 3.08Å; L26-A28 PolarHBondContact O-N 3.44Å; L26-T29 PolarHBondContact O-N 2.74Å; L26-F30 HydrophobicContact CD2-CD2 4.05Å; L26-F30 HydrophobicContact CD2-CE2 3.52Å; L26-F30 HydrophobicContact CD2-CZ 4.46Å; L26-F30 WeakPolarHBondContact O-CB 3.42Å; L26-F30 WeakPolarHBondContact O-CD2 3.43Å; L26-F30 PolarHBondContact O-N 2.76Å
27	A	80.3	Confident	69.8	Low	57 Å²	57	110 Å²	110	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-62.4	-41.9	176.8	0	0	0	0	0	112.1	L23 L24 T29 F30 A31	L23-A27 VanDerWaalsContact O-CB 3.29Å; L23-A27 WeakPolarHBondContact O-CB 3.39Å; L23-A27 PolarHBondContact O-N 2.84Å; L24-A27 PolarHBondContact O-N 3.04Å; A27-T29 VanDerWaalsContact C-N 3.35Å; A27-F30 PolarHBondContact O-N 2.71Å; A27-A31 VanDerWaalsContact O-CB 3.32Å; A27-A31 WeakPolarHBondContact O-CB 3.45Å; A27-A31 PolarHBondContact O-N 3.25Å
28	A	74.5	Confident	70	Confident	55 Å²	55	112.3 Å²	112.3	46%	0.455	56%	0.56	S	S	.	*	H	α-helix	trans	-64.3	-40.2	174.6	0	0	0	0	0	111.7	L24 L25 L26 A31 V32	L24-A28 WeakPolarHBondContact O-CB 3.43Å; L24-A28 PolarHBondContact O-N 3.06Å; L25-A28 PolarHBondContact O-N 3.43Å; L26-A28 PolarHBondContact O-N 3.44Å; A28-A31 PolarHBondContact O-N 3.32Å; A28-V32 VanDerWaalsContact O-CG2 3.31Å; A28-V32 WeakPolarHBondContact O-CG2 3.48Å; A28-V32 PolarHBondContact O-N 3.17Å
29	T	79.3	Confident	69	Low	73 Å²	73	105.2 Å²	105.2	45%	0.448	55%	0.55	S	S	.	*	H	α-helix	trans	-65.8	-44.2	177	-51	0	0	0	0	110.8	L25 L26 A27 A31 V32 I33	L25-T29 WeakPolarHBondContact O-CB 3.43Å; L25-T29 PolarHBondContact O-N 3.46Å; L25-T29 PolarHBondContact O-OG1 3.17Å; L26-T29 PolarHBondContact O-N 2.74Å; A27-T29 VanDerWaalsContact C-N 3.35Å; T29-A31 VanDerWaalsContact C-N 3.35Å; T29-A31 PolarHBondContact O-N 3.29Å; T29-V32 PolarHBondContact O-N 3.14Å; T29-I33 HydrophobicContact CG2-CD1 4.01Å; T29-I33 WeakPolarHBondContact O-CB 3.44Å; T29-I33 VanDerWaalsContact O-CG1 3.24Å; T29-I33 WeakPolarHBondContact O-CG1 3.3Å; T29-I33 PolarHBondContact O-N 3.42Å
30	F	78.9	Confident	68.3	Low	130 Å²	130	104.2 Å²	104.2	57%	0.57	54%	0.543	S	S	*	.	H	α-helix	trans	-65.2	-35.7	174.5	-83.2	-64.5	0	0	0	112.7	L26 A27 I33 A34	L26-F30 HydrophobicContact CD2-CD2 4.05Å; L26-F30 HydrophobicContact CD2-CE2 3.52Å; L26-F30 HydrophobicContact CD2-CZ 4.46Å; L26-F30 WeakPolarHBondContact O-CB 3.42Å; L26-F30 WeakPolarHBondContact O-CD2 3.43Å; L26-F30 PolarHBondContact O-N 2.76Å; A27-F30 PolarHBondContact O-N 2.71Å; F30-I33 PolarHBondContact O-N 3.14Å; F30-A34 WeakPolarHBondContact O-CB 3.47Å; F30-A34 PolarHBondContact O-N 2.68Å
31	A	73.4	Confident	67.3	Low	61 Å²	61	104.9 Å²	104.9	50%	0.504	55%	0.552	S	S	.	*	H	α-helix	trans	-66.8	-39.5	174.6	0	0	0	0	0	112	A27 A28 T29 A34 F35	A27-A31 VanDerWaalsContact O-CB 3.32Å; A27-A31 WeakPolarHBondContact O-CB 3.45Å; A27-A31 PolarHBondContact O-N 3.25Å; A28-A31 PolarHBondContact O-N 3.32Å; T29-A31 VanDerWaalsContact C-N 3.35Å; T29-A31 PolarHBondContact O-N 3.29Å; A31-A34 PolarHBondContact O-N 3.06Å; A31-F35 VanDerWaalsContact O-CB 3.28Å; A31-F35 WeakPolarHBondContact O-CB 3.47Å; A31-F35 PolarHBondContact O-N 2.04Å
32	V	70.2	Confident	66.2	Low	95 Å²	95	111 Å²	111	58%	0.576	57%	0.571	S	S	*	*	H	α-helix	trans	-66.2	-43.4	173.9	171.3	0	0	0	0	110.9	A28 T29 F35 Y36	A28-V32 VanDerWaalsContact O-CG2 3.31Å; A28-V32 WeakPolarHBondContact O-CG2 3.48Å; A28-V32 PolarHBondContact O-N 3.17Å; T29-V32 PolarHBondContact O-N 3.14Å; V32-F35 PolarHBondContact O-N 3.04Å; V32-Y36 PolarHBondContact O-N 2.96Å
33	I	71.3	Confident	65	Low	87 Å²	87	112 Å²	112	45%	0.446	58%	0.577	S	S	.	*	H	α-helix	trans	-62.9	-45.9	176	-68.4	166.7	0	0	0	110.1	T29 F30 F35 Y36 Y37	T29-I33 HydrophobicContact CG2-CD1 4.01Å; T29-I33 WeakPolarHBondContact O-CB 3.44Å; T29-I33 VanDerWaalsContact O-CG1 3.24Å; T29-I33 WeakPolarHBondContact O-CG1 3.3Å; T29-I33 PolarHBondContact O-N 3.42Å; F30-I33 PolarHBondContact O-N 3.14Å; I33-F35 PolarHBondContact O-N 3.25Å; I33-Y36 PolarHBondContact O-N 3.21Å; I33-Y36 VanDerWaalsContact O-N 3.14Å; I33-Y37 WeakPolarHBondContact O-CB 3.13Å; I33-Y37 PolarHBondContact O-N 3.42Å
34	A	68.1	Low	63.3	Low	41 Å²	41	109.6 Å²	109.6	34%	0.339	57%	0.57	S	S	.	*	H	α-helix	trans	-64.6	-38.3	177.5	0	0	0	0	0	112	F30 A31 Y36 Y37 F38	F30-A34 WeakPolarHBondContact O-CB 3.47Å; F30-A34 PolarHBondContact O-N 2.68Å; A31-A34 PolarHBondContact O-N 3.06Å; A34-Y36 VanDerWaalsContact C-N 3.3Å; A34-Y36 PolarHBondContact O-N 3.21Å; A34-Y37 PolarHBondContact O-N 3.03Å; A34-F38 HydrophobicContact CB-CD2 4.21Å; A34-F38 WeakPolarHBondContact O-CA 3.42Å; A34-F38 VanDerWaalsContact O-CB 3.29Å; A34-F38 WeakPolarHBondContact O-CB 3.27Å; A34-F38 PolarHBondContact O-N 3.45Å
35	F	66.6	Low	61.6	Low	160 Å²	160	110.8 Å²	110.8	70%	0.702	57%	0.571	S	S	*	*	H	α-helix	trans	-62.2	-38.4	172.4	-177	-95.1	0	0	0	111.6	A31 V32 I33 G39	A31-F35 VanDerWaalsContact O-CB 3.28Å; A31-F35 WeakPolarHBondContact O-CB 3.47Å; A31-F35 PolarHBondContact O-N 2.04Å; V32-F35 PolarHBondContact O-N 3.04Å; I33-F35 PolarHBondContact O-N 3.25Å; F35-G39 WeakPolarHBondContact O-CA 3.47Å; F35-G39 PolarHBondContact O-N 3.14Å
36	Y	57.9	Low	59.9	Low	185 Å²	185	109.9 Å²	109.9	73%	0.725	57%	0.573	S	S	*	*	H	α-helix	trans	-74.5	-37.2	178.1	-130.4	-92.7	0	0	0	113	V32 I33 A34 S40	V32-Y36 PolarHBondContact O-N 2.96Å; I33-Y36 PolarHBondContact O-N 3.21Å; I33-Y36 VanDerWaalsContact O-N 3.14Å; A34-Y36 VanDerWaalsContact C-N 3.3Å; A34-Y36 PolarHBondContact O-N 3.21Å; Y36-S40 VanDerWaalsContact O-CB 3.32Å; Y36-S40 WeakPolarHBondContact O-CB 3.35Å; Y36-S40 PolarHBondContact O-OG 3.2Å
37	Y	55.8	Low	58.1	Low	181 Å²	181	108 Å²	108	71%	0.71	57%	0.568	S	S	*	*	H	α-helix	trans	-86.4	-40.6	-175.9	-119.5	-93	0	0	0	113.2	I33 A34 S40	I33-Y37 WeakPolarHBondContact O-CB 3.13Å; I33-Y37 PolarHBondContact O-N 3.42Å; A34-Y37 PolarHBondContact O-N 3.03Å; Y37-S40 PolarHBondContact O-OG 3.4Å
38	F	57.6	Low	56.1	Low	166 Å²	166	107.5 Å²	107.5	73%	0.728	56%	0.559	S	S	*	*	H	α-helix	trans	-98.3	-25.8	-180	-67.6	-79.8	0	0	0	113.2	A34 S40	A34-F38 HydrophobicContact CB-CD2 4.21Å; A34-F38 WeakPolarHBondContact O-CA 3.42Å; A34-F38 VanDerWaalsContact O-CB 3.29Å; A34-F38 WeakPolarHBondContact O-CB 3.27Å; A34-F38 PolarHBondContact O-N 3.45Å; F38-S40 PolarHBondContact O-N 2.99Å
39	G	45.2	Very low	54.5	Low	54 Å²	54	106.6 Å²	106.6	56%	0.557	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-4.8	174.5	0	0	0	0	0	114.2	F35	F35-G39 WeakPolarHBondContact O-CA 3.47Å; F35-G39 PolarHBondContact O-N 3.14Å
40	S	45.8	Very low	52.5	Low	75 Å²	75	109.2 Å²	109.2	52%	0.524	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.1	0.1	180	59.4	0	0	0	0	114.9	Y36 Y37 F38 R42	Y36-S40 VanDerWaalsContact O-CB 3.32Å; Y36-S40 WeakPolarHBondContact O-CB 3.35Å; Y36-S40 PolarHBondContact O-OG 3.2Å; Y37-S40 PolarHBondContact O-OG 3.4Å; F38-S40 PolarHBondContact O-N 2.99Å; S40-R42 PolarHBondContact O-N 3.14Å
41	E	43.5	Very low	50.9	Low	170 Å²	170	110.9 Å²	110.9	79%	0.794	56%	0.555	S	S	*	*	S	Bend	trans	-81.6	17.8	176.1	-73.9	-153.8	153.4	0	0	115.2
42	R	47.2	Very low	49.7	Very low	224 Å²	224	108.8 Å²	108.8	85%	0.845	54%	0.535	S	S	*	.	S	Bend	trans	-128.5	118.3	159.1	-69.6	-172.2	-179.5	-174.2	0.5	108.5	S40 S44	S40-R42 PolarHBondContact O-N 3.14Å; R42-S44 PolarHBondContact O-N 3.47Å
43	H	46.3	Very low	48.3	Very low	153 Å²	153	113 Å²	113	71%	0.708	54%	0.541	S	S	*	.			trans	-33.3	101.4	-179.3	-68.9	-82.7	0	0	0	112.5
44	S	37.7	Very low	46.7	Very low	62 Å²	62	114.3 Å²	114.3	43%	0.434	55%	0.545	S	S	.	.			trans	-78.8	142.5	177.5	68.4	0	0	0	0	109.9	R42 S46 S47 T48	R42-S44 PolarHBondContact O-N 3.47Å; S44-S46 PolarHBondContact O-N 2.88Å; S44-S47 PolarHBondContact O-N 2.84Å; S44-S47 PolarHBondContact O-OG 2.89Å; S44-T48 PolarHBondContact O-N 2.92Å
45	F	39.1	Very low	45.3	Very low	113 Å²	113	115 Å²	115	50%	0.496	55%	0.546	S	S	.	.	H	α-helix	trans	-43.5	-33.3	175.7	177.7	-98.8	0	0	0	113.6	T49 W275	F45-T49 WeakPolarHBondContact O-CB 3.26Å; F45-T49 PolarHBondContact O-N 2.72Å; F45-T49 PolarHBondContact O-OG1 3.05Å; F45-W275 HydrophobicContact CE2-CD2 4.23Å; F45-W275 HydrophobicContact CE2-CE3 4.03Å; F45-W275 HydrophobicContact CE2-CZ3 4.2Å; F45-W275 HydrophobicContact CZ-CE3 4.29Å; F45-W275 HydrophobicContact CZ-CH2 4.5Å; F45-W275 HydrophobicContact CZ-CZ3 4.08Å
46	S	42	Very low	44.2	Very low	81 Å²	81	111.3 Å²	111.3	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-67.6	-38.8	177.3	-173.6	0	0	0	0	113.2	S44 K50	S44-S46 PolarHBondContact O-N 2.88Å; S46-K50 WeakPolarHBondContact O-CB 3.29Å; S46-K50 PolarHBondContact O-N 3.38Å
47	S	38.8	Very low	43.1	Very low	46 Å²	46	105.3 Å²	105.3	32%	0.322	52%	0.519	S	S	.	.	H	α-helix	trans	-77.3	-35.8	-178.9	64.1	0	0	0	0	112.5	S44 R51	S44-S47 PolarHBondContact O-N 2.84Å; S44-S47 PolarHBondContact O-OG 2.89Å; S47-R51 WeakPolarHBondContact O-CB 3.27Å; S47-R51 WeakPolarHBondContact O-CG 3.31Å; S47-R51 PolarHBondContact O-N 2.89Å
48	T	37.9	Very low	41.9	Very low	46 Å²	46	101.5 Å²	101.5	28%	0.282	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-46.3	172.5	-50	0	0	0	0	111.1	S44 K50 R51 I52	S44-T48 PolarHBondContact O-N 2.92Å; T48-K50 VanDerWaalsContact C-N 3.32Å; T48-K50 PolarHBondContact O-N 3.37Å; T48-R51 PolarHBondContact O-N 3.02Å; T48-I52 HydrophobicContact CG2-CD1 4.07Å; T48-I52 VanDerWaalsContact O-CG1 3.25Å; T48-I52 WeakPolarHBondContact O-CG1 3.2Å; T48-I52 PolarHBondContact O-N 2.95Å
49	T	41.2	Very low	40.9	Very low	36 Å²	36	96.7 Å²	96.7	22%	0.221	50%	0.495	C	S	.	.	H	α-helix	trans	-65.4	-34.1	175.3	-60.4	0	0	0	0	112.1	F45 I52 R53	F45-T49 WeakPolarHBondContact O-CB 3.26Å; F45-T49 PolarHBondContact O-N 2.72Å; F45-T49 PolarHBondContact O-OG1 3.05Å; T49-I52 PolarHBondContact O-N 2.87Å; T49-R53 WeakPolarHBondContact O-CB 3.29Å; T49-R53 WeakPolarHBondContact O-CG 3.43Å; T49-R53 PolarHBondContact O-N 3.28Å
50	K	37.7	Very low	40.3	Very low	127 Å²	127	99.3 Å²	99.3	55%	0.552	50%	0.496	S	S	*	.	H	α-helix	trans	-71.3	-37.6	174.6	-169	175.4	-175.8	-178.6	0	112	S46 T48 R53 Q54	S46-K50 WeakPolarHBondContact O-CB 3.29Å; S46-K50 PolarHBondContact O-N 3.38Å; T48-K50 VanDerWaalsContact C-N 3.32Å; T48-K50 PolarHBondContact O-N 3.37Å; K50-R53 PolarHBondContact O-N 2.94Å; K50-Q54 WeakPolarHBondContact O-CB 3.4Å; K50-Q54 VanDerWaalsContact O-CG 3.27Å; K50-Q54 WeakPolarHBondContact O-CG 3.41Å; K50-Q54 PolarHBondContact O-N 2.94Å
51	R	44.7	Very low	39.6	Very low	165 Å²	165	105 Å²	105	62%	0.623	51%	0.506	S	S	*	.	H	α-helix	trans	-64.3	-45.5	169.3	-81.6	-177.2	-176.6	175.4	1.4	111.4	S47 T48 R53 Q54 T55	S47-R51 WeakPolarHBondContact O-CB 3.27Å; S47-R51 WeakPolarHBondContact O-CG 3.31Å; S47-R51 PolarHBondContact O-N 2.89Å; T48-R51 PolarHBondContact O-N 3.02Å; R51-R53 VanDerWaalsContact C-N 3.34Å; R51-R53 PolarHBondContact O-N 3.29Å; R51-Q54 PolarHBondContact O-N 3.28Å; R51-T55 WeakPolarHBondContact O-CB 3.36Å; R51-T55 PolarHBondContact O-N 3.46Å; R51-T55 PolarHBondContact O-OG1 3.42Å
52	I	49.2	Very low	38.9	Very low	18 Å²	18	104 Å²	104	9%	0.092	51%	0.506	C	S	.	.	H	α-helix	trans	-58.4	-45.9	175.4	-68.5	165.3	0	0	0	110.5	T48 T49 Q54 Q56 W368	T48-I52 HydrophobicContact CG2-CD1 4.07Å; T48-I52 VanDerWaalsContact O-CG1 3.25Å; T48-I52 WeakPolarHBondContact O-CG1 3.2Å; T48-I52 PolarHBondContact O-N 2.95Å; T49-I52 PolarHBondContact O-N 2.87Å; I52-Q54 PolarHBondContact O-N 3.47Å; I52-Q56 HydrophobicContact CG2-CG 4.41Å; I52-Q56 WeakPolarHBondContact O-CB 3.29Å; I52-Q56 VanDerWaalsContact O-CG 3.29Å; I52-Q56 WeakPolarHBondContact O-CG 3.02Å; I52-Q56 PolarHBondContact O-N 2.94Å; I52-W368 HydrophobicContact CG1-CH2 4.23Å; I52-W368 HydrophobicContact CG2-CH2 4.24Å
53	R	40.9	Very low	38.3	Very low	182 Å²	182	97.2 Å²	97.2	69%	0.687	49%	0.487	S	S	*	.	H	α-helix	trans	-62.2	-40.5	174.8	-78.3	-177.7	178.1	-170.9	-0.4	113.3	T49 K50 R51 A57	T49-R53 WeakPolarHBondContact O-CB 3.29Å; T49-R53 WeakPolarHBondContact O-CG 3.43Å; T49-R53 PolarHBondContact O-N 3.28Å; K50-R53 PolarHBondContact O-N 2.94Å; R51-R53 VanDerWaalsContact C-N 3.34Å; R51-R53 PolarHBondContact O-N 3.29Å; R53-A57 WeakPolarHBondContact O-CB 3.27Å; R53-A57 PolarHBondContact O-N 3.05Å
54	Q	36.7	Very low	37.6	Very low	115 Å²	115	93.8 Å²	93.8	54%	0.537	49%	0.485	S	S	.	.	H	α-helix	trans	-75.4	-37	-179.5	-76.8	177	-31.8	0	0	112.5	K50 R51 I52 N58	K50-Q54 WeakPolarHBondContact O-CB 3.4Å; K50-Q54 VanDerWaalsContact O-CG 3.27Å; K50-Q54 WeakPolarHBondContact O-CG 3.41Å; K50-Q54 PolarHBondContact O-N 2.94Å; R51-Q54 PolarHBondContact O-N 3.28Å; I52-Q54 PolarHBondContact O-N 3.47Å; Q54-N58 PolarHBondContact O-N 3.48Å
55	T	40	Very low	37.2	Very low	57 Å²	57	96.5 Å²	96.5	35%	0.35	50%	0.495	S	S	.	.	H	α-helix	trans	-69.2	-44.7	173.6	-51.4	0	0	0	0	109.7	R51 A57 N58 T59	R51-T55 WeakPolarHBondContact O-CB 3.36Å; R51-T55 PolarHBondContact O-N 3.46Å; R51-T55 PolarHBondContact O-OG1 3.42Å; T55-A57 VanDerWaalsContact C-N 3.33Å; T55-A57 PolarHBondContact O-N 3.48Å; T55-N58 CarbonylContact O-C 3.19Å; T55-N58 WeakPolarHBondContact O-CA 3.05Å; T55-N58 PolarHBondContact O-N 3.36Å; T55-T59 PolarHBondContact O-N 3.39Å; T55-T59 PolarHBondContact O-OG1 3.21Å
56	Q	42	Very low	37.1	Very low	82 Å²	82	96.3 Å²	96.3	38%	0.383	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-38.9	173.8	-79.9	176.2	-27.2	0	0	112.7	I52 N58 T59 N60	I52-Q56 HydrophobicContact CG2-CG 4.41Å; I52-Q56 WeakPolarHBondContact O-CB 3.29Å; I52-Q56 VanDerWaalsContact O-CG 3.29Å; I52-Q56 WeakPolarHBondContact O-CG 3.02Å; I52-Q56 PolarHBondContact O-N 2.94Å; Q56-N58 VanDerWaalsContact C-N 3.25Å; Q56-N58 PolarHBondContact O-N 3.14Å; Q56-T59 PolarHBondContact O-N 3.48Å; Q56-N60 VanDerWaalsContact O-CB 3.28Å; Q56-N60 WeakPolarHBondContact O-CB 3.41Å; Q56-N60 PolarHBondContact O-N 2.92Å
57	A	34.9	Very low	36.5	Very low	58 Å²	58	98.2 Å²	98.2	48%	0.479	51%	0.507	S	S	.	.	H	α-helix	trans	-65.8	-26.2	173.5	0	0	0	0	0	113.5	R53 T55	R53-A57 WeakPolarHBondContact O-CB 3.27Å; R53-A57 PolarHBondContact O-N 3.05Å; T55-A57 VanDerWaalsContact C-N 3.33Å; T55-A57 PolarHBondContact O-N 3.48Å
58	N	31.3	Very low	36	Very low	102 Å²	102	101.5 Å²	101.5	55%	0.545	52%	0.524	S	S	.	.	H	α-helix	trans	-89.8	-29.5	175.6	-86.2	-13.2	0	0	0	113.2	Q54 T55 Q56 R61	Q54-N58 PolarHBondContact O-N 3.48Å; T55-N58 CarbonylContact O-C 3.19Å; T55-N58 WeakPolarHBondContact O-CA 3.05Å; T55-N58 PolarHBondContact O-N 3.36Å; Q56-N58 VanDerWaalsContact C-N 3.25Å; Q56-N58 PolarHBondContact O-N 3.14Å; N58-R61 WeakPolarHBondContact O-CB 3.48Å; N58-R61 PolarHBondContact O-N 2.96Å
59	T	36.5	Very low	35.5	Very low	64 Å²	64	106 Å²	106	39%	0.393	55%	0.546	S	S	.	.	H	α-helix	trans	-71	-36.7	172.1	-39.4	0	0	0	0	110.6	T55 Q56 R61 N62 D63	T55-T59 PolarHBondContact O-N 3.39Å; T55-T59 PolarHBondContact O-OG1 3.21Å; Q56-T59 PolarHBondContact O-N 3.48Å; T59-R61 PolarHBondContact O-N 3.19Å; T59-N62 PolarHBondContact O-N 3.31Å; T59-D63 PolarHBondContact O-N 3.41Å
60	N	32.9	Very low	34.9	Very low	109 Å²	109	110.6 Å²	110.6	58%	0.583	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-7.7	170.6	-77.1	-1.5	0	0	0	114.6	Q56	Q56-N60 VanDerWaalsContact O-CB 3.28Å; Q56-N60 WeakPolarHBondContact O-CB 3.41Å; Q56-N60 PolarHBondContact O-N 2.92Å
61	R	30.7	Very low	34.3	Very low	195 Å²	195	115.5 Å²	115.5	74%	0.736	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-18.9	170.2	-78.2	-178.4	164	-178.8	-5	113.2	N58 T59	N58-R61 WeakPolarHBondContact O-CB 3.48Å; N58-R61 PolarHBondContact O-N 2.96Å; T59-R61 PolarHBondContact O-N 3.19Å
62	N	29.7	Very low	33.5	Very low	149 Å²	149	114.9 Å²	114.9	80%	0.797	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-18.2	179.6	-70.6	-13.7	0	0	0	112.7	T59	T59-N62 PolarHBondContact O-N 3.31Å
63	D	33.2	Very low	32.3	Very low	82 Å²	82	119.3 Å²	119.3	44%	0.439	63%	0.63	S	S	.	*	S	Bend	trans	-76.3	125.4	155.8	-70.6	-38.4	0	0	0	107.6	T59 D65	T59-D63 PolarHBondContact O-N 3.41Å; D63-D65 PolarHBondContact O-N 3.19Å; D63-D65 VanDerWaalsContact O-N 3.09Å
64	A	31.6	Very low	31.6	Very low	81 Å²	81	119.4 Å²	119.4	67%	0.669	64%	0.638	S	S	*	*			trans	-41.4	116.5	-171.6	0	0	0	0	0	113.2	L66	A64-L66 PolarHBondContact O-N 3.23Å
65	D	29.2	Very low	31	Very low	119 Å²	119	122 Å²	122	64%	0.636	66%	0.655	S	S	*	*			trans	-54	99.3	170.4	-171.3	3.7	0	0	0	110	D63 T67	D63-D65 PolarHBondContact O-N 3.19Å; D63-D65 VanDerWaalsContact O-N 3.09Å; D65-T67 PolarHBondContact OD1-N 3.11Å; D65-T67 PolarHBondContact OD1-OG1 3.3Å
66	L	37	Very low	30.4	Very low	109 Å²	109	124.9 Å²	124.9	57%	0.571	67%	0.674	S	S	*	*			trans	-107.5	25.7	175.1	-82.9	164.1	0	0	0	111.1	A64	A64-L66 PolarHBondContact O-N 3.23Å
67	T	30.8	Very low	29.6	Very low	121 Å²	121	125.9 Å²	125.9	74%	0.742	70%	0.696	S	S	*	*			trans	-111.7	54.4	-177.3	52.2	0	0	0	0	113.7	D65	D65-T67 PolarHBondContact OD1-N 3.11Å; D65-T67 PolarHBondContact OD1-OG1 3.3Å
68	V	28.6	Very low	29.2	Very low	114 Å²	114	129 Å²	129	69%	0.691	71%	0.714	S	S	*	*			trans	-142.4	132.7	162.7	-176	0	0	0	0	111.2
69	D	27.5	Very low	28.9	Very low	140 Å²	140	131.2 Å²	131.2	75%	0.749	73%	0.726	S	S	*	*			trans	85	70.9	167	-64.4	-23.9	0	0	0	120.8
70	T	28	Very low	28.5	Very low	134 Å²	134	135.1 Å²	135.1	82%	0.822	74%	0.74	S	S	*	*			trans	-92	93.3	138.7	7.2	0	0	0	0	110
71	R	25.4	Very low	28.2	Very low	230 Å²	230	137.2 Å²	137.2	87%	0.868	75%	0.747	S	S	*	*			trans	-120.8	86.7	153.7	-79.8	-169.7	-175.4	-171.6	3.8	108.4
72	I	27.4	Very low	27.9	Very low	151 Å²	151	139.4 Å²	139.4	77%	0.774	76%	0.755	S	S	*	*			trans	-89.2	114.7	164.4	-64.5	177.2	0	0	0	107	H74	I72-H74 PolarHBondContact O-N 3.17Å
73	S	25.1	Very low	27.7	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	75%	0.754	S	S	*	*			trans	-66.2	121.2	172	-49.8	0	0	0	0	109.8
74	H	24.6	Very low	27.4	Very low	184 Å²	184	141 Å²	141	85%	0.852	78%	0.775	S	S	*	*			trans	-57.7	142.1	164.6	-83.1	-77.2	0	0	0	111.7	I72	I72-H74 PolarHBondContact O-N 3.17Å
75	L	24.4	Very low	27.2	Very low	170 Å²	170	145.8 Å²	145.8	89%	0.89	78%	0.784	S	S	*	*			trans	-160.1	155.1	142.2	-93.7	161.3	0	0	0	108.6
76	P	28.2	Very low	27	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	79%	0.79	S	S	*	*			trans	-111.4	170.5	-138.8	38.5	-28.3	0	0	0	115.4
77	A	24.7	Very low	26.5	Very low	103 Å²	103	149 Å²	149	85%	0.851	80%	0.8	S	S	*	*			trans	-56.1	147.9	175.7	0	0	0	0	0	114.5
78	S	26.5	Very low	26.3	Very low	123 Å²	123	150.2 Å²	150.2	86%	0.86	81%	0.808	S	S	*	*			trans	-130.4	128.2	155	58.6	0	0	0	0	109.4
79	D	25.7	Very low	26.2	Very low	149 Å²	149	147.9 Å²	147.9	80%	0.797	81%	0.807	S	S	*	*			trans	-86.5	168.1	-174.1	-132.3	-17.2	0	0	0	112
80	Q	27.7	Very low	26.1	Very low	146 Å²	146	150.8 Å²	150.8	68%	0.682	82%	0.816	S	S	*	*			trans	92.8	107.3	151.4	-75	177.1	27.9	0	0	122.3
81	Q	25.5	Very low	26	Very low	154 Å²	154	153 Å²	153	72%	0.72	82%	0.817	S	S	*	*				98.9	119.3	107.9	-91	-178.5	5.6	0	0	122.1
82	R	26	Very low	26	Very low	240 Å²	240	146.9 Å²	146.9	91%	0.906	81%	0.809	S	S	*	*				105.7	133.2	120.2	-141	174.6	-170.2	-173.8	0.6	118.3
83	G	25.4	Very low	25.9	Very low	75 Å²	75	147.5 Å²	147.5	77%	0.773	81%	0.814	S	S	*	*			trans	141.6	96.8	151.3	0	0	0	0	0	115.2
84	E	26.5	Very low	26.1	Very low	191 Å²	191	149.5 Å²	149.5	89%	0.893	82%	0.815	S	S	*	*			trans	-67.9	157.5	169.5	-64.9	165.1	135	0	0	112.5
85	E	26.8	Very low	26.3	Very low	180 Å²	180	146.4 Å²	146.4	84%	0.841	81%	0.814	S	S	*	*				-176.8	118.3	123.5	-98.4	-178.2	179.1	0	0	114
86	L	25.5	Very low	26.5	Very low	147 Å²	147	150 Å²	150	77%	0.77	82%	0.815	S	S	*	*			trans	52.4	113.4	132.6	-72.8	156.2	0	0	0	124.3
87	N	25.5	Very low	26.4	Very low	148 Å²	148	150.2 Å²	150.2	79%	0.791	82%	0.82	S	S	*	*				19.3	132.3	128.8	-82.5	-9.1	0	0	0	121
88	V	28.1	Very low	26.8	Very low	148 Å²	148	156.7 Å²	156.7	90%	0.897	82%	0.822	S	S	*	*				-156.5	136.2	115.8	-175.2	0	0	0	0	108.2
89	G	25.1	Very low	27.1	Very low	65 Å²	65	160.9 Å²	160.9	67%	0.67	83%	0.825	S	S	*	*			trans	-99.9	177.5	178.2	0	0	0	0	0	114.2
90	E	26.9	Very low	27.5	Very low	200 Å²	200	157.6 Å²	157.6	94%	0.935	83%	0.826	S	S	*	*			trans	-168.3	131.7	147.1	-111	172.2	-176.5	0	0	110.8
91	E	25.9	Very low	27.6	Very low	181 Å²	181	155.4 Å²	155.4	85%	0.846	83%	0.827	S	S	*	*			trans	-69.4	150.2	163.8	-57.7	173.1	133.6	0	0	108.3
92	S	25.6	Very low	28.3	Very low	101 Å²	101	154.1 Å²	154.1	71%	0.706	84%	0.835	S	S	*	*				166.6	145.6	59.8	42	0	0	0	0	105.9
93	D	25.3	Very low	29	Very low	164 Å²	164	151 Å²	151	88%	0.877	83%	0.83	S	S	*	*				-175.3	134.5	122.7	-110.1	-23.8	0	0	0	113.3
94	I	28.4	Very low	29.8	Very low	154 Å²	154	152.9 Å²	152.9	79%	0.79	84%	0.839	S	S	*	*			trans	-92	126.1	178.1	-68.3	164.8	0	0	0	107.7
95	S	27.9	Very low	31.2	Very low	119 Å²	119	146.9 Å²	146.9	83%	0.832	83%	0.828	S	S	*	*			trans	-133.9	118.9	151.3	77.7	0	0	0	0	111.2
96	R	29.4	Very low	33.5	Very low	245 Å²	245	140.2 Å²	140.2	93%	0.925	81%	0.807	S	S	*	*			trans	-77.9	128.1	167.6	-78.5	172.9	168.7	166.5	-2.3	108.1
97	S	27.1	Very low	36.8	Very low	122 Å²	122	138.8 Å²	138.8	85%	0.853	80%	0.797	S	S	*	*			trans	-128.8	121	154.1	-179.2	0	0	0	0	109.4
98	R	31.7	Very low	40.2	Very low	238 Å²	238	136.2 Å²	136.2	90%	0.898	78%	0.776	S	S	*	*			trans	-93.3	142	172.2	-101.1	179.4	172.1	176.8	-1.9	108.4
99	K	33.1	Very low	43.6	Very low	212 Å²	212	130.7 Å²	130.7	92%	0.922	74%	0.739	S	S	*	*	S	Bend	trans	66.7	115.3	157.2	-87.6	-177.1	170.6	-177.2	0	117.7
100	G	34.4	Very low	47.1	Very low	79 Å²	79	129 Å²	129	81%	0.814	71%	0.714	S	S	*	*			trans	108.8	84.4	132.1	0	0	0	0	0	115.6
101	S	29.9	Very low	50.5	Low	101 Å²	101	119.4 Å²	119.4	71%	0.706	67%	0.669	S	S	*	*			trans	-151.6	102.2	143.7	55.4	0	0	0	0	108.2	E103	S101-E103 PolarHBondContact O-N 2.76Å
102	S	40.3	Very low	54	Low	126 Å²	126	110.8 Å²	110.8	88%	0.881	63%	0.629	S	S	*	*			trans	-54.8	96.1	152.9	48.9	0	0	0	0	107	A104	S102-A104 PolarHBondContact O-N 3.34Å
103	E	41.3	Very low	57.4	Low	175 Å²	175	106 Å²	106	82%	0.818	60%	0.595	S	S	*	*			trans	-60.5	132.8	166.5	-86.3	-177.1	152.7	0	0	107.8	S101 G105	S101-E103 PolarHBondContact O-N 2.76Å; E103-G105 PolarHBondContact O-N 2.68Å
104	A	40.8	Very low	60.8	Low	115 Å²	115	99.9 Å²	99.9	95%	0.95	56%	0.562	S	S	*	*			trans	-69.7	53.9	178.8	0	0	0	0	0	111.8	S102	S102-A104 PolarHBondContact O-N 3.34Å
105	G	55.4	Low	64	Low	65 Å²	65	92.6 Å²	92.6	67%	0.67	52%	0.524	S	S	*	.			trans	-98.6	112.2	171.5	0	0	0	0	0	108.7	E103	E103-G105 PolarHBondContact O-N 2.68Å
106	G	76.6	Confident	67	Low	39 Å²	39	87.7 Å²	87.7	40%	0.402	49%	0.49	S	S	.	.			trans	-62.6	163.7	178.6	0	0	0	0	0	113.1	R108 G144	G106-R108 PolarHBondContact O-N 3.09Å; G106-G144 CarbonylContact C-O 3.43Å; G106-G144 WeakPolarHBondContact CA-O 3.34Å
107	Q	93.6	Very high	69.9	Low	118 Å²	118	79.2 Å²	79.2	55%	0.551	46%	0.459	S	S	*	.			trans	-61.8	130.6	-172.8	179.1	65.4	56.9	0	0	111.6	Y109 E145 V146	Q107-Y109 HydrophobicContact CB-CE2 4.22Å; Q107-Y109 HydrophobicContact CG-CD2 4.27Å; Q107-Y109 HydrophobicContact CG-CE1 4.44Å; Q107-Y109 HydrophobicContact CG-CE2 3.57Å; Q107-E145 HydrophobicContact CB-CG 4.3Å; Q107-E145 CarbonylContact O-C 3.6Å; Q107-E145 VanDerWaalsContact O-CA 3.29Å; Q107-E145 WeakPolarHBondContact O-CA 3.28Å; Q107-V146 PolarHBondContact O-N 3.32Å
108	R	97.6	Very high	73	Confident	93 Å²	93	73.4 Å²	73.4	35%	0.351	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.7	-179.2	-57.3	174.4	69.1	89.7	-3.8	110	G106 V146 V148 E177	G106-R108 PolarHBondContact O-N 3.09Å; R108-V146 WeakPolarHBondContact CA-O 3.29Å; R108-V148 HydrophobicContact CB-CG2 4.29Å; R108-E177 IonicContact CZ-OE1 3.87Å; R108-E177 IonicContact CZ-OE2 3.16Å; R108-E177 IonicContact NH1-OE1 2.65Å; R108-E177 PolarHBondContact NH1-OE1 2.96Å; R108-E177 IonicContact NH1-OE2 3.51Å; R108-E177 IonicContact NH2-OE1 2.89Å; R108-E177 PolarHBondContact NH2-OE1 2.87Å; R108-E177 VanDerWaalsContact NH2-OE1 3.16Å; R108-E177 IonicContact NH2-OE2 3.7Å; R108-E177 PolarHBondContact NH2-OE2 3.36Å
109	Y	98.6	Very high	75.8	Confident	33 Å²	33	64.6 Å²	64.6	13%	0.129	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	113.9	-179.8	-66.5	-89.4	0	0	0	108.4	Q107 F141 E145 V146 V148 R245 F248	Q107-Y109 HydrophobicContact CB-CE2 4.22Å; Q107-Y109 HydrophobicContact CG-CD2 4.27Å; Q107-Y109 HydrophobicContact CG-CE1 4.44Å; Q107-Y109 HydrophobicContact CG-CE2 3.57Å; Y109-F141 HydrophobicContact CD1-CE1 4.39Å; Y109-F141 AromaticContact CD2-CD1 3.76Å; Y109-F141 HydrophobicContact CD2-CD1 3.76Å; Y109-F141 AromaticContact CD2-CE1 3.58Å; Y109-F141 HydrophobicContact CD2-CE1 3.58Å; Y109-F141 HydrophobicContact CE2-CD1 4Å; Y109-F141 HydrophobicContact CE2-CE1 4.13Å; Y109-F141 HydrophobicContact CG-CD1 4.37Å; Y109-F141 AromaticContact CG-CE1 3.72Å; Y109-F141 HydrophobicContact CG-CE1 3.72Å; Y109-E145 HydrophobicContact CD2-CB 4.36Å; Y109-E145 HydrophobicContact CE2-CB 3.87Å; Y109-E145 HydrophobicContact CE2-CG 3.83Å; Y109-E145 PolarHBondContact OH-OE1 2.96Å; Y109-E145 VanDerWaalsContact OH-OE1 3.14Å; Y109-V146 PolarHBondContact N-O 3.37Å; Y109-V148 PolarHBondContact O-N 3.43Å; Y109-R245 HydrophobicContact CE1-CG 4.38Å; Y109-F248 HydrophobicContact CD1-CB 3.67Å; Y109-F248 AromaticContact CD1-CD1 3.71Å; Y109-F248 HydrophobicContact CD1-CD1 3.71Å; Y109-F248 AromaticContact CD1-CD2 3.76Å; Y109-F248 HydrophobicContact CD1-CD2 3.76Å; Y109-F248 HydrophobicContact CD1-CE1 4.22Å; Y109-F248 HydrophobicContact CD1-CE2 4.29Å; Y109-F248 AromaticContact CD1-CG 3.46Å; Y109-F248 HydrophobicContact CD1-CG 3.46Å; Y109-F248 VanDerWaalsContact CD1-CG 3.46Å; Y109-F248 HydrophobicContact CD1-CZ 4.5Å; Y109-F248 HydrophobicContact CE1-CB 3.83Å; Y109-F248 HydrophobicContact CE1-CG 4.15Å; Y109-F248 HydrophobicContact CG-CD2 4.46Å; Y109-F248 HydrophobicContact CG-CG 4.44Å
110	H	98.8	Very high	78.7	Confident	28 Å²	28	62.1 Å²	62.1	13%	0.13	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.6	-172.3	-65.3	-98.1	0	0	0	110.9	V148 H150 L228 I231 V232 F248	H110-V148 WeakPolarHBondContact CA-O 3.42Å; H110-H150 AromaticContact CE1-NE2 3.87Å; H110-H150 AromaticContact CG-NE2 3.78Å; H110-H150 AromaticContact ND1-CD2 3.91Å; H110-H150 AromaticContact ND1-CE1 3.72Å; H110-H150 AromaticContact ND1-NE2 2.87Å; H110-H150 PolarHBondContact ND1-NE2 3.03Å; H110-L228 HydrophobicContact CB-CD1 3.85Å; H110-L228 WeakPolarHBondContact CD2-CD1 3.43Å; H110-I231 HydrophobicContact CB-CB 4.27Å; H110-I231 HydrophobicContact CB-CD1 4.37Å; H110-I231 HydrophobicContact CB-CG1 3.84Å; H110-I231 WeakPolarHBondContact O-CA 3.5Å; H110-I231 WeakPolarHBondContact O-CG1 3.11Å; H110-V232 PolarHBondContact O-N 2.79Å; H110-F248 WeakPolarHBondContact O-CE1 3.35Å
111	A	98.8	Very high	81.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.1	174.9	0	0	0	0	0	109.7	L147 V148 L149 H150 V232 L234 F248	A111-L147 HydrophobicContact CB-CD1 4.35Å; A111-V148 PolarHBondContact N-O 3.28Å; A111-L149 HydrophobicContact CB-CD2 4.14Å; A111-L149 CarbonylContact O-C 3.5Å; A111-H150 PolarHBondContact O-N 3.19Å; A111-V232 CarbonylContact C-O 3.58Å; A111-V232 VanDerWaalsContact CA-O 3.27Å; A111-V232 WeakPolarHBondContact CA-O 3.47Å; A111-L234 HydrophobicContact CB-CD1 4.04Å; A111-F248 HydrophobicContact CB-CZ 4.43Å
112	L	98.8	Very high	84.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.2	-178.5	-175.4	147.4	0	0	0	111.5	M114 H150 V152 L216 M220 M224 I231 V232 Q233 L234	L112-M114 HydrophobicContact CD2-SD 4.26Å; L112-H150 CarbonylContact C-O 3.46Å; L112-H150 VanDerWaalsContact CA-O 3.28Å; L112-H150 WeakPolarHBondContact CA-O 3.43Å; L112-H150 HydrophobicContact CB-CB 3.91Å; L112-H150 HydrophobicContact CD1-CB 3.99Å; L112-H150 HydrophobicContact CG-CB 3.96Å; L112-V152 HydrophobicContact CD1-CG2 4.06Å; L112-V152 HydrophobicContact CD2-CG2 4.08Å; L112-V152 HydrophobicContact CG-CG2 4.25Å; L112-L216 HydrophobicContact CD1-CD2 4.35Å; L112-L216 HydrophobicContact CD2-CD2 4.1Å; L112-M220 HydrophobicContact CD1-CE 3.92Å; L112-M220 HydrophobicContact CD1-SD 4.17Å; L112-M220 HydrophobicContact CD2-CE 4.15Å; L112-M224 HydrophobicContact CD1-CE 3.39Å; L112-I231 HydrophobicContact CB-CD1 3.65Å; L112-I231 HydrophobicContact CB-CG1 4.18Å; L112-I231 HydrophobicContact CD1-CD1 3.98Å; L112-I231 HydrophobicContact CG-CD1 4.48Å; L112-V232 PolarHBondContact N-O 2.82Å; L112-Q233 HydrophobicContact CD2-CG 4Å; L112-Q233 CarbonylContact O-C 3.6Å; L112-Q233 WeakPolarHBondContact O-CA 3.13Å; L112-L234 PolarHBondContact O-N 2.99Å
113	M	98.4	Very high	87.2	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141.1	175.6	-58.2	176	-174.8	0	0	111.2	F115 F128 M132 H150 F151 V152 L234 L236	M113-F115 PolarHBondContact O-N 2.92Å; M113-F128 HydrophobicContact SD-CE2 4.2Å; M113-M132 HydrophobicContact CE-SD 4.22Å; M113-M132 HydrophobicContact SD-SD 4.32Å; M113-H150 PolarHBondContact N-O 3.39Å; M113-F151 HydrophobicContact CB-CD1 4.09Å; M113-F151 HydrophobicContact CB-CE1 4.13Å; M113-F151 HydrophobicContact CG-CE1 4.42Å; M113-F151 WeakPolarHBondContact O-CA 3.24Å; M113-F151 HydrophobicContact SD-CE1 3.86Å; M113-V152 PolarHBondContact O-N 2.87Å; M113-L234 WeakPolarHBondContact CA-O 3.34Å; M113-L234 HydrophobicContact CE-CB 4.29Å; M113-L234 HydrophobicContact CE-CD1 4.21Å; M113-L234 HydrophobicContact CG-CB 4.2Å; M113-L234 WeakPolarHBondContact CG-O 3.33Å; M113-L236 HydrophobicContact CB-CD2 3.67Å; M113-L236 HydrophobicContact CG-CD2 4.22Å; M113-L236 HydrophobicContact SD-CD2 3.88Å
114	M	95.9	Very high	89.7	Confident	35 Å²	35	52.9 Å²	52.9	17%	0.172	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	114.9	172.1	-64.7	-52.3	-55.6	0	0	109.4	L112 V152 I213 L216 L236	L112-M114 HydrophobicContact CD2-SD 4.26Å; M114-V152 HydrophobicContact CE-CB 3.8Å; M114-V152 HydrophobicContact CE-CG1 3.68Å; M114-V152 HydrophobicContact SD-CB 3.84Å; M114-V152 HydrophobicContact SD-CG1 4.28Å; M114-V152 HydrophobicContact SD-CG2 4.02Å; M114-I213 HydrophobicContact CE-CB 4.45Å; M114-I213 HydrophobicContact CE-CD1 4.21Å; M114-I213 HydrophobicContact CE-CG1 3.3Å; M114-I213 HydrophobicContact CE-CG2 4.42Å; M114-I213 HydrophobicContact SD-CG1 4.48Å; M114-L216 HydrophobicContact SD-CD2 3.94Å; M114-L236 WeakPolarHBondContact O-CD1 3.03Å; M114-L236 WeakPolarHBondContact O-CG 3.36Å
115	F	95.4	Very high	92.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.267	C	S	.	.			trans	-127.9	54.7	-170.1	-160.1	-98.9	0	0	0	111.9	M113 V118 F128 F151 V152 S153 S157 M164 L236	M113-F115 PolarHBondContact O-N 2.92Å; F115-V118 HydrophobicContact CD1-CB 4.48Å; F115-V118 HydrophobicContact CD1-CG2 3.97Å; F115-V118 HydrophobicContact CD2-CG2 3.77Å; F115-V118 HydrophobicContact CE1-CB 4.05Å; F115-V118 HydrophobicContact CE1-CG1 4.19Å; F115-V118 HydrophobicContact CE1-CG2 3.97Å; F115-V118 HydrophobicContact CE2-CB 4.27Å; F115-V118 HydrophobicContact CE2-CG1 3.91Å; F115-V118 HydrophobicContact CE2-CG2 3.75Å; F115-V118 HydrophobicContact CG-CG2 3.87Å; F115-V118 HydrophobicContact CZ-CB 3.94Å; F115-V118 HydrophobicContact CZ-CG1 3.6Å; F115-V118 HydrophobicContact CZ-CG2 3.86Å; F115-F128 HydrophobicContact CD2-CD1 4.48Å; F115-F128 HydrophobicContact CD2-CD2 4.42Å; F115-F128 HydrophobicContact CD2-CE1 4.4Å; F115-F128 HydrophobicContact CD2-CE2 4.32Å; F115-F128 HydrophobicContact CD2-CG 4.46Å; F115-F128 HydrophobicContact CD2-CZ 4.29Å; F115-F128 HydrophobicContact CE2-CB 4.37Å; F115-F128 AromaticContact CE2-CD1 3.41Å; F115-F128 HydrophobicContact CE2-CD1 3.41Å; F115-F128 VanDerWaalsContact CE2-CD1 3.41Å; F115-F128 HydrophobicContact CE2-CD2 4.03Å; F115-F128 AromaticContact CE2-CE1 3.46Å; F115-F128 HydrophobicContact CE2-CE1 3.46Å; F115-F128 VanDerWaalsContact CE2-CE1 3.46Å; F115-F128 HydrophobicContact CE2-CE2 4.05Å; F115-F128 AromaticContact CE2-CG 3.68Å; F115-F128 HydrophobicContact CE2-CG 3.68Å; F115-F128 AromaticContact CE2-CZ 3.77Å; F115-F128 HydrophobicContact CE2-CZ 3.77Å; F115-F128 AromaticContact CZ-CD1 3.91Å; F115-F128 HydrophobicContact CZ-CD1 3.91Å; F115-F128 AromaticContact CZ-CE1 3.79Å; F115-F128 HydrophobicContact CZ-CE1 3.79Å; F115-F128 HydrophobicContact CZ-CZ 4.37Å; F115-F151 HydrophobicContact CB-CB 4.16Å; F115-F151 HydrophobicContact CB-CD1 4.01Å; F115-F151 HydrophobicContact CD2-CD1 4.27Å; F115-F151 HydrophobicContact CG-CD1 4.17Å; F115-V152 CarbonylContact C-O 3.54Å; F115-V152 VanDerWaalsContact C-O 3.28Å; F115-V152 WeakPolarHBondContact CA-O 3.44Å; F115-V152 PolarHBondContact N-O 3.15Å; F115-S153 VanDerWaalsContact O-CA 3.32Å; F115-S153 WeakPolarHBondContact O-CA 3.42Å; F115-S153 WeakPolarHBondContact O-CB 3.06Å; F115-S157 VanDerWaalsContact CE1-O 3.27Å; F115-S157 WeakPolarHBondContact CE1-O 3.39Å; F115-S157 WeakPolarHBondContact O-CB 3.37Å; F115-M164 HydrophobicContact CZ-SD 4.46Å; F115-L236 HydrophobicContact CD2-CD1 3.68Å; F115-L236 HydrophobicContact CD2-CD2 3.97Å; F115-L236 HydrophobicContact CE2-CD1 4.22Å
116	T	91.8	Very high	94.4	Very high	17 Å²	17	52.4 Å²	52.4	10%	0.104	26%	0.261	C	S	.	.			trans	-109	147.1	-177.8	57.8	0	0	0	0	111.9	V118 D154 V183	T116-V118 PolarHBondContact O-N 2.77Å; T116-D154 WeakPolarHBondContact CA-OD2 3.49Å; T116-V183 HydrophobicContact CG2-CB 4.04Å; T116-V183 HydrophobicContact CG2-CG1 4.4Å; T116-V183 HydrophobicContact CG2-CG2 3.82Å
117	K	89.6	Confident	95.4	Very high	66 Å²	66	52 Å²	52	29%	0.287	25%	0.249	S	C	.	.	S	Bend	trans	56.7	25.9	177.6	-53.1	170.5	-173.7	165.5	0	113	D119 R120 D154 S157 E211	K117-D119 VanDerWaalsContact C-N 3.35Å; K117-R120 PolarHBondContact O-N 3.16Å; K117-D154 PolarHBondContact N-OD2 2.89Å; K117-S157 PolarHBondContact N-OG 3.35Å; K117-E211 IonicContact NZ-OE1 3.33Å; K117-E211 PolarHBondContact NZ-OE1 2.71Å; K117-E211 IonicContact NZ-OE2 3.96Å
118	V	91.9	Very high	95.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-72.7	-32.1	-176.1	178.7	0	0	0	0	111.2	F115 T116 R120 S121 L124 Q125 S157 L160 L236	F115-V118 HydrophobicContact CD1-CB 4.48Å; F115-V118 HydrophobicContact CD1-CG2 3.97Å; F115-V118 HydrophobicContact CD2-CG2 3.77Å; F115-V118 HydrophobicContact CE1-CB 4.05Å; F115-V118 HydrophobicContact CE1-CG1 4.19Å; F115-V118 HydrophobicContact CE1-CG2 3.97Å; F115-V118 HydrophobicContact CE2-CB 4.27Å; F115-V118 HydrophobicContact CE2-CG1 3.91Å; F115-V118 HydrophobicContact CE2-CG2 3.75Å; F115-V118 HydrophobicContact CG-CG2 3.87Å; F115-V118 HydrophobicContact CZ-CB 3.94Å; F115-V118 HydrophobicContact CZ-CG1 3.6Å; F115-V118 HydrophobicContact CZ-CG2 3.86Å; T116-V118 PolarHBondContact O-N 2.77Å; V118-R120 PolarHBondContact O-N 2.81Å; V118-R120 VanDerWaalsContact O-N 3.15Å; V118-S121 PolarHBondContact O-N 2.91Å; V118-S121 VanDerWaalsContact O-N 3.16Å; V118-L124 HydrophobicContact CG2-CD2 3.83Å; V118-L124 HydrophobicContact CG2-CG 4.34Å; V118-Q125 HydrophobicContact CG1-CG 3.56Å; V118-Q125 WeakPolarHBondContact O-CG 3.3Å; V118-Q125 PolarHBondContact O-NE2 2.91Å; V118-S157 PolarHBondContact N-OG 2.88Å; V118-L160 HydrophobicContact CG1-CD2 4.3Å; V118-L236 HydrophobicContact CG2-CD1 4.3Å
119	D	91.5	Very high	95.6	Very high	54 Å²	54	46.4 Å²	46.4	29%	0.289	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-54.9	-29.2	172.3	66	-55.5	0	0	0	113	K117 V156 L160	K117-D119 VanDerWaalsContact C-N 3.35Å; D119-V156 HydrophobicContact CB-CG1 3.75Å; D119-L160 HydrophobicContact CB-CD2 4.27Å
120	R	92.3	Very high	95.6	Very high	160 Å²	160	46.9 Å²	46.9	60%	0.604	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-90.2	-7.8	-176.7	-53.2	-173.2	-175.9	-171.4	-0.8	114.3	K117 V118	K117-R120 PolarHBondContact O-N 3.16Å; V118-R120 PolarHBondContact O-N 2.81Å; V118-R120 VanDerWaalsContact O-N 3.15Å
121	S	93.3	Very high	95.6	Very high	43 Å²	43	45.5 Å²	45.5	30%	0.301	22%	0.222	S	C	.	.			trans	-133.3	101.8	-173.3	-178.4	0	0	0	0	112.4	V118 S123 L124 Q125	V118-S121 PolarHBondContact O-N 2.91Å; V118-S121 VanDerWaalsContact O-N 3.16Å; S121-S123 PolarHBondContact O-N 2.91Å; S121-L124 PolarHBondContact O-N 3.02Å; S121-L124 VanDerWaalsContact O-N 3.13Å; S121-L124 WeakPolarHBondContact OG-CB 3.23Å; S121-L124 PolarHBondContact OG-N 3.2Å; S121-L124 VanDerWaalsContact OG-N 3.12Å; S121-Q125 WeakPolarHBondContact O-CG 3.39Å; S121-Q125 PolarHBondContact O-N 2.94Å
122	I	95.2	Very high	95.6	Very high	140 Å²	140	45.5 Å²	45.5	72%	0.718	22%	0.222	S	C	*	.	H	α-helix	trans	-60	-37	173.2	-61.1	173.6	0	0	0	110.7	L124 Q125 H126	I122-L124 VanDerWaalsContact C-N 3.35Å; I122-L124 PolarHBondContact O-N 3Å; I122-Q125 PolarHBondContact O-N 3.26Å; I122-H126 PolarHBondContact O-N 2.9Å
123	S	94.9	Very high	95.6	Very high	66 Å²	66	48.8 Å²	48.8	46%	0.462	24%	0.239	S	C	.	.	H	α-helix	trans	-60.1	-45.1	175.3	-179.6	0	0	0	0	111.4	S121 H126 K127	S121-S123 PolarHBondContact O-N 2.91Å; S123-H126 PolarHBondContact O-N 3.22Å; S123-K127 WeakPolarHBondContact O-CB 3.48Å; S123-K127 WeakPolarHBondContact O-CG 3.26Å; S123-K127 PolarHBondContact O-N 3.16Å
124	L	94.5	Very high	95.5	Very high	38 Å²	38	49.4 Å²	49.4	20%	0.199	24%	0.244	C	C	.	.	H	α-helix	trans	-67.7	-38.3	178.1	-169.3	58	0	0	0	112	V118 S121 I122 H126 K127 F128 L236	V118-L124 HydrophobicContact CG2-CD2 3.83Å; V118-L124 HydrophobicContact CG2-CG 4.34Å; S121-L124 PolarHBondContact O-N 3.02Å; S121-L124 VanDerWaalsContact O-N 3.13Å; S121-L124 WeakPolarHBondContact OG-CB 3.23Å; S121-L124 PolarHBondContact OG-N 3.2Å; S121-L124 VanDerWaalsContact OG-N 3.12Å; I122-L124 VanDerWaalsContact C-N 3.35Å; I122-L124 PolarHBondContact O-N 3Å; L124-H126 VanDerWaalsContact C-N 3.33Å; L124-H126 PolarHBondContact O-N 3.17Å; L124-K127 PolarHBondContact O-N 2.87Å; L124-F128 WeakPolarHBondContact O-CB 3.37Å; L124-F128 PolarHBondContact O-N 2.93Å; L124-L236 HydrophobicContact CD1-CB 4.05Å; L124-L236 HydrophobicContact CD1-CD1 3.93Å; L124-L236 HydrophobicContact CD2-CD1 4.34Å; L124-L236 HydrophobicContact CG-CD1 4.09Å
125	Q	97.4	Very high	95.7	Very high	48 Å²	48	47.9 Å²	47.9	22%	0.224	24%	0.236	C	C	.	.	H	α-helix	trans	-60.2	-42.7	172.6	-69.5	171.1	39.6	0	0	111.8	V118 S121 I122 F128 R129 L160 M164	V118-Q125 HydrophobicContact CG1-CG 3.56Å; V118-Q125 WeakPolarHBondContact O-CG 3.3Å; V118-Q125 PolarHBondContact O-NE2 2.91Å; S121-Q125 WeakPolarHBondContact O-CG 3.39Å; S121-Q125 PolarHBondContact O-N 2.94Å; I122-Q125 PolarHBondContact O-N 3.26Å; Q125-F128 PolarHBondContact O-N 3.07Å; Q125-R129 WeakPolarHBondContact O-CB 3.13Å; Q125-R129 PolarHBondContact O-N 3.2Å; Q125-L160 HydrophobicContact CG-CD2 4.16Å; Q125-M164 HydrophobicContact CB-CE 3.98Å; Q125-M164 HydrophobicContact CG-CE 4.35Å; Q125-M164 HydrophobicContact CG-SD 4.36Å
126	H	97.3	Very high	95.8	Very high	121 Å²	121	48.6 Å²	48.6	56%	0.56	24%	0.241	S	C	*	.	H	α-helix	trans	-66.1	-44.9	176.8	-177.5	-88.1	0	0	0	111.9	I122 S123 L124 F128 R129 V130	I122-H126 PolarHBondContact O-N 2.9Å; S123-H126 PolarHBondContact O-N 3.22Å; L124-H126 VanDerWaalsContact C-N 3.33Å; L124-H126 PolarHBondContact O-N 3.17Å; H126-F128 PolarHBondContact O-N 2.83Å; H126-R129 WeakPolarHBondContact O-CB 3.42Å; H126-R129 PolarHBondContact O-N 3.16Å; H126-V130 WeakPolarHBondContact O-CG2 3.42Å; H126-V130 PolarHBondContact O-N 2.84Å
127	K	97.8	Very high	96	Very high	31 Å²	31	55.3 Å²	55.3	14%	0.135	27%	0.269	C	S	.	.	H	α-helix	trans	-55.4	-50.3	174.1	-77.9	166.1	150	-148.3	0	111.3	S123 L124 R129 V130 A131 L236 D237 N396	S123-K127 WeakPolarHBondContact O-CB 3.48Å; S123-K127 WeakPolarHBondContact O-CG 3.26Å; S123-K127 PolarHBondContact O-N 3.16Å; L124-K127 PolarHBondContact O-N 2.87Å; K127-R129 VanDerWaalsContact C-N 3.33Å; K127-R129 PolarHBondContact O-N 2.85Å; K127-V130 WeakPolarHBondContact O-CB 3.48Å; K127-V130 PolarHBondContact O-N 3.25Å; K127-V130 VanDerWaalsContact O-N 3.14Å; K127-A131 PolarHBondContact O-N 3.33Å; K127-L236 CarbonylContact C-O 3.24Å; K127-L236 VanDerWaalsContact O-O 3.12Å; K127-D237 HydrophobicContact CB-CB 3.93Å; K127-D237 HydrophobicContact CD-CB 3.65Å; K127-D237 HydrophobicContact CG-CB 3.81Å; K127-D237 IonicContact NZ-OD2 3.37Å; K127-D237 PolarHBondContact NZ-OD2 2.75Å; K127-N396 PolarHBondContact NZ-OD1 3.49Å
128	F	98.1	Very high	96.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-60.1	-41.7	176.6	177.1	-125.4	0	0	0	112.7	M113 F115 L124 Q125 H126 V130 A131 M132 F151 M164 L165 F168 L236	M113-F128 HydrophobicContact SD-CE2 4.2Å; F115-F128 HydrophobicContact CD2-CD1 4.48Å; F115-F128 HydrophobicContact CD2-CD2 4.42Å; F115-F128 HydrophobicContact CD2-CE1 4.4Å; F115-F128 HydrophobicContact CD2-CE2 4.32Å; F115-F128 HydrophobicContact CD2-CG 4.46Å; F115-F128 HydrophobicContact CD2-CZ 4.29Å; F115-F128 HydrophobicContact CE2-CB 4.37Å; F115-F128 AromaticContact CE2-CD1 3.41Å; F115-F128 HydrophobicContact CE2-CD1 3.41Å; F115-F128 VanDerWaalsContact CE2-CD1 3.41Å; F115-F128 HydrophobicContact CE2-CD2 4.03Å; F115-F128 AromaticContact CE2-CE1 3.46Å; F115-F128 HydrophobicContact CE2-CE1 3.46Å; F115-F128 VanDerWaalsContact CE2-CE1 3.46Å; F115-F128 HydrophobicContact CE2-CE2 4.05Å; F115-F128 AromaticContact CE2-CG 3.68Å; F115-F128 HydrophobicContact CE2-CG 3.68Å; F115-F128 AromaticContact CE2-CZ 3.77Å; F115-F128 HydrophobicContact CE2-CZ 3.77Å; F115-F128 AromaticContact CZ-CD1 3.91Å; F115-F128 HydrophobicContact CZ-CD1 3.91Å; F115-F128 AromaticContact CZ-CE1 3.79Å; F115-F128 HydrophobicContact CZ-CE1 3.79Å; F115-F128 HydrophobicContact CZ-CZ 4.37Å; L124-F128 WeakPolarHBondContact O-CB 3.37Å; L124-F128 PolarHBondContact O-N 2.93Å; Q125-F128 PolarHBondContact O-N 3.07Å; H126-F128 PolarHBondContact O-N 2.83Å; F128-V130 VanDerWaalsContact C-N 3.35Å; F128-V130 PolarHBondContact O-N 2.94Å; F128-A131 PolarHBondContact O-N 3.39Å; F128-M132 HydrophobicContact CD2-CG 3.62Å; F128-M132 HydrophobicContact CD2-SD 4.45Å; F128-M132 HydrophobicContact CE1-CG 4.15Å; F128-M132 HydrophobicContact CE2-CG 3.17Å; F128-M132 HydrophobicContact CE2-SD 3.65Å; F128-M132 HydrophobicContact CG-CG 4.31Å; F128-M132 HydrophobicContact CZ-CG 3.5Å; F128-M132 VanDerWaalsContact CZ-CG 3.5Å; F128-M132 HydrophobicContact CZ-SD 4.12Å; F128-M132 WeakPolarHBondContact O-CB 3.41Å; F128-M132 WeakPolarHBondContact O-CG 3.1Å; F128-M132 PolarHBondContact O-N 3.33Å; F128-F151 AromaticContact CE2-CE1 3.72Å; F128-F151 HydrophobicContact CE2-CE1 3.72Å; F128-F151 HydrophobicContact CE2-CZ 4.27Å; F128-F151 AromaticContact CZ-CE1 3.8Å; F128-F151 HydrophobicContact CZ-CE1 3.8Å; F128-F151 HydrophobicContact CZ-CZ 4.1Å; F128-M164 HydrophobicContact CD1-CE 3.69Å; F128-M164 HydrophobicContact CD1-SD 4.2Å; F128-M164 HydrophobicContact CE1-CB 4.32Å; F128-M164 HydrophobicContact CE1-CE 4.38Å; F128-L165 HydrophobicContact CE1-CD2 4.43Å; F128-L165 HydrophobicContact CZ-CD2 3.82Å; F128-L165 HydrophobicContact CZ-CG 4.24Å; F128-F168 AromaticContact CD1-CE2 3.89Å; F128-F168 HydrophobicContact CD1-CE2 3.89Å; F128-F168 HydrophobicContact CE1-CD2 4.31Å; F128-F168 AromaticContact CE1-CE2 3.87Å; F128-F168 HydrophobicContact CE1-CE2 3.87Å; F128-L236 HydrophobicContact CD2-CD2 3.6Å; F128-L236 HydrophobicContact CE2-CD2 4.03Å; F128-L236 HydrophobicContact CG-CD2 4.42Å; F128-L236 PolarHBondContact N-O 2.85Å
129	R	98.3	Very high	96.7	Very high	93 Å²	93	55.4 Å²	55.4	35%	0.351	27%	0.272	S	S	.	.	H	α-helix	trans	-58.5	-46.1	174.6	-177.8	178.7	-173.7	97.1	9.4	111.4	Q125 H126 K127 L133 E167 F168	Q125-R129 WeakPolarHBondContact O-CB 3.13Å; Q125-R129 PolarHBondContact O-N 3.2Å; H126-R129 WeakPolarHBondContact O-CB 3.42Å; H126-R129 PolarHBondContact O-N 3.16Å; K127-R129 VanDerWaalsContact C-N 3.33Å; K127-R129 PolarHBondContact O-N 2.85Å; R129-L133 HydrophobicContact CG-CD1 3.62Å; R129-L133 HydrophobicContact CG-CG 4.17Å; R129-L133 VanDerWaalsContact O-CB 3.31Å; R129-L133 WeakPolarHBondContact O-CB 3.44Å; R129-L133 VanDerWaalsContact O-CG 3.27Å; R129-L133 WeakPolarHBondContact O-CG 3.45Å; R129-L133 PolarHBondContact O-N 2.81Å; R129-E167 IonicContact CZ-OE1 3.24Å; R129-E167 VanDerWaalsContact NH1-CD 3.29Å; R129-E167 IonicContact NH1-OE1 3.3Å; R129-E167 PolarHBondContact NH1-OE1 2.87Å; R129-E167 IonicContact NH1-OE2 2.74Å; R129-E167 PolarHBondContact NH1-OE2 3.48Å; R129-E167 VanDerWaalsContact NH1-OE2 3.14Å; R129-E167 IonicContact NH2-OE1 3.21Å; R129-E167 PolarHBondContact NH2-OE1 2.98Å; R129-F168 HydrophobicContact CB-CE1 4.4Å; R129-F168 HydrophobicContact CB-CE2 4.21Å; R129-F168 HydrophobicContact CB-CZ 3.73Å; R129-F168 HydrophobicContact CG-CE1 3.86Å; R129-F168 HydrophobicContact CG-CE2 4.45Å; R129-F168 HydrophobicContact CG-CZ 3.7Å
130	V	98.3	Very high	97	Very high	43 Å²	43	58.3 Å²	58.3	26%	0.261	28%	0.284	S	S	.	.	H	α-helix	trans	-60.6	-47	176.5	171.5	0	0	0	0	110.9	H126 K127 F128 S134 K239	H126-V130 WeakPolarHBondContact O-CG2 3.42Å; H126-V130 PolarHBondContact O-N 2.84Å; K127-V130 WeakPolarHBondContact O-CB 3.48Å; K127-V130 PolarHBondContact O-N 3.25Å; K127-V130 VanDerWaalsContact O-N 3.14Å; F128-V130 VanDerWaalsContact C-N 3.35Å; F128-V130 PolarHBondContact O-N 2.94Å; V130-S134 VanDerWaalsContact O-CB 3.29Å; V130-S134 WeakPolarHBondContact O-CB 3.47Å; V130-S134 PolarHBondContact O-N 3.39Å; V130-S134 PolarHBondContact O-OG 3.13Å; V130-K239 HydrophobicContact CG1-CB 4.04Å; V130-K239 HydrophobicContact CG1-CD 4.32Å; V130-K239 HydrophobicContact CG1-CG 4.1Å
131	A	98.5	Very high	97.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.7	-53	178.7	0	0	0	0	0	111.5	K127 F128 S134 M135 L236 L238 Y240	K127-A131 PolarHBondContact O-N 3.33Å; F128-A131 PolarHBondContact O-N 3.39Å; A131-S134 PolarHBondContact O-OG 3.14Å; A131-M135 WeakPolarHBondContact O-CB 3.43Å; A131-M135 PolarHBondContact O-N 2.98Å; A131-L236 WeakPolarHBondContact CB-O 3.46Å; A131-L238 WeakPolarHBondContact CA-O 3.4Å; A131-L238 VanDerWaalsContact CB-O 3.26Å; A131-L238 WeakPolarHBondContact CB-O 3.27Å; A131-L238 PolarHBondContact N-O 2.96Å; A131-Y240 HydrophobicContact CB-CE2 4.28Å; A131-Y240 VanDerWaalsContact O-CD2 3.23Å; A131-Y240 WeakPolarHBondContact O-CD2 3.46Å; A131-Y240 WeakPolarHBondContact O-CE2 3.48Å
132	M	98.3	Very high	97.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.8	-47.4	-177	-70.7	-57.2	-58.8	0	0	112.8	M113 F128 S134 M135 V136 L149 L165 F168 L169	M113-M132 HydrophobicContact CE-SD 4.22Å; M113-M132 HydrophobicContact SD-SD 4.32Å; F128-M132 HydrophobicContact CD2-CG 3.62Å; F128-M132 HydrophobicContact CD2-SD 4.45Å; F128-M132 HydrophobicContact CE1-CG 4.15Å; F128-M132 HydrophobicContact CE2-CG 3.17Å; F128-M132 HydrophobicContact CE2-SD 3.65Å; F128-M132 HydrophobicContact CG-CG 4.31Å; F128-M132 HydrophobicContact CZ-CG 3.5Å; F128-M132 VanDerWaalsContact CZ-CG 3.5Å; F128-M132 HydrophobicContact CZ-SD 4.12Å; F128-M132 WeakPolarHBondContact O-CB 3.41Å; F128-M132 WeakPolarHBondContact O-CG 3.1Å; F128-M132 PolarHBondContact O-N 3.33Å; M132-S134 VanDerWaalsContact C-N 3.34Å; M132-S134 PolarHBondContact O-N 3.19Å; M132-M135 HydrophobicContact CE-CE 3.49Å; M132-M135 VanDerWaalsContact CE-CE 3.49Å; M132-M135 PolarHBondContact O-N 3.42Å; M132-M135 HydrophobicContact SD-CE 4.03Å; M132-V136 WeakPolarHBondContact O-CB 3.41Å; M132-V136 VanDerWaalsContact O-CG2 3.26Å; M132-V136 WeakPolarHBondContact O-CG2 3.22Å; M132-V136 PolarHBondContact O-N 2.77Å; M132-L149 HydrophobicContact CE-CD1 3.86Å; M132-L165 HydrophobicContact CE-CD2 3.7Å; M132-L165 HydrophobicContact SD-CD2 4.46Å; M132-F168 HydrophobicContact CB-CB 4.25Å; M132-F168 HydrophobicContact CB-CD2 3.51Å; M132-F168 HydrophobicContact CB-CE2 4.22Å; M132-F168 HydrophobicContact CB-CG 4.19Å; M132-F168 HydrophobicContact CG-CD2 3.93Å; M132-F168 HydrophobicContact CG-CE2 4.47Å; M132-L169 HydrophobicContact CE-CD2 4.34Å
133	L	97.9	Very high	97.2	Very high	68 Å²	68	56.5 Å²	56.5	36%	0.356	28%	0.277	S	S	.	.	H	α-helix	trans	-65.7	-38.1	-178.3	-67.6	179.4	0	0	0	112	R129 K137 F168	R129-L133 HydrophobicContact CG-CD1 3.62Å; R129-L133 HydrophobicContact CG-CG 4.17Å; R129-L133 VanDerWaalsContact O-CB 3.31Å; R129-L133 WeakPolarHBondContact O-CB 3.44Å; R129-L133 VanDerWaalsContact O-CG 3.27Å; R129-L133 WeakPolarHBondContact O-CG 3.45Å; R129-L133 PolarHBondContact O-N 2.81Å; L133-K137 VanDerWaalsContact O-CB 3.25Å; L133-K137 WeakPolarHBondContact O-CB 3.41Å; L133-K137 PolarHBondContact O-N 2.02Å; L133-K137 VanDerWaalsContact O-N 3.08Å; L133-F168 HydrophobicContact CD2-CB 4.11Å; L133-F168 HydrophobicContact CD2-CD1 3.94Å; L133-F168 HydrophobicContact CD2-CG 4.17Å; L133-F168 HydrophobicContact CG-CD1 4.35Å
134	S	98.3	Very high	97.2	Very high	15 Å²	15	54.8 Å²	54.8	11%	0.105	27%	0.269	C	S	.	.	H	α-helix	trans	-67.8	-38.6	174.9	60.2	0	0	0	0	112.3	V130 A131 M132 L138 Y240	V130-S134 VanDerWaalsContact O-CB 3.29Å; V130-S134 WeakPolarHBondContact O-CB 3.47Å; V130-S134 PolarHBondContact O-N 3.39Å; V130-S134 PolarHBondContact O-OG 3.13Å; A131-S134 PolarHBondContact O-OG 3.14Å; M132-S134 VanDerWaalsContact C-N 3.34Å; M132-S134 PolarHBondContact O-N 3.19Å; S134-L138 WeakPolarHBondContact O-CG 3.47Å; S134-L138 PolarHBondContact O-N 3.43Å; S134-Y240 PolarHBondContact OG-N 3.32Å
135	M	98.3	Very high	97.4	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-53.6	173.9	-173.3	-167.2	68.1	0	0	111.3	A131 M132 K137 L138 A139 L147 L149 Y240 I244	A131-M135 WeakPolarHBondContact O-CB 3.43Å; A131-M135 PolarHBondContact O-N 2.98Å; M132-M135 HydrophobicContact CE-CE 3.49Å; M132-M135 VanDerWaalsContact CE-CE 3.49Å; M132-M135 PolarHBondContact O-N 3.42Å; M132-M135 HydrophobicContact SD-CE 4.03Å; M135-K137 VanDerWaalsContact C-N 3.27Å; M135-K137 PolarHBondContact O-N 3.36Å; M135-L138 PolarHBondContact O-N 3.12Å; M135-L138 VanDerWaalsContact O-N 3.08Å; M135-A139 WeakPolarHBondContact O-CB 3.47Å; M135-A139 PolarHBondContact O-N 3.24Å; M135-L147 HydrophobicContact CE-CD2 4.11Å; M135-L147 HydrophobicContact SD-CD2 4.21Å; M135-L149 HydrophobicContact CE-CD1 4.28Å; M135-L149 HydrophobicContact CE-CD2 4.21Å; M135-L149 HydrophobicContact SD-CD2 4.43Å; M135-Y240 HydrophobicContact CB-CD1 4.47Å; M135-Y240 HydrophobicContact CB-CD2 3.56Å; M135-Y240 HydrophobicContact CB-CE2 3.77Å; M135-Y240 HydrophobicContact CB-CG 3.95Å; M135-Y240 HydrophobicContact CG-CD1 4.45Å; M135-Y240 HydrophobicContact CG-CD2 4.33Å; M135-Y240 HydrophobicContact CG-CE1 4.43Å; M135-Y240 HydrophobicContact CG-CE2 4.33Å; M135-Y240 HydrophobicContact CG-CG 4.4Å; M135-I244 HydrophobicContact CG-CB 4.3Å; M135-I244 HydrophobicContact CG-CD1 4.2Å; M135-I244 HydrophobicContact CG-CG2 4.14Å; M135-I244 HydrophobicContact SD-CD1 3.74Å; M135-I244 HydrophobicContact SD-CG2 4.48Å
136	V	98.1	Very high	97.4	Very high	15 Å²	15	52.5 Å²	52.5	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-59.9	-39.2	-176.6	172.7	0	0	0	0	111.3	M132 L138 L169 A172 F174	M132-V136 WeakPolarHBondContact O-CB 3.41Å; M132-V136 VanDerWaalsContact O-CG2 3.26Å; M132-V136 WeakPolarHBondContact O-CG2 3.22Å; M132-V136 PolarHBondContact O-N 2.77Å; V136-L138 VanDerWaalsContact C-N 3.27Å; V136-L138 PolarHBondContact O-N 3.19Å; V136-L169 HydrophobicContact CG2-CD2 3.52Å; V136-A172 HydrophobicContact CG1-CB 4.1Å; V136-F174 HydrophobicContact CG2-CZ 4.38Å
137	K	97.3	Very high	97.4	Very high	159 Å²	159	46.7 Å²	46.7	69%	0.691	23%	0.232	S	C	*	.	H	α-helix	trans	-60.5	-33.9	177.1	-179.6	-179	176.5	-173.9	0	113.4	L133 M135	L133-K137 VanDerWaalsContact O-CB 3.25Å; L133-K137 WeakPolarHBondContact O-CB 3.41Å; L133-K137 PolarHBondContact O-N 2.02Å; L133-K137 VanDerWaalsContact O-N 3.08Å; M135-K137 VanDerWaalsContact C-N 3.27Å; M135-K137 PolarHBondContact O-N 3.36Å
138	L	97.4	Very high	97.5	Very high	63 Å²	63	45.2 Å²	45.2	33%	0.33	23%	0.226	S	C	.	.	H	α-helix	trans	-110.1	-16.6	-169.9	-62.6	175.2	0	0	0	113.7	S134 M135 V136 H140 Y240 K241 N243	S134-L138 WeakPolarHBondContact O-CG 3.47Å; S134-L138 PolarHBondContact O-N 3.43Å; M135-L138 PolarHBondContact O-N 3.12Å; M135-L138 VanDerWaalsContact O-N 3.08Å; V136-L138 VanDerWaalsContact C-N 3.27Å; V136-L138 PolarHBondContact O-N 3.19Å; L138-H140 PolarHBondContact O-N 3.38Å; L138-Y240 VanDerWaalsContact CD1-O 3.27Å; L138-Y240 WeakPolarHBondContact CD1-O 3.33Å; L138-K241 VanDerWaalsContact CD1-C 3.46Å; L138-N243 WeakPolarHBondContact O-CA 3.44Å
139	A	97.7	Very high	97.5	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.033	23%	0.226	C	C	.	.			trans	-69.6	130.8	-178.3	0	0	0	0	0	111.2	M135 F141 F174 N243 I244	M135-A139 WeakPolarHBondContact O-CB 3.47Å; M135-A139 PolarHBondContact O-N 3.24Å; A139-F141 HydrophobicContact CB-CE2 4.05Å; A139-F174 HydrophobicContact CB-CD1 3.96Å; A139-F174 HydrophobicContact CB-CE1 3.43Å; A139-F174 VanDerWaalsContact CB-CE1 3.43Å; A139-F174 HydrophobicContact CB-CZ 3.89Å; A139-F174 WeakPolarHBondContact O-CD1 3.49Å; A139-N243 WeakPolarHBondContact CA-OD1 3.42Å; A139-I244 HydrophobicContact CB-CG2 4.03Å
140	H	97.1	Very high	97.5	Very high	115 Å²	115	41.2 Å²	41.2	53%	0.532	21%	0.211	S	C	.	.			trans	-139.1	124.2	176.7	177.4	-82.3	0	0	0	109.6	L138 N243 R245	L138-H140 PolarHBondContact O-N 3.38Å; H140-N243 PolarHBondContact N-OD1 2.79Å; H140-N243 PolarHBondContact O-ND2 3.19Å; H140-N243 PolarHBondContact O-OD1 3.18Å; H140-R245 VanDerWaalsContact O-CD 3.23Å; H140-R245 WeakPolarHBondContact O-CD 3.45Å
141	F	97	Very high	97.6	Very high	17 Å²	17	39.2 Å²	39.2	8%	0.075	20%	0.199	C	C	.	.			trans	-123.2	145.8	-179.2	-70.6	-88.7	0	0	0	109.8	Y109 A139 E145 L147 F174 I244 R245	Y109-F141 HydrophobicContact CD1-CE1 4.39Å; Y109-F141 AromaticContact CD2-CD1 3.76Å; Y109-F141 HydrophobicContact CD2-CD1 3.76Å; Y109-F141 AromaticContact CD2-CE1 3.58Å; Y109-F141 HydrophobicContact CD2-CE1 3.58Å; Y109-F141 HydrophobicContact CE2-CD1 4Å; Y109-F141 HydrophobicContact CE2-CE1 4.13Å; Y109-F141 HydrophobicContact CG-CD1 4.37Å; Y109-F141 AromaticContact CG-CE1 3.72Å; Y109-F141 HydrophobicContact CG-CE1 3.72Å; A139-F141 HydrophobicContact CB-CE2 4.05Å; F141-E145 HydrophobicContact CB-CB 3.99Å; F141-E145 HydrophobicContact CD1-CB 4.16Å; F141-L147 HydrophobicContact CD2-CB 4.43Å; F141-L147 HydrophobicContact CE1-CB 4.33Å; F141-L147 HydrophobicContact CE2-CB 3.83Å; F141-L147 HydrophobicContact CE2-CD2 3.91Å; F141-L147 HydrophobicContact CE2-CG 4.3Å; F141-L147 HydrophobicContact CZ-CB 3.78Å; F141-L147 HydrophobicContact CZ-CD1 3.93Å; F141-L147 HydrophobicContact CZ-CD2 4.07Å; F141-L147 HydrophobicContact CZ-CG 4.13Å; F141-F174 HydrophobicContact CB-CB 4.01Å; F141-F174 HydrophobicContact CD2-CB 3.81Å; F141-F174 HydrophobicContact CD2-CD1 4.26Å; F141-F174 AromaticContact CD2-CD2 3.98Å; F141-F174 HydrophobicContact CD2-CD2 3.98Å; F141-F174 AromaticContact CD2-CG 3.75Å; F141-F174 HydrophobicContact CD2-CG 3.75Å; F141-F174 HydrophobicContact CE2-CD2 4.3Å; F141-F174 HydrophobicContact CE2-CG 4.39Å; F141-F174 HydrophobicContact CG-CB 4.35Å; F141-I244 HydrophobicContact CE2-CG2 4.11Å; F141-I244 HydrophobicContact CZ-CG2 3.91Å; F141-R245 HydrophobicContact CD1-CB 4.34Å; F141-R245 HydrophobicContact CD1-CG 4.23Å; F141-R245 HydrophobicContact CE1-CB 3.94Å; F141-R245 HydrophobicContact CE1-CG 4.1Å; F141-R245 HydrophobicContact CZ-CB 4.2Å
142	L	95.9	Very high	97.5	Very high	88 Å²	88	39.2 Å²	39.2	46%	0.461	20%	0.199	S	C	.	.			trans	-74.9	168	179.5	-56.8	-179.4	0	0	0	111.6	G144 E145	L142-G144 PolarHBondContact O-N 2.81Å; L142-E145 HydrophobicContact CB-CG 4.03Å; L142-E145 PolarHBondContact N-OE2 2.86Å; L142-E145 WeakPolarHBondContact O-CB 3.3Å; L142-E145 PolarHBondContact O-N 2.88Å
143	E	93.7	Very high	97.4	Very high	201 Å²	201	39.2 Å²	39.2	94%	0.939	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	129	173.9	-172.2	174	-172.8	0	0	111	E145	E143-E145 VanDerWaalsContact C-N 3.29Å; E143-E145 PolarHBondContact O-N 3.5Å
144	G	94.4	Very high	97.2	Very high	29 Å²	29	37.8 Å²	37.8	30%	0.299	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-13.1	-176.2	0	0	0	0	0	114.3	G106 L142	G106-G144 CarbonylContact C-O 3.43Å; G106-G144 WeakPolarHBondContact CA-O 3.34Å; L142-G144 PolarHBondContact O-N 2.81Å
145	E	97.5	Very high	97	Very high	18 Å²	18	42 Å²	42	8%	0.084	21%	0.21	C	C	.	.			trans	-80.9	142.3	175.4	-63	-177.7	165.7	0	0	111.4	Q107 Y109 F141 L142 E143 R245	Q107-E145 HydrophobicContact CB-CG 4.3Å; Q107-E145 CarbonylContact O-C 3.6Å; Q107-E145 VanDerWaalsContact O-CA 3.29Å; Q107-E145 WeakPolarHBondContact O-CA 3.28Å; Y109-E145 HydrophobicContact CD2-CB 4.36Å; Y109-E145 HydrophobicContact CE2-CB 3.87Å; Y109-E145 HydrophobicContact CE2-CG 3.83Å; Y109-E145 PolarHBondContact OH-OE1 2.96Å; Y109-E145 VanDerWaalsContact OH-OE1 3.14Å; F141-E145 HydrophobicContact CB-CB 3.99Å; F141-E145 HydrophobicContact CD1-CB 4.16Å; L142-E145 HydrophobicContact CB-CG 4.03Å; L142-E145 PolarHBondContact N-OE2 2.86Å; L142-E145 WeakPolarHBondContact O-CB 3.3Å; L142-E145 PolarHBondContact O-N 2.88Å; E143-E145 VanDerWaalsContact C-N 3.29Å; E143-E145 PolarHBondContact O-N 3.5Å; E145-R245 IonicContact OE1-CZ 3.54Å; E145-R245 IonicContact OE1-NE 2.73Å; E145-R245 PolarHBondContact OE1-NE 3.48Å; E145-R245 IonicContact OE1-NH2 3.63Å; E145-R245 PolarHBondContact OE1-NH2 2.88Å; E145-R245 WeakPolarHBondContact OE2-CD 3.38Å; E145-R245 IonicContact OE2-CZ 2.83Å; E145-R245 IonicContact OE2-NE 2.73Å; E145-R245 PolarHBondContact OE2-NE 3.39Å; E145-R245 IonicContact OE2-NH2 3.41Å
146	V	98.3	Very high	96.9	Very high	20 Å²	20	45.7 Å²	45.7	12%	0.121	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.4	-179.9	-176.8	0	0	0	0	110.3	Q107 R108 Y109 V148 K175 E177	Q107-V146 PolarHBondContact O-N 3.32Å; R108-V146 WeakPolarHBondContact CA-O 3.29Å; Y109-V146 PolarHBondContact N-O 3.37Å; V146-V148 HydrophobicContact CG1-CG2 4.31Å; V146-K175 HydrophobicContact CG2-CB 4.07Å; V146-E177 HydrophobicContact CG1-CB 4.49Å; V146-E177 HydrophobicContact CG1-CG 4Å
147	L	98.5	Very high	96.8	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115.9	168.9	179	60.9	0	0	0	110.1	A111 M135 F141 L149 F174 K175 Y176 E177 I244	A111-L147 HydrophobicContact CB-CD1 4.35Å; M135-L147 HydrophobicContact CE-CD2 4.11Å; M135-L147 HydrophobicContact SD-CD2 4.21Å; F141-L147 HydrophobicContact CD2-CB 4.43Å; F141-L147 HydrophobicContact CE1-CB 4.33Å; F141-L147 HydrophobicContact CE2-CB 3.83Å; F141-L147 HydrophobicContact CE2-CD2 3.91Å; F141-L147 HydrophobicContact CE2-CG 4.3Å; F141-L147 HydrophobicContact CZ-CB 3.78Å; F141-L147 HydrophobicContact CZ-CD1 3.93Å; F141-L147 HydrophobicContact CZ-CD2 4.07Å; F141-L147 HydrophobicContact CZ-CG 4.13Å; L147-L149 HydrophobicContact CD1-CD2 4.39Å; L147-L149 HydrophobicContact CD2-CD2 4.04Å; L147-L149 HydrophobicContact CD2-CG 4.4Å; L147-L149 HydrophobicContact CG-CD2 4.08Å; L147-L149 HydrophobicContact CG-CG 4.24Å; L147-F174 HydrophobicContact CB-CD2 4.35Å; L147-F174 HydrophobicContact CB-CE2 4.34Å; L147-F174 HydrophobicContact CD2-CE2 3.89Å; L147-F174 HydrophobicContact CD2-CZ 4.39Å; L147-K175 PolarHBondContact N-O 2.92Å; L147-Y176 CarbonylContact O-C 3.49Å; L147-Y176 WeakPolarHBondContact O-CA 3.25Å; L147-Y176 WeakPolarHBondContact O-CB 2.93Å; L147-E177 PolarHBondContact O-N 3.47Å; L147-I244 HydrophobicContact CD2-CG2 4.47Å
148	V	98.7	Very high	96.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.2	176.9	-168.7	0	0	0	0	108.7	R108 Y109 H110 A111 V146 H150 E177 I179	R108-V148 HydrophobicContact CB-CG2 4.29Å; Y109-V148 PolarHBondContact O-N 3.43Å; H110-V148 WeakPolarHBondContact CA-O 3.42Å; A111-V148 PolarHBondContact N-O 3.28Å; V146-V148 HydrophobicContact CG1-CG2 4.31Å; V148-H150 VanDerWaalsContact CG1-NE2 3.34Å; V148-H150 WeakPolarHBondContact CG1-NE2 3.44Å; V148-E177 WeakPolarHBondContact CA-O 3.32Å; V148-E177 HydrophobicContact CG1-CB 4.23Å; V148-E177 HydrophobicContact CG2-CB 4.42Å; V148-I179 HydrophobicContact CG1-CD1 3.57Å; V148-I179 HydrophobicContact CG1-CG1 4Å
149	L	98.8	Very high	96.8	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	111.7	179.7	-64.8	171	0	0	0	109.8	A111 M132 M135 L147 F151 L169 E177 I178 I179	A111-L149 HydrophobicContact CB-CD2 4.14Å; A111-L149 CarbonylContact O-C 3.5Å; M132-L149 HydrophobicContact CE-CD1 3.86Å; M135-L149 HydrophobicContact CE-CD1 4.28Å; M135-L149 HydrophobicContact CE-CD2 4.21Å; M135-L149 HydrophobicContact SD-CD2 4.43Å; L147-L149 HydrophobicContact CD1-CD2 4.39Å; L147-L149 HydrophobicContact CD2-CD2 4.04Å; L147-L149 HydrophobicContact CD2-CG 4.4Å; L147-L149 HydrophobicContact CG-CD2 4.08Å; L147-L149 HydrophobicContact CG-CG 4.24Å; L149-F151 HydrophobicContact CB-CE2 3.68Å; L149-F151 HydrophobicContact CB-CZ 4.1Å; L149-L169 HydrophobicContact CD1-CD1 4.12Å; L149-L169 HydrophobicContact CD1-CD2 4.49Å; L149-E177 PolarHBondContact N-O 3.18Å; L149-I178 WeakPolarHBondContact O-CA 3.31Å; L149-I179 PolarHBondContact O-N 3.05Å
150	H	98.8	Very high	96.7	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.037	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.8	176.5	-63.5	-118.7	0	0	0	109.4	H110 A111 L112 M113 V148 I179 H181	H110-H150 AromaticContact CE1-NE2 3.87Å; H110-H150 AromaticContact CG-NE2 3.78Å; H110-H150 AromaticContact ND1-CD2 3.91Å; H110-H150 AromaticContact ND1-CE1 3.72Å; H110-H150 AromaticContact ND1-NE2 2.87Å; H110-H150 PolarHBondContact ND1-NE2 3.03Å; A111-H150 PolarHBondContact O-N 3.19Å; L112-H150 CarbonylContact C-O 3.46Å; L112-H150 VanDerWaalsContact CA-O 3.28Å; L112-H150 WeakPolarHBondContact CA-O 3.43Å; L112-H150 HydrophobicContact CB-CB 3.91Å; L112-H150 HydrophobicContact CD1-CB 3.99Å; L112-H150 HydrophobicContact CG-CB 3.96Å; M113-H150 PolarHBondContact N-O 3.39Å; V148-H150 VanDerWaalsContact CG1-NE2 3.34Å; V148-H150 WeakPolarHBondContact CG1-NE2 3.44Å; H150-I179 CarbonylContact C-O 3.59Å; H150-I179 VanDerWaalsContact CA-O 3.27Å; H150-I179 WeakPolarHBondContact CA-O 3.48Å; H150-H181 AromaticContact CE1-NE2 3.98Å; H150-H181 AromaticContact CG-NE2 3.64Å; H150-H181 AromaticContact ND1-CE1 3.6Å; H150-H181 AromaticContact ND1-NE2 2.93Å; H150-H181 PolarHBondContact ND1-NE2 2.85Å
151	F	98.5	Very high	96.7	Very high	1 Å²	1	36.2 Å²	36.2	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.5	174.4	-64.8	-78.4	0	0	0	109.4	M113 F115 F128 L149 L165 I178 I179 F180 H181	M113-F151 HydrophobicContact CB-CD1 4.09Å; M113-F151 HydrophobicContact CB-CE1 4.13Å; M113-F151 HydrophobicContact CG-CE1 4.42Å; M113-F151 WeakPolarHBondContact O-CA 3.24Å; M113-F151 HydrophobicContact SD-CE1 3.86Å; F115-F151 HydrophobicContact CB-CB 4.16Å; F115-F151 HydrophobicContact CB-CD1 4.01Å; F115-F151 HydrophobicContact CD2-CD1 4.27Å; F115-F151 HydrophobicContact CG-CD1 4.17Å; F128-F151 AromaticContact CE2-CE1 3.72Å; F128-F151 HydrophobicContact CE2-CE1 3.72Å; F128-F151 HydrophobicContact CE2-CZ 4.27Å; F128-F151 AromaticContact CZ-CE1 3.8Å; F128-F151 HydrophobicContact CZ-CE1 3.8Å; F128-F151 HydrophobicContact CZ-CZ 4.1Å; L149-F151 HydrophobicContact CB-CE2 3.68Å; L149-F151 HydrophobicContact CB-CZ 4.1Å; F151-L165 HydrophobicContact CD2-CD1 3.93Å; F151-L165 HydrophobicContact CE2-CD1 3.41Å; F151-L165 VanDerWaalsContact CE2-CD1 3.41Å; F151-L165 HydrophobicContact CE2-CD2 4.09Å; F151-L165 HydrophobicContact CE2-CG 4.39Å; F151-L165 HydrophobicContact CZ-CD1 3.85Å; F151-L165 HydrophobicContact CZ-CD2 3.81Å; F151-L165 HydrophobicContact CZ-CG 4.43Å; F151-I178 HydrophobicContact CD2-CG2 3.99Å; F151-I178 HydrophobicContact CE2-CG2 4.05Å; F151-I179 PolarHBondContact N-O 2.88Å; F151-F180 HydrophobicContact CB-CD1 3.55Å; F151-F180 HydrophobicContact CB-CE1 3.63Å; F151-F180 HydrophobicContact CB-CG 4.44Å; F151-F180 HydrophobicContact CD2-CE1 4.08Å; F151-F180 HydrophobicContact CD2-CZ 4.22Å; F151-F180 HydrophobicContact CG-CD1 4.38Å; F151-F180 HydrophobicContact CG-CE1 4.02Å; F151-F180 CarbonylContact O-C 3.5Å; F151-F180 WeakPolarHBondContact O-CA 3.44Å; F151-H181 PolarHBondContact O-N 3.01Å
152	V	97.6	Very high	96.7	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	113.5	170.5	179.6	0	0	0	0	108.2	L112 M113 M114 F115 H181 V183 L186 I213 L216	L112-V152 HydrophobicContact CD1-CG2 4.06Å; L112-V152 HydrophobicContact CD2-CG2 4.08Å; L112-V152 HydrophobicContact CG-CG2 4.25Å; M113-V152 PolarHBondContact O-N 2.87Å; M114-V152 HydrophobicContact CE-CB 3.8Å; M114-V152 HydrophobicContact CE-CG1 3.68Å; M114-V152 HydrophobicContact SD-CB 3.84Å; M114-V152 HydrophobicContact SD-CG1 4.28Å; M114-V152 HydrophobicContact SD-CG2 4.02Å; F115-V152 CarbonylContact C-O 3.54Å; F115-V152 VanDerWaalsContact C-O 3.28Å; F115-V152 WeakPolarHBondContact CA-O 3.44Å; F115-V152 PolarHBondContact N-O 3.15Å; V152-H181 WeakPolarHBondContact CA-O 3.35Å; V152-H181 HydrophobicContact CG2-CB 4.28Å; V152-V183 HydrophobicContact CG1-CB 4.08Å; V152-V183 HydrophobicContact CG1-CG2 4.24Å; V152-L186 HydrophobicContact CB-CD1 4.36Å; V152-L186 HydrophobicContact CG1-CD1 3.81Å; V152-L186 HydrophobicContact CG2-CD1 3.65Å; V152-I213 HydrophobicContact CG1-CD1 3.92Å; V152-I213 HydrophobicContact CG1-CG1 4.24Å; V152-L216 HydrophobicContact CG2-CD2 3.75Å
153	S	96	Very high	96.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	152.8	-168.3	55.9	0	0	0	0	112.8	F115 F180 H181 V183	F115-S153 VanDerWaalsContact O-CA 3.32Å; F115-S153 WeakPolarHBondContact O-CA 3.42Å; F115-S153 WeakPolarHBondContact O-CB 3.06Å; S153-F180 WeakPolarHBondContact OG-CD1 3.39Å; S153-H181 PolarHBondContact N-O 3.45Å; S153-V183 PolarHBondContact O-N 3.39Å; S153-V183 VanDerWaalsContact O-N 3.09Å
154	D	93.5	Very high	97	Very high	37 Å²	37	34.2 Å²	34.2	20%	0.198	17%	0.17	C	C	.	.			trans	-76	162.6	155.8	62	84.2	0	0	0	110.6	T116 K117 V156 S157 Q158 V183	T116-D154 WeakPolarHBondContact CA-OD2 3.49Å; K117-D154 PolarHBondContact N-OD2 2.89Å; D154-V156 VanDerWaalsContact C-N 3.3Å; D154-V156 PolarHBondContact O-N 2.92Å; D154-V156 PolarHBondContact OD1-N 3.34Å; D154-S157 PolarHBondContact O-N 2.97Å; D154-S157 PolarHBondContact OD1-N 3.49Å; D154-S157 PolarHBondContact OD1-OG 2.93Å; D154-S157 WeakPolarHBondContact OD2-CB 3.44Å; D154-S157 PolarHBondContact OD2-OG 3.06Å; D154-Q158 PolarHBondContact O-N 3.23Å; D154-V183 HydrophobicContact CB-CG1 4.07Å
155	Q	94.1	Very high	97.2	Very high	105 Å²	105	33 Å²	33	49%	0.491	16%	0.157	S	C	.	.	H	α-helix	trans	-54.8	-41.4	-176	-176.9	64.1	30.8	0	0	113.4	Q158 E159	Q155-Q158 WeakPolarHBondContact O-CB 3.42Å; Q155-Q158 PolarHBondContact O-N 2.82Å; Q155-E159 PolarHBondContact NE2-OE1 3.29Å; Q155-E159 VanDerWaalsContact NE2-OE1 3.15Å; Q155-E159 PolarHBondContact O-N 3.02Å
156	V	95.7	Very high	97.1	Very high	78 Å²	78	39.2 Å²	39.2	47%	0.473	19%	0.186	S	C	.	.	H	α-helix	trans	-72.1	-43.2	-176.3	-174	0	0	0	0	110.3	D119 D154 Q158 E159 L160	D119-V156 HydrophobicContact CB-CG1 3.75Å; D154-V156 VanDerWaalsContact C-N 3.3Å; D154-V156 PolarHBondContact O-N 2.92Å; D154-V156 PolarHBondContact OD1-N 3.34Å; V156-Q158 VanDerWaalsContact C-N 3.32Å; V156-Q158 PolarHBondContact O-N 3.3Å; V156-E159 PolarHBondContact O-N 3.34Å; V156-L160 PolarHBondContact O-N 2.8Å
157	S	96.1	Very high	97.1	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-40.5	173.4	-62.7	0	0	0	0	111.1	F115 K117 V118 D154 E159 L160 G161	F115-S157 VanDerWaalsContact CE1-O 3.27Å; F115-S157 WeakPolarHBondContact CE1-O 3.39Å; F115-S157 WeakPolarHBondContact O-CB 3.37Å; K117-S157 PolarHBondContact N-OG 3.35Å; V118-S157 PolarHBondContact N-OG 2.88Å; D154-S157 PolarHBondContact O-N 2.97Å; D154-S157 PolarHBondContact OD1-N 3.49Å; D154-S157 PolarHBondContact OD1-OG 2.93Å; D154-S157 WeakPolarHBondContact OD2-CB 3.44Å; D154-S157 PolarHBondContact OD2-OG 3.06Å; S157-E159 PolarHBondContact O-N 3.12Å; S157-L160 PolarHBondContact O-N 3.13Å; S157-G161 PolarHBondContact O-N 3.04Å
158	Q	97.1	Very high	97	Very high	43 Å²	43	43.3 Å²	43.3	20%	0.201	20%	0.203	C	C	.	.	H	α-helix	trans	-57	-49.7	176.2	177.4	171.8	-30.8	0	0	112.3	D154 Q155 V156 L160 G161 Q162 F180	D154-Q158 PolarHBondContact O-N 3.23Å; Q155-Q158 WeakPolarHBondContact O-CB 3.42Å; Q155-Q158 PolarHBondContact O-N 2.82Å; V156-Q158 VanDerWaalsContact C-N 3.32Å; V156-Q158 PolarHBondContact O-N 3.3Å; Q158-L160 VanDerWaalsContact C-N 3.31Å; Q158-L160 PolarHBondContact O-N 2.78Å; Q158-G161 PolarHBondContact O-N 2.87Å; Q158-Q162 WeakPolarHBondContact O-CG 3.48Å; Q158-Q162 PolarHBondContact O-N 2.89Å; Q158-F180 HydrophobicContact CB-CD1 4.12Å; Q158-F180 HydrophobicContact CB-CE1 4.37Å; Q158-F180 HydrophobicContact CG-CB 4.16Å; Q158-F180 HydrophobicContact CG-CD1 3.7Å; Q158-F180 HydrophobicContact CG-CD2 4.06Å; Q158-F180 HydrophobicContact CG-CE1 4.03Å; Q158-F180 HydrophobicContact CG-CE2 4.37Å; Q158-F180 HydrophobicContact CG-CG 3.7Å; Q158-F180 HydrophobicContact CG-CZ 4.35Å
159	E	97.4	Very high	97	Very high	87 Å²	87	43.4 Å²	43.4	41%	0.407	20%	0.204	S	C	.	.	H	α-helix	trans	-61.6	-39.8	-179.6	-71.2	172.5	-165	0	0	112.3	Q155 V156 S157 R163	Q155-E159 PolarHBondContact NE2-OE1 3.29Å; Q155-E159 VanDerWaalsContact NE2-OE1 3.15Å; Q155-E159 PolarHBondContact O-N 3.02Å; V156-E159 PolarHBondContact O-N 3.34Å; S157-E159 PolarHBondContact O-N 3.12Å; E159-R163 PolarHBondContact O-NH1 2.96Å
160	L	97.1	Very high	96.7	Very high	26 Å²	26	50.4 Å²	50.4	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-66.3	-46.8	173.3	177	61.8	0	0	0	111.6	V118 D119 Q125 V156 S157 Q158 Q162 R163 M164	V118-L160 HydrophobicContact CG1-CD2 4.3Å; D119-L160 HydrophobicContact CB-CD2 4.27Å; Q125-L160 HydrophobicContact CG-CD2 4.16Å; V156-L160 PolarHBondContact O-N 2.8Å; S157-L160 PolarHBondContact O-N 3.13Å; Q158-L160 VanDerWaalsContact C-N 3.31Å; Q158-L160 PolarHBondContact O-N 2.78Å; L160-Q162 VanDerWaalsContact C-N 3.31Å; L160-Q162 PolarHBondContact O-N 2.84Å; L160-R163 PolarHBondContact O-N 2.88Å; L160-R163 VanDerWaalsContact O-N 3.15Å; L160-M164 HydrophobicContact CD1-CG 4.27Å; L160-M164 HydrophobicContact CD1-SD 4.21Å; L160-M164 HydrophobicContact CD2-SD 4.35Å; L160-M164 HydrophobicContact CG-CG 4.39Å; L160-M164 HydrophobicContact CG-SD 3.89Å; L160-M164 WeakPolarHBondContact O-CG 3.29Å; L160-M164 PolarHBondContact O-N 2.97Å
161	G	96.5	Very high	96.3	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-58.8	-40.7	-179.8	0	0	0	0	0	112.3	S157 Q158 R163 M164 L165	S157-G161 PolarHBondContact O-N 3.04Å; Q158-G161 PolarHBondContact O-N 2.87Å; G161-R163 VanDerWaalsContact C-N 3.33Å; G161-R163 PolarHBondContact O-N 2.65Å; G161-M164 PolarHBondContact O-N 2.92Å; G161-L165 VanDerWaalsContact O-CB 3.26Å; G161-L165 WeakPolarHBondContact O-CB 3.45Å; G161-L165 WeakPolarHBondContact O-CG 3.35Å; G161-L165 PolarHBondContact O-N 3.5Å
162	Q	97.5	Very high	96.2	Very high	96 Å²	96	57.7 Å²	57.7	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-57.3	-44.2	175.1	-75.7	176.6	-13.3	0	0	112.4	Q158 L160 Q166 F180	Q158-Q162 WeakPolarHBondContact O-CG 3.48Å; Q158-Q162 PolarHBondContact O-N 2.89Å; L160-Q162 VanDerWaalsContact C-N 3.31Å; L160-Q162 PolarHBondContact O-N 2.84Å; Q162-Q166 WeakPolarHBondContact O-CB 3.31Å; Q162-Q166 PolarHBondContact O-N 2.92Å; Q162-F180 HydrophobicContact CG-CE2 3.68Å; Q162-F180 HydrophobicContact CG-CZ 3.95Å
163	R	97.3	Very high	96	Very high	148 Å²	148	62.7 Å²	62.7	56%	0.558	31%	0.311	S	S	*	.	H	α-helix	trans	-66.9	-44.4	177.4	-65.4	-173.3	-65.4	-88	4.6	111.9	E159 L160 G161 Q166 E167	E159-R163 PolarHBondContact O-NH1 2.96Å; L160-R163 PolarHBondContact O-N 2.88Å; L160-R163 VanDerWaalsContact O-N 3.15Å; G161-R163 VanDerWaalsContact C-N 3.33Å; G161-R163 PolarHBondContact O-N 2.65Å; R163-Q166 PolarHBondContact O-N 2.75Å; R163-E167 PolarHBondContact O-N 2.88Å
164	M	97.9	Very high	96	Very high	21 Å²	21	63.5 Å²	63.5	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-45.2	178.3	-67	178.6	78	0	0	111.6	F115 Q125 F128 L160 G161 Q166 E167 F168	F115-M164 HydrophobicContact CZ-SD 4.46Å; Q125-M164 HydrophobicContact CB-CE 3.98Å; Q125-M164 HydrophobicContact CG-CE 4.35Å; Q125-M164 HydrophobicContact CG-SD 4.36Å; F128-M164 HydrophobicContact CD1-CE 3.69Å; F128-M164 HydrophobicContact CD1-SD 4.2Å; F128-M164 HydrophobicContact CE1-CB 4.32Å; F128-M164 HydrophobicContact CE1-CE 4.38Å; L160-M164 HydrophobicContact CD1-CG 4.27Å; L160-M164 HydrophobicContact CD1-SD 4.21Å; L160-M164 HydrophobicContact CD2-SD 4.35Å; L160-M164 HydrophobicContact CG-CG 4.39Å; L160-M164 HydrophobicContact CG-SD 3.89Å; L160-M164 WeakPolarHBondContact O-CG 3.29Å; L160-M164 PolarHBondContact O-N 2.97Å; G161-M164 PolarHBondContact O-N 2.92Å; M164-Q166 PolarHBondContact O-N 2.74Å; M164-E167 WeakPolarHBondContact O-CB 3.48Å; M164-E167 PolarHBondContact O-N 3.14Å; M164-F168 HydrophobicContact CB-CD2 4.44Å; M164-F168 HydrophobicContact CB-CE2 3.81Å; M164-F168 HydrophobicContact CB-CZ 3.85Å; M164-F168 HydrophobicContact CE-CE2 3.95Å; M164-F168 HydrophobicContact CE-CZ 3.69Å; M164-F168 HydrophobicContact CG-CZ 4.38Å; M164-F168 VanDerWaalsContact O-CD1 3.22Å; M164-F168 WeakPolarHBondContact O-CD1 3.2Å; M164-F168 WeakPolarHBondContact O-CD2 3.38Å; M164-F168 WeakPolarHBondContact O-CG 3.36Å; M164-F168 PolarHBondContact O-N 3Å
165	L	98	Very high	96.2	Very high	2 Å²	2	68.1 Å²	68.1	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-66.9	-35.7	-179.8	-72.9	168.4	0	0	0	112.4	F128 M132 F151 G161 E167 F168 L169 I178 F180	F128-L165 HydrophobicContact CE1-CD2 4.43Å; F128-L165 HydrophobicContact CZ-CD2 3.82Å; F128-L165 HydrophobicContact CZ-CG 4.24Å; M132-L165 HydrophobicContact CE-CD2 3.7Å; M132-L165 HydrophobicContact SD-CD2 4.46Å; F151-L165 HydrophobicContact CD2-CD1 3.93Å; F151-L165 HydrophobicContact CE2-CD1 3.41Å; F151-L165 VanDerWaalsContact CE2-CD1 3.41Å; F151-L165 HydrophobicContact CE2-CD2 4.09Å; F151-L165 HydrophobicContact CE2-CG 4.39Å; F151-L165 HydrophobicContact CZ-CD1 3.85Å; F151-L165 HydrophobicContact CZ-CD2 3.81Å; F151-L165 HydrophobicContact CZ-CG 4.43Å; G161-L165 VanDerWaalsContact O-CB 3.26Å; G161-L165 WeakPolarHBondContact O-CB 3.45Å; G161-L165 WeakPolarHBondContact O-CG 3.35Å; G161-L165 PolarHBondContact O-N 3.5Å; L165-E167 VanDerWaalsContact C-N 3.27Å; L165-E167 PolarHBondContact O-N 2.81Å; L165-F168 PolarHBondContact O-N 2.89Å; L165-L169 HydrophobicContact CB-CD1 4.27Å; L165-L169 HydrophobicContact CD2-CD1 4Å; L165-L169 VanDerWaalsContact O-CB 3.3Å; L165-L169 WeakPolarHBondContact O-CB 3.33Å; L165-L169 PolarHBondContact O-N 3Å; L165-I178 HydrophobicContact CB-CD1 4.11Å; L165-I178 HydrophobicContact CD1-CD1 4.18Å; L165-I178 HydrophobicContact CD1-CG2 4.01Å; L165-F180 HydrophobicContact CD1-CZ 3.87Å
166	Q	96.7	Very high	96.4	Very high	150 Å²	150	67.5 Å²	67.5	70%	0.701	33%	0.327	S	S	*	.	H	α-helix	trans	-59	-40.6	172.8	-174.7	180	3.8	0	0	111.5	Q162 R163 M164 Q170	Q162-Q166 WeakPolarHBondContact O-CB 3.31Å; Q162-Q166 PolarHBondContact O-N 2.92Å; R163-Q166 PolarHBondContact O-N 2.75Å; M164-Q166 PolarHBondContact O-N 2.74Å; Q166-Q170 PolarHBondContact O-N 3.27Å
167	E	96.9	Very high	96.5	Very high	98 Å²	98	67.4 Å²	67.4	46%	0.458	32%	0.321	S	S	.	.	H	α-helix	trans	-67.4	-48.5	174	-172.5	-165.2	160.3	0	0	111.3	R129 R163 M164 L165 L169	R129-E167 IonicContact CZ-OE1 3.24Å; R129-E167 VanDerWaalsContact NH1-CD 3.29Å; R129-E167 IonicContact NH1-OE1 3.3Å; R129-E167 PolarHBondContact NH1-OE1 2.87Å; R129-E167 IonicContact NH1-OE2 2.74Å; R129-E167 PolarHBondContact NH1-OE2 3.48Å; R129-E167 VanDerWaalsContact NH1-OE2 3.14Å; R129-E167 IonicContact NH2-OE1 3.21Å; R129-E167 PolarHBondContact NH2-OE1 2.98Å; R163-E167 PolarHBondContact O-N 2.88Å; M164-E167 WeakPolarHBondContact O-CB 3.48Å; M164-E167 PolarHBondContact O-N 3.14Å; L165-E167 VanDerWaalsContact C-N 3.27Å; L165-E167 PolarHBondContact O-N 2.81Å; E167-L169 PolarHBondContact O-N 2.86Å
168	F	97.8	Very high	96.6	Very high	7 Å²	7	70.5 Å²	70.5	3%	0.031	34%	0.337	C	S	.	.	H	α-helix	trans	-73.2	-28.3	-170.4	-56.6	-14.9	0	0	0	113.8	F128 R129 M132 L133 M164 L165	F128-F168 AromaticContact CD1-CE2 3.89Å; F128-F168 HydrophobicContact CD1-CE2 3.89Å; F128-F168 HydrophobicContact CE1-CD2 4.31Å; F128-F168 AromaticContact CE1-CE2 3.87Å; F128-F168 HydrophobicContact CE1-CE2 3.87Å; R129-F168 HydrophobicContact CB-CE1 4.4Å; R129-F168 HydrophobicContact CB-CE2 4.21Å; R129-F168 HydrophobicContact CB-CZ 3.73Å; R129-F168 HydrophobicContact CG-CE1 3.86Å; R129-F168 HydrophobicContact CG-CE2 4.45Å; R129-F168 HydrophobicContact CG-CZ 3.7Å; M132-F168 HydrophobicContact CB-CB 4.25Å; M132-F168 HydrophobicContact CB-CD2 3.51Å; M132-F168 HydrophobicContact CB-CE2 4.22Å; M132-F168 HydrophobicContact CB-CG 4.19Å; M132-F168 HydrophobicContact CG-CD2 3.93Å; M132-F168 HydrophobicContact CG-CE2 4.47Å; L133-F168 HydrophobicContact CD2-CB 4.11Å; L133-F168 HydrophobicContact CD2-CD1 3.94Å; L133-F168 HydrophobicContact CD2-CG 4.17Å; L133-F168 HydrophobicContact CG-CD1 4.35Å; M164-F168 HydrophobicContact CB-CD2 4.44Å; M164-F168 HydrophobicContact CB-CE2 3.81Å; M164-F168 HydrophobicContact CB-CZ 3.85Å; M164-F168 HydrophobicContact CE-CE2 3.95Å; M164-F168 HydrophobicContact CE-CZ 3.69Å; M164-F168 HydrophobicContact CG-CZ 4.38Å; M164-F168 VanDerWaalsContact O-CD1 3.22Å; M164-F168 WeakPolarHBondContact O-CD1 3.2Å; M164-F168 WeakPolarHBondContact O-CD2 3.38Å; M164-F168 WeakPolarHBondContact O-CG 3.36Å; M164-F168 PolarHBondContact O-N 3Å; L165-F168 PolarHBondContact O-N 2.89Å
169	L	97.1	Very high	96.7	Very high	2 Å²	2	71.1 Å²	71.1	1%	0.01	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	1.5	-175.2	-65.1	165.5	0	0	0	113.3	M132 V136 L149 L165 E167 D171 A172 Y176 I178	M132-L169 HydrophobicContact CE-CD2 4.34Å; V136-L169 HydrophobicContact CG2-CD2 3.52Å; L149-L169 HydrophobicContact CD1-CD1 4.12Å; L149-L169 HydrophobicContact CD1-CD2 4.49Å; L165-L169 HydrophobicContact CB-CD1 4.27Å; L165-L169 HydrophobicContact CD2-CD1 4Å; L165-L169 VanDerWaalsContact O-CB 3.3Å; L165-L169 WeakPolarHBondContact O-CB 3.33Å; L165-L169 PolarHBondContact O-N 3Å; E167-L169 PolarHBondContact O-N 2.86Å; L169-D171 PolarHBondContact O-N 3.25Å; L169-A172 HydrophobicContact CB-CB 4.44Å; L169-A172 HydrophobicContact CD2-CB 4.15Å; L169-A172 WeakPolarHBondContact O-CB 3.43Å; L169-A172 PolarHBondContact O-N 3.07Å; L169-A172 VanDerWaalsContact O-N 3.09Å; L169-Y176 HydrophobicContact CB-CE1 4.04Å; L169-Y176 HydrophobicContact CB-CE2 4.14Å; L169-Y176 HydrophobicContact CD1-CD2 3.99Å; L169-Y176 HydrophobicContact CD1-CE2 3.81Å; L169-Y176 HydrophobicContact CG-CE2 4.49Å; L169-I178 HydrophobicContact CD1-CD1 3.76Å; L169-I178 HydrophobicContact CD1-CG1 4.29Å
170	Q	94	Very high	96.7	Very high	148 Å²	148	69 Å²	69	69%	0.692	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-41.5	-177	-176.9	172.8	4	0	0	112.8	Q166	Q166-Q170 PolarHBondContact O-N 3.27Å
171	D	90.2	Very high	96.8	Very high	142 Å²	142	69.5 Å²	69.5	76%	0.759	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	22.3	-177.8	-59.8	-45.1	0	0	0	112.6	L169 P173	L169-D171 PolarHBondContact O-N 3.25Å; D171-P173 WeakPolarHBondContact O-CD 3.33Å
172	A	95.7	Very high	96.6	Very high	20 Å²	20	72.6 Å²	72.6	17%	0.165	35%	0.349	C	S	.	.			trans	-62.3	123.2	-179.8	0	0	0	0	0	110.6	V136 L169 F174 Y176	V136-A172 HydrophobicContact CG1-CB 4.1Å; L169-A172 HydrophobicContact CB-CB 4.44Å; L169-A172 HydrophobicContact CD2-CB 4.15Å; L169-A172 WeakPolarHBondContact O-CB 3.43Å; L169-A172 PolarHBondContact O-N 3.07Å; L169-A172 VanDerWaalsContact O-N 3.09Å; A172-F174 HydrophobicContact CB-CE1 4.16Å; A172-F174 HydrophobicContact CB-CE2 4.28Å; A172-F174 HydrophobicContact CB-CZ 4.02Å; A172-F174 PolarHBondContact O-N 3.06Å; A172-F174 VanDerWaalsContact O-N 3.11Å; A172-Y176 HydrophobicContact CB-CD1 4.04Å; A172-Y176 HydrophobicContact CB-CE1 3.97Å
173	P	94.1	Very high	96.4	Very high	106 Å²	106	68.8 Å²	68.8	69%	0.688	33%	0.332	S	S	*	.	S	Bend	trans	-79.9	10.7	-174.7	32.7	-36.1	0	0	0	113.6	D171	D171-P173 WeakPolarHBondContact O-CD 3.33Å
174	F	96.1	Very high	96	Very high	17 Å²	17	65.8 Å²	65.8	8%	0.075	33%	0.33	C	S	.	.	S	Bend	trans	-134.3	158.5	-173.6	52	-94.8	0	0	0	111.3	V136 A139 F141 L147 A172	V136-F174 HydrophobicContact CG2-CZ 4.38Å; A139-F174 HydrophobicContact CB-CD1 3.96Å; A139-F174 HydrophobicContact CB-CE1 3.43Å; A139-F174 VanDerWaalsContact CB-CE1 3.43Å; A139-F174 HydrophobicContact CB-CZ 3.89Å; A139-F174 WeakPolarHBondContact O-CD1 3.49Å; F141-F174 HydrophobicContact CB-CB 4.01Å; F141-F174 HydrophobicContact CD2-CB 3.81Å; F141-F174 HydrophobicContact CD2-CD1 4.26Å; F141-F174 AromaticContact CD2-CD2 3.98Å; F141-F174 HydrophobicContact CD2-CD2 3.98Å; F141-F174 AromaticContact CD2-CG 3.75Å; F141-F174 HydrophobicContact CD2-CG 3.75Å; F141-F174 HydrophobicContact CE2-CD2 4.3Å; F141-F174 HydrophobicContact CE2-CG 4.39Å; F141-F174 HydrophobicContact CG-CB 4.35Å; L147-F174 HydrophobicContact CB-CD2 4.35Å; L147-F174 HydrophobicContact CB-CE2 4.34Å; L147-F174 HydrophobicContact CD2-CE2 3.89Å; L147-F174 HydrophobicContact CD2-CZ 4.39Å; A172-F174 HydrophobicContact CB-CE1 4.16Å; A172-F174 HydrophobicContact CB-CE2 4.28Å; A172-F174 HydrophobicContact CB-CZ 4.02Å; A172-F174 PolarHBondContact O-N 3.06Å; A172-F174 VanDerWaalsContact O-N 3.11Å
175	K	97.5	Very high	95.7	Very high	133 Å²	133	69.2 Å²	69.2	58%	0.578	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	134.2	174	-66.7	-177.3	179.5	178.7	0	110	V146 L147	V146-K175 HydrophobicContact CG2-CB 4.07Å; L147-K175 PolarHBondContact N-O 2.92Å
176	Y	97.8	Very high	95.3	Very high	92 Å²	92	69.5 Å²	69.5	36%	0.361	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	159.9	178.5	66.6	-92.4	0	0	0	112.2	L147 L169 A172 I178	L147-Y176 CarbonylContact O-C 3.49Å; L147-Y176 WeakPolarHBondContact O-CA 3.25Å; L147-Y176 WeakPolarHBondContact O-CB 2.93Å; L169-Y176 HydrophobicContact CB-CE1 4.04Å; L169-Y176 HydrophobicContact CB-CE2 4.14Å; L169-Y176 HydrophobicContact CD1-CD2 3.99Å; L169-Y176 HydrophobicContact CD1-CE2 3.81Å; L169-Y176 HydrophobicContact CG-CE2 4.49Å; A172-Y176 HydrophobicContact CB-CD1 4.04Å; A172-Y176 HydrophobicContact CB-CE1 3.97Å; Y176-I178 HydrophobicContact CD2-CD1 4.38Å; Y176-I178 HydrophobicContact CD2-CG1 4.16Å; Y176-I178 HydrophobicContact CE2-CD1 4.07Å; Y176-I178 HydrophobicContact CE2-CG1 4.33Å
177	E	98.1	Very high	94.9	Very high	76 Å²	76	64.1 Å²	64.1	36%	0.355	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.2	170.3	-71.2	179.6	-142.7	0	0	109.6	R108 V146 L147 V148 L149	R108-E177 IonicContact CZ-OE1 3.87Å; R108-E177 IonicContact CZ-OE2 3.16Å; R108-E177 IonicContact NH1-OE1 2.65Å; R108-E177 PolarHBondContact NH1-OE1 2.96Å; R108-E177 IonicContact NH1-OE2 3.51Å; R108-E177 IonicContact NH2-OE1 2.89Å; R108-E177 PolarHBondContact NH2-OE1 2.87Å; R108-E177 VanDerWaalsContact NH2-OE1 3.16Å; R108-E177 IonicContact NH2-OE2 3.7Å; R108-E177 PolarHBondContact NH2-OE2 3.36Å; V146-E177 HydrophobicContact CG1-CB 4.49Å; V146-E177 HydrophobicContact CG1-CG 4Å; L147-E177 PolarHBondContact O-N 3.47Å; V148-E177 WeakPolarHBondContact CA-O 3.32Å; V148-E177 HydrophobicContact CG1-CB 4.23Å; V148-E177 HydrophobicContact CG2-CB 4.42Å; L149-E177 PolarHBondContact N-O 3.18Å
178	I	98.4	Very high	94.5	Very high	65 Å²	65	65.9 Å²	65.9	33%	0.333	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	128.4	-179.9	-58.9	168.1	0	0	0	108.2	L149 F151 L165 L169 Y176 F180	L149-I178 WeakPolarHBondContact O-CA 3.31Å; F151-I178 HydrophobicContact CD2-CG2 3.99Å; F151-I178 HydrophobicContact CE2-CG2 4.05Å; L165-I178 HydrophobicContact CB-CD1 4.11Å; L165-I178 HydrophobicContact CD1-CD1 4.18Å; L165-I178 HydrophobicContact CD1-CG2 4.01Å; L169-I178 HydrophobicContact CD1-CD1 3.76Å; L169-I178 HydrophobicContact CD1-CG1 4.29Å; Y176-I178 HydrophobicContact CD2-CD1 4.38Å; Y176-I178 HydrophobicContact CD2-CG1 4.16Å; Y176-I178 HydrophobicContact CE2-CD1 4.07Å; Y176-I178 HydrophobicContact CE2-CG1 4.33Å; I178-F180 HydrophobicContact CG2-CD2 4.02Å; I178-F180 HydrophobicContact CG2-CE2 3.51Å; I178-F180 HydrophobicContact CG2-CZ 4.12Å
179	I	98.4	Very high	94.1	Very high	57 Å²	57	70.1 Å²	70.1	29%	0.292	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.2	178.6	-55.1	-179.9	0	0	0	108.6	V148 L149 H150 F151 H181	V148-I179 HydrophobicContact CG1-CD1 3.57Å; V148-I179 HydrophobicContact CG1-CG1 4Å; L149-I179 PolarHBondContact O-N 3.05Å; H150-I179 CarbonylContact C-O 3.59Å; H150-I179 VanDerWaalsContact CA-O 3.27Å; H150-I179 WeakPolarHBondContact CA-O 3.48Å; F151-I179 PolarHBondContact N-O 2.88Å; I179-H181 WeakPolarHBondContact CG2-NE2 3.21Å
180	F	98.3	Very high	93.7	Very high	41 Å²	41	70 Å²	70	18%	0.18	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	140	171.2	-70.5	-87	0	0	0	110.3	F151 S153 Q158 Q162 L165 I178	F151-F180 HydrophobicContact CB-CD1 3.55Å; F151-F180 HydrophobicContact CB-CE1 3.63Å; F151-F180 HydrophobicContact CB-CG 4.44Å; F151-F180 HydrophobicContact CD2-CE1 4.08Å; F151-F180 HydrophobicContact CD2-CZ 4.22Å; F151-F180 HydrophobicContact CG-CD1 4.38Å; F151-F180 HydrophobicContact CG-CE1 4.02Å; F151-F180 CarbonylContact O-C 3.5Å; F151-F180 WeakPolarHBondContact O-CA 3.44Å; S153-F180 WeakPolarHBondContact OG-CD1 3.39Å; Q158-F180 HydrophobicContact CB-CD1 4.12Å; Q158-F180 HydrophobicContact CB-CE1 4.37Å; Q158-F180 HydrophobicContact CG-CB 4.16Å; Q158-F180 HydrophobicContact CG-CD1 3.7Å; Q158-F180 HydrophobicContact CG-CD2 4.06Å; Q158-F180 HydrophobicContact CG-CE1 4.03Å; Q158-F180 HydrophobicContact CG-CE2 4.37Å; Q158-F180 HydrophobicContact CG-CG 3.7Å; Q158-F180 HydrophobicContact CG-CZ 4.35Å; Q162-F180 HydrophobicContact CG-CE2 3.68Å; Q162-F180 HydrophobicContact CG-CZ 3.95Å; L165-F180 HydrophobicContact CD1-CZ 3.87Å; I178-F180 HydrophobicContact CG2-CD2 4.02Å; I178-F180 HydrophobicContact CG2-CE2 3.51Å; I178-F180 HydrophobicContact CG2-CZ 4.12Å
181	H	97.6	Very high	93.4	Very high	37 Å²	37	67.1 Å²	67.1	17%	0.171	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.4	175.4	-56	-92.3	0	0	0	108.5	H150 F151 V152 S153 I179 V183 L186	H150-H181 AromaticContact CE1-NE2 3.98Å; H150-H181 AromaticContact CG-NE2 3.64Å; H150-H181 AromaticContact ND1-CE1 3.6Å; H150-H181 AromaticContact ND1-NE2 2.93Å; H150-H181 PolarHBondContact ND1-NE2 2.85Å; F151-H181 PolarHBondContact O-N 3.01Å; V152-H181 WeakPolarHBondContact CA-O 3.35Å; V152-H181 HydrophobicContact CG2-CB 4.28Å; S153-H181 PolarHBondContact N-O 3.45Å; I179-H181 WeakPolarHBondContact CG2-NE2 3.21Å; H181-V183 PolarHBondContact O-N 2.84Å; H181-L186 HydrophobicContact CB-CD1 3.71Å; H181-L186 HydrophobicContact CB-CG 4.19Å
182	D	94.3	Very high	93.2	Very high	66 Å²	66	65 Å²	65	35%	0.353	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	121.2	178.2	-174.8	-55.8	0	0	0	110.3	V184 E185 L186	D182-V184 VanDerWaalsContact C-N 3.27Å; D182-V184 PolarHBondContact O-N 3.25Å; D182-V184 VanDerWaalsContact OD1-CA 3.3Å; D182-V184 WeakPolarHBondContact OD1-CA 3.26Å; D182-V184 WeakPolarHBondContact OD1-CB 3.39Å; D182-V184 PolarHBondContact OD1-N 2.74Å; D182-E185 HydrophobicContact CB-CB 4.04Å; D182-E185 PolarHBondContact O-N 3.3Å; D182-E185 PolarHBondContact OD1-N 3.37Å; D182-E185 VanDerWaalsContact OD1-N 3.12Å; D182-L186 WeakPolarHBondContact O-CG 3.32Å; D182-L186 PolarHBondContact O-N 2.78Å
183	V	92.2	Very high	92.7	Very high	16 Å²	16	66.1 Å²	66.1	10%	0.097	33%	0.333	C	S	.	.	H	α-helix	trans	-59.5	-35.1	-179.7	64.8	0	0	0	0	113.2	T116 V152 S153 D154 H181 T187 I213	T116-V183 HydrophobicContact CG2-CB 4.04Å; T116-V183 HydrophobicContact CG2-CG1 4.4Å; T116-V183 HydrophobicContact CG2-CG2 3.82Å; V152-V183 HydrophobicContact CG1-CB 4.08Å; V152-V183 HydrophobicContact CG1-CG2 4.24Å; S153-V183 PolarHBondContact O-N 3.39Å; S153-V183 VanDerWaalsContact O-N 3.09Å; D154-V183 HydrophobicContact CB-CG1 4.07Å; H181-V183 PolarHBondContact O-N 2.84Å; V183-T187 WeakPolarHBondContact O-CB 3.16Å; V183-T187 PolarHBondContact O-N 3.2Å; V183-T187 PolarHBondContact O-OG1 3.3Å; V183-I213 HydrophobicContact CG2-CB 4.29Å; V183-I213 HydrophobicContact CG2-CD1 4.11Å; V183-I213 HydrophobicContact CG2-CG1 3.9Å; V183-I213 HydrophobicContact CG2-CG2 4.48Å
184	V	88.9	Confident	92.2	Very high	85 Å²	85	61.1 Å²	61.1	52%	0.515	30%	0.3	S	S	.	.	H	α-helix	trans	-69.1	-45.5	179	-177.1	0	0	0	0	109.8	D182 T187 Q188	D182-V184 VanDerWaalsContact C-N 3.27Å; D182-V184 PolarHBondContact O-N 3.25Å; D182-V184 VanDerWaalsContact OD1-CA 3.3Å; D182-V184 WeakPolarHBondContact OD1-CA 3.26Å; D182-V184 WeakPolarHBondContact OD1-CB 3.39Å; D182-V184 PolarHBondContact OD1-N 2.74Å; V184-T187 PolarHBondContact O-N 3.32Å; V184-Q188 WeakPolarHBondContact O-CG 3.3Å; V184-Q188 PolarHBondContact O-N 3.2Å
185	E	91.1	Very high	91.7	Very high	93 Å²	93	65.6 Å²	65.6	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-47.8	177.4	-170.3	-169.8	156.7	0	0	111.2	D182 T187 Q188 K189	D182-E185 HydrophobicContact CB-CB 4.04Å; D182-E185 PolarHBondContact O-N 3.3Å; D182-E185 PolarHBondContact OD1-N 3.37Å; D182-E185 VanDerWaalsContact OD1-N 3.12Å; E185-T187 VanDerWaalsContact C-N 3.34Å; E185-T187 PolarHBondContact O-N 3.45Å; E185-Q188 PolarHBondContact O-N 3.06Å; E185-K189 PolarHBondContact O-N 3.41Å; E185-K189 VanDerWaalsContact O-N 3.17Å; E185-K189 VanDerWaalsContact OE1-CE 3.25Å; E185-K189 WeakPolarHBondContact OE1-CE 3.37Å; E185-K189 IonicContact OE1-NZ 3.39Å; E185-K189 PolarHBondContact OE1-NZ 3.16Å
186	L	91.3	Very high	90.8	Very high	8 Å²	8	60.2 Å²	60.2	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-40.5	178	-63.8	-168.9	0	0	0	111.8	V152 H181 D182 Q188 K189 L190 I213 L216 I223	V152-L186 HydrophobicContact CB-CD1 4.36Å; V152-L186 HydrophobicContact CG1-CD1 3.81Å; V152-L186 HydrophobicContact CG2-CD1 3.65Å; H181-L186 HydrophobicContact CB-CD1 3.71Å; H181-L186 HydrophobicContact CB-CG 4.19Å; D182-L186 WeakPolarHBondContact O-CG 3.32Å; D182-L186 PolarHBondContact O-N 2.78Å; L186-Q188 VanDerWaalsContact C-N 3.32Å; L186-Q188 PolarHBondContact O-N 3.17Å; L186-K189 PolarHBondContact O-N 3.29Å; L186-L190 WeakPolarHBondContact O-CB 3.43Å; L186-L190 VanDerWaalsContact O-CG 3.27Å; L186-L190 WeakPolarHBondContact O-CG 3.44Å; L186-L190 PolarHBondContact O-N 3.15Å; L186-I213 HydrophobicContact CB-CD1 3.83Å; L186-I213 HydrophobicContact CD1-CD1 4.44Å; L186-L216 HydrophobicContact CD1-CD1 4.3Å; L186-L216 HydrophobicContact CD1-CD2 4.24Å; L186-I223 HydrophobicContact CD2-CG2 3.56Å
187	T	87.6	Confident	90	Very high	37 Å²	37	55.9 Å²	55.9	23%	0.227	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-42.4	177.1	-66.1	0	0	0	0	111.6	V183 V184 E185 L190 F191	V183-T187 WeakPolarHBondContact O-CB 3.16Å; V183-T187 PolarHBondContact O-N 3.2Å; V183-T187 PolarHBondContact O-OG1 3.3Å; V184-T187 PolarHBondContact O-N 3.32Å; E185-T187 VanDerWaalsContact C-N 3.34Å; E185-T187 PolarHBondContact O-N 3.45Å; T187-L190 PolarHBondContact O-N 3.3Å; T187-F191 WeakPolarHBondContact O-CB 3.48Å; T187-F191 PolarHBondContact O-N 3.39Å
188	Q	87.8	Confident	89.1	Confident	135 Å²	135	53.9 Å²	53.9	63%	0.631	28%	0.276	S	S	*	.	H	α-helix	trans	-63.6	-41.3	177.4	-72.8	174	0	0	0	112.1	V184 E185 L186 P192	V184-Q188 WeakPolarHBondContact O-CG 3.3Å; V184-Q188 PolarHBondContact O-N 3.2Å; E185-Q188 PolarHBondContact O-N 3.06Å; L186-Q188 VanDerWaalsContact C-N 3.32Å; L186-Q188 PolarHBondContact O-N 3.17Å; Q188-P192 WeakPolarHBondContact O-CD 3.42Å
189	K	89.9	Confident	88.2	Confident	96 Å²	96	57.6 Å²	57.6	42%	0.417	29%	0.289	S	S	.	.	H	α-helix	trans	-69	-35.9	176.4	-67.3	177.2	-174.2	170.5	0	112.5	E185 L186 I223	E185-K189 PolarHBondContact O-N 3.41Å; E185-K189 VanDerWaalsContact O-N 3.17Å; E185-K189 VanDerWaalsContact OE1-CE 3.25Å; E185-K189 WeakPolarHBondContact OE1-CE 3.37Å; E185-K189 IonicContact OE1-NZ 3.39Å; E185-K189 PolarHBondContact OE1-NZ 3.16Å; L186-K189 PolarHBondContact O-N 3.29Å; K189-I223 HydrophobicContact CB-CD1 3.53Å
190	L	88.6	Confident	87.2	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-73.7	-39.4	-179.5	-77.3	169.9	0	0	0	112.9	L186 T187 I193 V194 I213 L216 A219 I223	L186-L190 WeakPolarHBondContact O-CB 3.43Å; L186-L190 VanDerWaalsContact O-CG 3.27Å; L186-L190 WeakPolarHBondContact O-CG 3.44Å; L186-L190 PolarHBondContact O-N 3.15Å; T187-L190 PolarHBondContact O-N 3.3Å; L190-I193 WeakPolarHBondContact O-CA 3.42Å; L190-I193 WeakPolarHBondContact O-CB 3.27Å; L190-I193 PolarHBondContact O-N 3.29Å; L190-V194 HydrophobicContact CB-CG2 4.38Å; L190-V194 WeakPolarHBondContact O-CG2 3.19Å; L190-V194 PolarHBondContact O-N 2.87Å; L190-V194 VanDerWaalsContact O-N 3.09Å; L190-I213 HydrophobicContact CD1-CD1 3.98Å; L190-L216 HydrophobicContact CD1-CB 3.88Å; L190-L216 HydrophobicContact CD1-CD1 3.85Å; L190-L216 HydrophobicContact CD1-CG 4.46Å; L190-L216 HydrophobicContact CD2-CD1 4.28Å; L190-L216 HydrophobicContact CG-CD1 4.38Å; L190-A219 HydrophobicContact CD2-CB 3.72Å; L190-I223 HydrophobicContact CD2-CD1 3.86Å; L190-I223 HydrophobicContact CD2-CG1 3.69Å; L190-I223 HydrophobicContact CG-CD1 3.99Å; L190-I223 HydrophobicContact CG-CG1 4.16Å
191	F	86.9	Confident	86.2	Confident	87 Å²	87	54 Å²	54	38%	0.382	27%	0.272	S	S	.	.	H	α-helix	trans	-49.1	-48.8	-168.7	178.6	-96.1	0	0	0	113.9	T187 I193 V194 E195	T187-F191 WeakPolarHBondContact O-CB 3.48Å; T187-F191 PolarHBondContact O-N 3.39Å; F191-I193 PolarHBondContact O-N 3.39Å; F191-I193 VanDerWaalsContact O-N 3.13Å; F191-V194 PolarHBondContact O-N 3.1Å; F191-E195 HydrophobicContact CE1-CB 4.47Å; F191-E195 HydrophobicContact CE1-CG 4.42Å; F191-E195 HydrophobicContact CE2-CB 4.25Å; F191-E195 HydrophobicContact CE2-CG 4.16Å; F191-E195 HydrophobicContact CZ-CB 4.18Å; F191-E195 HydrophobicContact CZ-CG 3.86Å; F191-E195 VanDerWaalsContact CZ-OE1 3.32Å; F191-E195 WeakPolarHBondContact CZ-OE1 3.29Å; F191-E195 WeakPolarHBondContact O-CB 3.43Å; F191-E195 PolarHBondContact O-N 3.23Å
192	P	86.9	Confident	85	Confident	99 Å²	99	53 Å²	53	64%	0.643	27%	0.269	S	S	*	.	H	α-helix	trans	-62	-24.2	179.6	-22.5	34.4	0	0	0	114.5	Q188	Q188-P192 WeakPolarHBondContact O-CD 3.42Å
193	I	85.1	Confident	83.2	Confident	43 Å²	43	52.4 Å²	52.4	22%	0.221	27%	0.273	C	S	.	.	H	α-helix	trans	-85.2	-38.2	-179.2	-54.2	171.1	0	0	0	110.1	L190 F191 A219 H222	L190-I193 WeakPolarHBondContact O-CA 3.42Å; L190-I193 WeakPolarHBondContact O-CB 3.27Å; L190-I193 PolarHBondContact O-N 3.29Å; F191-I193 PolarHBondContact O-N 3.39Å; F191-I193 VanDerWaalsContact O-N 3.13Å; I193-A219 HydrophobicContact CB-CB 4.43Å; I193-A219 HydrophobicContact CD1-CB 4.02Å; I193-A219 HydrophobicContact CG2-CB 3.87Å; I193-H222 HydrophobicContact CD1-CB 3.88Å
194	V	84.4	Confident	81.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-108.6	-7.7	-166	-50.5	0	0	0	0	114.6	L190 F191 A196 M197 Q198 F215	L190-V194 HydrophobicContact CB-CG2 4.38Å; L190-V194 WeakPolarHBondContact O-CG2 3.19Å; L190-V194 PolarHBondContact O-N 2.87Å; L190-V194 VanDerWaalsContact O-N 3.09Å; F191-V194 PolarHBondContact O-N 3.1Å; V194-A196 PolarHBondContact O-N 3.16Å; V194-M197 HydrophobicContact CB-CE 4.32Å; V194-M197 HydrophobicContact CB-CG 3.77Å; V194-M197 HydrophobicContact CB-SD 3.77Å; V194-M197 HydrophobicContact CG1-CE 4.14Å; V194-M197 HydrophobicContact CG1-CG 4.49Å; V194-M197 HydrophobicContact CG1-SD 3.84Å; V194-M197 WeakPolarHBondContact O-CG 3.27Å; V194-M197 PolarHBondContact O-N 3.06Å; V194-Q198 WeakPolarHBondContact O-CG 3.43Å; V194-Q198 PolarHBondContact O-N 2.86Å; V194-Q198 VanDerWaalsContact O-N 3.1Å; V194-F215 HydrophobicContact CB-CB 3.88Å; V194-F215 HydrophobicContact CB-CG 4.16Å; V194-F215 HydrophobicContact CG1-CB 3.65Å; V194-F215 HydrophobicContact CG1-CG 4.42Å; V194-F215 HydrophobicContact CG2-CB 4.16Å; V194-F215 HydrophobicContact CG2-CD2 4.43Å; V194-F215 HydrophobicContact CG2-CG 4.47Å
195	E	84.4	Confident	78.8	Confident	111 Å²	111	56.4 Å²	56.4	52%	0.519	31%	0.314	S	S	.	.	H	α-helix	trans	-52	-45	179.2	179.8	-175.7	-143.1	0	0	112	F191 M197 Q198	F191-E195 HydrophobicContact CE1-CB 4.47Å; F191-E195 HydrophobicContact CE1-CG 4.42Å; F191-E195 HydrophobicContact CE2-CB 4.25Å; F191-E195 HydrophobicContact CE2-CG 4.16Å; F191-E195 HydrophobicContact CZ-CB 4.18Å; F191-E195 HydrophobicContact CZ-CG 3.86Å; F191-E195 VanDerWaalsContact CZ-OE1 3.32Å; F191-E195 WeakPolarHBondContact CZ-OE1 3.29Å; F191-E195 WeakPolarHBondContact O-CB 3.43Å; F191-E195 PolarHBondContact O-N 3.23Å; E195-M197 VanDerWaalsContact C-N 3.26Å; E195-M197 PolarHBondContact O-N 3.22Å; E195-Q198 PolarHBondContact O-N 3.18Å
196	A	78.9	Confident	76.6	Confident	20 Å²	20	55.7 Å²	55.7	17%	0.165	33%	0.332	C	S	.	.	H	α-helix	trans	-67.3	-24.6	-178	0	0	0	0	0	114.1	V194 K199 P321	V194-A196 PolarHBondContact O-N 3.16Å; A196-K199 VanDerWaalsContact O-CE 3.31Å; A196-K199 WeakPolarHBondContact O-CE 3.46Å; A196-K199 WeakPolarHBondContact O-CG 3.47Å; A196-P321 HydrophobicContact CB-CB 3.43Å; A196-P321 VanDerWaalsContact CB-CB 3.43Å; A196-P321 HydrophobicContact CB-CG 3.56Å
197	M	80.7	Confident	74.6	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-89.6	-29.2	-179.7	59.7	179.2	75.2	0	0	112.3	V194 E195 K199 H200 F201 F215 V218 L319 V324	V194-M197 HydrophobicContact CB-CE 4.32Å; V194-M197 HydrophobicContact CB-CG 3.77Å; V194-M197 HydrophobicContact CB-SD 3.77Å; V194-M197 HydrophobicContact CG1-CE 4.14Å; V194-M197 HydrophobicContact CG1-CG 4.49Å; V194-M197 HydrophobicContact CG1-SD 3.84Å; V194-M197 WeakPolarHBondContact O-CG 3.27Å; V194-M197 PolarHBondContact O-N 3.06Å; E195-M197 VanDerWaalsContact C-N 3.26Å; E195-M197 PolarHBondContact O-N 3.22Å; M197-K199 VanDerWaalsContact C-N 3.26Å; M197-K199 PolarHBondContact O-N 3.24Å; M197-H200 PolarHBondContact O-N 3.05Å; M197-F201 HydrophobicContact CB-CD2 3.73Å; M197-F201 HydrophobicContact CB-CE2 3.69Å; M197-F201 WeakPolarHBondContact O-CD2 3.44Å; M197-F201 PolarHBondContact O-N 3.13Å; M197-F215 HydrophobicContact CG-CD1 3.93Å; M197-F215 HydrophobicContact CG-CE1 4.02Å; M197-F215 HydrophobicContact SD-CB 4.34Å; M197-F215 HydrophobicContact SD-CD1 3.46Å; M197-F215 WeakPolarHBondContact SD-CD1 3.27Å; M197-F215 HydrophobicContact SD-CE1 4.05Å; M197-F215 HydrophobicContact SD-CG 4.11Å; M197-V218 HydrophobicContact CE-CG1 3.98Å; M197-V218 HydrophobicContact SD-CG1 4.04Å; M197-L319 HydrophobicContact CE-CD2 4.36Å; M197-V324 HydrophobicContact CB-CG1 3.9Å
198	Q	79.1	Confident	72.7	Confident	35 Å²	35	60.1 Å²	60.1	16%	0.164	35%	0.349	C	S	.	.	H	α-helix	trans	-53.5	-40.3	178.3	-75.6	177.3	12.3	0	0	113.2	V194 E195 H200 F201 S202 S212 F215	V194-Q198 WeakPolarHBondContact O-CG 3.43Å; V194-Q198 PolarHBondContact O-N 2.86Å; V194-Q198 VanDerWaalsContact O-N 3.1Å; E195-Q198 PolarHBondContact O-N 3.18Å; Q198-H200 PolarHBondContact O-N 3.22Å; Q198-F201 PolarHBondContact O-N 3.17Å; Q198-S202 VanDerWaalsContact O-CB 3.25Å; Q198-S202 WeakPolarHBondContact O-CB 3.49Å; Q198-S202 PolarHBondContact O-N 2.81Å; Q198-S202 PolarHBondContact O-OG 2.82Å; Q198-S212 PolarHBondContact NE2-OG 3.33Å; Q198-F215 HydrophobicContact CG-CD2 4.19Å; Q198-F215 HydrophobicContact CG-CE2 3.68Å; Q198-F215 HydrophobicContact CG-CZ 4.24Å
199	K	79.8	Confident	70.9	Confident	142 Å²	142	57.8 Å²	57.8	62%	0.617	33%	0.334	S	S	*	.	H	α-helix	trans	-60.6	-21.3	179.2	72.6	-172.6	-177.9	-177.3	0	114.2	A196 M197	A196-K199 VanDerWaalsContact O-CE 3.31Å; A196-K199 WeakPolarHBondContact O-CE 3.46Å; A196-K199 WeakPolarHBondContact O-CG 3.47Å; M197-K199 VanDerWaalsContact C-N 3.26Å; M197-K199 PolarHBondContact O-N 3.24Å
200	H	78	Confident	69.1	Low	23 Å²	23	55.8 Å²	55.8	11%	0.106	33%	0.333	C	S	.	.	H	α-helix	trans	-99.2	-32.9	-179.6	-64.6	-74.5	0	0	0	112.8	M197 Q198 A328 G335	M197-H200 PolarHBondContact O-N 3.05Å; Q198-H200 PolarHBondContact O-N 3.22Å; H200-A328 HydrophobicContact CB-CB 4.2Å; H200-A328 WeakPolarHBondContact ND1-CB 3.3Å; H200-G335 PolarHBondContact O-N 3.24Å
201	F	77.1	Confident	68.1	Low	0 Å²	0	59.6 Å²	59.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-113.2	4.3	-169.8	-49.4	-56.9	0	0	0	114.4	M197 Q198 F215 V324 F333 G335 H336 G338 D341 F342 M345	M197-F201 HydrophobicContact CB-CD2 3.73Å; M197-F201 HydrophobicContact CB-CE2 3.69Å; M197-F201 WeakPolarHBondContact O-CD2 3.44Å; M197-F201 PolarHBondContact O-N 3.13Å; Q198-F201 PolarHBondContact O-N 3.17Å; F201-F215 HydrophobicContact CB-CE1 3.84Å; F201-F215 HydrophobicContact CB-CZ 3.8Å; F201-F215 AromaticContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CD2-CZ 4.49Å; F201-F215 HydrophobicContact CG-CE1 4.29Å; F201-V324 HydrophobicContact CE2-CG1 3.73Å; F201-V324 HydrophobicContact CZ-CG1 4.05Å; F201-F333 AromaticContact CD1-CD1 3.89Å; F201-F333 HydrophobicContact CD1-CD1 3.89Å; F201-F333 AromaticContact CD1-CE1 3.64Å; F201-F333 HydrophobicContact CD1-CE1 3.64Å; F201-F333 AromaticContact CE1-CD1 3.67Å; F201-F333 HydrophobicContact CE1-CD1 3.67Å; F201-F333 AromaticContact CE1-CE1 3.79Å; F201-F333 HydrophobicContact CE1-CE1 3.79Å; F201-G335 CarbonylContact C-O 3.5Å; F201-G335 CarbonylContact O-C 3.37Å; F201-H336 CarbonylContact O-C 3.58Å; F201-H336 WeakPolarHBondContact O-CA 3.32Å; F201-H336 PolarHBondContact O-N 3.3Å; F201-G338 PolarHBondContact O-N 3.35Å; F201-D341 HydrophobicContact CB-CB 4.2Å; F201-D341 HydrophobicContact CD1-CB 3.77Å; F201-D341 HydrophobicContact CG-CB 4.25Å; F201-F342 HydrophobicContact CD2-CB 4.23Å; F201-F342 HydrophobicContact CE2-CB 4.1Å; F201-F342 AromaticContact CE2-CD2 3.82Å; F201-F342 HydrophobicContact CE2-CD2 3.82Å; F201-F342 HydrophobicContact CE2-CG 4.46Å; F201-F342 HydrophobicContact CZ-CB 4.46Å; F201-F342 HydrophobicContact CZ-CD2 4.2Å; F201-M345 HydrophobicContact CE1-CE 4.17Å; F201-M345 HydrophobicContact CE1-SD 3.88Å; F201-M345 HydrophobicContact CZ-CE 3.53Å; F201-M345 HydrophobicContact CZ-SD 3.82Å
202	S	72.6	Confident	67.5	Low	16 Å²	16	55.8 Å²	55.8	11%	0.112	34%	0.335	C	S	.	.	S	Bend	trans	-127.6	40.5	176.5	-51.4	0	0	0	0	111.6	Q198 G204 Y209 G335	Q198-S202 VanDerWaalsContact O-CB 3.25Å; Q198-S202 WeakPolarHBondContact O-CB 3.49Å; Q198-S202 PolarHBondContact O-N 2.81Å; Q198-S202 PolarHBondContact O-OG 2.82Å; S202-G204 PolarHBondContact O-N 3.39Å; S202-Y209 PolarHBondContact OG-O 3.48Å; S202-G335 PolarHBondContact N-O 2.94Å
203	A	55.9	Low	67.2	Low	53 Å²	53	51.2 Å²	51.2	44%	0.438	31%	0.305	S	S	.	.			trans	-71.3	110.4	-174.3	0	0	0	0	0	112.7	G335	A203-G335 WeakPolarHBondContact CB-O 3.44Å; A203-G335 PolarHBondContact N-O 3.18Å
204	G	51.3	Low	67.2	Low	53 Å²	53	50.7 Å²	50.7	55%	0.546	30%	0.301	S	S	.	.	S	Bend	trans	145.1	138.5	172.5	0	0	0	0	0	112.1	S202 G206 A207	S202-G204 PolarHBondContact O-N 3.39Å; G204-G206 PolarHBondContact O-N 2.84Å; G204-A207 PolarHBondContact O-N 3.3Å
205	S	37.3	Very low	67.3	Low	132 Å²	132	50.7 Å²	50.7	92%	0.923	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	119	171.9	54.4	0	0	0	0	109.4
206	G	45.6	Very low	67.8	Low	78 Å²	78	45.4 Å²	45.4	80%	0.804	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	20.8	-178.5	0	0	0	0	0	115	G204 Y208	G204-G206 PolarHBondContact O-N 2.84Å; G206-Y208 PolarHBondContact O-N 2.98Å; G206-Y208 VanDerWaalsContact O-N 3.16Å
207	A	49.1	Very low	68.7	Low	19 Å²	19	44.5 Å²	44.5	16%	0.157	27%	0.268	C	S	.	.			trans	-59.7	118.6	170.9	0	0	0	0	0	109.4	G204 Y209 S210	G204-A207 PolarHBondContact O-N 3.3Å; A207-Y209 PolarHBondContact O-N 3.34Å; A207-S210 VanDerWaalsContact O-CB 3.28Å; A207-S210 WeakPolarHBondContact O-CB 3.43Å; A207-S210 PolarHBondContact O-N 2.89Å; A207-S210 PolarHBondContact O-OG 3.3Å
208	Y	47.3	Very low	69.4	Low	120 Å²	120	44.4 Å²	44.4	47%	0.471	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-47	-35.5	178.1	179.4	-100.7	0	0	0	112.2	G206 S210 F214	G206-Y208 PolarHBondContact O-N 2.98Å; G206-Y208 VanDerWaalsContact O-N 3.16Å; Y208-S210 VanDerWaalsContact C-N 3.34Å; Y208-S210 PolarHBondContact O-N 3.21Å; Y208-F214 HydrophobicContact CD1-CE1 4.04Å; Y208-F214 AromaticContact CD1-CZ 3.71Å; Y208-F214 HydrophobicContact CD1-CZ 3.71Å; Y208-F214 AromaticContact CE1-CE1 3.69Å; Y208-F214 HydrophobicContact CE1-CE1 3.69Å; Y208-F214 AromaticContact CE1-CZ 3.51Å; Y208-F214 HydrophobicContact CE1-CZ 3.51Å; Y208-F214 HydrophobicContact CG-CZ 4.43Å; Y208-F214 WeakPolarHBondContact O-CE2 3.24Å; Y208-F214 WeakPolarHBondContact O-CZ 3.4Å
209	Y	49.8	Very low	70.3	Confident	85 Å²	85	42.8 Å²	42.8	33%	0.333	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-85.9	17.5	179.3	-57.1	-81.5	0	0	0	115.6	S202 A207 E211 F214 H336 L337	S202-Y209 PolarHBondContact OG-O 3.48Å; A207-Y209 PolarHBondContact O-N 3.34Å; Y209-E211 VanDerWaalsContact C-N 3.31Å; Y209-F214 VanDerWaalsContact CA-CD2 3.4Å; Y209-F214 HydrophobicContact CD1-CB 4.11Å; Y209-F214 AromaticContact CD1-CD1 3.27Å; Y209-F214 HydrophobicContact CD1-CD1 3.27Å; Y209-F214 HydrophobicContact CD1-CD2 4.28Å; Y209-F214 AromaticContact CD1-CE1 3.58Å; Y209-F214 HydrophobicContact CD1-CE1 3.58Å; Y209-F214 AromaticContact CD1-CG 3.62Å; Y209-F214 HydrophobicContact CD1-CG 3.62Å; Y209-F214 HydrophobicContact CD1-CZ 4.22Å; Y209-F214 AromaticContact CE1-CD1 3.73Å; Y209-F214 HydrophobicContact CE1-CD1 3.73Å; Y209-F214 AromaticContact CE1-CE1 3.76Å; Y209-F214 HydrophobicContact CE1-CE1 3.76Å; Y209-F214 HydrophobicContact CG-CD1 4.34Å; Y209-F214 HydrophobicContact CG-CG 4.36Å; Y209-H336 VanDerWaalsContact CB-O 3.29Å; Y209-H336 WeakPolarHBondContact CB-O 3.27Å; Y209-H336 WeakPolarHBondContact CD2-O 3.33Å; Y209-L337 HydrophobicContact CE2-CD2 4.17Å
210	S	53	Low	71.1	Confident	54 Å²	54	36 Å²	36	38%	0.378	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-80.9	-10.9	177.8	65.6	0	0	0	0	114.1	A207 Y208	A207-S210 VanDerWaalsContact O-CB 3.28Å; A207-S210 WeakPolarHBondContact O-CB 3.43Å; A207-S210 PolarHBondContact O-N 2.89Å; A207-S210 PolarHBondContact O-OG 3.3Å; Y208-S210 VanDerWaalsContact C-N 3.34Å; Y208-S210 PolarHBondContact O-N 3.21Å
211	E	66.1	Low	72	Confident	81 Å²	81	35.1 Å²	35.1	38%	0.379	23%	0.227	S	C	.	.	S	Bend	trans	-78.6	142	178.7	-58.8	-179.5	-167.6	0	0	110.3	K117 Y209 I213 F214	K117-E211 IonicContact NZ-OE1 3.33Å; K117-E211 PolarHBondContact NZ-OE1 2.71Å; K117-E211 IonicContact NZ-OE2 3.96Å; Y209-E211 VanDerWaalsContact C-N 3.31Å; E211-I213 HydrophobicContact CB-CG2 4.13Å; E211-I213 PolarHBondContact O-N 3.22Å; E211-F214 HydrophobicContact CB-CD2 3.96Å; E211-F214 HydrophobicContact CB-CE2 3.91Å; E211-F214 HydrophobicContact CG-CE2 4.41Å; E211-F214 WeakPolarHBondContact O-CD2 3.49Å; E211-F214 PolarHBondContact O-N 3.31Å; E211-F214 VanDerWaalsContact O-N 3.17Å
212	S	74.2	Confident	72.9	Confident	7 Å²	7	40 Å²	40	5%	0.049	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-55.8	-24.5	-178.1	-46.3	0	0	0	0	113.7	Q198 F214 F215	Q198-S212 PolarHBondContact NE2-OG 3.33Å; S212-F214 PolarHBondContact O-N 3.1Å; S212-F215 PolarHBondContact O-N 2.62Å
213	I	81.8	Confident	74	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.015	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-64.5	-26	-176.9	-160.3	70.9	0	0	0	113.6	M114 V152 V183 L186 L190 E211 F215 L216	M114-I213 HydrophobicContact CE-CB 4.45Å; M114-I213 HydrophobicContact CE-CD1 4.21Å; M114-I213 HydrophobicContact CE-CG1 3.3Å; M114-I213 HydrophobicContact CE-CG2 4.42Å; M114-I213 HydrophobicContact SD-CG1 4.48Å; V152-I213 HydrophobicContact CG1-CD1 3.92Å; V152-I213 HydrophobicContact CG1-CG1 4.24Å; V183-I213 HydrophobicContact CG2-CB 4.29Å; V183-I213 HydrophobicContact CG2-CD1 4.11Å; V183-I213 HydrophobicContact CG2-CG1 3.9Å; V183-I213 HydrophobicContact CG2-CG2 4.48Å; L186-I213 HydrophobicContact CB-CD1 3.83Å; L186-I213 HydrophobicContact CD1-CD1 4.44Å; L190-I213 HydrophobicContact CD1-CD1 3.98Å; E211-I213 HydrophobicContact CB-CG2 4.13Å; E211-I213 PolarHBondContact O-N 3.22Å; I213-F215 PolarHBondContact O-N 3.45Å; I213-F215 VanDerWaalsContact O-N 3.08Å; I213-L216 HydrophobicContact CD1-CB 4.45Å; I213-L216 HydrophobicContact CD1-CD2 4.47Å; I213-L216 VanDerWaalsContact O-CB 3.23Å; I213-L216 WeakPolarHBondContact O-CB 3.36Å; I213-L216 PolarHBondContact O-N 3.32Å
214	F	83.7	Confident	75.9	Confident	31 Å²	31	38.3 Å²	38.3	14%	0.136	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-71.9	0	175.2	-62.3	-74.4	0	0	0	113.7	Y208 Y209 E211 S212 D339	Y208-F214 HydrophobicContact CD1-CE1 4.04Å; Y208-F214 AromaticContact CD1-CZ 3.71Å; Y208-F214 HydrophobicContact CD1-CZ 3.71Å; Y208-F214 AromaticContact CE1-CE1 3.69Å; Y208-F214 HydrophobicContact CE1-CE1 3.69Å; Y208-F214 AromaticContact CE1-CZ 3.51Å; Y208-F214 HydrophobicContact CE1-CZ 3.51Å; Y208-F214 HydrophobicContact CG-CZ 4.43Å; Y208-F214 WeakPolarHBondContact O-CE2 3.24Å; Y208-F214 WeakPolarHBondContact O-CZ 3.4Å; Y209-F214 VanDerWaalsContact CA-CD2 3.4Å; Y209-F214 HydrophobicContact CD1-CB 4.11Å; Y209-F214 AromaticContact CD1-CD1 3.27Å; Y209-F214 HydrophobicContact CD1-CD1 3.27Å; Y209-F214 HydrophobicContact CD1-CD2 4.28Å; Y209-F214 AromaticContact CD1-CE1 3.58Å; Y209-F214 HydrophobicContact CD1-CE1 3.58Å; Y209-F214 AromaticContact CD1-CG 3.62Å; Y209-F214 HydrophobicContact CD1-CG 3.62Å; Y209-F214 HydrophobicContact CD1-CZ 4.22Å; Y209-F214 AromaticContact CE1-CD1 3.73Å; Y209-F214 HydrophobicContact CE1-CD1 3.73Å; Y209-F214 AromaticContact CE1-CE1 3.76Å; Y209-F214 HydrophobicContact CE1-CE1 3.76Å; Y209-F214 HydrophobicContact CG-CD1 4.34Å; Y209-F214 HydrophobicContact CG-CG 4.36Å; E211-F214 HydrophobicContact CB-CD2 3.96Å; E211-F214 HydrophobicContact CB-CE2 3.91Å; E211-F214 HydrophobicContact CG-CE2 4.41Å; E211-F214 WeakPolarHBondContact O-CD2 3.49Å; E211-F214 PolarHBondContact O-N 3.31Å; E211-F214 VanDerWaalsContact O-N 3.17Å; S212-F214 PolarHBondContact O-N 3.1Å; F214-D339 VanDerWaalsContact O-CB 3.3Å; F214-D339 WeakPolarHBondContact O-CB 3.34Å; F214-D339 PolarHBondContact O-N 2.88Å
215	F	88.6	Confident	78.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-112.2	13.6	171.5	-60.1	-91.5	0	0	0	112	V194 M197 Q198 F201 S212 I213 S217 V218	V194-F215 HydrophobicContact CB-CB 3.88Å; V194-F215 HydrophobicContact CB-CG 4.16Å; V194-F215 HydrophobicContact CG1-CB 3.65Å; V194-F215 HydrophobicContact CG1-CG 4.42Å; V194-F215 HydrophobicContact CG2-CB 4.16Å; V194-F215 HydrophobicContact CG2-CD2 4.43Å; V194-F215 HydrophobicContact CG2-CG 4.47Å; M197-F215 HydrophobicContact CG-CD1 3.93Å; M197-F215 HydrophobicContact CG-CE1 4.02Å; M197-F215 HydrophobicContact SD-CB 4.34Å; M197-F215 HydrophobicContact SD-CD1 3.46Å; M197-F215 WeakPolarHBondContact SD-CD1 3.27Å; M197-F215 HydrophobicContact SD-CE1 4.05Å; M197-F215 HydrophobicContact SD-CG 4.11Å; Q198-F215 HydrophobicContact CG-CD2 4.19Å; Q198-F215 HydrophobicContact CG-CE2 3.68Å; Q198-F215 HydrophobicContact CG-CZ 4.24Å; F201-F215 HydrophobicContact CB-CE1 3.84Å; F201-F215 HydrophobicContact CB-CZ 3.8Å; F201-F215 AromaticContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CD2-CE1 3.89Å; F201-F215 HydrophobicContact CD2-CZ 4.49Å; F201-F215 HydrophobicContact CG-CE1 4.29Å; S212-F215 PolarHBondContact O-N 2.62Å; I213-F215 PolarHBondContact O-N 3.45Å; I213-F215 VanDerWaalsContact O-N 3.08Å; F215-S217 VanDerWaalsContact C-N 3.31Å; F215-S217 PolarHBondContact O-N 2.6Å; F215-V218 HydrophobicContact CB-CG2 4.4Å; F215-V218 HydrophobicContact CD1-CG2 4.35Å; F215-V218 WeakPolarHBondContact O-CB 3.24Å; F215-V218 PolarHBondContact O-N 3.15Å; F215-V218 VanDerWaalsContact O-N 3.1Å
216	L	94.1	Very high	80.8	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-45.1	-178.2	174.7	63.5	0	0	0	112.1	L112 M114 V152 L186 L190 I213 V218 A219 M220 I223	L112-L216 HydrophobicContact CD1-CD2 4.35Å; L112-L216 HydrophobicContact CD2-CD2 4.1Å; M114-L216 HydrophobicContact SD-CD2 3.94Å; V152-L216 HydrophobicContact CG2-CD2 3.75Å; L186-L216 HydrophobicContact CD1-CD1 4.3Å; L186-L216 HydrophobicContact CD1-CD2 4.24Å; L190-L216 HydrophobicContact CD1-CB 3.88Å; L190-L216 HydrophobicContact CD1-CD1 3.85Å; L190-L216 HydrophobicContact CD1-CG 4.46Å; L190-L216 HydrophobicContact CD2-CD1 4.28Å; L190-L216 HydrophobicContact CG-CD1 4.38Å; I213-L216 HydrophobicContact CD1-CB 4.45Å; I213-L216 HydrophobicContact CD1-CD2 4.47Å; I213-L216 VanDerWaalsContact O-CB 3.23Å; I213-L216 WeakPolarHBondContact O-CB 3.36Å; I213-L216 PolarHBondContact O-N 3.32Å; L216-V218 VanDerWaalsContact C-N 3.26Å; L216-V218 PolarHBondContact O-N 2.93Å; L216-A219 CarbonylContact O-C 3.39Å; L216-A219 PolarHBondContact O-N 3.44Å; L216-M220 HydrophobicContact CD1-CE 4.29Å; L216-M220 HydrophobicContact CD1-SD 3.89Å; L216-M220 HydrophobicContact CD2-CE 3.83Å; L216-M220 HydrophobicContact CD2-SD 4.27Å; L216-M220 HydrophobicContact CG-CE 3.58Å; L216-M220 HydrophobicContact CG-SD 3.87Å; L216-M220 VanDerWaalsContact O-CA 3.28Å; L216-M220 WeakPolarHBondContact O-CA 3.28Å; L216-M220 WeakPolarHBondContact O-CB 3.34Å; L216-M220 PolarHBondContact O-N 2.57Å; L216-I223 HydrophobicContact CD1-CB 4.42Å; L216-I223 HydrophobicContact CD1-CG1 4.29Å; L216-I223 HydrophobicContact CD1-CG2 4.14Å
217	S	97.1	Very high	83.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-36.4	178.3	57.7	0	0	0	0	112.9	F215 A219 Q233 M302 D339 F343	F215-S217 VanDerWaalsContact C-N 3.31Å; F215-S217 PolarHBondContact O-N 2.6Å; S217-A219 VanDerWaalsContact C-N 3.3Å; S217-A219 PolarHBondContact O-N 2.76Å; S217-Q233 VanDerWaalsContact CB-OE1 3.25Å; S217-M302 VanDerWaalsContact CB-CE 3.45Å; S217-D339 WeakPolarHBondContact CB-OD2 3.34Å; S217-D339 WeakPolarHBondContact OG-CB 3.31Å; S217-D339 PolarHBondContact OG-OD2 2.79Å; S217-F343 VanDerWaalsContact OG-CE2 3.31Å; S217-F343 WeakPolarHBondContact OG-CE2 3.47Å
218	V	96.8	Very high	85.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-38	-178.6	179.1	0	0	0	0	111.6	M197 F215 L216 Y315 L319 D339 F342 F343	M197-V218 HydrophobicContact CE-CG1 3.98Å; M197-V218 HydrophobicContact SD-CG1 4.04Å; F215-V218 HydrophobicContact CB-CG2 4.4Å; F215-V218 HydrophobicContact CD1-CG2 4.35Å; F215-V218 WeakPolarHBondContact O-CB 3.24Å; F215-V218 PolarHBondContact O-N 3.15Å; F215-V218 VanDerWaalsContact O-N 3.1Å; L216-V218 VanDerWaalsContact C-N 3.26Å; L216-V218 PolarHBondContact O-N 2.93Å; V218-Y315 PolarHBondContact O-OH 3.01Å; V218-L319 HydrophobicContact CG1-CD2 3.37Å; V218-D339 HydrophobicContact CG2-CB 3.76Å; V218-F342 HydrophobicContact CB-CD1 4.26Å; V218-F342 HydrophobicContact CB-CE1 4.5Å; V218-F342 HydrophobicContact CG1-CD1 3.62Å; V218-F342 HydrophobicContact CG1-CE1 3.5Å; V218-F342 VanDerWaalsContact CG1-CE1 3.5Å; V218-F342 HydrophobicContact CG1-CG 4.32Å; V218-F342 HydrophobicContact CG1-CZ 4.12Å; V218-F342 HydrophobicContact CG2-CB 4.31Å; V218-F342 HydrophobicContact CG2-CD1 3.63Å; V218-F342 HydrophobicContact CG2-CE1 4.33Å; V218-F342 HydrophobicContact CG2-CG 4.19Å; V218-F343 HydrophobicContact CB-CZ 4.35Å; V218-F343 HydrophobicContact CG2-CE1 4.02Å; V218-F343 HydrophobicContact CG2-CE2 4.3Å; V218-F343 HydrophobicContact CG2-CZ 3.79Å
219	A	96.2	Very high	88	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-116.4	15.2	-176.5	0	0	0	0	0	113.2	L190 I193 L216 S217 H221 H222 I223	L190-A219 HydrophobicContact CD2-CB 3.72Å; I193-A219 HydrophobicContact CB-CB 4.43Å; I193-A219 HydrophobicContact CD1-CB 4.02Å; I193-A219 HydrophobicContact CG2-CB 3.87Å; L216-A219 CarbonylContact O-C 3.39Å; L216-A219 PolarHBondContact O-N 3.44Å; S217-A219 VanDerWaalsContact C-N 3.3Å; S217-A219 PolarHBondContact O-N 2.76Å; A219-H221 PolarHBondContact O-N 2.93Å; A219-H222 WeakPolarHBondContact O-CB 3.36Å; A219-H222 PolarHBondContact O-N 2.95Å; A219-I223 WeakPolarHBondContact O-CG1 3.27Å; A219-I223 PolarHBondContact O-N 3.37Å
220	M	97.6	Very high	90.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-52.4	-35.2	-173.9	-171	71.7	79.2	0	0	112.2	L112 L216 H222 I223 M224 I231 Q233 L304 L306	L112-M220 HydrophobicContact CD1-CE 3.92Å; L112-M220 HydrophobicContact CD1-SD 4.17Å; L112-M220 HydrophobicContact CD2-CE 4.15Å; L216-M220 HydrophobicContact CD1-CE 4.29Å; L216-M220 HydrophobicContact CD1-SD 3.89Å; L216-M220 HydrophobicContact CD2-CE 3.83Å; L216-M220 HydrophobicContact CD2-SD 4.27Å; L216-M220 HydrophobicContact CG-CE 3.58Å; L216-M220 HydrophobicContact CG-SD 3.87Å; L216-M220 VanDerWaalsContact O-CA 3.28Å; L216-M220 WeakPolarHBondContact O-CA 3.28Å; L216-M220 WeakPolarHBondContact O-CB 3.34Å; L216-M220 PolarHBondContact O-N 2.57Å; M220-H222 VanDerWaalsContact C-N 3.29Å; M220-H222 PolarHBondContact O-N 3.35Å; M220-I223 PolarHBondContact O-N 3.1Å; M220-I223 VanDerWaalsContact O-N 3.13Å; M220-M224 HydrophobicContact CG-CG 3.86Å; M220-M224 WeakPolarHBondContact O-CB 3.27Å; M220-M224 PolarHBondContact O-N 3.12Å; M220-M224 HydrophobicContact SD-CE 3.46Å; M220-M224 WeakPolarHBondContact SD-CE 3.48Å; M220-M224 HydrophobicContact SD-CG 3.71Å; M220-M224 HydrophobicContact SD-SD 4.48Å; M220-I231 HydrophobicContact CG-CG2 4.04Å; M220-Q233 VanDerWaalsContact CE-OE1 3.22Å; M220-L304 HydrophobicContact CB-CD1 3.9Å; M220-L304 HydrophobicContact CE-CD1 3.98Å; M220-L304 HydrophobicContact CG-CD1 3.98Å; M220-L306 HydrophobicContact CB-CD2 3.84Å; M220-L306 HydrophobicContact CG-CD1 4.29Å; M220-L306 HydrophobicContact CG-CD2 3.7Å
221	H	97.9	Very high	92.5	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.019	20%	0.197	C	C	.	.	H	α-helix	trans	-70.9	-19.2	-179	69.1	-67.3	0	0	0	114.4	A219 L306 M309 R310 Y315 N316	A219-H221 PolarHBondContact O-N 2.93Å; H221-L306 HydrophobicContact CB-CB 4.11Å; H221-L306 HydrophobicContact CB-CD2 4.12Å; H221-M309 HydrophobicContact CB-CB 3.79Å; H221-M309 HydrophobicContact CB-CE 4.45Å; H221-M309 HydrophobicContact CB-SD 4.35Å; H221-R310 HydrophobicContact CB-CG 3.98Å; H221-R310 PolarHBondContact O-NE 2.94Å; H221-R310 PolarHBondContact O-NH2 2.89Å; H221-Y315 AromaticContact CE1-CE1 3.71Å; H221-N316 PolarHBondContact NE2-OD1 3.35Å
222	H	95.9	Very high	94	Very high	103 Å²	103	33.9 Å²	33.9	48%	0.477	18%	0.179	S	C	.	.	H	α-helix	trans	-88.9	-19.7	169.8	-69.5	-54.7	0	0	0	113.2	I193 A219 M220	I193-H222 HydrophobicContact CD1-CB 3.88Å; A219-H222 WeakPolarHBondContact O-CB 3.36Å; A219-H222 PolarHBondContact O-N 2.95Å; M220-H222 VanDerWaalsContact C-N 3.29Å; M220-H222 PolarHBondContact O-N 3.35Å
223	I	94.8	Very high	95.2	Very high	22 Å²	22	34 Å²	34	11%	0.113	18%	0.179	C	C	.	.	H	α-helix	trans	-94.9	-44.4	-173.5	-59.5	-58.4	0	0	0	111.3	L186 K189 L190 L216 A219 M220	L186-I223 HydrophobicContact CD2-CG2 3.56Å; K189-I223 HydrophobicContact CB-CD1 3.53Å; L190-I223 HydrophobicContact CD2-CD1 3.86Å; L190-I223 HydrophobicContact CD2-CG1 3.69Å; L190-I223 HydrophobicContact CG-CD1 3.99Å; L190-I223 HydrophobicContact CG-CG1 4.16Å; L216-I223 HydrophobicContact CD1-CB 4.42Å; L216-I223 HydrophobicContact CD1-CG1 4.29Å; L216-I223 HydrophobicContact CD1-CG2 4.14Å; A219-I223 WeakPolarHBondContact O-CG1 3.27Å; A219-I223 PolarHBondContact O-N 3.37Å; M220-I223 PolarHBondContact O-N 3.1Å; M220-I223 VanDerWaalsContact O-N 3.13Å
224	M	96.3	Very high	96	Very high	11 Å²	11	34 Å²	34	5%	0.054	18%	0.178	C	C	.	.	S	Bend	trans	-79.1	148.8	-179	-67.6	-64	170	0	0	111.4	L112 M220 L228 I231 L306 R310	L112-M224 HydrophobicContact CD1-CE 3.39Å; M220-M224 HydrophobicContact CG-CG 3.86Å; M220-M224 WeakPolarHBondContact O-CB 3.27Å; M220-M224 PolarHBondContact O-N 3.12Å; M220-M224 HydrophobicContact SD-CE 3.46Å; M220-M224 WeakPolarHBondContact SD-CE 3.48Å; M220-M224 HydrophobicContact SD-CG 3.71Å; M220-M224 HydrophobicContact SD-SD 4.48Å; M224-L228 HydrophobicContact CB-CD2 3.9Å; M224-L228 HydrophobicContact CG-CD2 3.94Å; M224-L228 HydrophobicContact SD-CD2 4.06Å; M224-I231 HydrophobicContact CE-CD1 4.43Å; M224-L306 HydrophobicContact CB-CD1 3.79Å; M224-L306 HydrophobicContact CG-CD1 4.15Å; M224-R310 PolarHBondContact O-NH2 2.85Å
225	P	96.3	Very high	96.7	Very high	77 Å²	77	34.7 Å²	34.7	50%	0.5	18%	0.183	S	C	.	.			trans	-59.3	152.8	-178.8	25.7	-35.3	0	0	0	112.1	S227 L228 R310	P225-S227 PolarHBondContact O-N 2.96Å; P225-L228 HydrophobicContact CG-CB 4.22Å; P225-L228 WeakPolarHBondContact O-CB 3.37Å; P225-L228 PolarHBondContact O-N 3.38Å; P225-R310 PolarHBondContact O-NH2 2.93Å
226	E	95.4	Very high	97.1	Very high	171 Å²	171	35.2 Å²	35.2	80%	0.799	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.5	-178.6	-68	-168.9	165	0	0	113.2	L228 R310	E226-L228 PolarHBondContact O-N 3.42Å; E226-R310 PolarHBondContact O-NH1 3.2Å
227	S	95.7	Very high	97.3	Very high	109 Å²	109	36.1 Å²	36.1	76%	0.762	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.1	176	55.8	0	0	0	0	113.3	P225 T229	P225-S227 PolarHBondContact O-N 2.96Å; S227-T229 PolarHBondContact O-N 2.71Å
228	L	97.8	Very high	97.4	Very high	9 Å²	9	36.1 Å²	36.1	5%	0.047	19%	0.191	C	C	.	.			trans	-84.8	112.1	173.6	-174.3	60.4	0	0	0	109.7	H110 M224 P225 E226 R230 I231 L306 R310	H110-L228 HydrophobicContact CB-CD1 3.85Å; H110-L228 WeakPolarHBondContact CD2-CD1 3.43Å; M224-L228 HydrophobicContact CB-CD2 3.9Å; M224-L228 HydrophobicContact CG-CD2 3.94Å; M224-L228 HydrophobicContact SD-CD2 4.06Å; P225-L228 HydrophobicContact CG-CB 4.22Å; P225-L228 WeakPolarHBondContact O-CB 3.37Å; P225-L228 PolarHBondContact O-N 3.38Å; E226-L228 PolarHBondContact O-N 3.42Å; L228-R230 WeakPolarHBondContact CD1-O 3.49Å; L228-I231 HydrophobicContact CD2-CB 4.4Å; L228-I231 HydrophobicContact CD2-CD1 4.05Å; L228-L306 HydrophobicContact CB-CD1 4.48Å; L228-L306 HydrophobicContact CD2-CD1 4.08Å; L228-L306 HydrophobicContact CG-CD1 3.96Å; L228-R310 PolarHBondContact O-NH1 3.4Å; L228-R310 PolarHBondContact O-NH2 2.98Å
229	T	98.3	Very high	97.5	Very high	68 Å²	68	37.1 Å²	37.1	42%	0.417	20%	0.196	S	C	.	.			trans	-100.6	-30.3	-174.3	55.6	0	0	0	0	113.5	S227 D305 L306 S307	S227-T229 PolarHBondContact O-N 2.71Å; T229-D305 CarbonylContact O-C 3.28Å; T229-L306 WeakPolarHBondContact O-CA 3.31Å; T229-L306 WeakPolarHBondContact O-CB 3.25Å; T229-L306 PolarHBondContact O-N 3.12Å; T229-S307 PolarHBondContact O-N 2.96Å; T229-S307 VanDerWaalsContact O-N 3.13Å
230	R	98.6	Very high	97.6	Very high	96 Å²	96	37.3 Å²	37.3	36%	0.362	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	138.9	-178.3	-65.5	175.4	-177.7	173.3	2.1	109.9	L228 F251 D252 L304 D305	L228-R230 WeakPolarHBondContact CD1-O 3.49Å; R230-F251 HydrophobicContact CB-CD2 4.43Å; R230-F251 HydrophobicContact CB-CE1 4.13Å; R230-F251 HydrophobicContact CB-CE2 4.04Å; R230-F251 HydrophobicContact CB-CZ 3.87Å; R230-F251 HydrophobicContact CG-CD1 4.1Å; R230-F251 HydrophobicContact CG-CE1 4.08Å; R230-F251 HydrophobicContact CG-CG 4.37Å; R230-F251 HydrophobicContact CG-CZ 4.32Å; R230-D252 IonicContact NH1-OD1 3.61Å; R230-D252 PolarHBondContact NH1-OD1 3.03Å; R230-L304 WeakPolarHBondContact CA-O 3.16Å; R230-D305 IonicContact NE-OD2 3.31Å; R230-D305 PolarHBondContact NE-OD2 3.32Å; R230-D305 IonicContact NH2-OD2 3.35Å
231	I	98.8	Very high	97.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144	174.9	-166.6	170.7	0	0	0	109.7	H110 L112 M220 M224 L228 L304 L306	H110-I231 HydrophobicContact CB-CB 4.27Å; H110-I231 HydrophobicContact CB-CD1 4.37Å; H110-I231 HydrophobicContact CB-CG1 3.84Å; H110-I231 WeakPolarHBondContact O-CA 3.5Å; H110-I231 WeakPolarHBondContact O-CG1 3.11Å; L112-I231 HydrophobicContact CB-CD1 3.65Å; L112-I231 HydrophobicContact CB-CG1 4.18Å; L112-I231 HydrophobicContact CD1-CD1 3.98Å; L112-I231 HydrophobicContact CG-CD1 4.48Å; M220-I231 HydrophobicContact CG-CG2 4.04Å; M224-I231 HydrophobicContact CE-CD1 4.43Å; L228-I231 HydrophobicContact CD2-CB 4.4Å; L228-I231 HydrophobicContact CD2-CD1 4.05Å; I231-L304 HydrophobicContact CG2-CB 3.92Å; I231-L304 HydrophobicContact CG2-CD1 4.15Å; I231-L304 HydrophobicContact CG2-CG 4.46Å; I231-L304 PolarHBondContact N-O 3.41Å; I231-L304 PolarHBondContact O-N 2.68Å; I231-L306 HydrophobicContact CG2-CD1 3.97Å; I231-L306 HydrophobicContact CG2-CD2 3.95Å; I231-L306 HydrophobicContact CG2-CG 4.06Å
232	V	98.8	Very high	97.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	126.7	170.7	-174.9	0	0	0	0	108.3	H110 A111 L112 L234 L247 F248 F251 M302 L303	H110-V232 PolarHBondContact O-N 2.79Å; A111-V232 CarbonylContact C-O 3.58Å; A111-V232 VanDerWaalsContact CA-O 3.27Å; A111-V232 WeakPolarHBondContact CA-O 3.47Å; L112-V232 PolarHBondContact N-O 2.82Å; V232-L234 HydrophobicContact CG1-CD1 4.08Å; V232-L234 HydrophobicContact CG1-CD2 3.68Å; V232-L234 HydrophobicContact CG1-CG 3.75Å; V232-L247 HydrophobicContact CG1-CD2 3.72Å; V232-L247 HydrophobicContact CG1-CG 4.48Å; V232-F248 HydrophobicContact CB-CE1 4.31Å; V232-F248 HydrophobicContact CB-CZ 4.28Å; V232-F248 HydrophobicContact CG2-CD1 3.75Å; V232-F248 HydrophobicContact CG2-CE1 3.46Å; V232-F248 VanDerWaalsContact CG2-CE1 3.46Å; V232-F248 HydrophobicContact CG2-CE2 4.3Å; V232-F248 HydrophobicContact CG2-CG 4.3Å; V232-F248 HydrophobicContact CG2-CZ 3.75Å; V232-F251 HydrophobicContact CG2-CE2 3.96Å; V232-F251 HydrophobicContact CG2-CZ 4.48Å; V232-M302 CarbonylContact C-O 3.5Å; V232-M302 VanDerWaalsContact CA-O 3.24Å; V232-M302 WeakPolarHBondContact CA-O 3.43Å; V232-M302 WeakPolarHBondContact CG1-O 3.27Å; V232-L303 HydrophobicContact CG1-CD1 4.22Å; V232-L303 HydrophobicContact CG2-CD1 4.34Å; V232-L303 HydrophobicContact CG2-CG 4.12Å
233	Q	98.8	Very high	97.7	Very high	10 Å²	10	38.2 Å²	38.2	5%	0.047	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.9	170.7	-176.9	172.5	-28.4	0	0	109.8	L112 S217 M220 M302 L304	L112-Q233 HydrophobicContact CD2-CG 4Å; L112-Q233 CarbonylContact O-C 3.6Å; L112-Q233 WeakPolarHBondContact O-CA 3.13Å; S217-Q233 VanDerWaalsContact CB-OE1 3.25Å; M220-Q233 VanDerWaalsContact CE-OE1 3.22Å; Q233-M302 HydrophobicContact CB-CB 4.43Å; Q233-M302 HydrophobicContact CB-CE 4Å; Q233-M302 VanDerWaalsContact CD-CE 3.49Å; Q233-M302 HydrophobicContact CG-CE 3.9Å; Q233-M302 PolarHBondContact N-O 3.29Å; Q233-M302 PolarHBondContact O-N 3Å; Q233-L304 HydrophobicContact CB-CD1 4.41Å
234	L	98.8	Very high	97.9	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.6	-169.3	-62.1	163.7	0	0	0	110.5	A111 L112 M113 V232 L238 Y240 I244 L247 G300 V301	A111-L234 HydrophobicContact CB-CD1 4.04Å; L112-L234 PolarHBondContact O-N 2.99Å; M113-L234 WeakPolarHBondContact CA-O 3.34Å; M113-L234 HydrophobicContact CE-CB 4.29Å; M113-L234 HydrophobicContact CE-CD1 4.21Å; M113-L234 HydrophobicContact CG-CB 4.2Å; M113-L234 WeakPolarHBondContact CG-O 3.33Å; V232-L234 HydrophobicContact CG1-CD1 4.08Å; V232-L234 HydrophobicContact CG1-CD2 3.68Å; V232-L234 HydrophobicContact CG1-CG 3.75Å; L234-L238 HydrophobicContact CB-CD1 4.01Å; L234-L238 HydrophobicContact CD2-CD1 4.04Å; L234-Y240 WeakPolarHBondContact CD1-OH 3.36Å; L234-I244 HydrophobicContact CD1-CD1 3.83Å; L234-L247 HydrophobicContact CD2-CD2 4.17Å; L234-G300 WeakPolarHBondContact CA-O 3.46Å; L234-V301 HydrophobicContact CD2-CB 4.28Å; L234-V301 HydrophobicContact CD2-CG1 3.9Å; L234-V301 HydrophobicContact CD2-CG2 3.98Å
235	D	98.3	Very high	98	Very high	46 Å²	46	38.9 Å²	38.9	25%	0.246	20%	0.203	C	C	.	.			trans	-72.2	161.7	170.9	-82.4	-10.4	0	0	0	112.3	L238 G300 H392	D235-L238 HydrophobicContact CB-CD2 4.35Å; D235-L238 HydrophobicContact CB-CG 4.24Å; D235-L238 WeakPolarHBondContact O-CD1 3.28Å; D235-L238 WeakPolarHBondContact O-CG 3.3Å; D235-G300 VanDerWaalsContact CG-CA 3.46Å; D235-G300 PolarHBondContact N-O 3.06Å; D235-G300 WeakPolarHBondContact OD2-CA 3.43Å; D235-H392 IonicContact OD2-CE1 3.25Å; D235-H392 PolarHBondContact OD2-CE1 3.28Å; D235-H392 IonicContact OD2-NE2 2.68Å; D235-H392 PolarHBondContact OD2-NE2 3.34Å
236	L	97.7	Very high	98.1	Very high	11 Å²	11	37.6 Å²	37.6	6%	0.058	19%	0.192	C	C	.	.	S	Bend	trans	-84.4	-14.7	179.6	-62.4	-176.2	0	0	0	114	M113 M114 F115 V118 L124 K127 F128 A131 L238	M113-L236 HydrophobicContact CB-CD2 3.67Å; M113-L236 HydrophobicContact CG-CD2 4.22Å; M113-L236 HydrophobicContact SD-CD2 3.88Å; M114-L236 WeakPolarHBondContact O-CD1 3.03Å; M114-L236 WeakPolarHBondContact O-CG 3.36Å; F115-L236 HydrophobicContact CD2-CD1 3.68Å; F115-L236 HydrophobicContact CD2-CD2 3.97Å; F115-L236 HydrophobicContact CE2-CD1 4.22Å; V118-L236 HydrophobicContact CG2-CD1 4.3Å; L124-L236 HydrophobicContact CD1-CB 4.05Å; L124-L236 HydrophobicContact CD1-CD1 3.93Å; L124-L236 HydrophobicContact CD2-CD1 4.34Å; L124-L236 HydrophobicContact CG-CD1 4.09Å; K127-L236 CarbonylContact C-O 3.24Å; K127-L236 VanDerWaalsContact O-O 3.12Å; F128-L236 HydrophobicContact CD2-CD2 3.6Å; F128-L236 HydrophobicContact CE2-CD2 4.03Å; F128-L236 HydrophobicContact CG-CD2 4.42Å; F128-L236 PolarHBondContact N-O 2.85Å; A131-L236 WeakPolarHBondContact CB-O 3.46Å; L236-L238 VanDerWaalsContact C-N 3.35Å
237	D	97.9	Very high	98.2	Very high	20 Å²	20	29.4 Å²	29.4	11%	0.107	15%	0.154	C	C	.	.	S	Bend	trans	-103.1	42.1	-178.9	59.6	-7.2	0	0	0	112.8	K127 H392 G393 I399	K127-D237 HydrophobicContact CB-CB 3.93Å; K127-D237 HydrophobicContact CD-CB 3.65Å; K127-D237 HydrophobicContact CG-CB 3.81Å; K127-D237 IonicContact NZ-OD2 3.37Å; K127-D237 PolarHBondContact NZ-OD2 2.75Å; D237-H392 IonicContact OD1-CD2 2.71Å; D237-H392 PolarHBondContact OD1-CD2 2.89Å; D237-H392 IonicContact OD1-NE2 3.34Å; D237-H392 PolarHBondContact OD1-NE2 3.46Å; D237-G393 PolarHBondContact O-N 3.42Å; D237-I399 WeakPolarHBondContact O-CD1 3.36Å
238	L	98.7	Very high	98.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	159.9	174.2	-56.6	-179	0	0	0	111.7	A131 L234 D235 L236 Y240 V301 I390 Y391 H392	A131-L238 WeakPolarHBondContact CA-O 3.4Å; A131-L238 VanDerWaalsContact CB-O 3.26Å; A131-L238 WeakPolarHBondContact CB-O 3.27Å; A131-L238 PolarHBondContact N-O 2.96Å; L234-L238 HydrophobicContact CB-CD1 4.01Å; L234-L238 HydrophobicContact CD2-CD1 4.04Å; D235-L238 HydrophobicContact CB-CD2 4.35Å; D235-L238 HydrophobicContact CB-CG 4.24Å; D235-L238 WeakPolarHBondContact O-CD1 3.28Å; D235-L238 WeakPolarHBondContact O-CG 3.3Å; L236-L238 VanDerWaalsContact C-N 3.35Å; L238-Y240 HydrophobicContact CB-CE2 4.34Å; L238-V301 HydrophobicContact CD1-CG2 4.03Å; L238-V301 HydrophobicContact CD2-CG2 4.48Å; L238-I390 HydrophobicContact CB-CG2 3.92Å; L238-I390 HydrophobicContact CD1-CG2 4.15Å; L238-I390 HydrophobicContact CD2-CG2 4.07Å; L238-I390 HydrophobicContact CG-CG2 4.26Å; L238-Y391 CarbonylContact C-O 3.5Å; L238-Y391 VanDerWaalsContact CA-O 3.24Å; L238-Y391 WeakPolarHBondContact CA-O 3.31Å; L238-H392 HydrophobicContact CD2-CB 3.58Å
239	K	98.6	Very high	98.4	Very high	22 Å²	22	28.7 Å²	28.7	10%	0.096	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.2	164.7	-178.8	-178.4	174.6	-176.5	0	108.8	V130 I390 Y391 I399 P400 D402	V130-K239 HydrophobicContact CG1-CB 4.04Å; V130-K239 HydrophobicContact CG1-CD 4.32Å; V130-K239 HydrophobicContact CG1-CG 4.1Å; K239-I390 WeakPolarHBondContact O-CA 3.29Å; K239-Y391 PolarHBondContact N-O 3.49Å; K239-Y391 PolarHBondContact O-N 2.8Å; K239-I399 HydrophobicContact CB-CD1 3.94Å; K239-I399 HydrophobicContact CB-CG2 3.8Å; K239-I399 HydrophobicContact CD-CG2 3.59Å; K239-I399 HydrophobicContact CG-CG2 4.33Å; K239-P400 PolarHBondContact NZ-O 3.45Å; K239-D402 WeakPolarHBondContact CE-OD1 3.3Å; K239-D402 IonicContact NZ-OD1 3.98Å; K239-D402 PolarHBondContact NZ-OD1 3.41Å
240	Y	98.5	Very high	98.4	Very high	3 Å²	3	26.1 Å²	26.1	1%	0.012	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	137	-178.1	-59.3	-100.4	0	0	0	110	A131 S134 M135 L138 L234 L238 I244 I390	A131-Y240 HydrophobicContact CB-CE2 4.28Å; A131-Y240 VanDerWaalsContact O-CD2 3.23Å; A131-Y240 WeakPolarHBondContact O-CD2 3.46Å; A131-Y240 WeakPolarHBondContact O-CE2 3.48Å; S134-Y240 PolarHBondContact OG-N 3.32Å; M135-Y240 HydrophobicContact CB-CD1 4.47Å; M135-Y240 HydrophobicContact CB-CD2 3.56Å; M135-Y240 HydrophobicContact CB-CE2 3.77Å; M135-Y240 HydrophobicContact CB-CG 3.95Å; M135-Y240 HydrophobicContact CG-CD1 4.45Å; M135-Y240 HydrophobicContact CG-CD2 4.33Å; M135-Y240 HydrophobicContact CG-CE1 4.43Å; M135-Y240 HydrophobicContact CG-CE2 4.33Å; M135-Y240 HydrophobicContact CG-CG 4.4Å; L138-Y240 VanDerWaalsContact CD1-O 3.27Å; L138-Y240 WeakPolarHBondContact CD1-O 3.33Å; L234-Y240 WeakPolarHBondContact CD1-OH 3.36Å; L238-Y240 HydrophobicContact CB-CE2 4.34Å; Y240-I244 HydrophobicContact CD1-CB 4.45Å; Y240-I244 HydrophobicContact CE1-CB 4.45Å; Y240-I244 HydrophobicContact CE1-CD1 3.82Å; Y240-I244 HydrophobicContact CE1-CG1 4.11Å; Y240-I390 HydrophobicContact CD1-CD1 3.98Å; Y240-I390 HydrophobicContact CD1-CG1 4.08Å; Y240-I390 HydrophobicContact CE1-CD1 3.93Å; Y240-I390 HydrophobicContact CE1-CG1 4.48Å
241	K	98.2	Very high	98.4	Very high	71 Å²	71	21.9 Å²	21.9	31%	0.309	11%	0.105	S	C	.	.	S	Bend	trans	-119.8	-3.3	177.5	-62.3	-67.5	-65.5	-174.7	0	112.4	L138 V388 Y389 Y391 D402	L138-K241 VanDerWaalsContact CD1-C 3.46Å; K241-V388 WeakPolarHBondContact CB-O 3.24Å; K241-Y389 WeakPolarHBondContact CA-O 3.5Å; K241-Y389 WeakPolarHBondContact CB-O 3.4Å; K241-Y389 PolarHBondContact N-O 3.1Å; K241-Y391 HydrophobicContact CD-CD2 4.24Å; K241-Y391 HydrophobicContact CD-CE2 4.25Å; K241-Y391 HydrophobicContact CG-CD2 3.94Å; K241-Y391 HydrophobicContact CG-CE2 4.12Å; K241-D402 IonicContact NZ-OD1 2.63Å; K241-D402 PolarHBondContact NZ-OD1 3.09Å; K241-D402 IonicContact NZ-OD2 3.76Å
242	T	98	Very high	98.4	Very high	34 Å²	34	27.5 Å²	27.5	21%	0.209	14%	0.136	C	C	.	.	S	Bend	trans	-141.4	175.6	174.3	-163.1	0	0	0	0	111	I244 W361 Y389	T242-I244 PolarHBondContact O-N 2.88Å; T242-W361 HydrophobicContact CG2-CH2 3.75Å; T242-W361 HydrophobicContact CG2-CZ3 3.65Å; T242-Y389 HydrophobicContact CG2-CD1 3.87Å; T242-Y389 HydrophobicContact CG2-CG 4.19Å; T242-Y389 PolarHBondContact N-O 2.94Å
243	N	98.4	Very high	98.4	Very high	21 Å²	21	32.9 Å²	32.9	11%	0.112	16%	0.159	C	C	.	.			trans	-64.4	122.3	173.4	-176.4	3.9	0	0	0	111.2	L138 A139 H140 R245 D246	L138-N243 WeakPolarHBondContact O-CA 3.44Å; A139-N243 WeakPolarHBondContact CA-OD1 3.42Å; H140-N243 PolarHBondContact N-OD1 2.79Å; H140-N243 PolarHBondContact O-ND2 3.19Å; H140-N243 PolarHBondContact O-OD1 3.18Å; N243-R245 PolarHBondContact O-N 3.04Å; N243-R245 VanDerWaalsContact O-N 3.16Å; N243-R245 WeakPolarHBondContact OD1-CB 3.46Å; N243-R245 PolarHBondContact OD1-N 2.88Å; N243-R245 VanDerWaalsContact OD1-N 3.08Å; N243-D246 WeakPolarHBondContact O-CB 3.41Å; N243-D246 PolarHBondContact O-N 3.01Å
244	I	98.2	Very high	98.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-59.5	-26.6	177.8	-168	174.3	0	0	0	112.7	M135 A139 F141 L147 L234 Y240 T242 D246 L247 F248	M135-I244 HydrophobicContact CG-CB 4.3Å; M135-I244 HydrophobicContact CG-CD1 4.2Å; M135-I244 HydrophobicContact CG-CG2 4.14Å; M135-I244 HydrophobicContact SD-CD1 3.74Å; M135-I244 HydrophobicContact SD-CG2 4.48Å; A139-I244 HydrophobicContact CB-CG2 4.03Å; F141-I244 HydrophobicContact CE2-CG2 4.11Å; F141-I244 HydrophobicContact CZ-CG2 3.91Å; L147-I244 HydrophobicContact CD2-CG2 4.47Å; L234-I244 HydrophobicContact CD1-CD1 3.83Å; Y240-I244 HydrophobicContact CD1-CB 4.45Å; Y240-I244 HydrophobicContact CE1-CB 4.45Å; Y240-I244 HydrophobicContact CE1-CD1 3.82Å; Y240-I244 HydrophobicContact CE1-CG1 4.11Å; T242-I244 PolarHBondContact O-N 2.88Å; I244-D246 PolarHBondContact O-N 3.26Å; I244-L247 VanDerWaalsContact O-CB 3.27Å; I244-L247 WeakPolarHBondContact O-CB 3.48Å; I244-L247 PolarHBondContact O-N 3.25Å; I244-F248 HydrophobicContact CG1-CE2 4.21Å; I244-F248 WeakPolarHBondContact O-CD2 3.25Å
245	R	98.1	Very high	98.3	Very high	45 Å²	45	36.8 Å²	36.8	17%	0.17	18%	0.182	C	C	.	.	H	α-helix	trans	-56.8	-33	175	-174.7	179.1	177.1	-97.5	-0.7	112.5	Y109 H140 F141 E145 N243 L247 F248	Y109-R245 HydrophobicContact CE1-CG 4.38Å; H140-R245 VanDerWaalsContact O-CD 3.23Å; H140-R245 WeakPolarHBondContact O-CD 3.45Å; F141-R245 HydrophobicContact CD1-CB 4.34Å; F141-R245 HydrophobicContact CD1-CG 4.23Å; F141-R245 HydrophobicContact CE1-CB 3.94Å; F141-R245 HydrophobicContact CE1-CG 4.1Å; F141-R245 HydrophobicContact CZ-CB 4.2Å; E145-R245 IonicContact OE1-CZ 3.54Å; E145-R245 IonicContact OE1-NE 2.73Å; E145-R245 PolarHBondContact OE1-NE 3.48Å; E145-R245 IonicContact OE1-NH2 3.63Å; E145-R245 PolarHBondContact OE1-NH2 2.88Å; E145-R245 WeakPolarHBondContact OE2-CD 3.38Å; E145-R245 IonicContact OE2-CZ 2.83Å; E145-R245 IonicContact OE2-NE 2.73Å; E145-R245 PolarHBondContact OE2-NE 3.39Å; E145-R245 IonicContact OE2-NH2 3.41Å; N243-R245 PolarHBondContact O-N 3.04Å; N243-R245 VanDerWaalsContact O-N 3.16Å; N243-R245 WeakPolarHBondContact OD1-CB 3.46Å; N243-R245 PolarHBondContact OD1-N 2.88Å; N243-R245 VanDerWaalsContact OD1-N 3.08Å; R245-L247 VanDerWaalsContact C-N 3.27Å; R245-L247 PolarHBondContact O-N 3.15Å; R245-F248 PolarHBondContact O-N 2.91Å
246	D	98.3	Very high	98.3	Very high	50 Å²	50	41.1 Å²	41.1	27%	0.267	21%	0.213	S	C	.	.	H	α-helix	trans	-68.8	-28.4	-180	-62.1	-21.2	0	0	0	111.8	N243 I244 F248 Q249 W361	N243-D246 WeakPolarHBondContact O-CB 3.41Å; N243-D246 PolarHBondContact O-N 3.01Å; I244-D246 PolarHBondContact O-N 3.26Å; D246-F248 VanDerWaalsContact C-N 3.29Å; D246-F248 PolarHBondContact O-N 3.18Å; D246-Q249 WeakPolarHBondContact O-CB 3.49Å; D246-Q249 PolarHBondContact O-N 2.76Å; D246-Q249 VanDerWaalsContact O-N 3.17Å; D246-Q249 PolarHBondContact OD1-NE2 2.77Å; D246-W361 HydrophobicContact CB-CH2 3.85Å; D246-W361 HydrophobicContact CB-CZ2 4.31Å
247	L	98.7	Very high	98.2	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.7	-38.5	173.9	-177.9	59.3	0	0	0	111	V232 L234 I244 R245 Q249 E250 V301 L303 W361 I390	V232-L247 HydrophobicContact CG1-CD2 3.72Å; V232-L247 HydrophobicContact CG1-CG 4.48Å; L234-L247 HydrophobicContact CD2-CD2 4.17Å; I244-L247 VanDerWaalsContact O-CB 3.27Å; I244-L247 WeakPolarHBondContact O-CB 3.48Å; I244-L247 PolarHBondContact O-N 3.25Å; R245-L247 VanDerWaalsContact C-N 3.27Å; R245-L247 PolarHBondContact O-N 3.15Å; L247-Q249 PolarHBondContact O-N 3.17Å; L247-E250 HydrophobicContact CD1-CG 4.49Å; L247-E250 VanDerWaalsContact O-CB 3.28Å; L247-E250 WeakPolarHBondContact O-CB 3.3Å; L247-E250 PolarHBondContact O-N 3.43Å; L247-E250 VanDerWaalsContact O-N 3.09Å; L247-V301 HydrophobicContact CD1-CG1 4.25Å; L247-V301 HydrophobicContact CD2-CG1 3.88Å; L247-L303 HydrophobicContact CD1-CD1 3.64Å; L247-L303 HydrophobicContact CD2-CD1 4.38Å; L247-L303 HydrophobicContact CG-CD1 3.89Å; L247-W361 HydrophobicContact CB-CE3 4.17Å; L247-W361 HydrophobicContact CB-CH2 3.95Å; L247-W361 HydrophobicContact CB-CZ3 3.71Å; L247-W361 HydrophobicContact CD1-CB 4.46Å; L247-W361 HydrophobicContact CD1-CD2 3.71Å; L247-W361 HydrophobicContact CD1-CE3 3.62Å; L247-W361 HydrophobicContact CD1-CG 4.12Å; L247-W361 HydrophobicContact CD1-CZ3 4.06Å; L247-W361 HydrophobicContact CG-CE3 4.37Å; L247-W361 HydrophobicContact CG-CZ3 4.39Å; L247-I390 HydrophobicContact CD2-CD1 4.17Å
248	F	98.6	Very high	98.3	Very high	16 Å²	16	42.3 Å²	42.3	7%	0.07	23%	0.232	C	C	.	.	H	α-helix	trans	-67.7	-22	178.2	-69.7	-94	0	0	0	113.2	Y109 H110 A111 V232 I244 R245 D246 E250 F251	Y109-F248 HydrophobicContact CD1-CB 3.67Å; Y109-F248 AromaticContact CD1-CD1 3.71Å; Y109-F248 HydrophobicContact CD1-CD1 3.71Å; Y109-F248 AromaticContact CD1-CD2 3.76Å; Y109-F248 HydrophobicContact CD1-CD2 3.76Å; Y109-F248 HydrophobicContact CD1-CE1 4.22Å; Y109-F248 HydrophobicContact CD1-CE2 4.29Å; Y109-F248 AromaticContact CD1-CG 3.46Å; Y109-F248 HydrophobicContact CD1-CG 3.46Å; Y109-F248 VanDerWaalsContact CD1-CG 3.46Å; Y109-F248 HydrophobicContact CD1-CZ 4.5Å; Y109-F248 HydrophobicContact CE1-CB 3.83Å; Y109-F248 HydrophobicContact CE1-CG 4.15Å; Y109-F248 HydrophobicContact CG-CD2 4.46Å; Y109-F248 HydrophobicContact CG-CG 4.44Å; H110-F248 WeakPolarHBondContact O-CE1 3.35Å; A111-F248 HydrophobicContact CB-CZ 4.43Å; V232-F248 HydrophobicContact CB-CE1 4.31Å; V232-F248 HydrophobicContact CB-CZ 4.28Å; V232-F248 HydrophobicContact CG2-CD1 3.75Å; V232-F248 HydrophobicContact CG2-CE1 3.46Å; V232-F248 VanDerWaalsContact CG2-CE1 3.46Å; V232-F248 HydrophobicContact CG2-CE2 4.3Å; V232-F248 HydrophobicContact CG2-CG 4.3Å; V232-F248 HydrophobicContact CG2-CZ 3.75Å; I244-F248 HydrophobicContact CG1-CE2 4.21Å; I244-F248 WeakPolarHBondContact O-CD2 3.25Å; R245-F248 PolarHBondContact O-N 2.91Å; D246-F248 VanDerWaalsContact C-N 3.29Å; D246-F248 PolarHBondContact O-N 3.18Å; F248-E250 PolarHBondContact O-N 3.3Å; F248-F251 HydrophobicContact CD1-CE2 4.17Å; F248-F251 WeakPolarHBondContact O-CD2 3.37Å; F248-F251 PolarHBondContact O-N 3.37Å
249	Q	97.8	Very high	98.3	Very high	86 Å²	86	42.4 Å²	42.4	40%	0.402	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-71	-16.8	174.7	-59.9	169.8	11.3	0	0	111.9	D246 L247 F251 D252	D246-Q249 WeakPolarHBondContact O-CB 3.49Å; D246-Q249 PolarHBondContact O-N 2.76Å; D246-Q249 VanDerWaalsContact O-N 3.17Å; D246-Q249 PolarHBondContact OD1-NE2 2.77Å; L247-Q249 PolarHBondContact O-N 3.17Å; Q249-F251 PolarHBondContact O-N 2.86Å; Q249-D252 PolarHBondContact O-N 3.18Å
250	E	98.7	Very high	98.3	Very high	14 Å²	14	41.4 Å²	41.4	7%	0.065	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-66	-22.6	174.4	-63.9	-65.9	139.7	0	0	112.4	L247 F248 D252 K253 F254 L303 Y355 L357 W361	L247-E250 HydrophobicContact CD1-CG 4.49Å; L247-E250 VanDerWaalsContact O-CB 3.28Å; L247-E250 WeakPolarHBondContact O-CB 3.3Å; L247-E250 PolarHBondContact O-N 3.43Å; L247-E250 VanDerWaalsContact O-N 3.09Å; F248-E250 PolarHBondContact O-N 3.3Å; E250-D252 PolarHBondContact O-N 3.38Å; E250-K253 WeakPolarHBondContact O-CB 3.35Å; E250-K253 PolarHBondContact O-N 2.95Å; E250-K253 VanDerWaalsContact O-N 3.11Å; E250-K253 IonicContact OE1-NZ 3.14Å; E250-K253 PolarHBondContact OE1-NZ 2.96Å; E250-K253 WeakPolarHBondContact OE2-CD 3.24Å; E250-K253 IonicContact OE2-NZ 2.76Å; E250-F254 WeakPolarHBondContact O-CD1 3.31Å; E250-L303 HydrophobicContact CB-CD2 3.59Å; E250-Y355 HydrophobicContact CB-CE1 4.15Å; E250-Y355 VanDerWaalsContact OE2-CE1 3.3Å; E250-Y355 WeakPolarHBondContact OE2-CE1 3.25Å; E250-Y355 PolarHBondContact OE2-OH 3.48Å; E250-L357 HydrophobicContact CB-CD2 4.02Å; E250-L357 HydrophobicContact CG-CD2 4.06Å; E250-W361 HydrophobicContact CG-CZ2 4.44Å; E250-W361 PolarHBondContact OE1-NE1 2.99Å
251	F	98.8	Very high	98.3	Very high	7 Å²	7	41.2 Å²	41.2	3%	0.031	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-58.6	-34.8	172	-80.3	-71.5	0	0	0	112.3	R230 V232 F248 Q249 K253 F254 L303 D305	R230-F251 HydrophobicContact CB-CD2 4.43Å; R230-F251 HydrophobicContact CB-CE1 4.13Å; R230-F251 HydrophobicContact CB-CE2 4.04Å; R230-F251 HydrophobicContact CB-CZ 3.87Å; R230-F251 HydrophobicContact CG-CD1 4.1Å; R230-F251 HydrophobicContact CG-CE1 4.08Å; R230-F251 HydrophobicContact CG-CG 4.37Å; R230-F251 HydrophobicContact CG-CZ 4.32Å; V232-F251 HydrophobicContact CG2-CE2 3.96Å; V232-F251 HydrophobicContact CG2-CZ 4.48Å; F248-F251 HydrophobicContact CD1-CE2 4.17Å; F248-F251 WeakPolarHBondContact O-CD2 3.37Å; F248-F251 PolarHBondContact O-N 3.37Å; Q249-F251 PolarHBondContact O-N 2.86Å; F251-K253 PolarHBondContact O-N 3.06Å; F251-F254 HydrophobicContact CD1-CE1 4.24Å; F251-F254 HydrophobicContact CD1-CE2 4.04Å; F251-F254 AromaticContact CD1-CZ 3.79Å; F251-F254 HydrophobicContact CD1-CZ 3.79Å; F251-F254 HydrophobicContact CE1-CE2 4.3Å; F251-F254 HydrophobicContact CE1-CZ 4.04Å; F251-F254 WeakPolarHBondContact O-CB 3.14Å; F251-F254 PolarHBondContact O-N 3.09Å; F251-L303 HydrophobicContact CD1-CB 4.32Å; F251-L303 HydrophobicContact CD1-CD2 4.29Å; F251-L303 HydrophobicContact CD2-CD2 3.8Å; F251-L303 HydrophobicContact CD2-CG 4.22Å; F251-L303 HydrophobicContact CE1-CB 3.69Å; F251-L303 HydrophobicContact CE1-CD2 4.36Å; F251-L303 HydrophobicContact CE1-CG 4.25Å; F251-L303 HydrophobicContact CE2-CB 4.08Å; F251-L303 HydrophobicContact CE2-CD2 3.87Å; F251-L303 HydrophobicContact CE2-CG 3.76Å; F251-L303 HydrophobicContact CG-CD2 4.02Å; F251-L303 HydrophobicContact CZ-CB 3.55Å; F251-L303 HydrophobicContact CZ-CD2 4.16Å; F251-L303 HydrophobicContact CZ-CG 3.78Å; F251-D305 HydrophobicContact CD1-CB 4.17Å; F251-D305 HydrophobicContact CE1-CB 4.01Å
252	D	98.1	Very high	98.4	Very high	119 Å²	119	37.9 Å²	37.9	64%	0.636	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-73.2	-9	-177.9	-58.1	-31	0	0	0	112.4	R230 Q249 E250	R230-D252 IonicContact NH1-OD1 3.61Å; R230-D252 PolarHBondContact NH1-OD1 3.03Å; Q249-D252 PolarHBondContact O-N 3.18Å; E250-D252 PolarHBondContact O-N 3.38Å
253	K	98.6	Very high	98.4	Very high	112 Å²	112	36.2 Å²	36.2	49%	0.487	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-97.9	-0.1	177.9	-57.6	176.9	-171.6	170.7	0	113	E250 F251 P255 Y355	E250-K253 WeakPolarHBondContact O-CB 3.35Å; E250-K253 PolarHBondContact O-N 2.95Å; E250-K253 VanDerWaalsContact O-N 3.11Å; E250-K253 IonicContact OE1-NZ 3.14Å; E250-K253 PolarHBondContact OE1-NZ 2.96Å; E250-K253 WeakPolarHBondContact OE2-CD 3.24Å; E250-K253 IonicContact OE2-NZ 2.76Å; F251-K253 PolarHBondContact O-N 3.06Å; K253-P255 WeakPolarHBondContact O-CD 3.21Å; K253-Y355 HydrophobicContact CB-CE1 4.35Å; K253-Y355 HydrophobicContact CB-CE2 3.91Å; K253-Y355 VanDerWaalsContact CD-OH 3.29Å; K253-Y355 WeakPolarHBondContact CD-OH 3.21Å
254	F	98.6	Very high	98.4	Very high	32 Å²	32	39 Å²	39	14%	0.14	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-63.6	124.4	179.8	-81.9	28.9	0	0	0	109.9	E250 F251 A258 G261 L303 D305 Y355	E250-F254 WeakPolarHBondContact O-CD1 3.31Å; F251-F254 HydrophobicContact CD1-CE1 4.24Å; F251-F254 HydrophobicContact CD1-CE2 4.04Å; F251-F254 AromaticContact CD1-CZ 3.79Å; F251-F254 HydrophobicContact CD1-CZ 3.79Å; F251-F254 HydrophobicContact CE1-CE2 4.3Å; F251-F254 HydrophobicContact CE1-CZ 4.04Å; F251-F254 WeakPolarHBondContact O-CB 3.14Å; F251-F254 PolarHBondContact O-N 3.09Å; F254-A258 HydrophobicContact CB-CB 4.25Å; F254-A258 HydrophobicContact CD2-CB 4.18Å; F254-A258 HydrophobicContact CG-CB 4.35Å; F254-G261 VanDerWaalsContact CZ-CA 3.45Å; F254-L303 HydrophobicContact CE1-CB 4.36Å; F254-L303 HydrophobicContact CE1-CD2 4.17Å; F254-L303 HydrophobicContact CZ-CB 3.82Å; F254-L303 HydrophobicContact CZ-CD2 4.4Å; F254-D305 HydrophobicContact CD2-CB 4.47Å; F254-D305 HydrophobicContact CE2-CB 4.14Å; F254-Y355 AromaticContact CD1-CD1 3.71Å; F254-Y355 HydrophobicContact CD1-CD1 3.71Å; F254-Y355 AromaticContact CD1-CG 3.72Å; F254-Y355 HydrophobicContact CD1-CG 3.72Å; F254-Y355 AromaticContact CE1-CD1 3.6Å; F254-Y355 HydrophobicContact CE1-CD1 3.6Å; F254-Y355 AromaticContact CE1-CG 3.97Å; F254-Y355 HydrophobicContact CE1-CG 3.97Å
255	P	98	Very high	98.4	Very high	62 Å²	62	39.3 Å²	39.3	40%	0.403	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-68.4	160.3	173.1	30.1	-34.7	0	0	0	110.3	K253 G257 A258	K253-P255 WeakPolarHBondContact O-CD 3.21Å; P255-G257 PolarHBondContact O-N 2.94Å; P255-A258 HydrophobicContact CG-CB 3.88Å; P255-A258 WeakPolarHBondContact O-CB 3.24Å; P255-A258 PolarHBondContact O-N 2.98Å
256	P	97.4	Very high	98.4	Very high	136 Å²	136	37.4 Å²	37.4	88%	0.883	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	127.4	174.8	-25.5	34.6	0	0	0	111.8
257	G	97.1	Very high	98.4	Very high	50 Å²	50	35.5 Å²	35.5	52%	0.515	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	-19.7	-179.3	0	0	0	0	0	114.8	P255 E352	P255-G257 PolarHBondContact O-N 2.94Å; G257-E352 CarbonylContact C-O 3.44Å
258	A	98.8	Very high	98.4	Very high	7 Å²	7	35.5 Å²	35.5	6%	0.058	20%	0.196	C	C	.	.			trans	-69.6	134.3	174	0	0	0	0	0	110.7	F254 P255 E352 L353	F254-A258 HydrophobicContact CB-CB 4.25Å; F254-A258 HydrophobicContact CD2-CB 4.18Å; F254-A258 HydrophobicContact CG-CB 4.35Å; P255-A258 HydrophobicContact CG-CB 3.88Å; P255-A258 WeakPolarHBondContact O-CB 3.24Å; P255-A258 PolarHBondContact O-N 2.98Å; A258-E352 WeakPolarHBondContact CA-O 3.38Å; A258-E352 PolarHBondContact N-O 3.14Å; A258-L353 WeakPolarHBondContact CA-O 3.31Å
259	V	98.9	Very high	98.4	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	20%	0.195	C	C	.	.			trans	-117.9	-21.5	-178.8	-60.9	0	0	0	0	112.3	D305 A308 M309 Y315 L353	V259-D305 PolarHBondContact O-N 3.1Å; V259-A308 HydrophobicContact CB-CB 4.3Å; V259-A308 HydrophobicContact CG1-CB 3.91Å; V259-M309 HydrophobicContact CB-CG 3.78Å; V259-M309 HydrophobicContact CG2-CG 4.19Å; V259-Y315 HydrophobicContact CG2-CD2 3.88Å; V259-Y315 HydrophobicContact CG2-CE2 4.37Å; V259-Y315 HydrophobicContact CG2-CG 4.16Å; V259-L353 HydrophobicContact CG1-CD2 4.44Å; V259-L353 HydrophobicContact CG2-CB 4.27Å; V259-L353 HydrophobicContact CG2-CD2 4.15Å; V259-L353 PolarHBondContact N-O 2.98Å
260	I	98.9	Very high	98.4	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.3	-178.2	-67.3	162.4	0	0	0	109.7	I262 L303 L304 M309 Y315 F343 L353 F354 Y355	I260-I262 HydrophobicContact CG2-CB 4.09Å; I260-I262 HydrophobicContact CG2-CG2 4.37Å; I260-L303 CarbonylContact C-O 3.53Å; I260-L303 VanDerWaalsContact CA-O 3.27Å; I260-L303 WeakPolarHBondContact CA-O 3.17Å; I260-L304 HydrophobicContact CD1-CD2 4.33Å; I260-L304 HydrophobicContact CG1-CD2 3.86Å; I260-L304 HydrophobicContact CG2-CD2 4.14Å; I260-M309 HydrophobicContact CD1-CE 4.34Å; I260-M309 HydrophobicContact CG1-SD 4.34Å; I260-Y315 HydrophobicContact CD1-CE2 3.97Å; I260-F343 HydrophobicContact CD1-CD1 3.91Å; I260-F343 HydrophobicContact CD1-CE1 3.37Å; I260-F343 HydrophobicContact CD1-CZ 3.79Å; I260-L353 PolarHBondContact N-O 3.43Å; I260-F354 HydrophobicContact CB-CD1 3.93Å; I260-F354 HydrophobicContact CB-CE1 4.09Å; I260-F354 HydrophobicContact CD1-CE1 4.07Å; I260-F354 HydrophobicContact CG2-CD1 4.01Å; I260-F354 HydrophobicContact CG2-CE1 4.16Å; I260-F354 CarbonylContact O-C 3.54Å; I260-F354 VanDerWaalsContact O-CA 3.27Å; I260-F354 WeakPolarHBondContact O-CA 3.43Å; I260-Y355 PolarHBondContact O-N 3.33Å
261	G	98.9	Very high	98.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	123.1	167.4	0	0	0	0	0	109.1	F254 M302 L303 Y355	F254-G261 VanDerWaalsContact CZ-CA 3.45Å; G261-M302 CarbonylContact O-C 3.42Å; G261-M302 WeakPolarHBondContact O-CA 3Å; G261-L303 PolarHBondContact N-O 3.17Å; G261-L303 PolarHBondContact O-N 3.49Å; G261-Y355 CarbonylContact C-O 3.13Å; G261-Y355 VanDerWaalsContact CA-O 3.27Å; G261-Y355 WeakPolarHBondContact CA-O 3.46Å
262	I	98.9	Very high	98.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	147.7	-174.7	-166	166.8	0	0	0	110.9	I260 F297 N298 M302 F343 F354 Y355 S356 L357	I260-I262 HydrophobicContact CG2-CB 4.09Å; I260-I262 HydrophobicContact CG2-CG2 4.37Å; I262-F297 HydrophobicContact CD1-CB 3.68Å; I262-F297 HydrophobicContact CD1-CG 4.3Å; I262-F297 HydrophobicContact CG1-CB 3.98Å; I262-F297 HydrophobicContact CG1-CG 4.44Å; I262-F297 HydrophobicContact CG2-CB 4.12Å; I262-F297 HydrophobicContact CG2-CD1 3.56Å; I262-F297 HydrophobicContact CG2-CD2 3.96Å; I262-F297 HydrophobicContact CG2-CE1 3.85Å; I262-F297 HydrophobicContact CG2-CE2 4.21Å; I262-F297 HydrophobicContact CG2-CG 3.62Å; I262-F297 HydrophobicContact CG2-CZ 4.17Å; I262-N298 VanDerWaalsContact CG1-O 3.31Å; I262-N298 WeakPolarHBondContact CG1-O 3.48Å; I262-M302 HydrophobicContact CD1-CG 3.75Å; I262-M302 HydrophobicContact CD1-SD 3.93Å; I262-M302 HydrophobicContact CG1-CG 4.01Å; I262-F343 HydrophobicContact CD1-CD2 4.27Å; I262-F354 HydrophobicContact CG2-CB 4.49Å; I262-F354 HydrophobicContact CG2-CD1 3.74Å; I262-F354 HydrophobicContact CG2-CE1 4.47Å; I262-F354 HydrophobicContact CG2-CG 4.47Å; I262-Y355 PolarHBondContact N-O 3.33Å; I262-S356 WeakPolarHBondContact O-CA 3.44Å; I262-L357 PolarHBondContact O-N 3.07Å
263	A	98.5	Very high	98.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.3	176.8	0	0	0	0	0	111.5	F297 N298 L357 N362	A263-F297 WeakPolarHBondContact O-CA 3.47Å; A263-N298 PolarHBondContact O-N 2.78Å; A263-L357 HydrophobicContact CB-CB 4.24Å; A263-N362 HydrophobicContact CB-CB 3.59Å
264	R	98.6	Very high	98.2	Very high	80 Å²	80	25 Å²	25	30%	0.302	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	145.1	172	-69.7	177.7	-173.2	-167.3	-3.1	110.7	P291 P295 G296 S356 Q364	R264-P291 PolarHBondContact NH1-O 3.04Å; R264-P295 HydrophobicContact CB-CG 3.89Å; R264-P295 HydrophobicContact CG-CG 4.11Å; R264-G296 WeakPolarHBondContact CA-O 3.44Å; R264-S356 PolarHBondContact NE-OG 3.29Å; R264-Q364 PolarHBondContact O-OE1 2.85Å
265	E	98.7	Very high	98.2	Very high	7 Å²	7	28.3 Å²	28.3	3%	0.033	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-68.7	127.1	171.8	176.4	50	-107.6	0	0	110.7	Q267 V269 Y270 G296 N298 Q364	E265-Q267 WeakPolarHBondContact OE1-CB 3.46Å; E265-Q267 PolarHBondContact OE1-N 3.33Å; E265-V269 HydrophobicContact CG-CG1 3.43Å; E265-V269 VanDerWaalsContact CG-CG1 3.43Å; E265-Y270 HydrophobicContact CB-CD2 4.06Å; E265-Y270 HydrophobicContact CB-CE2 4.13Å; E265-Y270 HydrophobicContact CG-CD2 3.98Å; E265-Y270 HydrophobicContact CG-CE2 4.07Å; E265-G296 PolarHBondContact N-O 2.77Å; E265-N298 PolarHBondContact OE2-ND2 2.99Å; E265-Q364 PolarHBondContact OE1-NE2 3.13Å; E265-Q364 PolarHBondContact OE2-NE2 2.89Å
266	M	98.6	Very high	98.2	Very high	5 Å²	5	28 Å²	28	3%	0.025	15%	0.152	C	C	.	.	S	Bend	trans	-91.7	5.2	-174.8	-63.9	-179.5	-166.7	0	0	113.8	C359 N362 R363 Q364 Y381 Y382	M266-C359 HydrophobicContact CE-CB 3.38Å; M266-C359 VanDerWaalsContact CE-O 3.29Å; M266-C359 WeakPolarHBondContact CE-O 3.09Å; M266-N362 WeakPolarHBondContact CE-O 3.39Å; M266-R363 PolarHBondContact SD-NH1 3.2Å; M266-Q364 HydrophobicContact CB-CB 4.18Å; M266-Q364 HydrophobicContact CG-CB 4.37Å; M266-Q364 HydrophobicContact CG-CG 4.47Å; M266-Q364 HydrophobicContact SD-CB 3.96Å; M266-Q364 HydrophobicContact SD-CG 4.28Å; M266-Y381 WeakPolarHBondContact CA-O 3.4Å; M266-Y381 CarbonylContact O-C 3.48Å; M266-Y381 VanDerWaalsContact O-C 3.24Å; M266-Y381 WeakPolarHBondContact O-CB 3.39Å; M266-Y382 HydrophobicContact CB-CD2 4.45Å; M266-Y382 VanDerWaalsContact O-CA 3.31Å; M266-Y382 WeakPolarHBondContact O-CA 3.31Å; M266-Y382 PolarHBondContact O-N 3.41Å
267	Q	98.6	Very high	98.2	Very high	11 Å²	11	23.1 Å²	23.1	5%	0.051	12%	0.116	C	C	.	.	S	Bend	trans	-118.1	154.4	173.1	-57.3	-164.5	-74.4	0	0	111.9	E265 V269 C366 T367 W368 W369 F378	E265-Q267 WeakPolarHBondContact OE1-CB 3.46Å; E265-Q267 PolarHBondContact OE1-N 3.33Å; Q267-V269 PolarHBondContact O-N 2.8Å; Q267-C366 VanDerWaalsContact NE2-C 3.25Å; Q267-C366 PolarHBondContact NE2-O 3.02Å; Q267-C366 PolarHBondContact OE1-SG 2.98Å; Q267-T367 VanDerWaalsContact NE2-C 3.32Å; Q267-W368 VanDerWaalsContact NE2-N 3.17Å; Q267-W369 HydrophobicContact CB-CB 4.31Å; Q267-W369 HydrophobicContact CB-CG 4.44Å; Q267-F378 HydrophobicContact CG-CE2 4.16Å
268	P	98.3	Very high	98.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	29.2	177.5	31	-34.8	0	0	0	113.6	Y270 R271 H272 W369 Y374 F378 Y381	P268-Y270 VanDerWaalsContact C-N 3.33Å; P268-Y270 PolarHBondContact O-N 2.97Å; P268-R271 HydrophobicContact CB-CB 3.96Å; P268-R271 VanDerWaalsContact O-CB 3.29Å; P268-R271 WeakPolarHBondContact O-CB 3Å; P268-R271 PolarHBondContact O-N 3.01Å; P268-H272 PolarHBondContact O-N 3.27Å; P268-H272 VanDerWaalsContact O-N 3.1Å; P268-W369 HydrophobicContact CG-CB 4.04Å; P268-Y374 HydrophobicContact CB-CD1 4.16Å; P268-Y374 HydrophobicContact CB-CG 4.15Å; P268-Y374 VanDerWaalsContact CG-CB 3.45Å; P268-Y374 HydrophobicContact CG-CD1 4.25Å; P268-Y374 HydrophobicContact CG-CD2 4.29Å; P268-Y374 HydrophobicContact CG-CG 3.75Å; P268-F378 HydrophobicContact CG-CD2 4.44Å; P268-Y381 HydrophobicContact CB-CD1 4.35Å; P268-Y381 HydrophobicContact CB-CD2 3.88Å; P268-Y381 HydrophobicContact CB-CE1 4.23Å; P268-Y381 HydrophobicContact CB-CE2 3.75Å; P268-Y381 HydrophobicContact CB-CG 4.19Å; P268-Y381 HydrophobicContact CG-CD2 4.42Å
269	V	97.9	Very high	98.2	Very high	8 Å²	8	29.9 Å²	29.9	5%	0.048	13%	0.128	C	C	.	.	H	α-helix	trans	-59.1	-44.5	178.9	62.2	0	0	0	0	110.9	E265 Q267 H272 T273 W369	E265-V269 HydrophobicContact CG-CG1 3.43Å; E265-V269 VanDerWaalsContact CG-CG1 3.43Å; Q267-V269 PolarHBondContact O-N 2.8Å; V269-H272 CarbonylContact O-C 3.6Å; V269-H272 WeakPolarHBondContact O-CA 3.36Å; V269-H272 VanDerWaalsContact O-CB 3.25Å; V269-H272 WeakPolarHBondContact O-CB 3.21Å; V269-H272 PolarHBondContact O-N 3.42Å; V269-H272 VanDerWaalsContact O-N 3.12Å; V269-T273 PolarHBondContact O-N 2.83Å; V269-T273 PolarHBondContact O-OG1 3.35Å; V269-W369 HydrophobicContact CB-CZ2 4.26Å; V269-W369 HydrophobicContact CG2-CZ2 3.73Å
270	Y	98.5	Very high	98.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-77.3	-23.7	178.8	-67.1	-65.2	0	0	0	112.9	E265 P268 H272 T273 F274 P295 F297 F333 Q340 D341 S344	E265-Y270 HydrophobicContact CB-CD2 4.06Å; E265-Y270 HydrophobicContact CB-CE2 4.13Å; E265-Y270 HydrophobicContact CG-CD2 3.98Å; E265-Y270 HydrophobicContact CG-CE2 4.07Å; P268-Y270 VanDerWaalsContact C-N 3.33Å; P268-Y270 PolarHBondContact O-N 2.97Å; Y270-H272 PolarHBondContact O-N 3.2Å; Y270-T273 PolarHBondContact O-N 2.93Å; Y270-F274 HydrophobicContact CD1-CD2 4.23Å; Y270-F274 AromaticContact CD1-CE2 3.74Å; Y270-F274 HydrophobicContact CD1-CE2 3.74Å; Y270-F274 HydrophobicContact CG-CE2 4.2Å; Y270-F274 WeakPolarHBondContact O-CB 3.29Å; Y270-F274 VanDerWaalsContact O-CD2 3.25Å; Y270-F274 WeakPolarHBondContact O-CD2 3.02Å; Y270-F274 PolarHBondContact O-N 2.86Å; Y270-P295 WeakPolarHBondContact CB-O 3.33Å; Y270-P295 WeakPolarHBondContact CD2-O 3.42Å; Y270-F297 WeakPolarHBondContact CE2-O 3.49Å; Y270-F333 HydrophobicContact CD1-CE2 4Å; Y270-F333 HydrophobicContact CD1-CZ 4.35Å; Y270-F333 HydrophobicContact CE1-CE2 4.04Å; Y270-F333 AromaticContact CE1-CZ 3.93Å; Y270-F333 HydrophobicContact CE1-CZ 3.93Å; Y270-Q340 WeakPolarHBondContact OH-CG 3.5Å; Y270-Q340 PolarHBondContact OH-NE2 2.94Å; Y270-Q340 PolarHBondContact OH-O 3Å; Y270-D341 WeakPolarHBondContact CE1-OD1 3.45Å; Y270-D341 PolarHBondContact OH-OD1 3.05Å; Y270-S344 VanDerWaalsContact CE2-OG 3.24Å; Y270-S344 WeakPolarHBondContact CE2-OG 3.37Å; Y270-S344 PolarHBondContact OH-OG 2.92Å
271	R	98.3	Very high	98.2	Very high	46 Å²	46	37.3 Å²	37.3	17%	0.174	17%	0.165	C	C	.	.	H	α-helix	trans	-57.1	-41.1	165.1	-165.8	-167.7	-174.1	84.6	0.6	110.7	P268 G287 E288 Y374 Y381	P268-R271 HydrophobicContact CB-CB 3.96Å; P268-R271 VanDerWaalsContact O-CB 3.29Å; P268-R271 WeakPolarHBondContact O-CB 3Å; P268-R271 PolarHBondContact O-N 3.01Å; R271-G287 WeakPolarHBondContact CB-O 3.22Å; R271-E288 IonicContact CZ-OE2 3.35Å; R271-E288 IonicContact NH1-OE1 3.96Å; R271-E288 IonicContact NH1-OE2 2.62Å; R271-E288 PolarHBondContact NH1-OE2 3.21Å; R271-Y374 HydrophobicContact CG-CE1 4.46Å; R271-Y381 VanDerWaalsContact CD-OH 3.27Å; R271-Y381 WeakPolarHBondContact CD-OH 3.43Å; R271-Y381 WeakPolarHBondContact CG-OH 3.48Å; R271-Y381 PolarHBondContact NH1-OH 3.16Å
272	H	97.2	Very high	98.1	Very high	48 Å²	48	42.5 Å²	42.5	22%	0.222	20%	0.199	C	C	.	.	H	α-helix	trans	-70.1	-52.2	174.9	-174.9	79	0	0	0	111.9	P268 V269 Y270 F274 W275 W369 Y374	P268-H272 PolarHBondContact O-N 3.27Å; P268-H272 VanDerWaalsContact O-N 3.1Å; V269-H272 CarbonylContact O-C 3.6Å; V269-H272 WeakPolarHBondContact O-CA 3.36Å; V269-H272 VanDerWaalsContact O-CB 3.25Å; V269-H272 WeakPolarHBondContact O-CB 3.21Å; V269-H272 PolarHBondContact O-N 3.42Å; V269-H272 VanDerWaalsContact O-N 3.12Å; Y270-H272 PolarHBondContact O-N 3.2Å; H272-F274 VanDerWaalsContact C-N 3.35Å; H272-F274 PolarHBondContact O-N 3.39Å; H272-W275 WeakPolarHBondContact O-CB 3.2Å; H272-W275 PolarHBondContact O-N 2.68Å; H272-W369 HydrophobicContact CB-CH2 3.93Å; H272-W369 HydrophobicContact CB-CZ3 3.89Å; H272-W369 AromaticContact CD2-CH2 3.46Å; H272-W369 VanDerWaalsContact CD2-CH2 3.46Å; H272-W369 WeakPolarHBondContact CD2-CH2 3.45Å; H272-W369 AromaticContact CD2-CZ3 3.96Å; H272-W369 AromaticContact CG-CH2 3.61Å; H272-W369 AromaticContact CG-CZ3 3.66Å; H272-W369 AromaticContact ND1-CZ3 3.95Å; H272-W369 AromaticContact NE2-CH2 3.99Å; H272-Y374 WeakPolarHBondContact CA-OH 3.48Å; H272-Y374 HydrophobicContact CB-CE2 3.96Å; H272-Y374 WeakPolarHBondContact CB-OH 3.35Å; H272-Y374 VanDerWaalsContact CG-OH 3.24Å; H272-Y374 AromaticContact ND1-CE2 3.94Å; H272-Y374 AromaticContact ND1-CZ 3.81Å; H272-Y374 PolarHBondContact ND1-OH 2.83Å
273	T	96.8	Very high	98	Very high	30 Å²	30	50.3 Å²	50.3	18%	0.184	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-41.3	-173.8	-53.4	0	0	0	0	112.2	V269 Y270 W275 F333 K334	V269-T273 PolarHBondContact O-N 2.83Å; V269-T273 PolarHBondContact O-OG1 3.35Å; Y270-T273 PolarHBondContact O-N 2.93Å; T273-W275 VanDerWaalsContact C-N 3.26Å; T273-W275 PolarHBondContact O-N 3.01Å; T273-F333 HydrophobicContact CG2-CD2 3.75Å; T273-F333 HydrophobicContact CG2-CE1 4.21Å; T273-F333 HydrophobicContact CG2-CE2 3.38Å; T273-F333 HydrophobicContact CG2-CG 4.37Å; T273-F333 HydrophobicContact CG2-CZ 3.64Å; T273-K334 WeakPolarHBondContact CG2-O 3.35Å
274	F	97.9	Very high	98	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	16	177	-66.6	-86.3	0	0	0	113.4	Y270 H272 L276 Y277 R278 V286 Y331 F333 M348	Y270-F274 HydrophobicContact CD1-CD2 4.23Å; Y270-F274 AromaticContact CD1-CE2 3.74Å; Y270-F274 HydrophobicContact CD1-CE2 3.74Å; Y270-F274 HydrophobicContact CG-CE2 4.2Å; Y270-F274 WeakPolarHBondContact O-CB 3.29Å; Y270-F274 VanDerWaalsContact O-CD2 3.25Å; Y270-F274 WeakPolarHBondContact O-CD2 3.02Å; Y270-F274 PolarHBondContact O-N 2.86Å; H272-F274 VanDerWaalsContact C-N 3.35Å; H272-F274 PolarHBondContact O-N 3.39Å; F274-L276 VanDerWaalsContact C-N 3.29Å; F274-L276 PolarHBondContact O-N 2.84Å; F274-L276 VanDerWaalsContact O-N 3.16Å; F274-Y277 PolarHBondContact O-N 2.96Å; F274-Y277 VanDerWaalsContact O-N 3.16Å; F274-R278 HydrophobicContact CB-CG 4.31Å; F274-R278 WeakPolarHBondContact O-CG 3.32Å; F274-R278 PolarHBondContact O-N 2.87Å; F274-V286 HydrophobicContact CB-CG1 3.81Å; F274-V286 HydrophobicContact CD1-CG1 3.62Å; F274-V286 HydrophobicContact CD2-CG1 3.85Å; F274-V286 HydrophobicContact CE1-CG1 4.02Å; F274-V286 HydrophobicContact CE2-CG1 4.29Å; F274-V286 HydrophobicContact CG-CG1 3.51Å; F274-V286 HydrophobicContact CZ-CG1 4.36Å; F274-Y331 HydrophobicContact CD1-CD1 4.08Å; F274-Y331 HydrophobicContact CD1-CG 4.35Å; F274-Y331 AromaticContact CE1-CD1 3.84Å; F274-Y331 HydrophobicContact CE1-CD1 3.84Å; F274-Y331 AromaticContact CE1-CG 3.87Å; F274-Y331 HydrophobicContact CE1-CG 3.87Å; F274-F333 AromaticContact CD1-CD2 3.87Å; F274-F333 HydrophobicContact CD1-CD2 3.87Å; F274-F333 HydrophobicContact CD2-CD2 4.26Å; F274-F333 HydrophobicContact CD2-CE2 4.19Å; F274-F333 AromaticContact CE1-CD2 3.38Å; F274-F333 HydrophobicContact CE1-CD2 3.38Å; F274-F333 HydrophobicContact CE1-CE2 4Å; F274-F333 HydrophobicContact CE1-CG 4.36Å; F274-F333 AromaticContact CE2-CD2 3.78Å; F274-F333 HydrophobicContact CE2-CD2 3.78Å; F274-F333 AromaticContact CE2-CE2 3.53Å; F274-F333 HydrophobicContact CE2-CE2 3.53Å; F274-F333 HydrophobicContact CG-CD2 4.3Å; F274-F333 AromaticContact CZ-CD2 3.3Å; F274-F333 HydrophobicContact CZ-CD2 3.3Å; F274-F333 AromaticContact CZ-CE2 3.42Å; F274-F333 HydrophobicContact CZ-CE2 3.42Å; F274-F333 VanDerWaalsContact CZ-CE2 3.42Å; F274-F333 HydrophobicContact CZ-CG 4.49Å; F274-M348 HydrophobicContact CD2-CE 4.35Å; F274-M348 HydrophobicContact CE1-CG 4.1Å; F274-M348 HydrophobicContact CE2-CE 3.62Å; F274-M348 HydrophobicContact CE2-CG 4.32Å; F274-M348 HydrophobicContact CZ-CE 3.98Å; F274-M348 HydrophobicContact CZ-CG 3.74Å
275	W	97.1	Very high	98	Very high	102 Å²	102	54.1 Å²	54.1	39%	0.386	26%	0.258	S	S	.	.	H	α-helix	trans	-49.9	-45.4	-175.3	148.7	80.1	0	0	0	113.4	F45 H272 T273 R278 K279	F45-W275 HydrophobicContact CE2-CD2 4.23Å; F45-W275 HydrophobicContact CE2-CE3 4.03Å; F45-W275 HydrophobicContact CE2-CZ3 4.2Å; F45-W275 HydrophobicContact CZ-CE3 4.29Å; F45-W275 HydrophobicContact CZ-CH2 4.5Å; F45-W275 HydrophobicContact CZ-CZ3 4.08Å; H272-W275 WeakPolarHBondContact O-CB 3.2Å; H272-W275 PolarHBondContact O-N 2.68Å; T273-W275 VanDerWaalsContact C-N 3.26Å; T273-W275 PolarHBondContact O-N 3.01Å; W275-R278 PolarHBondContact O-N 2.9Å; W275-K279 WeakPolarHBondContact O-CB 3.25Å; W275-K279 PolarHBondContact O-N 3.45Å
276	L	97.5	Very high	98	Very high	56 Å²	56	54 Å²	54	29%	0.293	26%	0.258	S	S	.	.	H	α-helix	trans	-68	-45.7	-176.8	-175.5	56.6	0	0	0	110.9	F274 R278 K279 E280 R332	F274-L276 VanDerWaalsContact C-N 3.29Å; F274-L276 PolarHBondContact O-N 2.84Å; F274-L276 VanDerWaalsContact O-N 3.16Å; L276-R278 VanDerWaalsContact C-N 3.34Å; L276-R278 PolarHBondContact O-N 3.13Å; L276-K279 WeakPolarHBondContact O-CB 3.46Å; L276-K279 PolarHBondContact O-N 3.43Å; L276-E280 WeakPolarHBondContact O-CG 3.39Å; L276-E280 PolarHBondContact O-N 2.87Å; L276-R332 HydrophobicContact CB-CB 3.93Å; L276-R332 HydrophobicContact CB-CG 4.18Å; L276-R332 HydrophobicContact CD2-CB 3.99Å; L276-R332 HydrophobicContact CD2-CG 3.9Å; L276-R332 HydrophobicContact CG-CB 4.14Å; L276-R332 HydrophobicContact CG-CG 3.92Å
277	Y	98.3	Very high	97.9	Very high	32 Å²	32	53.8 Å²	53.8	13%	0.125	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-44.1	175.3	176.7	-94.3	0	0	0	111.8	F274 K279 E280 N281 T284 V286 Q330 Y331	F274-Y277 PolarHBondContact O-N 2.96Å; F274-Y277 VanDerWaalsContact O-N 3.16Å; Y277-K279 VanDerWaalsContact C-N 3.32Å; Y277-K279 PolarHBondContact O-N 3.38Å; Y277-E280 CarbonylContact O-C 3.18Å; Y277-E280 PolarHBondContact O-N 3.44Å; Y277-N281 WeakPolarHBondContact CD2-ND2 3.17Å; Y277-N281 HydrophobicContact CE1-CB 4.39Å; Y277-N281 WeakPolarHBondContact CE2-ND2 3.19Å; Y277-N281 WeakPolarHBondContact O-CB 3.5Å; Y277-N281 PolarHBondContact O-N 3.22Å; Y277-N281 PolarHBondContact O-ND2 3.45Å; Y277-T284 HydrophobicContact CD1-CG2 4.33Å; Y277-T284 HydrophobicContact CE1-CG2 4.07Å; Y277-V286 HydrophobicContact CD1-CB 4.13Å; Y277-V286 HydrophobicContact CD1-CG1 4.06Å; Y277-V286 HydrophobicContact CD1-CG2 4.47Å; Y277-V286 HydrophobicContact CE1-CB 3.85Å; Y277-V286 HydrophobicContact CE1-CG1 4.2Å; Y277-V286 HydrophobicContact CE1-CG2 3.78Å; Y277-Q330 WeakPolarHBondContact CD2-O 3.45Å; Y277-Y331 WeakPolarHBondContact CB-O 3.46Å; Y277-Y331 HydrophobicContact CD1-CD1 4.1Å; Y277-Y331 AromaticContact CD2-CD1 3.94Å; Y277-Y331 HydrophobicContact CD2-CD1 3.94Å; Y277-Y331 AromaticContact CE1-CD1 3.99Å; Y277-Y331 HydrophobicContact CE1-CD1 3.99Å; Y277-Y331 AromaticContact CE1-CE1 3.97Å; Y277-Y331 HydrophobicContact CE1-CE1 3.97Å; Y277-Y331 AromaticContact CE2-CD1 3.81Å; Y277-Y331 HydrophobicContact CE2-CD1 3.81Å; Y277-Y331 AromaticContact CE2-CE1 3.98Å; Y277-Y331 HydrophobicContact CE2-CE1 3.98Å; Y277-Y331 HydrophobicContact CG-CD1 4.08Å; Y277-Y331 AromaticContact CZ-CD1 3.84Å; Y277-Y331 AromaticContact CZ-CE1 3.66Å
278	R	98.3	Very high	97.9	Very high	52 Å²	52	55.7 Å²	55.7	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-36.5	176.7	-69.4	178.6	66	-98.3	-9.3	112.5	F274 W275 L276 N281 T284 V286 E288	F274-R278 HydrophobicContact CB-CG 4.31Å; F274-R278 WeakPolarHBondContact O-CG 3.32Å; F274-R278 PolarHBondContact O-N 2.87Å; W275-R278 PolarHBondContact O-N 2.9Å; L276-R278 VanDerWaalsContact C-N 3.34Å; L276-R278 PolarHBondContact O-N 3.13Å; R278-N281 CarbonylContact O-C 3.5Å; R278-N281 PolarHBondContact O-N 3.38Å; R278-T284 HydrophobicContact CB-CG2 4.37Å; R278-T284 HydrophobicContact CG-CG2 3.89Å; R278-V286 WeakPolarHBondContact CD-O 3.47Å; R278-V286 VanDerWaalsContact CG-O 3.31Å; R278-V286 WeakPolarHBondContact CG-O 3.5Å; R278-V286 PolarHBondContact NE-O 3.32Å; R278-E288 IonicContact CZ-OE1 2.98Å; R278-E288 IonicContact NE-OE1 3.8Å; R278-E288 PolarHBondContact NE-OE1 3.33Å; R278-E288 IonicContact NH2-OE1 3.66Å; R278-E288 PolarHBondContact NH2-OE1 2.93Å
279	K	97.9	Very high	97.9	Very high	147 Å²	147	56.6 Å²	56.6	64%	0.639	27%	0.272	S	S	*	.	H	α-helix	trans	-64.9	-40.6	174.4	-175.7	-174.8	176.7	-172.8	0	111.6	W275 L276 Y277 N281	W275-K279 WeakPolarHBondContact O-CB 3.25Å; W275-K279 PolarHBondContact O-N 3.45Å; L276-K279 WeakPolarHBondContact O-CB 3.46Å; L276-K279 PolarHBondContact O-N 3.43Å; Y277-K279 VanDerWaalsContact C-N 3.32Å; Y277-K279 PolarHBondContact O-N 3.38Å; K279-N281 VanDerWaalsContact C-N 3.29Å
280	E	98.3	Very high	97.9	Very high	97 Å²	97	58.6 Å²	58.6	45%	0.453	29%	0.285	S	S	.	.	H	α-helix	trans	-73.6	-22.2	177.2	-68.8	175	173.3	0	0	112.2	L276 Y277 R332	L276-E280 WeakPolarHBondContact O-CG 3.39Å; L276-E280 PolarHBondContact O-N 2.87Å; Y277-E280 CarbonylContact O-C 3.18Å; Y277-E280 PolarHBondContact O-N 3.44Å; E280-R332 IonicContact OE1-NE 2.86Å; E280-R332 IonicContact OE2-CZ 3.76Å; E280-R332 IonicContact OE2-NE 3.86Å; E280-R332 PolarHBondContact OE2-NE 2.94Å; E280-R332 IonicContact OE2-NH2 3.23Å
281	N	98.3	Very high	97.7	Very high	62 Å²	62	63.3 Å²	63.3	33%	0.332	32%	0.315	S	S	.	.			trans	-131.5	74.8	-175.9	-58.4	-86.8	0	0	0	111.6	Y277 R278 K279 N283 T284	Y277-N281 WeakPolarHBondContact CD2-ND2 3.17Å; Y277-N281 HydrophobicContact CE1-CB 4.39Å; Y277-N281 WeakPolarHBondContact CE2-ND2 3.19Å; Y277-N281 WeakPolarHBondContact O-CB 3.5Å; Y277-N281 PolarHBondContact O-N 3.22Å; Y277-N281 PolarHBondContact O-ND2 3.45Å; R278-N281 CarbonylContact O-C 3.5Å; R278-N281 PolarHBondContact O-N 3.38Å; K279-N281 VanDerWaalsContact C-N 3.29Å; N281-N283 PolarHBondContact O-N 2.88Å; N281-T284 HydrophobicContact CB-CG2 4.32Å; N281-T284 WeakPolarHBondContact O-CB 3.48Å; N281-T284 WeakPolarHBondContact O-CG2 3.25Å; N281-T284 PolarHBondContact O-N 3.14Å
282	P	97	Very high	97.5	Very high	109 Å²	109	67.7 Å²	67.7	71%	0.708	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.9	-169.6	-26.9	35.8	0	0	0	116.2
283	N	97.1	Very high	97.5	Very high	163 Å²	163	65.6 Å²	65.6	87%	0.872	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	9.8	-179.6	-60.3	-31.6	0	0	0	113	N281	N281-N283 PolarHBondContact O-N 2.88Å
284	T	98.3	Very high	97.6	Very high	29 Å²	29	65.6 Å²	65.6	18%	0.178	33%	0.328	C	S	.	.			trans	-70	150.6	-179.3	-167.3	0	0	0	0	112	Y277 R278 N281 V286	Y277-T284 HydrophobicContact CD1-CG2 4.33Å; Y277-T284 HydrophobicContact CE1-CG2 4.07Å; R278-T284 HydrophobicContact CB-CG2 4.37Å; R278-T284 HydrophobicContact CG-CG2 3.89Å; N281-T284 HydrophobicContact CB-CG2 4.32Å; N281-T284 WeakPolarHBondContact O-CB 3.48Å; N281-T284 WeakPolarHBondContact O-CG2 3.25Å; N281-T284 PolarHBondContact O-N 3.14Å; T284-V286 HydrophobicContact CG2-CB 4.11Å; T284-V286 WeakPolarHBondContact OG1-CG2 3.24Å; T284-V286 PolarHBondContact OG1-N 3.1Å
285	R	98.4	Very high	97.7	Very high	132 Å²	132	65.7 Å²	65.7	50%	0.498	33%	0.328	S	S	.	.			trans	-86.4	-12.5	170.1	-57.7	-171.8	-60.1	147.6	-4.8	112.5	G287 E288 E292 L294	R285-G287 PolarHBondContact O-N 3.28Å; R285-E288 WeakPolarHBondContact O-CB 3.29Å; R285-E288 PolarHBondContact O-N 3.26Å; R285-E288 VanDerWaalsContact O-N 3.1Å; R285-E292 WeakPolarHBondContact CD-O 3.36Å; R285-E292 PolarHBondContact NH1-O 3.31Å; R285-L294 HydrophobicContact CB-CD1 4.49Å; R285-L294 HydrophobicContact CB-CG 4.32Å; R285-L294 PolarHBondContact O-N 3.16Å
286	V	98.6	Very high	97.7	Very high	5 Å²	5	61 Å²	61	3%	0.03	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-62.3	124.6	-177.7	173.7	0	0	0	0	110.5	F274 Y277 R278 T284 E288 Y331 M348	F274-V286 HydrophobicContact CB-CG1 3.81Å; F274-V286 HydrophobicContact CD1-CG1 3.62Å; F274-V286 HydrophobicContact CD2-CG1 3.85Å; F274-V286 HydrophobicContact CE1-CG1 4.02Å; F274-V286 HydrophobicContact CE2-CG1 4.29Å; F274-V286 HydrophobicContact CG-CG1 3.51Å; F274-V286 HydrophobicContact CZ-CG1 4.36Å; Y277-V286 HydrophobicContact CD1-CB 4.13Å; Y277-V286 HydrophobicContact CD1-CG1 4.06Å; Y277-V286 HydrophobicContact CD1-CG2 4.47Å; Y277-V286 HydrophobicContact CE1-CB 3.85Å; Y277-V286 HydrophobicContact CE1-CG1 4.2Å; Y277-V286 HydrophobicContact CE1-CG2 3.78Å; R278-V286 WeakPolarHBondContact CD-O 3.47Å; R278-V286 VanDerWaalsContact CG-O 3.31Å; R278-V286 WeakPolarHBondContact CG-O 3.5Å; R278-V286 PolarHBondContact NE-O 3.32Å; T284-V286 HydrophobicContact CG2-CB 4.11Å; T284-V286 WeakPolarHBondContact OG1-CG2 3.24Å; T284-V286 PolarHBondContact OG1-N 3.1Å; V286-E288 PolarHBondContact O-N 3.26Å; V286-Y331 HydrophobicContact CG2-CE1 4.08Å; V286-M348 HydrophobicContact CB-SD 4.24Å; V286-M348 HydrophobicContact CG1-CE 4.33Å; V286-M348 HydrophobicContact CG1-CG 3.92Å; V286-M348 HydrophobicContact CG1-SD 3.91Å; V286-M348 HydrophobicContact CG2-CB 3.98Å; V286-M348 HydrophobicContact CG2-CG 4.01Å; V286-M348 HydrophobicContact CG2-SD 3.97Å
287	G	98.2	Very high	97.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	1.6	-178	0	0	0	0	0	114.7	R271 R285 L294 Y381	R271-G287 WeakPolarHBondContact CB-O 3.22Å; R285-G287 PolarHBondContact O-N 3.28Å; G287-L294 VanDerWaalsContact CA-O 3.3Å; G287-L294 WeakPolarHBondContact CA-O 3.4Å; G287-L294 PolarHBondContact N-O 2.83Å; G287-Y381 WeakPolarHBondContact O-CE1 3.44Å; G287-Y381 PolarHBondContact O-OH 3.38Å
288	E	98.5	Very high	97.8	Very high	50 Å²	50	58.1 Å²	58.1	23%	0.234	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-76.6	153.3	172.9	-69.6	-51.4	142.8	0	0	111.7	R271 R278 R285 V286 G293 L294	R271-E288 IonicContact CZ-OE2 3.35Å; R271-E288 IonicContact NH1-OE1 3.96Å; R271-E288 IonicContact NH1-OE2 2.62Å; R271-E288 PolarHBondContact NH1-OE2 3.21Å; R278-E288 IonicContact CZ-OE1 2.98Å; R278-E288 IonicContact NE-OE1 3.8Å; R278-E288 PolarHBondContact NE-OE1 3.33Å; R278-E288 IonicContact NH2-OE1 3.66Å; R278-E288 PolarHBondContact NH2-OE1 2.93Å; R285-E288 WeakPolarHBondContact O-CB 3.29Å; R285-E288 PolarHBondContact O-N 3.26Å; R285-E288 VanDerWaalsContact O-N 3.1Å; V286-E288 PolarHBondContact O-N 3.26Å; E288-G293 CarbonylContact O-C 3.52Å; E288-G293 WeakPolarHBondContact O-CA 3.45Å; E288-L294 CarbonylContact O-C 3.57Å; E288-L294 PolarHBondContact O-N 3.16Å
289	P	98.2	Very high	97.8	Very high	20 Å²	20	56.4 Å²	56.4	13%	0.13	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-70.5	161.5	179.7	29.8	-33.2	0	0	0	112.4	G293 L380 Y381	P289-G293 WeakPolarHBondContact O-CA 3.44Å; P289-G293 PolarHBondContact O-N 3.34Å; P289-L380 HydrophobicContact CB-CB 3.66Å; P289-L380 WeakPolarHBondContact CB-O 3.42Å; P289-L380 HydrophobicContact CG-CB 3.77Å; P289-L380 HydrophobicContact CG-CD1 4.17Å; P289-Y381 HydrophobicContact CB-CD1 4.09Å; P289-Y381 HydrophobicContact CB-CD2 3.97Å; P289-Y381 HydrophobicContact CB-CE1 3.96Å; P289-Y381 HydrophobicContact CB-CE2 3.82Å; P289-Y381 HydrophobicContact CB-CG 4.08Å; P289-Y381 WeakPolarHBondContact CD-OH 3.48Å; P289-Y381 HydrophobicContact CG-CE2 4.14Å
290	P	96.8	Very high	97.8	Very high	49 Å²	49	49.4 Å²	49.4	32%	0.318	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	160.8	167.8	28	-35.9	0	0	0	112.2
291	P	94.7	Very high	97.8	Very high	99 Å²	99	44.8 Å²	44.8	64%	0.643	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	cis	-79.9	-33.3	5.4	28.8	-32.5	0	0	0	114.3	R264	R264-P291 PolarHBondContact NH1-O 3.04Å
292	E	94.6	Very high	97.8	Very high	138 Å²	138	41.8 Å²	41.8	65%	0.645	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-22.5	-170.4	-58.4	-51.3	139.3	0	0	114.5	R285	R285-E292 WeakPolarHBondContact CD-O 3.36Å; R285-E292 PolarHBondContact NH1-O 3.31Å
293	G	97.8	Very high	97.9	Very high	4 Å²	4	36.6 Å²	36.6	4%	0.041	19%	0.192	C	C	.	.	S	Bend	trans	-77.7	166.8	-179.1	0	0	0	0	0	114	E288 P289 P295	E288-G293 CarbonylContact O-C 3.52Å; E288-G293 WeakPolarHBondContact O-CA 3.45Å; P289-G293 WeakPolarHBondContact O-CA 3.44Å; P289-G293 PolarHBondContact O-N 3.34Å; G293-P295 VanDerWaalsContact O-CD 3.29Å; G293-P295 WeakPolarHBondContact O-CD 3.2Å
294	L	98.6	Very high	98	Very high	30 Å²	30	28.9 Å²	28.9	16%	0.157	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-112.4	85.6	176.1	-58.6	174.9	0	0	0	108.5	R285 G287 E288 G296 M348	R285-L294 HydrophobicContact CB-CD1 4.49Å; R285-L294 HydrophobicContact CB-CG 4.32Å; R285-L294 PolarHBondContact O-N 3.16Å; G287-L294 VanDerWaalsContact CA-O 3.3Å; G287-L294 WeakPolarHBondContact CA-O 3.4Å; G287-L294 PolarHBondContact N-O 2.83Å; E288-L294 CarbonylContact O-C 3.57Å; E288-L294 PolarHBondContact O-N 3.16Å; L294-G296 PolarHBondContact O-N 3.38Å; L294-G296 VanDerWaalsContact O-N 3.15Å; L294-M348 HydrophobicContact CB-CE 4.29Å; L294-M348 HydrophobicContact CB-SD 3.48Å; L294-M348 WeakPolarHBondContact CB-SD 3.47Å; L294-M348 HydrophobicContact CD1-SD 4.01Å; L294-M348 HydrophobicContact CG-SD 4.39Å; L294-M348 WeakPolarHBondContact O-CE 3.47Å
295	P	98.5	Very high	98	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.019	15%	0.147	C	C	.	.			trans	-75.8	0.8	-174.4	33.4	-39.3	0	0	0	113.2	R264 Y270 G293 Y381	R264-P295 HydrophobicContact CB-CG 3.89Å; R264-P295 HydrophobicContact CG-CG 4.11Å; Y270-P295 WeakPolarHBondContact CB-O 3.33Å; Y270-P295 WeakPolarHBondContact CD2-O 3.42Å; G293-P295 VanDerWaalsContact O-CD 3.29Å; G293-P295 WeakPolarHBondContact O-CD 3.2Å; P295-Y381 HydrophobicContact CB-CD1 3.85Å; P295-Y381 HydrophobicContact CB-CE1 3.98Å
296	G	98.6	Very high	98.1	Very high	3 Å²	3	22 Å²	22	3%	0.031	12%	0.123	C	C	.	.			trans	81.6	-171.1	-167.9	0	0	0	0	0	111.9	R264 E265 L294	R264-G296 WeakPolarHBondContact CA-O 3.44Å; E265-G296 PolarHBondContact N-O 2.77Å; L294-G296 PolarHBondContact O-N 3.38Å; L294-G296 VanDerWaalsContact O-N 3.15Å
297	F	98.8	Very high	98.1	Very high	22 Å²	22	24.7 Å²	24.7	10%	0.096	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	159.3	-173.2	-59.7	-54.9	0	0	0	112.2	I262 A263 Y270 Q340 F343 S344 F354	I262-F297 HydrophobicContact CD1-CB 3.68Å; I262-F297 HydrophobicContact CD1-CG 4.3Å; I262-F297 HydrophobicContact CG1-CB 3.98Å; I262-F297 HydrophobicContact CG1-CG 4.44Å; I262-F297 HydrophobicContact CG2-CB 4.12Å; I262-F297 HydrophobicContact CG2-CD1 3.56Å; I262-F297 HydrophobicContact CG2-CD2 3.96Å; I262-F297 HydrophobicContact CG2-CE1 3.85Å; I262-F297 HydrophobicContact CG2-CE2 4.21Å; I262-F297 HydrophobicContact CG2-CG 3.62Å; I262-F297 HydrophobicContact CG2-CZ 4.17Å; A263-F297 WeakPolarHBondContact O-CA 3.47Å; Y270-F297 WeakPolarHBondContact CE2-O 3.49Å; F297-Q340 WeakPolarHBondContact O-CG 3.49Å; F297-Q340 PolarHBondContact O-NE2 2.93Å; F297-F343 HydrophobicContact CD2-CB 4.28Å; F297-S344 PolarHBondContact N-OG 2.97Å; F297-F354 HydrophobicContact CD2-CD1 4.44Å; F297-F354 HydrophobicContact CD2-CE1 4.46Å; F297-F354 HydrophobicContact CE2-CB 4.28Å; F297-F354 AromaticContact CE2-CD1 3.87Å; F297-F354 HydrophobicContact CE2-CD1 3.87Å; F297-F354 AromaticContact CE2-CD2 3.85Å; F297-F354 HydrophobicContact CE2-CD2 3.85Å; F297-F354 HydrophobicContact CE2-CE1 4.11Å; F297-F354 HydrophobicContact CE2-CE2 4.11Å; F297-F354 AromaticContact CE2-CG 3.72Å; F297-F354 HydrophobicContact CE2-CG 3.72Å; F297-F354 HydrophobicContact CE2-CZ 4.22Å; F297-F354 HydrophobicContact CZ-CB 3.85Å; F297-F354 HydrophobicContact CZ-CD1 4.26Å; F297-F354 HydrophobicContact CZ-CD2 4.14Å; F297-F354 AromaticContact CZ-CG 3.82Å; F297-F354 HydrophobicContact CZ-CG 3.82Å
298	N	98.7	Very high	98.1	Very high	6 Å²	6	26 Å²	26	3%	0.032	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.3	170.7	-176.9	-93.8	0	0	0	110.6	I262 A263 E265 G300 Q340 N362 Q364 H392	I262-N298 VanDerWaalsContact CG1-O 3.31Å; I262-N298 WeakPolarHBondContact CG1-O 3.48Å; A263-N298 PolarHBondContact O-N 2.78Å; E265-N298 PolarHBondContact OE2-ND2 2.99Å; N298-G300 PolarHBondContact O-N 3.27Å; N298-G300 PolarHBondContact OD1-N 3.3Å; N298-G300 VanDerWaalsContact OD1-N 3.07Å; N298-Q340 PolarHBondContact ND2-OE1 3.4Å; N298-N362 PolarHBondContact OD1-ND2 3.46Å; N298-Q364 VanDerWaalsContact CB-CD 3.44Å; N298-Q364 HydrophobicContact CB-CG 4.3Å; N298-Q364 VanDerWaalsContact CG-CD 3.44Å; N298-Q364 VanDerWaalsContact CG-NE2 3.26Å; N298-Q364 PolarHBondContact ND2-NE2 2.96Å; N298-H392 PolarHBondContact OD1-CE1 3.34Å; N298-H392 VanDerWaalsContact OD1-CE1 3.27Å; N298-H392 PolarHBondContact OD1-ND1 3.29Å
299	S	97.7	Very high	98.1	Very high	16 Å²	16	23.7 Å²	23.7	11%	0.112	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	0.2	-173	54.2	0	0	0	0	115.1	V301 M302 D339	S299-V301 PolarHBondContact O-N 3.08Å; S299-M302 WeakPolarHBondContact O-CE 3.43Å; S299-D339 PolarHBondContact OG-OD1 2.97Å
300	G	98.1	Very high	98.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	-19.1	-176	0	0	0	0	0	115.5	L234 D235 N298	L234-G300 WeakPolarHBondContact CA-O 3.46Å; D235-G300 VanDerWaalsContact CG-CA 3.46Å; D235-G300 PolarHBondContact N-O 3.06Å; D235-G300 WeakPolarHBondContact OD2-CA 3.43Å; N298-G300 PolarHBondContact O-N 3.27Å; N298-G300 PolarHBondContact OD1-N 3.3Å; N298-G300 VanDerWaalsContact OD1-N 3.07Å
301	V	98.9	Very high	98.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	113.7	170.8	-179.4	0	0	0	0	109	L234 L238 L247 S299 L357 W361 N362 I390	L234-V301 HydrophobicContact CD2-CB 4.28Å; L234-V301 HydrophobicContact CD2-CG1 3.9Å; L234-V301 HydrophobicContact CD2-CG2 3.98Å; L238-V301 HydrophobicContact CD1-CG2 4.03Å; L238-V301 HydrophobicContact CD2-CG2 4.48Å; L247-V301 HydrophobicContact CD1-CG1 4.25Å; L247-V301 HydrophobicContact CD2-CG1 3.88Å; S299-V301 PolarHBondContact O-N 3.08Å; V301-L357 HydrophobicContact CG1-CD1 4.29Å; V301-W361 WeakPolarHBondContact CG2-O 3.46Å; V301-N362 HydrophobicContact CB-CB 4.03Å; V301-N362 HydrophobicContact CG2-CB 3.94Å; V301-I390 HydrophobicContact CG2-CD1 4.4Å
302	M	98.9	Very high	98.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.9	-179.2	-62	-176.9	-68.1	0	0	111.2	S217 V232 Q233 G261 I262 S299 L304 F343	S217-M302 VanDerWaalsContact CB-CE 3.45Å; V232-M302 CarbonylContact C-O 3.5Å; V232-M302 VanDerWaalsContact CA-O 3.24Å; V232-M302 WeakPolarHBondContact CA-O 3.43Å; V232-M302 WeakPolarHBondContact CG1-O 3.27Å; Q233-M302 HydrophobicContact CB-CB 4.43Å; Q233-M302 HydrophobicContact CB-CE 4Å; Q233-M302 VanDerWaalsContact CD-CE 3.49Å; Q233-M302 HydrophobicContact CG-CE 3.9Å; Q233-M302 PolarHBondContact N-O 3.29Å; Q233-M302 PolarHBondContact O-N 3Å; G261-M302 CarbonylContact O-C 3.42Å; G261-M302 WeakPolarHBondContact O-CA 3Å; I262-M302 HydrophobicContact CD1-CG 3.75Å; I262-M302 HydrophobicContact CD1-SD 3.93Å; I262-M302 HydrophobicContact CG1-CG 4.01Å; S299-M302 WeakPolarHBondContact O-CE 3.43Å; M302-L304 HydrophobicContact CB-CD2 4.09Å; M302-L304 HydrophobicContact CB-CG 4.48Å; M302-F343 HydrophobicContact SD-CD2 4.02Å; M302-F343 HydrophobicContact SD-CE2 3.64Å
303	L	98.9	Very high	98.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	113.2	169.9	-85.6	69.2	0	0	0	108.4	V232 L247 E250 F251 F254 I260 G261 L357	V232-L303 HydrophobicContact CG1-CD1 4.22Å; V232-L303 HydrophobicContact CG2-CD1 4.34Å; V232-L303 HydrophobicContact CG2-CG 4.12Å; L247-L303 HydrophobicContact CD1-CD1 3.64Å; L247-L303 HydrophobicContact CD2-CD1 4.38Å; L247-L303 HydrophobicContact CG-CD1 3.89Å; E250-L303 HydrophobicContact CB-CD2 3.59Å; F251-L303 HydrophobicContact CD1-CB 4.32Å; F251-L303 HydrophobicContact CD1-CD2 4.29Å; F251-L303 HydrophobicContact CD2-CD2 3.8Å; F251-L303 HydrophobicContact CD2-CG 4.22Å; F251-L303 HydrophobicContact CE1-CB 3.69Å; F251-L303 HydrophobicContact CE1-CD2 4.36Å; F251-L303 HydrophobicContact CE1-CG 4.25Å; F251-L303 HydrophobicContact CE2-CB 4.08Å; F251-L303 HydrophobicContact CE2-CD2 3.87Å; F251-L303 HydrophobicContact CE2-CG 3.76Å; F251-L303 HydrophobicContact CG-CD2 4.02Å; F251-L303 HydrophobicContact CZ-CB 3.55Å; F251-L303 HydrophobicContact CZ-CD2 4.16Å; F251-L303 HydrophobicContact CZ-CG 3.78Å; F254-L303 HydrophobicContact CE1-CB 4.36Å; F254-L303 HydrophobicContact CE1-CD2 4.17Å; F254-L303 HydrophobicContact CZ-CB 3.82Å; F254-L303 HydrophobicContact CZ-CD2 4.4Å; I260-L303 CarbonylContact C-O 3.53Å; I260-L303 VanDerWaalsContact CA-O 3.27Å; I260-L303 WeakPolarHBondContact CA-O 3.17Å; G261-L303 PolarHBondContact N-O 3.17Å; G261-L303 PolarHBondContact O-N 3.49Å; L303-L357 HydrophobicContact CD1-CD1 4.03Å; L303-L357 HydrophobicContact CD1-CD2 4.35Å
304	L	98.9	Very high	98.6	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	107.4	-177.8	-51.1	178.5	0	0	0	109	M220 R230 I231 Q233 I260 M302 L306 M309	M220-L304 HydrophobicContact CB-CD1 3.9Å; M220-L304 HydrophobicContact CE-CD1 3.98Å; M220-L304 HydrophobicContact CG-CD1 3.98Å; R230-L304 WeakPolarHBondContact CA-O 3.16Å; I231-L304 HydrophobicContact CG2-CB 3.92Å; I231-L304 HydrophobicContact CG2-CD1 4.15Å; I231-L304 HydrophobicContact CG2-CG 4.46Å; I231-L304 PolarHBondContact N-O 3.41Å; I231-L304 PolarHBondContact O-N 2.68Å; Q233-L304 HydrophobicContact CB-CD1 4.41Å; I260-L304 HydrophobicContact CD1-CD2 4.33Å; I260-L304 HydrophobicContact CG1-CD2 3.86Å; I260-L304 HydrophobicContact CG2-CD2 4.14Å; M302-L304 HydrophobicContact CB-CD2 4.09Å; M302-L304 HydrophobicContact CB-CG 4.48Å; L304-L306 HydrophobicContact CB-CD2 3.77Å; L304-L306 PolarHBondContact O-N 3.27Å; L304-L306 VanDerWaalsContact O-N 3.17Å; L304-M309 HydrophobicContact CB-SD 4.06Å
305	D	98.8	Very high	98.6	Very high	18 Å²	18	22.6 Å²	22.6	10%	0.096	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	88.1	171.1	-168.7	-45.1	0	0	0	107.8	T229 R230 F251 F254 V259 S307 A308 M309	T229-D305 CarbonylContact O-C 3.28Å; R230-D305 IonicContact NE-OD2 3.31Å; R230-D305 PolarHBondContact NE-OD2 3.32Å; R230-D305 IonicContact NH2-OD2 3.35Å; F251-D305 HydrophobicContact CD1-CB 4.17Å; F251-D305 HydrophobicContact CE1-CB 4.01Å; F254-D305 HydrophobicContact CD2-CB 4.47Å; F254-D305 HydrophobicContact CE2-CB 4.14Å; V259-D305 PolarHBondContact O-N 3.1Å; D305-S307 PolarHBondContact O-N 2.84Å; D305-S307 WeakPolarHBondContact OD1-CB 3.34Å; D305-S307 PolarHBondContact OD1-N 2.99Å; D305-A308 HydrophobicContact CB-CB 3.9Å; D305-A308 PolarHBondContact O-N 3.16Å; D305-A308 VanDerWaalsContact O-N 3.1Å; D305-A308 WeakPolarHBondContact OD1-CB 3.45Å; D305-A308 PolarHBondContact OD1-N 3Å; D305-M309 VanDerWaalsContact O-CG 3.25Å; D305-M309 WeakPolarHBondContact O-CG 3.37Å; D305-M309 PolarHBondContact O-N 2.71Å
306	L	98.8	Very high	98.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.3	-31.4	-175.7	-51.9	-172.5	0	0	0	111.9	M220 H221 M224 L228 T229 I231 L304 M309 R310	M220-L306 HydrophobicContact CB-CD2 3.84Å; M220-L306 HydrophobicContact CG-CD1 4.29Å; M220-L306 HydrophobicContact CG-CD2 3.7Å; H221-L306 HydrophobicContact CB-CB 4.11Å; H221-L306 HydrophobicContact CB-CD2 4.12Å; M224-L306 HydrophobicContact CB-CD1 3.79Å; M224-L306 HydrophobicContact CG-CD1 4.15Å; L228-L306 HydrophobicContact CB-CD1 4.48Å; L228-L306 HydrophobicContact CD2-CD1 4.08Å; L228-L306 HydrophobicContact CG-CD1 3.96Å; T229-L306 WeakPolarHBondContact O-CA 3.31Å; T229-L306 WeakPolarHBondContact O-CB 3.25Å; T229-L306 PolarHBondContact O-N 3.12Å; I231-L306 HydrophobicContact CG2-CD1 3.97Å; I231-L306 HydrophobicContact CG2-CD2 3.95Å; I231-L306 HydrophobicContact CG2-CG 4.06Å; L304-L306 HydrophobicContact CB-CD2 3.77Å; L304-L306 PolarHBondContact O-N 3.27Å; L304-L306 VanDerWaalsContact O-N 3.17Å; L306-M309 HydrophobicContact CD2-SD 3.86Å; L306-R310 WeakPolarHBondContact O-CB 3.28Å; L306-R310 WeakPolarHBondContact O-CD 3.44Å; L306-R310 WeakPolarHBondContact O-CG 3.35Å; L306-R310 PolarHBondContact O-N 2.9Å
307	S	98.5	Very high	98.5	Very high	61 Å²	61	28.3 Å²	28.3	43%	0.427	17%	0.168	S	C	.	.	H	α-helix	trans	-66	-48.2	174.5	-172	0	0	0	0	111	T229 D305 R310 A311	T229-S307 PolarHBondContact O-N 2.96Å; T229-S307 VanDerWaalsContact O-N 3.13Å; D305-S307 PolarHBondContact O-N 2.84Å; D305-S307 WeakPolarHBondContact OD1-CB 3.34Å; D305-S307 PolarHBondContact OD1-N 2.99Å; S307-R310 PolarHBondContact O-N 3.4Å; S307-A311 WeakPolarHBondContact O-CB 3.41Å; S307-A311 PolarHBondContact O-N 3.49Å
308	A	98.7	Very high	98.4	Very high	28 Å²	28	27.7 Å²	27.7	23%	0.231	17%	0.166	C	C	.	.	H	α-helix	trans	-65.3	-39.9	177	0	0	0	0	0	112	V259 D305 A311 S312	V259-A308 HydrophobicContact CB-CB 4.3Å; V259-A308 HydrophobicContact CG1-CB 3.91Å; D305-A308 HydrophobicContact CB-CB 3.9Å; D305-A308 PolarHBondContact O-N 3.16Å; D305-A308 VanDerWaalsContact O-N 3.1Å; D305-A308 WeakPolarHBondContact OD1-CB 3.45Å; D305-A308 PolarHBondContact OD1-N 3Å; A308-A311 PolarHBondContact O-N 3.38Å; A308-S312 VanDerWaalsContact O-CB 3.22Å; A308-S312 WeakPolarHBondContact O-CB 3.43Å; A308-S312 PolarHBondContact O-N 2.81Å
309	M	98.8	Very high	98.2	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.8	-44.9	173.9	-67.5	170.1	79.1	0	0	111.7	H221 V259 I260 L304 D305 L306 Y315 N316	H221-M309 HydrophobicContact CB-CB 3.79Å; H221-M309 HydrophobicContact CB-CE 4.45Å; H221-M309 HydrophobicContact CB-SD 4.35Å; V259-M309 HydrophobicContact CB-CG 3.78Å; V259-M309 HydrophobicContact CG2-CG 4.19Å; I260-M309 HydrophobicContact CD1-CE 4.34Å; I260-M309 HydrophobicContact CG1-SD 4.34Å; L304-M309 HydrophobicContact CB-SD 4.06Å; D305-M309 VanDerWaalsContact O-CG 3.25Å; D305-M309 WeakPolarHBondContact O-CG 3.37Å; D305-M309 PolarHBondContact O-N 2.71Å; L306-M309 HydrophobicContact CD2-SD 3.86Å; M309-Y315 HydrophobicContact CB-CD1 4.21Å; M309-Y315 HydrophobicContact CB-CE1 4.29Å; M309-Y315 HydrophobicContact CE-CE1 3.53Å; M309-Y315 WeakPolarHBondContact CE-OH 3.46Å; M309-Y315 HydrophobicContact CG-CD1 4.44Å; M309-Y315 HydrophobicContact CG-CE1 4.3Å; M309-N316 PolarHBondContact O-ND2 3.22Å
310	R	98.5	Very high	98.1	Very high	66 Å²	66	32.7 Å²	32.7	25%	0.249	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-43.5	174.9	-72.6	164.7	-167.6	140.1	-2.9	111.9	H221 M224 P225 E226 L228 L306 S307 N316	H221-R310 HydrophobicContact CB-CG 3.98Å; H221-R310 PolarHBondContact O-NE 2.94Å; H221-R310 PolarHBondContact O-NH2 2.89Å; M224-R310 PolarHBondContact O-NH2 2.85Å; P225-R310 PolarHBondContact O-NH2 2.93Å; E226-R310 PolarHBondContact O-NH1 3.2Å; L228-R310 PolarHBondContact O-NH1 3.4Å; L228-R310 PolarHBondContact O-NH2 2.98Å; L306-R310 WeakPolarHBondContact O-CB 3.28Å; L306-R310 WeakPolarHBondContact O-CD 3.44Å; L306-R310 WeakPolarHBondContact O-CG 3.35Å; L306-R310 PolarHBondContact O-N 2.9Å; S307-R310 PolarHBondContact O-N 3.4Å; R310-N316 PolarHBondContact O-ND2 3.36Å
311	A	98.5	Very high	97.8	Very high	77 Å²	77	36.3 Å²	36.3	64%	0.636	21%	0.21	S	C	*	.	H	α-helix	trans	-76	-25.6	-176.5	0	0	0	0	0	113.7	S307 A308 T313	S307-A311 WeakPolarHBondContact O-CB 3.41Å; S307-A311 PolarHBondContact O-N 3.49Å; A308-A311 PolarHBondContact O-N 3.38Å; A311-T313 PolarHBondContact O-N 3.42Å; A311-T313 VanDerWaalsContact O-N 3.11Å
312	S	98.7	Very high	97.5	Very high	22 Å²	22	40.2 Å²	40.2	15%	0.154	24%	0.237	C	C	.	.			trans	-73.6	104.8	-174.5	179	0	0	0	0	111.9	A308 L314 Y315 N316	A308-S312 VanDerWaalsContact O-CB 3.22Å; A308-S312 WeakPolarHBondContact O-CB 3.43Å; A308-S312 PolarHBondContact O-N 2.81Å; S312-L314 PolarHBondContact O-N 3.48Å; S312-Y315 PolarHBondContact O-N 3.42Å; S312-Y315 WeakPolarHBondContact OG-CB 3.01Å; S312-Y315 PolarHBondContact OG-N 3.26Å; S312-Y315 VanDerWaalsContact OG-N 3.1Å; S312-N316 PolarHBondContact O-N 2.86Å; S312-N316 VanDerWaalsContact O-N 3.14Å; S312-N316 PolarHBondContact O-ND2 2.88Å
313	T	98.4	Very high	97.4	Very high	99 Å²	99	42.5 Å²	42.5	61%	0.607	25%	0.249	S	C	*	.	H	α-helix	trans	-58.9	-38.9	173.8	-63.4	0	0	0	0	111.2	A311 Q317	A311-T313 PolarHBondContact O-N 3.42Å; A311-T313 VanDerWaalsContact O-N 3.11Å; T313-Q317 HydrophobicContact CG2-CG 4.44Å; T313-Q317 WeakPolarHBondContact O-CB 3.3Å; T313-Q317 VanDerWaalsContact O-CG 3.25Å; T313-Q317 WeakPolarHBondContact O-CG 3.23Å; T313-Q317 PolarHBondContact O-N 3.49Å
314	L	98.4	Very high	97.1	Very high	54 Å²	54	42.6 Å²	42.6	28%	0.283	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-51.9	179.2	176.7	58.6	0	0	0	111.3	S312 N316 Q317 L318 H350 L353	S312-L314 PolarHBondContact O-N 3.48Å; L314-N316 PolarHBondContact O-N 2.83Å; L314-Q317 WeakPolarHBondContact O-CB 3.44Å; L314-Q317 PolarHBondContact O-N 3.31Å; L314-Q317 VanDerWaalsContact O-N 3.13Å; L314-L318 HydrophobicContact CD1-CD1 4.42Å; L314-L318 HydrophobicContact CG-CD1 4.38Å; L314-L318 WeakPolarHBondContact O-CG 2.88Å; L314-L318 PolarHBondContact O-N 3.11Å; L314-L318 VanDerWaalsContact O-N 3.12Å; L314-H350 HydrophobicContact CD2-CB 4.46Å; L314-L353 HydrophobicContact CD2-CD1 4.3Å; L314-L353 HydrophobicContact CD2-CD2 4.1Å; L314-L353 HydrophobicContact CD2-CG 4.21Å; L314-L353 HydrophobicContact CG-CD1 4.3Å; L314-L353 HydrophobicContact CG-CD2 4.35Å
315	Y	98.5	Very high	96.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.4	-47.8	-179.6	-174.5	-104	0	0	0	111.5	V218 H221 V259 I260 M309 S312 Q317 L318 L319 F343 I346 L353	V218-Y315 PolarHBondContact O-OH 3.01Å; H221-Y315 AromaticContact CE1-CE1 3.71Å; V259-Y315 HydrophobicContact CG2-CD2 3.88Å; V259-Y315 HydrophobicContact CG2-CE2 4.37Å; V259-Y315 HydrophobicContact CG2-CG 4.16Å; I260-Y315 HydrophobicContact CD1-CE2 3.97Å; M309-Y315 HydrophobicContact CB-CD1 4.21Å; M309-Y315 HydrophobicContact CB-CE1 4.29Å; M309-Y315 HydrophobicContact CE-CE1 3.53Å; M309-Y315 WeakPolarHBondContact CE-OH 3.46Å; M309-Y315 HydrophobicContact CG-CD1 4.44Å; M309-Y315 HydrophobicContact CG-CE1 4.3Å; S312-Y315 PolarHBondContact O-N 3.42Å; S312-Y315 WeakPolarHBondContact OG-CB 3.01Å; S312-Y315 PolarHBondContact OG-N 3.26Å; S312-Y315 VanDerWaalsContact OG-N 3.1Å; Y315-Q317 VanDerWaalsContact C-N 3.28Å; Y315-Q317 PolarHBondContact O-N 2.82Å; Y315-L318 WeakPolarHBondContact O-CB 3.11Å; Y315-L318 PolarHBondContact O-N 3.14Å; Y315-L319 HydrophobicContact CD1-CD1 4.43Å; Y315-L319 HydrophobicContact CE1-CD1 4.09Å; Y315-L319 HydrophobicContact CE1-CD2 4.34Å; Y315-L319 HydrophobicContact CE1-CG 4.43Å; Y315-L319 PolarHBondContact O-N 2.91Å; Y315-F343 HydrophobicContact CE2-CE1 4.41Å; Y315-F343 WeakPolarHBondContact OH-CE1 3.03Å; Y315-I346 HydrophobicContact CD2-CD1 4.33Å; Y315-I346 HydrophobicContact CE2-CD1 4.06Å; Y315-L353 HydrophobicContact CD2-CD1 4.36Å
316	N	97.9	Very high	96.6	Very high	37 Å²	37	49.1 Å²	49.1	20%	0.198	28%	0.281	C	S	.	.	H	α-helix	trans	-67.1	-26.6	179.5	-69.3	-71.5	0	0	0	113.2	H221 M309 R310 S312 L314	H221-N316 PolarHBondContact NE2-OD1 3.35Å; M309-N316 PolarHBondContact O-ND2 3.22Å; R310-N316 PolarHBondContact O-ND2 3.36Å; S312-N316 PolarHBondContact O-N 2.86Å; S312-N316 VanDerWaalsContact O-N 3.14Å; S312-N316 PolarHBondContact O-ND2 2.88Å; L314-N316 PolarHBondContact O-N 2.83Å
317	Q	97.2	Very high	96.5	Very high	88 Å²	88	49.6 Å²	49.6	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-68.9	-36.8	170.7	-77.3	177.5	9.5	0	0	111.8	T313 L314 Y315 L319 K320 N323	T313-Q317 HydrophobicContact CG2-CG 4.44Å; T313-Q317 WeakPolarHBondContact O-CB 3.3Å; T313-Q317 VanDerWaalsContact O-CG 3.25Å; T313-Q317 WeakPolarHBondContact O-CG 3.23Å; T313-Q317 PolarHBondContact O-N 3.49Å; L314-Q317 WeakPolarHBondContact O-CB 3.44Å; L314-Q317 PolarHBondContact O-N 3.31Å; L314-Q317 VanDerWaalsContact O-N 3.13Å; Y315-Q317 VanDerWaalsContact C-N 3.28Å; Y315-Q317 PolarHBondContact O-N 2.82Å; Q317-L319 PolarHBondContact O-N 3.33Å; Q317-K320 WeakPolarHBondContact O-CB 3.29Å; Q317-K320 WeakPolarHBondContact O-CG 3.1Å; Q317-K320 PolarHBondContact O-N 3.01Å; Q317-K320 VanDerWaalsContact O-N 3.14Å; Q317-N323 PolarHBondContact O-ND2 3.4Å
318	L	96.6	Very high	96.4	Very high	9 Å²	9	46.8 Å²	46.8	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-67	-25.2	179.8	-66.9	166.2	0	0	0	113	L314 Y315 K320 V324 L327 I346 L353	L314-L318 HydrophobicContact CD1-CD1 4.42Å; L314-L318 HydrophobicContact CG-CD1 4.38Å; L314-L318 WeakPolarHBondContact O-CG 2.88Å; L314-L318 PolarHBondContact O-N 3.11Å; L314-L318 VanDerWaalsContact O-N 3.12Å; Y315-L318 WeakPolarHBondContact O-CB 3.11Å; Y315-L318 PolarHBondContact O-N 3.14Å; L318-K320 PolarHBondContact O-N 3.39Å; L318-V324 WeakPolarHBondContact O-CG2 3.39Å; L318-L327 HydrophobicContact CD2-CD1 3.63Å; L318-I346 HydrophobicContact CB-CG2 4.47Å; L318-I346 HydrophobicContact CD1-CB 4.26Å; L318-I346 HydrophobicContact CD1-CD1 4.13Å; L318-I346 HydrophobicContact CD2-CG2 4.5Å; L318-L353 HydrophobicContact CD1-CD1 3.45Å; L318-L353 VanDerWaalsContact CD1-CD1 3.45Å
319	L	94.8	Very high	96.2	Very high	14 Å²	14	50.2 Å²	50.2	7%	0.073	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-17.4	174.4	-58.1	-178.9	0	0	0	113.3	M197 V218 Y315 Q317 F342	M197-L319 HydrophobicContact CE-CD2 4.36Å; V218-L319 HydrophobicContact CG1-CD2 3.37Å; Y315-L319 HydrophobicContact CD1-CD1 4.43Å; Y315-L319 HydrophobicContact CE1-CD1 4.09Å; Y315-L319 HydrophobicContact CE1-CD2 4.34Å; Y315-L319 HydrophobicContact CE1-CG 4.43Å; Y315-L319 PolarHBondContact O-N 2.91Å; Q317-L319 PolarHBondContact O-N 3.33Å; L319-F342 HydrophobicContact CD2-CE1 4.05Å; L319-F342 HydrophobicContact CD2-CZ 3.75Å
320	K	94.6	Very high	96.2	Very high	113 Å²	113	53.7 Å²	53.7	49%	0.491	29%	0.294	S	S	.	.	S	Bend	trans	-67.1	135.3	-177.1	-64.9	-176.9	179.9	-177.4	0	110.7	Q317 L318 S322 N323 V324	Q317-K320 WeakPolarHBondContact O-CB 3.29Å; Q317-K320 WeakPolarHBondContact O-CG 3.1Å; Q317-K320 PolarHBondContact O-N 3.01Å; Q317-K320 VanDerWaalsContact O-N 3.14Å; L318-K320 PolarHBondContact O-N 3.39Å; K320-S322 VanDerWaalsContact C-N 3.26Å; K320-S322 PolarHBondContact O-N 2.77Å; K320-N323 PolarHBondContact O-N 3.12Å; K320-V324 PolarHBondContact O-N 3.31Å
321	P	91.6	Very high	96.1	Very high	77 Å²	77	51 Å²	51	50%	0.5	28%	0.284	S	S	.	.	H	α-helix	trans	-47.6	-42.5	-177.9	-33.9	36.9	0	0	0	115.5	A196 A325	A196-P321 HydrophobicContact CB-CB 3.43Å; A196-P321 VanDerWaalsContact CB-CB 3.43Å; A196-P321 HydrophobicContact CB-CG 3.56Å; P321-A325 WeakPolarHBondContact O-CB 3.34Å; P321-A325 PolarHBondContact O-N 3.37Å
322	S	93.9	Very high	96	Very high	81 Å²	81	53.2 Å²	53.2	57%	0.566	28%	0.276	S	S	*	.	H	α-helix	trans	-66.8	-37.1	-179.6	54	0	0	0	0	112.8	K320 K326	K320-S322 VanDerWaalsContact C-N 3.26Å; K320-S322 PolarHBondContact O-N 2.77Å; S322-K326 VanDerWaalsContact O-CB 3.3Å; S322-K326 WeakPolarHBondContact O-CB 3.2Å; S322-K326 PolarHBondContact O-N 3.33Å
323	N	95.5	Very high	95.7	Very high	49 Å²	49	52.3 Å²	52.3	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-75.8	-40.3	-179.8	-71.3	-20.9	0	0	0	111.1	Q317 K320 A325 K326 L327	Q317-N323 PolarHBondContact O-ND2 3.4Å; K320-N323 PolarHBondContact O-N 3.12Å; N323-A325 VanDerWaalsContact C-N 3.35Å; N323-A325 PolarHBondContact O-N 3.04Å; N323-K326 PolarHBondContact O-N 3.13Å; N323-L327 WeakPolarHBondContact O-CG 3.18Å; N323-L327 PolarHBondContact O-N 3.38Å
324	V	92.9	Very high	95.3	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-56.4	-50.7	171.5	178.4	0	0	0	0	110.6	M197 F201 L318 K320 K326 L327 A328 F342	M197-V324 HydrophobicContact CB-CG1 3.9Å; F201-V324 HydrophobicContact CE2-CG1 3.73Å; F201-V324 HydrophobicContact CZ-CG1 4.05Å; L318-V324 WeakPolarHBondContact O-CG2 3.39Å; K320-V324 PolarHBondContact O-N 3.31Å; V324-K326 PolarHBondContact O-N 3.07Å; V324-L327 PolarHBondContact O-N 2.86Å; V324-A328 WeakPolarHBondContact O-CB 3.14Å; V324-A328 PolarHBondContact O-N 3.42Å; V324-F342 HydrophobicContact CG2-CE2 4.14Å
325	A	92.8	Very high	94.6	Very high	20 Å²	20	52.7 Å²	52.7	17%	0.165	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-44.3	-180	0	0	0	0	0	111.8	P321 N323 L327 A328 D329	P321-A325 WeakPolarHBondContact O-CB 3.34Å; P321-A325 PolarHBondContact O-N 3.37Å; N323-A325 VanDerWaalsContact C-N 3.35Å; N323-A325 PolarHBondContact O-N 3.04Å; A325-L327 PolarHBondContact O-N 2.88Å; A325-A328 PolarHBondContact O-N 3.34Å; A325-D329 WeakPolarHBondContact O-CB 3.42Å; A325-D329 PolarHBondContact O-N 3.13Å
326	K	96.1	Very high	93.9	Very high	135 Å²	135	56.6 Å²	56.6	59%	0.587	28%	0.279	S	S	*	.	H	α-helix	trans	-57.8	-46.7	177.4	-177.5	-174.7	174.5	-168.3	0	111.9	S322 N323 V324 D329 Q330	S322-K326 VanDerWaalsContact O-CB 3.3Å; S322-K326 WeakPolarHBondContact O-CB 3.2Å; S322-K326 PolarHBondContact O-N 3.33Å; N323-K326 PolarHBondContact O-N 3.13Å; V324-K326 PolarHBondContact O-N 3.07Å; K326-D329 PolarHBondContact O-N 2.6Å; K326-Q330 VanDerWaalsContact O-CB 3.31Å; K326-Q330 WeakPolarHBondContact O-CB 3.4Å; K326-Q330 PolarHBondContact O-N 2.83Å
327	L	96.6	Very high	93.2	Very high	11 Å²	11	56.5 Å²	56.5	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-68.3	-43.1	179	-69.7	177.8	0	0	0	111.7	L318 N323 V324 A325 D329 Q330 Y331 M345 I346 E349	L318-L327 HydrophobicContact CD2-CD1 3.63Å; N323-L327 WeakPolarHBondContact O-CG 3.18Å; N323-L327 PolarHBondContact O-N 3.38Å; V324-L327 PolarHBondContact O-N 2.86Å; A325-L327 PolarHBondContact O-N 2.88Å; L327-D329 VanDerWaalsContact C-N 3.27Å; L327-D329 PolarHBondContact O-N 3.19Å; L327-Q330 PolarHBondContact O-N 3Å; L327-Y331 HydrophobicContact CD2-CE2 4.11Å; L327-Y331 WeakPolarHBondContact O-CB 3.22Å; L327-Y331 VanDerWaalsContact O-CD2 3.31Å; L327-Y331 WeakPolarHBondContact O-CD2 3.29Å; L327-Y331 PolarHBondContact O-N 2.9Å; L327-M345 HydrophobicContact CB-CE 3.54Å; L327-M345 HydrophobicContact CB-CG 4.48Å; L327-M345 HydrophobicContact CB-SD 3.96Å; L327-M345 HydrophobicContact CD1-CE 4.27Å; L327-I346 HydrophobicContact CD1-CG2 3.96Å; L327-E349 HydrophobicContact CD2-CB 4.19Å; L327-E349 HydrophobicContact CD2-CG 3.93Å
328	A	95	Very high	92.9	Very high	2 Å²	2	52.3 Å²	52.3	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-41	176.7	0	0	0	0	0	111.7	H200 V324 A325 R332 F333 M345	H200-A328 HydrophobicContact CB-CB 4.2Å; H200-A328 WeakPolarHBondContact ND1-CB 3.3Å; V324-A328 WeakPolarHBondContact O-CB 3.14Å; V324-A328 PolarHBondContact O-N 3.42Å; A325-A328 PolarHBondContact O-N 3.34Å; A328-R332 WeakPolarHBondContact O-CA 3.44Å; A328-R332 PolarHBondContact O-N 3.34Å; A328-F333 PolarHBondContact O-N 3.04Å; A328-M345 VanDerWaalsContact CA-SD 3.55Å; A328-M345 HydrophobicContact CB-SD 4.01Å; A328-M345 PolarHBondContact N-SD 2.97Å; A328-M345 VanDerWaalsContact N-SD 3.45Å
329	D	95.9	Very high	92.7	Very high	99 Å²	99	52.5 Å²	52.5	53%	0.529	26%	0.26	S	S	.	.	H	α-helix	trans	-69.3	-42.4	176.4	-73.8	-19.3	0	0	0	112.6	A325 K326 L327 R332	A325-D329 WeakPolarHBondContact O-CB 3.42Å; A325-D329 PolarHBondContact O-N 3.13Å; K326-D329 PolarHBondContact O-N 2.6Å; L327-D329 VanDerWaalsContact C-N 3.27Å; L327-D329 PolarHBondContact O-N 3.19Å; D329-R332 WeakPolarHBondContact O-CD 3.34Å; D329-R332 PolarHBondContact O-N 3.45Å; D329-R332 PolarHBondContact O-NH1 2.63Å
330	Q	97.2	Very high	92.7	Very high	73 Å²	73	52.4 Å²	52.4	34%	0.341	26%	0.259	S	S	.	.	H	α-helix	trans	-59.2	-46.6	176.7	176.7	176.9	-55.2	0	0	111.1	Y277 K326 L327 R332 E349	Y277-Q330 WeakPolarHBondContact CD2-O 3.45Å; K326-Q330 VanDerWaalsContact O-CB 3.31Å; K326-Q330 WeakPolarHBondContact O-CB 3.4Å; K326-Q330 PolarHBondContact O-N 2.83Å; L327-Q330 PolarHBondContact O-N 3Å; Q330-R332 VanDerWaalsContact C-N 3.33Å; Q330-E349 PolarHBondContact NE2-OE2 3.44Å
331	Y	97.5	Very high	92.7	Very high	9 Å²	9	47.1 Å²	47.1	4%	0.035	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	3.6	-177.1	-75	-70.9	0	0	0	114.2	F274 Y277 V286 L327 F333 M345 M348 E349	F274-Y331 HydrophobicContact CD1-CD1 4.08Å; F274-Y331 HydrophobicContact CD1-CG 4.35Å; F274-Y331 AromaticContact CE1-CD1 3.84Å; F274-Y331 HydrophobicContact CE1-CD1 3.84Å; F274-Y331 AromaticContact CE1-CG 3.87Å; F274-Y331 HydrophobicContact CE1-CG 3.87Å; Y277-Y331 WeakPolarHBondContact CB-O 3.46Å; Y277-Y331 HydrophobicContact CD1-CD1 4.1Å; Y277-Y331 AromaticContact CD2-CD1 3.94Å; Y277-Y331 HydrophobicContact CD2-CD1 3.94Å; Y277-Y331 AromaticContact CE1-CD1 3.99Å; Y277-Y331 HydrophobicContact CE1-CD1 3.99Å; Y277-Y331 AromaticContact CE1-CE1 3.97Å; Y277-Y331 HydrophobicContact CE1-CE1 3.97Å; Y277-Y331 AromaticContact CE2-CD1 3.81Å; Y277-Y331 HydrophobicContact CE2-CD1 3.81Å; Y277-Y331 AromaticContact CE2-CE1 3.98Å; Y277-Y331 HydrophobicContact CE2-CE1 3.98Å; Y277-Y331 HydrophobicContact CG-CD1 4.08Å; Y277-Y331 AromaticContact CZ-CD1 3.84Å; Y277-Y331 AromaticContact CZ-CE1 3.66Å; V286-Y331 HydrophobicContact CG2-CE1 4.08Å; L327-Y331 HydrophobicContact CD2-CE2 4.11Å; L327-Y331 WeakPolarHBondContact O-CB 3.22Å; L327-Y331 VanDerWaalsContact O-CD2 3.31Å; L327-Y331 WeakPolarHBondContact O-CD2 3.29Å; L327-Y331 PolarHBondContact O-N 2.9Å; Y331-F333 PolarHBondContact O-N 3.24Å; Y331-F333 VanDerWaalsContact O-N 3.13Å; Y331-M345 HydrophobicContact CD2-CG 4.16Å; Y331-M348 HydrophobicContact CD1-CB 4.46Å; Y331-M348 HydrophobicContact CE1-CB 3.77Å; Y331-M348 HydrophobicContact CE1-CG 4.47Å; Y331-M348 HydrophobicContact CE2-CB 4.39Å; Y331-E349 HydrophobicContact CE2-CB 4.29Å; Y331-E349 WeakPolarHBondContact CE2-OE2 3.42Å; Y331-E349 PolarHBondContact OH-OE2 2.82Å
332	R	95.5	Very high	93	Very high	124 Å²	124	43.5 Å²	43.5	47%	0.468	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	34.2	-176.4	-51.5	-60.8	-172.8	-159.4	7	112.2	L276 E280 A328 D329 Q330	L276-R332 HydrophobicContact CB-CB 3.93Å; L276-R332 HydrophobicContact CB-CG 4.18Å; L276-R332 HydrophobicContact CD2-CB 3.99Å; L276-R332 HydrophobicContact CD2-CG 3.9Å; L276-R332 HydrophobicContact CG-CB 4.14Å; L276-R332 HydrophobicContact CG-CG 3.92Å; E280-R332 IonicContact OE1-NE 2.86Å; E280-R332 IonicContact OE2-CZ 3.76Å; E280-R332 IonicContact OE2-NE 3.86Å; E280-R332 PolarHBondContact OE2-NE 2.94Å; E280-R332 IonicContact OE2-NH2 3.23Å; A328-R332 WeakPolarHBondContact O-CA 3.44Å; A328-R332 PolarHBondContact O-N 3.34Å; D329-R332 WeakPolarHBondContact O-CD 3.34Å; D329-R332 PolarHBondContact O-N 3.45Å; D329-R332 PolarHBondContact O-NH1 2.63Å; Q330-R332 VanDerWaalsContact C-N 3.33Å
333	F	93.8	Very high	93.2	Very high	3 Å²	3	39.6 Å²	39.6	1%	0.013	19%	0.186	C	C	.	.			trans	-90.2	132.2	-164.4	-168.5	-81	0	0	0	111.3	F201 Y270 T273 F274 A328 Y331 D341 M345	F201-F333 AromaticContact CD1-CD1 3.89Å; F201-F333 HydrophobicContact CD1-CD1 3.89Å; F201-F333 AromaticContact CD1-CE1 3.64Å; F201-F333 HydrophobicContact CD1-CE1 3.64Å; F201-F333 AromaticContact CE1-CD1 3.67Å; F201-F333 HydrophobicContact CE1-CD1 3.67Å; F201-F333 AromaticContact CE1-CE1 3.79Å; F201-F333 HydrophobicContact CE1-CE1 3.79Å; Y270-F333 HydrophobicContact CD1-CE2 4Å; Y270-F333 HydrophobicContact CD1-CZ 4.35Å; Y270-F333 HydrophobicContact CE1-CE2 4.04Å; Y270-F333 AromaticContact CE1-CZ 3.93Å; Y270-F333 HydrophobicContact CE1-CZ 3.93Å; T273-F333 HydrophobicContact CG2-CD2 3.75Å; T273-F333 HydrophobicContact CG2-CE1 4.21Å; T273-F333 HydrophobicContact CG2-CE2 3.38Å; T273-F333 HydrophobicContact CG2-CG 4.37Å; T273-F333 HydrophobicContact CG2-CZ 3.64Å; F274-F333 AromaticContact CD1-CD2 3.87Å; F274-F333 HydrophobicContact CD1-CD2 3.87Å; F274-F333 HydrophobicContact CD2-CD2 4.26Å; F274-F333 HydrophobicContact CD2-CE2 4.19Å; F274-F333 AromaticContact CE1-CD2 3.38Å; F274-F333 HydrophobicContact CE1-CD2 3.38Å; F274-F333 HydrophobicContact CE1-CE2 4Å; F274-F333 HydrophobicContact CE1-CG 4.36Å; F274-F333 AromaticContact CE2-CD2 3.78Å; F274-F333 HydrophobicContact CE2-CD2 3.78Å; F274-F333 AromaticContact CE2-CE2 3.53Å; F274-F333 HydrophobicContact CE2-CE2 3.53Å; F274-F333 HydrophobicContact CG-CD2 4.3Å; F274-F333 AromaticContact CZ-CD2 3.3Å; F274-F333 HydrophobicContact CZ-CD2 3.3Å; F274-F333 AromaticContact CZ-CE2 3.42Å; F274-F333 HydrophobicContact CZ-CE2 3.42Å; F274-F333 VanDerWaalsContact CZ-CE2 3.42Å; F274-F333 HydrophobicContact CZ-CG 4.49Å; A328-F333 PolarHBondContact O-N 3.04Å; Y331-F333 PolarHBondContact O-N 3.24Å; Y331-F333 VanDerWaalsContact O-N 3.13Å; F333-D341 HydrophobicContact CE1-CB 3.74Å; F333-D341 HydrophobicContact CZ-CB 3.74Å; F333-M345 HydrophobicContact CB-SD 4.27Å; F333-M345 HydrophobicContact CG-SD 4.45Å
334	K	88.3	Confident	93.3	Very high	160 Å²	160	37.3 Å²	37.3	70%	0.696	17%	0.173	S	C	*	.			trans	-139.9	124.6	165.4	-69.2	-167.7	176.7	-172.1	0	109.2	T273	T273-K334 WeakPolarHBondContact CG2-O 3.35Å
335	G	84.7	Confident	93.6	Very high	2 Å²	2	37.2 Å²	37.2	2%	0.021	17%	0.173	C	C	.	.			trans	-123.8	175.9	-173	0	0	0	0	0	113.4	H200 F201 S202 A203 D341	H200-G335 PolarHBondContact O-N 3.24Å; F201-G335 CarbonylContact C-O 3.5Å; F201-G335 CarbonylContact O-C 3.37Å; S202-G335 PolarHBondContact N-O 2.94Å; A203-G335 WeakPolarHBondContact CB-O 3.44Å; A203-G335 PolarHBondContact N-O 3.18Å; G335-D341 VanDerWaalsContact C-OD2 3.24Å; G335-D341 WeakPolarHBondContact CA-OD2 3.25Å
336	H	83	Confident	93.8	Very high	81 Å²	81	36.3 Å²	36.3	38%	0.375	17%	0.165	S	C	.	.	S	Bend	trans	-147.9	14.2	175.8	66	-75.8	0	0	0	112.9	F201 Y209 D341	F201-H336 CarbonylContact O-C 3.58Å; F201-H336 WeakPolarHBondContact O-CA 3.32Å; F201-H336 PolarHBondContact O-N 3.3Å; Y209-H336 VanDerWaalsContact CB-O 3.29Å; Y209-H336 WeakPolarHBondContact CB-O 3.27Å; Y209-H336 WeakPolarHBondContact CD2-O 3.33Å; H336-D341 PolarHBondContact N-OD2 3.46Å
337	L	84.7	Confident	93.9	Very high	35 Å²	35	30 Å²	30	18%	0.183	14%	0.138	C	C	.	.	S	Bend	trans	-112.3	20.9	-175.6	-55.3	176.3	0	0	0	112.2	Y209 D339 Q340 D341	Y209-L337 HydrophobicContact CE2-CD2 4.17Å; L337-D339 PolarHBondContact O-N 3.28Å; L337-Q340 HydrophobicContact CB-CB 4.15Å; L337-Q340 WeakPolarHBondContact O-CB 3.28Å; L337-Q340 PolarHBondContact O-N 3.17Å; L337-D341 PolarHBondContact N-OD2 3.04Å
338	G	89.1	Confident	94	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	-124.9	170.1	0	0	0	0	0	113.9	F201 Q340 D341 F342	F201-G338 PolarHBondContact O-N 3.35Å; G338-Q340 VanDerWaalsContact C-N 3.31Å; G338-Q340 PolarHBondContact O-N 3.41Å; G338-D341 PolarHBondContact O-N 3.31Å; G338-F342 PolarHBondContact O-N 2.89Å
339	D	92.3	Very high	94.1	Very high	13 Å²	13	33.5 Å²	33.5	7%	0.07	15%	0.154	C	C	.	.	H	α-helix	trans	-56.3	-39.7	178.6	57.6	2.6	0	0	0	114.1	F214 S217 V218 S299 L337 D341 F342 F343	F214-D339 VanDerWaalsContact O-CB 3.3Å; F214-D339 WeakPolarHBondContact O-CB 3.34Å; F214-D339 PolarHBondContact O-N 2.88Å; S217-D339 WeakPolarHBondContact CB-OD2 3.34Å; S217-D339 WeakPolarHBondContact OG-CB 3.31Å; S217-D339 PolarHBondContact OG-OD2 2.79Å; V218-D339 HydrophobicContact CG2-CB 3.76Å; S299-D339 PolarHBondContact OG-OD1 2.97Å; L337-D339 PolarHBondContact O-N 3.28Å; D339-D341 PolarHBondContact O-N 3.23Å; D339-F342 PolarHBondContact O-N 3.42Å; D339-F342 VanDerWaalsContact O-N 3.14Å; D339-F343 HydrophobicContact CB-CD2 4.27Å; D339-F343 HydrophobicContact CB-CE2 3.92Å; D339-F343 VanDerWaalsContact O-CD2 3.24Å; D339-F343 WeakPolarHBondContact O-CD2 3.44Å; D339-F343 WeakPolarHBondContact O-CG 3.46Å; D339-F343 PolarHBondContact O-N 3.49Å
340	Q	95.7	Very high	94.3	Very high	13 Å²	13	30.7 Å²	30.7	6%	0.061	14%	0.138	C	C	.	.	H	α-helix	trans	-56.5	-41.7	179.5	-163.2	-175.7	-83.4	0	0	111.5	Y270 F297 N298 L337 G338 S344	Y270-Q340 WeakPolarHBondContact OH-CG 3.5Å; Y270-Q340 PolarHBondContact OH-NE2 2.94Å; Y270-Q340 PolarHBondContact OH-O 3Å; F297-Q340 WeakPolarHBondContact O-CG 3.49Å; F297-Q340 PolarHBondContact O-NE2 2.93Å; N298-Q340 PolarHBondContact ND2-OE1 3.4Å; L337-Q340 HydrophobicContact CB-CB 4.15Å; L337-Q340 WeakPolarHBondContact O-CB 3.28Å; L337-Q340 PolarHBondContact O-N 3.17Å; G338-Q340 VanDerWaalsContact C-N 3.31Å; G338-Q340 PolarHBondContact O-N 3.41Å; Q340-S344 WeakPolarHBondContact O-CB 3.42Å; Q340-S344 PolarHBondContact O-N 3.31Å; Q340-S344 PolarHBondContact O-OG 2.9Å
341	D	95.5	Very high	94.3	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.011	14%	0.139	C	C	.	.	H	α-helix	trans	-71.2	-41.4	179.1	-77	-18	0	0	0	111.9	F201 Y270 F333 G335 H336 L337 G338 D339 M345	F201-D341 HydrophobicContact CB-CB 4.2Å; F201-D341 HydrophobicContact CD1-CB 3.77Å; F201-D341 HydrophobicContact CG-CB 4.25Å; Y270-D341 WeakPolarHBondContact CE1-OD1 3.45Å; Y270-D341 PolarHBondContact OH-OD1 3.05Å; F333-D341 HydrophobicContact CE1-CB 3.74Å; F333-D341 HydrophobicContact CZ-CB 3.74Å; G335-D341 VanDerWaalsContact C-OD2 3.24Å; G335-D341 WeakPolarHBondContact CA-OD2 3.25Å; H336-D341 PolarHBondContact N-OD2 3.46Å; L337-D341 PolarHBondContact N-OD2 3.04Å; G338-D341 PolarHBondContact O-N 3.31Å; D339-D341 PolarHBondContact O-N 3.23Å; D341-M345 WeakPolarHBondContact O-CB 3.43Å; D341-M345 PolarHBondContact O-N 3.18Å
342	F	96.5	Very high	94.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.4	-52.3	175.2	173.8	-99.5	0	0	0	111.1	F201 V218 L319 V324 G338 D339 S344 M345 I346	F201-F342 HydrophobicContact CD2-CB 4.23Å; F201-F342 HydrophobicContact CE2-CB 4.1Å; F201-F342 AromaticContact CE2-CD2 3.82Å; F201-F342 HydrophobicContact CE2-CD2 3.82Å; F201-F342 HydrophobicContact CE2-CG 4.46Å; F201-F342 HydrophobicContact CZ-CB 4.46Å; F201-F342 HydrophobicContact CZ-CD2 4.2Å; V218-F342 HydrophobicContact CB-CD1 4.26Å; V218-F342 HydrophobicContact CB-CE1 4.5Å; V218-F342 HydrophobicContact CG1-CD1 3.62Å; V218-F342 HydrophobicContact CG1-CE1 3.5Å; V218-F342 VanDerWaalsContact CG1-CE1 3.5Å; V218-F342 HydrophobicContact CG1-CG 4.32Å; V218-F342 HydrophobicContact CG1-CZ 4.12Å; V218-F342 HydrophobicContact CG2-CB 4.31Å; V218-F342 HydrophobicContact CG2-CD1 3.63Å; V218-F342 HydrophobicContact CG2-CE1 4.33Å; V218-F342 HydrophobicContact CG2-CG 4.19Å; L319-F342 HydrophobicContact CD2-CE1 4.05Å; L319-F342 HydrophobicContact CD2-CZ 3.75Å; V324-F342 HydrophobicContact CG2-CE2 4.14Å; G338-F342 PolarHBondContact O-N 2.89Å; D339-F342 PolarHBondContact O-N 3.42Å; D339-F342 VanDerWaalsContact O-N 3.14Å; F342-S344 PolarHBondContact O-N 2.96Å; F342-M345 PolarHBondContact O-N 3.29Å; F342-I346 HydrophobicContact CD1-CD1 4.33Å; F342-I346 HydrophobicContact CD2-CG2 4.24Å; F342-I346 HydrophobicContact CE1-CD1 3.59Å; F342-I346 HydrophobicContact CE1-CG1 4.26Å; F342-I346 HydrophobicContact CE1-CG2 4.34Å; F342-I346 HydrophobicContact CE2-CG2 3.73Å; F342-I346 HydrophobicContact CZ-CD1 3.87Å; F342-I346 HydrophobicContact CZ-CG1 4.48Å; F342-I346 HydrophobicContact CZ-CG2 3.78Å; F342-I346 WeakPolarHBondContact O-CG1 3.45Å; F342-I346 PolarHBondContact O-N 2.88Å
343	F	98.4	Very high	94.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-42.3	179.6	-65.3	-42.3	0	0	0	112.3	S217 V218 I260 I262 F297 M302 Y315 D339 M345 I346 G347 F354	S217-F343 VanDerWaalsContact OG-CE2 3.31Å; S217-F343 WeakPolarHBondContact OG-CE2 3.47Å; V218-F343 HydrophobicContact CB-CZ 4.35Å; V218-F343 HydrophobicContact CG2-CE1 4.02Å; V218-F343 HydrophobicContact CG2-CE2 4.3Å; V218-F343 HydrophobicContact CG2-CZ 3.79Å; I260-F343 HydrophobicContact CD1-CD1 3.91Å; I260-F343 HydrophobicContact CD1-CE1 3.37Å; I260-F343 HydrophobicContact CD1-CZ 3.79Å; I262-F343 HydrophobicContact CD1-CD2 4.27Å; F297-F343 HydrophobicContact CD2-CB 4.28Å; M302-F343 HydrophobicContact SD-CD2 4.02Å; M302-F343 HydrophobicContact SD-CE2 3.64Å; Y315-F343 HydrophobicContact CE2-CE1 4.41Å; Y315-F343 WeakPolarHBondContact OH-CE1 3.03Å; D339-F343 HydrophobicContact CB-CD2 4.27Å; D339-F343 HydrophobicContact CB-CE2 3.92Å; D339-F343 VanDerWaalsContact O-CD2 3.24Å; D339-F343 WeakPolarHBondContact O-CD2 3.44Å; D339-F343 WeakPolarHBondContact O-CG 3.46Å; D339-F343 PolarHBondContact O-N 3.49Å; F343-M345 VanDerWaalsContact C-N 3.32Å; F343-M345 PolarHBondContact O-N 3.23Å; F343-I346 HydrophobicContact CD1-CD1 4.45Å; F343-G347 WeakPolarHBondContact O-CA 3.31Å; F343-G347 PolarHBondContact O-N 2.98Å; F343-F354 HydrophobicContact CB-CE1 3.98Å; F343-F354 HydrophobicContact CB-CZ 4.09Å; F343-F354 AromaticContact CD1-CE1 3.98Å; F343-F354 HydrophobicContact CD1-CE1 3.98Å; F343-F354 HydrophobicContact CD1-CZ 4.06Å; F343-F354 HydrophobicContact CG-CE1 4.16Å; F343-F354 HydrophobicContact CG-CZ 4.44Å
344	S	98.4	Very high	94.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-42.9	176.3	-64.8	0	0	0	0	111.4	Y270 F297 Q340 F342 M348	Y270-S344 VanDerWaalsContact CE2-OG 3.24Å; Y270-S344 WeakPolarHBondContact CE2-OG 3.37Å; Y270-S344 PolarHBondContact OH-OG 2.92Å; F297-S344 PolarHBondContact N-OG 2.97Å; Q340-S344 WeakPolarHBondContact O-CB 3.42Å; Q340-S344 PolarHBondContact O-N 3.31Å; Q340-S344 PolarHBondContact O-OG 2.9Å; F342-S344 PolarHBondContact O-N 2.96Å; S344-M348 VanDerWaalsContact O-CG 3.31Å; S344-M348 WeakPolarHBondContact O-CG 3.2Å; S344-M348 PolarHBondContact O-N 3.48Å
345	M	98	Very high	95.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.1	-50.4	178.8	-173.4	-169.3	71.1	0	0	112.2	F201 L327 A328 Y331 F333 D341 F342 F343 G347 M348	F201-M345 HydrophobicContact CE1-CE 4.17Å; F201-M345 HydrophobicContact CE1-SD 3.88Å; F201-M345 HydrophobicContact CZ-CE 3.53Å; F201-M345 HydrophobicContact CZ-SD 3.82Å; L327-M345 HydrophobicContact CB-CE 3.54Å; L327-M345 HydrophobicContact CB-CG 4.48Å; L327-M345 HydrophobicContact CB-SD 3.96Å; L327-M345 HydrophobicContact CD1-CE 4.27Å; A328-M345 VanDerWaalsContact CA-SD 3.55Å; A328-M345 HydrophobicContact CB-SD 4.01Å; A328-M345 PolarHBondContact N-SD 2.97Å; A328-M345 VanDerWaalsContact N-SD 3.45Å; Y331-M345 HydrophobicContact CD2-CG 4.16Å; F333-M345 HydrophobicContact CB-SD 4.27Å; F333-M345 HydrophobicContact CG-SD 4.45Å; D341-M345 WeakPolarHBondContact O-CB 3.43Å; D341-M345 PolarHBondContact O-N 3.18Å; F342-M345 PolarHBondContact O-N 3.29Å; F343-M345 VanDerWaalsContact C-N 3.32Å; F343-M345 PolarHBondContact O-N 3.23Å; M345-G347 VanDerWaalsContact C-N 3.26Å; M345-G347 PolarHBondContact O-N 2.78Å; M345-M348 WeakPolarHBondContact O-CB 3.47Å; M345-M348 PolarHBondContact O-N 3.37Å
346	I	98.2	Very high	95.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-69.4	-27.2	179.9	68.7	164.2	0	0	0	111.9	Y315 L318 L327 F342 F343 M348 E349 H350 L353 F354	Y315-I346 HydrophobicContact CD2-CD1 4.33Å; Y315-I346 HydrophobicContact CE2-CD1 4.06Å; L318-I346 HydrophobicContact CB-CG2 4.47Å; L318-I346 HydrophobicContact CD1-CB 4.26Å; L318-I346 HydrophobicContact CD1-CD1 4.13Å; L318-I346 HydrophobicContact CD2-CG2 4.5Å; L327-I346 HydrophobicContact CD1-CG2 3.96Å; F342-I346 HydrophobicContact CD1-CD1 4.33Å; F342-I346 HydrophobicContact CD2-CG2 4.24Å; F342-I346 HydrophobicContact CE1-CD1 3.59Å; F342-I346 HydrophobicContact CE1-CG1 4.26Å; F342-I346 HydrophobicContact CE1-CG2 4.34Å; F342-I346 HydrophobicContact CE2-CG2 3.73Å; F342-I346 HydrophobicContact CZ-CD1 3.87Å; F342-I346 HydrophobicContact CZ-CG1 4.48Å; F342-I346 HydrophobicContact CZ-CG2 3.78Å; F342-I346 WeakPolarHBondContact O-CG1 3.45Å; F342-I346 PolarHBondContact O-N 2.88Å; F343-I346 HydrophobicContact CD1-CD1 4.45Å; I346-M348 VanDerWaalsContact C-N 3.26Å; I346-M348 PolarHBondContact O-N 2.83Å; I346-E349 PolarHBondContact O-N 3.43Å; I346-E349 VanDerWaalsContact O-N 3.16Å; I346-H350 PolarHBondContact O-N 3.14Å; I346-L353 HydrophobicContact CD1-CD1 4.45Å; I346-F354 HydrophobicContact CD1-CE2 4.16Å; I346-F354 HydrophobicContact CD1-CZ 3.78Å; I346-F354 HydrophobicContact CG1-CE2 3.89Å; I346-F354 HydrophobicContact CG1-CZ 3.7Å
347	G	98.4	Very high	96.6	Very high	3 Å²	3	21.7 Å²	21.7	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-69.3	-20.6	174.3	0	0	0	0	0	114.1	F343 M345 E349	F343-G347 WeakPolarHBondContact O-CA 3.31Å; F343-G347 PolarHBondContact O-N 2.98Å; M345-G347 VanDerWaalsContact C-N 3.26Å; M345-G347 PolarHBondContact O-N 2.78Å; G347-E349 VanDerWaalsContact C-N 3.34Å
348	M	98.2	Very high	97.2	Very high	16 Å²	16	22.6 Å²	22.6	8%	0.079	13%	0.125	C	C	.	.	H	α-helix	trans	-69	-36.2	169.2	-59.1	-48.2	165.5	0	0	111.8	F274 V286 L294 Y331 S344 M345 I346	F274-M348 HydrophobicContact CD2-CE 4.35Å; F274-M348 HydrophobicContact CE1-CG 4.1Å; F274-M348 HydrophobicContact CE2-CE 3.62Å; F274-M348 HydrophobicContact CE2-CG 4.32Å; F274-M348 HydrophobicContact CZ-CE 3.98Å; F274-M348 HydrophobicContact CZ-CG 3.74Å; V286-M348 HydrophobicContact CB-SD 4.24Å; V286-M348 HydrophobicContact CG1-CE 4.33Å; V286-M348 HydrophobicContact CG1-CG 3.92Å; V286-M348 HydrophobicContact CG1-SD 3.91Å; V286-M348 HydrophobicContact CG2-CB 3.98Å; V286-M348 HydrophobicContact CG2-CG 4.01Å; V286-M348 HydrophobicContact CG2-SD 3.97Å; L294-M348 HydrophobicContact CB-CE 4.29Å; L294-M348 HydrophobicContact CB-SD 3.48Å; L294-M348 WeakPolarHBondContact CB-SD 3.47Å; L294-M348 HydrophobicContact CD1-SD 4.01Å; L294-M348 HydrophobicContact CG-SD 4.39Å; L294-M348 WeakPolarHBondContact O-CE 3.47Å; Y331-M348 HydrophobicContact CD1-CB 4.46Å; Y331-M348 HydrophobicContact CE1-CB 3.77Å; Y331-M348 HydrophobicContact CE1-CG 4.47Å; Y331-M348 HydrophobicContact CE2-CB 4.39Å; S344-M348 VanDerWaalsContact O-CG 3.31Å; S344-M348 WeakPolarHBondContact O-CG 3.2Å; S344-M348 PolarHBondContact O-N 3.48Å; M345-M348 WeakPolarHBondContact O-CB 3.47Å; M345-M348 PolarHBondContact O-N 3.37Å; I346-M348 VanDerWaalsContact C-N 3.26Å; I346-M348 PolarHBondContact O-N 2.83Å
349	E	97.8	Very high	97.7	Very high	71 Å²	71	24.4 Å²	24.4	33%	0.332	14%	0.137	S	C	.	.	H	α-helix	trans	-86.1	-43.5	-178	-168.5	71	-166.3	0	0	112.2	L327 Q330 Y331 I346 G347 P351	L327-E349 HydrophobicContact CD2-CB 4.19Å; L327-E349 HydrophobicContact CD2-CG 3.93Å; Q330-E349 PolarHBondContact NE2-OE2 3.44Å; Y331-E349 HydrophobicContact CE2-CB 4.29Å; Y331-E349 WeakPolarHBondContact CE2-OE2 3.42Å; Y331-E349 PolarHBondContact OH-OE2 2.82Å; I346-E349 PolarHBondContact O-N 3.43Å; I346-E349 VanDerWaalsContact O-N 3.16Å; G347-E349 VanDerWaalsContact C-N 3.34Å; E349-P351 WeakPolarHBondContact O-CD 3.32Å
350	H	98.3	Very high	98	Very high	39 Å²	39	23.9 Å²	23.9	18%	0.181	13%	0.134	C	C	.	.			trans	-129.7	66.6	-170.8	-65.8	-65.4	0	0	0	111.2	L314 I346 E352 L353	L314-H350 HydrophobicContact CD2-CB 4.46Å; I346-H350 PolarHBondContact O-N 3.14Å; H350-E352 VanDerWaalsContact CA-OE2 3.24Å; H350-E352 WeakPolarHBondContact CA-OE2 3.45Å; H350-E352 IonicContact CG-OE1 2.63Å; H350-E352 IonicContact ND1-OE1 3Å; H350-E352 PolarHBondContact ND1-OE1 2.92Å; H350-E352 PolarHBondContact O-N 2.77Å; H350-E352 VanDerWaalsContact O-N 3.16Å; H350-L353 HydrophobicContact CB-CD1 3.71Å; H350-L353 HydrophobicContact CB-CG 4.08Å; H350-L353 PolarHBondContact O-N 3.49Å
351	P	97.9	Very high	98.1	Very high	57 Å²	57	23.7 Å²	23.7	37%	0.37	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-59.8	-24.1	178.9	26.5	-35.6	0	0	0	112.9	E349 L353 F354	E349-P351 WeakPolarHBondContact O-CD 3.32Å; P351-L353 PolarHBondContact O-N 2.96Å; P351-F354 PolarHBondContact O-N 2.87Å
352	E	98.3	Very high	98.3	Very high	93 Å²	93	23.6 Å²	23.6	44%	0.435	13%	0.133	S	C	.	.	G	3₁₀ helix	trans	-62.8	-19.5	177.4	68.4	-82.5	-168.3	0	0	114.4	G257 A258 H350 F354	G257-E352 CarbonylContact C-O 3.44Å; A258-E352 WeakPolarHBondContact CA-O 3.38Å; A258-E352 PolarHBondContact N-O 3.14Å; H350-E352 VanDerWaalsContact CA-OE2 3.24Å; H350-E352 WeakPolarHBondContact CA-OE2 3.45Å; H350-E352 IonicContact CG-OE1 2.63Å; H350-E352 IonicContact ND1-OE1 3Å; H350-E352 PolarHBondContact ND1-OE1 2.92Å; H350-E352 PolarHBondContact O-N 2.77Å; H350-E352 VanDerWaalsContact O-N 3.16Å; E352-F354 PolarHBondContact O-N 3.36Å
353	L	98.8	Very high	98.4	Very high	2 Å²	2	25 Å²	25	1%	0.01	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-73.7	-12.9	174.4	-69.2	172.5	0	0	0	112.7	A258 V259 I260 L314 Y315 L318 I346 H350 P351	A258-L353 WeakPolarHBondContact CA-O 3.31Å; V259-L353 HydrophobicContact CG1-CD2 4.44Å; V259-L353 HydrophobicContact CG2-CB 4.27Å; V259-L353 HydrophobicContact CG2-CD2 4.15Å; V259-L353 PolarHBondContact N-O 2.98Å; I260-L353 PolarHBondContact N-O 3.43Å; L314-L353 HydrophobicContact CD2-CD1 4.3Å; L314-L353 HydrophobicContact CD2-CD2 4.1Å; L314-L353 HydrophobicContact CD2-CG 4.21Å; L314-L353 HydrophobicContact CG-CD1 4.3Å; L314-L353 HydrophobicContact CG-CD2 4.35Å; Y315-L353 HydrophobicContact CD2-CD1 4.36Å; L318-L353 HydrophobicContact CD1-CD1 3.45Å; L318-L353 VanDerWaalsContact CD1-CD1 3.45Å; I346-L353 HydrophobicContact CD1-CD1 4.45Å; H350-L353 HydrophobicContact CB-CD1 3.71Å; H350-L353 HydrophobicContact CB-CG 4.08Å; H350-L353 PolarHBondContact O-N 3.49Å; P351-L353 PolarHBondContact O-N 2.96Å
354	F	98.8	Very high	98.4	Very high	15 Å²	15	25 Å²	25	7%	0.066	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	127.7	-170.8	-59.8	-85.6	0	0	0	112.4	I260 I262 F297 F343 I346 P351 E352	I260-F354 HydrophobicContact CB-CD1 3.93Å; I260-F354 HydrophobicContact CB-CE1 4.09Å; I260-F354 HydrophobicContact CD1-CE1 4.07Å; I260-F354 HydrophobicContact CG2-CD1 4.01Å; I260-F354 HydrophobicContact CG2-CE1 4.16Å; I260-F354 CarbonylContact O-C 3.54Å; I260-F354 VanDerWaalsContact O-CA 3.27Å; I260-F354 WeakPolarHBondContact O-CA 3.43Å; I262-F354 HydrophobicContact CG2-CB 4.49Å; I262-F354 HydrophobicContact CG2-CD1 3.74Å; I262-F354 HydrophobicContact CG2-CE1 4.47Å; I262-F354 HydrophobicContact CG2-CG 4.47Å; F297-F354 HydrophobicContact CD2-CD1 4.44Å; F297-F354 HydrophobicContact CD2-CE1 4.46Å; F297-F354 HydrophobicContact CE2-CB 4.28Å; F297-F354 AromaticContact CE2-CD1 3.87Å; F297-F354 HydrophobicContact CE2-CD1 3.87Å; F297-F354 AromaticContact CE2-CD2 3.85Å; F297-F354 HydrophobicContact CE2-CD2 3.85Å; F297-F354 HydrophobicContact CE2-CE1 4.11Å; F297-F354 HydrophobicContact CE2-CE2 4.11Å; F297-F354 AromaticContact CE2-CG 3.72Å; F297-F354 HydrophobicContact CE2-CG 3.72Å; F297-F354 HydrophobicContact CE2-CZ 4.22Å; F297-F354 HydrophobicContact CZ-CB 3.85Å; F297-F354 HydrophobicContact CZ-CD1 4.26Å; F297-F354 HydrophobicContact CZ-CD2 4.14Å; F297-F354 AromaticContact CZ-CG 3.82Å; F297-F354 HydrophobicContact CZ-CG 3.82Å; F343-F354 HydrophobicContact CB-CE1 3.98Å; F343-F354 HydrophobicContact CB-CZ 4.09Å; F343-F354 AromaticContact CD1-CE1 3.98Å; F343-F354 HydrophobicContact CD1-CE1 3.98Å; F343-F354 HydrophobicContact CD1-CZ 4.06Å; F343-F354 HydrophobicContact CG-CE1 4.16Å; F343-F354 HydrophobicContact CG-CZ 4.44Å; I346-F354 HydrophobicContact CD1-CE2 4.16Å; I346-F354 HydrophobicContact CD1-CZ 3.78Å; I346-F354 HydrophobicContact CG1-CE2 3.89Å; I346-F354 HydrophobicContact CG1-CZ 3.7Å; P351-F354 PolarHBondContact O-N 2.87Å; E352-F354 PolarHBondContact O-N 3.36Å
355	Y	98.8	Very high	98.4	Very high	45 Å²	45	26 Å²	26	18%	0.176	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	115.1	161.6	174.2	-108.8	0	0	0	109	E250 K253 F254 I260 G261 I262 L357	E250-Y355 HydrophobicContact CB-CE1 4.15Å; E250-Y355 VanDerWaalsContact OE2-CE1 3.3Å; E250-Y355 WeakPolarHBondContact OE2-CE1 3.25Å; E250-Y355 PolarHBondContact OE2-OH 3.48Å; K253-Y355 HydrophobicContact CB-CE1 4.35Å; K253-Y355 HydrophobicContact CB-CE2 3.91Å; K253-Y355 VanDerWaalsContact CD-OH 3.29Å; K253-Y355 WeakPolarHBondContact CD-OH 3.21Å; F254-Y355 AromaticContact CD1-CD1 3.71Å; F254-Y355 HydrophobicContact CD1-CD1 3.71Å; F254-Y355 AromaticContact CD1-CG 3.72Å; F254-Y355 HydrophobicContact CD1-CG 3.72Å; F254-Y355 AromaticContact CE1-CD1 3.6Å; F254-Y355 HydrophobicContact CE1-CD1 3.6Å; F254-Y355 AromaticContact CE1-CG 3.97Å; F254-Y355 HydrophobicContact CE1-CG 3.97Å; I260-Y355 PolarHBondContact O-N 3.33Å; G261-Y355 CarbonylContact C-O 3.13Å; G261-Y355 VanDerWaalsContact CA-O 3.27Å; G261-Y355 WeakPolarHBondContact CA-O 3.46Å; I262-Y355 PolarHBondContact N-O 3.33Å; Y355-L357 HydrophobicContact CD1-CD2 4.01Å; Y355-L357 HydrophobicContact CE1-CD2 3.81Å; Y355-L357 PolarHBondContact O-N 2.93Å
356	S	97.8	Very high	98.4	Very high	47 Å²	47	26.1 Å²	26.1	33%	0.329	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	106.9	179.6	-174.6	0	0	0	0	110	I262 R264	I262-S356 WeakPolarHBondContact O-CA 3.44Å; R264-S356 PolarHBondContact NE-OG 3.29Å
357	L	98.5	Very high	98.4	Very high	5 Å²	5	27.9 Å²	27.9	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	147.8	173.1	-64.8	171.5	0	0	0	110.5	E250 I262 A263 V301 L303 Y355 W361	E250-L357 HydrophobicContact CB-CD2 4.02Å; E250-L357 HydrophobicContact CG-CD2 4.06Å; I262-L357 PolarHBondContact O-N 3.07Å; A263-L357 HydrophobicContact CB-CB 4.24Å; V301-L357 HydrophobicContact CG1-CD1 4.29Å; L303-L357 HydrophobicContact CD1-CD1 4.03Å; L303-L357 HydrophobicContact CD1-CD2 4.35Å; Y355-L357 HydrophobicContact CD1-CD2 4.01Å; Y355-L357 HydrophobicContact CE1-CD2 3.81Å; Y355-L357 PolarHBondContact O-N 2.93Å; L357-W361 HydrophobicContact CB-CB 4.34Å
358	A	98.1	Very high	98.3	Very high	54 Å²	54	31.1 Å²	31.1	45%	0.446	17%	0.166	S	C	.	.			trans	-57.9	141.6	168.2	0	0	0	0	0	110.1	G360 W361	A358-G360 PolarHBondContact O-N 3.2Å; A358-W361 WeakPolarHBondContact O-CB 2.92Å; A358-W361 PolarHBondContact O-N 3.33Å
359	C	98.3	Very high	98.3	Very high	38 Å²	38	31.7 Å²	31.7	26%	0.257	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-54	-31.6	-178.2	62.9	0	0	0	0	113	M266 W361 N362 R363 C384	M266-C359 HydrophobicContact CE-CB 3.38Å; M266-C359 VanDerWaalsContact CE-O 3.29Å; M266-C359 WeakPolarHBondContact CE-O 3.09Å; C359-W361 PolarHBondContact O-N 2.93Å; C359-N362 CarbonylContact O-C 3.12Å; C359-N362 PolarHBondContact O-N 3.07Å; C359-N362 VanDerWaalsContact O-N 3.14Å; C359-R363 PolarHBondContact O-N 3.23Å; C359-C384 VanDerWaalsContact C-SG 3.56Å; C359-C384 HydrophobicContact CB-CB 3.77Å; C359-C384 WeakPolarHBondContact CB-SG 3.28Å; C359-C384 WeakPolarHBondContact SG-CA 3.48Å; C359-C384 WeakPolarHBondContact SG-CB 3.33Å; C359-C384 CovalentContact SG-SG 2.04Å; C359-C384 PolarHBondContact SG-SG 3.35Å
360	G	98.4	Very high	98.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.01	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-63	-23.7	177.7	0	0	0	0	0	115.2	A358 N362 P387 Y389 I390	A358-G360 PolarHBondContact O-N 3.2Å; G360-N362 PolarHBondContact O-N 2.92Å; G360-P387 VanDerWaalsContact CA-O 3.3Å; G360-P387 WeakPolarHBondContact CA-O 3.32Å; G360-Y389 WeakPolarHBondContact O-CA 3.49Å; G360-Y389 WeakPolarHBondContact O-CB 3.21Å; G360-Y389 PolarHBondContact O-N 3.05Å; G360-I390 PolarHBondContact O-N 2.88Å
361	W	98.8	Very high	98.2	Very high	10 Å²	10	36.2 Å²	36.2	4%	0.038	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-74.6	-14.6	176.7	-79.7	124.7	0	0	0	113.2	T242 D246 L247 E250 V301 L357 A358 C359 Y389 I390	T242-W361 HydrophobicContact CG2-CH2 3.75Å; T242-W361 HydrophobicContact CG2-CZ3 3.65Å; D246-W361 HydrophobicContact CB-CH2 3.85Å; D246-W361 HydrophobicContact CB-CZ2 4.31Å; L247-W361 HydrophobicContact CB-CE3 4.17Å; L247-W361 HydrophobicContact CB-CH2 3.95Å; L247-W361 HydrophobicContact CB-CZ3 3.71Å; L247-W361 HydrophobicContact CD1-CB 4.46Å; L247-W361 HydrophobicContact CD1-CD2 3.71Å; L247-W361 HydrophobicContact CD1-CE3 3.62Å; L247-W361 HydrophobicContact CD1-CG 4.12Å; L247-W361 HydrophobicContact CD1-CZ3 4.06Å; L247-W361 HydrophobicContact CG-CE3 4.37Å; L247-W361 HydrophobicContact CG-CZ3 4.39Å; E250-W361 HydrophobicContact CG-CZ2 4.44Å; E250-W361 PolarHBondContact OE1-NE1 2.99Å; V301-W361 WeakPolarHBondContact CG2-O 3.46Å; L357-W361 HydrophobicContact CB-CB 4.34Å; A358-W361 WeakPolarHBondContact O-CB 2.92Å; A358-W361 PolarHBondContact O-N 3.33Å; C359-W361 PolarHBondContact O-N 2.93Å; W361-Y389 AromaticContact CD2-CD2 3.67Å; W361-Y389 HydrophobicContact CD2-CD2 3.67Å; W361-Y389 HydrophobicContact CD2-CE2 4.47Å; W361-Y389 HydrophobicContact CD2-CG 4.01Å; W361-Y389 AromaticContact CE2-CD2 3.78Å; W361-Y389 VanDerWaalsContact CE3-CB 3.45Å; W361-Y389 HydrophobicContact CE3-CD2 4.13Å; W361-Y389 HydrophobicContact CE3-CG 4Å; W361-Y389 AromaticContact CG-CD2 3.88Å; W361-Y389 HydrophobicContact CG-CD2 3.88Å; W361-Y389 HydrophobicContact CH2-CG 4.32Å; W361-Y389 HydrophobicContact CZ2-CD2 4.33Å; W361-Y389 HydrophobicContact CZ2-CG 4.35Å; W361-Y389 HydrophobicContact CZ3-CG 4.16Å; W361-I390 HydrophobicContact CE3-CD1 4.08Å; W361-I390 HydrophobicContact CE3-CG1 4.21Å; W361-I390 HydrophobicContact CZ3-CD1 4.44Å; W361-I390 WeakPolarHBondContact O-CB 3.27Å
362	N	98.8	Very high	98.1	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-150.7	69	173.6	-175.7	0.4	0	0	0	108.3	A263 M266 N298 V301 C359 G360 Q364 H392	A263-N362 HydrophobicContact CB-CB 3.59Å; M266-N362 WeakPolarHBondContact CE-O 3.39Å; N298-N362 PolarHBondContact OD1-ND2 3.46Å; V301-N362 HydrophobicContact CB-CB 4.03Å; V301-N362 HydrophobicContact CG2-CB 3.94Å; C359-N362 CarbonylContact O-C 3.12Å; C359-N362 PolarHBondContact O-N 3.07Å; C359-N362 VanDerWaalsContact O-N 3.14Å; G360-N362 PolarHBondContact O-N 2.92Å; N362-Q364 VanDerWaalsContact C-N 3.33Å; N362-Q364 PolarHBondContact O-N 3.09Å; N362-H392 WeakPolarHBondContact OD1-CB 3.47Å; N362-H392 PolarHBondContact OD1-ND1 3.13Å
363	R	98.7	Very high	97.9	Very high	29 Å²	29	34.2 Å²	34.2	11%	0.109	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	90.3	-178.9	179.7	54.3	-174.4	155	-2.8	109.7	M266 C359 Y382 V388 I390 Y391 H392	M266-R363 PolarHBondContact SD-NH1 3.2Å; C359-R363 PolarHBondContact O-N 3.23Å; R363-Y382 VanDerWaalsContact CZ-O 3.23Å; R363-Y382 PolarHBondContact NH1-O 2.67Å; R363-Y382 PolarHBondContact NH2-O 2.91Å; R363-V388 HydrophobicContact CB-CG1 3.71Å; R363-V388 HydrophobicContact CB-CG2 4.19Å; R363-V388 HydrophobicContact CG-CG1 4.2Å; R363-V388 HydrophobicContact CG-CG2 3.96Å; R363-I390 WeakPolarHBondContact CB-O 3.32Å; R363-I390 PolarHBondContact N-O 3.3Å; R363-Y391 HydrophobicContact CB-CD1 4.11Å; R363-Y391 HydrophobicContact CG-CD1 3.87Å; R363-Y391 HydrophobicContact CG-CE1 3.92Å; R363-H392 PolarHBondContact O-N 3.04Å
364	Q	98.7	Very high	97.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	133.7	179.1	-59	172.7	-102.5	0	0	111.4	R264 E265 M266 N298 N362 Y382	R264-Q364 PolarHBondContact O-OE1 2.85Å; E265-Q364 PolarHBondContact OE1-NE2 3.13Å; E265-Q364 PolarHBondContact OE2-NE2 2.89Å; M266-Q364 HydrophobicContact CB-CB 4.18Å; M266-Q364 HydrophobicContact CG-CB 4.37Å; M266-Q364 HydrophobicContact CG-CG 4.47Å; M266-Q364 HydrophobicContact SD-CB 3.96Å; M266-Q364 HydrophobicContact SD-CG 4.28Å; N298-Q364 VanDerWaalsContact CB-CD 3.44Å; N298-Q364 HydrophobicContact CB-CG 4.3Å; N298-Q364 VanDerWaalsContact CG-CD 3.44Å; N298-Q364 VanDerWaalsContact CG-NE2 3.26Å; N298-Q364 PolarHBondContact ND2-NE2 2.96Å; N362-Q364 VanDerWaalsContact C-N 3.33Å; N362-Q364 PolarHBondContact O-N 3.09Å; Q364-Y382 WeakPolarHBondContact O-CE2 3.33Å
365	L	98.4	Very high	97.8	Very high	21 Å²	21	37.4 Å²	37.4	11%	0.11	22%	0.216	C	C	.	.			trans	-103.9	-14.8	-175.8	-65.2	178.1	0	0	0	113.5	T367 Y382 Y391 H392 N394 I399	L365-T367 PolarHBondContact O-N 3.1Å; L365-Y382 PolarHBondContact O-OH 3.49Å; L365-Y391 HydrophobicContact CD1-CD1 4.13Å; L365-Y391 HydrophobicContact CD2-CD1 3.82Å; L365-Y391 HydrophobicContact CD2-CE1 4.13Å; L365-Y391 HydrophobicContact CG-CD1 4.2Å; L365-H392 WeakPolarHBondContact CB-O 3.37Å; L365-H392 PolarHBondContact N-O 3.07Å; L365-N394 PolarHBondContact N-OD1 3.41Å; L365-N394 VanDerWaalsContact N-OD1 3.07Å; L365-I399 HydrophobicContact CD1-CB 4.22Å; L365-I399 HydrophobicContact CD1-CG1 4.01Å; L365-I399 HydrophobicContact CD1-CG2 4.26Å
366	C	98.3	Very high	97.8	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.02	24%	0.242	C	C	.	.			trans	-57.8	131.8	-179.7	-168.1	0	0	0	0	113	Q267 N394 C395 S397	Q267-C366 VanDerWaalsContact NE2-C 3.25Å; Q267-C366 PolarHBondContact NE2-O 3.02Å; Q267-C366 PolarHBondContact OE1-SG 2.98Å; C366-N394 HydrophobicContact CB-CB 4.46Å; C366-N394 VanDerWaalsContact CB-CG 3.42Å; C366-N394 VanDerWaalsContact CB-ND2 3.25Å; C366-N394 WeakPolarHBondContact CB-ND2 3.25Å; C366-N394 VanDerWaalsContact CB-OD1 3.32Å; C366-N394 WeakPolarHBondContact CB-OD1 3.35Å; C366-N394 PolarHBondContact N-OD1 3.18Å; C366-C395 WeakPolarHBondContact CA-SG 3.38Å; C366-C395 HydrophobicContact CB-CB 3.94Å; C366-C395 WeakPolarHBondContact CB-SG 3.28Å; C366-C395 WeakPolarHBondContact SG-CB 3.47Å; C366-C395 CovalentContact SG-SG 2.02Å; C366-C395 PolarHBondContact SG-SG 3Å; C366-S397 VanDerWaalsContact CA-OG 3.31Å; C366-S397 WeakPolarHBondContact CA-OG 3.4Å; C366-S397 PolarHBondContact N-OG 3.27Å
367	T	97.9	Very high	97.8	Very high	37 Å²	37	40.3 Å²	40.3	23%	0.227	23%	0.231	C	C	.	.			trans	-118	9.5	173.9	67	0	0	0	0	113.7	Q267 L365 W369 R370 F378 Y382	Q267-T367 VanDerWaalsContact NE2-C 3.32Å; L365-T367 PolarHBondContact O-N 3.1Å; T367-W369 VanDerWaalsContact C-N 3.29Å; T367-W369 PolarHBondContact O-N 3.2Å; T367-W369 VanDerWaalsContact O-N 3.14Å; T367-R370 WeakPolarHBondContact O-CB 2.99Å; T367-R370 PolarHBondContact O-N 2.91Å; T367-R370 PolarHBondContact OG1-NH2 3.43Å; T367-F378 HydrophobicContact CG2-CE1 4.18Å; T367-F378 HydrophobicContact CG2-CZ 3.92Å; T367-Y382 HydrophobicContact CG2-CE2 4.21Å
368	W	97.1	Very high	97.8	Very high	71 Å²	71	40.3 Å²	40.3	27%	0.269	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-47.6	-47.6	-175.5	-170.7	93.4	0	0	0	113.3	I52 Q267 R370 D371 H372	I52-W368 HydrophobicContact CG1-CH2 4.23Å; I52-W368 HydrophobicContact CG2-CH2 4.24Å; Q267-W368 VanDerWaalsContact NE2-N 3.17Å; W368-R370 VanDerWaalsContact C-N 3.27Å; W368-R370 PolarHBondContact O-N 3.33Å; W368-D371 PolarHBondContact O-N 3.48Å; W368-H372 AromaticContact CD1-CE1 3.78Å; W368-H372 AromaticContact CD2-CE1 3.7Å; W368-H372 AromaticContact CD2-CG 3.9Å; W368-H372 AromaticContact CD2-ND1 3.46Å; W368-H372 AromaticContact CE2-CD2 3.76Å; W368-H372 AromaticContact CE2-CE1 3.25Å; W368-H372 AromaticContact CE2-CG 3.78Å; W368-H372 AromaticContact CE2-ND1 3.46Å; W368-H372 AromaticContact CE2-NE2 3.44Å; W368-H372 HydrophobicContact CE3-CB 4.03Å; W368-H372 AromaticContact CE3-CG 3.83Å; W368-H372 AromaticContact CE3-ND1 3.78Å; W368-H372 AromaticContact CG-ND1 3.94Å; W368-H372 HydrophobicContact CH2-CB 3.93Å; W368-H372 AromaticContact CH2-CD2 3.46Å; W368-H372 VanDerWaalsContact CH2-CD2 3.46Å; W368-H372 WeakPolarHBondContact CH2-CD2 3.11Å; W368-H372 AromaticContact CH2-CG 3.55Å; W368-H372 AromaticContact CH2-NE2 3.99Å; W368-H372 HydrophobicContact CZ2-CB 4.48Å; W368-H372 AromaticContact CZ2-CD2 3.28Å; W368-H372 WeakPolarHBondContact CZ2-CD2 3.39Å; W368-H372 AromaticContact CZ2-CE1 3.62Å; W368-H372 AromaticContact CZ2-CG 3.62Å; W368-H372 AromaticContact CZ2-ND1 3.81Å; W368-H372 AromaticContact CZ2-NE2 3.3Å; W368-H372 VanDerWaalsContact CZ2-NE2 3.3Å; W368-H372 WeakPolarHBondContact CZ2-NE2 3.2Å; W368-H372 HydrophobicContact CZ3-CB 3.67Å; W368-H372 AromaticContact CZ3-CG 3.65Å; W368-H372 AromaticContact NE1-CE1 3.29Å; W368-H372 PolarHBondContact NE1-CE1 2.94Å; W368-H372 VanDerWaalsContact NE1-CE1 3.29Å; W368-H372 AromaticContact NE1-ND1 3.87Å; W368-H372 AromaticContact NE1-NE2 3.68Å; W368-H372 PolarHBondContact O-ND1 2.84Å
369	W	97.3	Very high	97.8	Very high	28 Å²	28	44 Å²	44	11%	0.106	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-67.3	-22	-177.3	-77.6	101.5	0	0	0	115	Q267 P268 V269 H272 T367 D371 H372 Y374	Q267-W369 HydrophobicContact CB-CB 4.31Å; Q267-W369 HydrophobicContact CB-CG 4.44Å; P268-W369 HydrophobicContact CG-CB 4.04Å; V269-W369 HydrophobicContact CB-CZ2 4.26Å; V269-W369 HydrophobicContact CG2-CZ2 3.73Å; H272-W369 HydrophobicContact CB-CH2 3.93Å; H272-W369 HydrophobicContact CB-CZ3 3.89Å; H272-W369 AromaticContact CD2-CH2 3.46Å; H272-W369 VanDerWaalsContact CD2-CH2 3.46Å; H272-W369 WeakPolarHBondContact CD2-CH2 3.45Å; H272-W369 AromaticContact CD2-CZ3 3.96Å; H272-W369 AromaticContact CG-CH2 3.61Å; H272-W369 AromaticContact CG-CZ3 3.66Å; H272-W369 AromaticContact ND1-CZ3 3.95Å; H272-W369 AromaticContact NE2-CH2 3.99Å; T367-W369 VanDerWaalsContact C-N 3.29Å; T367-W369 PolarHBondContact O-N 3.2Å; T367-W369 VanDerWaalsContact O-N 3.14Å; W369-D371 VanDerWaalsContact C-N 3.25Å; W369-D371 PolarHBondContact O-N 2.89Å; W369-H372 HydrophobicContact CE3-CB 4.49Å; W369-H372 PolarHBondContact O-N 3.32Å; W369-Y374 AromaticContact CE3-CD2 3.64Å; W369-Y374 HydrophobicContact CE3-CD2 3.64Å; W369-Y374 AromaticContact CE3-CE2 3.55Å; W369-Y374 HydrophobicContact CE3-CE2 3.55Å; W369-Y374 HydrophobicContact CZ3-CD2 4.21Å; W369-Y374 AromaticContact CZ3-CE2 3.65Å; W369-Y374 HydrophobicContact CZ3-CE2 3.65Å
370	R	97.5	Very high	97.8	Very high	103 Å²	103	47 Å²	47	39%	0.389	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-56.4	-46.1	173	-173.7	-174	64	-153.6	-11	110.5	T367 W368 H372 G375 F378	T367-R370 WeakPolarHBondContact O-CB 2.99Å; T367-R370 PolarHBondContact O-N 2.91Å; T367-R370 PolarHBondContact OG1-NH2 3.43Å; W368-R370 VanDerWaalsContact C-N 3.27Å; W368-R370 PolarHBondContact O-N 3.33Å; R370-H372 VanDerWaalsContact C-N 3.28Å; R370-H372 PolarHBondContact O-N 3.48Å; R370-G375 WeakPolarHBondContact O-CA 3.31Å; R370-G375 PolarHBondContact O-N 2.79Å; R370-G375 VanDerWaalsContact O-N 3.13Å; R370-F378 HydrophobicContact CB-CB 4.18Å; R370-F378 HydrophobicContact CB-CD1 3.9Å; R370-F378 HydrophobicContact CB-CD2 3.56Å; R370-F378 HydrophobicContact CB-CE1 4.16Å; R370-F378 HydrophobicContact CB-CE2 3.86Å; R370-F378 HydrophobicContact CB-CG 3.59Å; R370-F378 HydrophobicContact CB-CZ 4.16Å; R370-F378 HydrophobicContact CG-CB 4.03Å; R370-F378 HydrophobicContact CG-CD1 3.88Å; R370-F378 HydrophobicContact CG-CD2 4.3Å; R370-F378 HydrophobicContact CG-CE1 4.45Å; R370-F378 HydrophobicContact CG-CG 3.79Å
371	D	96.3	Very high	97.8	Very high	102 Å²	102	47.2 Å²	47.2	55%	0.545	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-90	3.4	-171.6	-53.9	-33	0	0	0	112	W368 W369	W368-D371 PolarHBondContact O-N 3.48Å; W369-D371 VanDerWaalsContact C-N 3.25Å; W369-D371 PolarHBondContact O-N 2.89Å
372	H	96.2	Very high	97.8	Very high	45 Å²	45	48.5 Å²	48.5	21%	0.208	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-119.5	35.2	-177.9	-67.9	79.3	0	0	0	113.2	W368 W369 R370	W368-H372 AromaticContact CD1-CE1 3.78Å; W368-H372 AromaticContact CD2-CE1 3.7Å; W368-H372 AromaticContact CD2-CG 3.9Å; W368-H372 AromaticContact CD2-ND1 3.46Å; W368-H372 AromaticContact CE2-CD2 3.76Å; W368-H372 AromaticContact CE2-CE1 3.25Å; W368-H372 AromaticContact CE2-CG 3.78Å; W368-H372 AromaticContact CE2-ND1 3.46Å; W368-H372 AromaticContact CE2-NE2 3.44Å; W368-H372 HydrophobicContact CE3-CB 4.03Å; W368-H372 AromaticContact CE3-CG 3.83Å; W368-H372 AromaticContact CE3-ND1 3.78Å; W368-H372 AromaticContact CG-ND1 3.94Å; W368-H372 HydrophobicContact CH2-CB 3.93Å; W368-H372 AromaticContact CH2-CD2 3.46Å; W368-H372 VanDerWaalsContact CH2-CD2 3.46Å; W368-H372 WeakPolarHBondContact CH2-CD2 3.11Å; W368-H372 AromaticContact CH2-CG 3.55Å; W368-H372 AromaticContact CH2-NE2 3.99Å; W368-H372 HydrophobicContact CZ2-CB 4.48Å; W368-H372 AromaticContact CZ2-CD2 3.28Å; W368-H372 WeakPolarHBondContact CZ2-CD2 3.39Å; W368-H372 AromaticContact CZ2-CE1 3.62Å; W368-H372 AromaticContact CZ2-CG 3.62Å; W368-H372 AromaticContact CZ2-ND1 3.81Å; W368-H372 AromaticContact CZ2-NE2 3.3Å; W368-H372 VanDerWaalsContact CZ2-NE2 3.3Å; W368-H372 WeakPolarHBondContact CZ2-NE2 3.2Å; W368-H372 HydrophobicContact CZ3-CB 3.67Å; W368-H372 AromaticContact CZ3-CG 3.65Å; W368-H372 AromaticContact NE1-CE1 3.29Å; W368-H372 PolarHBondContact NE1-CE1 2.94Å; W368-H372 VanDerWaalsContact NE1-CE1 3.29Å; W368-H372 AromaticContact NE1-ND1 3.87Å; W368-H372 AromaticContact NE1-NE2 3.68Å; W368-H372 PolarHBondContact O-ND1 2.84Å; W369-H372 HydrophobicContact CE3-CB 4.49Å; W369-H372 PolarHBondContact O-N 3.32Å; R370-H372 VanDerWaalsContact C-N 3.28Å; R370-H372 PolarHBondContact O-N 3.48Å
373	G	95.5	Very high	97.6	Very high	62 Å²	62	49.9 Å²	49.9	64%	0.639	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.6	12.4	168.3	0	0	0	0	0	115.9
374	Y	97.8	Very high	97.5	Very high	37 Å²	37	49.7 Å²	49.7	15%	0.145	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	19.7	179.5	-63.1	-83.3	0	0	0	113.9	P268 R271 H272 W369 D376 V377 F378	P268-Y374 HydrophobicContact CB-CD1 4.16Å; P268-Y374 HydrophobicContact CB-CG 4.15Å; P268-Y374 VanDerWaalsContact CG-CB 3.45Å; P268-Y374 HydrophobicContact CG-CD1 4.25Å; P268-Y374 HydrophobicContact CG-CD2 4.29Å; P268-Y374 HydrophobicContact CG-CG 3.75Å; R271-Y374 HydrophobicContact CG-CE1 4.46Å; H272-Y374 WeakPolarHBondContact CA-OH 3.48Å; H272-Y374 HydrophobicContact CB-CE2 3.96Å; H272-Y374 WeakPolarHBondContact CB-OH 3.35Å; H272-Y374 VanDerWaalsContact CG-OH 3.24Å; H272-Y374 AromaticContact ND1-CE2 3.94Å; H272-Y374 AromaticContact ND1-CZ 3.81Å; H272-Y374 PolarHBondContact ND1-OH 2.83Å; W369-Y374 AromaticContact CE3-CD2 3.64Å; W369-Y374 HydrophobicContact CE3-CD2 3.64Å; W369-Y374 AromaticContact CE3-CE2 3.55Å; W369-Y374 HydrophobicContact CE3-CE2 3.55Å; W369-Y374 HydrophobicContact CZ3-CD2 4.21Å; W369-Y374 AromaticContact CZ3-CE2 3.65Å; W369-Y374 HydrophobicContact CZ3-CE2 3.65Å; Y374-D376 PolarHBondContact O-N 2.99Å; Y374-D376 VanDerWaalsContact O-N 3.16Å; Y374-V377 HydrophobicContact CD1-CG2 4.03Å; Y374-V377 PolarHBondContact O-N 3.22Å; Y374-V377 VanDerWaalsContact O-N 3.16Å; Y374-F378 WeakPolarHBondContact O-CB 3.47Å; Y374-F378 PolarHBondContact O-N 2.9Å
375	G	97.6	Very high	97.1	Very high	47 Å²	47	57.8 Å²	57.8	49%	0.485	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-29.2	-177.5	0	0	0	0	0	114.1	R370	R370-G375 WeakPolarHBondContact O-CA 3.31Å; R370-G375 PolarHBondContact O-N 2.79Å; R370-G375 VanDerWaalsContact O-N 3.13Å
376	D	97.8	Very high	96.7	Very high	137 Å²	137	58.5 Å²	58.5	73%	0.733	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-35.2	178	61.7	-35.2	0	0	0	113.6	Y374	Y374-D376 PolarHBondContact O-N 2.99Å; Y374-D376 VanDerWaalsContact O-N 3.16Å
377	V	97.8	Very high	96.7	Very high	16 Å²	16	62.3 Å²	62.3	10%	0.097	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-11.1	-178.8	-62.6	0	0	0	0	113.5	Y374 Q379 L380 Y381	Y374-V377 HydrophobicContact CD1-CG2 4.03Å; Y374-V377 PolarHBondContact O-N 3.22Å; Y374-V377 VanDerWaalsContact O-N 3.16Å; V377-Q379 VanDerWaalsContact C-N 3.3Å; V377-Q379 PolarHBondContact O-N 3.49Å; V377-Q379 VanDerWaalsContact O-N 3.17Å; V377-L380 HydrophobicContact CB-CD1 4.36Å; V377-L380 VanDerWaalsContact O-CB 3.29Å; V377-L380 WeakPolarHBondContact O-CB 3.48Å; V377-L380 PolarHBondContact O-N 3.4Å; V377-Y381 HydrophobicContact CB-CE2 4.16Å; V377-Y381 HydrophobicContact CG2-CE2 4.04Å; V377-Y381 WeakPolarHBondContact O-CD2 3.3Å
378	F	98.5	Very high	96.7	Very high	6 Å²	6	62.4 Å²	62.4	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-51.9	-45.2	-169.6	-177.5	-99.6	0	0	0	113.4	Q267 P268 T367 R370 Y374 L380 Y381 Y382	Q267-F378 HydrophobicContact CG-CE2 4.16Å; P268-F378 HydrophobicContact CG-CD2 4.44Å; T367-F378 HydrophobicContact CG2-CE1 4.18Å; T367-F378 HydrophobicContact CG2-CZ 3.92Å; R370-F378 HydrophobicContact CB-CB 4.18Å; R370-F378 HydrophobicContact CB-CD1 3.9Å; R370-F378 HydrophobicContact CB-CD2 3.56Å; R370-F378 HydrophobicContact CB-CE1 4.16Å; R370-F378 HydrophobicContact CB-CE2 3.86Å; R370-F378 HydrophobicContact CB-CG 3.59Å; R370-F378 HydrophobicContact CB-CZ 4.16Å; R370-F378 HydrophobicContact CG-CB 4.03Å; R370-F378 HydrophobicContact CG-CD1 3.88Å; R370-F378 HydrophobicContact CG-CD2 4.3Å; R370-F378 HydrophobicContact CG-CE1 4.45Å; R370-F378 HydrophobicContact CG-CG 3.79Å; Y374-F378 WeakPolarHBondContact O-CB 3.47Å; Y374-F378 PolarHBondContact O-N 2.9Å; F378-L380 PolarHBondContact O-N 2.83Å; F378-Y381 PolarHBondContact O-N 3.44Å; F378-Y382 HydrophobicContact CD1-CG 4.27Å; F378-Y382 VanDerWaalsContact CE1-CB 3.44Å; F378-Y382 AromaticContact CE1-CD1 3.76Å; F378-Y382 HydrophobicContact CE1-CD1 3.76Å; F378-Y382 AromaticContact CE1-CD2 3.76Å; F378-Y382 HydrophobicContact CE1-CD2 3.76Å; F378-Y382 HydrophobicContact CE1-CE1 4.43Å; F378-Y382 HydrophobicContact CE1-CE2 4.42Å; F378-Y382 AromaticContact CE1-CG 3.37Å; F378-Y382 HydrophobicContact CE1-CG 3.37Å; F378-Y382 HydrophobicContact CE2-CD2 4.47Å; F378-Y382 HydrophobicContact CZ-CD1 4.34Å; F378-Y382 AromaticContact CZ-CD2 3.48Å; F378-Y382 HydrophobicContact CZ-CD2 3.48Å; F378-Y382 VanDerWaalsContact CZ-CD2 3.48Å; F378-Y382 HydrophobicContact CZ-CE2 4.09Å; F378-Y382 AromaticContact CZ-CG 3.61Å; F378-Y382 HydrophobicContact CZ-CG 3.61Å; F378-Y382 WeakPolarHBondContact O-CB 3.42Å; F378-Y382 PolarHBondContact O-N 2.85Å
379	Q	97.9	Very high	96.7	Very high	131 Å²	131	62.4 Å²	62.4	61%	0.612	36%	0.357	S	S	*	.	H	α-helix	trans	-64.7	-25.1	-176.5	-168.3	58.3	25.3	0	0	113.3	V377 Y381 G383	V377-Q379 VanDerWaalsContact C-N 3.3Å; V377-Q379 PolarHBondContact O-N 3.49Å; V377-Q379 VanDerWaalsContact O-N 3.17Å; Q379-Y381 PolarHBondContact O-N 3.44Å; Q379-G383 PolarHBondContact O-N 3.42Å; Q379-G383 VanDerWaalsContact O-N 3.14Å
380	L	98	Very high	96.8	Very high	102 Å²	102	61.1 Å²	61.1	53%	0.534	35%	0.352	S	S	.	.	H	α-helix	trans	-67.7	-26.9	175.9	-54.9	174.9	0	0	0	112.1	P289 V377 F378	P289-L380 HydrophobicContact CB-CB 3.66Å; P289-L380 WeakPolarHBondContact CB-O 3.42Å; P289-L380 HydrophobicContact CG-CB 3.77Å; P289-L380 HydrophobicContact CG-CD1 4.17Å; V377-L380 HydrophobicContact CB-CD1 4.36Å; V377-L380 VanDerWaalsContact O-CB 3.29Å; V377-L380 WeakPolarHBondContact O-CB 3.48Å; V377-L380 PolarHBondContact O-N 3.4Å; F378-L380 PolarHBondContact O-N 2.83Å
381	Y	98.6	Very high	96.9	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-91.6	-40.5	175.5	-63.4	-98.2	0	0	0	111.3	M266 P268 R271 G287 P289 P295 V377 F378 Q379 G383	M266-Y381 WeakPolarHBondContact CA-O 3.4Å; M266-Y381 CarbonylContact O-C 3.48Å; M266-Y381 VanDerWaalsContact O-C 3.24Å; M266-Y381 WeakPolarHBondContact O-CB 3.39Å; P268-Y381 HydrophobicContact CB-CD1 4.35Å; P268-Y381 HydrophobicContact CB-CD2 3.88Å; P268-Y381 HydrophobicContact CB-CE1 4.23Å; P268-Y381 HydrophobicContact CB-CE2 3.75Å; P268-Y381 HydrophobicContact CB-CG 4.19Å; P268-Y381 HydrophobicContact CG-CD2 4.42Å; R271-Y381 VanDerWaalsContact CD-OH 3.27Å; R271-Y381 WeakPolarHBondContact CD-OH 3.43Å; R271-Y381 WeakPolarHBondContact CG-OH 3.48Å; R271-Y381 PolarHBondContact NH1-OH 3.16Å; G287-Y381 WeakPolarHBondContact O-CE1 3.44Å; G287-Y381 PolarHBondContact O-OH 3.38Å; P289-Y381 HydrophobicContact CB-CD1 4.09Å; P289-Y381 HydrophobicContact CB-CD2 3.97Å; P289-Y381 HydrophobicContact CB-CE1 3.96Å; P289-Y381 HydrophobicContact CB-CE2 3.82Å; P289-Y381 HydrophobicContact CB-CG 4.08Å; P289-Y381 WeakPolarHBondContact CD-OH 3.48Å; P289-Y381 HydrophobicContact CG-CE2 4.14Å; P295-Y381 HydrophobicContact CB-CD1 3.85Å; P295-Y381 HydrophobicContact CB-CE1 3.98Å; V377-Y381 HydrophobicContact CB-CE2 4.16Å; V377-Y381 HydrophobicContact CG2-CE2 4.04Å; V377-Y381 WeakPolarHBondContact O-CD2 3.3Å; F378-Y381 PolarHBondContact O-N 3.44Å; Q379-Y381 PolarHBondContact O-N 3.44Å; Y381-G383 PolarHBondContact O-N 3.41Å
382	Y	98.3	Very high	97	Very high	37 Å²	37	54.1 Å²	54.1	15%	0.145	32%	0.318	C	S	.	.	H	α-helix	trans	-81	-13.1	-169.5	-167	-108.1	0	0	0	114.1	M266 R363 Q364 L365 T367 F378	M266-Y382 HydrophobicContact CB-CD2 4.45Å; M266-Y382 VanDerWaalsContact O-CA 3.31Å; M266-Y382 WeakPolarHBondContact O-CA 3.31Å; M266-Y382 PolarHBondContact O-N 3.41Å; R363-Y382 VanDerWaalsContact CZ-O 3.23Å; R363-Y382 PolarHBondContact NH1-O 2.67Å; R363-Y382 PolarHBondContact NH2-O 2.91Å; Q364-Y382 WeakPolarHBondContact O-CE2 3.33Å; L365-Y382 PolarHBondContact O-OH 3.49Å; T367-Y382 HydrophobicContact CG2-CE2 4.21Å; F378-Y382 HydrophobicContact CD1-CG 4.27Å; F378-Y382 VanDerWaalsContact CE1-CB 3.44Å; F378-Y382 AromaticContact CE1-CD1 3.76Å; F378-Y382 HydrophobicContact CE1-CD1 3.76Å; F378-Y382 AromaticContact CE1-CD2 3.76Å; F378-Y382 HydrophobicContact CE1-CD2 3.76Å; F378-Y382 HydrophobicContact CE1-CE1 4.43Å; F378-Y382 HydrophobicContact CE1-CE2 4.42Å; F378-Y382 AromaticContact CE1-CG 3.37Å; F378-Y382 HydrophobicContact CE1-CG 3.37Å; F378-Y382 HydrophobicContact CE2-CD2 4.47Å; F378-Y382 HydrophobicContact CZ-CD1 4.34Å; F378-Y382 AromaticContact CZ-CD2 3.48Å; F378-Y382 HydrophobicContact CZ-CD2 3.48Å; F378-Y382 VanDerWaalsContact CZ-CD2 3.48Å; F378-Y382 HydrophobicContact CZ-CE2 4.09Å; F378-Y382 AromaticContact CZ-CG 3.61Å; F378-Y382 HydrophobicContact CZ-CG 3.61Å; F378-Y382 WeakPolarHBondContact O-CB 3.42Å; F378-Y382 PolarHBondContact O-N 2.85Å
383	G	96.3	Very high	97.1	Very high	30 Å²	30	52 Å²	52	31%	0.309	31%	0.309	S	S	.	.			trans	-60.4	136.1	176.1	0	0	0	0	0	112.7	Q379 Y381	Q379-G383 PolarHBondContact O-N 3.42Å; Q379-G383 VanDerWaalsContact O-N 3.14Å; Y381-G383 PolarHBondContact O-N 3.41Å
384	C	96.6	Very high	97.1	Very high	24 Å²	24	49.9 Å²	49.9	16%	0.162	28%	0.283	C	S	.	.			trans	-147.4	101.3	171.6	177.9	0	0	0	0	108.6	C359	C359-C384 VanDerWaalsContact C-SG 3.56Å; C359-C384 HydrophobicContact CB-CB 3.77Å; C359-C384 WeakPolarHBondContact CB-SG 3.28Å; C359-C384 WeakPolarHBondContact SG-CA 3.48Å; C359-C384 WeakPolarHBondContact SG-CB 3.33Å; C359-C384 CovalentContact SG-SG 2.04Å; C359-C384 PolarHBondContact SG-SG 3.35Å
385	D	89.7	Confident	96.9	Very high	171 Å²	171	51.5 Å²	51.5	91%	0.914	30%	0.299	S	S	*	.			trans	-87.9	-6.8	-170.7	-58.2	-34.6	0	0	0	113.3
386	G	90.8	Very high	96.8	Very high	36 Å²	36	53.8 Å²	53.8	37%	0.371	30%	0.3	S	S	.	.	S	Bend	trans	-86.4	167	179.4	0	0	0	0	0	114
387	P	96.5	Very high	96.7	Very high	82 Å²	82	48.3 Å²	48.3	53%	0.532	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-58.9	143.4	172.5	27.8	-36.3	0	0	0	110.9	G360 Y389	G360-P387 VanDerWaalsContact CA-O 3.3Å; G360-P387 WeakPolarHBondContact CA-O 3.32Å; P387-Y389 HydrophobicContact CB-CE1 4.31Å; P387-Y389 HydrophobicContact CG-CE1 3.99Å; P387-Y389 HydrophobicContact CG-CE2 4.12Å; P387-Y389 VanDerWaalsContact CG-OH 3.25Å; P387-Y389 WeakPolarHBondContact CG-OH 3.32Å
388	V	98.1	Very high	96.7	Very high	39 Å²	39	53.1 Å²	53.1	24%	0.236	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-88.3	119.8	176.4	-179.1	0	0	0	0	109.7	K241 R363 Y391	K241-V388 WeakPolarHBondContact CB-O 3.24Å; R363-V388 HydrophobicContact CB-CG1 3.71Å; R363-V388 HydrophobicContact CB-CG2 4.19Å; R363-V388 HydrophobicContact CG-CG1 4.2Å; R363-V388 HydrophobicContact CG-CG2 3.96Å; V388-Y391 HydrophobicContact CB-CE1 4.37Å; V388-Y391 HydrophobicContact CB-CE2 4.48Å; V388-Y391 HydrophobicContact CG1-CD1 3.82Å; V388-Y391 HydrophobicContact CG1-CD2 3.96Å; V388-Y391 HydrophobicContact CG1-CE1 3.74Å; V388-Y391 HydrophobicContact CG1-CE2 3.88Å; V388-Y391 HydrophobicContact CG1-CG 3.92Å; V388-Y391 HydrophobicContact CG2-CE1 4.14Å
389	Y	98.4	Very high	96.6	Very high	72 Å²	72	54.7 Å²	54.7	28%	0.282	31%	0.312	S	S	.	.	S	Bend	trans	-98.2	-36.6	177.1	-55.3	-63.5	0	0	0	111.9	K241 T242 G360 W361 P387	K241-Y389 WeakPolarHBondContact CA-O 3.5Å; K241-Y389 WeakPolarHBondContact CB-O 3.4Å; K241-Y389 PolarHBondContact N-O 3.1Å; T242-Y389 HydrophobicContact CG2-CD1 3.87Å; T242-Y389 HydrophobicContact CG2-CG 4.19Å; T242-Y389 PolarHBondContact N-O 2.94Å; G360-Y389 WeakPolarHBondContact O-CA 3.49Å; G360-Y389 WeakPolarHBondContact O-CB 3.21Å; G360-Y389 PolarHBondContact O-N 3.05Å; W361-Y389 AromaticContact CD2-CD2 3.67Å; W361-Y389 HydrophobicContact CD2-CD2 3.67Å; W361-Y389 HydrophobicContact CD2-CE2 4.47Å; W361-Y389 HydrophobicContact CD2-CG 4.01Å; W361-Y389 AromaticContact CE2-CD2 3.78Å; W361-Y389 VanDerWaalsContact CE3-CB 3.45Å; W361-Y389 HydrophobicContact CE3-CD2 4.13Å; W361-Y389 HydrophobicContact CE3-CG 4Å; W361-Y389 AromaticContact CG-CD2 3.88Å; W361-Y389 HydrophobicContact CG-CD2 3.88Å; W361-Y389 HydrophobicContact CH2-CG 4.32Å; W361-Y389 HydrophobicContact CZ2-CD2 4.33Å; W361-Y389 HydrophobicContact CZ2-CG 4.35Å; W361-Y389 HydrophobicContact CZ3-CG 4.16Å; P387-Y389 HydrophobicContact CB-CE1 4.31Å; P387-Y389 HydrophobicContact CG-CE1 3.99Å; P387-Y389 HydrophobicContact CG-CE2 4.12Å; P387-Y389 VanDerWaalsContact CG-OH 3.25Å; P387-Y389 WeakPolarHBondContact CG-OH 3.32Å
390	I	98.8	Very high	96.4	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	122.9	177.6	-55.6	179.2	0	0	0	108.1	L238 K239 Y240 L247 V301 G360 W361 R363	L238-I390 HydrophobicContact CB-CG2 3.92Å; L238-I390 HydrophobicContact CD1-CG2 4.15Å; L238-I390 HydrophobicContact CD2-CG2 4.07Å; L238-I390 HydrophobicContact CG-CG2 4.26Å; K239-I390 WeakPolarHBondContact O-CA 3.29Å; Y240-I390 HydrophobicContact CD1-CD1 3.98Å; Y240-I390 HydrophobicContact CD1-CG1 4.08Å; Y240-I390 HydrophobicContact CE1-CD1 3.93Å; Y240-I390 HydrophobicContact CE1-CG1 4.48Å; L247-I390 HydrophobicContact CD2-CD1 4.17Å; V301-I390 HydrophobicContact CG2-CD1 4.4Å; G360-I390 PolarHBondContact O-N 2.88Å; W361-I390 HydrophobicContact CE3-CD1 4.08Å; W361-I390 HydrophobicContact CE3-CG1 4.21Å; W361-I390 HydrophobicContact CZ3-CD1 4.44Å; W361-I390 WeakPolarHBondContact O-CB 3.27Å; R363-I390 WeakPolarHBondContact CB-O 3.32Å; R363-I390 PolarHBondContact N-O 3.3Å
391	Y	98.8	Very high	95.8	Very high	54 Å²	54	53.8 Å²	53.8	21%	0.212	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	143.7	165.4	-77.8	-67.1	0	0	0	110.2	L238 K239 K241 R363 L365 V388 I399	L238-Y391 CarbonylContact C-O 3.5Å; L238-Y391 VanDerWaalsContact CA-O 3.24Å; L238-Y391 WeakPolarHBondContact CA-O 3.31Å; K239-Y391 PolarHBondContact N-O 3.49Å; K239-Y391 PolarHBondContact O-N 2.8Å; K241-Y391 HydrophobicContact CD-CD2 4.24Å; K241-Y391 HydrophobicContact CD-CE2 4.25Å; K241-Y391 HydrophobicContact CG-CD2 3.94Å; K241-Y391 HydrophobicContact CG-CE2 4.12Å; R363-Y391 HydrophobicContact CB-CD1 4.11Å; R363-Y391 HydrophobicContact CG-CD1 3.87Å; R363-Y391 HydrophobicContact CG-CE1 3.92Å; L365-Y391 HydrophobicContact CD1-CD1 4.13Å; L365-Y391 HydrophobicContact CD2-CD1 3.82Å; L365-Y391 HydrophobicContact CD2-CE1 4.13Å; L365-Y391 HydrophobicContact CG-CD1 4.2Å; V388-Y391 HydrophobicContact CB-CE1 4.37Å; V388-Y391 HydrophobicContact CB-CE2 4.48Å; V388-Y391 HydrophobicContact CG1-CD1 3.82Å; V388-Y391 HydrophobicContact CG1-CD2 3.96Å; V388-Y391 HydrophobicContact CG1-CE1 3.74Å; V388-Y391 HydrophobicContact CG1-CE2 3.88Å; V388-Y391 HydrophobicContact CG1-CG 3.92Å; V388-Y391 HydrophobicContact CG2-CE1 4.14Å; Y391-I399 HydrophobicContact CD2-CG2 4.28Å; Y391-I399 HydrophobicContact CG-CG2 4.14Å
392	H	98.8	Very high	94.4	Very high	3 Å²	3	61.1 Å²	61.1	1%	0.014	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	108.7	176.4	-180	-173.6	0	0	0	109.9	D235 D237 L238 N298 N362 R363 L365 N394	D235-H392 IonicContact OD2-CE1 3.25Å; D235-H392 PolarHBondContact OD2-CE1 3.28Å; D235-H392 IonicContact OD2-NE2 2.68Å; D235-H392 PolarHBondContact OD2-NE2 3.34Å; D237-H392 IonicContact OD1-CD2 2.71Å; D237-H392 PolarHBondContact OD1-CD2 2.89Å; D237-H392 IonicContact OD1-NE2 3.34Å; D237-H392 PolarHBondContact OD1-NE2 3.46Å; L238-H392 HydrophobicContact CD2-CB 3.58Å; N298-H392 PolarHBondContact OD1-CE1 3.34Å; N298-H392 VanDerWaalsContact OD1-CE1 3.27Å; N298-H392 PolarHBondContact OD1-ND1 3.29Å; N362-H392 WeakPolarHBondContact OD1-CB 3.47Å; N362-H392 PolarHBondContact OD1-ND1 3.13Å; R363-H392 PolarHBondContact O-N 3.04Å; L365-H392 WeakPolarHBondContact CB-O 3.37Å; L365-H392 PolarHBondContact N-O 3.07Å; H392-N394 PolarHBondContact CD2-N 3.25Å; H392-N394 WeakPolarHBondContact NE2-CB 3.48Å; H392-N394 PolarHBondContact O-N 3.45Å; H392-N394 PolarHBondContact O-OD1 3.43Å
393	G	98.3	Very high	94.2	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.01	37%	0.365	C	S	.	.			trans	-77.2	38.8	179.5	0	0	0	0	0	113.9	D237 N396 S397	D237-G393 PolarHBondContact O-N 3.42Å; G393-N396 PolarHBondContact O-N 2.98Å; G393-S397 WeakPolarHBondContact CA-O 3.4Å; G393-S397 PolarHBondContact O-N 3.13Å
394	N	97	Very high	94.1	Very high	17 Å²	17	64 Å²	64	9%	0.091	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-57.6	154.9	-177.9	63.2	-38.2	0	0	0	111.9	L365 C366 H392 N396 S397	L365-N394 PolarHBondContact N-OD1 3.41Å; L365-N394 VanDerWaalsContact N-OD1 3.07Å; C366-N394 HydrophobicContact CB-CB 4.46Å; C366-N394 VanDerWaalsContact CB-CG 3.42Å; C366-N394 VanDerWaalsContact CB-ND2 3.25Å; C366-N394 WeakPolarHBondContact CB-ND2 3.25Å; C366-N394 VanDerWaalsContact CB-OD1 3.32Å; C366-N394 WeakPolarHBondContact CB-OD1 3.35Å; C366-N394 PolarHBondContact N-OD1 3.18Å; H392-N394 PolarHBondContact CD2-N 3.25Å; H392-N394 WeakPolarHBondContact NE2-CB 3.48Å; H392-N394 PolarHBondContact O-N 3.45Å; H392-N394 PolarHBondContact O-OD1 3.43Å; N394-N396 PolarHBondContact O-N 3.31Å; N394-S397 VanDerWaalsContact O-CB 3.3Å; N394-S397 WeakPolarHBondContact O-CB 3.45Å; N394-S397 PolarHBondContact O-N 3.46Å; N394-S397 VanDerWaalsContact O-N 3.12Å; N394-S397 PolarHBondContact O-OG 3.23Å
395	C	93.5	Very high	94	Very high	72 Å²	72	66.2 Å²	66.2	49%	0.486	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	53.6	32.6	-173.3	84.3	0	0	0	0	114.2	C366 S397	C366-C395 WeakPolarHBondContact CA-SG 3.38Å; C366-C395 HydrophobicContact CB-CB 3.94Å; C366-C395 WeakPolarHBondContact CB-SG 3.28Å; C366-C395 WeakPolarHBondContact SG-CB 3.47Å; C366-C395 CovalentContact SG-SG 2.02Å; C366-C395 PolarHBondContact SG-SG 3Å; C395-S397 PolarHBondContact O-N 3.38Å; C395-S397 PolarHBondContact SG-OG 3.3Å; C395-S397 VanDerWaalsContact SG-OG 3.42Å
396	N	94.8	Very high	94.3	Very high	95 Å²	95	60.1 Å²	60.1	51%	0.508	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	62	28	-177.7	-58.3	-45.9	0	0	0	113.8	K127 G393 N394	K127-N396 PolarHBondContact NZ-OD1 3.49Å; G393-N396 PolarHBondContact O-N 2.98Å; N394-N396 PolarHBondContact O-N 3.31Å
397	S	96.6	Very high	94.5	Very high	21 Å²	21	61.6 Å²	61.6	15%	0.147	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-69.4	130.1	176.2	-58.4	0	0	0	0	110.3	C366 G393 N394 C395 I399	C366-S397 VanDerWaalsContact CA-OG 3.31Å; C366-S397 WeakPolarHBondContact CA-OG 3.4Å; C366-S397 PolarHBondContact N-OG 3.27Å; G393-S397 WeakPolarHBondContact CA-O 3.4Å; G393-S397 PolarHBondContact O-N 3.13Å; N394-S397 VanDerWaalsContact O-CB 3.3Å; N394-S397 WeakPolarHBondContact O-CB 3.45Å; N394-S397 PolarHBondContact O-N 3.46Å; N394-S397 VanDerWaalsContact O-N 3.12Å; N394-S397 PolarHBondContact O-OG 3.23Å; C395-S397 PolarHBondContact O-N 3.38Å; C395-S397 PolarHBondContact SG-OG 3.3Å; C395-S397 VanDerWaalsContact SG-OG 3.42Å; S397-I399 PolarHBondContact O-N 3.39Å
398	P	96.2	Very high	94.3	Very high	118 Å²	118	60.2 Å²	60.2	77%	0.766	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-57.8	131.8	172.3	-23.6	33.7	0	0	0	110.7
399	I	97.4	Very high	94.1	Very high	39 Å²	39	61.7 Å²	61.7	20%	0.2	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-85.1	130.5	173.4	-56.8	177.5	0	0	0	107.8	D237 K239 L365 Y391 S397	D237-I399 WeakPolarHBondContact O-CD1 3.36Å; K239-I399 HydrophobicContact CB-CD1 3.94Å; K239-I399 HydrophobicContact CB-CG2 3.8Å; K239-I399 HydrophobicContact CD-CG2 3.59Å; K239-I399 HydrophobicContact CG-CG2 4.33Å; L365-I399 HydrophobicContact CD1-CB 4.22Å; L365-I399 HydrophobicContact CD1-CG1 4.01Å; L365-I399 HydrophobicContact CD1-CG2 4.26Å; Y391-I399 HydrophobicContact CD2-CG2 4.28Å; Y391-I399 HydrophobicContact CG-CG2 4.14Å; S397-I399 PolarHBondContact O-N 3.39Å
400	P	93.5	Very high	93.7	Very high	61 Å²	61	60.9 Å²	60.9	40%	0.396	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-55.3	140	176.9	-25.6	33.7	0	0	0	112.7	K239	K239-P400 PolarHBondContact NZ-O 3.45Å
401	D	85.3	Confident	93.3	Very high	152 Å²	152	65.9 Å²	65.9	81%	0.813	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-63.9	156.3	159.9	-68.1	-38.5	0	0	0	109.6
402	D	69.9	Low	92.8	Very high	158 Å²	158	67 Å²	67	85%	0.845	39%	0.389	S	S	*	.			trans	-61.2	0	-171.5	-74.7	-11.5	0	0	0	114.3	K239 K241	K239-D402 WeakPolarHBondContact CE-OD1 3.3Å; K239-D402 IonicContact NZ-OD1 3.98Å; K239-D402 PolarHBondContact NZ-OD1 3.41Å; K241-D402 IonicContact NZ-OD1 2.63Å; K241-D402 PolarHBondContact NZ-OD1 3.09Å; K241-D402 IonicContact NZ-OD2 3.76Å

Retrieved 402 of 402 residues in 267.3 ms (Link to these results)

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