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Beclin-1

Plays a central role in autophagy^{1,2,3,4,5,6,7}. Acts as a core subunit of the PI3K complex that mediates formation of phosphatidylinositol 3-phosphate; different complex forms are believed to play a role in multiple membrane trafficking pathways: PI3KC3-C1 is involved in initiation of autophagosomes and PI3KC3-C2 in maturation of autophagosomes and endocytosis. Involved in regulation of degradative endocytic trafficking and required for the abscission step in cytokinesis, probably in the context of PI3KC3-C2^8,9,10,11. Essential for the formation of PI3KC3-C2 but not PI3KC3-C1 PI3K complex forms. Involved in endocytosis¹². May play a role in antiviral host defense. Beclin-1-C 35 kDa localized to mitochondria can promote apoptosis; it induces the mitochondrial translocation of BAX and the release of proapoptotic factors. (Microbial infection) Protects against infection by a neurovirulent strain of Sindbis virus.

AlphaFold DB , UniProt , Accession Q14457, Species HUMAN (Homo sapiens, Human), Gene BECN1, Length 450 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	35.2	Very low	245 Å²	245	148.9 Å²	148.9	100%	1.207	86%	0.856	S	S	*	*				0	126.8	0	-71.8	-177.8	172.8	0	0	106.2
2	E	33.7	Very low	35.4	Very low	207 Å²	207	150.2 Å²	150.2	97%	0.967	85%	0.852	S	S	*	*			trans	22.3	116.2	179.9	-76.8	175.6	152.5	0	0	118.7
3	G	36.3	Very low	36.2	Very low	66 Å²	66	152 Å²	152	68%	0.68	85%	0.849	S	S	*	*			trans	169.3	51.3	167.9	0	0	0	0	0	113.8	K5	G3-K5 PolarHBondContact O-N 3.03Å; G3-K5 VanDerWaalsContact O-N 3.07Å
4	S	38.4	Very low	37.5	Very low	127 Å²	127	148.4 Å²	148.4	89%	0.888	83%	0.832	S	S	*	*			trans	-62.5	103.3	168	-48.5	0	0	0	0	109
5	K	34.6	Very low	39.4	Very low	198 Å²	198	143.2 Å²	143.2	86%	0.861	81%	0.81	S	S	*	*			trans	-97.3	107.2	171.3	-75.8	-176.9	176	-179.5	0	109	G3 S7	G3-K5 PolarHBondContact O-N 3.03Å; G3-K5 VanDerWaalsContact O-N 3.07Å; K5-S7 PolarHBondContact O-N 2.64Å
6	T	34.5	Very low	41.6	Very low	133 Å²	133	136.9 Å²	136.9	82%	0.816	77%	0.771	S	S	*	*			trans	-68.2	112.7	166.5	45.8	0	0	0	0	109.7
7	S	35.5	Very low	43.9	Very low	114 Å²	114	132.2 Å²	132.2	80%	0.797	75%	0.746	S	S	*	*			trans	-98.9	107.9	164.9	-82.9	0	0	0	0	109.1	K5 N9	K5-S7 PolarHBondContact O-N 2.64Å; S7-N9 PolarHBondContact O-N 3.09Å
8	N	32.1	Very low	46.1	Very low	153 Å²	153	124.9 Å²	124.9	82%	0.818	71%	0.705	S	S	*	*			trans	-62	103.2	168.5	-80.3	-16.4	0	0	0	110.1	S10	N8-S10 PolarHBondContact O-N 3.47Å
9	N	34.8	Very low	48.1	Very low	159 Å²	159	123.7 Å²	123.7	85%	0.85	69%	0.693	S	S	*	*			trans	-87	90.5	158.5	-101.3	3.1	0	0	0	108	S7 T11	S7-N9 PolarHBondContact O-N 3.09Å; N9-T11 PolarHBondContact O-N 3.05Å
10	S	33.5	Very low	49.7	Very low	100 Å²	100	123.1 Å²	123.1	70%	0.699	68%	0.679	S	S	*	*			trans	-70.9	102.9	172.7	166.9	0	0	0	0	109.9	N8 M12	N8-S10 PolarHBondContact O-N 3.47Å; S10-M12 PolarHBondContact O-N 3.08Å
11	T	36.7	Very low	51.5	Low	136 Å²	136	119.5 Å²	119.5	83%	0.834	66%	0.662	S	S	*	*			trans	-73.2	106	168.6	-33.4	0	0	0	0	108.5	N9 Q13	N9-T11 PolarHBondContact O-N 3.05Å; T11-Q13 PolarHBondContact O-N 3.3Å
12	M	37.9	Very low	53.6	Low	164 Å²	164	112.1 Å²	112.1	81%	0.808	63%	0.634	S	S	*	*			trans	-71.4	109.5	175.1	-65.2	-170.9	88.6	0	0	109.7	S10	S10-M12 PolarHBondContact O-N 3.08Å
13	Q	45.7	Very low	55.9	Low	174 Å²	174	107.9 Å²	107.9	81%	0.813	62%	0.615	S	S	*	*			trans	-77.6	119.6	165.7	-109.9	177	-10.7	0	0	108.4	T11	T11-Q13 PolarHBondContact O-N 3.3Å
14	V	54.1	Low	57.9	Low	101 Å²	101	109.3 Å²	109.3	61%	0.612	61%	0.612	S	S	*	*			trans	-83.8	122	174	-175.1	0	0	0	0	108.2	L116	V14-L116 HydrophobicContact CB-CD1 4.06Å; V14-L116 HydrophobicContact CG1-CD1 4.4Å; V14-L116 HydrophobicContact CG1-CD2 4.46Å; V14-L116 HydrophobicContact CG2-CD1 4.29Å
15	S	66.4	Low	59.6	Low	71 Å²	71	105 Å²	105	50%	0.497	58%	0.579	S	S	.	*			trans	-113	138.4	172.6	71.6	0	0	0	0	110.9
16	F	74.1	Confident	61.4	Low	42 Å²	42	105.5 Å²	105.5	18%	0.184	58%	0.581	C	S	.	*			trans	-69.8	152.4	167.2	-66.4	-87.7	0	0	0	110	P24 L25 L27 L116 T119 F123	F16-P24 CarbonylContact O-C 3.55Å; F16-P24 WeakPolarHBondContact O-CA 3.33Å; F16-L25 PolarHBondContact O-N 3.27Å; F16-L27 HydrophobicContact CD2-CD1 3.26Å; F16-L27 HydrophobicContact CD2-CD2 4.49Å; F16-L27 HydrophobicContact CD2-CG 3.92Å; F16-L27 HydrophobicContact CE2-CD1 3.44Å; F16-L27 VanDerWaalsContact CE2-CD1 3.44Å; F16-L27 HydrophobicContact CG-CD1 4.12Å; F16-L27 HydrophobicContact CZ-CD1 4.44Å; F16-L116 HydrophobicContact CE2-CD2 3.54Å; F16-L116 HydrophobicContact CZ-CD2 3.81Å; F16-T119 WeakPolarHBondContact CZ-OG1 3.47Å; F16-F123 AromaticContact CD1-CD2 3.99Å; F16-F123 HydrophobicContact CD1-CD2 3.99Å; F16-F123 AromaticContact CD1-CE2 3.83Å; F16-F123 HydrophobicContact CD1-CE2 3.83Å; F16-F123 HydrophobicContact CE1-CD2 4.13Å; F16-F123 HydrophobicContact CE1-CE2 4.11Å; F16-F123 HydrophobicContact CG-CE2 4.19Å
17	V	82.2	Confident	62.9	Low	58 Å²	58	101.6 Å²	101.6	35%	0.352	56%	0.555	S	S	.	*	B	Isolated β-bridge	trans	-124.3	149.2	178.2	-67.5	0	0	0	0	109.9	Q19 Q23	V17-Q19 PolarHBondContact O-N 3.48Å; V17-Q23 CarbonylContact C-O 3.55Å; V17-Q23 VanDerWaalsContact CA-O 3.26Å; V17-Q23 WeakPolarHBondContact CA-O 3.41Å
18	C	83.2	Confident	64.5	Low	0 Å²	0	100.5 Å²	100.5	0%	0	54%	0.54	C	S	.	.			trans	-64	128.2	170.4	171.5	0	0	0	0	109.2	R20 C21 S22 Q23 L25 P135 C137	C18-R20 PolarHBondContact O-N 3.25Å; C18-R20 PolarHBondContact SG-N 2.81Å; C18-C21 WeakPolarHBondContact CB-SG 3.23Å; C18-C21 PolarHBondContact SG-N 3.37Å; C18-C21 VanDerWaalsContact SG-N 3.45Å; C18-C21 PolarHBondContact SG-SG 2.91Å; C18-S22 WeakPolarHBondContact O-CA 3.37Å; C18-S22 PolarHBondContact O-N 3.39Å; C18-Q23 PolarHBondContact N-O 3.14Å; C18-L25 HydrophobicContact CB-CD1 4.22Å; C18-L25 HydrophobicContact CB-CD2 4.15Å; C18-L25 HydrophobicContact CB-CG 4.16Å; C18-P135 CarbonylContact C-O 3.53Å; C18-P135 VanDerWaalsContact CA-O 3.3Å; C18-P135 WeakPolarHBondContact CA-O 3.29Å; C18-C137 HydrophobicContact CB-CB 4.18Å; C18-C137 PolarHBondContact SG-N 3.22Å
19	Q	83.4	Confident	65.9	Low	102 Å²	102	97.4 Å²	97.4	48%	0.477	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.4	-178.1	-63.4	-64.7	-2.7	0	0	113.1	V17 D133 H134 P135	V17-Q19 PolarHBondContact O-N 3.48Å; Q19-D133 HydrophobicContact CB-CB 3.8Å; Q19-D133 WeakPolarHBondContact CB-O 3.4Å; Q19-D133 HydrophobicContact CG-CB 3.95Å; Q19-H134 WeakPolarHBondContact CG-O 3.36Å; Q19-P135 PolarHBondContact N-O 3.04Å
20	R	79.9	Confident	67.3	Low	112 Å²	112	92.9 Å²	92.9	42%	0.423	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-49.5	177.9	-172.4	173.4	-173.4	174.3	7.1	113.4	C18 L136 C140	C18-R20 PolarHBondContact O-N 3.25Å; C18-R20 PolarHBondContact SG-N 2.81Å; R20-L136 HydrophobicContact CB-CD2 3.62Å; R20-C140 HydrophobicContact CB-CB 4.13Å; R20-C140 HydrophobicContact CG-CB 4.41Å; R20-C140 PolarHBondContact NH1-O 3.49Å; R20-C140 VanDerWaalsContact NH1-O 3.14Å
21	C	88	Confident	68.7	Low	48 Å²	48	90.5 Å²	90.5	32%	0.324	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-2.7	-175.7	71.7	0	0	0	0	114.5	C18 Q23	C18-C21 WeakPolarHBondContact CB-SG 3.23Å; C18-C21 PolarHBondContact SG-N 3.37Å; C18-C21 VanDerWaalsContact SG-N 3.45Å; C18-C21 PolarHBondContact SG-SG 2.91Å; C21-Q23 HydrophobicContact CB-CG 4.39Å; C21-Q23 PolarHBondContact O-N 2.94Å
22	S	81.1	Confident	69.9	Low	89 Å²	89	90.3 Å²	90.3	62%	0.622	47%	0.472	S	S	*	.			trans	56.2	14.2	-177.7	-57.7	0	0	0	0	115	C18	C18-S22 WeakPolarHBondContact O-CA 3.37Å; C18-S22 PolarHBondContact O-N 3.39Å
23	Q	81	Confident	71	Confident	118 Å²	118	89.3 Å²	89.3	55%	0.551	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-78.8	143.6	177	-67.1	-169.5	-0.2	0	0	111.1	V17 C18 C21 L25	V17-Q23 CarbonylContact C-O 3.55Å; V17-Q23 VanDerWaalsContact CA-O 3.26Å; V17-Q23 WeakPolarHBondContact CA-O 3.41Å; C18-Q23 PolarHBondContact N-O 3.14Å; C21-Q23 HydrophobicContact CB-CG 4.39Å; C21-Q23 PolarHBondContact O-N 2.94Å; Q23-L25 PolarHBondContact O-N 2.68Å
24	P	79.8	Confident	71.6	Confident	96 Å²	96	83.2 Å²	83.2	62%	0.623	44%	0.441	S	S	*	.	B	Isolated β-bridge	trans	-63.5	126.1	179.1	25.8	-33.1	0	0	0	110.9	F16	F16-P24 CarbonylContact O-C 3.55Å; F16-P24 WeakPolarHBondContact O-CA 3.33Å
25	L	73.4	Confident	71.9	Confident	36 Å²	36	83.5 Å²	83.5	19%	0.188	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-90.1	133	179.6	-71.5	169.3	0	0	0	110.7	F16 C18 Q23 L27 P135 C137	F16-L25 PolarHBondContact O-N 3.27Å; C18-L25 HydrophobicContact CB-CD1 4.22Å; C18-L25 HydrophobicContact CB-CD2 4.15Å; C18-L25 HydrophobicContact CB-CG 4.16Å; Q23-L25 PolarHBondContact O-N 2.68Å; L25-L27 PolarHBondContact O-N 2.95Å; L25-P135 HydrophobicContact CD1-CB 3.68Å; L25-P135 HydrophobicContact CD1-CG 3.38Å; L25-C137 HydrophobicContact CD2-CB 3.72Å
26	K	72.1	Confident	71.7	Confident	210 Å²	210	90.5 Å²	90.5	91%	0.913	46%	0.455	S	S	*	.			trans	-88.4	95.7	168.3	-157	178.6	-174.4	-177.1	0	107.9	D28	K26-D28 PolarHBondContact O-N 3.3Å
27	L	66.6	Low	71.2	Confident	50 Å²	50	92.7 Å²	92.7	26%	0.262	47%	0.472	S	S	.	.			trans	-59.2	134.8	175.6	-65.5	-175.9	0	0	0	110.1	F16 L25 F31 T119 F123	F16-L27 HydrophobicContact CD2-CD1 3.26Å; F16-L27 HydrophobicContact CD2-CD2 4.49Å; F16-L27 HydrophobicContact CD2-CG 3.92Å; F16-L27 HydrophobicContact CE2-CD1 3.44Å; F16-L27 VanDerWaalsContact CE2-CD1 3.44Å; F16-L27 HydrophobicContact CG-CD1 4.12Å; F16-L27 HydrophobicContact CZ-CD1 4.44Å; L25-L27 PolarHBondContact O-N 2.95Å; L27-F31 HydrophobicContact CB-CB 4.49Å; L27-F31 HydrophobicContact CB-CD2 4.03Å; L27-F31 HydrophobicContact CB-CG 4.46Å; L27-F31 HydrophobicContact CD2-CD2 4.31Å; L27-F31 HydrophobicContact CD2-CE2 4.24Å; L27-T119 HydrophobicContact CD1-CG2 4.34Å; L27-F123 HydrophobicContact CD2-CE2 4.08Å; L27-F123 HydrophobicContact CD2-CZ 3.69Å
28	D	68.2	Low	70.4	Confident	92 Å²	92	92.8 Å²	92.8	49%	0.492	47%	0.473	S	S	.	.			trans	-60.4	152.1	175.7	-176.5	-100.9	0	0	0	111.3	K26 S30 F31	K26-D28 PolarHBondContact O-N 3.3Å; D28-S30 PolarHBondContact O-N 3.11Å; D28-S30 VanDerWaalsContact O-N 3.14Å; D28-S30 WeakPolarHBondContact OD1-CB 3.19Å; D28-S30 PolarHBondContact OD1-N 3.37Å; D28-S30 PolarHBondContact OD1-OG 3.1Å; D28-F31 HydrophobicContact CB-CD2 4.42Å; D28-F31 PolarHBondContact O-N 3.36Å; D28-F31 VanDerWaalsContact O-N 3.1Å
29	T	62.3	Low	69.4	Low	87 Å²	87	94.9 Å²	94.9	53%	0.534	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-60.3	-23	-179.6	57.3	0	0	0	0	113.6	F31 K32	T29-F31 PolarHBondContact O-N 2.88Å; T29-K32 WeakPolarHBondContact O-CB 3.39Å; T29-K32 WeakPolarHBondContact O-CG 3.37Å; T29-K32 PolarHBondContact O-N 3.34Å
30	S	64.6	Low	68.4	Low	64 Å²	64	97.2 Å²	97.2	45%	0.448	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-55.9	-33.9	172.9	52.9	0	0	0	0	113.2	D28 K32 I33	D28-S30 PolarHBondContact O-N 3.11Å; D28-S30 VanDerWaalsContact O-N 3.14Å; D28-S30 WeakPolarHBondContact OD1-CB 3.19Å; D28-S30 PolarHBondContact OD1-N 3.37Å; D28-S30 PolarHBondContact OD1-OG 3.1Å; S30-K32 PolarHBondContact O-N 3.03Å; S30-K32 VanDerWaalsContact O-N 3.12Å; S30-I33 CarbonylContact O-C 3.58Å; S30-I33 PolarHBondContact O-N 2.98Å
31	F	62.8	Low	67.7	Low	51 Å²	51	98.8 Å²	98.8	22%	0.224	51%	0.506	C	S	.	.	G	3₁₀ helix	trans	-65.3	-15.7	174.6	-73.2	-80.9	0	0	0	113.5	L27 D28 T29 I33 L34 T119 L122 F123	L27-F31 HydrophobicContact CB-CB 4.49Å; L27-F31 HydrophobicContact CB-CD2 4.03Å; L27-F31 HydrophobicContact CB-CG 4.46Å; L27-F31 HydrophobicContact CD2-CD2 4.31Å; L27-F31 HydrophobicContact CD2-CE2 4.24Å; D28-F31 HydrophobicContact CB-CD2 4.42Å; D28-F31 PolarHBondContact O-N 3.36Å; D28-F31 VanDerWaalsContact O-N 3.1Å; T29-F31 PolarHBondContact O-N 2.88Å; F31-I33 VanDerWaalsContact C-N 3.32Å; F31-L34 HydrophobicContact CB-CD1 4.32Å; F31-L34 HydrophobicContact CD1-CD1 3.69Å; F31-L34 HydrophobicContact CG-CD1 4.38Å; F31-T119 HydrophobicContact CB-CG2 4.09Å; F31-T119 HydrophobicContact CD1-CG2 3.67Å; F31-T119 HydrophobicContact CG-CG2 4.24Å; F31-L122 HydrophobicContact CE1-CD2 4.02Å; F31-F123 HydrophobicContact CE1-CE1 4.25Å; F31-F123 HydrophobicContact CE1-CZ 4.12Å; F31-F123 HydrophobicContact CZ-CE1 4.16Å; F31-F123 HydrophobicContact CZ-CZ 4.1Å
32	K	61.7	Low	66.5	Low	131 Å²	131	101.2 Å²	101.2	57%	0.57	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-79.7	-15.8	173.9	-53.4	-177.9	-179.4	172.8	0	112.5	T29 S30	T29-K32 WeakPolarHBondContact O-CB 3.39Å; T29-K32 WeakPolarHBondContact O-CG 3.37Å; T29-K32 PolarHBondContact O-N 3.34Å; S30-K32 PolarHBondContact O-N 3.03Å; S30-K32 VanDerWaalsContact O-N 3.12Å
33	I	60	Low	65.3	Low	143 Å²	143	99.2 Å²	99.2	73%	0.733	50%	0.5	S	S	*	.	S	Bend	trans	-125.7	42	-171	-42.5	173.3	0	0	0	109.9	S30 F31 D35	S30-I33 CarbonylContact O-C 3.58Å; S30-I33 PolarHBondContact O-N 2.98Å; F31-I33 VanDerWaalsContact C-N 3.32Å; I33-D35 PolarHBondContact O-N 3.47Å
34	L	58.3	Low	64.1	Low	46 Å²	46	96.2 Å²	96.2	24%	0.241	50%	0.495	C	S	.	.			trans	-84.8	110.1	173.1	-84.8	150.4	0	0	0	109.8	F31 I39 L42	F31-L34 HydrophobicContact CB-CD1 4.32Å; F31-L34 HydrophobicContact CD1-CD1 3.69Å; F31-L34 HydrophobicContact CG-CD1 4.38Å; L34-I39 HydrophobicContact CB-CD1 4.27Å; L34-I39 HydrophobicContact CB-CG1 4.1Å; L34-I39 HydrophobicContact CD2-CG1 4.09Å; L34-L42 HydrophobicContact CD2-CD1 3.85Å
35	D	61.2	Low	62.9	Low	108 Å²	108	96 Å²	96	58%	0.578	49%	0.493	S	S	*	.			trans	-75.5	160.9	168.4	-171.8	21	0	0	0	110.6	I33 V37 T38 I39	I33-D35 PolarHBondContact O-N 3.47Å; D35-V37 PolarHBondContact O-N 3Å; D35-T38 PolarHBondContact N-OG1 2.87Å; D35-T38 PolarHBondContact O-N 2.98Å; D35-T38 PolarHBondContact O-OG1 2.87Å; D35-I39 WeakPolarHBondContact O-CG1 3.41Å; D35-I39 PolarHBondContact O-N 2.93Å
36	R	62.1	Low	61.7	Low	218 Å²	218	101.4 Å²	101.4	82%	0.823	52%	0.522	S	S	*	.	H	α-helix	trans	-61.2	-31.9	-177.4	-139.3	179.1	176	-166.9	-3.6	112.8	Q40	R36-Q40 PolarHBondContact O-N 3.15Å
37	V	64.2	Low	60.3	Low	88 Å²	88	99 Å²	99	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-72.1	-45.1	179.3	-176.8	0	0	0	0	111.2	D35 I39 Q40 E41	D35-V37 PolarHBondContact O-N 3Å; V37-I39 VanDerWaalsContact C-N 3.32Å; V37-I39 PolarHBondContact O-N 3.49Å; V37-Q40 WeakPolarHBondContact O-CB 3.45Å; V37-Q40 PolarHBondContact O-N 3.49Å; V37-Q40 VanDerWaalsContact O-N 3.09Å; V37-E41 PolarHBondContact O-N 3.05Å; V37-E41 VanDerWaalsContact O-N 3.1Å
38	T	64.8	Low	58.6	Low	60 Å²	60	103 Å²	103	37%	0.368	55%	0.545	S	S	.	.	H	α-helix	trans	-65.6	-34.5	179.4	35.7	0	0	0	0	112.3	D35 Q40 E41 L42	D35-T38 PolarHBondContact N-OG1 2.87Å; D35-T38 PolarHBondContact O-N 2.98Å; D35-T38 PolarHBondContact O-OG1 2.87Å; T38-Q40 VanDerWaalsContact C-N 3.31Å; T38-Q40 PolarHBondContact O-N 3.46Å; T38-E41 PolarHBondContact O-N 3.48Å; T38-L42 WeakPolarHBondContact O-CB 3.29Å; T38-L42 VanDerWaalsContact O-CG 3.26Å; T38-L42 WeakPolarHBondContact O-CG 3.5Å; T38-L42 PolarHBondContact O-N 3.23Å
39	I	61.9	Low	56.8	Low	44 Å²	44	105.2 Å²	105.2	23%	0.226	56%	0.562	C	S	.	*	H	α-helix	trans	-61.6	-42.4	172.2	-63.1	159.1	0	0	0	110.6	L34 D35 V37 E41 L42 T43 V118	L34-I39 HydrophobicContact CB-CD1 4.27Å; L34-I39 HydrophobicContact CB-CG1 4.1Å; L34-I39 HydrophobicContact CD2-CG1 4.09Å; D35-I39 WeakPolarHBondContact O-CG1 3.41Å; D35-I39 PolarHBondContact O-N 2.93Å; V37-I39 VanDerWaalsContact C-N 3.32Å; V37-I39 PolarHBondContact O-N 3.49Å; I39-E41 PolarHBondContact O-N 2.9Å; I39-L42 PolarHBondContact O-N 2.89Å; I39-T43 VanDerWaalsContact O-CB 3.23Å; I39-T43 WeakPolarHBondContact O-CB 3.31Å; I39-T43 PolarHBondContact O-N 3.42Å; I39-T43 PolarHBondContact O-OG1 3.48Å; I39-V118 HydrophobicContact CD1-CG1 3.4Å; I39-V118 HydrophobicContact CD1-CG2 4.49Å; I39-V118 HydrophobicContact CG1-CG1 3.91Å
40	Q	63.1	Low	55.1	Low	150 Å²	150	105.1 Å²	105.1	70%	0.701	57%	0.57	S	S	*	*	H	α-helix	trans	-66.8	-37.1	-178.4	-132.5	174.5	3.2	0	0	112.3	R36 V37 T38 A44	R36-Q40 PolarHBondContact O-N 3.15Å; V37-Q40 WeakPolarHBondContact O-CB 3.45Å; V37-Q40 PolarHBondContact O-N 3.49Å; V37-Q40 VanDerWaalsContact O-N 3.09Å; T38-Q40 VanDerWaalsContact C-N 3.31Å; T38-Q40 PolarHBondContact O-N 3.46Å; Q40-A44 PolarHBondContact O-N 2.92Å
41	E	65.3	Low	53.3	Low	145 Å²	145	111.3 Å²	111.3	68%	0.678	59%	0.592	S	S	*	*	H	α-helix	trans	-70.1	-42.8	174.4	-69.2	-161.3	159.9	0	0	112.5	V37 T38 I39 T43 A44	V37-E41 PolarHBondContact O-N 3.05Å; V37-E41 VanDerWaalsContact O-N 3.1Å; T38-E41 PolarHBondContact O-N 3.48Å; I39-E41 PolarHBondContact O-N 2.9Å; E41-T43 PolarHBondContact O-N 3.36Å; E41-A44 VanDerWaalsContact O-CB 3.3Å; E41-A44 WeakPolarHBondContact O-CB 3.32Å; E41-A44 PolarHBondContact O-N 3.28Å; E41-A44 VanDerWaalsContact O-N 3.16Å
42	L	61.8	Low	51.5	Low	99 Å²	99	113.4 Å²	113.4	52%	0.518	62%	0.619	S	S	.	*	H	α-helix	trans	-67.4	-24.9	177.2	-68.6	167.7	0	0	0	112.9	L34 T38 I39 L122	L34-L42 HydrophobicContact CD2-CD1 3.85Å; T38-L42 WeakPolarHBondContact O-CB 3.29Å; T38-L42 VanDerWaalsContact O-CG 3.26Å; T38-L42 WeakPolarHBondContact O-CG 3.5Å; T38-L42 PolarHBondContact O-N 3.23Å; I39-L42 PolarHBondContact O-N 2.89Å; L42-L122 HydrophobicContact CB-CD1 3.7Å; L42-L122 HydrophobicContact CD1-CD2 4.24Å
43	T	57.1	Low	49.8	Very low	47 Å²	47	116.4 Å²	116.4	29%	0.288	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86	-9.6	177.3	-55	0	0	0	0	112.4	I39 E41 I125	I39-T43 VanDerWaalsContact O-CB 3.23Å; I39-T43 WeakPolarHBondContact O-CB 3.31Å; I39-T43 PolarHBondContact O-N 3.42Å; I39-T43 PolarHBondContact O-OG1 3.48Å; E41-T43 PolarHBondContact O-N 3.36Å; T43-I125 HydrophobicContact CG2-CD1 3.28Å; T43-I125 HydrophobicContact CG2-CG1 4.14Å; T43-I125 HydrophobicContact CG2-CG2 4.06Å
44	A	55.5	Low	48.3	Very low	55 Å²	55	115.6 Å²	115.6	46%	0.455	64%	0.636	S	S	.	*	S	Bend	trans	-66.9	132.3	-178.9	0	0	0	0	0	110.2	Q40 E41 L46	Q40-A44 PolarHBondContact O-N 2.92Å; E41-A44 VanDerWaalsContact O-CB 3.3Å; E41-A44 WeakPolarHBondContact O-CB 3.32Å; E41-A44 PolarHBondContact O-N 3.28Å; E41-A44 VanDerWaalsContact O-N 3.16Å; A44-L46 PolarHBondContact O-N 3.01Å
45	P	53.6	Low	46.8	Very low	91 Å²	91	117.1 Å²	117.1	59%	0.591	66%	0.662	S	S	*	*			trans	-56	125.5	177.4	-23.3	32.3	0	0	0	111	L47	P45-L47 PolarHBondContact O-N 3.39Å; P45-L47 VanDerWaalsContact O-N 3.11Å
46	L	48.3	Very low	45.1	Very low	150 Å²	150	120.4 Å²	120.4	79%	0.785	67%	0.674	S	S	*	*			trans	-64.4	115.9	173.7	-72.3	172.6	0	0	0	108.1	A44 T48	A44-L46 PolarHBondContact O-N 3.01Å; L46-T48 PolarHBondContact O-N 3.5Å
47	L	42.7	Very low	43.4	Very low	161 Å²	161	115.3 Å²	115.3	84%	0.843	67%	0.667	S	S	*	*			trans	-56.8	108.4	-179.7	-71.5	163	0	0	0	108.9	P45 T49	P45-L47 PolarHBondContact O-N 3.39Å; P45-L47 VanDerWaalsContact O-N 3.11Å; L47-T49 PolarHBondContact O-N 2.91Å
48	T	30.4	Very low	41.7	Very low	132 Å²	132	119.1 Å²	119.1	81%	0.81	68%	0.68	S	S	*	*			trans	-54.2	105.7	168.1	51.3	0	0	0	0	107.7	L46 A50	L46-T48 PolarHBondContact O-N 3.5Å; T48-A50 VanDerWaalsContact C-N 3.26Å; T48-A50 PolarHBondContact O-N 2.66Å
49	T	31.7	Very low	39.8	Very low	139 Å²	139	124.8 Å²	124.8	85%	0.853	70%	0.702	S	S	*	*			trans	-71.4	89.6	179.3	39.9	0	0	0	0	108.6	L47 Q51	L47-T49 PolarHBondContact O-N 2.91Å; T49-Q51 PolarHBondContact O-N 3.05Å
50	A	26	Very low	38.2	Very low	85 Å²	85	131.9 Å²	131.9	70%	0.702	73%	0.734	S	S	*	*			trans	-59.6	115.2	169.5	0	0	0	0	0	109.8	T48 A52	T48-A50 VanDerWaalsContact C-N 3.26Å; T48-A50 PolarHBondContact O-N 2.66Å; A50-A52 PolarHBondContact O-N 2.81Å
51	Q	26.1	Very low	36.4	Very low	194 Å²	194	133.2 Å²	133.2	91%	0.907	74%	0.74	S	S	*	*			trans	25.4	94.9	132.2	-68.3	178.7	-24.3	0	0	116.4	T49	T49-Q51 PolarHBondContact O-N 3.05Å
52	A	26.2	Very low	34.8	Very low	96 Å²	96	132.8 Å²	132.8	79%	0.793	75%	0.748	S	S	*	*			trans	-167.1	133.6	149.6	0	0	0	0	0	107.5	A50	A50-A52 PolarHBondContact O-N 2.81Å
53	K	26.4	Very low	33	Very low	193 Å²	193	135.3 Å²	135.3	84%	0.839	76%	0.762	S	S	*	*			cis	-167.6	139.9	-10	-133.3	-179.9	-178.9	-175.3	0	101.7	G55	K53-G55 PolarHBondContact O-N 3.13Å
54	P	26.8	Very low	31.7	Very low	127 Å²	127	138.3 Å²	138.3	83%	0.825	79%	0.785	S	S	*	*			trans	-71.5	122.5	-169.8	-5	20.8	0	0	0	109.9
55	G	27.4	Very low	30.3	Very low	77 Å²	77	139 Å²	139	79%	0.794	80%	0.797	S	S	*	*			trans	-90.1	104.8	168	0	0	0	0	0	109.3	K53	K53-G55 PolarHBondContact O-N 3.13Å
56	E	25.9	Very low	29.2	Very low	177 Å²	177	144.1 Å²	144.1	83%	0.827	81%	0.813	S	S	*	*			trans	-20.6	140	147.1	-56.3	161.9	173.7	0	0	111.3
57	T	26.4	Very low	28.2	Very low	111 Å²	111	145.4 Å²	145.4	68%	0.681	82%	0.815	S	S	*	*			cis	174.9	161.2	49.7	-20.7	0	0	0	0	107.5
58	Q	28.3	Very low	27.7	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	81%	0.805	S	S	*	*			trans	76.8	93.3	155.8	-66.1	162.7	14.7	0	0	115.1
59	E	24.7	Very low	27.4	Very low	179 Å²	179	144.7 Å²	144.7	84%	0.836	80%	0.804	S	S	*	*				49.4	87.9	64.9	-59.5	179.9	-171.2	0	0	112.6
60	E	29.5	Very low	27.5	Very low	193 Å²	193	145.6 Å²	145.6	90%	0.902	80%	0.802	S	S	*	*			trans	-127.3	109.3	145.3	-86.5	-167.6	162.1	0	0	109
61	E	25.4	Very low	27.7	Very low	177 Å²	177	149 Å²	149	83%	0.827	80%	0.804	S	S	*	*			trans	-60.6	133	170.4	-56.1	171.4	141	0	0	110.2
62	T	29.7	Very low	28	Very low	137 Å²	137	145.6 Å²	145.6	84%	0.84	80%	0.796	S	S	*	*			trans	-144.3	81	150.4	10.9	0	0	0	0	110	S64	T62-S64 PolarHBondContact O-N 3.31Å
63	N	25.8	Very low	28.6	Very low	152 Å²	152	146.9 Å²	146.9	81%	0.813	80%	0.797	S	S	*	*			trans	-25.6	120.1	140.3	179.8	16.4	0	0	0	113.1
64	S	29.7	Very low	28.9	Very low	109 Å²	109	148.8 Å²	148.8	76%	0.762	80%	0.798	S	S	*	*			trans	-161.6	129.4	140.5	42.8	0	0	0	0	109.7	T62	T62-S64 PolarHBondContact O-N 3.31Å
65	G	26.4	Very low	29.5	Very low	70 Å²	70	151 Å²	151	72%	0.722	80%	0.798	S	S	*	*			trans	-73.8	149.5	-169.1	0	0	0	0	0	114
66	E	29.2	Very low	30	Very low	198 Å²	198	154 Å²	154	93%	0.925	80%	0.796	S	S	*	*			trans	-128.4	83.8	156.9	-70.4	-169.2	164.4	0	0	107.6
67	E	28.5	Very low	30.5	Very low	177 Å²	177	150 Å²	150	83%	0.827	80%	0.802	S	S	*	*			trans	-102.1	158.6	151.2	-85.6	-92.1	131.5	0	0	105.9
68	P	31.6	Very low	31.1	Very low	97 Å²	97	149.5 Å²	149.5	63%	0.63	80%	0.798	S	S	*	*			cis	-136.8	-170.6	-17.6	29.1	-6.5	0	0	0	112
69	F	24.8	Very low	32	Very low	181 Å²	181	147.3 Å²	147.3	79%	0.794	80%	0.802	S	S	*	*			trans	84.9	81.1	139.7	-146.4	-98.1	0	0	0	117.5
70	I	33.7	Very low	33.1	Very low	158 Å²	158	149.4 Å²	149.4	81%	0.81	80%	0.802	S	S	*	*			trans	-117.8	102.9	159.5	-60.6	-179.3	0	0	0	110
71	E	30.2	Very low	33.5	Very low	157 Å²	157	151.4 Å²	151.4	73%	0.734	80%	0.801	S	S	*	*			trans	54.7	96.3	141.7	-60.9	-175.2	161	0	0	118.2	P73	E71-P73 WeakPolarHBondContact O-CD 3.5Å; E71-P73 VanDerWaalsContact O-N 3.12Å
72	T	30.6	Very low	34.6	Very low	123 Å²	123	151.7 Å²	151.7	76%	0.755	80%	0.8	S	S	*	*			trans	-41.1	110.3	148.1	28.1	0	0	0	0	111.6	R74	T72-R74 PolarHBondContact O-N 3.37Å; T72-R74 VanDerWaalsContact O-N 3.08Å
73	P	40.2	Very low	35.2	Very low	123 Å²	123	152.1 Å²	152.1	80%	0.799	80%	0.796	S	S	*	*			trans	-82.2	91.7	170.6	26.2	-15.9	0	0	0	107.5	E71 Q75	E71-P73 WeakPolarHBondContact O-CD 3.5Å; E71-P73 VanDerWaalsContact O-N 3.12Å; P73-Q75 PolarHBondContact O-N 2.86Å
74	R	32.9	Very low	36.2	Very low	232 Å²	232	149.3 Å²	149.3	88%	0.875	79%	0.786	S	S	*	*			trans	-72.4	96.2	157.6	-74	-174.7	177.3	171.5	0.2	107	T72	T72-R74 PolarHBondContact O-N 3.37Å; T72-R74 VanDerWaalsContact O-N 3.08Å
75	Q	38.6	Very low	36.5	Very low	173 Å²	173	149.6 Å²	149.6	81%	0.808	79%	0.785	S	S	*	*			trans	-159.8	107.5	161.2	-111.1	159.7	41.8	0	0	111.7	P73	P73-Q75 PolarHBondContact O-N 2.86Å
76	D	37.2	Very low	37	Very low	142 Å²	142	150.6 Å²	150.6	76%	0.759	79%	0.787	S	S	*	*			trans	44.7	107	144.1	-57.8	-18.8	0	0	0	118	V78	D76-V78 PolarHBondContact O-N 3.21Å
77	G	37.9	Very low	37.5	Very low	93 Å²	93	153 Å²	153	96%	0.959	79%	0.787	S	S	*	*			trans	-63.6	51.2	176.6	0	0	0	0	0	115.9
78	V	38.1	Very low	37.8	Very low	99 Å²	99	152.8 Å²	152.8	60%	0.6	79%	0.789	S	S	*	*			trans	-101.3	92.4	166.5	-173.3	0	0	0	0	108	D76 R80	D76-V78 PolarHBondContact O-N 3.21Å; V78-R80 HydrophobicContact CG1-CG 4.07Å; V78-R80 PolarHBondContact O-N 2.84Å; V78-R80 VanDerWaalsContact O-N 3.16Å
79	S	47.4	Very low	37.8	Very low	123 Å²	123	156.4 Å²	156.4	86%	0.86	80%	0.799	S	S	*	*			trans	-63.8	110.9	170.9	-167.5	0	0	0	0	109.5
80	R	47.6	Very low	38.4	Very low	223 Å²	223	153 Å²	153	84%	0.842	80%	0.798	S	S	*	*			trans	-106.8	110.8	176.3	-63.8	-178.5	-179.4	173	1.5	108.8	V78 F82	V78-R80 HydrophobicContact CG1-CG 4.07Å; V78-R80 PolarHBondContact O-N 2.84Å; V78-R80 VanDerWaalsContact O-N 3.16Å; R80-F82 PolarHBondContact O-N 3.29Å
81	R	38.5	Very low	38.5	Very low	235 Å²	235	151 Å²	151	89%	0.887	79%	0.793	S	S	*	*			trans	-82.5	112.4	-178.8	-157.1	174.5	-171.9	174.4	2.3	109.8
82	F	48.3	Very low	38.6	Very low	184 Å²	184	152 Å²	152	81%	0.807	80%	0.798	S	S	*	*			trans	-79.1	127.7	175.4	-170.3	-99.2	0	0	0	109.9	R80 P84	R80-F82 PolarHBondContact O-N 3.29Å; F82-P84 HydrophobicContact CE1-CB 4.38Å
83	I	41.7	Very low	38.8	Very low	146 Å²	146	151.6 Å²	151.6	75%	0.749	80%	0.8	S	S	*	*			trans	-113.7	111.8	175.3	-57.8	177.4	0	0	0	107.9
84	P	46.7	Very low	38.6	Very low	92 Å²	92	150.6 Å²	150.6	60%	0.597	80%	0.802	S	S	*	*			trans	-73.4	146.1	179.2	27.5	-31.5	0	0	0	111.9	F82	F82-P84 HydrophobicContact CE1-CB 4.38Å
85	P	37.4	Very low	38.6	Very low	115 Å²	115	147.6 Å²	147.6	75%	0.747	80%	0.803	S	S	*	*			trans	-73.7	133.9	-179.7	27.5	-31.5	0	0	0	111.9	R87	P85-R87 PolarHBondContact O-N 3.37Å; P85-R87 VanDerWaalsContact O-N 3.13Å
86	A	36.3	Very low	38.3	Very low	92 Å²	92	144.6 Å²	144.6	76%	0.76	80%	0.801	S	S	*	*			trans	-66	106.9	173.9	0	0	0	0	0	110.1	M88	A86-M88 PolarHBondContact O-N 3.19Å
87	R	39.3	Very low	38.4	Very low	247 Å²	247	146.9 Å²	146.9	93%	0.932	81%	0.805	S	S	*	*			trans	-74.6	112.5	171.3	-87.6	-176.9	172.5	170.1	-1.9	109.1	P85	P85-R87 PolarHBondContact O-N 3.37Å; P85-R87 VanDerWaalsContact O-N 3.13Å
88	M	34	Very low	38.3	Very low	174 Å²	174	147.4 Å²	147.4	86%	0.857	79%	0.79	S	S	*	*			trans	-74.3	156	178.8	-69	-138.7	139.8	0	0	112.8	A86	A86-M88 PolarHBondContact O-N 3.19Å
89	M	32.1	Very low	38.1	Very low	172 Å²	172	148.9 Å²	148.9	85%	0.847	79%	0.793	S	S	*	*			trans	-52.1	141.2	169.7	-54	-86	97.8	0	0	112.8
90	S	36.9	Very low	37.5	Very low	111 Å²	111	150.8 Å²	150.8	78%	0.776	79%	0.792	S	S	*	*			trans	-124	97.8	158.8	-64.5	0	0	0	0	106.9
91	T	37.5	Very low	36.7	Very low	115 Å²	115	142.9 Å²	142.9	71%	0.706	78%	0.78	S	S	*	*				55.9	97.3	94.2	65.3	0	0	0	0	112.3
92	E	31.8	Very low	36.5	Very low	178 Å²	178	141 Å²	141	83%	0.832	78%	0.782	S	S	*	*				66.8	118.9	91.5	-74.6	-165.3	171.8	0	0	115.5
93	S	34.8	Very low	36	Very low	114 Å²	114	137.5 Å²	137.5	80%	0.797	79%	0.786	S	S	*	*			trans	73	106.5	142.4	71.5	0	0	0	0	119.6
94	A	36	Very low	35.6	Very low	102 Å²	102	135.2 Å²	135.2	84%	0.843	78%	0.784	S	S	*	*			trans	-149.5	64	148.6	0	0	0	0	0	110.2	S96	A94-S96 PolarHBondContact O-N 3.14Å
95	N	33.5	Very low	35.2	Very low	169 Å²	169	138.7 Å²	138.7	90%	0.904	80%	0.797	S	S	*	*			trans	-63.2	108.9	156.4	-76.2	-8.1	0	0	0	108
96	S	31.4	Very low	35	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	81%	0.807	S	S	*	*			trans	160	98	147.6	175	0	0	0	0	110	A94	A94-S96 PolarHBondContact O-N 3.14Å
97	F	38.4	Very low	35.1	Very low	191 Å²	191	136 Å²	136	84%	0.838	80%	0.799	S	S	*	*			trans	-130.6	129.1	158.8	161.8	-101.5	0	0	0	109.6
98	T	36.1	Very low	35.4	Very low	103 Å²	103	129 Å²	129	63%	0.632	78%	0.784	S	S	*	*			trans	-87.6	125.3	-175.4	-52.2	0	0	0	0	110.3
99	L	34.7	Very low	36	Very low	130 Å²	130	128.6 Å²	128.6	68%	0.681	78%	0.782	S	S	*	*			trans	-66.5	123.6	176.1	-175.4	74.4	0	0	0	111.7
100	I	34	Very low	36.8	Very low	163 Å²	163	127.4 Å²	127.4	84%	0.836	77%	0.774	S	S	*	*			trans	-125.3	118.5	164.3	-57.6	176.8	0	0	0	106.7
101	G	31.4	Very low	37.7	Very low	57 Å²	57	127.3 Å²	127.3	59%	0.588	77%	0.765	S	S	*	*	S	Bend	trans	141.4	100.6	166.1	0	0	0	0	0	115.4
102	E	34	Very low	38.7	Very low	196 Å²	196	125.6 Å²	125.6	92%	0.916	75%	0.751	S	S	*	*			trans	55.9	58.9	147.3	-58.8	-178.2	179.7	0	0	117.8	S104	E102-S104 VanDerWaalsContact C-N 3.3Å; E102-S104 PolarHBondContact O-N 2.84Å
103	A	37.3	Very low	40.1	Very low	110 Å²	110	121 Å²	121	91%	0.909	74%	0.738	S	S	*	*			trans	-81.4	80.4	149.6	0	0	0	0	0	108.7
104	S	33.7	Very low	41.5	Very low	99 Å²	99	123.8 Å²	123.8	69%	0.692	73%	0.732	S	S	*	*			trans	-141.5	82.2	171.1	-176.1	0	0	0	0	110.2	E102	E102-S104 VanDerWaalsContact C-N 3.3Å; E102-S104 PolarHBondContact O-N 2.84Å
105	D	39.1	Very low	42.9	Very low	165 Å²	165	123.7 Å²	123.7	88%	0.882	71%	0.71	S	S	*	*			trans	-155.7	105	135.4	-96.3	-18.8	0	0	0	107.6	G107	D105-G107 PolarHBondContact O-N 3.08Å
106	G	32.1	Very low	44.6	Very low	92 Å²	92	117.7 Å²	117.7	95%	0.948	68%	0.677	S	S	*	*			trans	-70.7	117.4	176.4	0	0	0	0	0	110.4
107	G	38.5	Very low	46.5	Very low	58 Å²	58	119.1 Å²	119.1	60%	0.598	67%	0.669	S	S	*	*			trans	176.3	100.2	176.3	0	0	0	0	0	113.7	D105	D105-G107 PolarHBondContact O-N 3.08Å
108	T	45.9	Very low	48	Very low	99 Å²	99	112.1 Å²	112.1	61%	0.607	64%	0.642	S	S	*	*			trans	55.2	108.4	157.8	59.2	0	0	0	0	119.7	E110 N111	T108-E110 PolarHBondContact O-N 3.25Å; T108-N111 PolarHBondContact O-N 2.71Å
109	M	46.2	Very low	49.7	Very low	166 Å²	166	107.4 Å²	107.4	82%	0.818	61%	0.613	S	S	*	*	H	α-helix	trans	-46.8	-22.6	170	-168.4	168.2	78	0	0	115	N111 L112 S113	M109-N111 PolarHBondContact O-N 2.61Å; M109-L112 PolarHBondContact O-N 3.06Å; M109-S113 PolarHBondContact O-N 2.88Å
110	E	49.4	Very low	51.5	Low	147 Å²	147	102.1 Å²	102.1	69%	0.687	59%	0.59	S	S	*	*	H	α-helix	trans	-66.4	-30.8	-179.5	-62.6	-176.7	172.2	0	0	113.7	T108	T108-E110 PolarHBondContact O-N 3.25Å
111	N	55.3	Low	53.3	Low	109 Å²	109	98 Å²	98	58%	0.583	57%	0.57	S	S	*	*	H	α-helix	trans	-76.7	-31.8	178.1	-77.3	-18	0	0	0	112.5	T108 M109 R115	T108-N111 PolarHBondContact O-N 2.71Å; M109-N111 PolarHBondContact O-N 2.61Å; N111-R115 PolarHBondContact O-N 3.33Å
112	L	58.5	Low	55.4	Low	80 Å²	80	95.9 Å²	95.9	42%	0.419	55%	0.545	S	S	.	.	H	α-helix	trans	-70.6	-43.7	177.8	-175.2	67.5	0	0	0	111.6	M109 R114 R115 L116	M109-L112 PolarHBondContact O-N 3.06Å; L112-R114 PolarHBondContact O-N 3.25Å; L112-R115 PolarHBondContact O-N 3.27Å; L112-L116 HydrophobicContact CG-CD1 4.09Å; L112-L116 WeakPolarHBondContact O-CG 3.36Å; L112-L116 PolarHBondContact O-N 2.93Å
113	S	62.3	Low	57.4	Low	80 Å²	80	87.2 Å²	87.2	56%	0.559	50%	0.504	S	S	*	.	H	α-helix	trans	-62.1	-44	-178.5	179.1	0	0	0	0	112.3	M109 R115 L116 K117	M109-S113 PolarHBondContact O-N 2.88Å; S113-R115 VanDerWaalsContact C-N 3.31Å; S113-R115 PolarHBondContact O-N 2.82Å; S113-L116 PolarHBondContact O-N 3.42Å; S113-K117 PolarHBondContact O-N 3.2Å
114	R	64.7	Low	59.3	Low	174 Å²	174	87.4 Å²	87.4	66%	0.657	49%	0.49	S	S	*	.	H	α-helix	trans	-62.8	-38.9	178.3	-145	-173.5	-55.9	-151.5	3.2	111.8	L112 K117 V118	L112-R114 PolarHBondContact O-N 3.25Å; R114-K117 PolarHBondContact O-N 3.33Å; R114-V118 WeakPolarHBondContact O-CG2 3.43Å; R114-V118 PolarHBondContact O-N 3.25Å; R114-V118 VanDerWaalsContact O-N 3.12Å
115	R	65.2	Low	61.2	Low	100 Å²	100	85.2 Å²	85.2	38%	0.377	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-43.8	177.8	-174.8	176.1	66.9	-175.9	2.1	112.6	N111 L112 S113 K117 V118 T119	N111-R115 PolarHBondContact O-N 3.33Å; L112-R115 PolarHBondContact O-N 3.27Å; S113-R115 VanDerWaalsContact C-N 3.31Å; S113-R115 PolarHBondContact O-N 2.82Å; R115-K117 VanDerWaalsContact C-N 3.27Å; R115-K117 PolarHBondContact O-N 3.17Å; R115-V118 PolarHBondContact O-N 2.92Å; R115-T119 PolarHBondContact O-N 3.03Å; R115-T119 VanDerWaalsContact O-N 3.07Å; R115-T119 PolarHBondContact O-OG1 3.25Å
116	L	67.7	Low	62.7	Low	42 Å²	42	81 Å²	81	22%	0.22	45%	0.446	C	S	.	.	H	α-helix	trans	-61.7	-37.5	175.9	-72.7	171	0	0	0	111.5	V14 F16 L112 S113 T119 G120	V14-L116 HydrophobicContact CB-CD1 4.06Å; V14-L116 HydrophobicContact CG1-CD1 4.4Å; V14-L116 HydrophobicContact CG1-CD2 4.46Å; V14-L116 HydrophobicContact CG2-CD1 4.29Å; F16-L116 HydrophobicContact CE2-CD2 3.54Å; F16-L116 HydrophobicContact CZ-CD2 3.81Å; L112-L116 HydrophobicContact CG-CD1 4.09Å; L112-L116 WeakPolarHBondContact O-CG 3.36Å; L112-L116 PolarHBondContact O-N 2.93Å; S113-L116 PolarHBondContact O-N 3.42Å; L116-T119 WeakPolarHBondContact CA-OG1 3.16Å; L116-T119 PolarHBondContact O-OG1 3.21Å; L116-T119 VanDerWaalsContact O-OG1 3.13Å; L116-G120 PolarHBondContact O-N 3.13Å
117	K	71.9	Confident	65	Low	140 Å²	140	77.7 Å²	77.7	61%	0.609	41%	0.408	S	S	*	.	H	α-helix	trans	-64.9	-49	176	-170.2	175.7	179.6	-179.3	0	112.2	S113 R114 R115 T119 G120 D121	S113-K117 PolarHBondContact O-N 3.2Å; R114-K117 PolarHBondContact O-N 3.33Å; R115-K117 VanDerWaalsContact C-N 3.27Å; R115-K117 PolarHBondContact O-N 3.17Å; K117-T119 VanDerWaalsContact C-N 3.32Å; K117-T119 PolarHBondContact O-N 2.94Å; K117-G120 PolarHBondContact O-N 2.9Å; K117-D121 WeakPolarHBondContact O-CB 3.46Å; K117-D121 PolarHBondContact O-N 3.45Å
118	V	69.9	Low	66.7	Low	45 Å²	45	78 Å²	78	27%	0.273	41%	0.412	S	S	.	.	H	α-helix	trans	-61.3	-40.4	179.7	169.3	0	0	0	0	112.3	I39 R114 R115 L122	I39-V118 HydrophobicContact CD1-CG1 3.4Å; I39-V118 HydrophobicContact CD1-CG2 4.49Å; I39-V118 HydrophobicContact CG1-CG1 3.91Å; R114-V118 WeakPolarHBondContact O-CG2 3.43Å; R114-V118 PolarHBondContact O-N 3.25Å; R114-V118 VanDerWaalsContact O-N 3.12Å; R115-V118 PolarHBondContact O-N 2.92Å; V118-L122 PolarHBondContact O-N 3.41Å; V118-L122 VanDerWaalsContact O-N 3.12Å
119	T	72	Confident	67.9	Low	4 Å²	4	78.3 Å²	78.3	3%	0.025	41%	0.406	C	S	.	.	H	α-helix	trans	-70.9	-38.8	178.1	37.9	0	0	0	0	112.4	F16 L27 F31 R115 L116 K117 L122 F123	F16-T119 WeakPolarHBondContact CZ-OG1 3.47Å; L27-T119 HydrophobicContact CD1-CG2 4.34Å; F31-T119 HydrophobicContact CB-CG2 4.09Å; F31-T119 HydrophobicContact CD1-CG2 3.67Å; F31-T119 HydrophobicContact CG-CG2 4.24Å; R115-T119 PolarHBondContact O-N 3.03Å; R115-T119 VanDerWaalsContact O-N 3.07Å; R115-T119 PolarHBondContact O-OG1 3.25Å; L116-T119 WeakPolarHBondContact CA-OG1 3.16Å; L116-T119 PolarHBondContact O-OG1 3.21Å; L116-T119 VanDerWaalsContact O-OG1 3.13Å; K117-T119 VanDerWaalsContact C-N 3.32Å; K117-T119 PolarHBondContact O-N 2.94Å; T119-L122 PolarHBondContact O-N 2.91Å; T119-F123 WeakPolarHBondContact O-CD2 3.44Å; T119-F123 WeakPolarHBondContact O-CG 3.43Å; T119-F123 PolarHBondContact O-N 2.88Å
120	G	72.5	Confident	69.1	Low	19 Å²	19	73.1 Å²	73.1	20%	0.196	38%	0.384	C	S	.	.	H	α-helix	trans	-61.7	-49.8	171.1	0	0	0	0	0	112.5	L116 K117 L122 F123 D124	L116-G120 PolarHBondContact O-N 3.13Å; K117-G120 PolarHBondContact O-N 2.9Å; G120-L122 PolarHBondContact O-N 3.47Å; G120-F123 PolarHBondContact O-N 3.14Å; G120-F123 VanDerWaalsContact O-N 3.11Å; G120-D124 PolarHBondContact O-N 3.43Å
121	D	72.5	Confident	70.2	Confident	77 Å²	77	74.6 Å²	74.6	41%	0.412	40%	0.397	S	S	.	.	H	α-helix	trans	-56.9	-39.8	178.9	-66.8	-13	0	0	0	111	K117 D124 I125	K117-D121 WeakPolarHBondContact O-CB 3.46Å; K117-D121 PolarHBondContact O-N 3.45Å; D121-D124 PolarHBondContact O-N 2.91Å; D121-I125 VanDerWaalsContact O-CD1 3.27Å; D121-I125 WeakPolarHBondContact O-CD1 3.47Å; D121-I125 VanDerWaalsContact O-CG1 3.26Å; D121-I125 WeakPolarHBondContact O-CG1 3.45Å; D121-I125 PolarHBondContact O-N 3.28Å
122	L	74.2	Confident	71.3	Confident	11 Å²	11	71.6 Å²	71.6	6%	0.058	38%	0.382	C	S	.	.	H	α-helix	trans	-65.2	-43.2	177.3	-178.3	66.6	0	0	0	112.7	F31 L42 V118 T119 G120 D124 I125 M126	F31-L122 HydrophobicContact CE1-CD2 4.02Å; L42-L122 HydrophobicContact CB-CD1 3.7Å; L42-L122 HydrophobicContact CD1-CD2 4.24Å; V118-L122 PolarHBondContact O-N 3.41Å; V118-L122 VanDerWaalsContact O-N 3.12Å; T119-L122 PolarHBondContact O-N 2.91Å; G120-L122 PolarHBondContact O-N 3.47Å; L122-D124 VanDerWaalsContact C-N 3.35Å; L122-I125 PolarHBondContact O-N 2.78Å; L122-M126 HydrophobicContact CG-SD 4.45Å; L122-M126 WeakPolarHBondContact O-CG 3.44Å; L122-M126 PolarHBondContact O-N 3.05Å
123	F	76.7	Confident	72.3	Confident	15 Å²	15	72.9 Å²	72.9	7%	0.066	39%	0.389	C	S	.	.	H	α-helix	trans	-67.5	-36.8	177.3	-64.7	-39.9	0	0	0	112.1	F16 L27 F31 T119 G120 I125 M126 S127 P135	F16-F123 AromaticContact CD1-CD2 3.99Å; F16-F123 HydrophobicContact CD1-CD2 3.99Å; F16-F123 AromaticContact CD1-CE2 3.83Å; F16-F123 HydrophobicContact CD1-CE2 3.83Å; F16-F123 HydrophobicContact CE1-CD2 4.13Å; F16-F123 HydrophobicContact CE1-CE2 4.11Å; F16-F123 HydrophobicContact CG-CE2 4.19Å; L27-F123 HydrophobicContact CD2-CE2 4.08Å; L27-F123 HydrophobicContact CD2-CZ 3.69Å; F31-F123 HydrophobicContact CE1-CE1 4.25Å; F31-F123 HydrophobicContact CE1-CZ 4.12Å; F31-F123 HydrophobicContact CZ-CE1 4.16Å; F31-F123 HydrophobicContact CZ-CZ 4.1Å; T119-F123 WeakPolarHBondContact O-CD2 3.44Å; T119-F123 WeakPolarHBondContact O-CG 3.43Å; T119-F123 PolarHBondContact O-N 2.88Å; G120-F123 PolarHBondContact O-N 3.14Å; G120-F123 VanDerWaalsContact O-N 3.11Å; F123-I125 VanDerWaalsContact C-N 3.33Å; F123-I125 PolarHBondContact O-N 3.12Å; F123-M126 PolarHBondContact O-N 3.43Å; F123-S127 WeakPolarHBondContact O-CB 3.4Å; F123-S127 PolarHBondContact O-N 2.98Å; F123-S127 PolarHBondContact O-OG 3.31Å; F123-P135 HydrophobicContact CD1-CB 3.86Å; F123-P135 HydrophobicContact CD1-CG 4.16Å; F123-P135 HydrophobicContact CD2-CB 4.43Å; F123-P135 HydrophobicContact CD2-CG 3.85Å; F123-P135 HydrophobicContact CE1-CB 3.68Å; F123-P135 HydrophobicContact CE1-CG 4.13Å; F123-P135 HydrophobicContact CE2-CB 4.26Å; F123-P135 HydrophobicContact CE2-CG 3.8Å; F123-P135 HydrophobicContact CG-CB 4.25Å; F123-P135 HydrophobicContact CG-CG 4.05Å; F123-P135 HydrophobicContact CZ-CB 3.9Å; F123-P135 HydrophobicContact CZ-CG 3.95Å
124	D	76.3	Confident	73.1	Confident	113 Å²	113	70.9 Å²	70.9	60%	0.604	37%	0.371	S	S	*	.	H	α-helix	trans	-62.9	-40.5	174	-74.8	-11.9	0	0	0	111.3	G120 D121 L122 G128	G120-D124 PolarHBondContact O-N 3.43Å; D121-D124 PolarHBondContact O-N 2.91Å; L122-D124 VanDerWaalsContact C-N 3.35Å; D124-G128 PolarHBondContact O-N 3.25Å
125	I	74.8	Confident	73.9	Confident	54 Å²	54	63.2 Å²	63.2	28%	0.277	34%	0.344	S	S	.	.	H	α-helix	trans	-66.4	-46.4	177	-70.6	156	0	0	0	111.5	T43 D121 L122 F123 S127 G128 Q129	T43-I125 HydrophobicContact CG2-CD1 3.28Å; T43-I125 HydrophobicContact CG2-CG1 4.14Å; T43-I125 HydrophobicContact CG2-CG2 4.06Å; D121-I125 VanDerWaalsContact O-CD1 3.27Å; D121-I125 WeakPolarHBondContact O-CD1 3.47Å; D121-I125 VanDerWaalsContact O-CG1 3.26Å; D121-I125 WeakPolarHBondContact O-CG1 3.45Å; D121-I125 PolarHBondContact O-N 3.28Å; L122-I125 PolarHBondContact O-N 2.78Å; F123-I125 VanDerWaalsContact C-N 3.33Å; F123-I125 PolarHBondContact O-N 3.12Å; I125-S127 VanDerWaalsContact C-N 3.33Å; I125-S127 PolarHBondContact O-N 3.5Å; I125-G128 PolarHBondContact O-N 2.87Å; I125-G128 VanDerWaalsContact O-N 3.12Å; I125-Q129 WeakPolarHBondContact O-CG 3.45Å; I125-Q129 PolarHBondContact O-N 2.9Å
126	M	70.5	Confident	74.7	Confident	76 Å²	76	59.6 Å²	59.6	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-44.5	178.5	-71.6	179.9	64.2	0	0	111.1	L122 F123 G128 Q129 T130 H134	L122-M126 HydrophobicContact CG-SD 4.45Å; L122-M126 WeakPolarHBondContact O-CG 3.44Å; L122-M126 PolarHBondContact O-N 3.05Å; F123-M126 PolarHBondContact O-N 3.43Å; M126-G128 PolarHBondContact O-N 3.21Å; M126-Q129 PolarHBondContact O-N 2.86Å; M126-Q129 VanDerWaalsContact O-N 3.15Å; M126-T130 PolarHBondContact O-N 2.99Å; M126-T130 PolarHBondContact O-OG1 3.16Å; M126-T130 VanDerWaalsContact O-OG1 3.09Å; M126-H134 HydrophobicContact CB-CB 4.09Å
127	S	79.5	Confident	75.5	Confident	22 Å²	22	58.5 Å²	58.5	15%	0.154	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-24.5	175.7	-49.2	0	0	0	0	113.4	F123 I125 H134	F123-S127 WeakPolarHBondContact O-CB 3.4Å; F123-S127 PolarHBondContact O-N 2.98Å; F123-S127 PolarHBondContact O-OG 3.31Å; I125-S127 VanDerWaalsContact C-N 3.33Å; I125-S127 PolarHBondContact O-N 3.5Å; S127-H134 PolarHBondContact OG-N 3.46Å; S127-H134 PolarHBondContact OG-O 3.14Å
128	G	73.8	Confident	76.2	Confident	65 Å²	65	59.4 Å²	59.4	67%	0.67	33%	0.334	S	S	*	.	H	α-helix	trans	-82.3	-14.6	176.4	0	0	0	0	0	114.4	D124 I125 M126	D124-G128 PolarHBondContact O-N 3.25Å; I125-G128 PolarHBondContact O-N 2.87Å; I125-G128 VanDerWaalsContact O-N 3.12Å; M126-G128 PolarHBondContact O-N 3.21Å
129	Q	72.1	Confident	77.1	Confident	105 Å²	105	64.2 Å²	64.2	49%	0.491	35%	0.353	S	S	.	.	H	α-helix	trans	-103.3	-19.8	-178.6	-66	-72.6	7.4	0	0	113	I125 M126	I125-Q129 WeakPolarHBondContact O-CG 3.45Å; I125-Q129 PolarHBondContact O-N 2.9Å; M126-Q129 PolarHBondContact O-N 2.86Å; M126-Q129 VanDerWaalsContact O-N 3.15Å
130	T	71.8	Confident	77.9	Confident	58 Å²	58	64.7 Å²	64.7	36%	0.356	36%	0.357	S	S	.	.	S	Bend	trans	-114.8	157.3	176.1	59.2	0	0	0	0	109.4	M126 V132 H134	M126-T130 PolarHBondContact O-N 2.99Å; M126-T130 PolarHBondContact O-OG1 3.16Å; M126-T130 VanDerWaalsContact O-OG1 3.09Å; T130-V132 PolarHBondContact O-N 3.17Å; T130-V132 PolarHBondContact OG1-O 3.23Å; T130-V132 VanDerWaalsContact OG1-O 3.11Å; T130-H134 PolarHBondContact OG1-CD2 2.83Å; T130-H134 VanDerWaalsContact OG1-CD2 3.3Å; T130-H134 PolarHBondContact OG1-NE2 2.94Å
131	D	72.6	Confident	78.5	Confident	178 Å²	178	66.3 Å²	66.3	95%	0.952	36%	0.363	S	S	*	.	S	Bend	trans	-75.1	14.8	175.1	-65.6	-28.7	0	0	0	112.7
132	V	78.1	Confident	79.4	Confident	45 Å²	45	66.7 Å²	66.7	27%	0.273	37%	0.365	S	S	.	.	S	Bend	trans	-133.1	127.4	-172.7	-172.6	0	0	0	0	111	T130 H134 L136 L144	T130-V132 PolarHBondContact O-N 3.17Å; T130-V132 PolarHBondContact OG1-O 3.23Å; T130-V132 VanDerWaalsContact OG1-O 3.11Å; V132-H134 PolarHBondContact O-CD2 2.95Å; V132-H134 PolarHBondContact O-N 3.48Å; V132-L136 HydrophobicContact CG1-CD1 3.85Å; V132-L136 HydrophobicContact CG1-CD2 4.42Å; V132-L136 HydrophobicContact CG1-CG 4.46Å; V132-L144 HydrophobicContact CB-CD2 4.34Å; V132-L144 HydrophobicContact CG1-CD2 4.13Å; V132-L144 HydrophobicContact CG2-CD1 4.24Å; V132-L144 HydrophobicContact CG2-CD2 3.84Å
133	D	79.2	Confident	80.2	Confident	107 Å²	107	69.1 Å²	69.1	57%	0.572	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-66.9	123.7	177.8	-64.3	-44	0	0	0	111.7	Q19	Q19-D133 HydrophobicContact CB-CB 3.8Å; Q19-D133 WeakPolarHBondContact CB-O 3.4Å; Q19-D133 HydrophobicContact CG-CB 3.95Å
134	H	79.2	Confident	80.8	Confident	38 Å²	38	70.2 Å²	70.2	18%	0.176	39%	0.387	C	S	.	.	S	Bend	trans	-98.3	153.3	175.7	-69.3	-84.4	0	0	0	111.2	Q19 M126 S127 T130 V132	Q19-H134 WeakPolarHBondContact CG-O 3.36Å; M126-H134 HydrophobicContact CB-CB 4.09Å; S127-H134 PolarHBondContact OG-N 3.46Å; S127-H134 PolarHBondContact OG-O 3.14Å; T130-H134 PolarHBondContact OG1-CD2 2.83Å; T130-H134 VanDerWaalsContact OG1-CD2 3.3Å; T130-H134 PolarHBondContact OG1-NE2 2.94Å; V132-H134 PolarHBondContact O-CD2 2.95Å; V132-H134 PolarHBondContact O-N 3.48Å
135	P	82.2	Confident	81.5	Confident	13 Å²	13	69.2 Å²	69.2	8%	0.084	38%	0.381	C	S	.	.	P	Polyproline II helix	cis	-84.6	150.4	-0.4	32.3	-33.2	0	0	0	113.2	C18 Q19 L25 F123	C18-P135 CarbonylContact C-O 3.53Å; C18-P135 VanDerWaalsContact CA-O 3.3Å; C18-P135 WeakPolarHBondContact CA-O 3.29Å; Q19-P135 PolarHBondContact N-O 3.04Å; L25-P135 HydrophobicContact CD1-CB 3.68Å; L25-P135 HydrophobicContact CD1-CG 3.38Å; F123-P135 HydrophobicContact CD1-CB 3.86Å; F123-P135 HydrophobicContact CD1-CG 4.16Å; F123-P135 HydrophobicContact CD2-CB 4.43Å; F123-P135 HydrophobicContact CD2-CG 3.85Å; F123-P135 HydrophobicContact CE1-CB 3.68Å; F123-P135 HydrophobicContact CE1-CG 4.13Å; F123-P135 HydrophobicContact CE2-CB 4.26Å; F123-P135 HydrophobicContact CE2-CG 3.8Å; F123-P135 HydrophobicContact CG-CB 4.25Å; F123-P135 HydrophobicContact CG-CG 4.05Å; F123-P135 HydrophobicContact CZ-CB 3.9Å; F123-P135 HydrophobicContact CZ-CG 3.95Å
136	L	80.9	Confident	82.4	Confident	24 Å²	24	71.8 Å²	71.8	13%	0.126	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-102	151.5	168.5	-62.3	175.8	0	0	0	109.4	R20 V132 C140 T141 L144	R20-L136 HydrophobicContact CB-CD2 3.62Å; V132-L136 HydrophobicContact CG1-CD1 3.85Å; V132-L136 HydrophobicContact CG1-CD2 4.42Å; V132-L136 HydrophobicContact CG1-CG 4.46Å; L136-C140 HydrophobicContact CB-CB 4.19Å; L136-C140 HydrophobicContact CD2-CB 4.34Å; L136-T141 WeakPolarHBondContact CB-OG1 3.34Å; L136-L144 HydrophobicContact CD1-CD2 4.15Å
137	C	85.6	Confident	83.3	Confident	19 Å²	19	73.1 Å²	73.1	13%	0.128	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-73.1	162.9	163.9	66.1	0	0	0	0	110.2	C18 L25 E139 C140 T141	C18-C137 HydrophobicContact CB-CB 4.18Å; C18-C137 PolarHBondContact SG-N 3.22Å; L25-C137 HydrophobicContact CD2-CB 3.72Å; C137-E139 VanDerWaalsContact C-N 3.34Å; C137-E139 PolarHBondContact O-N 3.21Å; C137-C140 PolarHBondContact O-N 2.9Å; C137-C140 VanDerWaalsContact O-N 3.12Å; C137-C140 VanDerWaalsContact SG-CB 3.57Å; C137-C140 PolarHBondContact SG-N 2.92Å; C137-C140 PolarHBondContact SG-SG 3.47Å; C137-T141 PolarHBondContact O-N 3.35Å; C137-T141 PolarHBondContact O-OG1 2.95Å
138	E	86.7	Confident	83.9	Confident	160 Å²	160	76 Å²	76	75%	0.748	41%	0.414	S	S	*	.	H	α-helix	trans	-49	-53.7	177.3	-172	174.2	179.7	0	0	111.2	C140 T141 D142	E138-C140 VanDerWaalsContact C-N 3.32Å; E138-C140 PolarHBondContact O-N 3.46Å; E138-T141 WeakPolarHBondContact O-CB 3.45Å; E138-T141 PolarHBondContact O-N 3.45Å; E138-D142 PolarHBondContact O-N 3.32Å
139	E	87.9	Confident	84.9	Confident	145 Å²	145	78 Å²	78	68%	0.678	41%	0.409	S	S	*	.	H	α-helix	trans	-57.8	-40.1	179.3	-58.7	-178.8	174.3	0	0	113.7	C137 T141 T143	C137-E139 VanDerWaalsContact C-N 3.34Å; C137-E139 PolarHBondContact O-N 3.21Å; E139-T141 VanDerWaalsContact C-N 3.31Å; E139-T143 WeakPolarHBondContact O-CB 3.23Å; E139-T143 PolarHBondContact O-N 2.85Å; E139-T143 VanDerWaalsContact O-N 3.15Å; E139-T143 PolarHBondContact O-OG1 3.43Å
140	C	88.1	Confident	86	Confident	14 Å²	14	77.3 Å²	77.3	10%	0.095	41%	0.412	C	S	.	.	H	α-helix	trans	-72.6	-27.3	179.5	-77.6	0	0	0	0	112.7	R20 L136 C137 E138 L144	R20-C140 HydrophobicContact CB-CB 4.13Å; R20-C140 HydrophobicContact CG-CB 4.41Å; R20-C140 PolarHBondContact NH1-O 3.49Å; R20-C140 VanDerWaalsContact NH1-O 3.14Å; L136-C140 HydrophobicContact CB-CB 4.19Å; L136-C140 HydrophobicContact CD2-CB 4.34Å; C137-C140 PolarHBondContact O-N 2.9Å; C137-C140 VanDerWaalsContact O-N 3.12Å; C137-C140 VanDerWaalsContact SG-CB 3.57Å; C137-C140 PolarHBondContact SG-N 2.92Å; C137-C140 PolarHBondContact SG-SG 3.47Å; E138-C140 VanDerWaalsContact C-N 3.32Å; E138-C140 PolarHBondContact O-N 3.46Å; C140-L144 PolarHBondContact O-N 3.42Å
141	T	86.4	Confident	87.1	Confident	53 Å²	53	80.7 Å²	80.7	33%	0.325	42%	0.424	S	S	.	.	H	α-helix	trans	-75.9	-47.4	177.8	-51.1	0	0	0	0	110	L136 C137 E138 E139 T143 L144 L145	L136-T141 WeakPolarHBondContact CB-OG1 3.34Å; C137-T141 PolarHBondContact O-N 3.35Å; C137-T141 PolarHBondContact O-OG1 2.95Å; E138-T141 WeakPolarHBondContact O-CB 3.45Å; E138-T141 PolarHBondContact O-N 3.45Å; E139-T141 VanDerWaalsContact C-N 3.31Å; T141-T143 VanDerWaalsContact C-N 3.29Å; T141-T143 PolarHBondContact O-N 2.91Å; T141-L144 WeakPolarHBondContact O-CB 3.16Å; T141-L144 PolarHBondContact O-N 2.88Å; T141-L145 HydrophobicContact CG2-CD1 4.48Å; T141-L145 WeakPolarHBondContact O-CG 3.08Å; T141-L145 PolarHBondContact O-N 2.81Å
142	D	91.4	Very high	88.1	Confident	85 Å²	85	77.7 Å²	77.7	46%	0.455	41%	0.407	S	S	.	.	H	α-helix	trans	-57.2	-45.7	175.7	-65.4	-20.6	0	0	0	110.8	E138 L144 L145 D146	E138-D142 PolarHBondContact O-N 3.32Å; D142-L144 VanDerWaalsContact C-N 3.25Å; D142-L144 PolarHBondContact O-N 3.22Å; D142-L145 PolarHBondContact O-N 2.75Å; D142-L145 VanDerWaalsContact O-N 3.14Å; D142-D146 PolarHBondContact O-N 2.88Å
143	T	90	Very high	89	Confident	63 Å²	63	80.6 Å²	80.6	39%	0.387	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-33.1	177.3	-53.4	0	0	0	0	112.8	E139 T141 Q147	E139-T143 WeakPolarHBondContact O-CB 3.23Å; E139-T143 PolarHBondContact O-N 2.85Å; E139-T143 VanDerWaalsContact O-N 3.15Å; E139-T143 PolarHBondContact O-OG1 3.43Å; T141-T143 VanDerWaalsContact C-N 3.29Å; T141-T143 PolarHBondContact O-N 2.91Å; T143-Q147 WeakPolarHBondContact O-CG 3.15Å; T143-Q147 PolarHBondContact O-N 2.89Å
144	L	89.1	Confident	89.8	Confident	38 Å²	38	79.3 Å²	79.3	20%	0.199	42%	0.417	C	S	.	.	H	α-helix	trans	-72.7	-41.4	177.1	174.5	68.5	0	0	0	111.1	V132 L136 C140 T141 D142 Q147 L148	V132-L144 HydrophobicContact CB-CD2 4.34Å; V132-L144 HydrophobicContact CG1-CD2 4.13Å; V132-L144 HydrophobicContact CG2-CD1 4.24Å; V132-L144 HydrophobicContact CG2-CD2 3.84Å; L136-L144 HydrophobicContact CD1-CD2 4.15Å; C140-L144 PolarHBondContact O-N 3.42Å; T141-L144 WeakPolarHBondContact O-CB 3.16Å; T141-L144 PolarHBondContact O-N 2.88Å; D142-L144 VanDerWaalsContact C-N 3.25Å; D142-L144 PolarHBondContact O-N 3.22Å; L144-Q147 PolarHBondContact O-N 2.97Å; L144-L148 HydrophobicContact CD1-CD1 4.46Å; L144-L148 HydrophobicContact CG-CD1 4.19Å; L144-L148 WeakPolarHBondContact O-CG 3.28Å; L144-L148 PolarHBondContact O-N 2.96Å
145	L	91.3	Very high	90.6	Very high	92 Å²	92	80.6 Å²	80.6	48%	0.482	43%	0.428	S	S	.	.	H	α-helix	trans	-61	-45.1	177.7	-67.5	172.4	0	0	0	111.1	T141 D142 Q147 L148 D149	T141-L145 HydrophobicContact CG2-CD1 4.48Å; T141-L145 WeakPolarHBondContact O-CG 3.08Å; T141-L145 PolarHBondContact O-N 2.81Å; D142-L145 PolarHBondContact O-N 2.75Å; D142-L145 VanDerWaalsContact O-N 3.14Å; L145-Q147 VanDerWaalsContact C-N 3.26Å; L145-Q147 PolarHBondContact O-N 3.39Å; L145-L148 PolarHBondContact O-N 3.09Å; L145-L148 VanDerWaalsContact O-N 3.16Å; L145-D149 PolarHBondContact O-N 3.47Å
146	D	94.3	Very high	91.2	Very high	107 Å²	107	85.3 Å²	85.3	57%	0.572	45%	0.449	S	S	*	.	H	α-helix	trans	-57.4	-38.4	175.9	-73	-19	0	0	0	112.7	D142 T150	D142-D146 PolarHBondContact O-N 2.88Å; D146-T150 PolarHBondContact O-N 3.47Å; D146-T150 VanDerWaalsContact O-N 3.16Å; D146-T150 PolarHBondContact O-OG1 3.46Å
147	Q	89.5	Confident	91.9	Very high	104 Å²	104	88 Å²	88	49%	0.486	46%	0.463	S	S	.	.	H	α-helix	trans	-68.7	-43	178	-73.9	178.2	-16.6	0	0	112	T143 L144 L145 T150 Q151	T143-Q147 WeakPolarHBondContact O-CG 3.15Å; T143-Q147 PolarHBondContact O-N 2.89Å; L144-Q147 PolarHBondContact O-N 2.97Å; L145-Q147 VanDerWaalsContact C-N 3.26Å; L145-Q147 PolarHBondContact O-N 3.39Å; Q147-T150 PolarHBondContact O-N 3.41Å; Q147-Q151 PolarHBondContact O-N 2.81Å; Q147-Q151 VanDerWaalsContact O-N 3.09Å
148	L	91.1	Very high	92.4	Very high	84 Å²	84	91.8 Å²	91.8	44%	0.44	48%	0.479	S	S	.	.	H	α-helix	trans	-64.9	-41.5	178.3	-70.3	171.6	0	0	0	111.4	L144 L145 T150 Q151 L152	L144-L148 HydrophobicContact CD1-CD1 4.46Å; L144-L148 HydrophobicContact CG-CD1 4.19Å; L144-L148 WeakPolarHBondContact O-CG 3.28Å; L144-L148 PolarHBondContact O-N 2.96Å; L145-L148 PolarHBondContact O-N 3.09Å; L145-L148 VanDerWaalsContact O-N 3.16Å; L148-T150 VanDerWaalsContact C-N 3.33Å; L148-T150 PolarHBondContact O-N 3.05Å; L148-Q151 PolarHBondContact O-N 2.88Å; L148-L152 WeakPolarHBondContact O-CB 3.37Å; L148-L152 WeakPolarHBondContact O-CG 3.41Å; L148-L152 PolarHBondContact O-N 3.34Å
149	D	95.4	Very high	92.7	Very high	106 Å²	106	87.3 Å²	87.3	57%	0.567	46%	0.464	S	S	*	.	H	α-helix	trans	-61.5	-41.7	175.5	-83.3	-10.3	0	0	0	111.9	L145 Q151 L152 N153	L145-D149 PolarHBondContact O-N 3.47Å; D149-Q151 VanDerWaalsContact C-N 3.35Å; D149-Q151 PolarHBondContact O-N 3.22Å; D149-L152 PolarHBondContact O-N 3.48Å; D149-N153 PolarHBondContact O-N 2.67Å
150	T	94.8	Very high	93	Very high	91 Å²	91	84.3 Å²	84.3	56%	0.558	45%	0.45	S	S	*	.	H	α-helix	trans	-61.9	-43.9	176.7	-53.9	0	0	0	0	111.4	D146 Q147 L148 N153 V154	D146-T150 PolarHBondContact O-N 3.47Å; D146-T150 VanDerWaalsContact O-N 3.16Å; D146-T150 PolarHBondContact O-OG1 3.46Å; Q147-T150 PolarHBondContact O-N 3.41Å; L148-T150 VanDerWaalsContact C-N 3.33Å; L148-T150 PolarHBondContact O-N 3.05Å; T150-N153 PolarHBondContact O-N 2.86Å; T150-V154 WeakPolarHBondContact O-CG2 3.48Å; T150-V154 PolarHBondContact O-N 2.93Å; T150-V154 VanDerWaalsContact O-N 3.15Å
151	Q	95.2	Very high	93.3	Very high	128 Å²	128	86.9 Å²	86.9	60%	0.598	46%	0.464	S	S	*	.	H	α-helix	trans	-68.6	-38.8	179.9	-173.6	174.3	-5.9	0	0	112.3	Q147 L148 D149 N153 V154 T155	Q147-Q151 PolarHBondContact O-N 2.81Å; Q147-Q151 VanDerWaalsContact O-N 3.09Å; L148-Q151 PolarHBondContact O-N 2.88Å; D149-Q151 VanDerWaalsContact C-N 3.35Å; D149-Q151 PolarHBondContact O-N 3.22Å; Q151-N153 VanDerWaalsContact C-N 3.32Å; Q151-N153 PolarHBondContact O-N 2.98Å; Q151-V154 PolarHBondContact O-N 2.95Å; Q151-T155 PolarHBondContact O-N 3.28Å; Q151-T155 PolarHBondContact O-OG1 3.46Å
152	L	94.8	Very high	93.4	Very high	115 Å²	115	91.9 Å²	91.9	60%	0.602	48%	0.478	S	S	*	.	H	α-helix	trans	-59	-45	173.9	-77.8	172	0	0	0	111.1	L148 D149 T155 E156	L148-L152 WeakPolarHBondContact O-CB 3.37Å; L148-L152 WeakPolarHBondContact O-CG 3.41Å; L148-L152 PolarHBondContact O-N 3.34Å; D149-L152 PolarHBondContact O-N 3.48Å; L152-T155 PolarHBondContact O-N 2.96Å; L152-E156 WeakPolarHBondContact O-CB 3.44Å; L152-E156 PolarHBondContact O-N 3.42Å
153	N	96.2	Very high	93.4	Very high	107 Å²	107	94.3 Å²	94.3	57%	0.572	48%	0.484	S	S	*	.	H	α-helix	trans	-64.6	-41.6	179.6	-169.2	16.5	0	0	0	113	D149 T150 Q151 T155 E156 N157	D149-N153 PolarHBondContact O-N 2.67Å; T150-N153 PolarHBondContact O-N 2.86Å; Q151-N153 VanDerWaalsContact C-N 3.32Å; Q151-N153 PolarHBondContact O-N 2.98Å; N153-T155 PolarHBondContact O-N 2.97Å; N153-E156 PolarHBondContact O-N 3.18Å; N153-N157 PolarHBondContact O-N 3.16Å
154	V	96.2	Very high	93.3	Very high	79 Å²	79	97.5 Å²	97.5	48%	0.479	49%	0.489	S	S	.	.	H	α-helix	trans	-60.8	-46.8	174.7	171.8	0	0	0	0	110.9	T150 Q151 E156 N157 E158	T150-V154 WeakPolarHBondContact O-CG2 3.48Å; T150-V154 PolarHBondContact O-N 2.93Å; T150-V154 VanDerWaalsContact O-N 3.15Å; Q151-V154 PolarHBondContact O-N 2.95Å; V154-E156 VanDerWaalsContact C-N 3.31Å; V154-E156 PolarHBondContact O-N 3.43Å; V154-N157 PolarHBondContact O-N 2.94Å; V154-E158 WeakPolarHBondContact O-CG 3.44Å; V154-E158 PolarHBondContact O-N 2.96Å
155	T	95.1	Very high	93.2	Very high	66 Å²	66	99 Å²	99	41%	0.405	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-38.7	-180	-47.6	0	0	0	0	110.9	Q151 L152 N153 E158 C159	Q151-T155 PolarHBondContact O-N 3.28Å; Q151-T155 PolarHBondContact O-OG1 3.46Å; L152-T155 PolarHBondContact O-N 2.96Å; N153-T155 PolarHBondContact O-N 2.97Å; T155-E158 PolarHBondContact O-N 3.25Å; T155-C159 WeakPolarHBondContact O-CB 3.37Å; T155-C159 PolarHBondContact O-N 3.45Å; T155-C159 PolarHBondContact O-SG 3.37Å; T155-C159 VanDerWaalsContact O-SG 3.39Å
156	E	95.7	Very high	92.9	Very high	111 Å²	111	99.6 Å²	99.6	52%	0.519	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-44.6	175.1	-173.2	176.7	-173.8	0	0	111.8	L152 N153 V154 C159 Q160	L152-E156 WeakPolarHBondContact O-CB 3.44Å; L152-E156 PolarHBondContact O-N 3.42Å; N153-E156 PolarHBondContact O-N 3.18Å; V154-E156 VanDerWaalsContact C-N 3.31Å; V154-E156 PolarHBondContact O-N 3.43Å; E156-C159 WeakPolarHBondContact O-CB 3.29Å; E156-C159 PolarHBondContact O-N 2.97Å; E156-Q160 WeakPolarHBondContact O-CG 3.47Å; E156-Q160 PolarHBondContact O-N 3.36Å
157	N	95.8	Very high	92.6	Very high	81 Å²	81	99.6 Å²	99.6	43%	0.433	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-41.9	177.3	-171.9	18.6	0	0	0	112.1	N153 V154 Q160 N161	N153-N157 PolarHBondContact O-N 3.16Å; V154-N157 PolarHBondContact O-N 2.94Å; N157-Q160 PolarHBondContact O-N 3.37Å; N157-N161 VanDerWaalsContact O-CG 3.27Å; N157-N161 PolarHBondContact O-N 3.07Å; N157-N161 PolarHBondContact O-ND2 3.28Å; N157-N161 VanDerWaalsContact O-ND2 3.09Å; N157-N161 PolarHBondContact OD1-ND2 3.12Å
158	E	95.5	Very high	92.3	Very high	98 Å²	98	99.4 Å²	99.4	46%	0.458	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-46.8	172.6	-71.3	179.9	175.3	0	0	111.5	V154 T155 Q160 N161 Y162	V154-E158 WeakPolarHBondContact O-CG 3.44Å; V154-E158 PolarHBondContact O-N 2.96Å; T155-E158 PolarHBondContact O-N 3.25Å; E158-Q160 VanDerWaalsContact C-N 3.32Å; E158-Q160 PolarHBondContact O-N 2.96Å; E158-N161 PolarHBondContact O-N 2.72Å; E158-Y162 HydrophobicContact CB-CE2 4.22Å; E158-Y162 WeakPolarHBondContact O-CD2 3.43Å; E158-Y162 PolarHBondContact O-N 3.39Å
159	C	92.5	Very high	91.7	Very high	66 Å²	66	100.7 Å²	100.7	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-59.8	-40.2	175.4	-75.4	0	0	0	0	112.6	T155 E156 Y162 K163	T155-C159 WeakPolarHBondContact O-CB 3.37Å; T155-C159 PolarHBondContact O-N 3.45Å; T155-C159 PolarHBondContact O-SG 3.37Å; T155-C159 VanDerWaalsContact O-SG 3.39Å; E156-C159 WeakPolarHBondContact O-CB 3.29Å; E156-C159 PolarHBondContact O-N 2.97Å; C159-Y162 PolarHBondContact O-N 3.21Å; C159-K163 WeakPolarHBondContact O-CG 3.49Å; C159-K163 PolarHBondContact O-N 2.72Å
160	Q	94.2	Very high	91.1	Very high	82 Å²	82	103.4 Å²	103.4	38%	0.383	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-42	175.4	-72.7	178.1	14.3	0	0	111.7	E156 N157 E158 K163 R164	E156-Q160 WeakPolarHBondContact O-CG 3.47Å; E156-Q160 PolarHBondContact O-N 3.36Å; N157-Q160 PolarHBondContact O-N 3.37Å; E158-Q160 VanDerWaalsContact C-N 3.32Å; E158-Q160 PolarHBondContact O-N 2.96Å; Q160-K163 PolarHBondContact O-N 2.86Å; Q160-R164 PolarHBondContact O-N 2.87Å
161	N	93.8	Very high	90.4	Very high	69 Å²	69	106.6 Å²	106.6	37%	0.369	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-44.2	175.8	-68.7	-34.4	0	0	0	111.5	N157 E158 K163 R164 C165	N157-N161 VanDerWaalsContact O-CG 3.27Å; N157-N161 PolarHBondContact O-N 3.07Å; N157-N161 PolarHBondContact O-ND2 3.28Å; N157-N161 VanDerWaalsContact O-ND2 3.09Å; N157-N161 PolarHBondContact OD1-ND2 3.12Å; E158-N161 PolarHBondContact O-N 2.72Å; N161-K163 VanDerWaalsContact C-N 3.35Å; N161-K163 PolarHBondContact O-N 3.44Å; N161-R164 PolarHBondContact O-N 2.88Å; N161-R164 PolarHBondContact OD1-NH1 2.96Å; N161-C165 PolarHBondContact O-N 2.76Å; N161-C165 PolarHBondContact O-SG 3.38Å
162	Y	89.7	Confident	89.3	Confident	158 Å²	158	104 Å²	104	62%	0.62	52%	0.516	S	S	*	.	H	α-helix	trans	-62.8	-39	175	-69.2	-54.8	0	0	0	112.9	E158 C159 C165 L166	E158-Y162 HydrophobicContact CB-CE2 4.22Å; E158-Y162 WeakPolarHBondContact O-CD2 3.43Å; E158-Y162 PolarHBondContact O-N 3.39Å; C159-Y162 PolarHBondContact O-N 3.21Å; Y162-C165 PolarHBondContact O-N 3.2Å; Y162-L166 WeakPolarHBondContact O-CG 3.41Å; Y162-L166 PolarHBondContact O-N 3.46Å
163	K	91.3	Very high	88.4	Confident	136 Å²	136	102.2 Å²	102.2	59%	0.591	51%	0.507	S	S	*	.	H	α-helix	trans	-61	-48.6	174.4	-79.3	-179.2	179.7	-177.9	0	111.9	C159 Q160 N161 C165 L166 E167	C159-K163 WeakPolarHBondContact O-CG 3.49Å; C159-K163 PolarHBondContact O-N 2.72Å; Q160-K163 PolarHBondContact O-N 2.86Å; N161-K163 VanDerWaalsContact C-N 3.35Å; N161-K163 PolarHBondContact O-N 3.44Å; K163-C165 VanDerWaalsContact C-N 3.27Å; K163-C165 PolarHBondContact O-N 2.93Å; K163-L166 WeakPolarHBondContact O-CB 3.32Å; K163-L166 PolarHBondContact O-N 3.01Å; K163-E167 WeakPolarHBondContact O-CG 3.41Å; K163-E167 PolarHBondContact O-N 3.45Å
164	R	88.4	Confident	87.3	Confident	130 Å²	130	104.1 Å²	104.1	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-58	-41.4	175.4	-71.2	-175.8	-169.1	126.4	2.4	111.8	Q160 N161 L166 E167 I168	Q160-R164 PolarHBondContact O-N 2.87Å; N161-R164 PolarHBondContact O-N 2.88Å; N161-R164 PolarHBondContact OD1-NH1 2.96Å; R164-L166 PolarHBondContact O-N 3.49Å; R164-E167 PolarHBondContact O-N 3.45Å; R164-I168 WeakPolarHBondContact O-CD1 3.38Å; R164-I168 VanDerWaalsContact O-CG1 3.26Å; R164-I168 WeakPolarHBondContact O-CG1 3.46Å; R164-I168 PolarHBondContact O-N 2.97Å
165	C	85.6	Confident	86.4	Confident	70 Å²	70	106 Å²	106	47%	0.473	52%	0.52	S	S	.	.	H	α-helix	trans	-62.6	-40.2	175.1	-68.3	0	0	0	0	112.5	N161 Y162 K163 L169	N161-C165 PolarHBondContact O-N 2.76Å; N161-C165 PolarHBondContact O-SG 3.38Å; Y162-C165 PolarHBondContact O-N 3.2Å; K163-C165 VanDerWaalsContact C-N 3.27Å; K163-C165 PolarHBondContact O-N 2.93Å; C165-L169 VanDerWaalsContact O-CG 3.28Å; C165-L169 WeakPolarHBondContact O-CG 3.2Å; C165-L169 PolarHBondContact O-N 3.2Å
166	L	86.3	Confident	85.7	Confident	103 Å²	103	105.4 Å²	105.4	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-65.4	-43.8	175.8	-77	167.9	0	0	0	112	Y162 K163 R164 I168 L169 E170	Y162-L166 WeakPolarHBondContact O-CG 3.41Å; Y162-L166 PolarHBondContact O-N 3.46Å; K163-L166 WeakPolarHBondContact O-CB 3.32Å; K163-L166 PolarHBondContact O-N 3.01Å; R164-L166 PolarHBondContact O-N 3.49Å; L166-I168 VanDerWaalsContact C-N 3.32Å; L166-I168 PolarHBondContact O-N 3.21Å; L166-L169 PolarHBondContact O-N 3.35Å; L166-L169 VanDerWaalsContact O-N 3.16Å; L166-E170 PolarHBondContact O-N 2.93Å
167	E	87.8	Confident	84.9	Confident	107 Å²	107	102.2 Å²	102.2	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-59.2	-43.3	176.5	-72.6	165.5	-165	0	0	111.6	K163 R164 E170 Q171	K163-E167 WeakPolarHBondContact O-CG 3.41Å; K163-E167 PolarHBondContact O-N 3.45Å; R164-E167 PolarHBondContact O-N 3.45Å; E167-E170 PolarHBondContact O-N 2.88Å; E167-Q171 WeakPolarHBondContact O-CG 2.99Å; E167-Q171 PolarHBondContact O-N 2.85Å
168	I	83.3	Confident	84.5	Confident	100 Å²	100	104.5 Å²	104.5	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-45.9	174.9	-67.2	165	0	0	0	110.3	R164 L166 E170 Q171 M172	R164-I168 WeakPolarHBondContact O-CD1 3.38Å; R164-I168 VanDerWaalsContact O-CG1 3.26Å; R164-I168 WeakPolarHBondContact O-CG1 3.46Å; R164-I168 PolarHBondContact O-N 2.97Å; L166-I168 VanDerWaalsContact C-N 3.32Å; L166-I168 PolarHBondContact O-N 3.21Å; I168-E170 VanDerWaalsContact C-N 3.34Å; I168-E170 PolarHBondContact O-N 2.85Å; I168-Q171 PolarHBondContact O-N 2.98Å; I168-M172 HydrophobicContact CG2-CG 4.36Å; I168-M172 HydrophobicContact CG2-SD 4.23Å; I168-M172 VanDerWaalsContact O-CG 3.31Å; I168-M172 WeakPolarHBondContact O-CG 3.29Å; I168-M172 PolarHBondContact O-N 3.41Å
169	L	78.8	Confident	84.1	Confident	111 Å²	111	105.5 Å²	105.5	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-64.6	-34.2	179.5	-73.8	169.7	0	0	0	113.4	C165 L166 Q171 M172	C165-L169 VanDerWaalsContact O-CG 3.28Å; C165-L169 WeakPolarHBondContact O-CG 3.2Å; C165-L169 PolarHBondContact O-N 3.2Å; L166-L169 PolarHBondContact O-N 3.35Å; L166-L169 VanDerWaalsContact O-N 3.16Å; L169-Q171 VanDerWaalsContact C-N 3.31Å; L169-M172 HydrophobicContact CD2-SD 4Å
170	E	81.3	Confident	83.9	Confident	163 Å²	163	106.8 Å²	106.8	76%	0.762	52%	0.519	S	S	*	.	H	α-helix	trans	-69.5	-29	175.5	-75.8	-178.3	175	0	0	112.5	L166 E167 I168	L166-E170 PolarHBondContact O-N 2.93Å; E167-E170 PolarHBondContact O-N 2.88Å; I168-E170 VanDerWaalsContact C-N 3.34Å; I168-E170 PolarHBondContact O-N 2.85Å
171	Q	79.7	Confident	83.6	Confident	158 Å²	158	108 Å²	108	74%	0.738	53%	0.525	S	S	*	.	H	α-helix	trans	-85.7	-23.2	177.3	-69.5	175.7	13	0	0	113.3	E167 I168 L169	E167-Q171 WeakPolarHBondContact O-CG 2.99Å; E167-Q171 PolarHBondContact O-N 2.85Å; I168-Q171 PolarHBondContact O-N 2.98Å; L169-Q171 VanDerWaalsContact C-N 3.31Å
172	M	73.2	Confident	83.5	Confident	73 Å²	73	110.7 Å²	110.7	36%	0.36	54%	0.537	S	S	.	.			trans	-63.5	133.7	178	-78.6	177.4	75	0	0	111.3	I168 L169 D176 L180	I168-M172 HydrophobicContact CG2-CG 4.36Å; I168-M172 HydrophobicContact CG2-SD 4.23Å; I168-M172 VanDerWaalsContact O-CG 3.31Å; I168-M172 WeakPolarHBondContact O-CG 3.29Å; I168-M172 PolarHBondContact O-N 3.41Å; L169-M172 HydrophobicContact CD2-SD 4Å; M172-D176 WeakPolarHBondContact CA-OD2 3.47Å; M172-D176 HydrophobicContact CE-CB 4.47Å; M172-L180 HydrophobicContact CE-CD1 3.95Å
173	N	75.5	Confident	83.7	Confident	79 Å²	79	107.7 Å²	107.7	42%	0.422	53%	0.528	S	S	.	.			trans	-103.6	170.3	174.1	57	39.8	0	0	0	110.7	D175 D176 S177	N173-D175 PolarHBondContact O-N 3.06Å; N173-D175 WeakPolarHBondContact OD1-CB 3.45Å; N173-D175 PolarHBondContact OD1-N 3.35Å; N173-D176 PolarHBondContact N-OD2 2.79Å; N173-D176 VanDerWaalsContact N-OD2 3.1Å; N173-D176 PolarHBondContact O-N 2.95Å; N173-D176 PolarHBondContact OD1-N 2.89Å; N173-D176 PolarHBondContact OD1-OD1 3.36Å; N173-D176 PolarHBondContact OD1-OD2 3.39Å; N173-D176 VanDerWaalsContact OD1-OD2 3.1Å; N173-S177 PolarHBondContact O-N 2.85Å
174	E	73.8	Confident	83.8	Confident	147 Å²	147	107 Å²	107	69%	0.687	53%	0.53	S	S	*	.	H	α-helix	trans	-61.2	-31.1	175.3	-74.2	-76.2	174.6	0	0	111.8	D176 S177 E178	E174-D176 VanDerWaalsContact C-N 3.34Å; E174-D176 PolarHBondContact O-N 3.33Å; E174-S177 WeakPolarHBondContact O-CB 3.48Å; E174-S177 PolarHBondContact O-N 3.22Å; E174-E178 PolarHBondContact O-N 3.16Å
175	D	76	Confident	84.1	Confident	117 Å²	117	107.2 Å²	107.2	63%	0.626	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-37.8	177.9	-66	-10.8	0	0	0	111.6	N173 E178 Q179	N173-D175 PolarHBondContact O-N 3.06Å; N173-D175 WeakPolarHBondContact OD1-CB 3.45Å; N173-D175 PolarHBondContact OD1-N 3.35Å; D175-E178 PolarHBondContact O-N 3.32Å; D175-Q179 WeakPolarHBondContact O-CB 3.3Å; D175-Q179 PolarHBondContact O-N 2.92Å
176	D	80.7	Confident	84.6	Confident	55 Å²	55	110.3 Å²	110.3	29%	0.294	54%	0.542	S	S	.	.	H	α-helix	trans	-65.9	-39.8	176.7	-62.6	-33.4	0	0	0	111	M172 N173 E174 Q179 L180	M172-D176 WeakPolarHBondContact CA-OD2 3.47Å; M172-D176 HydrophobicContact CE-CB 4.47Å; N173-D176 PolarHBondContact N-OD2 2.79Å; N173-D176 VanDerWaalsContact N-OD2 3.1Å; N173-D176 PolarHBondContact O-N 2.95Å; N173-D176 PolarHBondContact OD1-N 2.89Å; N173-D176 PolarHBondContact OD1-OD1 3.36Å; N173-D176 PolarHBondContact OD1-OD2 3.39Å; N173-D176 VanDerWaalsContact OD1-OD2 3.1Å; E174-D176 VanDerWaalsContact C-N 3.34Å; E174-D176 PolarHBondContact O-N 3.33Å; D176-Q179 PolarHBondContact O-N 3.39Å; D176-L180 WeakPolarHBondContact O-CB 3.31Å; D176-L180 VanDerWaalsContact O-CG 3.29Å; D176-L180 WeakPolarHBondContact O-CG 3.46Å; D176-L180 PolarHBondContact O-N 3.23Å
177	S	80.2	Confident	85.1	Confident	44 Å²	44	110.3 Å²	110.3	31%	0.308	54%	0.542	S	S	.	.	H	α-helix	trans	-65.2	-43.5	175.7	176.2	0	0	0	0	111.3	N173 E174 L180 Q181	N173-S177 PolarHBondContact O-N 2.85Å; E174-S177 WeakPolarHBondContact O-CB 3.48Å; E174-S177 PolarHBondContact O-N 3.22Å; S177-L180 PolarHBondContact O-N 3.17Å; S177-Q181 WeakPolarHBondContact O-CB 3.38Å; S177-Q181 WeakPolarHBondContact O-CG 3.37Å; S177-Q181 PolarHBondContact O-N 2.81Å
178	E	86.3	Confident	85.5	Confident	128 Å²	128	107.4 Å²	107.4	60%	0.598	54%	0.537	S	S	*	.	H	α-helix	trans	-64.3	-40.5	174.6	-70.3	-167.9	173.9	0	0	111.9	E174 D175 Q181 M182	E174-E178 PolarHBondContact O-N 3.16Å; D175-E178 PolarHBondContact O-N 3.32Å; E178-Q181 PolarHBondContact O-N 2.94Å; E178-M182 WeakPolarHBondContact O-CB 3.45Å; E178-M182 PolarHBondContact O-N 2.98Å
179	Q	88	Confident	86.1	Confident	119 Å²	119	109 Å²	109	56%	0.556	55%	0.545	S	S	*	.	H	α-helix	trans	-62.7	-46.8	175.9	-175.5	175.3	-10.4	0	0	111.7	D175 D176 Q181 M182 E183	D175-Q179 WeakPolarHBondContact O-CB 3.3Å; D175-Q179 PolarHBondContact O-N 2.92Å; D176-Q179 PolarHBondContact O-N 3.39Å; Q179-Q181 VanDerWaalsContact C-N 3.34Å; Q179-Q181 PolarHBondContact O-N 3.45Å; Q179-M182 WeakPolarHBondContact O-CB 3.4Å; Q179-M182 PolarHBondContact O-N 2.75Å; Q179-E183 PolarHBondContact O-N 3.15Å
180	L	86.7	Confident	87	Confident	93 Å²	93	106.4 Å²	106.4	49%	0.487	53%	0.531	S	S	.	.	H	α-helix	trans	-63.2	-38.1	176.2	-74.4	169	0	0	0	112	M172 D176 S177 M182 E183 L184	M172-L180 HydrophobicContact CE-CD1 3.95Å; D176-L180 WeakPolarHBondContact O-CB 3.31Å; D176-L180 VanDerWaalsContact O-CG 3.29Å; D176-L180 WeakPolarHBondContact O-CG 3.46Å; D176-L180 PolarHBondContact O-N 3.23Å; S177-L180 PolarHBondContact O-N 3.17Å; L180-M182 VanDerWaalsContact C-N 3.34Å; L180-E183 PolarHBondContact O-N 3.14Å; L180-L184 VanDerWaalsContact O-CB 3.31Å; L180-L184 WeakPolarHBondContact O-CB 3.3Å; L180-L184 PolarHBondContact O-N 2.9Å
181	Q	89.7	Confident	87.7	Confident	109 Å²	109	104.7 Å²	104.7	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-67.4	-35.2	174.5	-76	-176.3	19.3	0	0	112.6	S177 E178 Q179 K185	S177-Q181 WeakPolarHBondContact O-CB 3.38Å; S177-Q181 WeakPolarHBondContact O-CG 3.37Å; S177-Q181 PolarHBondContact O-N 2.81Å; E178-Q181 PolarHBondContact O-N 2.94Å; Q179-Q181 VanDerWaalsContact C-N 3.34Å; Q179-Q181 PolarHBondContact O-N 3.45Å; Q181-K185 VanDerWaalsContact O-CG 3.31Å; Q181-K185 WeakPolarHBondContact O-CG 3.19Å; Q181-K185 PolarHBondContact O-N 3.35Å; Q181-K185 VanDerWaalsContact O-N 3.13Å
182	M	91.9	Very high	88.5	Confident	125 Å²	125	101.9 Å²	101.9	62%	0.616	51%	0.509	S	S	*	.	H	α-helix	trans	-67.3	-44.8	174.2	-173.7	174.2	62.9	0	0	110.9	E178 Q179 L180 K185 E186	E178-M182 WeakPolarHBondContact O-CB 3.45Å; E178-M182 PolarHBondContact O-N 2.98Å; Q179-M182 WeakPolarHBondContact O-CB 3.4Å; Q179-M182 PolarHBondContact O-N 2.75Å; L180-M182 VanDerWaalsContact C-N 3.34Å; M182-K185 PolarHBondContact O-N 2.88Å; M182-E186 PolarHBondContact O-N 2.95Å
183	E	94	Very high	89.6	Confident	95 Å²	95	105.1 Å²	105.1	44%	0.444	52%	0.518	S	S	.	.	H	α-helix	trans	-62.1	-43.5	175.4	-175	176.6	-178.7	0	0	111.7	Q179 L180 K185 E186 L187	Q179-E183 PolarHBondContact O-N 3.15Å; L180-E183 PolarHBondContact O-N 3.14Å; E183-K185 VanDerWaalsContact C-N 3.3Å; E183-K185 PolarHBondContact O-N 2.86Å; E183-E186 PolarHBondContact O-N 3.02Å; E183-E186 VanDerWaalsContact O-N 3.15Å; E183-L187 HydrophobicContact CG-CD1 4.06Å; E183-L187 HydrophobicContact CG-CG 4.38Å; E183-L187 WeakPolarHBondContact O-CB 3.43Å; E183-L187 WeakPolarHBondContact O-CG 3.45Å; E183-L187 PolarHBondContact O-N 3.13Å
184	L	93.2	Very high	90.7	Very high	121 Å²	121	105.5 Å²	105.5	63%	0.634	52%	0.519	S	S	*	.	H	α-helix	trans	-61.1	-39.6	176.6	-168.8	153.2	0	0	0	111.5	L180 A188	L180-L184 VanDerWaalsContact O-CB 3.31Å; L180-L184 WeakPolarHBondContact O-CB 3.3Å; L180-L184 PolarHBondContact O-N 2.9Å; L184-A188 VanDerWaalsContact O-CB 3.27Å; L184-A188 WeakPolarHBondContact O-CB 3.5Å; L184-A188 PolarHBondContact O-N 3.1Å
185	K	94.9	Very high	91.8	Very high	134 Å²	134	102 Å²	102	58%	0.583	50%	0.504	S	S	*	.	H	α-helix	trans	-66.9	-40.2	174.4	-74.2	171	-174.7	166.6	0	112.1	Q181 M182 E183 A188 L189	Q181-K185 VanDerWaalsContact O-CG 3.31Å; Q181-K185 WeakPolarHBondContact O-CG 3.19Å; Q181-K185 PolarHBondContact O-N 3.35Å; Q181-K185 VanDerWaalsContact O-N 3.13Å; M182-K185 PolarHBondContact O-N 2.88Å; E183-K185 VanDerWaalsContact C-N 3.3Å; E183-K185 PolarHBondContact O-N 2.86Å; K185-A188 PolarHBondContact O-N 3.11Å; K185-L189 WeakPolarHBondContact O-CG 3.26Å; K185-L189 PolarHBondContact O-N 2.88Å; K185-L189 VanDerWaalsContact O-N 3.08Å
186	E	96.2	Very high	92.8	Very high	136 Å²	136	101.2 Å²	101.2	64%	0.636	50%	0.497	S	S	*	.	H	α-helix	trans	-64	-47.9	176.4	-175.6	173.5	-176.2	0	0	111.3	M182 E183 A188 L189 E190	M182-E186 PolarHBondContact O-N 2.95Å; E183-E186 PolarHBondContact O-N 3.02Å; E183-E186 VanDerWaalsContact O-N 3.15Å; E186-A188 VanDerWaalsContact C-N 3.33Å; E186-A188 PolarHBondContact O-N 3.43Å; E186-L189 PolarHBondContact O-N 3.19Å; E186-E190 PolarHBondContact O-N 2.94Å
187	L	96.3	Very high	93.6	Very high	102 Å²	102	104 Å²	104	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-38.8	176.1	-72.8	173.8	0	0	0	112.2	E183 L189 E190 E191	E183-L187 HydrophobicContact CG-CD1 4.06Å; E183-L187 HydrophobicContact CG-CG 4.38Å; E183-L187 WeakPolarHBondContact O-CB 3.43Å; E183-L187 WeakPolarHBondContact O-CG 3.45Å; E183-L187 PolarHBondContact O-N 3.13Å; L187-L189 VanDerWaalsContact C-N 3.35Å; L187-E190 PolarHBondContact O-N 3.47Å; L187-E191 WeakPolarHBondContact O-CB 3.34Å; L187-E191 PolarHBondContact O-N 2.87Å
188	A	96.3	Very high	94.4	Very high	47 Å²	47	106.7 Å²	106.7	39%	0.388	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-36.8	175.9	0	0	0	0	0	112.4	L184 K185 E186 E192	L184-A188 VanDerWaalsContact O-CB 3.27Å; L184-A188 WeakPolarHBondContact O-CB 3.5Å; L184-A188 PolarHBondContact O-N 3.1Å; K185-A188 PolarHBondContact O-N 3.11Å; E186-A188 VanDerWaalsContact C-N 3.33Å; E186-A188 PolarHBondContact O-N 3.43Å; A188-E192 PolarHBondContact O-N 2.94Å; A188-E192 VanDerWaalsContact O-N 3.15Å
189	L	96.4	Very high	94.9	Very high	132 Å²	132	105.4 Å²	105.4	69%	0.691	51%	0.513	S	S	*	.	H	α-helix	trans	-68.8	-37.5	173.2	-71.9	172	0	0	0	111.9	K185 E186 L187 R193	K185-L189 WeakPolarHBondContact O-CG 3.26Å; K185-L189 PolarHBondContact O-N 2.88Å; K185-L189 VanDerWaalsContact O-N 3.08Å; E186-L189 PolarHBondContact O-N 3.19Å; L187-L189 VanDerWaalsContact C-N 3.35Å; L189-R193 WeakPolarHBondContact O-CB 3.45Å; L189-R193 PolarHBondContact O-N 3.43Å
190	E	96.2	Very high	95.3	Very high	58 Å²	58	103.7 Å²	103.7	27%	0.271	51%	0.507	S	S	.	.	H	α-helix	trans	-66.1	-44.5	175.2	-178	58.4	-149.9	0	0	111.7	E186 L187 E192 R193 L194	E186-E190 PolarHBondContact O-N 2.94Å; L187-E190 PolarHBondContact O-N 3.47Å; E190-E192 PolarHBondContact O-N 3.31Å; E190-R193 VanDerWaalsContact CD-CZ 3.5Å; E190-R193 WeakPolarHBondContact O-CB 3.44Å; E190-R193 PolarHBondContact O-N 2.8Å; E190-R193 IonicContact OE1-CZ 3.37Å; E190-R193 VanDerWaalsContact OE1-CZ 3.31Å; E190-R193 IonicContact OE1-NE 3.72Å; E190-R193 PolarHBondContact OE1-NE 3Å; E190-R193 IonicContact OE1-NH2 3.42Å; E190-R193 PolarHBondContact OE1-NH2 3.5Å; E190-R193 IonicContact OE2-CZ 2.72Å; E190-R193 IonicContact OE2-NE 3.73Å; E190-R193 PolarHBondContact OE2-NE 3.25Å; E190-R193 IonicContact OE2-NH1 2.76Å; E190-R193 PolarHBondContact OE2-NH1 2.96Å; E190-R193 IonicContact OE2-NH2 2.87Å; E190-R193 PolarHBondContact OE2-NH2 3.45Å; E190-L194 HydrophobicContact CG-CD1 4.02Å; E190-L194 HydrophobicContact CG-CG 4.44Å; E190-L194 WeakPolarHBondContact O-CB 3.5Å; E190-L194 WeakPolarHBondContact O-CG 3.47Å; E190-L194 PolarHBondContact O-N 3.13Å; E190-L194 WeakPolarHBondContact OE1-CG 3.5Å
191	E	96.1	Very high	95.9	Very high	127 Å²	127	103.4 Å²	103.4	59%	0.593	51%	0.509	S	S	*	.	H	α-helix	trans	-56.7	-49.8	175.5	-178.8	-179.7	-171.2	0	0	110.7	L187 R193 L194 I195	L187-E191 WeakPolarHBondContact O-CB 3.34Å; L187-E191 PolarHBondContact O-N 2.87Å; E191-R193 VanDerWaalsContact C-N 3.32Å; E191-R193 PolarHBondContact O-N 3.34Å; E191-L194 PolarHBondContact O-N 3.21Å; E191-I195 HydrophobicContact CG-CD1 3.86Å; E191-I195 VanDerWaalsContact O-CG1 3.26Å; E191-I195 WeakPolarHBondContact O-CG1 3.32Å; E191-I195 PolarHBondContact O-N 3.42Å
192	E	96.4	Very high	96.2	Very high	99 Å²	99	102.5 Å²	102.5	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-41.5	177.2	179.4	59.9	-150.3	0	0	111.8	A188 E190 I195 Q196	A188-E192 PolarHBondContact O-N 2.94Å; A188-E192 VanDerWaalsContact O-N 3.15Å; E190-E192 PolarHBondContact O-N 3.31Å; E192-I195 PolarHBondContact O-N 3.17Å; E192-Q196 WeakPolarHBondContact O-CG 3.25Å; E192-Q196 PolarHBondContact O-N 3.06Å; E192-Q196 VanDerWaalsContact O-N 3.09Å; E192-Q196 PolarHBondContact OE1-NE2 3.35Å
193	R	97.7	Very high	96.4	Very high	141 Å²	141	101.4 Å²	101.4	53%	0.532	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-45.7	176.3	-173.4	-175	74.6	-177.9	4.8	111.8	L189 E190 E191 I195 Q196 E197	L189-R193 WeakPolarHBondContact O-CB 3.45Å; L189-R193 PolarHBondContact O-N 3.43Å; E190-R193 VanDerWaalsContact CD-CZ 3.5Å; E190-R193 WeakPolarHBondContact O-CB 3.44Å; E190-R193 PolarHBondContact O-N 2.8Å; E190-R193 IonicContact OE1-CZ 3.37Å; E190-R193 VanDerWaalsContact OE1-CZ 3.31Å; E190-R193 IonicContact OE1-NE 3.72Å; E190-R193 PolarHBondContact OE1-NE 3Å; E190-R193 IonicContact OE1-NH2 3.42Å; E190-R193 PolarHBondContact OE1-NH2 3.5Å; E190-R193 IonicContact OE2-CZ 2.72Å; E190-R193 IonicContact OE2-NE 3.73Å; E190-R193 PolarHBondContact OE2-NE 3.25Å; E190-R193 IonicContact OE2-NH1 2.76Å; E190-R193 PolarHBondContact OE2-NH1 2.96Å; E190-R193 IonicContact OE2-NH2 2.87Å; E190-R193 PolarHBondContact OE2-NH2 3.45Å; E191-R193 VanDerWaalsContact C-N 3.32Å; E191-R193 PolarHBondContact O-N 3.34Å; R193-I195 VanDerWaalsContact C-N 3.35Å; R193-Q196 PolarHBondContact O-N 2.88Å; R193-E197 PolarHBondContact O-N 3.17Å
194	L	97.6	Very high	96.6	Very high	86 Å²	86	101.5 Å²	101.5	45%	0.45	50%	0.5	S	S	.	.	H	α-helix	trans	-67	-36	179.8	-72.2	172.1	0	0	0	111.9	E190 E191 E197 L198	E190-L194 HydrophobicContact CG-CD1 4.02Å; E190-L194 HydrophobicContact CG-CG 4.44Å; E190-L194 WeakPolarHBondContact O-CB 3.5Å; E190-L194 WeakPolarHBondContact O-CG 3.47Å; E190-L194 PolarHBondContact O-N 3.13Å; E190-L194 WeakPolarHBondContact OE1-CG 3.5Å; E191-L194 PolarHBondContact O-N 3.21Å; L194-E197 PolarHBondContact O-N 3.39Å; L194-L198 VanDerWaalsContact O-CB 3.3Å; L194-L198 WeakPolarHBondContact O-CB 3.45Å; L194-L198 PolarHBondContact O-N 2.89Å
195	I	96.7	Very high	96.8	Very high	73 Å²	73	103.1 Å²	103.1	37%	0.374	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-47.4	173.7	-71.4	167.7	0	0	0	110.1	E191 E192 R193 E197 L198 E199	E191-I195 HydrophobicContact CG-CD1 3.86Å; E191-I195 VanDerWaalsContact O-CG1 3.26Å; E191-I195 WeakPolarHBondContact O-CG1 3.32Å; E191-I195 PolarHBondContact O-N 3.42Å; E192-I195 PolarHBondContact O-N 3.17Å; R193-I195 VanDerWaalsContact C-N 3.35Å; I195-E197 PolarHBondContact O-N 2.7Å; I195-L198 PolarHBondContact O-N 2.84Å; I195-E199 WeakPolarHBondContact O-CG 3.38Å; I195-E199 PolarHBondContact O-N 3.29Å
196	Q	96.8	Very high	96.9	Very high	101 Å²	101	102.2 Å²	102.2	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-61.1	-42.9	176.9	-69.7	173.5	12.3	0	0	112.1	E192 R193 E199 D200	E192-Q196 WeakPolarHBondContact O-CG 3.25Å; E192-Q196 PolarHBondContact O-N 3.06Å; E192-Q196 VanDerWaalsContact O-N 3.09Å; E192-Q196 PolarHBondContact OE1-NE2 3.35Å; R193-Q196 PolarHBondContact O-N 2.88Å; Q196-E199 PolarHBondContact O-N 3.37Å; Q196-D200 PolarHBondContact O-N 3.47Å; Q196-D200 VanDerWaalsContact O-N 3.11Å
197	E	97.7	Very high	97	Very high	113 Å²	113	100 Å²	100	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-62.2	-43.6	175.6	-174.1	175.7	177.9	0	0	111.7	R193 L194 I195 E199 D200 V201	R193-E197 PolarHBondContact O-N 3.17Å; L194-E197 PolarHBondContact O-N 3.39Å; I195-E197 PolarHBondContact O-N 2.7Å; E197-E199 PolarHBondContact O-N 3.08Å; E197-D200 PolarHBondContact O-N 2.81Å; E197-V201 VanDerWaalsContact O-CG2 3.31Å; E197-V201 WeakPolarHBondContact O-CG2 3.36Å; E197-V201 PolarHBondContact O-N 2.83Å
198	L	96.7	Very high	97.1	Very high	102 Å²	102	99.6 Å²	99.6	53%	0.534	49%	0.487	S	S	.	.	H	α-helix	trans	-63.5	-41.9	178.2	-171.3	128.6	0	0	0	111.6	L194 I195 D200 V201 E202	L194-L198 VanDerWaalsContact O-CB 3.3Å; L194-L198 WeakPolarHBondContact O-CB 3.45Å; L194-L198 PolarHBondContact O-N 2.89Å; I195-L198 PolarHBondContact O-N 2.84Å; L198-D200 VanDerWaalsContact C-N 3.33Å; L198-D200 PolarHBondContact O-N 3.13Å; L198-V201 PolarHBondContact O-N 3.1Å; L198-E202 HydrophobicContact CD2-CG 4.4Å; L198-E202 WeakPolarHBondContact O-CB 3.44Å; L198-E202 WeakPolarHBondContact O-CG 3.24Å; L198-E202 PolarHBondContact O-N 2.83Å
199	E	97.2	Very high	97.1	Very high	101 Å²	101	99.7 Å²	99.7	47%	0.472	49%	0.488	S	S	.	.	H	α-helix	trans	-59.8	-41.8	174.7	-74.9	-172.8	178.8	0	0	112.4	I195 Q196 E197 E202 K203	I195-E199 WeakPolarHBondContact O-CG 3.38Å; I195-E199 PolarHBondContact O-N 3.29Å; Q196-E199 PolarHBondContact O-N 3.37Å; E197-E199 PolarHBondContact O-N 3.08Å; E199-E202 PolarHBondContact O-N 3.29Å; E199-K203 VanDerWaalsContact O-CG 3.28Å; E199-K203 WeakPolarHBondContact O-CG 3.46Å; E199-K203 PolarHBondContact O-N 3.49Å
200	D	97.6	Very high	97.2	Very high	83 Å²	83	98.6 Å²	98.6	44%	0.444	48%	0.479	S	S	.	.	H	α-helix	trans	-70.5	-38.8	178.3	-75.8	-12.8	0	0	0	112.1	Q196 E197 L198 E202 K203 N204	Q196-D200 PolarHBondContact O-N 3.47Å; Q196-D200 VanDerWaalsContact O-N 3.11Å; E197-D200 PolarHBondContact O-N 2.81Å; L198-D200 VanDerWaalsContact C-N 3.33Å; L198-D200 PolarHBondContact O-N 3.13Å; D200-E202 VanDerWaalsContact C-N 3.33Å; D200-E202 PolarHBondContact O-N 3.33Å; D200-K203 PolarHBondContact O-N 3.46Å; D200-K203 IonicContact OD1-NZ 3.46Å; D200-K203 PolarHBondContact OD1-NZ 3.01Å; D200-N204 WeakPolarHBondContact O-CB 3.49Å; D200-N204 VanDerWaalsContact O-CG 3.25Å; D200-N204 PolarHBondContact O-N 3.21Å; D200-N204 PolarHBondContact O-ND2 3.09Å
201	V	97.6	Very high	97.3	Very high	86 Å²	86	99.6 Å²	99.6	52%	0.521	49%	0.487	S	S	.	.	H	α-helix	trans	-61.8	-41.5	171.5	170.9	0	0	0	0	110.9	E197 L198 N204 R205	E197-V201 VanDerWaalsContact O-CG2 3.31Å; E197-V201 WeakPolarHBondContact O-CG2 3.36Å; E197-V201 PolarHBondContact O-N 2.83Å; L198-V201 PolarHBondContact O-N 3.1Å; V201-N204 PolarHBondContact O-N 2.91Å; V201-R205 WeakPolarHBondContact O-CB 3.47Å; V201-R205 PolarHBondContact O-N 3.39Å
202	E	96.5	Very high	97.3	Very high	90 Å²	90	98.1 Å²	98.1	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-65.9	-41	176.9	-77.8	-166.5	175.3	0	0	113	L198 E199 D200 N204 R205 K206	L198-E202 HydrophobicContact CD2-CG 4.4Å; L198-E202 WeakPolarHBondContact O-CB 3.44Å; L198-E202 WeakPolarHBondContact O-CG 3.24Å; L198-E202 PolarHBondContact O-N 2.83Å; E199-E202 PolarHBondContact O-N 3.29Å; D200-E202 VanDerWaalsContact C-N 3.33Å; D200-E202 PolarHBondContact O-N 3.33Å; E202-N204 VanDerWaalsContact C-N 3.34Å; E202-R205 PolarHBondContact O-N 3.03Å; E202-K206 WeakPolarHBondContact O-CG 3.34Å; E202-K206 PolarHBondContact O-N 3.04Å; E202-K206 VanDerWaalsContact O-N 3.08Å
203	K	97.5	Very high	97.4	Very high	103 Å²	103	100.1 Å²	100.1	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-58.8	-47.6	172.3	-71	166.9	-156.5	153.3	0	110.3	E199 D200 R205 K206 I207	E199-K203 VanDerWaalsContact O-CG 3.28Å; E199-K203 WeakPolarHBondContact O-CG 3.46Å; E199-K203 PolarHBondContact O-N 3.49Å; D200-K203 PolarHBondContact O-N 3.46Å; D200-K203 IonicContact OD1-NZ 3.46Å; D200-K203 PolarHBondContact OD1-NZ 3.01Å; K203-R205 PolarHBondContact O-N 3.47Å; K203-K206 PolarHBondContact O-N 2.93Å; K203-I207 WeakPolarHBondContact O-CG1 3.32Å; K203-I207 PolarHBondContact O-N 3.24Å
204	N	97.8	Very high	97.4	Very high	97 Å²	97	99.6 Å²	99.6	52%	0.519	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-42	178.2	-72.3	-28.5	0	0	0	112.2	D200 V201 E202 K206 I207 V208	D200-N204 WeakPolarHBondContact O-CB 3.49Å; D200-N204 VanDerWaalsContact O-CG 3.25Å; D200-N204 PolarHBondContact O-N 3.21Å; D200-N204 PolarHBondContact O-ND2 3.09Å; V201-N204 PolarHBondContact O-N 2.91Å; E202-N204 VanDerWaalsContact C-N 3.34Å; N204-K206 VanDerWaalsContact C-N 3.31Å; N204-K206 PolarHBondContact O-N 3.18Å; N204-I207 PolarHBondContact O-N 3.41Å; N204-V208 WeakPolarHBondContact O-CB 3.27Å; N204-V208 VanDerWaalsContact O-CG2 3.29Å; N204-V208 WeakPolarHBondContact O-CG2 3.42Å; N204-V208 PolarHBondContact O-N 3.47Å
205	R	97.1	Very high	97.4	Very high	155 Å²	155	99.8 Å²	99.8	59%	0.585	50%	0.498	S	S	*	.	H	α-helix	trans	-59.1	-42.2	176.5	-171	-172.4	68.3	79.1	-2.7	111.7	V201 E202 K203 A209	V201-R205 WeakPolarHBondContact O-CB 3.47Å; V201-R205 PolarHBondContact O-N 3.39Å; E202-R205 PolarHBondContact O-N 3.03Å; K203-R205 PolarHBondContact O-N 3.47Å; R205-A209 WeakPolarHBondContact O-CB 3.34Å; R205-A209 PolarHBondContact O-N 2.89Å
206	K	96.9	Very high	97.5	Very high	114 Å²	114	101.3 Å²	101.3	50%	0.496	50%	0.503	S	S	.	.	H	α-helix	trans	-63.6	-47.3	176.6	-70.7	170.9	-175	167.8	0	111.2	E202 K203 N204 V208 A209 E210	E202-K206 WeakPolarHBondContact O-CG 3.34Å; E202-K206 PolarHBondContact O-N 3.04Å; E202-K206 VanDerWaalsContact O-N 3.08Å; K203-K206 PolarHBondContact O-N 2.93Å; N204-K206 VanDerWaalsContact C-N 3.31Å; N204-K206 PolarHBondContact O-N 3.18Å; K206-V208 PolarHBondContact O-N 2.9Å; K206-A209 PolarHBondContact O-N 3.49Å; K206-E210 WeakPolarHBondContact O-CG 3.46Å; K206-E210 PolarHBondContact O-N 3.44Å
207	I	97.9	Very high	97.5	Very high	89 Å²	89	99.2 Å²	99.2	46%	0.456	50%	0.503	S	S	.	.	H	α-helix	trans	-59.9	-45.8	177.5	-65.9	164.8	0	0	0	111.3	K203 N204 E210 N211	K203-I207 WeakPolarHBondContact O-CG1 3.32Å; K203-I207 PolarHBondContact O-N 3.24Å; N204-I207 PolarHBondContact O-N 3.41Å; I207-E210 PolarHBondContact O-N 3.39Å; I207-N211 WeakPolarHBondContact O-CB 3.35Å; I207-N211 VanDerWaalsContact O-CG 3.27Å; I207-N211 PolarHBondContact O-N 2.88Å; I207-N211 PolarHBondContact O-ND2 3.31Å
208	V	98	Very high	97.6	Very high	94 Å²	94	98.8 Å²	98.8	57%	0.57	50%	0.501	S	S	*	.	H	α-helix	trans	-64.8	-41.1	179.3	171.6	0	0	0	0	111.1	N204 K206 N211 L212	N204-V208 WeakPolarHBondContact O-CB 3.27Å; N204-V208 VanDerWaalsContact O-CG2 3.29Å; N204-V208 WeakPolarHBondContact O-CG2 3.42Å; N204-V208 PolarHBondContact O-N 3.47Å; K206-V208 PolarHBondContact O-N 2.9Å; V208-N211 PolarHBondContact O-N 2.68Å; V208-L212 WeakPolarHBondContact O-CB 3.47Å; V208-L212 PolarHBondContact O-N 2.83Å
209	A	97.5	Very high	97.6	Very high	49 Å²	49	96 Å²	96	41%	0.405	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-45.8	177.2	0	0	0	0	0	112	R205 K206 N211 L212 E213	R205-A209 WeakPolarHBondContact O-CB 3.34Å; R205-A209 PolarHBondContact O-N 2.89Å; K206-A209 PolarHBondContact O-N 3.49Å; A209-N211 VanDerWaalsContact C-N 3.33Å; A209-N211 PolarHBondContact O-N 2.95Å; A209-L212 PolarHBondContact O-N 3.22Å; A209-E213 PolarHBondContact O-N 3.14Å; A209-E213 VanDerWaalsContact O-N 3.07Å
210	E	97.3	Very high	97.7	Very high	110 Å²	110	97.1 Å²	97.1	51%	0.514	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-39	176	-71.6	178.3	-167.1	0	0	112.4	K206 I207 K214	K206-E210 WeakPolarHBondContact O-CG 3.46Å; K206-E210 PolarHBondContact O-N 3.44Å; I207-E210 PolarHBondContact O-N 3.39Å; E210-K214 VanDerWaalsContact O-CG 3.31Å; E210-K214 WeakPolarHBondContact O-CG 3.27Å; E210-K214 PolarHBondContact O-N 3.03Å; E210-K214 VanDerWaalsContact O-N 3.17Å
211	N	98.3	Very high	97.7	Very high	79 Å²	79	98.7 Å²	98.7	42%	0.422	50%	0.498	S	S	.	.	H	α-helix	trans	-69.2	-38.9	177.2	-72	-22.1	0	0	0	112	I207 V208 A209 K214 V215	I207-N211 WeakPolarHBondContact O-CB 3.35Å; I207-N211 VanDerWaalsContact O-CG 3.27Å; I207-N211 PolarHBondContact O-N 2.88Å; I207-N211 PolarHBondContact O-ND2 3.31Å; V208-N211 PolarHBondContact O-N 2.68Å; A209-N211 VanDerWaalsContact C-N 3.33Å; A209-N211 PolarHBondContact O-N 2.95Å; N211-K214 PolarHBondContact O-N 3.41Å; N211-V215 VanDerWaalsContact O-CG2 3.31Å; N211-V215 WeakPolarHBondContact O-CG2 3.25Å; N211-V215 PolarHBondContact O-N 3.38Å
212	L	97	Very high	97.8	Very high	96 Å²	96	98.5 Å²	98.5	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-45.2	176.8	-177.8	64.7	0	0	0	111	V208 A209 K214 V215 Q216	V208-L212 WeakPolarHBondContact O-CB 3.47Å; V208-L212 PolarHBondContact O-N 2.83Å; A209-L212 PolarHBondContact O-N 3.22Å; L212-K214 PolarHBondContact O-N 3Å; L212-V215 PolarHBondContact O-N 2.71Å; L212-Q216 HydrophobicContact CD1-CG 4.39Å; L212-Q216 WeakPolarHBondContact O-CB 3.34Å; L212-Q216 VanDerWaalsContact O-CG 3.29Å; L212-Q216 WeakPolarHBondContact O-CG 3.48Å; L212-Q216 PolarHBondContact O-N 2.97Å
213	E	97.5	Very high	97.9	Very high	140 Å²	140	99.2 Å²	99.2	65%	0.654	50%	0.5	S	S	*	.	H	α-helix	trans	-60.3	-44.7	176.8	-173.6	179.7	-179.5	0	0	111.6	A209 V215 Q216 A217	A209-E213 PolarHBondContact O-N 3.14Å; A209-E213 VanDerWaalsContact O-N 3.07Å; E213-V215 PolarHBondContact O-N 2.89Å; E213-Q216 PolarHBondContact O-N 2.86Å; E213-A217 WeakPolarHBondContact O-CB 3.47Å; E213-A217 PolarHBondContact O-N 3.42Å
214	K	97.9	Very high	97.9	Very high	130 Å²	130	100.9 Å²	100.9	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-60.4	-45.7	176.4	-71.8	169	-170.4	164.8	0	112.3	E210 N211 L212 A217 E218	E210-K214 VanDerWaalsContact O-CG 3.31Å; E210-K214 WeakPolarHBondContact O-CG 3.27Å; E210-K214 PolarHBondContact O-N 3.03Å; E210-K214 VanDerWaalsContact O-N 3.17Å; N211-K214 PolarHBondContact O-N 3.41Å; L212-K214 PolarHBondContact O-N 3Å; K214-A217 PolarHBondContact O-N 3.34Å; K214-E218 WeakPolarHBondContact O-CB 3.37Å; K214-E218 PolarHBondContact O-N 3.28Å
215	V	98.2	Very high	97.9	Very high	91 Å²	91	100.7 Å²	100.7	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-67.4	-39	-179.8	171.1	0	0	0	0	111.2	N211 L212 E213 E218 A219	N211-V215 VanDerWaalsContact O-CG2 3.31Å; N211-V215 WeakPolarHBondContact O-CG2 3.25Å; N211-V215 PolarHBondContact O-N 3.38Å; L212-V215 PolarHBondContact O-N 2.71Å; E213-V215 PolarHBondContact O-N 2.89Å; V215-E218 PolarHBondContact O-N 2.89Å; V215-A219 WeakPolarHBondContact O-CB 3.32Å; V215-A219 PolarHBondContact O-N 3.18Å
216	Q	98.2	Very high	98	Very high	105 Å²	105	98.2 Å²	98.2	49%	0.491	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-46.4	175.9	-75.6	175.8	-18.1	0	0	111.6	L212 E213 E218 A219 E220	L212-Q216 HydrophobicContact CD1-CG 4.39Å; L212-Q216 WeakPolarHBondContact O-CB 3.34Å; L212-Q216 VanDerWaalsContact O-CG 3.29Å; L212-Q216 WeakPolarHBondContact O-CG 3.48Å; L212-Q216 PolarHBondContact O-N 2.97Å; E213-Q216 PolarHBondContact O-N 2.86Å; Q216-E218 VanDerWaalsContact C-N 3.29Å; Q216-E218 PolarHBondContact O-N 2.99Å; Q216-A219 PolarHBondContact O-N 3.06Å; Q216-E220 WeakPolarHBondContact O-CG 3.31Å; Q216-E220 PolarHBondContact O-N 2.93Å
217	A	97.8	Very high	98.1	Very high	57 Å²	57	94.3 Å²	94.3	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-62.1	-37.1	176.1	0	0	0	0	0	112.4	E213 K214 R221	E213-A217 WeakPolarHBondContact O-CB 3.47Å; E213-A217 PolarHBondContact O-N 3.42Å; K214-A217 PolarHBondContact O-N 3.34Å; A217-R221 PolarHBondContact O-N 3.3Å; A217-R221 VanDerWaalsContact O-N 3.15Å
218	E	98.4	Very high	98.1	Very high	103 Å²	103	95.1 Å²	95.1	48%	0.481	49%	0.492	S	S	.	.	H	α-helix	trans	-68	-41.9	175	-175	170.4	-165.1	0	0	112.3	K214 V215 Q216 R221 L222	K214-E218 WeakPolarHBondContact O-CB 3.37Å; K214-E218 PolarHBondContact O-N 3.28Å; V215-E218 PolarHBondContact O-N 2.89Å; Q216-E218 VanDerWaalsContact C-N 3.29Å; Q216-E218 PolarHBondContact O-N 2.99Å; E218-R221 PolarHBondContact O-N 2.92Å; E218-R221 IonicContact OE1-NH2 2.75Å; E218-L222 HydrophobicContact CG-CD1 4.22Å; E218-L222 WeakPolarHBondContact O-CG 3.39Å; E218-L222 PolarHBondContact O-N 3.31Å
219	A	98.2	Very high	98.1	Very high	45 Å²	45	97.8 Å²	97.8	37%	0.372	49%	0.493	S	S	.	.	H	α-helix	trans	-61	-46.4	176.5	0	0	0	0	0	111.6	V215 Q216 R221 L222 D223	V215-A219 WeakPolarHBondContact O-CB 3.32Å; V215-A219 PolarHBondContact O-N 3.18Å; Q216-A219 PolarHBondContact O-N 3.06Å; A219-R221 VanDerWaalsContact C-N 3.3Å; A219-R221 PolarHBondContact O-N 3.41Å; A219-L222 PolarHBondContact O-N 3.47Å; A219-D223 PolarHBondContact O-N 3.42Å
220	E	98.2	Very high	98.1	Very high	123 Å²	123	100.3 Å²	100.3	58%	0.575	50%	0.496	S	S	*	.	H	α-helix	trans	-61.4	-38	176.7	-71.7	179.2	-175.8	0	0	112.5	Q216 Q224	Q216-E220 WeakPolarHBondContact O-CG 3.31Å; Q216-E220 PolarHBondContact O-N 2.93Å; E220-Q224 VanDerWaalsContact O-CG 3.3Å; E220-Q224 WeakPolarHBondContact O-CG 3.45Å; E220-Q224 PolarHBondContact O-N 3.15Å
221	R	98.4	Very high	98.2	Very high	116 Å²	116	103.3 Å²	103.3	44%	0.438	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-45.1	174.7	-175.7	-175.9	66	92.3	-0.1	111.3	A217 E218 A219 Q224 E225	A217-R221 PolarHBondContact O-N 3.3Å; A217-R221 VanDerWaalsContact O-N 3.15Å; E218-R221 PolarHBondContact O-N 2.92Å; E218-R221 IonicContact OE1-NH2 2.75Å; A219-R221 VanDerWaalsContact C-N 3.3Å; A219-R221 PolarHBondContact O-N 3.41Å; R221-Q224 PolarHBondContact O-N 2.98Å; R221-E225 IonicContact CZ-OE1 2.61Å; R221-E225 IonicContact NH1-OE1 2.67Å; R221-E225 PolarHBondContact NH1-OE1 3.34Å; R221-E225 IonicContact NH1-OE2 3.44Å; R221-E225 WeakPolarHBondContact O-CG 3.5Å; R221-E225 PolarHBondContact O-N 3.03Å
222	L	98.6	Very high	98.2	Very high	82 Å²	82	103.4 Å²	103.4	43%	0.429	50%	0.501	S	S	.	.	H	α-helix	trans	-63.6	-40.6	178.6	-72.2	172.5	0	0	0	111.8	E218 A219 Q224 E225 E226	E218-L222 HydrophobicContact CG-CD1 4.22Å; E218-L222 WeakPolarHBondContact O-CG 3.39Å; E218-L222 PolarHBondContact O-N 3.31Å; A219-L222 PolarHBondContact O-N 3.47Å; L222-Q224 VanDerWaalsContact C-N 3.29Å; L222-Q224 PolarHBondContact O-N 2.83Å; L222-E225 PolarHBondContact O-N 2.9Å; L222-E226 WeakPolarHBondContact O-CB 3.48Å; L222-E226 PolarHBondContact O-N 3.36Å
223	D	98.6	Very high	98.2	Very high	105 Å²	105	105 Å²	105	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-61.5	-38.4	176.7	-75	-13	0	0	0	111.8	A219 A227	A219-D223 PolarHBondContact O-N 3.42Å; D223-A227 WeakPolarHBondContact O-CB 3.46Å; D223-A227 PolarHBondContact O-N 2.94Å
224	Q	97.9	Very high	98.3	Very high	138 Å²	138	101.8 Å²	101.8	65%	0.645	49%	0.494	S	S	*	.	H	α-helix	trans	-67.6	-43.4	175.7	-69.9	171.3	29.6	0	0	112	E220 R221 L222 A227 Q228	E220-Q224 VanDerWaalsContact O-CG 3.3Å; E220-Q224 WeakPolarHBondContact O-CG 3.45Å; E220-Q224 PolarHBondContact O-N 3.15Å; R221-Q224 PolarHBondContact O-N 2.98Å; L222-Q224 VanDerWaalsContact C-N 3.29Å; L222-Q224 PolarHBondContact O-N 2.83Å; Q224-A227 PolarHBondContact O-N 3.42Å; Q224-Q228 PolarHBondContact O-N 3.32Å
225	E	98.4	Very high	98.3	Very high	93 Å²	93	100.4 Å²	100.4	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-63.5	-41.9	176	-74.2	176.6	-166.6	0	0	111.3	R221 L222 Q228 Y229	R221-E225 IonicContact CZ-OE1 2.61Å; R221-E225 IonicContact NH1-OE1 2.67Å; R221-E225 PolarHBondContact NH1-OE1 3.34Å; R221-E225 IonicContact NH1-OE2 3.44Å; R221-E225 WeakPolarHBondContact O-CG 3.5Å; R221-E225 PolarHBondContact O-N 3.03Å; L222-E225 PolarHBondContact O-N 2.9Å; E225-Q228 PolarHBondContact O-N 3.41Å; E225-Y229 WeakPolarHBondContact O-CB 3.49Å; E225-Y229 PolarHBondContact O-N 3.43Å
226	E	98.5	Very high	98.3	Very high	103 Å²	103	102.3 Å²	102.3	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-62.9	-46.5	175.7	-172.4	-178.6	170.9	0	0	111	L222 Q228 Y229 Q230	L222-E226 WeakPolarHBondContact O-CB 3.48Å; L222-E226 PolarHBondContact O-N 3.36Å; E226-Q228 VanDerWaalsContact C-N 3.26Å; E226-Q228 PolarHBondContact O-N 3.07Å; E226-Y229 PolarHBondContact O-N 3.2Å; E226-Q230 HydrophobicContact CG-CG 4.29Å; E226-Q230 WeakPolarHBondContact O-CB 3.2Å; E226-Q230 VanDerWaalsContact O-CG 3.3Å; E226-Q230 WeakPolarHBondContact O-CG 3.32Å; E226-Q230 PolarHBondContact O-N 3.2Å; E226-Q230 PolarHBondContact OE1-NE2 2.94Å
227	A	98.3	Very high	98.3	Very high	33 Å²	33	101.1 Å²	101.1	27%	0.273	48%	0.484	S	S	.	.	H	α-helix	trans	-60.8	-36.9	177.8	0	0	0	0	0	112.1	D223 Q224 R231	D223-A227 WeakPolarHBondContact O-CB 3.46Å; D223-A227 PolarHBondContact O-N 2.94Å; Q224-A227 PolarHBondContact O-N 3.42Å; A227-R231 WeakPolarHBondContact O-CG 3.45Å; A227-R231 PolarHBondContact O-N 2.94Å
228	Q	98	Very high	98.4	Very high	105 Å²	105	104 Å²	104	49%	0.491	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-49.6	173.4	-179.8	175	-15.1	0	0	111.2	Q224 E225 E226 Q230 R231 E232	Q224-Q228 PolarHBondContact O-N 3.32Å; E225-Q228 PolarHBondContact O-N 3.41Å; E226-Q228 VanDerWaalsContact C-N 3.26Å; E226-Q228 PolarHBondContact O-N 3.07Å; Q228-Q230 VanDerWaalsContact C-N 3.29Å; Q228-Q230 PolarHBondContact O-N 3.33Å; Q228-R231 WeakPolarHBondContact O-CB 3.44Å; Q228-R231 PolarHBondContact O-N 3.45Å; Q228-R231 VanDerWaalsContact O-N 3.08Å; Q228-E232 WeakPolarHBondContact CG-OE1 3.37Å; Q228-E232 PolarHBondContact NE2-OE1 3.05Å; Q228-E232 PolarHBondContact O-N 3.28Å
229	Y	98.1	Very high	98.4	Very high	150 Å²	150	103 Å²	103	59%	0.588	48%	0.478	S	S	*	.	H	α-helix	trans	-57.3	-41.6	178.6	176.3	-100.4	0	0	0	112.1	E225 E226 R231 E232 Y233	E225-Y229 WeakPolarHBondContact O-CB 3.49Å; E225-Y229 PolarHBondContact O-N 3.43Å; E226-Y229 PolarHBondContact O-N 3.2Å; Y229-R231 VanDerWaalsContact C-N 3.32Å; Y229-R231 PolarHBondContact O-N 3.35Å; Y229-E232 PolarHBondContact O-N 2.9Å; Y229-Y233 VanDerWaalsContact O-CB 3.3Å; Y229-Y233 WeakPolarHBondContact O-CB 3.42Å; Y229-Y233 PolarHBondContact O-N 3.01Å
230	Q	98.4	Very high	98.4	Very high	102 Å²	102	105.4 Å²	105.4	48%	0.477	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-36.1	177.5	-73.1	-179.3	13.3	0	0	112.5	E226 Q228 S234	E226-Q230 HydrophobicContact CG-CG 4.29Å; E226-Q230 WeakPolarHBondContact O-CB 3.2Å; E226-Q230 VanDerWaalsContact O-CG 3.3Å; E226-Q230 WeakPolarHBondContact O-CG 3.32Å; E226-Q230 PolarHBondContact O-N 3.2Å; E226-Q230 PolarHBondContact OE1-NE2 2.94Å; Q228-Q230 VanDerWaalsContact C-N 3.29Å; Q228-Q230 PolarHBondContact O-N 3.33Å; Q230-S234 WeakPolarHBondContact O-CB 3.21Å; Q230-S234 PolarHBondContact O-N 3.43Å; Q230-S234 PolarHBondContact O-OG 3.02Å
231	R	98.4	Very high	98.4	Very high	174 Å²	174	104.3 Å²	104.3	66%	0.657	48%	0.479	S	S	*	.	H	α-helix	trans	-66.5	-48.3	174.8	-69.1	174.1	-158.3	141.2	6	111.1	A227 Q228 Y229 S234 E235	A227-R231 WeakPolarHBondContact O-CG 3.45Å; A227-R231 PolarHBondContact O-N 2.94Å; Q228-R231 WeakPolarHBondContact O-CB 3.44Å; Q228-R231 PolarHBondContact O-N 3.45Å; Q228-R231 VanDerWaalsContact O-N 3.08Å; Y229-R231 VanDerWaalsContact C-N 3.32Å; Y229-R231 PolarHBondContact O-N 3.35Å; R231-S234 PolarHBondContact O-N 3.47Å; R231-E235 PolarHBondContact O-N 3.2Å
232	E	98.4	Very high	98.4	Very high	81 Å²	81	103.1 Å²	103.1	38%	0.379	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-46.4	178.4	-68.3	176.8	-165.3	0	0	110.9	Q228 Y229 S234 E235 F236	Q228-E232 WeakPolarHBondContact CG-OE1 3.37Å; Q228-E232 PolarHBondContact NE2-OE1 3.05Å; Q228-E232 PolarHBondContact O-N 3.28Å; Y229-E232 PolarHBondContact O-N 2.9Å; E232-S234 VanDerWaalsContact C-N 3.32Å; E232-S234 PolarHBondContact O-N 3.13Å; E232-E235 PolarHBondContact O-N 2.94Å; E232-F236 HydrophobicContact CB-CD2 4.49Å; E232-F236 HydrophobicContact CB-CE2 4.28Å; E232-F236 WeakPolarHBondContact O-CD2 3.32Å; E232-F236 PolarHBondContact O-N 3.12Å
233	Y	98.5	Very high	98.4	Very high	129 Å²	129	104.4 Å²	104.4	51%	0.506	49%	0.485	S	S	.	.	H	α-helix	trans	-57.5	-44.6	175	176.3	-97.4	0	0	0	112.1	Y229 E235 F236 K237	Y229-Y233 VanDerWaalsContact O-CB 3.3Å; Y229-Y233 WeakPolarHBondContact O-CB 3.42Å; Y229-Y233 PolarHBondContact O-N 3.01Å; Y233-E235 VanDerWaalsContact C-N 3.32Å; Y233-E235 PolarHBondContact O-N 3.44Å; Y233-F236 PolarHBondContact O-N 3.25Å; Y233-K237 VanDerWaalsContact O-CB 3.3Å; Y233-K237 WeakPolarHBondContact O-CB 3.39Å; Y233-K237 PolarHBondContact O-N 3.18Å
234	S	98.2	Very high	98.4	Very high	73 Å²	73	102.6 Å²	102.6	51%	0.51	48%	0.475	S	S	.	.	H	α-helix	trans	-64	-38.7	178.5	-60.6	0	0	0	0	111.8	Q230 R231 E232 K237 R238	Q230-S234 WeakPolarHBondContact O-CB 3.21Å; Q230-S234 PolarHBondContact O-N 3.43Å; Q230-S234 PolarHBondContact O-OG 3.02Å; R231-S234 PolarHBondContact O-N 3.47Å; E232-S234 VanDerWaalsContact C-N 3.32Å; E232-S234 PolarHBondContact O-N 3.13Å; S234-K237 PolarHBondContact O-N 2.73Å; S234-R238 PolarHBondContact O-N 3.41Å
235	E	98.4	Very high	98.4	Very high	101 Å²	101	101.3 Å²	101.3	47%	0.472	47%	0.473	S	S	.	.	H	α-helix	trans	-65.7	-49.8	175.5	-176.5	174.3	-172.8	0	0	111.8	R231 E232 Y233 K237 R238 Q239	R231-E235 PolarHBondContact O-N 3.2Å; E232-E235 PolarHBondContact O-N 2.94Å; Y233-E235 VanDerWaalsContact C-N 3.32Å; Y233-E235 PolarHBondContact O-N 3.44Å; E235-K237 PolarHBondContact O-N 3.41Å; E235-R238 WeakPolarHBondContact O-CB 3.39Å; E235-R238 PolarHBondContact O-N 3.47Å; E235-R238 VanDerWaalsContact O-N 3.16Å; E235-Q239 WeakPolarHBondContact O-CG 3.42Å; E235-Q239 PolarHBondContact O-N 3.46Å; E235-Q239 PolarHBondContact OE1-NE2 3.36Å
236	F	98.5	Very high	98.4	Very high	130 Å²	130	102.8 Å²	102.8	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-59.1	-38.6	175.9	-73.3	-56.4	0	0	0	111.6	E232 Y233 Q239 Q240	E232-F236 HydrophobicContact CB-CD2 4.49Å; E232-F236 HydrophobicContact CB-CE2 4.28Å; E232-F236 WeakPolarHBondContact O-CD2 3.32Å; E232-F236 PolarHBondContact O-N 3.12Å; Y233-F236 PolarHBondContact O-N 3.25Å; F236-Q239 PolarHBondContact O-N 3.4Å; F236-Q240 WeakPolarHBondContact O-CB 3.32Å; F236-Q240 PolarHBondContact O-N 2.98Å
237	K	98.7	Very high	98.4	Very high	80 Å²	80	103 Å²	103	35%	0.348	48%	0.484	S	S	.	.	H	α-helix	trans	-65.5	-40.3	178	-170.8	62.2	-177	173.9	0	112.1	Y233 S234 E235 Q240 L241	Y233-K237 VanDerWaalsContact O-CB 3.3Å; Y233-K237 WeakPolarHBondContact O-CB 3.39Å; Y233-K237 PolarHBondContact O-N 3.18Å; S234-K237 PolarHBondContact O-N 2.73Å; E235-K237 PolarHBondContact O-N 3.41Å; K237-Q240 PolarHBondContact O-N 3Å; K237-L241 WeakPolarHBondContact O-CG 2.75Å; K237-L241 PolarHBondContact O-N 2.99Å; K237-L241 VanDerWaalsContact O-N 3.15Å
238	R	98.5	Very high	98.4	Very high	119 Å²	119	107.1 Å²	107.1	45%	0.449	50%	0.495	S	S	.	.	H	α-helix	trans	-61.5	-48.4	173.9	-179	-178.6	61.1	77.8	2.1	111.1	S234 E235 Q240 L241 E242	S234-R238 PolarHBondContact O-N 3.41Å; E235-R238 WeakPolarHBondContact O-CB 3.39Å; E235-R238 PolarHBondContact O-N 3.47Å; E235-R238 VanDerWaalsContact O-N 3.16Å; R238-Q240 VanDerWaalsContact C-N 3.32Å; R238-Q240 PolarHBondContact O-N 3.46Å; R238-L241 PolarHBondContact O-N 3.16Å; R238-L241 VanDerWaalsContact O-N 3.16Å; R238-E242 WeakPolarHBondContact CG-OE1 3.4Å; R238-E242 IonicContact CZ-OE1 2.61Å; R238-E242 VanDerWaalsContact NH1-CD 3.34Å; R238-E242 IonicContact NH1-OE1 3.06Å; R238-E242 PolarHBondContact NH1-OE1 2.93Å; R238-E242 IonicContact NH1-OE2 3.32Å; R238-E242 PolarHBondContact NH1-OE2 3.16Å; R238-E242 WeakPolarHBondContact O-CG 3.42Å; R238-E242 PolarHBondContact O-N 3.15Å
239	Q	98.6	Very high	98.4	Very high	81 Å²	81	104.7 Å²	104.7	38%	0.379	49%	0.49	S	S	.	.	H	α-helix	trans	-60	-41.2	178.3	-68.1	175.3	13.1	0	0	112.1	E235 F236 L241 E242 L243	E235-Q239 WeakPolarHBondContact O-CG 3.42Å; E235-Q239 PolarHBondContact O-N 3.46Å; E235-Q239 PolarHBondContact OE1-NE2 3.36Å; F236-Q239 PolarHBondContact O-N 3.4Å; Q239-L241 VanDerWaalsContact C-N 3.34Å; Q239-L241 PolarHBondContact O-N 3.38Å; Q239-E242 PolarHBondContact O-N 3.46Å; Q239-L243 WeakPolarHBondContact O-CB 3.49Å; Q239-L243 PolarHBondContact O-N 3.31Å
240	Q	98.5	Very high	98.4	Very high	95 Å²	95	101.2 Å²	101.2	44%	0.444	48%	0.484	S	S	.	.	H	α-helix	trans	-58.7	-46.1	175.2	-174.6	-169.1	0.7	0	0	111.5	F236 K237 R238 L243 D244	F236-Q240 WeakPolarHBondContact O-CB 3.32Å; F236-Q240 PolarHBondContact O-N 2.98Å; K237-Q240 PolarHBondContact O-N 3Å; R238-Q240 VanDerWaalsContact C-N 3.32Å; R238-Q240 PolarHBondContact O-N 3.46Å; Q240-L243 PolarHBondContact O-N 3.18Å; Q240-D244 WeakPolarHBondContact O-CB 3.4Å; Q240-D244 PolarHBondContact O-N 2.86Å
241	L	98.6	Very high	98.4	Very high	100 Å²	100	100.8 Å²	100.8	52%	0.524	48%	0.482	S	S	.	.	H	α-helix	trans	-67.1	-38.1	-179.2	-70	171.3	0	0	0	112.4	K237 R238 Q239 D244 D245	K237-L241 WeakPolarHBondContact O-CG 2.75Å; K237-L241 PolarHBondContact O-N 2.99Å; K237-L241 VanDerWaalsContact O-N 3.15Å; R238-L241 PolarHBondContact O-N 3.16Å; R238-L241 VanDerWaalsContact O-N 3.16Å; Q239-L241 VanDerWaalsContact C-N 3.34Å; Q239-L241 PolarHBondContact O-N 3.38Å; L241-D244 PolarHBondContact O-N 3.45Å; L241-D245 PolarHBondContact O-N 2.92Å; L241-D245 VanDerWaalsContact O-N 3.12Å
242	E	98.6	Very high	98.4	Very high	92 Å²	92	97.1 Å²	97.1	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-61.9	-47.8	174.6	-74	169	-171.9	0	0	110.8	R238 Q239 D244 D245 E246	R238-E242 WeakPolarHBondContact CG-OE1 3.4Å; R238-E242 IonicContact CZ-OE1 2.61Å; R238-E242 VanDerWaalsContact NH1-CD 3.34Å; R238-E242 IonicContact NH1-OE1 3.06Å; R238-E242 PolarHBondContact NH1-OE1 2.93Å; R238-E242 IonicContact NH1-OE2 3.32Å; R238-E242 PolarHBondContact NH1-OE2 3.16Å; R238-E242 WeakPolarHBondContact O-CG 3.42Å; R238-E242 PolarHBondContact O-N 3.15Å; Q239-E242 PolarHBondContact O-N 3.46Å; E242-D244 VanDerWaalsContact C-N 3.34Å; E242-D244 PolarHBondContact O-N 3.39Å; E242-D245 PolarHBondContact O-N 2.9Å; E242-E246 WeakPolarHBondContact O-CG 3.33Å; E242-E246 PolarHBondContact O-N 3.42Å
243	L	98.5	Very high	98.4	Very high	108 Å²	108	99.1 Å²	99.1	57%	0.565	49%	0.485	S	S	*	.	H	α-helix	trans	-63.2	-39.1	178.3	-174.8	65	0	0	0	112.5	Q239 Q240 D245 E246 L247	Q239-L243 WeakPolarHBondContact O-CB 3.49Å; Q239-L243 PolarHBondContact O-N 3.31Å; Q240-L243 PolarHBondContact O-N 3.18Å; L243-D245 VanDerWaalsContact C-N 3.31Å; L243-D245 PolarHBondContact O-N 2.95Å; L243-E246 PolarHBondContact O-N 3.46Å; L243-L247 WeakPolarHBondContact O-CB 3.36Å; L243-L247 PolarHBondContact O-N 3.33Å
244	D	98.6	Very high	98.4	Very high	67 Å²	67	98.2 Å²	98.2	36%	0.358	49%	0.487	S	S	.	.	H	α-helix	trans	-64.7	-34.9	176.7	-81.2	-9.7	0	0	0	112.2	Q240 L241 E242 K248	Q240-D244 WeakPolarHBondContact O-CB 3.4Å; Q240-D244 PolarHBondContact O-N 2.86Å; L241-D244 PolarHBondContact O-N 3.45Å; E242-D244 VanDerWaalsContact C-N 3.34Å; E242-D244 PolarHBondContact O-N 3.39Å; D244-K248 WeakPolarHBondContact O-CD 3.42Å; D244-K248 VanDerWaalsContact O-CG 3.28Å; D244-K248 WeakPolarHBondContact O-CG 3.45Å; D244-K248 PolarHBondContact O-N 3.02Å
245	D	98.5	Very high	98.4	Very high	112 Å²	112	101.5 Å²	101.5	60%	0.599	49%	0.488	S	S	*	.	H	α-helix	trans	-70.6	-44.3	175.4	-169.7	57.4	0	0	0	111.5	L241 E242 L243 L247 K248 S249	L241-D245 PolarHBondContact O-N 2.92Å; L241-D245 VanDerWaalsContact O-N 3.12Å; E242-D245 PolarHBondContact O-N 2.9Å; L243-D245 VanDerWaalsContact C-N 3.31Å; L243-D245 PolarHBondContact O-N 2.95Å; D245-L247 PolarHBondContact O-N 3.07Å; D245-K248 PolarHBondContact O-N 3.08Å; D245-S249 WeakPolarHBondContact O-CB 3.39Å; D245-S249 PolarHBondContact O-N 3.33Å
246	E	98.5	Very high	98.3	Very high	124 Å²	124	104.1 Å²	104.1	58%	0.579	50%	0.495	S	S	*	.	H	α-helix	trans	-59.6	-45.1	175.6	-72.4	-173.8	173.9	0	0	111.8	E242 L243 K248 S249 V250	E242-E246 WeakPolarHBondContact O-CG 3.33Å; E242-E246 PolarHBondContact O-N 3.42Å; L243-E246 PolarHBondContact O-N 3.46Å; E246-K248 PolarHBondContact O-N 3.41Å; E246-S249 WeakPolarHBondContact O-CB 3.45Å; E246-S249 PolarHBondContact O-N 2.83Å; E246-V250 WeakPolarHBondContact O-CG2 3.4Å; E246-V250 PolarHBondContact O-N 3.38Å
247	L	98.5	Very high	98.3	Very high	107 Å²	107	100.5 Å²	100.5	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-59	-46.8	177.8	-174.7	152.9	0	0	0	111.3	L243 D245 S249 V250 E251	L243-L247 WeakPolarHBondContact O-CB 3.36Å; L243-L247 PolarHBondContact O-N 3.33Å; D245-L247 PolarHBondContact O-N 3.07Å; L247-S249 VanDerWaalsContact C-N 3.33Å; L247-S249 PolarHBondContact O-N 3.23Å; L247-V250 PolarHBondContact O-N 2.99Å; L247-E251 PolarHBondContact O-N 3.33Å
248	K	98.3	Very high	98.2	Very high	119 Å²	119	102.2 Å²	102.2	52%	0.517	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-39.3	177.3	-72.8	168.4	-172.7	162.8	0	112	D244 D245 E246 E251 N252	D244-K248 WeakPolarHBondContact O-CD 3.42Å; D244-K248 VanDerWaalsContact O-CG 3.28Å; D244-K248 WeakPolarHBondContact O-CG 3.45Å; D244-K248 PolarHBondContact O-N 3.02Å; D245-K248 PolarHBondContact O-N 3.08Å; E246-K248 PolarHBondContact O-N 3.41Å; K248-E251 PolarHBondContact O-N 3.32Å; K248-N252 WeakPolarHBondContact O-CB 3.48Å; K248-N252 VanDerWaalsContact O-CG 3.28Å; K248-N252 PolarHBondContact O-N 3.3Å; K248-N252 PolarHBondContact O-ND2 3.01Å; K248-N252 VanDerWaalsContact O-ND2 3.13Å
249	S	98	Very high	98	Very high	54 Å²	54	99.6 Å²	99.6	38%	0.378	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-47.9	176.3	-175.6	0	0	0	0	111.3	D245 E246 L247 N252 Q253	D245-S249 WeakPolarHBondContact O-CB 3.39Å; D245-S249 PolarHBondContact O-N 3.33Å; E246-S249 WeakPolarHBondContact O-CB 3.45Å; E246-S249 PolarHBondContact O-N 2.83Å; L247-S249 VanDerWaalsContact C-N 3.33Å; L247-S249 PolarHBondContact O-N 3.23Å; S249-N252 PolarHBondContact O-N 2.72Å; S249-Q253 WeakPolarHBondContact O-CG 3.3Å; S249-Q253 PolarHBondContact O-N 2.83Å; S249-Q253 VanDerWaalsContact O-N 3.07Å
250	V	98.1	Very high	97.8	Very high	77 Å²	77	98.8 Å²	98.8	47%	0.467	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-43.4	177.7	174	0	0	0	0	111.5	E246 L247 N252 Q253 M254	E246-V250 WeakPolarHBondContact O-CG2 3.4Å; E246-V250 PolarHBondContact O-N 3.38Å; L247-V250 PolarHBondContact O-N 2.99Å; V250-N252 VanDerWaalsContact C-N 3.3Å; V250-N252 PolarHBondContact O-N 3.19Å; V250-Q253 PolarHBondContact O-N 2.87Å; V250-M254 HydrophobicContact CG1-CG 4.36Å; V250-M254 HydrophobicContact CG1-SD 4.19Å; V250-M254 WeakPolarHBondContact O-CG 3.3Å; V250-M254 PolarHBondContact O-N 3.38Å
251	E	98.4	Very high	97.3	Very high	93 Å²	93	98.3 Å²	98.3	44%	0.435	49%	0.492	S	S	.	.	H	α-helix	trans	-58.3	-43.3	177.2	-168.5	-168	151	0	0	111.6	L247 K248 M254 R255	L247-E251 PolarHBondContact O-N 3.33Å; K248-E251 PolarHBondContact O-N 3.32Å; E251-M254 PolarHBondContact O-N 3.41Å; E251-R255 WeakPolarHBondContact O-CB 3.4Å; E251-R255 PolarHBondContact O-N 3.23Å; E251-R255 IonicContact OE1-NH1 2.71Å
252	N	97.6	Very high	96.7	Very high	97 Å²	97	97.1 Å²	97.1	52%	0.519	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-41.8	177.7	-74.5	-32.2	0	0	0	112.3	K248 S249 V250 R255 Y256	K248-N252 WeakPolarHBondContact O-CB 3.48Å; K248-N252 VanDerWaalsContact O-CG 3.28Å; K248-N252 PolarHBondContact O-N 3.3Å; K248-N252 PolarHBondContact O-ND2 3.01Å; K248-N252 VanDerWaalsContact O-ND2 3.13Å; S249-N252 PolarHBondContact O-N 2.72Å; V250-N252 VanDerWaalsContact C-N 3.3Å; V250-N252 PolarHBondContact O-N 3.19Å; N252-R255 PolarHBondContact O-N 3.04Å; N252-Y256 WeakPolarHBondContact O-CB 3.37Å; N252-Y256 PolarHBondContact O-N 3.15Å
253	Q	98.3	Very high	96.1	Very high	124 Å²	124	98.2 Å²	98.2	58%	0.579	49%	0.489	S	S	*	.	H	α-helix	trans	-63.8	-43.2	175.7	-69.6	178.2	15.5	0	0	111.6	S249 V250 Y256 A257	S249-Q253 WeakPolarHBondContact O-CG 3.3Å; S249-Q253 PolarHBondContact O-N 2.83Å; S249-Q253 VanDerWaalsContact O-N 3.07Å; V250-Q253 PolarHBondContact O-N 2.87Å; Q253-Y256 PolarHBondContact O-N 3.21Å; Q253-A257 WeakPolarHBondContact O-CB 3.33Å; Q253-A257 PolarHBondContact O-N 3.3Å
254	M	97.9	Very high	95.3	Very high	110 Å²	110	99.3 Å²	99.3	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-60.2	-47.2	175.9	-73.7	-177	68.4	0	0	111.5	V250 E251 Y256 A257 Q258	V250-M254 HydrophobicContact CG1-CG 4.36Å; V250-M254 HydrophobicContact CG1-SD 4.19Å; V250-M254 WeakPolarHBondContact O-CG 3.3Å; V250-M254 PolarHBondContact O-N 3.38Å; E251-M254 PolarHBondContact O-N 3.41Å; M254-Y256 VanDerWaalsContact C-N 3.32Å; M254-Y256 PolarHBondContact O-N 2.98Å; M254-A257 PolarHBondContact O-N 2.82Å; M254-Q258 WeakPolarHBondContact O-CB 3.05Å; M254-Q258 VanDerWaalsContact O-CG 3.3Å; M254-Q258 WeakPolarHBondContact O-CG 3.33Å; M254-Q258 PolarHBondContact O-N 2.92Å
255	R	97.9	Very high	94.2	Very high	142 Å²	142	101.3 Å²	101.3	54%	0.536	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-41.6	177.1	179.2	-178.5	-94.9	124	-1.9	111.8	E251 N252 T259	E251-R255 WeakPolarHBondContact O-CB 3.4Å; E251-R255 PolarHBondContact O-N 3.23Å; E251-R255 IonicContact OE1-NH1 2.71Å; N252-R255 PolarHBondContact O-N 3.04Å; R255-T259 WeakPolarHBondContact O-CB 3.1Å; R255-T259 PolarHBondContact O-N 2.85Å; R255-T259 PolarHBondContact O-OG1 2.69Å
256	Y	97.5	Very high	93	Very high	155 Å²	155	103.6 Å²	103.6	61%	0.608	51%	0.505	S	S	*	.	H	α-helix	trans	-62.6	-50.7	176.5	177	-95.1	0	0	0	111.4	N252 Q253 M254 Q258 T259 Q260	N252-Y256 WeakPolarHBondContact O-CB 3.37Å; N252-Y256 PolarHBondContact O-N 3.15Å; Q253-Y256 PolarHBondContact O-N 3.21Å; M254-Y256 VanDerWaalsContact C-N 3.32Å; M254-Y256 PolarHBondContact O-N 2.98Å; Y256-Q258 VanDerWaalsContact C-N 3.34Å; Y256-Q258 PolarHBondContact O-N 3.17Å; Y256-T259 WeakPolarHBondContact O-CB 3.39Å; Y256-T259 PolarHBondContact O-N 3.28Å; Y256-T259 VanDerWaalsContact O-N 3.15Å; Y256-Q260 HydrophobicContact CD1-CG 4.21Å; Y256-Q260 HydrophobicContact CE1-CG 3.76Å; Y256-Q260 HydrophobicContact CE2-CG 4.27Å; Y256-Q260 WeakPolarHBondContact O-CG 3.42Å; Y256-Q260 PolarHBondContact O-N 3.24Å
257	A	97.6	Very high	91.8	Very high	55 Å²	55	102.1 Å²	102.1	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-60.2	-42.9	179.9	0	0	0	0	0	111.9	Q253 M254 T259 Q260 L261	Q253-A257 WeakPolarHBondContact O-CB 3.33Å; Q253-A257 PolarHBondContact O-N 3.3Å; M254-A257 PolarHBondContact O-N 2.82Å; A257-T259 PolarHBondContact O-N 3.36Å; A257-Q260 PolarHBondContact O-N 3Å; A257-L261 VanDerWaalsContact O-CB 3.29Å; A257-L261 WeakPolarHBondContact O-CB 3.4Å; A257-L261 PolarHBondContact O-N 2.9Å
258	Q	96.4	Very high	90.6	Very high	116 Å²	116	99 Å²	99	54%	0.542	49%	0.488	S	S	.	.	H	α-helix	trans	-59.4	-44.9	174.4	-75.2	174.3	-7	0	0	111.8	M254 Y256 Q260 L261 D262	M254-Q258 WeakPolarHBondContact O-CB 3.05Å; M254-Q258 VanDerWaalsContact O-CG 3.3Å; M254-Q258 WeakPolarHBondContact O-CG 3.33Å; M254-Q258 PolarHBondContact O-N 2.92Å; Y256-Q258 VanDerWaalsContact C-N 3.34Å; Y256-Q258 PolarHBondContact O-N 3.17Å; Q258-Q260 VanDerWaalsContact C-N 3.34Å; Q258-Q260 PolarHBondContact O-N 2.95Å; Q258-L261 PolarHBondContact O-N 3.39Å; Q258-D262 WeakPolarHBondContact O-CB 3.19Å; Q258-D262 PolarHBondContact O-N 2.99Å
259	T	95.6	Very high	89.7	Confident	64 Å²	64	98.5 Å²	98.5	39%	0.393	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-40.6	178.5	-56.8	0	0	0	0	112	R255 Y256 A257 K263	R255-T259 WeakPolarHBondContact O-CB 3.1Å; R255-T259 PolarHBondContact O-N 2.85Å; R255-T259 PolarHBondContact O-OG1 2.69Å; Y256-T259 WeakPolarHBondContact O-CB 3.39Å; Y256-T259 PolarHBondContact O-N 3.28Å; Y256-T259 VanDerWaalsContact O-N 3.15Å; A257-T259 PolarHBondContact O-N 3.36Å; T259-K263 WeakPolarHBondContact O-CG 3.44Å; T259-K263 PolarHBondContact O-N 2.97Å
260	Q	93.1	Very high	88.8	Confident	63 Å²	63	97.5 Å²	97.5	29%	0.294	48%	0.484	S	S	.	.	H	α-helix	trans	-67.9	-43.1	176.6	-64	-55.2	-29.4	0	0	111.4	Y256 A257 Q258 D262 K263 L264	Y256-Q260 HydrophobicContact CD1-CG 4.21Å; Y256-Q260 HydrophobicContact CE1-CG 3.76Å; Y256-Q260 HydrophobicContact CE2-CG 4.27Å; Y256-Q260 WeakPolarHBondContact O-CG 3.42Å; Y256-Q260 PolarHBondContact O-N 3.24Å; A257-Q260 PolarHBondContact O-N 3Å; Q258-Q260 VanDerWaalsContact C-N 3.34Å; Q258-Q260 PolarHBondContact O-N 2.95Å; Q260-D262 VanDerWaalsContact C-N 3.31Å; Q260-D262 PolarHBondContact O-N 3.47Å; Q260-K263 WeakPolarHBondContact O-CB 3.31Å; Q260-K263 PolarHBondContact O-N 3.07Å; Q260-L264 WeakPolarHBondContact O-CG 3.36Å; Q260-L264 PolarHBondContact O-N 2.9Å
261	L	89	Confident	87.9	Confident	85 Å²	85	98 Å²	98	45%	0.445	48%	0.484	S	S	.	.	H	α-helix	trans	-60.7	-41.3	176.5	-178.7	137.2	0	0	0	111.3	A257 Q258 L264 K265	A257-L261 VanDerWaalsContact O-CB 3.29Å; A257-L261 WeakPolarHBondContact O-CB 3.4Å; A257-L261 PolarHBondContact O-N 2.9Å; Q258-L261 PolarHBondContact O-N 3.39Å; L261-L264 PolarHBondContact O-N 3.36Å; L261-K265 HydrophobicContact CD2-CD 3.71Å; L261-K265 VanDerWaalsContact CD2-CE 3.44Å; L261-K265 HydrophobicContact CD2-CG 4.39Å; L261-K265 HydrophobicContact CG-CD 4.38Å; L261-K265 VanDerWaalsContact O-CB 3.31Å; L261-K265 WeakPolarHBondContact O-CB 3.39Å; L261-K265 VanDerWaalsContact O-CG 3.29Å; L261-K265 WeakPolarHBondContact O-CG 3.29Å; L261-K265 PolarHBondContact O-N 2.97Å
262	D	86.3	Confident	86.9	Confident	76 Å²	76	97.2 Å²	97.2	41%	0.406	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-39.9	174.7	-77.1	-11.8	0	0	0	112.6	Q258 Q260 K266	Q258-D262 WeakPolarHBondContact O-CB 3.19Å; Q258-D262 PolarHBondContact O-N 2.99Å; Q260-D262 VanDerWaalsContact C-N 3.31Å; Q260-D262 PolarHBondContact O-N 3.47Å; D262-K266 WeakPolarHBondContact O-CB 3.23Å; D262-K266 VanDerWaalsContact O-CG 3.23Å; D262-K266 WeakPolarHBondContact O-CG 3.45Å; D262-K266 PolarHBondContact O-N 3.48Å
263	K	85	Confident	86.3	Confident	115 Å²	115	95.7 Å²	95.7	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-63.6	-44.4	174.5	-75.3	176.5	-179	179.5	0	111.5	T259 Q260 K266 T267	T259-K263 WeakPolarHBondContact O-CG 3.44Å; T259-K263 PolarHBondContact O-N 2.97Å; Q260-K263 WeakPolarHBondContact O-CB 3.31Å; Q260-K263 PolarHBondContact O-N 3.07Å; K263-K266 PolarHBondContact O-N 3.35Å; K263-T267 WeakPolarHBondContact O-CB 3.29Å; K263-T267 PolarHBondContact O-N 3.37Å; K263-T267 PolarHBondContact O-OG1 3.17Å
264	L	82.6	Confident	85.9	Confident	131 Å²	131	90.3 Å²	90.3	69%	0.686	46%	0.463	S	S	*	.	H	α-helix	trans	-66.2	-43.1	178.8	-70	174.1	0	0	0	111.3	Q260 L261 K266 T267	Q260-L264 WeakPolarHBondContact O-CG 3.36Å; Q260-L264 PolarHBondContact O-N 2.9Å; L261-L264 PolarHBondContact O-N 3.36Å; L264-K266 VanDerWaalsContact C-N 3.32Å; L264-K266 PolarHBondContact O-N 3.48Å; L264-T267 PolarHBondContact O-N 3.32Å; L264-T267 VanDerWaalsContact O-N 3.14Å
265	K	75.6	Confident	85.5	Confident	108 Å²	108	89.1 Å²	89.1	47%	0.47	46%	0.456	S	S	.	.	H	α-helix	trans	-60.5	-39.5	175.1	-79.9	-174.9	175.1	-177.7	0	112.6	L261 Y448	L261-K265 HydrophobicContact CD2-CD 3.71Å; L261-K265 VanDerWaalsContact CD2-CE 3.44Å; L261-K265 HydrophobicContact CD2-CG 4.39Å; L261-K265 HydrophobicContact CG-CD 4.38Å; L261-K265 VanDerWaalsContact O-CB 3.31Å; L261-K265 WeakPolarHBondContact O-CB 3.39Å; L261-K265 VanDerWaalsContact O-CG 3.29Å; L261-K265 WeakPolarHBondContact O-CG 3.29Å; L261-K265 PolarHBondContact O-N 2.97Å; K265-Y448 HydrophobicContact CB-CE2 3.8Å; K265-Y448 WeakPolarHBondContact O-CE2 3.5Å
266	K	73.5	Confident	85.2	Confident	161 Å²	161	82.8 Å²	82.8	70%	0.7	43%	0.432	S	S	*	.	H	α-helix	trans	-72.6	-28	175.9	-72.2	170.9	-176.1	174.1	0	113	D262 K263 L264 N268	D262-K266 WeakPolarHBondContact O-CB 3.23Å; D262-K266 VanDerWaalsContact O-CG 3.23Å; D262-K266 WeakPolarHBondContact O-CG 3.45Å; D262-K266 PolarHBondContact O-N 3.48Å; K263-K266 PolarHBondContact O-N 3.35Å; L264-K266 VanDerWaalsContact C-N 3.32Å; L264-K266 PolarHBondContact O-N 3.48Å; K266-N268 VanDerWaalsContact C-N 3.35Å; K266-N268 PolarHBondContact O-N 3.03Å
267	T	73	Confident	84.9	Confident	92 Å²	92	82 Å²	82	56%	0.564	43%	0.428	S	S	*	.			trans	-82.9	79.9	-178.8	-53.2	0	0	0	0	109.9	K263 L264 V269	K263-T267 WeakPolarHBondContact O-CB 3.29Å; K263-T267 PolarHBondContact O-N 3.37Å; K263-T267 PolarHBondContact O-OG1 3.17Å; L264-T267 PolarHBondContact O-N 3.32Å; L264-T267 VanDerWaalsContact O-N 3.14Å; T267-V269 PolarHBondContact O-N 3.43Å
268	N	72.6	Confident	84.6	Confident	41 Å²	41	84.1 Å²	84.1	22%	0.219	43%	0.429	C	S	.	.			trans	-74.6	122.4	171.8	-167.7	-42.2	0	0	0	110.3	K266 F270 N271 A272 S444	K266-N268 VanDerWaalsContact C-N 3.35Å; K266-N268 PolarHBondContact O-N 3.03Å; N268-F270 PolarHBondContact O-N 3.3Å; N268-F270 VanDerWaalsContact O-N 3.17Å; N268-F270 WeakPolarHBondContact OD1-CB 3.3Å; N268-F270 PolarHBondContact OD1-N 3.45Å; N268-N271 HydrophobicContact CB-CB 4.45Å; N268-N271 PolarHBondContact O-N 2.88Å; N268-N271 VanDerWaalsContact O-N 3.1Å; N268-A272 PolarHBondContact O-N 3.34Å; N268-A272 VanDerWaalsContact O-N 3.08Å; N268-S444 WeakPolarHBondContact ND2-CB 3.46Å; N268-S444 PolarHBondContact ND2-OG 3.24Å
269	V	79.7	Confident	84.2	Confident	109 Å²	109	81.7 Å²	81.7	66%	0.661	42%	0.424	S	S	*	.	H	α-helix	trans	-53	-36.9	179.2	179.2	0	0	0	0	112	T267 A272 T273	T267-V269 PolarHBondContact O-N 3.43Å; V269-A272 PolarHBondContact O-N 3.01Å; V269-T273 VanDerWaalsContact O-CB 3.32Å; V269-T273 WeakPolarHBondContact O-CB 3.47Å; V269-T273 PolarHBondContact O-N 2.97Å; V269-T273 PolarHBondContact O-OG1 3.27Å
270	F	79.5	Confident	83.7	Confident	33 Å²	33	81.5 Å²	81.5	15%	0.145	44%	0.436	C	S	.	.	H	α-helix	trans	-67.4	-43	179.5	-76.2	-71.1	0	0	0	112.9	N268 A272 T273 F274 A316 L317 K320 L440	N268-F270 PolarHBondContact O-N 3.3Å; N268-F270 VanDerWaalsContact O-N 3.17Å; N268-F270 WeakPolarHBondContact OD1-CB 3.3Å; N268-F270 PolarHBondContact OD1-N 3.45Å; F270-A272 VanDerWaalsContact C-N 3.29Å; F270-A272 PolarHBondContact O-N 3.28Å; F270-T273 PolarHBondContact O-N 3.07Å; F270-F274 HydrophobicContact CD1-CD2 4.31Å; F270-F274 HydrophobicContact CD1-CE2 4.33Å; F270-F274 PolarHBondContact O-N 3.08Å; F270-A316 HydrophobicContact CE1-CB 4.06Å; F270-L317 HydrophobicContact CD1-CD2 4.36Å; F270-L317 HydrophobicContact CE1-CD2 4.18Å; F270-L317 HydrophobicContact CZ-CD2 4.44Å; F270-K320 HydrophobicContact CE2-CD 4.49Å; F270-K320 HydrophobicContact CE2-CG 4.16Å; F270-K320 HydrophobicContact CZ-CB 4.07Å; F270-K320 HydrophobicContact CZ-CD 4.47Å; F270-K320 HydrophobicContact CZ-CG 4.06Å; F270-L440 HydrophobicContact CB-CD1 3.46Å; F270-L440 VanDerWaalsContact CB-CD1 3.46Å; F270-L440 HydrophobicContact CB-CD2 4.41Å; F270-L440 HydrophobicContact CB-CG 4.14Å; F270-L440 HydrophobicContact CD1-CD1 3.88Å; F270-L440 HydrophobicContact CG-CD1 3.79Å
271	N	77.8	Confident	83.3	Confident	88 Å²	88	83 Å²	83	47%	0.471	44%	0.443	S	S	.	.	H	α-helix	trans	-67.4	-32.9	176.2	-75.4	-20.3	0	0	0	111.5	N268 L440	N268-N271 HydrophobicContact CB-CB 4.45Å; N268-N271 PolarHBondContact O-N 2.88Å; N268-N271 VanDerWaalsContact O-N 3.1Å; N271-L440 WeakPolarHBondContact OD1-CD2 3.3Å
272	A	79.1	Confident	83.4	Confident	77 Å²	77	79.4 Å²	79.4	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-71.9	-32.7	175	0	0	0	0	0	112.7	N268 V269 F270	N268-A272 PolarHBondContact O-N 3.34Å; N268-A272 VanDerWaalsContact O-N 3.08Å; V269-A272 PolarHBondContact O-N 3.01Å; F270-A272 VanDerWaalsContact C-N 3.29Å; F270-A272 PolarHBondContact O-N 3.28Å
273	T	85	Confident	83.6	Confident	65 Å²	65	75.9 Å²	75.9	40%	0.399	41%	0.405	S	S	.	.	H	α-helix	trans	-87.9	-35.6	-177.3	-51.2	0	0	0	0	112.7	V269 F270 N286	V269-T273 VanDerWaalsContact O-CB 3.32Å; V269-T273 WeakPolarHBondContact O-CB 3.47Å; V269-T273 PolarHBondContact O-N 2.97Å; V269-T273 PolarHBondContact O-OG1 3.27Å; F270-T273 PolarHBondContact O-N 3.07Å; T273-N286 PolarHBondContact O-ND2 3.26Å; T273-N286 PolarHBondContact O-OD1 3.45Å
274	F	89.7	Confident	84	Confident	10 Å²	10	70.7 Å²	70.7	4%	0.044	38%	0.383	C	S	.	.			trans	-125.9	85.2	-175.8	-55.9	-75.1	0	0	0	110.6	F270 I276 I285 N286 L312 L313	F270-F274 HydrophobicContact CD1-CD2 4.31Å; F270-F274 HydrophobicContact CD1-CE2 4.33Å; F270-F274 PolarHBondContact O-N 3.08Å; F274-I276 PolarHBondContact O-N 3.39Å; F274-I276 VanDerWaalsContact O-N 3.13Å; F274-I285 HydrophobicContact CD1-CD1 4.3Å; F274-N286 WeakPolarHBondContact CA-OD1 3.43Å; F274-L312 HydrophobicContact CE1-CB 4.25Å; F274-L312 HydrophobicContact CE1-CD2 4.02Å; F274-L312 HydrophobicContact CE1-CG 4.04Å; F274-L312 HydrophobicContact CZ-CB 4.46Å; F274-L312 HydrophobicContact CZ-CD2 4.04Å; F274-L312 HydrophobicContact CZ-CG 3.87Å; F274-L313 HydrophobicContact CB-CD1 3.99Å; F274-L313 HydrophobicContact CD1-CB 3.96Å; F274-L313 HydrophobicContact CD1-CD1 4.44Å; F274-L313 HydrophobicContact CD2-CB 4.44Å; F274-L313 HydrophobicContact CD2-CD1 3.61Å; F274-L313 HydrophobicContact CE1-CB 4.09Å; F274-L313 HydrophobicContact CE2-CD1 4.18Å; F274-L313 HydrophobicContact CG-CB 4.14Å; F274-L313 HydrophobicContact CG-CD1 3.76Å; F274-L313 HydrophobicContact CG-CG 4.45Å; F274-L313 HydrophobicContact CZ-CB 4.4Å
275	H	88.9	Confident	84.4	Confident	85 Å²	85	64.5 Å²	64.5	39%	0.394	35%	0.35	S	S	.	.			trans	-78.4	96.7	176.7	-177.2	-103.4	0	0	0	110.8	I285 N286	H275-I285 WeakPolarHBondContact O-CA 3.48Å; H275-N286 PolarHBondContact N-OD1 3.33Å; H275-N286 PolarHBondContact O-N 3.47Å
276	I	91.6	Very high	85.1	Confident	10 Å²	10	61.4 Å²	61.4	5%	0.051	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	115.3	177.3	-51.3	171.5	0	0	0	110.5	F274 T284 I285 L313 L433 L436 K437	F274-I276 PolarHBondContact O-N 3.39Å; F274-I276 VanDerWaalsContact O-N 3.13Å; I276-T284 CarbonylContact C-O 3.12Å; I276-T284 WeakPolarHBondContact CA-O 3.49Å; I276-I285 HydrophobicContact CG1-CD1 4.25Å; I276-I285 HydrophobicContact CG1-CG1 4.2Å; I276-L313 HydrophobicContact CD1-CD2 3.48Å; I276-L313 VanDerWaalsContact CD1-CD2 3.48Å; I276-L313 HydrophobicContact CG1-CD2 4.41Å; I276-L433 HydrophobicContact CG2-CB 4.16Å; I276-L436 HydrophobicContact CD1-CB 4.46Å; I276-K437 HydrophobicContact CB-CB 4.19Å; I276-K437 HydrophobicContact CB-CD 4.25Å; I276-K437 HydrophobicContact CB-CG 4.33Å; I276-K437 HydrophobicContact CD1-CB 4.01Å; I276-K437 HydrophobicContact CG2-CB 4.01Å; I276-K437 HydrophobicContact CG2-CD 4.25Å; I276-K437 WeakPolarHBondContact O-CE 3.49Å; I276-K437 PolarHBondContact O-NZ 2.87Å
277	W	91.9	Very high	86	Confident	138 Å²	138	59.5 Å²	59.5	52%	0.523	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	-164.7	-178.7	-154.1	-108.1	0	0	0	111.5	T284	W277-T284 VanDerWaalsContact C-OG1 3.24Å; W277-T284 PolarHBondContact N-O 3.26Å; W277-T284 PolarHBondContact O-N 3.07Å; W277-T284 PolarHBondContact O-OG1 3.13Å
278	H	90.3	Very high	87	Confident	100 Å²	100	58.8 Å²	58.8	46%	0.463	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	143.6	172.5	64.9	88.5	0	0	0	110.9	F282	H278-F282 CarbonylContact C-O 3.51Å; H278-F282 WeakPolarHBondContact CA-O 3.49Å; H278-F282 WeakPolarHBondContact CB-O 3.4Å
279	S	87.5	Confident	88	Confident	64 Å²	64	59.7 Å²	59.7	45%	0.448	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	102.3	171.5	-176.5	0	0	0	0	108	Q281 F282	S279-Q281 PolarHBondContact O-N 3.47Å; S279-Q281 VanDerWaalsContact O-N 3.13Å; S279-F282 PolarHBondContact N-O 2.71Å; S279-F282 WeakPolarHBondContact O-CD2 3.39Å; S279-F282 PolarHBondContact O-N 3.16Å
280	G	86.4	Confident	88.5	Confident	61 Å²	61	54.5 Å²	54.5	63%	0.629	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	-115.6	-170.6	0	0	0	0	0	112.2
281	Q	85.2	Confident	89	Confident	95 Å²	95	52.9 Å²	52.9	44%	0.444	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-10.9	-179.9	-65.1	-164.5	76.6	0	0	114	S279 L293 K430	S279-Q281 PolarHBondContact O-N 3.47Å; S279-Q281 VanDerWaalsContact O-N 3.13Å; Q281-L293 HydrophobicContact CB-CD1 3.68Å; Q281-L293 HydrophobicContact CG-CD1 4.31Å; Q281-K430 WeakPolarHBondContact O-CD 3.35Å
282	F	89.6	Confident	89.5	Confident	9 Å²	9	52.2 Å²	52.2	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	142.7	-177.5	-57.4	-83.8	0	0	0	111.9	H278 S279 R289 L293 V296 V298 T426	H278-F282 CarbonylContact C-O 3.51Å; H278-F282 WeakPolarHBondContact CA-O 3.49Å; H278-F282 WeakPolarHBondContact CB-O 3.4Å; S279-F282 PolarHBondContact N-O 2.71Å; S279-F282 WeakPolarHBondContact O-CD2 3.39Å; S279-F282 PolarHBondContact O-N 3.16Å; F282-R289 HydrophobicContact CB-CB 4.19Å; F282-R289 HydrophobicContact CB-CG 4.2Å; F282-R289 HydrophobicContact CD1-CB 4.42Å; F282-R289 HydrophobicContact CG-CB 4.27Å; F282-R289 HydrophobicContact CG-CG 4.36Å; F282-L293 HydrophobicContact CE1-CB 4.4Å; F282-L293 HydrophobicContact CE1-CD1 4.11Å; F282-L293 HydrophobicContact CE1-CG 3.87Å; F282-L293 HydrophobicContact CE2-CD1 3.86Å; F282-L293 HydrophobicContact CE2-CG 4.39Å; F282-L293 HydrophobicContact CZ-CB 3.84Å; F282-L293 HydrophobicContact CZ-CD1 3.56Å; F282-L293 HydrophobicContact CZ-CG 3.6Å; F282-V296 HydrophobicContact CE2-CB 4Å; F282-V296 HydrophobicContact CE2-CG1 3.99Å; F282-V296 HydrophobicContact CZ-CB 4.11Å; F282-V296 HydrophobicContact CZ-CG1 4.31Å; F282-V298 HydrophobicContact CD1-CG2 4.4Å; F282-V298 HydrophobicContact CE1-CG2 3.8Å; F282-V298 HydrophobicContact CZ-CG2 3.88Å; F282-T426 HydrophobicContact CD1-CG2 3.49Å; F282-T426 VanDerWaalsContact CD1-CG2 3.49Å; F282-T426 HydrophobicContact CE1-CG2 3.78Å; F282-T426 HydrophobicContact CG-CG2 4.36Å
283	G	91.1	Very high	90	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	139.8	157.7	0	0	0	0	0	109.4	L290	G283-L290 PolarHBondContact O-N 3.32Å
284	T	92.9	Very high	89.9	Confident	7 Å²	7	50.2 Å²	50.2	4%	0.043	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	142.7	178.6	58	0	0	0	0	111.1	I276 W277 F288 R289	I276-T284 CarbonylContact C-O 3.12Å; I276-T284 WeakPolarHBondContact CA-O 3.49Å; W277-T284 VanDerWaalsContact C-OG1 3.24Å; W277-T284 PolarHBondContact N-O 3.26Å; W277-T284 PolarHBondContact O-N 3.07Å; W277-T284 PolarHBondContact O-OG1 3.13Å; T284-F288 VanDerWaalsContact CA-O 3.24Å; T284-F288 WeakPolarHBondContact CA-O 3.49Å; T284-R289 HydrophobicContact CG2-CG 3.86Å
285	I	92.2	Very high	89.7	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.1	170.3	-174.5	166.4	0	0	0	108.5	F274 H275 I276 N287 F288 A306 Q309 L313 L433	F274-I285 HydrophobicContact CD1-CD1 4.3Å; H275-I285 WeakPolarHBondContact O-CA 3.48Å; I276-I285 HydrophobicContact CG1-CD1 4.25Å; I276-I285 HydrophobicContact CG1-CG1 4.2Å; I285-N287 PolarHBondContact O-N 3.38Å; I285-N287 VanDerWaalsContact O-N 3.14Å; I285-F288 PolarHBondContact N-O 3.38Å; I285-F288 PolarHBondContact O-N 2.83Å; I285-A306 HydrophobicContact CG2-CB 3.98Å; I285-A306 WeakPolarHBondContact CG2-O 3.34Å; I285-Q309 HydrophobicContact CD1-CB 3.79Å; I285-Q309 HydrophobicContact CG1-CB 3.94Å; I285-Q309 HydrophobicContact CG2-CB 3.9Å; I285-L313 HydrophobicContact CD1-CB 4.45Å; I285-L313 HydrophobicContact CD1-CD2 4.12Å; I285-L433 HydrophobicContact CB-CD2 4.37Å
286	N	90.8	Very high	89.7	Confident	43 Å²	43	52.9 Å²	52.9	23%	0.23	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	40.2	-173.2	-68.1	-19.6	0	0	0	112.4	T273 F274 H275 F288 Q309	T273-N286 PolarHBondContact O-ND2 3.26Å; T273-N286 PolarHBondContact O-OD1 3.45Å; F274-N286 WeakPolarHBondContact CA-OD1 3.43Å; H275-N286 PolarHBondContact N-OD1 3.33Å; H275-N286 PolarHBondContact O-N 3.47Å; N286-F288 HydrophobicContact CB-CD2 4.35Å; N286-F288 HydrophobicContact CB-CE2 4.5Å; N286-F288 PolarHBondContact O-N 2.97Å; N286-Q309 PolarHBondContact ND2-OE1 3.49Å
287	N	91.7	Very high	89.4	Confident	122 Å²	122	56.3 Å²	56.3	65%	0.652	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	2	-177.5	-54.2	-33	0	0	0	116.6	I285	I285-N287 PolarHBondContact O-N 3.38Å; I285-N287 VanDerWaalsContact O-N 3.14Å
288	F	94.1	Very high	89.2	Confident	76 Å²	76	49.8 Å²	49.8	33%	0.333	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	127.4	170.6	-57.6	-64.2	0	0	0	110.7	T284 I285 N286 E302 A305 A306 Q309	T284-F288 VanDerWaalsContact CA-O 3.24Å; T284-F288 WeakPolarHBondContact CA-O 3.49Å; I285-F288 PolarHBondContact N-O 3.38Å; I285-F288 PolarHBondContact O-N 2.83Å; N286-F288 HydrophobicContact CB-CD2 4.35Å; N286-F288 HydrophobicContact CB-CE2 4.5Å; N286-F288 PolarHBondContact O-N 2.97Å; F288-E302 HydrophobicContact CB-CG 4.19Å; F288-E302 HydrophobicContact CD1-CG 3.94Å; F288-A305 HydrophobicContact CD1-CB 4.22Å; F288-A305 HydrophobicContact CD2-CB 4.33Å; F288-A305 HydrophobicContact CE1-CB 4.32Å; F288-A305 HydrophobicContact CE2-CB 4.43Å; F288-A305 HydrophobicContact CG-CB 4.22Å; F288-A305 HydrophobicContact CZ-CB 4.42Å; F288-A306 HydrophobicContact CB-CB 3.71Å; F288-Q309 HydrophobicContact CD2-CG 4.24Å; F288-Q309 HydrophobicContact CE2-CG 4.45Å
289	R	93.2	Very high	89.2	Confident	60 Å²	60	51.5 Å²	51.5	23%	0.226	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	126.6	178.1	-65.5	170.5	-68.8	172	4.3	110.9	F282 T284 V298 E302	F282-R289 HydrophobicContact CB-CB 4.19Å; F282-R289 HydrophobicContact CB-CG 4.2Å; F282-R289 HydrophobicContact CD1-CB 4.42Å; F282-R289 HydrophobicContact CG-CB 4.27Å; F282-R289 HydrophobicContact CG-CG 4.36Å; T284-R289 HydrophobicContact CG2-CG 3.86Å; R289-V298 HydrophobicContact CB-CG1 4.07Å; R289-V298 HydrophobicContact CB-CG2 4.24Å; R289-E302 VanDerWaalsContact CB-OE1 3.27Å; R289-E302 WeakPolarHBondContact CB-OE1 3.44Å; R289-E302 WeakPolarHBondContact CG-OE1 3.28Å; R289-E302 IonicContact CZ-OE1 2.69Å; R289-E302 IonicContact CZ-OE2 2.73Å; R289-E302 PolarHBondContact N-OE1 2.9Å; R289-E302 IonicContact NE-OE1 2.84Å; R289-E302 PolarHBondContact NE-OE1 3.43Å; R289-E302 IonicContact NE-OE2 3.7Å; R289-E302 PolarHBondContact NE-OE2 3.11Å; R289-E302 IonicContact NH2-OE1 3.99Å; R289-E302 IonicContact NH2-OE2 3.54Å; R289-E302 PolarHBondContact NH2-OE2 3.26Å
290	L	90.9	Very high	89.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	101.4	176.1	-166.8	68.5	0	0	0	109.9	G283 I303 A306 W307 L429 M432 L433	G283-L290 PolarHBondContact O-N 3.32Å; L290-I303 HydrophobicContact CD1-CG2 4.45Å; L290-A306 HydrophobicContact CB-CB 4.04Å; L290-A306 HydrophobicContact CD1-CB 3.64Å; L290-A306 HydrophobicContact CG-CB 4.42Å; L290-W307 HydrophobicContact CD1-CD2 4.02Å; L290-W307 HydrophobicContact CD1-CG 3.85Å; L290-L429 HydrophobicContact CD2-CB 4.02Å; L290-L429 HydrophobicContact CD2-CD2 4.21Å; L290-L429 HydrophobicContact CG-CB 4.03Å; L290-L429 HydrophobicContact CG-CD1 4.11Å; L290-L429 HydrophobicContact CG-CD2 4.39Å; L290-L429 HydrophobicContact CG-CG 4.4Å; L290-M432 HydrophobicContact CD2-CE 3.6Å; L290-L433 HydrophobicContact CB-CD1 3.71Å; L290-L433 HydrophobicContact CD2-CD1 3.64Å; L290-L433 HydrophobicContact CD2-CD2 4.1Å; L290-L433 HydrophobicContact CD2-CG 3.66Å; L290-L433 HydrophobicContact CG-CD1 4.32Å
291	G	89.8	Confident	89.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.275	C	S	.	.	S	Bend	trans	127	-179	-179.3	0	0	0	0	0	112.4	V298	G291-V298 WeakPolarHBondContact O-CB 3.41Å; G291-V298 WeakPolarHBondContact O-CG2 3.5Å
292	R	88.3	Confident	89.8	Confident	74 Å²	74	49.5 Å²	49.5	28%	0.279	26%	0.263	S	S	.	.			trans	-146.5	142.2	-178	-168.2	177.4	-171.6	-150.1	7.8	110.6	I303 E422 W425 T426	R292-I303 HydrophobicContact CB-CD1 4.28Å; R292-E422 IonicContact CZ-OE1 3.54Å; R292-E422 IonicContact NH1-OE1 3.55Å; R292-E422 PolarHBondContact NH1-OE1 3.26Å; R292-E422 VanDerWaalsContact NH1-OE1 3.14Å; R292-E422 CarbonylContact O-C 3.54Å; R292-E422 WeakPolarHBondContact O-CB 3.4Å; R292-E422 VanDerWaalsContact O-O 3.12Å; R292-W425 HydrophobicContact CB-CZ3 3.88Å; R292-T426 PolarHBondContact N-OG1 2.95Å; R292-T426 PolarHBondContact O-OG1 3.47Å
293	L	88.2	Confident	89.9	Confident	4 Å²	4	49 Å²	49	2%	0.021	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-125.7	148.1	171.9	-68.2	171.2	0	0	0	109.9	Q281 F282 S295 V296 E423 T426	Q281-L293 HydrophobicContact CB-CD1 3.68Å; Q281-L293 HydrophobicContact CG-CD1 4.31Å; F282-L293 HydrophobicContact CE1-CB 4.4Å; F282-L293 HydrophobicContact CE1-CD1 4.11Å; F282-L293 HydrophobicContact CE1-CG 3.87Å; F282-L293 HydrophobicContact CE2-CD1 3.86Å; F282-L293 HydrophobicContact CE2-CG 4.39Å; F282-L293 HydrophobicContact CZ-CB 3.84Å; F282-L293 HydrophobicContact CZ-CD1 3.56Å; F282-L293 HydrophobicContact CZ-CG 3.6Å; L293-S295 PolarHBondContact O-N 3.17Å; L293-V296 PolarHBondContact N-O 3.41Å; L293-V296 CarbonylContact O-C 3.55Å; L293-V296 PolarHBondContact O-N 3.22Å; L293-V296 VanDerWaalsContact O-N 3.14Å; L293-E423 HydrophobicContact CD2-CB 3.98Å; L293-E423 HydrophobicContact CD2-CG 3.73Å; L293-T426 HydrophobicContact CG-CG2 4.45Å
294	P	83.6	Confident	90	Very high	96 Å²	96	49.3 Å²	49.3	62%	0.623	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-32.3	175.7	-25.8	34.8	0	0	0	113.2
295	S	86	Confident	90.1	Very high	90 Å²	90	50 Å²	50	63%	0.629	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-28.3	178.7	55.4	0	0	0	0	113.9	L293	L293-S295 PolarHBondContact O-N 3.17Å
296	V	88.1	Confident	90.2	Very high	60 Å²	60	50 Å²	50	36%	0.364	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-134	89.1	-178.7	-176.6	0	0	0	0	107.9	F282 L293 V298	F282-V296 HydrophobicContact CE2-CB 4Å; F282-V296 HydrophobicContact CE2-CG1 3.99Å; F282-V296 HydrophobicContact CZ-CB 4.11Å; F282-V296 HydrophobicContact CZ-CG1 4.31Å; L293-V296 PolarHBondContact N-O 3.41Å; L293-V296 CarbonylContact O-C 3.55Å; L293-V296 PolarHBondContact O-N 3.22Å; L293-V296 VanDerWaalsContact O-N 3.14Å; V296-V298 PolarHBondContact O-N 3.08Å
297	P	85.8	Confident	90.3	Very high	82 Å²	82	47.9 Å²	47.9	53%	0.532	26%	0.257	S	S	.	.			trans	-65.6	135.6	178.4	27	-33.2	0	0	0	110
298	V	88	Confident	90.5	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.012	23%	0.227	C	C	.	.			trans	-114.2	132	174.8	-176.3	0	0	0	0	107.2	F282 R289 G291 V296 E302 I303	F282-V298 HydrophobicContact CD1-CG2 4.4Å; F282-V298 HydrophobicContact CE1-CG2 3.8Å; F282-V298 HydrophobicContact CZ-CG2 3.88Å; R289-V298 HydrophobicContact CB-CG1 4.07Å; R289-V298 HydrophobicContact CB-CG2 4.24Å; G291-V298 WeakPolarHBondContact O-CB 3.41Å; G291-V298 WeakPolarHBondContact O-CG2 3.5Å; V296-V298 PolarHBondContact O-N 3.08Å; V298-E302 HydrophobicContact CG1-CB 4Å; V298-E302 HydrophobicContact CG1-CG 4.23Å; V298-E302 WeakPolarHBondContact CG1-OE2 3.44Å; V298-I303 HydrophobicContact CB-CD1 4.24Å; V298-I303 HydrophobicContact CB-CG1 4.25Å; V298-I303 HydrophobicContact CG1-CD1 4.22Å; V298-I303 HydrophobicContact CG1-CG1 3.69Å
299	E	89.8	Confident	90.5	Very high	135 Å²	135	41 Å²	41	63%	0.631	22%	0.222	S	C	*	.			trans	-68.8	141.7	179.3	-73.3	-58.4	139.4	0	0	111	N301 E302 I303	E299-N301 PolarHBondContact O-N 3.49Å; E299-E302 VanDerWaalsContact O-CB 3.31Å; E299-E302 WeakPolarHBondContact O-CB 3.39Å; E299-E302 PolarHBondContact O-N 3.33Å; E299-I303 PolarHBondContact O-N 3.19Å
300	W	88.4	Confident	90.5	Very high	23 Å²	23	38.1 Å²	38.1	9%	0.087	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-32.9	-177.7	-81.4	100.4	0	0	0	113.1	E302 I303 N304 C353 G355 F359 F365 W425	W300-E302 VanDerWaalsContact C-N 3.27Å; W300-E302 PolarHBondContact O-N 2.84Å; W300-I303 HydrophobicContact CD2-CD1 4.41Å; W300-I303 HydrophobicContact CE3-CB 4.31Å; W300-I303 HydrophobicContact CE3-CD1 4.11Å; W300-I303 HydrophobicContact CE3-CG2 4.36Å; W300-I303 HydrophobicContact CH2-CD1 4.31Å; W300-I303 HydrophobicContact CZ3-CB 4.49Å; W300-I303 HydrophobicContact CZ3-CD1 4.06Å; W300-I303 HydrophobicContact CZ3-CG2 4.08Å; W300-I303 PolarHBondContact O-N 3.39Å; W300-N304 VanDerWaalsContact O-CB 3.28Å; W300-N304 WeakPolarHBondContact O-CB 3.5Å; W300-N304 PolarHBondContact O-N 2.85Å; W300-N304 PolarHBondContact O-ND2 3.17Å; W300-N304 PolarHBondContact O-OD1 3.35Å; W300-C353 HydrophobicContact CD2-CB 4.48Å; W300-C353 HydrophobicContact CE3-CB 3.86Å; W300-C353 HydrophobicContact CZ3-CB 3.98Å; W300-G355 VanDerWaalsContact NE1-CA 3.28Å; W300-F359 HydrophobicContact CH2-CD1 4.47Å; W300-F359 AromaticContact CH2-CD2 3.33Å; W300-F359 HydrophobicContact CH2-CD2 3.33Å; W300-F359 HydrophobicContact CH2-CE1 4.22Å; W300-F359 AromaticContact CH2-CE2 3.02Å; W300-F359 HydrophobicContact CH2-CE2 3.02Å; W300-F359 HydrophobicContact CH2-CG 4.06Å; W300-F359 AromaticContact CH2-CZ 3.5Å; W300-F359 HydrophobicContact CH2-CZ 3.5Å; W300-F359 VanDerWaalsContact CH2-CZ 3.5Å; W300-F359 HydrophobicContact CZ2-CB 4.43Å; W300-F359 AromaticContact CZ2-CD1 3.94Å; W300-F359 HydrophobicContact CZ2-CD1 3.94Å; W300-F359 AromaticContact CZ2-CD2 3.39Å; W300-F359 HydrophobicContact CZ2-CD2 3.39Å; W300-F359 AromaticContact CZ2-CE1 3.97Å; W300-F359 HydrophobicContact CZ2-CE1 3.97Å; W300-F359 AromaticContact CZ2-CE2 3.47Å; W300-F359 HydrophobicContact CZ2-CE2 3.47Å; W300-F359 VanDerWaalsContact CZ2-CE2 3.47Å; W300-F359 AromaticContact CZ2-CG 3.64Å; W300-F359 HydrophobicContact CZ2-CG 3.64Å; W300-F359 AromaticContact CZ2-CZ 3.73Å; W300-F359 HydrophobicContact CZ2-CZ 3.73Å; W300-F359 HydrophobicContact CZ3-CD2 4.21Å; W300-F359 HydrophobicContact CZ3-CE2 4Å; W300-F365 HydrophobicContact CZ3-CE1 4.47Å; W300-W425 AromaticContact CH2-CH2 3.9Å; W300-W425 HydrophobicContact CH2-CH2 3.9Å; W300-W425 HydrophobicContact CH2-CZ3 4.49Å; W300-W425 HydrophobicContact CZ3-CH2 4.21Å
301	N	91.4	Very high	90.7	Very high	116 Å²	116	38.1 Å²	38.1	62%	0.62	21%	0.212	S	C	*	.	H	α-helix	trans	-60.6	-37.6	174.7	-69.3	-28.2	0	0	0	112.3	E299 A305	E299-N301 PolarHBondContact O-N 3.49Å; N301-A305 VanDerWaalsContact O-CB 3.29Å; N301-A305 WeakPolarHBondContact O-CB 3.49Å; N301-A305 PolarHBondContact O-N 3.29Å
302	E	93	Very high	90.9	Very high	39 Å²	39	41.2 Å²	41.2	18%	0.182	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-44.6	177.2	-165.7	-173.4	157	0	0	110.8	F288 R289 V298 E299 W300 A305 A306	F288-E302 HydrophobicContact CB-CG 4.19Å; F288-E302 HydrophobicContact CD1-CG 3.94Å; R289-E302 VanDerWaalsContact CB-OE1 3.27Å; R289-E302 WeakPolarHBondContact CB-OE1 3.44Å; R289-E302 WeakPolarHBondContact CG-OE1 3.28Å; R289-E302 IonicContact CZ-OE1 2.69Å; R289-E302 IonicContact CZ-OE2 2.73Å; R289-E302 PolarHBondContact N-OE1 2.9Å; R289-E302 IonicContact NE-OE1 2.84Å; R289-E302 PolarHBondContact NE-OE1 3.43Å; R289-E302 IonicContact NE-OE2 3.7Å; R289-E302 PolarHBondContact NE-OE2 3.11Å; R289-E302 IonicContact NH2-OE1 3.99Å; R289-E302 IonicContact NH2-OE2 3.54Å; R289-E302 PolarHBondContact NH2-OE2 3.26Å; V298-E302 HydrophobicContact CG1-CB 4Å; V298-E302 HydrophobicContact CG1-CG 4.23Å; V298-E302 WeakPolarHBondContact CG1-OE2 3.44Å; E299-E302 VanDerWaalsContact O-CB 3.31Å; E299-E302 WeakPolarHBondContact O-CB 3.39Å; E299-E302 PolarHBondContact O-N 3.33Å; W300-E302 VanDerWaalsContact C-N 3.27Å; W300-E302 PolarHBondContact O-N 2.84Å; E302-A305 PolarHBondContact O-N 3.39Å; E302-A306 WeakPolarHBondContact O-CB 3.47Å; E302-A306 PolarHBondContact O-N 3.5Å
303	I	91.2	Very high	91.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-45.1	177.8	-60	174.8	0	0	0	110.6	L290 R292 V298 E299 W300 A305 A306 W307 W425	L290-I303 HydrophobicContact CD1-CG2 4.45Å; R292-I303 HydrophobicContact CB-CD1 4.28Å; V298-I303 HydrophobicContact CB-CD1 4.24Å; V298-I303 HydrophobicContact CB-CG1 4.25Å; V298-I303 HydrophobicContact CG1-CD1 4.22Å; V298-I303 HydrophobicContact CG1-CG1 3.69Å; E299-I303 PolarHBondContact O-N 3.19Å; W300-I303 HydrophobicContact CD2-CD1 4.41Å; W300-I303 HydrophobicContact CE3-CB 4.31Å; W300-I303 HydrophobicContact CE3-CD1 4.11Å; W300-I303 HydrophobicContact CE3-CG2 4.36Å; W300-I303 HydrophobicContact CH2-CD1 4.31Å; W300-I303 HydrophobicContact CZ3-CB 4.49Å; W300-I303 HydrophobicContact CZ3-CD1 4.06Å; W300-I303 HydrophobicContact CZ3-CG2 4.08Å; W300-I303 PolarHBondContact O-N 3.39Å; I303-A305 VanDerWaalsContact C-N 3.34Å; I303-A305 PolarHBondContact O-N 2.92Å; I303-A306 WeakPolarHBondContact O-CB 3.41Å; I303-A306 PolarHBondContact O-N 3.45Å; I303-W307 PolarHBondContact O-N 2.99Å; I303-W425 HydrophobicContact CD1-CH2 4.27Å; I303-W425 HydrophobicContact CG2-CH2 4.17Å
304	N	93	Very high	91.4	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.037	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-38.5	178.5	-65.2	-16.6	0	0	0	111.3	W300 W307 G308 N335 Y352 C353	W300-N304 VanDerWaalsContact O-CB 3.28Å; W300-N304 WeakPolarHBondContact O-CB 3.5Å; W300-N304 PolarHBondContact O-N 2.85Å; W300-N304 PolarHBondContact O-ND2 3.17Å; W300-N304 PolarHBondContact O-OD1 3.35Å; N304-W307 PolarHBondContact O-N 3.4Å; N304-G308 PolarHBondContact O-N 3.24Å; N304-N335 HydrophobicContact CB-CB 4.28Å; N304-N335 WeakPolarHBondContact CB-O 3.47Å; N304-Y352 WeakPolarHBondContact OD1-CA 3.44Å; N304-C353 PolarHBondContact ND2-N 3.03Å; N304-C353 PolarHBondContact ND2-O 3.16Å; N304-C353 PolarHBondContact OD1-N 2.98Å
305	A	94.1	Very high	91.8	Very high	20 Å²	20	36.6 Å²	36.6	17%	0.165	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-41.1	173.1	0	0	0	0	0	111.9	F288 N301 E302 I303 G308 Q309	F288-A305 HydrophobicContact CD1-CB 4.22Å; F288-A305 HydrophobicContact CD2-CB 4.33Å; F288-A305 HydrophobicContact CE1-CB 4.32Å; F288-A305 HydrophobicContact CE2-CB 4.43Å; F288-A305 HydrophobicContact CG-CB 4.22Å; F288-A305 HydrophobicContact CZ-CB 4.42Å; N301-A305 VanDerWaalsContact O-CB 3.29Å; N301-A305 WeakPolarHBondContact O-CB 3.49Å; N301-A305 PolarHBondContact O-N 3.29Å; E302-A305 PolarHBondContact O-N 3.39Å; I303-A305 VanDerWaalsContact C-N 3.34Å; I303-A305 PolarHBondContact O-N 2.92Å; A305-G308 WeakPolarHBondContact O-CA 3.46Å; A305-G308 PolarHBondContact O-N 2.86Å; A305-G308 VanDerWaalsContact O-N 3.14Å; A305-Q309 WeakPolarHBondContact O-CG 3.48Å; A305-Q309 PolarHBondContact O-N 3.23Å
306	A	94.4	Very high	92.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.7	-44.7	174.4	0	0	0	0	0	111.3	I285 F288 L290 E302 I303 G308 Q309 T310	I285-A306 HydrophobicContact CG2-CB 3.98Å; I285-A306 WeakPolarHBondContact CG2-O 3.34Å; F288-A306 HydrophobicContact CB-CB 3.71Å; L290-A306 HydrophobicContact CB-CB 4.04Å; L290-A306 HydrophobicContact CD1-CB 3.64Å; L290-A306 HydrophobicContact CG-CB 4.42Å; E302-A306 WeakPolarHBondContact O-CB 3.47Å; E302-A306 PolarHBondContact O-N 3.5Å; I303-A306 WeakPolarHBondContact O-CB 3.41Å; I303-A306 PolarHBondContact O-N 3.45Å; A306-G308 VanDerWaalsContact C-N 3.31Å; A306-G308 PolarHBondContact O-N 2.77Å; A306-Q309 PolarHBondContact O-N 2.99Å; A306-T310 WeakPolarHBondContact O-CB 3.44Å; A306-T310 PolarHBondContact O-N 2.82Å; A306-T310 PolarHBondContact O-OG1 3.43Å
307	W	94.1	Very high	92.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-42.7	171.7	-88.2	117.3	0	0	0	112.1	L290 I303 N304 Q309 T310 V311 L351 F365 M369 F372 I415 L429 M432	L290-W307 HydrophobicContact CD1-CD2 4.02Å; L290-W307 HydrophobicContact CD1-CG 3.85Å; I303-W307 PolarHBondContact O-N 2.99Å; N304-W307 PolarHBondContact O-N 3.4Å; W307-Q309 PolarHBondContact O-N 3.09Å; W307-T310 HydrophobicContact CE3-CG2 4.5Å; W307-T310 WeakPolarHBondContact O-CB 3.37Å; W307-T310 PolarHBondContact O-N 3.34Å; W307-T310 VanDerWaalsContact O-N 3.12Å; W307-V311 VanDerWaalsContact O-CG2 3.32Å; W307-V311 WeakPolarHBondContact O-CG2 3.07Å; W307-V311 PolarHBondContact O-N 2.88Å; W307-L351 HydrophobicContact CB-CB 4.49Å; W307-L351 HydrophobicContact CD2-CD2 4.3Å; W307-L351 HydrophobicContact CE3-CD1 3.98Å; W307-L351 HydrophobicContact CE3-CD2 4.14Å; W307-L351 HydrophobicContact CH2-CD2 4.39Å; W307-L351 HydrophobicContact CZ3-CD1 4.27Å; W307-L351 HydrophobicContact CZ3-CD2 4.19Å; W307-F365 AromaticContact NE1-CZ 3.58Å; W307-M369 HydrophobicContact CH2-CB 4.46Å; W307-M369 HydrophobicContact CH2-CG 3.92Å; W307-M369 HydrophobicContact CH2-SD 4.48Å; W307-M369 HydrophobicContact CZ2-CB 4.45Å; W307-M369 HydrophobicContact CZ2-CG 3.52Å; W307-M369 HydrophobicContact CZ2-SD 3.62Å; W307-F372 HydrophobicContact CH2-CD1 4.14Å; W307-F372 HydrophobicContact CZ3-CB 4.39Å; W307-F372 AromaticContact CZ3-CD1 3.57Å; W307-F372 HydrophobicContact CZ3-CD1 3.57Å; W307-F372 HydrophobicContact CZ3-CD2 4.45Å; W307-F372 AromaticContact CZ3-CE1 3.92Å; W307-F372 HydrophobicContact CZ3-CE1 3.92Å; W307-F372 AromaticContact CZ3-CG 3.86Å; W307-F372 HydrophobicContact CZ3-CG 3.86Å; W307-I415 HydrophobicContact CH2-CD1 4.29Å; W307-L429 HydrophobicContact CH2-CD2 3.94Å; W307-L429 HydrophobicContact CZ2-CD2 3.34Å; W307-M432 HydrophobicContact CH2-CE 3.56Å; W307-M432 HydrophobicContact CH2-SD 3.69Å; W307-M432 HydrophobicContact CZ2-CE 4.3Å; W307-M432 HydrophobicContact CZ3-CE 3.68Å; W307-M432 HydrophobicContact CZ3-SD 3.99Å
308	G	94.5	Very high	92.4	Very high	3 Å²	3	27 Å²	27	3%	0.031	14%	0.14	C	C	.	.	H	α-helix	trans	-49.8	-54.5	172.8	0	0	0	0	0	113.9	N304 A305 A306 T310 V311 L312 G334 S337	N304-G308 PolarHBondContact O-N 3.24Å; A305-G308 WeakPolarHBondContact O-CA 3.46Å; A305-G308 PolarHBondContact O-N 2.86Å; A305-G308 VanDerWaalsContact O-N 3.14Å; A306-G308 VanDerWaalsContact C-N 3.31Å; A306-G308 PolarHBondContact O-N 2.77Å; G308-T310 VanDerWaalsContact C-N 3.31Å; G308-T310 PolarHBondContact O-N 3.24Å; G308-V311 PolarHBondContact O-N 3.23Å; G308-L312 WeakPolarHBondContact O-CB 3.36Å; G308-L312 PolarHBondContact O-N 3.38Å; G308-G334 WeakPolarHBondContact CA-O 3.41Å; G308-S337 WeakPolarHBondContact CA-OG 3.29Å
309	Q	94.3	Very high	92.5	Very high	49 Å²	49	32.8 Å²	32.8	23%	0.229	17%	0.171	C	C	.	.	H	α-helix	trans	-64.5	-36.9	177.4	-64.4	-60.4	-38.7	0	0	112.1	I285 N286 F288 A305 A306 W307 L312 L313	I285-Q309 HydrophobicContact CD1-CB 3.79Å; I285-Q309 HydrophobicContact CG1-CB 3.94Å; I285-Q309 HydrophobicContact CG2-CB 3.9Å; N286-Q309 PolarHBondContact ND2-OE1 3.49Å; F288-Q309 HydrophobicContact CD2-CG 4.24Å; F288-Q309 HydrophobicContact CE2-CG 4.45Å; A305-Q309 WeakPolarHBondContact O-CG 3.48Å; A305-Q309 PolarHBondContact O-N 3.23Å; A306-Q309 PolarHBondContact O-N 2.99Å; W307-Q309 PolarHBondContact O-N 3.09Å; Q309-L312 PolarHBondContact O-N 2.87Å; Q309-L313 VanDerWaalsContact O-CB 3.31Å; Q309-L313 WeakPolarHBondContact O-CB 3.45Å; Q309-L313 PolarHBondContact O-N 3.2Å
310	T	94	Very high	92.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.7	-42.3	179.8	-55	0	0	0	0	111.5	A306 W307 G308 L313 L314 F372 M432 L433 L436	A306-T310 WeakPolarHBondContact O-CB 3.44Å; A306-T310 PolarHBondContact O-N 2.82Å; A306-T310 PolarHBondContact O-OG1 3.43Å; W307-T310 HydrophobicContact CE3-CG2 4.5Å; W307-T310 WeakPolarHBondContact O-CB 3.37Å; W307-T310 PolarHBondContact O-N 3.34Å; W307-T310 VanDerWaalsContact O-N 3.12Å; G308-T310 VanDerWaalsContact C-N 3.31Å; G308-T310 PolarHBondContact O-N 3.24Å; T310-L313 PolarHBondContact O-N 3.06Å; T310-L314 PolarHBondContact O-N 3.32Å; T310-L314 VanDerWaalsContact O-N 3.09Å; T310-F372 HydrophobicContact CG2-CE1 3.92Å; T310-F372 HydrophobicContact CG2-CZ 3.69Å; T310-M432 HydrophobicContact CG2-CE 3.92Å; T310-L433 HydrophobicContact CG2-CD2 4.03Å; T310-L436 HydrophobicContact CG2-CD1 3.36Å
311	V	95.1	Very high	92.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.8	-44	175.1	174.5	0	0	0	0	110.8	W307 G308 L313 L314 H315 L330 P332 L351 F372	W307-V311 VanDerWaalsContact O-CG2 3.32Å; W307-V311 WeakPolarHBondContact O-CG2 3.07Å; W307-V311 PolarHBondContact O-N 2.88Å; G308-V311 PolarHBondContact O-N 3.23Å; V311-L313 VanDerWaalsContact C-N 3.33Å; V311-L313 PolarHBondContact O-N 3.48Å; V311-L314 PolarHBondContact O-N 3.44Å; V311-H315 VanDerWaalsContact O-CB 3.26Å; V311-H315 WeakPolarHBondContact O-CB 3.3Å; V311-H315 PolarHBondContact O-N 2.9Å; V311-L330 HydrophobicContact CG1-CB 4.08Å; V311-L330 HydrophobicContact CG1-CD2 4.37Å; V311-P332 HydrophobicContact CG1-CB 4.14Å; V311-L351 HydrophobicContact CG2-CD1 3.38Å; V311-F372 HydrophobicContact CB-CE2 4.46Å; V311-F372 HydrophobicContact CG2-CD2 4.07Å; V311-F372 HydrophobicContact CG2-CE2 3.89Å
312	L	94.4	Very high	91.8	Very high	66 Å²	66	30.2 Å²	30.2	35%	0.346	17%	0.172	S	C	.	.	H	α-helix	trans	-62.5	-41.4	177.7	-177.6	62.5	0	0	0	111.7	F274 G308 Q309 H315 A316 P332	F274-L312 HydrophobicContact CE1-CB 4.25Å; F274-L312 HydrophobicContact CE1-CD2 4.02Å; F274-L312 HydrophobicContact CE1-CG 4.04Å; F274-L312 HydrophobicContact CZ-CB 4.46Å; F274-L312 HydrophobicContact CZ-CD2 4.04Å; F274-L312 HydrophobicContact CZ-CG 3.87Å; G308-L312 WeakPolarHBondContact O-CB 3.36Å; G308-L312 PolarHBondContact O-N 3.38Å; Q309-L312 PolarHBondContact O-N 2.87Å; L312-H315 PolarHBondContact O-N 3.45Å; L312-A316 VanDerWaalsContact O-CB 3.25Å; L312-A316 WeakPolarHBondContact O-CB 3.3Å; L312-A316 PolarHBondContact O-N 2.78Å; L312-P332 HydrophobicContact CB-CB 3.87Å; L312-P332 HydrophobicContact CD1-CB 3.8Å; L312-P332 HydrophobicContact CD1-CG 3.84Å; L312-P332 HydrophobicContact CG-CB 4.43Å
313	L	93.7	Very high	91.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.5	-54.1	174.9	170.4	65.7	0	0	0	111.4	F274 I276 I285 Q309 T310 V311 H315 A316 L317 L436 L440	F274-L313 HydrophobicContact CB-CD1 3.99Å; F274-L313 HydrophobicContact CD1-CB 3.96Å; F274-L313 HydrophobicContact CD1-CD1 4.44Å; F274-L313 HydrophobicContact CD2-CB 4.44Å; F274-L313 HydrophobicContact CD2-CD1 3.61Å; F274-L313 HydrophobicContact CE1-CB 4.09Å; F274-L313 HydrophobicContact CE2-CD1 4.18Å; F274-L313 HydrophobicContact CG-CB 4.14Å; F274-L313 HydrophobicContact CG-CD1 3.76Å; F274-L313 HydrophobicContact CG-CG 4.45Å; F274-L313 HydrophobicContact CZ-CB 4.4Å; I276-L313 HydrophobicContact CD1-CD2 3.48Å; I276-L313 VanDerWaalsContact CD1-CD2 3.48Å; I276-L313 HydrophobicContact CG1-CD2 4.41Å; I285-L313 HydrophobicContact CD1-CB 4.45Å; I285-L313 HydrophobicContact CD1-CD2 4.12Å; Q309-L313 VanDerWaalsContact O-CB 3.31Å; Q309-L313 WeakPolarHBondContact O-CB 3.45Å; Q309-L313 PolarHBondContact O-N 3.2Å; T310-L313 PolarHBondContact O-N 3.06Å; V311-L313 VanDerWaalsContact C-N 3.33Å; V311-L313 PolarHBondContact O-N 3.48Å; L313-H315 VanDerWaalsContact C-N 3.32Å; L313-H315 PolarHBondContact O-N 3.25Å; L313-A316 PolarHBondContact O-N 2.88Å; L313-L317 HydrophobicContact CD1-CD1 4.04Å; L313-L317 HydrophobicContact CD1-CG 4.09Å; L313-L317 HydrophobicContact CG-CD1 4.21Å; L313-L317 WeakPolarHBondContact O-CB 3.3Å; L313-L317 WeakPolarHBondContact O-CG 3.46Å; L313-L317 PolarHBondContact O-N 3.32Å; L313-L436 HydrophobicContact CD2-CB 4.04Å; L313-L436 HydrophobicContact CD2-CD1 4.46Å; L313-L440 HydrophobicContact CD1-CD1 3.57Å; L313-L440 HydrophobicContact CD1-CD2 4.5Å
314	L	93.3	Very high	91.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-39.7	-178.7	-177.7	61.4	0	0	0	111.5	T310 V311 L317 A318 F325 L330 F372 C375 V376 F379 L436	T310-L314 PolarHBondContact O-N 3.32Å; T310-L314 VanDerWaalsContact O-N 3.09Å; V311-L314 PolarHBondContact O-N 3.44Å; L314-L317 PolarHBondContact O-N 2.61Å; L314-A318 VanDerWaalsContact O-CB 3.3Å; L314-A318 WeakPolarHBondContact O-CB 3.39Å; L314-A318 PolarHBondContact O-N 2.67Å; L314-F325 HydrophobicContact CD1-CZ 4.26Å; L314-F325 HydrophobicContact CD2-CZ 4.38Å; L314-F325 HydrophobicContact CG-CZ 4.08Å; L314-L330 HydrophobicContact CB-CD1 3.95Å; L314-L330 HydrophobicContact CD2-CD1 3.65Å; L314-L330 HydrophobicContact CD2-CD2 4.47Å; L314-L330 HydrophobicContact CG-CD1 3.61Å; L314-F372 HydrophobicContact CB-CE2 4.17Å; L314-F372 HydrophobicContact CB-CZ 4.06Å; L314-F372 HydrophobicContact CD2-CD2 4.3Å; L314-F372 HydrophobicContact CD2-CE1 4.37Å; L314-F372 HydrophobicContact CD2-CE2 3.57Å; L314-F372 HydrophobicContact CD2-CZ 3.61Å; L314-F372 HydrophobicContact CG-CZ 4.49Å; L314-C375 HydrophobicContact CD2-CB 3.82Å; L314-V376 HydrophobicContact CD2-CG2 3.81Å; L314-F379 HydrophobicContact CD1-CB 3.91Å; L314-F379 HydrophobicContact CD1-CD1 4.38Å; L314-F379 HydrophobicContact CD1-CD2 4.14Å; L314-F379 HydrophobicContact CD1-CG 3.88Å; L314-L436 HydrophobicContact CB-CD2 4.39Å; L314-L436 HydrophobicContact CD1-CD2 3.99Å
315	H	92.4	Very high	91.3	Very high	76 Å²	76	39.4 Å²	39.4	35%	0.352	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-44.5	174.1	179.4	-86.1	0	0	0	111.8	V311 L312 L313 A318 N319 L330 P332	V311-H315 VanDerWaalsContact O-CB 3.26Å; V311-H315 WeakPolarHBondContact O-CB 3.3Å; V311-H315 PolarHBondContact O-N 2.9Å; L312-H315 PolarHBondContact O-N 3.45Å; L313-H315 VanDerWaalsContact C-N 3.32Å; L313-H315 PolarHBondContact O-N 3.25Å; H315-A318 PolarHBondContact O-N 3.47Å; H315-N319 WeakPolarHBondContact O-CB 3.5Å; H315-N319 PolarHBondContact O-N 3.38Å; H315-L330 HydrophobicContact CB-CB 4.34Å; H315-L330 HydrophobicContact CB-CD1 4.33Å; H315-P332 HydrophobicContact CB-CG 4.45Å
316	A	90.9	Very high	90.8	Very high	26 Å²	26	45.9 Å²	45.9	22%	0.215	24%	0.239	C	C	.	.	H	α-helix	trans	-66.3	-40.4	178.4	0	0	0	0	0	112.3	F270 L312 L313 K320	F270-A316 HydrophobicContact CE1-CB 4.06Å; L312-A316 VanDerWaalsContact O-CB 3.25Å; L312-A316 WeakPolarHBondContact O-CB 3.3Å; L312-A316 PolarHBondContact O-N 2.78Å; L313-A316 PolarHBondContact O-N 2.88Å; A316-K320 WeakPolarHBondContact O-CB 3.33Å; A316-K320 PolarHBondContact O-N 3.14Å
317	L	89.8	Confident	90.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.2	-47.3	174.4	-73.8	-178.2	0	0	0	111.8	F270 L313 L314 N319 K320 M321 F379 L440 V443	F270-L317 HydrophobicContact CD1-CD2 4.36Å; F270-L317 HydrophobicContact CE1-CD2 4.18Å; F270-L317 HydrophobicContact CZ-CD2 4.44Å; L313-L317 HydrophobicContact CD1-CD1 4.04Å; L313-L317 HydrophobicContact CD1-CG 4.09Å; L313-L317 HydrophobicContact CG-CD1 4.21Å; L313-L317 WeakPolarHBondContact O-CB 3.3Å; L313-L317 WeakPolarHBondContact O-CG 3.46Å; L313-L317 PolarHBondContact O-N 3.32Å; L314-L317 PolarHBondContact O-N 2.61Å; L317-N319 PolarHBondContact O-N 3.21Å; L317-K320 PolarHBondContact O-N 3.43Å; L317-M321 PolarHBondContact O-N 3.37Å; L317-F379 HydrophobicContact CB-CE2 3.77Å; L317-F379 HydrophobicContact CB-CZ 4.14Å; L317-F379 HydrophobicContact CD1-CE1 4.5Å; L317-F379 HydrophobicContact CD1-CE2 4.41Å; L317-F379 HydrophobicContact CD1-CZ 3.96Å; L317-L440 HydrophobicContact CD1-CD1 4.26Å; L317-L440 HydrophobicContact CD2-CD1 3.63Å; L317-L440 HydrophobicContact CG-CD1 4.23Å; L317-V443 HydrophobicContact CD2-CB 3.89Å; L317-V443 HydrophobicContact CD2-CG1 3.92Å; L317-V443 HydrophobicContact CD2-CG2 3.94Å
318	A	89.9	Confident	90.1	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.033	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-45.6	177.7	0	0	0	0	0	111.6	L314 H315 K320 M321 G322 L323 F325	L314-A318 VanDerWaalsContact O-CB 3.3Å; L314-A318 WeakPolarHBondContact O-CB 3.39Å; L314-A318 PolarHBondContact O-N 2.67Å; H315-A318 PolarHBondContact O-N 3.47Å; A318-K320 VanDerWaalsContact C-N 3.3Å; A318-K320 PolarHBondContact O-N 3.35Å; A318-M321 CarbonylContact O-C 3.54Å; A318-M321 PolarHBondContact O-N 3.47Å; A318-G322 PolarHBondContact O-N 2.86Å; A318-L323 HydrophobicContact CB-CB 4.26Å; A318-L323 PolarHBondContact O-N 3.01Å; A318-F325 HydrophobicContact CB-CE2 3.48Å; A318-F325 VanDerWaalsContact CB-CE2 3.48Å; A318-F325 HydrophobicContact CB-CZ 3.55Å
319	N	90	Very high	90	Very high	125 Å²	125	60.1 Å²	60.1	67%	0.668	29%	0.292	S	S	*	.	H	α-helix	trans	-61.9	-38.9	176.4	-170.6	45.1	0	0	0	111.9	H315 L317 M321 G322	H315-N319 WeakPolarHBondContact O-CB 3.5Å; H315-N319 PolarHBondContact O-N 3.38Å; L317-N319 PolarHBondContact O-N 3.21Å; N319-M321 VanDerWaalsContact C-N 3.32Å; N319-M321 PolarHBondContact O-N 3.45Å; N319-G322 PolarHBondContact O-N 2.76Å
320	K	85.8	Confident	89.8	Confident	105 Å²	105	58 Å²	58	46%	0.457	28%	0.282	S	S	.	.	H	α-helix	trans	-66.4	-33.5	177.3	-172.5	66.6	177	-176.5	0	112.7	F270 A316 L317 A318 V443 F447	F270-K320 HydrophobicContact CE2-CD 4.49Å; F270-K320 HydrophobicContact CE2-CG 4.16Å; F270-K320 HydrophobicContact CZ-CB 4.07Å; F270-K320 HydrophobicContact CZ-CD 4.47Å; F270-K320 HydrophobicContact CZ-CG 4.06Å; A316-K320 WeakPolarHBondContact O-CB 3.33Å; A316-K320 PolarHBondContact O-N 3.14Å; L317-K320 PolarHBondContact O-N 3.43Å; A318-K320 VanDerWaalsContact C-N 3.3Å; A318-K320 PolarHBondContact O-N 3.35Å; K320-V443 HydrophobicContact CG-CG1 4.2Å; K320-F447 HydrophobicContact CD-CE2 4.08Å; K320-F447 HydrophobicContact CD-CZ 4.11Å; K320-F447 VanDerWaalsContact CE-CE2 3.48Å; K320-F447 HydrophobicContact CG-CD2 4.32Å; K320-F447 HydrophobicContact CG-CE2 3.5Å; K320-F447 VanDerWaalsContact CG-CE2 3.5Å; K320-F447 HydrophobicContact CG-CZ 3.83Å
321	M	84.6	Confident	89.7	Confident	53 Å²	53	59.2 Å²	59.2	26%	0.261	29%	0.29	S	S	.	.	H	α-helix	trans	-84.5	-9.6	174.4	-69.5	-177.4	63.4	0	0	113.6	L317 A318 N319 L323 F379 E382 V383 W442 V443	L317-M321 PolarHBondContact O-N 3.37Å; A318-M321 CarbonylContact O-C 3.54Å; A318-M321 PolarHBondContact O-N 3.47Å; N319-M321 VanDerWaalsContact C-N 3.32Å; N319-M321 PolarHBondContact O-N 3.45Å; M321-L323 HydrophobicContact CB-CB 4.44Å; M321-L323 PolarHBondContact O-N 3.12Å; M321-F379 HydrophobicContact SD-CD2 4.07Å; M321-F379 HydrophobicContact SD-CE2 3.32Å; M321-F379 WeakPolarHBondContact SD-CE2 3.3Å; M321-F379 HydrophobicContact SD-CZ 3.91Å; M321-E382 HydrophobicContact CE-CB 4.33Å; M321-E382 HydrophobicContact CE-CG 4.1Å; M321-V383 HydrophobicContact CE-CG2 3.73Å; M321-V383 HydrophobicContact SD-CG2 3.82Å; M321-W442 HydrophobicContact CE-CH2 3.99Å; M321-W442 HydrophobicContact CE-CZ3 3.62Å; M321-W442 HydrophobicContact SD-CZ3 3.82Å; M321-V443 HydrophobicContact CG-CG2 4.15Å; M321-V443 HydrophobicContact SD-CG2 3.74Å
322	G	85.1	Confident	89.5	Confident	62 Å²	62	61.1 Å²	61.1	64%	0.639	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	18.4	-170.7	0	0	0	0	0	113.8	A318 N319	A318-G322 PolarHBondContact O-N 2.86Å; N319-G322 PolarHBondContact O-N 2.76Å
323	L	87.7	Confident	89.4	Confident	27 Å²	27	65.4 Å²	65.4	14%	0.141	32%	0.315	C	S	.	.			trans	-75.4	126.7	179.8	175.2	62.2	0	0	0	110.6	A318 M321 F325 F379 E382	A318-L323 HydrophobicContact CB-CB 4.26Å; A318-L323 PolarHBondContact O-N 3.01Å; M321-L323 HydrophobicContact CB-CB 4.44Å; M321-L323 PolarHBondContact O-N 3.12Å; L323-F325 HydrophobicContact CD2-CD1 4.27Å; L323-F325 HydrophobicContact CD2-CE1 3.7Å; L323-F325 HydrophobicContact CD2-CZ 4.16Å; L323-F325 HydrophobicContact CG-CE1 4.32Å; L323-F379 HydrophobicContact CD2-CB 4.13Å; L323-F379 HydrophobicContact CD2-CD2 4.16Å; L323-E382 HydrophobicContact CD1-CB 4.06Å; L323-E382 HydrophobicContact CD1-CG 3.96Å; L323-E382 HydrophobicContact CD2-CB 4.12Å
324	K	88.8	Confident	89.2	Confident	186 Å²	186	67.6 Å²	67.6	81%	0.809	34%	0.338	S	S	*	.			trans	-105.7	120.4	167.9	-66.7	-175.3	-179.5	178.8	0	109.7
325	F	90.3	Very high	89	Confident	26 Å²	26	70.8 Å²	70.8	11%	0.114	36%	0.355	C	S	.	.			trans	-69.1	139.9	175.4	-60.8	-67	0	0	0	111.2	L314 A318 L323 Y328 L330 L342 C375 Q378 F379	L314-F325 HydrophobicContact CD1-CZ 4.26Å; L314-F325 HydrophobicContact CD2-CZ 4.38Å; L314-F325 HydrophobicContact CG-CZ 4.08Å; A318-F325 HydrophobicContact CB-CE2 3.48Å; A318-F325 VanDerWaalsContact CB-CE2 3.48Å; A318-F325 HydrophobicContact CB-CZ 3.55Å; L323-F325 HydrophobicContact CD2-CD1 4.27Å; L323-F325 HydrophobicContact CD2-CE1 3.7Å; L323-F325 HydrophobicContact CD2-CZ 4.16Å; L323-F325 HydrophobicContact CG-CE1 4.32Å; F325-Y328 WeakPolarHBondContact CB-O 3.37Å; F325-L330 HydrophobicContact CD2-CD1 4.21Å; F325-L330 HydrophobicContact CD2-CG 4.39Å; F325-L330 HydrophobicContact CE2-CD1 3.51Å; F325-L330 HydrophobicContact CE2-CG 4.17Å; F325-L330 HydrophobicContact CZ-CD1 4.05Å; F325-L342 WeakPolarHBondContact O-CD1 3.48Å; F325-C375 HydrophobicContact CD1-CB 4.03Å; F325-C375 HydrophobicContact CE1-CB 3.95Å; F325-C375 WeakPolarHBondContact CE1-O 3.45Å; F325-C375 HydrophobicContact CG-CB 4.46Å; F325-C375 HydrophobicContact CZ-CB 4.29Å; F325-Q378 HydrophobicContact CD1-CB 3.95Å; F325-Q378 HydrophobicContact CE1-CB 4.29Å; F325-F379 HydrophobicContact CE1-CB 4.33Å
326	Q	83.7	Confident	89	Confident	155 Å²	155	70.8 Å²	70.8	72%	0.724	36%	0.355	S	S	*	.	S	Bend	trans	-88	-26.7	-172	-63.5	-179	15.6	0	0	114	L342	Q326-L342 WeakPolarHBondContact O-CD1 3.37Å
327	R	85	Confident	89	Confident	100 Å²	100	69.6 Å²	69.6	38%	0.377	35%	0.345	S	S	.	.	S	Bend	trans	-109.4	-34.9	-172.4	-70	-176.8	-74.3	-82.9	2.3	114.3	L342 D374	R327-L342 PolarHBondContact O-N 3.36Å; R327-D374 IonicContact CZ-OD1 3.14Å; R327-D374 IonicContact CZ-OD2 3.91Å; R327-D374 VanDerWaalsContact CZ-OD2 3.25Å; R327-D374 IonicContact NE-OD1 3.18Å; R327-D374 PolarHBondContact NE-OD1 3.24Å; R327-D374 IonicContact NE-OD2 3.78Å; R327-D374 PolarHBondContact NE-OD2 3.09Å; R327-D374 IonicContact NH2-OD1 3.25Å; R327-D374 PolarHBondContact NH2-OD1 3.15Å; R327-D374 IonicContact NH2-OD2 3.18Å; R327-D374 PolarHBondContact NH2-OD2 2.99Å; R327-D374 VanDerWaalsContact NH2-OD2 3.08Å
328	Y	89.9	Confident	89.1	Confident	54 Å²	54	71.9 Å²	71.9	21%	0.212	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.5	-173.6	-55.3	-77.4	0	0	0	110.7	F325 L339 E340 L349 A371 D374	F325-Y328 WeakPolarHBondContact CB-O 3.37Å; Y328-L339 HydrophobicContact CG-CD2 4.34Å; Y328-E340 CarbonylContact C-O 3.29Å; Y328-E340 VanDerWaalsContact CA-O 3.29Å; Y328-E340 WeakPolarHBondContact CA-O 3.48Å; Y328-L349 HydrophobicContact CD1-CD1 4.08Å; Y328-L349 HydrophobicContact CE1-CD1 3.76Å; Y328-A371 HydrophobicContact CD1-CB 3.81Å; Y328-A371 HydrophobicContact CD2-CB 3.89Å; Y328-A371 HydrophobicContact CE1-CB 3.58Å; Y328-A371 HydrophobicContact CE2-CB 3.68Å; Y328-A371 HydrophobicContact CG-CB 3.96Å; Y328-D374 HydrophobicContact CD2-CB 4.44Å; Y328-D374 HydrophobicContact CE2-CB 4.16Å; Y328-D374 WeakPolarHBondContact CE2-OD2 3.48Å
329	R	90.6	Very high	89.2	Confident	149 Å²	149	71.7 Å²	71.7	56%	0.562	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.6	169.8	-173.7	-175.9	-175.2	-166.5	2.2	109.1	L339 E340 L342	R329-L339 WeakPolarHBondContact O-CA 3.36Å; R329-E340 HydrophobicContact CB-CB 4.33Å; R329-E340 PolarHBondContact N-O 3.37Å; R329-E340 IonicContact NH1-OE2 3.74Å; R329-E340 PolarHBondContact O-N 2.99Å; R329-L342 HydrophobicContact CB-CD2 4.32Å
330	L	92	Very high	89.1	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	126.7	174.5	-61.6	172.7	0	0	0	109.6	V311 L314 H315 F325 L339 F372 C375	V311-L330 HydrophobicContact CG1-CB 4.08Å; V311-L330 HydrophobicContact CG1-CD2 4.37Å; L314-L330 HydrophobicContact CB-CD1 3.95Å; L314-L330 HydrophobicContact CD2-CD1 3.65Å; L314-L330 HydrophobicContact CD2-CD2 4.47Å; L314-L330 HydrophobicContact CG-CD1 3.61Å; H315-L330 HydrophobicContact CB-CB 4.34Å; H315-L330 HydrophobicContact CB-CD1 4.33Å; F325-L330 HydrophobicContact CD2-CD1 4.21Å; F325-L330 HydrophobicContact CD2-CG 4.39Å; F325-L330 HydrophobicContact CE2-CD1 3.51Å; F325-L330 HydrophobicContact CE2-CG 4.17Å; F325-L330 HydrophobicContact CZ-CD1 4.05Å; L330-L339 HydrophobicContact CD2-CD1 4.13Å; L330-L339 HydrophobicContact CD2-CD2 3.89Å; L330-L339 HydrophobicContact CD2-CG 3.88Å; L330-F372 HydrophobicContact CD2-CD2 3.75Å; L330-F372 HydrophobicContact CD2-CE2 3.97Å; L330-C375 HydrophobicContact CD2-CB 4.31Å
331	V	91.9	Very high	89.2	Confident	25 Å²	25	63.7 Å²	63.7	15%	0.152	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	96.9	173.3	-172.6	0	0	0	0	109	Y333 Y338 E340	V331-Y333 PolarHBondContact O-N 3.02Å; V331-Y338 HydrophobicContact CB-CD1 4.37Å; V331-Y338 HydrophobicContact CB-CD2 4.17Å; V331-Y338 HydrophobicContact CB-CE1 4.08Å; V331-Y338 HydrophobicContact CB-CE2 3.89Å; V331-Y338 HydrophobicContact CB-CG 4.41Å; V331-Y338 HydrophobicContact CG1-CD1 4.43Å; V331-Y338 HydrophobicContact CG1-CE1 3.74Å; V331-Y338 HydrophobicContact CG1-CE2 4.15Å; V331-Y338 HydrophobicContact CG2-CD2 4.32Å; V331-Y338 HydrophobicContact CG2-CE2 3.85Å; V331-Y338 PolarHBondContact N-O 3.08Å; V331-Y338 PolarHBondContact O-N 3.2Å; V331-E340 HydrophobicContact CG2-CG 4.03Å
332	P	90.4	Very high	89.2	Confident	41 Å²	41	65.2 Å²	65.2	27%	0.266	32%	0.322	S	S	.	.			trans	-70.9	115.5	175	28.1	-31.4	0	0	0	109.7	V311 L312 H315	V311-P332 HydrophobicContact CG1-CB 4.14Å; L312-P332 HydrophobicContact CB-CB 3.87Å; L312-P332 HydrophobicContact CD1-CB 3.8Å; L312-P332 HydrophobicContact CD1-CG 3.84Å; L312-P332 HydrophobicContact CG-CB 4.43Å; H315-P332 HydrophobicContact CB-CG 4.45Å
333	Y	91.5	Very high	89.1	Confident	156 Å²	156	68.6 Å²	68.6	61%	0.612	33%	0.331	S	S	*	.			trans	-135.6	52.9	-177.4	-161.7	-116.2	0	0	0	111.1	V331 N335 H336 S337	V331-Y333 PolarHBondContact O-N 3.02Å; Y333-N335 PolarHBondContact O-N 3.27Å; Y333-H336 HydrophobicContact CD1-CB 3.94Å; Y333-H336 CarbonylContact O-C 3.59Å; Y333-H336 WeakPolarHBondContact O-CA 3.46Å; Y333-H336 PolarHBondContact O-N 3.15Å; Y333-S337 PolarHBondContact N-OG 3.36Å; Y333-S337 PolarHBondContact O-N 2.8Å
334	G	90	Very high	88.7	Confident	46 Å²	46	70.5 Å²	70.5	47%	0.474	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	57.8	-129.6	179.7	0	0	0	0	0	112.1	G308 H336 S337	G308-G334 WeakPolarHBondContact CA-O 3.41Å; G334-H336 PolarHBondContact O-N 3.27Å; G334-S337 PolarHBondContact O-OG 2.91Å
335	N	89	Confident	87.9	Confident	67 Å²	67	70.8 Å²	70.8	36%	0.358	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-76.7	5	175.8	63.7	-29.4	0	0	0	114.2	N304 Y333 Y352	N304-N335 HydrophobicContact CB-CB 4.28Å; N304-N335 WeakPolarHBondContact CB-O 3.47Å; Y333-N335 PolarHBondContact O-N 3.27Å; N335-Y352 WeakPolarHBondContact O-CB 3.31Å
336	H	91.4	Very high	87	Confident	76 Å²	76	74.5 Å²	74.5	35%	0.352	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-126.9	31.9	178.1	-65.9	82.7	0	0	0	111.3	Y333 G334 Y338 Y352	Y333-H336 HydrophobicContact CD1-CB 3.94Å; Y333-H336 CarbonylContact O-C 3.59Å; Y333-H336 WeakPolarHBondContact O-CA 3.46Å; Y333-H336 PolarHBondContact O-N 3.15Å; G334-H336 PolarHBondContact O-N 3.27Å; H336-Y338 WeakPolarHBondContact O-CD1 3.31Å; H336-Y352 HydrophobicContact CB-CD1 4.01Å; H336-Y352 HydrophobicContact CB-CE1 4.12Å; H336-Y352 HydrophobicContact CB-CG 4.4Å; H336-Y352 AromaticContact CD2-CD2 3.66Å; H336-Y352 AromaticContact CD2-CE2 3.64Å; H336-Y352 AromaticContact CD2-CG 3.98Å; H336-Y352 AromaticContact CD2-CZ 3.94Å
337	S	92.4	Very high	86.7	Confident	1 Å²	1	72 Å²	72	1%	0.007	36%	0.358	C	S	.	.			trans	-57.6	146.5	176.2	-69.9	0	0	0	0	112.2	G308 Y333 G334 L351	G308-S337 WeakPolarHBondContact CA-OG 3.29Å; Y333-S337 PolarHBondContact N-OG 3.36Å; Y333-S337 PolarHBondContact O-N 2.8Å; G334-S337 PolarHBondContact O-OG 2.91Å; S337-L351 WeakPolarHBondContact O-CA 3.42Å; S337-L351 WeakPolarHBondContact O-CB 3.41Å; S337-L351 PolarHBondContact O-N 3.49Å
338	Y	91.6	Very high	86.7	Confident	48 Å²	48	72.6 Å²	72.6	19%	0.188	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	165.3	-178.6	62.6	-86.1	0	0	0	111.3	V331 H336 E340 E348 L349	V331-Y338 HydrophobicContact CB-CD1 4.37Å; V331-Y338 HydrophobicContact CB-CD2 4.17Å; V331-Y338 HydrophobicContact CB-CE1 4.08Å; V331-Y338 HydrophobicContact CB-CE2 3.89Å; V331-Y338 HydrophobicContact CB-CG 4.41Å; V331-Y338 HydrophobicContact CG1-CD1 4.43Å; V331-Y338 HydrophobicContact CG1-CE1 3.74Å; V331-Y338 HydrophobicContact CG1-CE2 4.15Å; V331-Y338 HydrophobicContact CG2-CD2 4.32Å; V331-Y338 HydrophobicContact CG2-CE2 3.85Å; V331-Y338 PolarHBondContact N-O 3.08Å; V331-Y338 PolarHBondContact O-N 3.2Å; H336-Y338 WeakPolarHBondContact O-CD1 3.31Å; Y338-E340 HydrophobicContact CD2-CG 4.12Å; Y338-E340 HydrophobicContact CE2-CG 3.74Å; Y338-E348 HydrophobicContact CD2-CB 4.4Å; Y338-E348 HydrophobicContact CD2-CG 4.23Å; Y338-E348 HydrophobicContact CE2-CG 4.3Å; Y338-L349 CarbonylContact C-O 3.55Å; Y338-L349 WeakPolarHBondContact CA-O 3.36Å
339	L	90.9	Very high	86.7	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	137.2	173.4	-79.7	77.9	0	0	0	109.6	Y328 R329 L330 L349 L351 A371 F372	Y328-L339 HydrophobicContact CG-CD2 4.34Å; R329-L339 WeakPolarHBondContact O-CA 3.36Å; L330-L339 HydrophobicContact CD2-CD1 4.13Å; L330-L339 HydrophobicContact CD2-CD2 3.89Å; L330-L339 HydrophobicContact CD2-CG 3.88Å; L339-L349 HydrophobicContact CB-CB 4.08Å; L339-L349 PolarHBondContact N-O 3.42Å; L339-L349 WeakPolarHBondContact O-CB 3.46Å; L339-L349 PolarHBondContact O-N 3.29Å; L339-L351 HydrophobicContact CD1-CD1 3.22Å; L339-L351 HydrophobicContact CD1-CG 3.76Å; L339-A371 HydrophobicContact CD2-CB 3.83Å; L339-F372 HydrophobicContact CD1-CB 4.49Å; L339-F372 HydrophobicContact CD1-CD2 4.44Å; L339-F372 HydrophobicContact CD2-CB 4.33Å
340	E	89.8	Confident	86.6	Confident	50 Å²	50	64.2 Å²	64.2	23%	0.234	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.6	170.4	-63	173.8	168	0	0	108.8	Y328 R329 V331 Y338	Y328-E340 CarbonylContact C-O 3.29Å; Y328-E340 VanDerWaalsContact CA-O 3.29Å; Y328-E340 WeakPolarHBondContact CA-O 3.48Å; R329-E340 HydrophobicContact CB-CB 4.33Å; R329-E340 PolarHBondContact N-O 3.37Å; R329-E340 IonicContact NH1-OE2 3.74Å; R329-E340 PolarHBondContact O-N 2.99Å; V331-E340 HydrophobicContact CG2-CG 4.03Å; Y338-E340 HydrophobicContact CD2-CG 4.12Å; Y338-E340 HydrophobicContact CE2-CG 3.74Å
341	S	86.8	Confident	86.3	Confident	12 Å²	12	64.1 Å²	64.1	8%	0.084	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	129.1	170.8	-172.8	0	0	0	0	110.2	T343 D344 K347	S341-T343 VanDerWaalsContact C-N 3.29Å; S341-T343 PolarHBondContact O-N 3.26Å; S341-T343 PolarHBondContact OG-OG1 3.09Å; S341-D344 CarbonylContact O-C 3.56Å; S341-D344 VanDerWaalsContact O-C 3.29Å; S341-K347 PolarHBondContact N-O 2.77Å
342	L	84.9	Confident	86.1	Confident	85 Å²	85	66.7 Å²	66.7	45%	0.445	34%	0.344	S	S	.	.	S	Bend	trans	-73.1	-24	178.8	-69.3	174.7	0	0	0	112.6	F325 Q326 R327 R329	F325-L342 WeakPolarHBondContact O-CD1 3.48Å; Q326-L342 WeakPolarHBondContact O-CD1 3.37Å; R327-L342 PolarHBondContact O-N 3.36Å; R329-L342 HydrophobicContact CB-CD2 4.32Å
343	T	82.8	Confident	85.7	Confident	132 Å²	132	65.1 Å²	65.1	81%	0.81	33%	0.333	S	S	*	.	S	Bend	trans	-80	-40.8	175.3	51.3	0	0	0	0	111.8	S341	S341-T343 VanDerWaalsContact C-N 3.29Å; S341-T343 PolarHBondContact O-N 3.26Å; S341-T343 PolarHBondContact OG-OG1 3.09Å
344	D	79.9	Confident	85.1	Confident	68 Å²	68	63.3 Å²	63.3	36%	0.364	34%	0.344	S	S	.	.			trans	-122	92.2	178.6	-175.5	1.2	0	0	0	110.7	S341 S346 K347	S341-D344 CarbonylContact O-C 3.56Å; S341-D344 VanDerWaalsContact O-C 3.29Å; D344-S346 PolarHBondContact O-N 3.46Å; D344-S346 WeakPolarHBondContact OD1-CB 3.33Å; D344-S346 PolarHBondContact OD1-N 3.32Å; D344-S346 VanDerWaalsContact OD1-N 3.09Å; D344-S346 PolarHBondContact OD1-OG 3.45Å; D344-K347 HydrophobicContact CB-CB 4.16Å; D344-K347 PolarHBondContact O-N 3Å
345	K	71.4	Confident	84.1	Confident	191 Å²	191	61.6 Å²	61.6	83%	0.83	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.1	179.8	-66.1	-174.3	-180	179.8	0	113.6	K347	K345-K347 VanDerWaalsContact C-N 3.32Å
346	S	70.4	Confident	83.1	Confident	104 Å²	104	61.2 Å²	61.2	73%	0.727	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-11.6	179.8	74.5	0	0	0	0	113.3	D344 E348	D344-S346 PolarHBondContact O-N 3.46Å; D344-S346 WeakPolarHBondContact OD1-CB 3.33Å; D344-S346 PolarHBondContact OD1-N 3.32Å; D344-S346 VanDerWaalsContact OD1-N 3.09Å; D344-S346 PolarHBondContact OD1-OG 3.45Å; S346-E348 PolarHBondContact O-N 3.4Å
347	K	78.3	Confident	81.6	Confident	102 Å²	102	64.5 Å²	64.5	44%	0.443	36%	0.357	S	S	.	.			trans	-98.7	94.3	-174.3	-166	175.9	-175.9	-178.6	0	111.2	S341 D344 K345 L349	S341-K347 PolarHBondContact N-O 2.77Å; D344-K347 HydrophobicContact CB-CB 4.16Å; D344-K347 PolarHBondContact O-N 3Å; K345-K347 VanDerWaalsContact C-N 3.32Å; K347-L349 HydrophobicContact CG-CD2 4.32Å
348	E	85.2	Confident	80	Confident	113 Å²	113	73.7 Å²	73.7	53%	0.528	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	128.5	165.8	-65.9	177.3	174.9	0	0	110.1	Y338 S346 P350	Y338-E348 HydrophobicContact CD2-CB 4.4Å; Y338-E348 HydrophobicContact CD2-CG 4.23Å; Y338-E348 HydrophobicContact CE2-CG 4.3Å; S346-E348 PolarHBondContact O-N 3.4Å; E348-P350 VanDerWaalsContact O-CD 3.29Å; E348-P350 WeakPolarHBondContact O-CD 3.29Å
349	L	88.7	Confident	78.5	Confident	8 Å²	8	71.9 Å²	71.9	4%	0.042	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	93.5	177.2	-66.9	177	0	0	0	108.7	Y328 Y338 L339 K347 L351 H367 A368 A371	Y328-L349 HydrophobicContact CD1-CD1 4.08Å; Y328-L349 HydrophobicContact CE1-CD1 3.76Å; Y338-L349 CarbonylContact C-O 3.55Å; Y338-L349 WeakPolarHBondContact CA-O 3.36Å; L339-L349 HydrophobicContact CB-CB 4.08Å; L339-L349 PolarHBondContact N-O 3.42Å; L339-L349 WeakPolarHBondContact O-CB 3.46Å; L339-L349 PolarHBondContact O-N 3.29Å; K347-L349 HydrophobicContact CG-CD2 4.32Å; L349-L351 PolarHBondContact O-N 3.3Å; L349-H367 HydrophobicContact CD2-CB 4.02Å; L349-A368 HydrophobicContact CB-CB 3.77Å; L349-A371 HydrophobicContact CD1-CB 3.73Å
350	P	89.4	Confident	77	Confident	20 Å²	20	77 Å²	77	13%	0.13	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	130.6	-175.3	28.2	-35	0	0	0	111.7	E348 Y352 K364 A368	E348-P350 VanDerWaalsContact O-CD 3.29Å; E348-P350 WeakPolarHBondContact O-CD 3.29Å; P350-Y352 VanDerWaalsContact C-N 3.29Å; P350-Y352 HydrophobicContact CB-CD1 3.71Å; P350-Y352 HydrophobicContact CB-CE1 3.41Å; P350-Y352 VanDerWaalsContact CB-CE1 3.41Å; P350-Y352 HydrophobicContact CB-CG 4.43Å; P350-K364 HydrophobicContact CG-CB 4.16Å; P350-A368 WeakPolarHBondContact O-CB 3.39Å
351	L	86.8	Confident	75.6	Confident	1 Å²	1	84.1 Å²	84.1	1%	0.005	43%	0.432	C	S	.	.	S	Bend	trans	-97.6	36.1	169.4	-77.6	175.9	0	0	0	111.5	W307 V311 S337 L339 L349 F365 A368 M369 F372	W307-L351 HydrophobicContact CB-CB 4.49Å; W307-L351 HydrophobicContact CD2-CD2 4.3Å; W307-L351 HydrophobicContact CE3-CD1 3.98Å; W307-L351 HydrophobicContact CE3-CD2 4.14Å; W307-L351 HydrophobicContact CH2-CD2 4.39Å; W307-L351 HydrophobicContact CZ3-CD1 4.27Å; W307-L351 HydrophobicContact CZ3-CD2 4.19Å; V311-L351 HydrophobicContact CG2-CD1 3.38Å; S337-L351 WeakPolarHBondContact O-CA 3.42Å; S337-L351 WeakPolarHBondContact O-CB 3.41Å; S337-L351 PolarHBondContact O-N 3.49Å; L339-L351 HydrophobicContact CD1-CD1 3.22Å; L339-L351 HydrophobicContact CD1-CG 3.76Å; L349-L351 PolarHBondContact O-N 3.3Å; L351-F365 HydrophobicContact CD2-CE2 4.46Å; L351-A368 HydrophobicContact CD2-CB 3.68Å; L351-A368 HydrophobicContact CG-CB 3.94Å; L351-M369 HydrophobicContact CD2-CB 4.47Å; L351-M369 HydrophobicContact CD2-CG 3.8Å; L351-F372 HydrophobicContact CD1-CB 4.2Å; L351-F372 HydrophobicContact CD1-CD2 4.01Å; L351-F372 HydrophobicContact CD1-CG 4.29Å
352	Y	86.8	Confident	74.7	Confident	80 Å²	80	85.4 Å²	85.4	31%	0.314	44%	0.438	S	S	.	.			trans	-138.9	147.7	174.4	65.7	-89.2	0	0	0	109.9	N304 N335 H336 P350	N304-Y352 WeakPolarHBondContact OD1-CA 3.44Å; N335-Y352 WeakPolarHBondContact O-CB 3.31Å; H336-Y352 HydrophobicContact CB-CD1 4.01Å; H336-Y352 HydrophobicContact CB-CE1 4.12Å; H336-Y352 HydrophobicContact CB-CG 4.4Å; H336-Y352 AromaticContact CD2-CD2 3.66Å; H336-Y352 AromaticContact CD2-CE2 3.64Å; H336-Y352 AromaticContact CD2-CG 3.98Å; H336-Y352 AromaticContact CD2-CZ 3.94Å; P350-Y352 VanDerWaalsContact C-N 3.29Å; P350-Y352 HydrophobicContact CB-CD1 3.71Å; P350-Y352 HydrophobicContact CB-CE1 3.41Å; P350-Y352 VanDerWaalsContact CB-CE1 3.41Å; P350-Y352 HydrophobicContact CB-CG 4.43Å
353	C	82.1	Confident	74.4	Confident	8 Å²	8	84.7 Å²	84.7	5%	0.054	44%	0.435	C	S	.	.			trans	-135.1	140.3	175.8	-169	0	0	0	0	110.1	W300 N304 G355	W300-C353 HydrophobicContact CD2-CB 4.48Å; W300-C353 HydrophobicContact CE3-CB 3.86Å; W300-C353 HydrophobicContact CZ3-CB 3.98Å; N304-C353 PolarHBondContact ND2-N 3.03Å; N304-C353 PolarHBondContact ND2-O 3.16Å; N304-C353 PolarHBondContact OD1-N 2.98Å; C353-G355 PolarHBondContact O-N 3.27Å
354	S	78	Confident	74.5	Confident	118 Å²	118	84.6 Å²	84.6	83%	0.825	42%	0.423	S	S	*	.			trans	-81.7	5.7	177.3	-52.3	0	0	0	0	113.5
355	G	69.7	Low	74.8	Confident	10 Å²	10	81.5 Å²	81.5	10%	0.103	41%	0.406	C	S	.	.			trans	68.8	-162.5	-171.9	0	0	0	0	0	114.9	W300 C353	W300-G355 VanDerWaalsContact NE1-CA 3.28Å; C353-G355 PolarHBondContact O-N 3.27Å
356	G	68.7	Low	75.6	Confident	59 Å²	59	72.8 Å²	72.8	61%	0.608	37%	0.369	S	S	*	.	S	Bend	trans	79.4	-175.4	-176.6	0	0	0	0	0	114.2	R358 F359	G356-R358 PolarHBondContact O-N 3.07Å; G356-R358 VanDerWaalsContact O-N 3.08Å; G356-F359 WeakPolarHBondContact O-CB 3.28Å; G356-F359 PolarHBondContact O-N 3.24Å
357	L	59.1	Low	76.5	Confident	145 Å²	145	72.7 Å²	72.7	76%	0.759	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-58.5	-23.4	179	-68.1	173.5	0	0	0	112.9	F359 F360 W361	L357-F359 PolarHBondContact O-N 3.14Å; L357-F360 PolarHBondContact O-N 3.01Å; L357-W361 VanDerWaalsContact O-CD1 3.27Å
358	R	59.5	Low	77	Confident	193 Å²	193	67.9 Å²	67.9	73%	0.728	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-59.5	-29.2	175.9	-160.2	175.4	-164.9	169.3	5.6	112.4	G356 F360 W361 D362	G356-R358 PolarHBondContact O-N 3.07Å; G356-R358 VanDerWaalsContact O-N 3.08Å; R358-F360 VanDerWaalsContact C-N 3.29Å; R358-F360 PolarHBondContact O-N 3.23Å; R358-W361 PolarHBondContact O-N 3.04Å; R358-W361 VanDerWaalsContact O-N 3.1Å; R358-D362 HydrophobicContact CG-CB 4.49Å; R358-D362 WeakPolarHBondContact O-CB 3.39Å; R358-D362 PolarHBondContact O-N 3.35Å
359	F	59.3	Low	77.2	Confident	10 Å²	10	62.5 Å²	62.5	4%	0.044	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-54.4	-40.5	176.7	174.9	-115.9	0	0	0	113.3	W300 G356 L357 W361 F365 T417	W300-F359 HydrophobicContact CH2-CD1 4.47Å; W300-F359 AromaticContact CH2-CD2 3.33Å; W300-F359 HydrophobicContact CH2-CD2 3.33Å; W300-F359 HydrophobicContact CH2-CE1 4.22Å; W300-F359 AromaticContact CH2-CE2 3.02Å; W300-F359 HydrophobicContact CH2-CE2 3.02Å; W300-F359 HydrophobicContact CH2-CG 4.06Å; W300-F359 AromaticContact CH2-CZ 3.5Å; W300-F359 HydrophobicContact CH2-CZ 3.5Å; W300-F359 VanDerWaalsContact CH2-CZ 3.5Å; W300-F359 HydrophobicContact CZ2-CB 4.43Å; W300-F359 AromaticContact CZ2-CD1 3.94Å; W300-F359 HydrophobicContact CZ2-CD1 3.94Å; W300-F359 AromaticContact CZ2-CD2 3.39Å; W300-F359 HydrophobicContact CZ2-CD2 3.39Å; W300-F359 AromaticContact CZ2-CE1 3.97Å; W300-F359 HydrophobicContact CZ2-CE1 3.97Å; W300-F359 AromaticContact CZ2-CE2 3.47Å; W300-F359 HydrophobicContact CZ2-CE2 3.47Å; W300-F359 VanDerWaalsContact CZ2-CE2 3.47Å; W300-F359 AromaticContact CZ2-CG 3.64Å; W300-F359 HydrophobicContact CZ2-CG 3.64Å; W300-F359 AromaticContact CZ2-CZ 3.73Å; W300-F359 HydrophobicContact CZ2-CZ 3.73Å; W300-F359 HydrophobicContact CZ3-CD2 4.21Å; W300-F359 HydrophobicContact CZ3-CE2 4Å; G356-F359 WeakPolarHBondContact O-CB 3.28Å; G356-F359 PolarHBondContact O-N 3.24Å; L357-F359 PolarHBondContact O-N 3.14Å; F359-W361 VanDerWaalsContact C-N 3.27Å; F359-W361 PolarHBondContact O-N 2.83Å; F359-F365 HydrophobicContact CE2-CD1 4.35Å; F359-F365 HydrophobicContact CE2-CE1 4.34Å; F359-T417 HydrophobicContact CE1-CG2 4.47Å; F359-T417 HydrophobicContact CE2-CG2 3.59Å; F359-T417 HydrophobicContact CZ-CG2 3.38Å
360	F	59.5	Low	77.3	Confident	107 Å²	107	63.3 Å²	63.3	47%	0.469	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-75	-15.6	-178.7	-69.4	-75.2	0	0	0	114.1	L357 R358	L357-F360 PolarHBondContact O-N 3.01Å; R358-F360 VanDerWaalsContact C-N 3.29Å; R358-F360 PolarHBondContact O-N 3.23Å
361	W	60.2	Low	77.3	Confident	200 Å²	200	62.4 Å²	62.4	76%	0.758	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-9	-174	-56	103.9	0	0	0	113.4	L357 R358 F359 N363	L357-W361 VanDerWaalsContact O-CD1 3.27Å; R358-W361 PolarHBondContact O-N 3.04Å; R358-W361 VanDerWaalsContact O-N 3.1Å; F359-W361 VanDerWaalsContact C-N 3.27Å; F359-W361 PolarHBondContact O-N 2.83Å; W361-N363 PolarHBondContact O-N 3.16Å; W361-N363 VanDerWaalsContact O-N 3.11Å
362	D	67.2	Low	77.6	Confident	40 Å²	40	62.3 Å²	62.3	21%	0.214	31%	0.31	C	S	.	.			trans	-83.5	90.3	-178.9	-164.9	-2	0	0	0	111.6	R358 K364 F365	R358-D362 HydrophobicContact CG-CB 4.49Å; R358-D362 WeakPolarHBondContact O-CB 3.39Å; R358-D362 PolarHBondContact O-N 3.35Å; D362-K364 PolarHBondContact O-N 3.19Å; D362-K364 VanDerWaalsContact O-N 3.14Å; D362-K364 VanDerWaalsContact OD1-CB 3.23Å; D362-K364 WeakPolarHBondContact OD1-CB 3.47Å; D362-K364 WeakPolarHBondContact OD1-CG 3.19Å; D362-K364 PolarHBondContact OD1-N 3.39Å; D362-F365 PolarHBondContact O-N 3.41Å
363	N	79.3	Confident	77.8	Confident	70 Å²	70	58.5 Å²	58.5	37%	0.374	30%	0.295	S	S	.	.	H	α-helix	trans	-60	-23.1	175	-64.1	-20.8	0	0	0	112.2	W361 F365 D366 H367 Q418	W361-N363 PolarHBondContact O-N 3.16Å; W361-N363 VanDerWaalsContact O-N 3.11Å; N363-F365 VanDerWaalsContact C-N 3.32Å; N363-F365 PolarHBondContact O-N 2.93Å; N363-D366 PolarHBondContact O-N 3.45Å; N363-H367 PolarHBondContact O-N 3.39Å; N363-H367 PolarHBondContact O-ND1 2.81Å; N363-Q418 PolarHBondContact OD1-OE1 3.03Å
364	K	85.8	Confident	78.3	Confident	130 Å²	130	58.7 Å²	58.7	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-62.6	-40	-174.6	-65.2	-175.4	175.9	-171.3	0	112.1	P350 D362 H367 A368	P350-K364 HydrophobicContact CG-CB 4.16Å; D362-K364 PolarHBondContact O-N 3.19Å; D362-K364 VanDerWaalsContact O-N 3.14Å; D362-K364 VanDerWaalsContact OD1-CB 3.23Å; D362-K364 WeakPolarHBondContact OD1-CB 3.47Å; D362-K364 WeakPolarHBondContact OD1-CG 3.19Å; D362-K364 PolarHBondContact OD1-N 3.39Å; K364-H367 PolarHBondContact O-N 3.1Å; K364-A368 WeakPolarHBondContact O-CB 3.31Å; K364-A368 PolarHBondContact O-N 3.14Å
365	F	85.9	Confident	78.9	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.009	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-43.5	178.5	-175.6	-119.5	0	0	0	111.6	W300 W307 L351 F359 D362 N363 H367 A368 M369 T417 W425	W300-F365 HydrophobicContact CZ3-CE1 4.47Å; W307-F365 AromaticContact NE1-CZ 3.58Å; L351-F365 HydrophobicContact CD2-CE2 4.46Å; F359-F365 HydrophobicContact CE2-CD1 4.35Å; F359-F365 HydrophobicContact CE2-CE1 4.34Å; D362-F365 PolarHBondContact O-N 3.41Å; N363-F365 VanDerWaalsContact C-N 3.32Å; N363-F365 PolarHBondContact O-N 2.93Å; F365-H367 PolarHBondContact O-N 3.44Å; F365-A368 WeakPolarHBondContact O-CB 3.3Å; F365-A368 PolarHBondContact O-N 2.86Å; F365-A368 VanDerWaalsContact O-N 3.15Å; F365-M369 HydrophobicContact CD1-CE 3.41Å; F365-M369 VanDerWaalsContact CD1-CE 3.41Å; F365-M369 HydrophobicContact CD1-SD 4.11Å; F365-M369 HydrophobicContact CE1-CE 3.42Å; F365-M369 VanDerWaalsContact CE1-CE 3.42Å; F365-M369 HydrophobicContact CE1-CG 4.4Å; F365-M369 HydrophobicContact CE1-SD 3.54Å; F365-M369 VanDerWaalsContact CE1-SD 3.54Å; F365-M369 HydrophobicContact CE2-CG 4.34Å; F365-M369 HydrophobicContact CE2-SD 4.4Å; F365-M369 HydrophobicContact CG-CE 4.15Å; F365-M369 HydrophobicContact CZ-CE 4.16Å; F365-M369 HydrophobicContact CZ-CG 4.23Å; F365-M369 HydrophobicContact CZ-SD 3.72Å; F365-M369 WeakPolarHBondContact O-CG 3.44Å; F365-M369 PolarHBondContact O-N 2.96Å; F365-T417 HydrophobicContact CE1-CG2 4.42Å; F365-W425 AromaticContact CE1-CZ2 3.96Å; F365-W425 HydrophobicContact CE1-CZ2 3.96Å; F365-W425 HydrophobicContact CZ-CZ2 4.37Å
366	D	88	Confident	79.9	Confident	8 Å²	8	52.7 Å²	52.7	4%	0.043	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-41.2	175.1	-80.9	2	0	0	0	112.2	N363 A368 M369 V370 K416 T417 Q418	N363-D366 PolarHBondContact O-N 3.45Å; D366-A368 VanDerWaalsContact C-N 3.32Å; D366-A368 PolarHBondContact O-N 2.85Å; D366-M369 PolarHBondContact O-N 3.45Å; D366-M369 WeakPolarHBondContact OD1-CE 3.39Å; D366-V370 VanDerWaalsContact O-CG2 3.31Å; D366-V370 WeakPolarHBondContact O-CG2 3.36Å; D366-V370 PolarHBondContact O-N 3.48Å; D366-K416 HydrophobicContact CB-CB 4.32Å; D366-K416 HydrophobicContact CB-CG 4.27Å; D366-K416 WeakPolarHBondContact OD2-CB 3.31Å; D366-T417 VanDerWaalsContact CG-N 3.26Å; D366-T417 WeakPolarHBondContact OD1-CB 3.46Å; D366-T417 PolarHBondContact OD1-N 3.13Å; D366-T417 PolarHBondContact OD1-OG1 3.03Å; D366-T417 PolarHBondContact OD2-N 3.36Å; D366-T417 PolarHBondContact OD2-OG1 3.34Å; D366-Q418 WeakPolarHBondContact OD2-CB 3.45Å; D366-Q418 PolarHBondContact OD2-N 3.26Å
367	H	88.2	Confident	80.9	Confident	103 Å²	103	51.2 Å²	51.2	48%	0.477	23%	0.229	S	C	.	.	H	α-helix	trans	-63.4	-39.2	173.4	-73	90.2	0	0	0	111.7	L349 N363 K364 F365 V370 A371	L349-H367 HydrophobicContact CD2-CB 4.02Å; N363-H367 PolarHBondContact O-N 3.39Å; N363-H367 PolarHBondContact O-ND1 2.81Å; K364-H367 PolarHBondContact O-N 3.1Å; F365-H367 PolarHBondContact O-N 3.44Å; H367-V370 PolarHBondContact O-N 2.93Å; H367-A371 VanDerWaalsContact O-CB 3.32Å; H367-A371 WeakPolarHBondContact O-CB 3.26Å; H367-A371 PolarHBondContact O-N 3.15Å
368	A	89.2	Confident	82.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.8	-42.5	177.3	0	0	0	0	0	112	L349 P350 L351 K364 F365 D366 A371 F372	L349-A368 HydrophobicContact CB-CB 3.77Å; P350-A368 WeakPolarHBondContact O-CB 3.39Å; L351-A368 HydrophobicContact CD2-CB 3.68Å; L351-A368 HydrophobicContact CG-CB 3.94Å; K364-A368 WeakPolarHBondContact O-CB 3.31Å; K364-A368 PolarHBondContact O-N 3.14Å; F365-A368 WeakPolarHBondContact O-CB 3.3Å; F365-A368 PolarHBondContact O-N 2.86Å; F365-A368 VanDerWaalsContact O-N 3.15Å; D366-A368 VanDerWaalsContact C-N 3.32Å; D366-A368 PolarHBondContact O-N 2.85Å; A368-A371 PolarHBondContact O-N 3.25Å; A368-F372 WeakPolarHBondContact O-CB 3.1Å; A368-F372 PolarHBondContact O-N 2.69Å
369	M	90.2	Very high	83.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.5	-38.6	176.8	-71.4	-173.1	-69.9	0	0	112.3	W307 L351 F365 D366 F372 L373 I415 T417 W425	W307-M369 HydrophobicContact CH2-CB 4.46Å; W307-M369 HydrophobicContact CH2-CG 3.92Å; W307-M369 HydrophobicContact CH2-SD 4.48Å; W307-M369 HydrophobicContact CZ2-CB 4.45Å; W307-M369 HydrophobicContact CZ2-CG 3.52Å; W307-M369 HydrophobicContact CZ2-SD 3.62Å; L351-M369 HydrophobicContact CD2-CB 4.47Å; L351-M369 HydrophobicContact CD2-CG 3.8Å; F365-M369 HydrophobicContact CD1-CE 3.41Å; F365-M369 VanDerWaalsContact CD1-CE 3.41Å; F365-M369 HydrophobicContact CD1-SD 4.11Å; F365-M369 HydrophobicContact CE1-CE 3.42Å; F365-M369 VanDerWaalsContact CE1-CE 3.42Å; F365-M369 HydrophobicContact CE1-CG 4.4Å; F365-M369 HydrophobicContact CE1-SD 3.54Å; F365-M369 VanDerWaalsContact CE1-SD 3.54Å; F365-M369 HydrophobicContact CE2-CG 4.34Å; F365-M369 HydrophobicContact CE2-SD 4.4Å; F365-M369 HydrophobicContact CG-CE 4.15Å; F365-M369 HydrophobicContact CZ-CE 4.16Å; F365-M369 HydrophobicContact CZ-CG 4.23Å; F365-M369 HydrophobicContact CZ-SD 3.72Å; F365-M369 WeakPolarHBondContact O-CG 3.44Å; F365-M369 PolarHBondContact O-N 2.96Å; D366-M369 PolarHBondContact O-N 3.45Å; D366-M369 WeakPolarHBondContact OD1-CE 3.39Å; M369-F372 PolarHBondContact O-N 2.96Å; M369-L373 WeakPolarHBondContact O-CB 3.36Å; M369-L373 PolarHBondContact O-N 3.42Å; M369-I415 HydrophobicContact CB-CD1 4.16Å; M369-I415 HydrophobicContact CB-CG1 4.14Å; M369-I415 HydrophobicContact CB-CG2 4.22Å; M369-I415 VanDerWaalsContact CE-O 3.23Å; M369-I415 WeakPolarHBondContact CE-O 3.48Å; M369-I415 HydrophobicContact SD-CG1 4.32Å; M369-T417 HydrophobicContact CE-CG2 3.91Å; M369-W425 HydrophobicContact SD-CZ2 4.41Å
370	V	89.9	Confident	85.1	Confident	26 Å²	26	36.4 Å²	36.4	16%	0.158	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-41.8	174.3	174.4	0	0	0	0	111.1	D366 H367 F372 L373 D374 I415 K416	D366-V370 VanDerWaalsContact O-CG2 3.31Å; D366-V370 WeakPolarHBondContact O-CG2 3.36Å; D366-V370 PolarHBondContact O-N 3.48Å; H367-V370 PolarHBondContact O-N 2.93Å; V370-F372 VanDerWaalsContact C-N 3.27Å; V370-F372 PolarHBondContact O-N 3.47Å; V370-L373 WeakPolarHBondContact O-CB 3.39Å; V370-L373 PolarHBondContact O-N 3.49Å; V370-D374 WeakPolarHBondContact O-CB 3.47Å; V370-D374 PolarHBondContact O-N 3.11Å; V370-I415 HydrophobicContact CG2-CG2 4.1Å; V370-K416 HydrophobicContact CG2-CD 4.38Å; V370-K416 VanDerWaalsContact CG2-CE 3.48Å; V370-K416 HydrophobicContact CG2-CG 3.95Å
371	A	90.2	Very high	86.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-33.5	173.6	0	0	0	0	0	112.4	Y328 L339 L349 H367 A368 D374 C375	Y328-A371 HydrophobicContact CD1-CB 3.81Å; Y328-A371 HydrophobicContact CD2-CB 3.89Å; Y328-A371 HydrophobicContact CE1-CB 3.58Å; Y328-A371 HydrophobicContact CE2-CB 3.68Å; Y328-A371 HydrophobicContact CG-CB 3.96Å; L339-A371 HydrophobicContact CD2-CB 3.83Å; L349-A371 HydrophobicContact CD1-CB 3.73Å; H367-A371 VanDerWaalsContact O-CB 3.32Å; H367-A371 WeakPolarHBondContact O-CB 3.26Å; H367-A371 PolarHBondContact O-N 3.15Å; A368-A371 PolarHBondContact O-N 3.25Å; A371-D374 WeakPolarHBondContact O-CB 3.48Å; A371-C375 PolarHBondContact O-N 3.11Å; A371-C375 PolarHBondContact O-SG 3.31Å
372	F	93	Very high	87.5	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-68.4	-46.2	172.3	-175.1	-93.6	0	0	0	111.5	W307 T310 V311 L314 L330 L339 L351 A368 M369 V370 D374 C375 V376 M432 L436	W307-F372 HydrophobicContact CH2-CD1 4.14Å; W307-F372 HydrophobicContact CZ3-CB 4.39Å; W307-F372 AromaticContact CZ3-CD1 3.57Å; W307-F372 HydrophobicContact CZ3-CD1 3.57Å; W307-F372 HydrophobicContact CZ3-CD2 4.45Å; W307-F372 AromaticContact CZ3-CE1 3.92Å; W307-F372 HydrophobicContact CZ3-CE1 3.92Å; W307-F372 AromaticContact CZ3-CG 3.86Å; W307-F372 HydrophobicContact CZ3-CG 3.86Å; T310-F372 HydrophobicContact CG2-CE1 3.92Å; T310-F372 HydrophobicContact CG2-CZ 3.69Å; V311-F372 HydrophobicContact CB-CE2 4.46Å; V311-F372 HydrophobicContact CG2-CD2 4.07Å; V311-F372 HydrophobicContact CG2-CE2 3.89Å; L314-F372 HydrophobicContact CB-CE2 4.17Å; L314-F372 HydrophobicContact CB-CZ 4.06Å; L314-F372 HydrophobicContact CD2-CD2 4.3Å; L314-F372 HydrophobicContact CD2-CE1 4.37Å; L314-F372 HydrophobicContact CD2-CE2 3.57Å; L314-F372 HydrophobicContact CD2-CZ 3.61Å; L314-F372 HydrophobicContact CG-CZ 4.49Å; L330-F372 HydrophobicContact CD2-CD2 3.75Å; L330-F372 HydrophobicContact CD2-CE2 3.97Å; L339-F372 HydrophobicContact CD1-CB 4.49Å; L339-F372 HydrophobicContact CD1-CD2 4.44Å; L339-F372 HydrophobicContact CD2-CB 4.33Å; L351-F372 HydrophobicContact CD1-CB 4.2Å; L351-F372 HydrophobicContact CD1-CD2 4.01Å; L351-F372 HydrophobicContact CD1-CG 4.29Å; A368-F372 WeakPolarHBondContact O-CB 3.1Å; A368-F372 PolarHBondContact O-N 2.69Å; M369-F372 PolarHBondContact O-N 2.96Å; V370-F372 VanDerWaalsContact C-N 3.27Å; V370-F372 PolarHBondContact O-N 3.47Å; F372-D374 PolarHBondContact O-N 3.09Å; F372-C375 WeakPolarHBondContact O-CA 3.26Å; F372-C375 WeakPolarHBondContact O-CB 3.3Å; F372-C375 PolarHBondContact O-N 3.3Å; F372-V376 HydrophobicContact CD1-CG2 3.86Å; F372-V376 HydrophobicContact CE1-CG2 3.45Å; F372-V376 VanDerWaalsContact CE1-CG2 3.45Å; F372-V376 HydrophobicContact CZ-CG2 4.03Å; F372-V376 WeakPolarHBondContact O-CG2 3.48Å; F372-V376 PolarHBondContact O-N 3.5Å; F372-M432 HydrophobicContact CD1-SD 3.61Å; F372-M432 HydrophobicContact CE1-CE 4.18Å; F372-M432 HydrophobicContact CE1-CG 4.42Å; F372-M432 HydrophobicContact CE1-SD 3.57Å; F372-M432 VanDerWaalsContact CE1-SD 3.57Å; F372-L436 HydrophobicContact CE1-CD1 4.26Å; F372-L436 HydrophobicContact CZ-CD1 4.25Å
373	L	91.6	Very high	88.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.3	-38.3	176.5	-169.1	67	0	0	0	111.6	M369 V370 V376 Q377 M396 I403 I415	M369-L373 WeakPolarHBondContact O-CB 3.36Å; M369-L373 PolarHBondContact O-N 3.42Å; V370-L373 WeakPolarHBondContact O-CB 3.39Å; V370-L373 PolarHBondContact O-N 3.49Å; L373-V376 PolarHBondContact O-N 3.42Å; L373-Q377 WeakPolarHBondContact O-CB 3.41Å; L373-Q377 PolarHBondContact O-N 3.15Å; L373-M396 HydrophobicContact CD1-CB 4.07Å; L373-M396 HydrophobicContact CD1-CG 3.74Å; L373-M396 HydrophobicContact CD1-SD 3.5Å; L373-M396 WeakPolarHBondContact CD1-SD 3.5Å; L373-M396 HydrophobicContact CD2-CB 4.44Å; L373-M396 HydrophobicContact CG-CB 4.18Å; L373-M396 HydrophobicContact CG-CG 4.4Å; L373-M396 HydrophobicContact CG-SD 4.32Å; L373-I403 HydrophobicContact CD1-CD1 3.77Å; L373-I403 HydrophobicContact CD1-CG1 3.86Å; L373-I403 HydrophobicContact CD2-CG1 4.25Å; L373-I415 HydrophobicContact CD1-CD1 4.49Å; L373-I415 HydrophobicContact CD2-CG2 4.41Å
374	D	91.1	Very high	88.3	Confident	12 Å²	12	26.7 Å²	26.7	6%	0.064	13%	0.125	C	C	.	.	H	α-helix	trans	-60.1	-41.5	172.4	-176.2	73.7	0	0	0	113.2	R327 Y328 V370 A371 F372 Q377 Q378 V398	R327-D374 IonicContact CZ-OD1 3.14Å; R327-D374 IonicContact CZ-OD2 3.91Å; R327-D374 VanDerWaalsContact CZ-OD2 3.25Å; R327-D374 IonicContact NE-OD1 3.18Å; R327-D374 PolarHBondContact NE-OD1 3.24Å; R327-D374 IonicContact NE-OD2 3.78Å; R327-D374 PolarHBondContact NE-OD2 3.09Å; R327-D374 IonicContact NH2-OD1 3.25Å; R327-D374 PolarHBondContact NH2-OD1 3.15Å; R327-D374 IonicContact NH2-OD2 3.18Å; R327-D374 PolarHBondContact NH2-OD2 2.99Å; R327-D374 VanDerWaalsContact NH2-OD2 3.08Å; Y328-D374 HydrophobicContact CD2-CB 4.44Å; Y328-D374 HydrophobicContact CE2-CB 4.16Å; Y328-D374 WeakPolarHBondContact CE2-OD2 3.48Å; V370-D374 WeakPolarHBondContact O-CB 3.47Å; V370-D374 PolarHBondContact O-N 3.11Å; A371-D374 WeakPolarHBondContact O-CB 3.48Å; F372-D374 PolarHBondContact O-N 3.09Å; D374-Q377 PolarHBondContact O-N 3.03Å; D374-Q378 WeakPolarHBondContact O-CG 3.37Å; D374-Q378 PolarHBondContact O-N 3.39Å; D374-Q378 PolarHBondContact OD2-NE2 3.48Å; D374-V398 HydrophobicContact CB-CG1 3.67Å; D374-V398 WeakPolarHBondContact OD1-CG1 3.5Å
375	C	91.4	Very high	88	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.6	-40	173.3	-62.1	0	0	0	0	111.6	L314 F325 L330 A371 F372 Q377 Q378 F379	L314-C375 HydrophobicContact CD2-CB 3.82Å; F325-C375 HydrophobicContact CD1-CB 4.03Å; F325-C375 HydrophobicContact CE1-CB 3.95Å; F325-C375 WeakPolarHBondContact CE1-O 3.45Å; F325-C375 HydrophobicContact CG-CB 4.46Å; F325-C375 HydrophobicContact CZ-CB 4.29Å; L330-C375 HydrophobicContact CD2-CB 4.31Å; A371-C375 PolarHBondContact O-N 3.11Å; A371-C375 PolarHBondContact O-SG 3.31Å; F372-C375 WeakPolarHBondContact O-CA 3.26Å; F372-C375 WeakPolarHBondContact O-CB 3.3Å; F372-C375 PolarHBondContact O-N 3.3Å; C375-Q377 VanDerWaalsContact C-N 3.29Å; C375-Q377 PolarHBondContact O-N 2.77Å; C375-Q378 PolarHBondContact O-N 2.91Å; C375-F379 WeakPolarHBondContact O-CB 3.35Å; C375-F379 PolarHBondContact O-N 3.05Å
376	V	91.5	Very high	87.3	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.006	16%	0.157	C	C	.	.	H	α-helix	trans	-64.2	-36.8	175.5	-172.1	0	0	0	0	110.7	L314 F372 L373 F379 K380 M396 L436	L314-V376 HydrophobicContact CD2-CG2 3.81Å; F372-V376 HydrophobicContact CD1-CG2 3.86Å; F372-V376 HydrophobicContact CE1-CG2 3.45Å; F372-V376 VanDerWaalsContact CE1-CG2 3.45Å; F372-V376 HydrophobicContact CZ-CG2 4.03Å; F372-V376 WeakPolarHBondContact O-CG2 3.48Å; F372-V376 PolarHBondContact O-N 3.5Å; L373-V376 PolarHBondContact O-N 3.42Å; V376-F379 WeakPolarHBondContact O-CB 3.34Å; V376-F379 PolarHBondContact O-N 3.02Å; V376-K380 WeakPolarHBondContact O-CB 3.49Å; V376-K380 PolarHBondContact O-N 3Å; V376-M396 HydrophobicContact CB-CE 4.2Å; V376-M396 HydrophobicContact CB-SD 3.89Å; V376-M396 HydrophobicContact CG1-CE 3.78Å; V376-M396 HydrophobicContact CG1-SD 3.61Å; V376-L436 HydrophobicContact CG1-CD2 4.16Å; V376-L436 HydrophobicContact CG2-CD2 4.24Å
377	Q	89.6	Confident	86.3	Confident	29 Å²	29	33.9 Å²	33.9	14%	0.136	17%	0.173	C	C	.	.	H	α-helix	trans	-67.2	-43	175.5	179.8	58.1	33.3	0	0	112.1	L373 D374 C375 F379 K380 E381 M396 V398	L373-Q377 WeakPolarHBondContact O-CB 3.41Å; L373-Q377 PolarHBondContact O-N 3.15Å; D374-Q377 PolarHBondContact O-N 3.03Å; C375-Q377 VanDerWaalsContact C-N 3.29Å; C375-Q377 PolarHBondContact O-N 2.77Å; Q377-F379 VanDerWaalsContact C-N 3.29Å; Q377-F379 PolarHBondContact O-N 3.41Å; Q377-K380 WeakPolarHBondContact O-CB 3.42Å; Q377-K380 PolarHBondContact O-N 3.44Å; Q377-E381 PolarHBondContact NE2-OE1 2.94Å; Q377-E381 WeakPolarHBondContact O-CG 3.37Å; Q377-E381 PolarHBondContact O-N 3.36Å; Q377-M396 HydrophobicContact CB-CE 4.14Å; Q377-V398 HydrophobicContact CB-CG2 3.66Å; Q377-V398 HydrophobicContact CG-CG2 3.83Å
378	Q	89.7	Confident	85	Confident	12 Å²	12	35.7 Å²	35.7	6%	0.056	19%	0.192	C	C	.	.	H	α-helix	trans	-61.1	-39.3	172.2	-71.6	176.1	55.5	0	0	111.8	F325 D374 C375 E381 E382	F325-Q378 HydrophobicContact CD1-CB 3.95Å; F325-Q378 HydrophobicContact CE1-CB 4.29Å; D374-Q378 WeakPolarHBondContact O-CG 3.37Å; D374-Q378 PolarHBondContact O-N 3.39Å; D374-Q378 PolarHBondContact OD2-NE2 3.48Å; C375-Q378 PolarHBondContact O-N 2.91Å; Q378-E381 PolarHBondContact O-N 3.45Å; Q378-E382 PolarHBondContact O-N 3.29Å; Q378-E382 VanDerWaalsContact O-N 3.12Å
379	F	89	Confident	83.9	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-44.7	174.1	175	-94.6	0	0	0	111.7	L314 L317 M321 L323 F325 C375 V376 Q377 E381 E382 V383 V443	L314-F379 HydrophobicContact CD1-CB 3.91Å; L314-F379 HydrophobicContact CD1-CD1 4.38Å; L314-F379 HydrophobicContact CD1-CD2 4.14Å; L314-F379 HydrophobicContact CD1-CG 3.88Å; L317-F379 HydrophobicContact CB-CE2 3.77Å; L317-F379 HydrophobicContact CB-CZ 4.14Å; L317-F379 HydrophobicContact CD1-CE1 4.5Å; L317-F379 HydrophobicContact CD1-CE2 4.41Å; L317-F379 HydrophobicContact CD1-CZ 3.96Å; M321-F379 HydrophobicContact SD-CD2 4.07Å; M321-F379 HydrophobicContact SD-CE2 3.32Å; M321-F379 WeakPolarHBondContact SD-CE2 3.3Å; M321-F379 HydrophobicContact SD-CZ 3.91Å; L323-F379 HydrophobicContact CD2-CB 4.13Å; L323-F379 HydrophobicContact CD2-CD2 4.16Å; F325-F379 HydrophobicContact CE1-CB 4.33Å; C375-F379 WeakPolarHBondContact O-CB 3.35Å; C375-F379 PolarHBondContact O-N 3.05Å; V376-F379 WeakPolarHBondContact O-CB 3.34Å; V376-F379 PolarHBondContact O-N 3.02Å; Q377-F379 VanDerWaalsContact C-N 3.29Å; Q377-F379 PolarHBondContact O-N 3.41Å; F379-E381 PolarHBondContact O-N 3.09Å; F379-E382 PolarHBondContact O-N 2.93Å; F379-V383 HydrophobicContact CD1-CG2 4.1Å; F379-V383 HydrophobicContact CD2-CG2 4.48Å; F379-V383 HydrophobicContact CE1-CG2 3.66Å; F379-V383 HydrophobicContact CE2-CG2 4.09Å; F379-V383 HydrophobicContact CG-CG2 4.49Å; F379-V383 HydrophobicContact CZ-CG2 3.65Å; F379-V383 VanDerWaalsContact O-CG2 3.27Å; F379-V383 WeakPolarHBondContact O-CG2 3.46Å; F379-V383 PolarHBondContact O-N 3.25Å; F379-V443 HydrophobicContact CE2-CG2 4.32Å; F379-V443 HydrophobicContact CZ-CG2 3.87Å
380	K	87.1	Confident	83	Confident	22 Å²	22	48.1 Å²	48.1	10%	0.096	24%	0.239	C	C	.	.	H	α-helix	trans	-55	-50.3	174.6	179.5	-172	170.3	179.1	0	111.5	V376 Q377 E382 V383 E384 L392 M396	V376-K380 WeakPolarHBondContact O-CB 3.49Å; V376-K380 PolarHBondContact O-N 3Å; Q377-K380 WeakPolarHBondContact O-CB 3.42Å; Q377-K380 PolarHBondContact O-N 3.44Å; K380-E382 VanDerWaalsContact C-N 3.29Å; K380-E382 PolarHBondContact O-N 3.43Å; K380-V383 PolarHBondContact O-N 3.44Å; K380-E384 WeakPolarHBondContact CE-OE1 3.46Å; K380-E384 WeakPolarHBondContact CE-OE2 3.27Å; K380-E384 HydrophobicContact CG-CG 4.38Å; K380-E384 IonicContact NZ-OE1 3.31Å; K380-E384 WeakPolarHBondContact O-CB 3.41Å; K380-E384 WeakPolarHBondContact O-CG 3.15Å; K380-E384 PolarHBondContact O-N 3.37Å; K380-L392 HydrophobicContact CB-CD1 3.62Å; K380-L392 HydrophobicContact CB-CG 4.39Å; K380-L392 HydrophobicContact CD-CB 4.34Å; K380-L392 HydrophobicContact CD-CD1 3.96Å; K380-L392 HydrophobicContact CD-CG 4.29Å; K380-L392 HydrophobicContact CG-CB 4.49Å; K380-L392 HydrophobicContact CG-CD1 3.64Å; K380-L392 HydrophobicContact CG-CG 3.93Å; K380-M396 HydrophobicContact CB-CE 4.18Å; K380-M396 HydrophobicContact CD-CE 4.11Å
381	E	86.6	Confident	82.3	Confident	85 Å²	85	50.3 Å²	50.3	40%	0.397	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-39	-179	-73.1	164.7	-163.1	0	0	112	Q377 Q378 F379 K385	Q377-E381 PolarHBondContact NE2-OE1 2.94Å; Q377-E381 WeakPolarHBondContact O-CG 3.37Å; Q377-E381 PolarHBondContact O-N 3.36Å; Q378-E381 PolarHBondContact O-N 3.45Å; F379-E381 PolarHBondContact O-N 3.09Å; E381-K385 VanDerWaalsContact O-CG 3.32Å; E381-K385 WeakPolarHBondContact O-CG 3.36Å; E381-K385 PolarHBondContact O-N 3.4Å; E381-K385 VanDerWaalsContact O-N 3.11Å
382	E	84.4	Confident	81.9	Confident	69 Å²	69	50.7 Å²	50.7	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-69.9	-37	177	-161	64.7	-165.6	0	0	112.5	M321 L323 Q378 F379 K380 K385	M321-E382 HydrophobicContact CE-CB 4.33Å; M321-E382 HydrophobicContact CE-CG 4.1Å; L323-E382 HydrophobicContact CD1-CB 4.06Å; L323-E382 HydrophobicContact CD1-CG 3.96Å; L323-E382 HydrophobicContact CD2-CB 4.12Å; Q378-E382 PolarHBondContact O-N 3.29Å; Q378-E382 VanDerWaalsContact O-N 3.12Å; F379-E382 PolarHBondContact O-N 2.93Å; K380-E382 VanDerWaalsContact C-N 3.29Å; K380-E382 PolarHBondContact O-N 3.43Å; E382-K385 IonicContact OE2-NZ 2.89Å; E382-K385 PolarHBondContact OE2-NZ 3.05Å
383	V	83	Confident	81.4	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-44.1	174.2	169.7	0	0	0	0	111.3	M321 F379 K380 K385 G386 E387 F390 W442	M321-V383 HydrophobicContact CE-CG2 3.73Å; M321-V383 HydrophobicContact SD-CG2 3.82Å; F379-V383 HydrophobicContact CD1-CG2 4.1Å; F379-V383 HydrophobicContact CD2-CG2 4.48Å; F379-V383 HydrophobicContact CE1-CG2 3.66Å; F379-V383 HydrophobicContact CE2-CG2 4.09Å; F379-V383 HydrophobicContact CG-CG2 4.49Å; F379-V383 HydrophobicContact CZ-CG2 3.65Å; F379-V383 VanDerWaalsContact O-CG2 3.27Å; F379-V383 WeakPolarHBondContact O-CG2 3.46Å; F379-V383 PolarHBondContact O-N 3.25Å; K380-V383 PolarHBondContact O-N 3.44Å; V383-K385 VanDerWaalsContact C-N 3.32Å; V383-K385 PolarHBondContact O-N 3.44Å; V383-G386 PolarHBondContact O-N 3.12Å; V383-G386 VanDerWaalsContact O-N 3.1Å; V383-E387 PolarHBondContact O-N 2.98Å; V383-F390 HydrophobicContact CG1-CD1 3.33Å; V383-F390 HydrophobicContact CG1-CE1 3.52Å; V383-F390 HydrophobicContact CG1-CG 4.31Å; V383-W442 HydrophobicContact CB-CD2 4.47Å; V383-W442 HydrophobicContact CB-CE3 4.22Å; V383-W442 HydrophobicContact CB-CH2 4.4Å; V383-W442 HydrophobicContact CB-CZ3 4.21Å; V383-W442 HydrophobicContact CG1-CD2 3.41Å; V383-W442 VanDerWaalsContact CG1-CD2 3.41Å; V383-W442 HydrophobicContact CG1-CE3 3.6Å; V383-W442 HydrophobicContact CG1-CG 3.85Å; V383-W442 HydrophobicContact CG1-CH2 4.12Å; V383-W442 HydrophobicContact CG1-CZ2 3.95Å; V383-W442 HydrophobicContact CG1-CZ3 3.97Å; V383-W442 HydrophobicContact CG2-CD2 4.44Å; V383-W442 HydrophobicContact CG2-CE3 3.76Å; V383-W442 HydrophobicContact CG2-CH2 4.37Å; V383-W442 HydrophobicContact CG2-CZ3 3.74Å
384	E	80	Confident	81.2	Confident	59 Å²	59	54.4 Å²	54.4	28%	0.276	28%	0.276	S	S	.	.	H	α-helix	trans	-67.7	-28.7	-179.9	-75.5	-179.9	164.9	0	0	113.1	K380 G386 E387 F390	K380-E384 WeakPolarHBondContact CE-OE1 3.46Å; K380-E384 WeakPolarHBondContact CE-OE2 3.27Å; K380-E384 HydrophobicContact CG-CG 4.38Å; K380-E384 IonicContact NZ-OE1 3.31Å; K380-E384 WeakPolarHBondContact O-CB 3.41Å; K380-E384 WeakPolarHBondContact O-CG 3.15Å; K380-E384 PolarHBondContact O-N 3.37Å; E384-G386 VanDerWaalsContact C-N 3.28Å; E384-G386 PolarHBondContact O-N 3.29Å; E384-E387 CarbonylContact O-C 3.55Å; E384-F390 WeakPolarHBondContact CG-O 3.45Å
385	K	78.7	Confident	80.9	Confident	151 Å²	151	60.9 Å²	60.9	66%	0.657	30%	0.3	S	S	*	.	H	α-helix	trans	-63.7	-33.9	170.4	-74.4	172.6	-161.9	165.2	0	112.6	E381 E382 V383	E381-K385 VanDerWaalsContact O-CG 3.32Å; E381-K385 WeakPolarHBondContact O-CG 3.36Å; E381-K385 PolarHBondContact O-N 3.4Å; E381-K385 VanDerWaalsContact O-N 3.11Å; E382-K385 IonicContact OE2-NZ 2.89Å; E382-K385 PolarHBondContact OE2-NZ 3.05Å; V383-K385 VanDerWaalsContact C-N 3.32Å; V383-K385 PolarHBondContact O-N 3.44Å
386	G	70.5	Confident	80.7	Confident	58 Å²	58	61.3 Å²	61.3	60%	0.598	30%	0.302	S	S	*	.	H	α-helix	trans	-76	-35.4	-179.5	0	0	0	0	0	113.3	V383 E384	V383-G386 PolarHBondContact O-N 3.12Å; V383-G386 VanDerWaalsContact O-N 3.1Å; E384-G386 VanDerWaalsContact C-N 3.28Å; E384-G386 PolarHBondContact O-N 3.29Å
387	E	67.1	Low	80.3	Confident	82 Å²	82	62.6 Å²	62.6	38%	0.383	31%	0.309	S	S	.	.			trans	-144.7	107.5	-175.2	-168.1	96.2	-138.7	0	0	111.1	V383 E384 R389 F390 W442 Q446	V383-E387 PolarHBondContact O-N 2.98Å; E384-E387 CarbonylContact O-C 3.55Å; E387-R389 PolarHBondContact O-N 3.13Å; E387-R389 VanDerWaalsContact O-N 3.09Å; E387-F390 HydrophobicContact CB-CB 4.32Å; E387-F390 HydrophobicContact CG-CB 4.34Å; E387-F390 PolarHBondContact O-N 2.72Å; E387-W442 HydrophobicContact CB-CZ2 4.22Å; E387-Q446 PolarHBondContact OE2-NE2 2.94Å
388	T	60.9	Low	80	Confident	140 Å²	140	62.7 Å²	62.7	86%	0.859	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-16.8	-175.7	50	0	0	0	0	114.7
389	R	67.5	Low	79.4	Confident	228 Å²	228	70.9 Å²	70.9	86%	0.86	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-14.9	-179.9	-60.7	-169.6	-162.4	-176.5	6.8	114	E387	E387-R389 PolarHBondContact O-N 3.13Å; E387-R389 VanDerWaalsContact O-N 3.09Å
390	F	71.6	Confident	79	Confident	33 Å²	33	76.2 Å²	76.2	15%	0.145	37%	0.372	C	S	.	.			trans	-88.8	123.7	-179.7	-179.3	-92.5	0	0	0	109.6	V383 E384 E387 L392 W438 W442	V383-F390 HydrophobicContact CG1-CD1 3.33Å; V383-F390 HydrophobicContact CG1-CE1 3.52Å; V383-F390 HydrophobicContact CG1-CG 4.31Å; E384-F390 WeakPolarHBondContact CG-O 3.45Å; E387-F390 HydrophobicContact CB-CB 4.32Å; E387-F390 HydrophobicContact CG-CB 4.34Å; E387-F390 PolarHBondContact O-N 2.72Å; F390-L392 HydrophobicContact CE1-CD2 3.67Å; F390-L392 HydrophobicContact CE1-CG 4.31Å; F390-L392 HydrophobicContact CZ-CD2 3.79Å; F390-W438 HydrophobicContact CE2-CE3 4.1Å; F390-W438 HydrophobicContact CZ-CB 4.13Å; F390-W438 WeakPolarHBondContact CZ-O 3.47Å; F390-W442 HydrophobicContact CD1-CB 4.39Å; F390-W442 AromaticContact CD1-CD1 3.85Å; F390-W442 HydrophobicContact CD1-CG 4.09Å; F390-W442 HydrophobicContact CD2-CB 3.98Å; F390-W442 AromaticContact CD2-CD1 3.47Å; F390-W442 VanDerWaalsContact CD2-CD1 3.47Å; F390-W442 HydrophobicContact CD2-CG 4.01Å; F390-W442 HydrophobicContact CE1-CB 4.02Å; F390-W442 HydrophobicContact CE1-CG 4.18Å; F390-W442 HydrophobicContact CE2-CB 3.61Å; F390-W442 HydrophobicContact CE2-CG 4.12Å; F390-W442 HydrophobicContact CG-CB 4.34Å; F390-W442 AromaticContact CG-CD1 3.34Å; F390-W442 AromaticContact CG-CG 3.97Å; F390-W442 HydrophobicContact CG-CG 3.97Å; F390-W442 AromaticContact CG-NE1 3.96Å; F390-W442 HydrophobicContact CZ-CB 3.6Å; F390-W442 HydrophobicContact CZ-CG 4.18Å
391	C	74	Confident	78.7	Confident	72 Å²	72	75.2 Å²	75.2	49%	0.486	37%	0.368	S	S	.	.			trans	-132	140.4	172.2	-176	0	0	0	0	108.5
392	L	81.2	Confident	78.8	Confident	8 Å²	8	74.5 Å²	74.5	4%	0.042	36%	0.364	C	S	.	.			trans	-66.8	140.2	173.5	-66.8	-177.2	0	0	0	110.3	K380 F390 Y394 M396 N435 W438	K380-L392 HydrophobicContact CB-CD1 3.62Å; K380-L392 HydrophobicContact CB-CG 4.39Å; K380-L392 HydrophobicContact CD-CB 4.34Å; K380-L392 HydrophobicContact CD-CD1 3.96Å; K380-L392 HydrophobicContact CD-CG 4.29Å; K380-L392 HydrophobicContact CG-CB 4.49Å; K380-L392 HydrophobicContact CG-CD1 3.64Å; K380-L392 HydrophobicContact CG-CG 3.93Å; F390-L392 HydrophobicContact CE1-CD2 3.67Å; F390-L392 HydrophobicContact CE1-CG 4.31Å; F390-L392 HydrophobicContact CZ-CD2 3.79Å; L392-Y394 PolarHBondContact O-N 3.39Å; L392-M396 HydrophobicContact CD1-CE 4.11Å; L392-N435 HydrophobicContact CD1-CB 4.12Å; L392-N435 WeakPolarHBondContact CD2-O 3.4Å; L392-W438 HydrophobicContact CD2-CB 3.95Å
393	P	82.4	Confident	79	Confident	35 Å²	35	71.2 Å²	71.2	23%	0.227	35%	0.348	C	S	.	.	S	Bend	trans	-63.2	-29.3	-172.5	24.8	-35.4	0	0	0	113.5	T406 T434 N435 W438	P393-T406 PolarHBondContact O-OG1 3.46Å; P393-T434 HydrophobicContact CG-CG2 4.25Å; P393-N435 VanDerWaalsContact CD-OD1 3.3Å; P393-N435 WeakPolarHBondContact CD-OD1 3.26Å; P393-N435 WeakPolarHBondContact CG-OD1 3.47Å; P393-W438 HydrophobicContact CG-CD2 4.04Å; P393-W438 HydrophobicContact CG-CG 3.85Å
394	Y	87.1	Confident	79.2	Confident	44 Å²	44	73.6 Å²	73.6	17%	0.173	36%	0.359	C	S	.	.	S	Bend	trans	-115.7	130.9	-179.5	-55.7	-69.7	0	0	0	111.2	L392 I403 D405 F431 T434 N435	L392-Y394 PolarHBondContact O-N 3.39Å; Y394-I403 HydrophobicContact CG-CG2 4.42Å; Y394-D405 HydrophobicContact CD1-CB 4.28Å; Y394-D405 HydrophobicContact CE1-CB 4.26Å; Y394-F431 HydrophobicContact CD1-CB 4.25Å; Y394-F431 HydrophobicContact CD1-CD1 4.29Å; Y394-F431 AromaticContact CD1-CD2 3.89Å; Y394-F431 HydrophobicContact CD1-CD2 3.89Å; Y394-F431 HydrophobicContact CD1-CE2 4.23Å; Y394-F431 AromaticContact CD1-CG 3.91Å; Y394-F431 HydrophobicContact CD1-CG 3.91Å; Y394-F431 HydrophobicContact CD2-CB 3.63Å; Y394-F431 HydrophobicContact CD2-CD1 4.21Å; Y394-F431 AromaticContact CD2-CG 3.98Å; Y394-F431 HydrophobicContact CD2-CG 3.98Å; Y394-F431 WeakPolarHBondContact CD2-O 3.49Å; Y394-F431 AromaticContact CE1-CD1 3.77Å; Y394-F431 HydrophobicContact CE1-CD1 3.77Å; Y394-F431 HydrophobicContact CE1-CD2 4Å; Y394-F431 AromaticContact CE1-CE1 3.82Å; Y394-F431 HydrophobicContact CE1-CE1 3.82Å; Y394-F431 HydrophobicContact CE1-CE2 4.02Å; Y394-F431 AromaticContact CE1-CG 3.87Å; Y394-F431 HydrophobicContact CE1-CG 3.87Å; Y394-F431 AromaticContact CE1-CZ 3.94Å; Y394-F431 HydrophobicContact CE1-CZ 3.94Å; Y394-F431 HydrophobicContact CE2-CB 3.96Å; Y394-F431 AromaticContact CE2-CD1 3.65Å; Y394-F431 HydrophobicContact CE2-CD1 3.65Å; Y394-F431 HydrophobicContact CE2-CE1 4.34Å; Y394-F431 AromaticContact CE2-CG 3.91Å; Y394-F431 HydrophobicContact CE2-CG 3.91Å; Y394-F431 HydrophobicContact CG-CB 3.79Å; Y394-F431 HydrophobicContact CG-CD1 4.49Å; Y394-F431 HydrophobicContact CG-CD2 4.27Å; Y394-F431 AromaticContact CG-CG 3.97Å; Y394-F431 HydrophobicContact CG-CG 3.97Å; Y394-F431 AromaticContact CZ-CD1 3.41Å; Y394-F431 VanDerWaalsContact CZ-CD1 3.41Å; Y394-F431 AromaticContact CZ-CE1 3.64Å; Y394-F431 AromaticContact CZ-CG 3.87Å; Y394-T434 HydrophobicContact CD2-CG2 4.36Å; Y394-T434 HydrophobicContact CE2-CG2 3.68Å; Y394-N435 WeakPolarHBondContact CB-OD1 3.43Å; Y394-N435 PolarHBondContact N-OD1 3.05Å; Y394-N435 PolarHBondContact O-ND2 3.07Å
395	R	85.7	Confident	79.3	Confident	148 Å²	148	71.7 Å²	71.7	56%	0.558	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	140.1	177.6	-177.4	179.9	-178.1	164.3	0.4	109.9	I403 E404 T406	R395-I403 CarbonylContact O-C 3.55Å; R395-I403 WeakPolarHBondContact O-CA 3.31Å; R395-E404 HydrophobicContact CB-CB 4.34Å; R395-E404 PolarHBondContact N-O 3.38Å; R395-E404 PolarHBondContact O-N 3.21Å; R395-T406 HydrophobicContact CB-CG2 4Å
396	M	86.5	Confident	79.1	Confident	9 Å²	9	69.1 Å²	69.1	4%	0.044	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.4	179.3	-59.6	173.9	-69	0	0	109.1	L373 V376 Q377 K380 L392 I403	L373-M396 HydrophobicContact CD1-CB 4.07Å; L373-M396 HydrophobicContact CD1-CG 3.74Å; L373-M396 HydrophobicContact CD1-SD 3.5Å; L373-M396 WeakPolarHBondContact CD1-SD 3.5Å; L373-M396 HydrophobicContact CD2-CB 4.44Å; L373-M396 HydrophobicContact CG-CB 4.18Å; L373-M396 HydrophobicContact CG-CG 4.4Å; L373-M396 HydrophobicContact CG-SD 4.32Å; V376-M396 HydrophobicContact CB-CE 4.2Å; V376-M396 HydrophobicContact CB-SD 3.89Å; V376-M396 HydrophobicContact CG1-CE 3.78Å; V376-M396 HydrophobicContact CG1-SD 3.61Å; Q377-M396 HydrophobicContact CB-CE 4.14Å; K380-M396 HydrophobicContact CB-CE 4.18Å; K380-M396 HydrophobicContact CD-CE 4.11Å; L392-M396 HydrophobicContact CD1-CE 4.11Å; M396-I403 HydrophobicContact CG-CG1 4.32Å
397	D	84.9	Confident	78.7	Confident	28 Å²	28	69.9 Å²	69.9	15%	0.15	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	95.1	168.9	-177.1	-24.7	0	0	0	107.6	E399 K400 G401 K402	D397-E399 VanDerWaalsContact C-N 3.34Å; D397-E399 PolarHBondContact OD1-N 3.06Å; D397-K400 PolarHBondContact OD1-N 2.97Å; D397-K400 VanDerWaalsContact OD2-CD 3.29Å; D397-K400 WeakPolarHBondContact OD2-CD 3.4Å; D397-K400 WeakPolarHBondContact OD2-CE 3.38Å; D397-K400 WeakPolarHBondContact OD2-CG 3.39Å; D397-K400 IonicContact OD2-NZ 3.08Å; D397-K400 PolarHBondContact OD2-NZ 2.92Å; D397-G401 WeakPolarHBondContact O-CA 3.16Å; D397-G401 PolarHBondContact O-N 3.29Å; D397-K402 PolarHBondContact N-O 2.87Å; D397-K402 PolarHBondContact O-N 3.49Å
398	V	81.8	Confident	78.7	Confident	31 Å²	31	68.8 Å²	68.8	19%	0.188	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-37.2	-176.4	-179.6	0	0	0	0	111.6	D374 Q377 K400 G401	D374-V398 HydrophobicContact CB-CG1 3.67Å; D374-V398 WeakPolarHBondContact OD1-CG1 3.5Å; Q377-V398 HydrophobicContact CB-CG2 3.66Å; Q377-V398 HydrophobicContact CG-CG2 3.83Å; V398-K400 VanDerWaalsContact C-N 3.32Å; V398-K400 PolarHBondContact O-N 3.12Å; V398-G401 PolarHBondContact O-N 2.61Å
399	E	77.3	Confident	78.8	Confident	183 Å²	183	66 Å²	66	86%	0.855	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-42	-178.4	-63.4	-177.9	176.2	0	0	111.1	D397	D397-E399 VanDerWaalsContact C-N 3.34Å; D397-E399 PolarHBondContact OD1-N 3.06Å
400	K	79.9	Confident	79	Confident	115 Å²	115	58.2 Å²	58.2	50%	0.5	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-18.1	176.7	-61.3	-174.7	-162	120.3	0	113.2	D397 V398 K402	D397-K400 PolarHBondContact OD1-N 2.97Å; D397-K400 VanDerWaalsContact OD2-CD 3.29Å; D397-K400 WeakPolarHBondContact OD2-CD 3.4Å; D397-K400 WeakPolarHBondContact OD2-CE 3.38Å; D397-K400 WeakPolarHBondContact OD2-CG 3.39Å; D397-K400 IonicContact OD2-NZ 3.08Å; D397-K400 PolarHBondContact OD2-NZ 2.92Å; V398-K400 VanDerWaalsContact C-N 3.32Å; V398-K400 PolarHBondContact O-N 3.12Å; K400-K402 HydrophobicContact CB-CB 4.33Å; K400-K402 HydrophobicContact CB-CD 4.23Å; K400-K402 HydrophobicContact CB-CG 3.97Å
401	G	82.4	Confident	79.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	39.5	-170.1	0	0	0	0	0	111.7	D397 V398 I415	D397-G401 WeakPolarHBondContact O-CA 3.16Å; D397-G401 PolarHBondContact O-N 3.29Å; V398-G401 PolarHBondContact O-N 2.61Å; G401-I415 WeakPolarHBondContact O-CG2 3.18Å; G401-I415 PolarHBondContact O-N 3.28Å
402	K	88.2	Confident	79.9	Confident	70 Å²	70	56.6 Å²	56.6	30%	0.304	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	149.6	-176.8	-67.1	-170.6	175.9	-169.4	0	111.7	D397 K400 Y413	D397-K402 PolarHBondContact N-O 2.87Å; D397-K402 PolarHBondContact O-N 3.49Å; K400-K402 HydrophobicContact CB-CB 4.33Å; K400-K402 HydrophobicContact CB-CD 4.23Å; K400-K402 HydrophobicContact CB-CG 3.97Å; K402-Y413 CarbonylContact C-O 3.4Å; K402-Y413 VanDerWaalsContact CA-O 3.25Å; K402-Y413 WeakPolarHBondContact CA-O 3.46Å
403	I	89.1	Confident	80.3	Confident	0 Å²	0	58 Å²	58	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124	173.6	-57.4	173.9	0	0	0	107.6	L373 Y394 R395 M396 Y413 A428 F431 M432	L373-I403 HydrophobicContact CD1-CD1 3.77Å; L373-I403 HydrophobicContact CD1-CG1 3.86Å; L373-I403 HydrophobicContact CD2-CG1 4.25Å; Y394-I403 HydrophobicContact CG-CG2 4.42Å; R395-I403 CarbonylContact O-C 3.55Å; R395-I403 WeakPolarHBondContact O-CA 3.31Å; M396-I403 HydrophobicContact CG-CG1 4.32Å; I403-Y413 PolarHBondContact N-O 2.99Å; I403-Y413 PolarHBondContact O-N 3.44Å; I403-A428 HydrophobicContact CD1-CB 4.47Å; I403-A428 VanDerWaalsContact CD1-O 3.32Å; I403-A428 WeakPolarHBondContact CD1-O 3.44Å; I403-F431 HydrophobicContact CG2-CB 3.78Å; I403-F431 HydrophobicContact CG2-CD2 4.27Å; I403-M432 HydrophobicContact CD1-CB 3.74Å
404	E	86.5	Confident	80.6	Confident	52 Å²	52	57 Å²	57	24%	0.243	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.4	-173.9	-57.7	-176.6	157.1	0	0	110.7	R395 T406 G411	R395-E404 HydrophobicContact CB-CB 4.34Å; R395-E404 PolarHBondContact N-O 3.38Å; R395-E404 PolarHBondContact O-N 3.21Å; E404-T406 PolarHBondContact O-N 2.88Å; E404-G411 WeakPolarHBondContact CA-O 3.37Å
405	D	82.8	Confident	80.6	Confident	19 Å²	19	55 Å²	55	10%	0.102	33%	0.331	C	S	.	.			trans	-85.2	90.7	171.9	-179.6	17.2	0	0	0	110.5	Y394 G407 G408 S409 G410 G411 F431	Y394-D405 HydrophobicContact CD1-CB 4.28Å; Y394-D405 HydrophobicContact CE1-CB 4.26Å; D405-G407 VanDerWaalsContact C-N 3.32Å; D405-G407 PolarHBondContact OD1-N 3.19Å; D405-G408 PolarHBondContact OD1-N 2.93Å; D405-G408 VanDerWaalsContact OD2-CA 3.3Å; D405-G408 WeakPolarHBondContact OD2-CA 3.49Å; D405-S409 PolarHBondContact OD2-N 3.35Å; D405-S409 PolarHBondContact OD2-OG 2.96Å; D405-G410 WeakPolarHBondContact O-CA 3.41Å; D405-G410 PolarHBondContact O-N 2.9Å; D405-G410 VanDerWaalsContact O-N 3.17Å; D405-G411 PolarHBondContact N-O 3.46Å; D405-F431 HydrophobicContact CB-CE2 3.98Å; D405-F431 HydrophobicContact CB-CZ 4.43Å
406	T	73	Confident	80.7	Confident	96 Å²	96	51.4 Å²	51.4	59%	0.589	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-22.1	178.8	47.7	0	0	0	0	113.3	P393 R395 E404	P393-T406 PolarHBondContact O-OG1 3.46Å; R395-T406 HydrophobicContact CB-CG2 4Å; E404-T406 PolarHBondContact O-N 2.88Å
407	G	63.6	Low	80.5	Confident	74 Å²	74	51.5 Å²	51.5	76%	0.763	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-26.9	-173.8	0	0	0	0	0	114.8	D405	D405-G407 VanDerWaalsContact C-N 3.32Å; D405-G407 PolarHBondContact OD1-N 3.19Å
408	G	66.1	Low	80.3	Confident	59 Å²	59	53.1 Å²	53.1	61%	0.608	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-105.1	-176.4	0	0	0	0	0	113.5	D405 G410	D405-G408 PolarHBondContact OD1-N 2.93Å; D405-G408 VanDerWaalsContact OD2-CA 3.3Å; D405-G408 WeakPolarHBondContact OD2-CA 3.49Å; G408-G410 VanDerWaalsContact C-N 3.32Å; G408-G410 PolarHBondContact O-N 3.46Å
409	S	63.8	Low	80.1	Confident	83 Å²	83	61.1 Å²	61.1	58%	0.58	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.8	-167.8	60.1	0	0	0	0	115.1	D405 G411	D405-S409 PolarHBondContact OD2-N 3.35Å; D405-S409 PolarHBondContact OD2-OG 2.96Å; S409-G411 PolarHBondContact O-N 2.93Å; S409-G411 PolarHBondContact OG-N 3.44Å
410	G	71.3	Confident	80.4	Confident	64 Å²	64	53.9 Å²	53.9	66%	0.66	33%	0.327	S	S	*	.			trans	67.5	9.2	-169.9	0	0	0	0	0	113.5	D405 G408	D405-G410 WeakPolarHBondContact O-CA 3.41Å; D405-G410 PolarHBondContact O-N 2.9Å; D405-G410 VanDerWaalsContact O-N 3.17Å; G408-G410 VanDerWaalsContact C-N 3.32Å; G408-G410 PolarHBondContact O-N 3.46Å
411	G	81	Confident	80.7	Confident	19 Å²	19	50.8 Å²	50.8	20%	0.196	32%	0.32	C	S	.	.			trans	-73.1	137.4	-176.7	0	0	0	0	0	112.7	E404 D405 S409	E404-G411 WeakPolarHBondContact CA-O 3.37Å; D405-G411 PolarHBondContact N-O 3.46Å; S409-G411 PolarHBondContact O-N 2.93Å; S409-G411 PolarHBondContact OG-N 3.44Å
412	S	84.3	Confident	80.9	Confident	51 Å²	51	52.7 Å²	52.7	36%	0.357	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.2	168.2	65.3	0	0	0	0	109.9
413	Y	89.5	Confident	80.8	Confident	37 Å²	37	53.8 Å²	53.8	15%	0.145	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.1	-177.2	-59.6	-80.6	0	0	0	110.2	K402 I403 Q424 K427 F431	K402-Y413 CarbonylContact C-O 3.4Å; K402-Y413 VanDerWaalsContact CA-O 3.25Å; K402-Y413 WeakPolarHBondContact CA-O 3.46Å; I403-Y413 PolarHBondContact N-O 2.99Å; I403-Y413 PolarHBondContact O-N 3.44Å; Y413-Q424 HydrophobicContact CD1-CB 4.13Å; Y413-Q424 HydrophobicContact CD1-CG 4Å; Y413-Q424 HydrophobicContact CE1-CG 4.38Å; Y413-K427 HydrophobicContact CD1-CB 4.15Å; Y413-K427 HydrophobicContact CD1-CD 4.38Å; Y413-K427 HydrophobicContact CE1-CB 4.41Å; Y413-K427 HydrophobicContact CE1-CD 3.86Å; Y413-K427 HydrophobicContact CG-CB 4.32Å; Y413-F431 AromaticContact CD2-CD2 3.98Å; Y413-F431 HydrophobicContact CD2-CD2 3.98Å; Y413-F431 AromaticContact CD2-CE2 3.45Å; Y413-F431 HydrophobicContact CD2-CE2 3.45Å; Y413-F431 VanDerWaalsContact CD2-CE2 3.45Å; Y413-F431 HydrophobicContact CD2-CZ 4.43Å; Y413-F431 HydrophobicContact CE2-CD2 4.46Å; Y413-F431 AromaticContact CE2-CE2 3.5Å; Y413-F431 HydrophobicContact CE2-CE2 3.5Å; Y413-F431 VanDerWaalsContact CE2-CE2 3.5Å; Y413-F431 HydrophobicContact CE2-CZ 4.13Å
414	S	87.9	Confident	80.8	Confident	16 Å²	16	58 Å²	58	11%	0.112	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	136.2	179.7	178.1	0	0	0	0	111.4	K416 N420 A428	S414-K416 VanDerWaalsContact C-N 3.33Å; S414-K416 WeakPolarHBondContact OG-CB 3.42Å; S414-K416 PolarHBondContact OG-N 3.2Å; S414-K416 VanDerWaalsContact OG-N 3.13Å; S414-K416 PolarHBondContact OG-O 3.34Å; S414-N420 PolarHBondContact O-ND2 3.3Å; S414-A428 WeakPolarHBondContact O-CB 3.21Å
415	I	88	Confident	81	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-81.4	-17.3	169.8	-154.4	172.2	0	0	0	112	W307 M369 V370 L373 G401 W425 L429 M432	W307-I415 HydrophobicContact CH2-CD1 4.29Å; M369-I415 HydrophobicContact CB-CD1 4.16Å; M369-I415 HydrophobicContact CB-CG1 4.14Å; M369-I415 HydrophobicContact CB-CG2 4.22Å; M369-I415 VanDerWaalsContact CE-O 3.23Å; M369-I415 WeakPolarHBondContact CE-O 3.48Å; M369-I415 HydrophobicContact SD-CG1 4.32Å; V370-I415 HydrophobicContact CG2-CG2 4.1Å; L373-I415 HydrophobicContact CD1-CD1 4.49Å; L373-I415 HydrophobicContact CD2-CG2 4.41Å; G401-I415 WeakPolarHBondContact O-CG2 3.18Å; G401-I415 PolarHBondContact O-N 3.28Å; I415-W425 PolarHBondContact O-NE1 2.94Å; I415-L429 HydrophobicContact CD1-CD2 4.2Å; I415-L429 HydrophobicContact CG1-CD2 3.94Å; I415-M432 HydrophobicContact CD1-SD 3.85Å
416	K	86.5	Confident	81.3	Confident	73 Å²	73	54.9 Å²	54.9	32%	0.317	34%	0.34	S	S	.	.			trans	-72.1	141.7	174.6	-60	176.6	-178.6	169.3	0	109.7	D366 V370 S414 N420	D366-K416 HydrophobicContact CB-CB 4.32Å; D366-K416 HydrophobicContact CB-CG 4.27Å; D366-K416 WeakPolarHBondContact OD2-CB 3.31Å; V370-K416 HydrophobicContact CG2-CD 4.38Å; V370-K416 VanDerWaalsContact CG2-CE 3.48Å; V370-K416 HydrophobicContact CG2-CG 3.95Å; S414-K416 VanDerWaalsContact C-N 3.33Å; S414-K416 WeakPolarHBondContact OG-CB 3.42Å; S414-K416 PolarHBondContact OG-N 3.2Å; S414-K416 VanDerWaalsContact OG-N 3.13Å; S414-K416 PolarHBondContact OG-O 3.34Å; K416-N420 WeakPolarHBondContact O-CB 3.29Å; K416-N420 PolarHBondContact O-ND2 3Å
417	T	83.3	Confident	82.1	Confident	11 Å²	11	53.7 Å²	53.7	7%	0.067	33%	0.326	C	S	.	.			trans	-86.2	-30.4	177	57	0	0	0	0	111.4	F359 F365 D366 M369 N420 W425	F359-T417 HydrophobicContact CE1-CG2 4.47Å; F359-T417 HydrophobicContact CE2-CG2 3.59Å; F359-T417 HydrophobicContact CZ-CG2 3.38Å; F365-T417 HydrophobicContact CE1-CG2 4.42Å; D366-T417 VanDerWaalsContact CG-N 3.26Å; D366-T417 WeakPolarHBondContact OD1-CB 3.46Å; D366-T417 PolarHBondContact OD1-N 3.13Å; D366-T417 PolarHBondContact OD1-OG1 3.03Å; D366-T417 PolarHBondContact OD2-N 3.36Å; D366-T417 PolarHBondContact OD2-OG1 3.34Å; M369-T417 HydrophobicContact CE-CG2 3.91Å; T417-N420 PolarHBondContact O-N 3.4Å; T417-W425 HydrophobicContact CG2-CD2 3.88Å; T417-W425 HydrophobicContact CG2-CG 3.96Å; T417-W425 HydrophobicContact CG2-CZ2 4.04Å
418	Q	80.8	Confident	83.4	Confident	63 Å²	63	50.1 Å²	50.1	29%	0.294	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	134.2	177.9	-156.9	-174.6	24.9	0	0	111.9	N363 D366 N420	N363-Q418 PolarHBondContact OD1-OE1 3.03Å; D366-Q418 WeakPolarHBondContact OD2-CB 3.45Å; D366-Q418 PolarHBondContact OD2-N 3.26Å; Q418-N420 PolarHBondContact O-N 3.12Å; Q418-N420 VanDerWaalsContact O-N 3.13Å
419	F	77.8	Confident	84.7	Confident	199 Å²	199	47.3 Å²	47.3	87%	0.873	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	24.9	-176.2	-52.2	-72.5	0	0	0	114.2
420	N	83	Confident	86	Confident	30 Å²	30	46 Å²	46	16%	0.16	25%	0.245	C	C	.	.	S	Bend	trans	-123.5	157.6	-178.3	-164.3	14.4	0	0	0	110.8	S414 K416 T417 Q418 Q424	S414-N420 PolarHBondContact O-ND2 3.3Å; K416-N420 WeakPolarHBondContact O-CB 3.29Å; K416-N420 PolarHBondContact O-ND2 3Å; T417-N420 PolarHBondContact O-N 3.4Å; Q418-N420 PolarHBondContact O-N 3.12Å; Q418-N420 VanDerWaalsContact O-N 3.13Å; N420-Q424 WeakPolarHBondContact OD1-CB 3.27Å; N420-Q424 PolarHBondContact OD1-OE1 3.36Å; N420-Q424 VanDerWaalsContact OD1-OE1 3.05Å
421	S	86.4	Confident	86.9	Confident	51 Å²	51	44 Å²	44	36%	0.357	22%	0.218	S	C	.	.			trans	-86.9	148.1	171.5	73.7	0	0	0	0	110.9	E423 Q424 W425	S421-E423 PolarHBondContact O-N 2.93Å; S421-E423 VanDerWaalsContact O-N 3.16Å; S421-Q424 PolarHBondContact O-N 3.29Å; S421-Q424 VanDerWaalsContact O-N 3.17Å; S421-Q424 WeakPolarHBondContact OG-CG 3.03Å; S421-Q424 PolarHBondContact OG-N 3.24Å; S421-W425 WeakPolarHBondContact O-CB 3.26Å; S421-W425 PolarHBondContact O-N 2.86Å
422	E	85.3	Confident	87.5	Confident	39 Å²	39	43.1 Å²	43.1	18%	0.182	21%	0.209	C	C	.	.	H	α-helix	trans	-56.9	-30.9	176.3	-66.4	-167.2	157.4	0	0	111.7	R292 T426	R292-E422 IonicContact CZ-OE1 3.54Å; R292-E422 IonicContact NH1-OE1 3.55Å; R292-E422 PolarHBondContact NH1-OE1 3.26Å; R292-E422 VanDerWaalsContact NH1-OE1 3.14Å; R292-E422 CarbonylContact O-C 3.54Å; R292-E422 WeakPolarHBondContact O-CB 3.4Å; R292-E422 VanDerWaalsContact O-O 3.12Å; E422-T426 VanDerWaalsContact O-CB 3.3Å; E422-T426 WeakPolarHBondContact O-CB 3.48Å; E422-T426 PolarHBondContact O-N 3.15Å; E422-T426 PolarHBondContact O-OG1 3.39Å
423	E	87.9	Confident	87.9	Confident	94 Å²	94	40.8 Å²	40.8	44%	0.439	19%	0.192	S	C	.	.	H	α-helix	trans	-69.2	-46.2	176.6	-51.3	-167.8	160.7	0	0	113.3	L293 S421 W425 T426 K427	L293-E423 HydrophobicContact CD2-CB 3.98Å; L293-E423 HydrophobicContact CD2-CG 3.73Å; S421-E423 PolarHBondContact O-N 2.93Å; S421-E423 VanDerWaalsContact O-N 3.16Å; E423-W425 VanDerWaalsContact C-N 3.35Å; E423-T426 PolarHBondContact O-N 3.12Å; E423-K427 WeakPolarHBondContact O-CB 3.47Å; E423-K427 WeakPolarHBondContact O-CG 3.44Å; E423-K427 PolarHBondContact O-N 3.46Å
424	Q	88.7	Confident	88	Confident	89 Å²	89	40.7 Å²	40.7	42%	0.416	20%	0.195	S	C	.	.	H	α-helix	trans	-67.3	-40	178.2	-75.1	-173.7	4.5	0	0	110.8	Y413 N420 S421 K427 A428	Y413-Q424 HydrophobicContact CD1-CB 4.13Å; Y413-Q424 HydrophobicContact CD1-CG 4Å; Y413-Q424 HydrophobicContact CE1-CG 4.38Å; N420-Q424 WeakPolarHBondContact OD1-CB 3.27Å; N420-Q424 PolarHBondContact OD1-OE1 3.36Å; N420-Q424 VanDerWaalsContact OD1-OE1 3.05Å; S421-Q424 PolarHBondContact O-N 3.29Å; S421-Q424 VanDerWaalsContact O-N 3.17Å; S421-Q424 WeakPolarHBondContact OG-CG 3.03Å; S421-Q424 PolarHBondContact OG-N 3.24Å; Q424-K427 PolarHBondContact O-N 2.86Å; Q424-A428 PolarHBondContact O-N 3.4Å
425	W	89.9	Confident	88.1	Confident	3 Å²	3	40 Å²	40	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-50	173.2	177.6	61.8	0	0	0	111.9	R292 W300 I303 F365 M369 I415 T417 S421 E423 K427 A428 L429	R292-W425 HydrophobicContact CB-CZ3 3.88Å; W300-W425 AromaticContact CH2-CH2 3.9Å; W300-W425 HydrophobicContact CH2-CH2 3.9Å; W300-W425 HydrophobicContact CH2-CZ3 4.49Å; W300-W425 HydrophobicContact CZ3-CH2 4.21Å; I303-W425 HydrophobicContact CD1-CH2 4.27Å; I303-W425 HydrophobicContact CG2-CH2 4.17Å; F365-W425 AromaticContact CE1-CZ2 3.96Å; F365-W425 HydrophobicContact CE1-CZ2 3.96Å; F365-W425 HydrophobicContact CZ-CZ2 4.37Å; M369-W425 HydrophobicContact SD-CZ2 4.41Å; I415-W425 PolarHBondContact O-NE1 2.94Å; T417-W425 HydrophobicContact CG2-CD2 3.88Å; T417-W425 HydrophobicContact CG2-CG 3.96Å; T417-W425 HydrophobicContact CG2-CZ2 4.04Å; S421-W425 WeakPolarHBondContact O-CB 3.26Å; S421-W425 PolarHBondContact O-N 2.86Å; E423-W425 VanDerWaalsContact C-N 3.35Å; W425-K427 VanDerWaalsContact C-N 3.32Å; W425-K427 PolarHBondContact O-N 3.31Å; W425-A428 WeakPolarHBondContact O-CB 3.44Å; W425-A428 PolarHBondContact O-N 2.99Å; W425-A428 VanDerWaalsContact O-N 3.16Å; W425-L429 HydrophobicContact CD2-CD1 3.74Å; W425-L429 HydrophobicContact CE3-CD1 4.21Å; W425-L429 HydrophobicContact CG-CD1 4.29Å; W425-L429 HydrophobicContact CH2-CD1 3.99Å; W425-L429 HydrophobicContact CZ2-CD1 3.47Å; W425-L429 VanDerWaalsContact CZ2-CD1 3.47Å; W425-L429 HydrophobicContact CZ3-CD1 4.33Å; W425-L429 WeakPolarHBondContact O-CG 3.39Å; W425-L429 PolarHBondContact O-N 2.99Å
426	T	89.9	Confident	88.3	Confident	1 Å²	1	40 Å²	40	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-61.6	-38.5	177.9	-63.4	0	0	0	0	112.5	F282 R292 L293 E422 E423 L429 K430	F282-T426 HydrophobicContact CD1-CG2 3.49Å; F282-T426 VanDerWaalsContact CD1-CG2 3.49Å; F282-T426 HydrophobicContact CE1-CG2 3.78Å; F282-T426 HydrophobicContact CG-CG2 4.36Å; R292-T426 PolarHBondContact N-OG1 2.95Å; R292-T426 PolarHBondContact O-OG1 3.47Å; L293-T426 HydrophobicContact CG-CG2 4.45Å; E422-T426 VanDerWaalsContact O-CB 3.3Å; E422-T426 WeakPolarHBondContact O-CB 3.48Å; E422-T426 PolarHBondContact O-N 3.15Å; E422-T426 PolarHBondContact O-OG1 3.39Å; E423-T426 PolarHBondContact O-N 3.12Å; T426-L429 PolarHBondContact O-N 3.38Å; T426-K430 WeakPolarHBondContact O-CB 3.5Å; T426-K430 PolarHBondContact O-N 2.94Å
427	K	90.1	Very high	88.5	Confident	71 Å²	71	40.2 Å²	40.2	31%	0.309	19%	0.192	S	C	.	.	H	α-helix	trans	-64	-43.9	173.9	-75.8	178.3	-176.3	177.2	0	111.9	Y413 E423 Q424 W425 L429 K430 F431	Y413-K427 HydrophobicContact CD1-CB 4.15Å; Y413-K427 HydrophobicContact CD1-CD 4.38Å; Y413-K427 HydrophobicContact CE1-CB 4.41Å; Y413-K427 HydrophobicContact CE1-CD 3.86Å; Y413-K427 HydrophobicContact CG-CB 4.32Å; E423-K427 WeakPolarHBondContact O-CB 3.47Å; E423-K427 WeakPolarHBondContact O-CG 3.44Å; E423-K427 PolarHBondContact O-N 3.46Å; Q424-K427 PolarHBondContact O-N 2.86Å; W425-K427 VanDerWaalsContact C-N 3.32Å; W425-K427 PolarHBondContact O-N 3.31Å; K427-L429 VanDerWaalsContact C-N 3.34Å; K427-L429 PolarHBondContact O-N 3.47Å; K427-K430 PolarHBondContact O-N 3.32Å; K427-F431 WeakPolarHBondContact O-CG 3.33Å; K427-F431 PolarHBondContact O-N 3.5Å
428	A	90.3	Very high	88.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.8	-46	175.2	0	0	0	0	0	111.4	I403 S414 Q424 W425 K430 F431 M432	I403-A428 HydrophobicContact CD1-CB 4.47Å; I403-A428 VanDerWaalsContact CD1-O 3.32Å; I403-A428 WeakPolarHBondContact CD1-O 3.44Å; S414-A428 WeakPolarHBondContact O-CB 3.21Å; Q424-A428 PolarHBondContact O-N 3.4Å; W425-A428 WeakPolarHBondContact O-CB 3.44Å; W425-A428 PolarHBondContact O-N 2.99Å; W425-A428 VanDerWaalsContact O-N 3.16Å; A428-K430 PolarHBondContact O-N 3.41Å; A428-F431 PolarHBondContact O-N 2.87Å; A428-M432 PolarHBondContact O-N 3.34Å
429	L	92.3	Very high	89	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.9	-39.4	178	-66.8	174.4	0	0	0	113	L290 W307 I415 W425 T426 K427 M432 L433	L290-L429 HydrophobicContact CD2-CB 4.02Å; L290-L429 HydrophobicContact CD2-CD2 4.21Å; L290-L429 HydrophobicContact CG-CB 4.03Å; L290-L429 HydrophobicContact CG-CD1 4.11Å; L290-L429 HydrophobicContact CG-CD2 4.39Å; L290-L429 HydrophobicContact CG-CG 4.4Å; W307-L429 HydrophobicContact CH2-CD2 3.94Å; W307-L429 HydrophobicContact CZ2-CD2 3.34Å; I415-L429 HydrophobicContact CD1-CD2 4.2Å; I415-L429 HydrophobicContact CG1-CD2 3.94Å; W425-L429 HydrophobicContact CD2-CD1 3.74Å; W425-L429 HydrophobicContact CE3-CD1 4.21Å; W425-L429 HydrophobicContact CG-CD1 4.29Å; W425-L429 HydrophobicContact CH2-CD1 3.99Å; W425-L429 HydrophobicContact CZ2-CD1 3.47Å; W425-L429 VanDerWaalsContact CZ2-CD1 3.47Å; W425-L429 HydrophobicContact CZ3-CD1 4.33Å; W425-L429 WeakPolarHBondContact O-CG 3.39Å; W425-L429 PolarHBondContact O-N 2.99Å; T426-L429 PolarHBondContact O-N 3.38Å; K427-L429 VanDerWaalsContact C-N 3.34Å; K427-L429 PolarHBondContact O-N 3.47Å; L429-M432 HydrophobicContact CD2-CE 4.19Å; L429-M432 WeakPolarHBondContact O-CB 3.28Å; L429-M432 PolarHBondContact O-N 3.16Å; L429-L433 PolarHBondContact O-N 3.28Å
430	K	91.1	Very high	89.4	Confident	56 Å²	56	33.5 Å²	33.5	24%	0.243	16%	0.157	C	C	.	.	H	α-helix	trans	-61.9	-42.6	173.1	178.8	174.5	174.8	177.1	0	111.9	Q281 T426 K427 A428 L433 T434	Q281-K430 WeakPolarHBondContact O-CD 3.35Å; T426-K430 WeakPolarHBondContact O-CB 3.5Å; T426-K430 PolarHBondContact O-N 2.94Å; K427-K430 PolarHBondContact O-N 3.32Å; A428-K430 PolarHBondContact O-N 3.41Å; K430-L433 PolarHBondContact O-N 2.99Å; K430-T434 WeakPolarHBondContact O-CB 3.41Å; K430-T434 PolarHBondContact O-N 3.43Å; K430-T434 PolarHBondContact O-OG1 2.92Å
431	F	91.1	Very high	89.6	Confident	22 Å²	22	34.6 Å²	34.6	10%	0.096	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-39.6	176.6	-67.9	-9.9	0	0	0	112.1	Y394 I403 D405 Y413 K427 A428 T434 N435	Y394-F431 HydrophobicContact CD1-CB 4.25Å; Y394-F431 HydrophobicContact CD1-CD1 4.29Å; Y394-F431 AromaticContact CD1-CD2 3.89Å; Y394-F431 HydrophobicContact CD1-CD2 3.89Å; Y394-F431 HydrophobicContact CD1-CE2 4.23Å; Y394-F431 AromaticContact CD1-CG 3.91Å; Y394-F431 HydrophobicContact CD1-CG 3.91Å; Y394-F431 HydrophobicContact CD2-CB 3.63Å; Y394-F431 HydrophobicContact CD2-CD1 4.21Å; Y394-F431 AromaticContact CD2-CG 3.98Å; Y394-F431 HydrophobicContact CD2-CG 3.98Å; Y394-F431 WeakPolarHBondContact CD2-O 3.49Å; Y394-F431 AromaticContact CE1-CD1 3.77Å; Y394-F431 HydrophobicContact CE1-CD1 3.77Å; Y394-F431 HydrophobicContact CE1-CD2 4Å; Y394-F431 AromaticContact CE1-CE1 3.82Å; Y394-F431 HydrophobicContact CE1-CE1 3.82Å; Y394-F431 HydrophobicContact CE1-CE2 4.02Å; Y394-F431 AromaticContact CE1-CG 3.87Å; Y394-F431 HydrophobicContact CE1-CG 3.87Å; Y394-F431 AromaticContact CE1-CZ 3.94Å; Y394-F431 HydrophobicContact CE1-CZ 3.94Å; Y394-F431 HydrophobicContact CE2-CB 3.96Å; Y394-F431 AromaticContact CE2-CD1 3.65Å; Y394-F431 HydrophobicContact CE2-CD1 3.65Å; Y394-F431 HydrophobicContact CE2-CE1 4.34Å; Y394-F431 AromaticContact CE2-CG 3.91Å; Y394-F431 HydrophobicContact CE2-CG 3.91Å; Y394-F431 HydrophobicContact CG-CB 3.79Å; Y394-F431 HydrophobicContact CG-CD1 4.49Å; Y394-F431 HydrophobicContact CG-CD2 4.27Å; Y394-F431 AromaticContact CG-CG 3.97Å; Y394-F431 HydrophobicContact CG-CG 3.97Å; Y394-F431 AromaticContact CZ-CD1 3.41Å; Y394-F431 VanDerWaalsContact CZ-CD1 3.41Å; Y394-F431 AromaticContact CZ-CE1 3.64Å; Y394-F431 AromaticContact CZ-CG 3.87Å; I403-F431 HydrophobicContact CG2-CB 3.78Å; I403-F431 HydrophobicContact CG2-CD2 4.27Å; D405-F431 HydrophobicContact CB-CE2 3.98Å; D405-F431 HydrophobicContact CB-CZ 4.43Å; Y413-F431 AromaticContact CD2-CD2 3.98Å; Y413-F431 HydrophobicContact CD2-CD2 3.98Å; Y413-F431 AromaticContact CD2-CE2 3.45Å; Y413-F431 HydrophobicContact CD2-CE2 3.45Å; Y413-F431 VanDerWaalsContact CD2-CE2 3.45Å; Y413-F431 HydrophobicContact CD2-CZ 4.43Å; Y413-F431 HydrophobicContact CE2-CD2 4.46Å; Y413-F431 AromaticContact CE2-CE2 3.5Å; Y413-F431 HydrophobicContact CE2-CE2 3.5Å; Y413-F431 VanDerWaalsContact CE2-CE2 3.5Å; Y413-F431 HydrophobicContact CE2-CZ 4.13Å; K427-F431 WeakPolarHBondContact O-CG 3.33Å; K427-F431 PolarHBondContact O-N 3.5Å; A428-F431 PolarHBondContact O-N 2.87Å; F431-T434 WeakPolarHBondContact O-CB 3.46Å; F431-T434 PolarHBondContact O-N 3.06Å; F431-T434 VanDerWaalsContact O-N 3.16Å; F431-N435 PolarHBondContact O-N 3.04Å
432	M	92.7	Very high	89.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-48.4	173.2	-175.2	-166	68	0	0	111.9	L290 W307 T310 F372 I403 I415 A428 L429 T434 N435 L436	L290-M432 HydrophobicContact CD2-CE 3.6Å; W307-M432 HydrophobicContact CH2-CE 3.56Å; W307-M432 HydrophobicContact CH2-SD 3.69Å; W307-M432 HydrophobicContact CZ2-CE 4.3Å; W307-M432 HydrophobicContact CZ3-CE 3.68Å; W307-M432 HydrophobicContact CZ3-SD 3.99Å; T310-M432 HydrophobicContact CG2-CE 3.92Å; F372-M432 HydrophobicContact CD1-SD 3.61Å; F372-M432 HydrophobicContact CE1-CE 4.18Å; F372-M432 HydrophobicContact CE1-CG 4.42Å; F372-M432 HydrophobicContact CE1-SD 3.57Å; F372-M432 VanDerWaalsContact CE1-SD 3.57Å; I403-M432 HydrophobicContact CD1-CB 3.74Å; I415-M432 HydrophobicContact CD1-SD 3.85Å; A428-M432 PolarHBondContact O-N 3.34Å; L429-M432 HydrophobicContact CD2-CE 4.19Å; L429-M432 WeakPolarHBondContact O-CB 3.28Å; L429-M432 PolarHBondContact O-N 3.16Å; M432-T434 PolarHBondContact O-N 3.19Å; M432-N435 WeakPolarHBondContact O-CB 3.49Å; M432-N435 PolarHBondContact O-N 3.43Å; M432-L436 PolarHBondContact O-N 2.98Å
433	L	93.1	Very high	89.3	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-34.8	175.1	-78.8	178.1	0	0	0	112.1	I276 I285 L290 T310 L429 K430 L436 K437	I276-L433 HydrophobicContact CG2-CB 4.16Å; I285-L433 HydrophobicContact CB-CD2 4.37Å; L290-L433 HydrophobicContact CB-CD1 3.71Å; L290-L433 HydrophobicContact CD2-CD1 3.64Å; L290-L433 HydrophobicContact CD2-CD2 4.1Å; L290-L433 HydrophobicContact CD2-CG 3.66Å; L290-L433 HydrophobicContact CG-CD1 4.32Å; T310-L433 HydrophobicContact CG2-CD2 4.03Å; L429-L433 PolarHBondContact O-N 3.28Å; K430-L433 PolarHBondContact O-N 2.99Å; L433-L436 PolarHBondContact O-N 2.64Å; L433-K437 WeakPolarHBondContact O-CB 3.31Å; L433-K437 PolarHBondContact O-N 3.47Å
434	T	91.2	Very high	89	Confident	35 Å²	35	27.6 Å²	27.6	22%	0.215	13%	0.132	C	C	.	.	H	α-helix	trans	-67.5	-43.8	176.3	-54.9	0	0	0	0	110.5	P393 Y394 K430 F431 M432 L436 K437 W438	P393-T434 HydrophobicContact CG-CG2 4.25Å; Y394-T434 HydrophobicContact CD2-CG2 4.36Å; Y394-T434 HydrophobicContact CE2-CG2 3.68Å; K430-T434 WeakPolarHBondContact O-CB 3.41Å; K430-T434 PolarHBondContact O-N 3.43Å; K430-T434 PolarHBondContact O-OG1 2.92Å; F431-T434 WeakPolarHBondContact O-CB 3.46Å; F431-T434 PolarHBondContact O-N 3.06Å; F431-T434 VanDerWaalsContact O-N 3.16Å; M432-T434 PolarHBondContact O-N 3.19Å; T434-L436 VanDerWaalsContact C-N 3.31Å; T434-L436 PolarHBondContact O-N 3.09Å; T434-K437 WeakPolarHBondContact O-CB 3.37Å; T434-K437 PolarHBondContact O-N 3.39Å; T434-K437 VanDerWaalsContact O-N 3.13Å; T434-W438 PolarHBondContact O-N 2.97Å
435	N	91.1	Very high	88.5	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-55.7	-45.5	170.8	-84.5	-1.4	0	0	0	111.9	L392 P393 Y394 F431 M432 K437 W438 G439	L392-N435 HydrophobicContact CD1-CB 4.12Å; L392-N435 WeakPolarHBondContact CD2-O 3.4Å; P393-N435 VanDerWaalsContact CD-OD1 3.3Å; P393-N435 WeakPolarHBondContact CD-OD1 3.26Å; P393-N435 WeakPolarHBondContact CG-OD1 3.47Å; Y394-N435 WeakPolarHBondContact CB-OD1 3.43Å; Y394-N435 PolarHBondContact N-OD1 3.05Å; Y394-N435 PolarHBondContact O-ND2 3.07Å; F431-N435 PolarHBondContact O-N 3.04Å; M432-N435 WeakPolarHBondContact O-CB 3.49Å; M432-N435 PolarHBondContact O-N 3.43Å; N435-K437 VanDerWaalsContact C-N 3.34Å; N435-K437 PolarHBondContact O-N 3.5Å; N435-W438 PolarHBondContact O-N 3.24Å; N435-G439 PolarHBondContact O-N 3.33Å
436	L	91.4	Very high	87.8	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-36.1	176.3	-71.5	172.7	0	0	0	112.7	I276 T310 L313 L314 F372 V376 M432 L433 T434 G439 L440	I276-L436 HydrophobicContact CD1-CB 4.46Å; T310-L436 HydrophobicContact CG2-CD1 3.36Å; L313-L436 HydrophobicContact CD2-CB 4.04Å; L313-L436 HydrophobicContact CD2-CD1 4.46Å; L314-L436 HydrophobicContact CB-CD2 4.39Å; L314-L436 HydrophobicContact CD1-CD2 3.99Å; F372-L436 HydrophobicContact CE1-CD1 4.26Å; F372-L436 HydrophobicContact CZ-CD1 4.25Å; V376-L436 HydrophobicContact CG1-CD2 4.16Å; V376-L436 HydrophobicContact CG2-CD2 4.24Å; M432-L436 PolarHBondContact O-N 2.98Å; L433-L436 PolarHBondContact O-N 2.64Å; T434-L436 VanDerWaalsContact C-N 3.31Å; T434-L436 PolarHBondContact O-N 3.09Å; L436-G439 PolarHBondContact O-N 3.26Å; L436-L440 WeakPolarHBondContact O-CB 3.48Å; L436-L440 PolarHBondContact O-N 3.41Å
437	K	90.2	Very high	86.8	Confident	78 Å²	78	32.5 Å²	32.5	34%	0.339	16%	0.16	S	C	.	.	H	α-helix	trans	-62.8	-41.9	173.2	-176.4	174.6	-178.2	162.5	0	112.1	I276 L433 T434 N435 L440 A441	I276-K437 HydrophobicContact CB-CB 4.19Å; I276-K437 HydrophobicContact CB-CD 4.25Å; I276-K437 HydrophobicContact CB-CG 4.33Å; I276-K437 HydrophobicContact CD1-CB 4.01Å; I276-K437 HydrophobicContact CG2-CB 4.01Å; I276-K437 HydrophobicContact CG2-CD 4.25Å; I276-K437 WeakPolarHBondContact O-CE 3.49Å; I276-K437 PolarHBondContact O-NZ 2.87Å; L433-K437 WeakPolarHBondContact O-CB 3.31Å; L433-K437 PolarHBondContact O-N 3.47Å; T434-K437 WeakPolarHBondContact O-CB 3.37Å; T434-K437 PolarHBondContact O-N 3.39Å; T434-K437 VanDerWaalsContact O-N 3.13Å; N435-K437 VanDerWaalsContact C-N 3.34Å; N435-K437 PolarHBondContact O-N 3.5Å; K437-L440 WeakPolarHBondContact O-CB 3.23Å; K437-L440 PolarHBondContact O-N 3.43Å; K437-A441 PolarHBondContact O-N 3.42Å
438	W	88.7	Confident	85.5	Confident	128 Å²	128	35.1 Å²	35.1	49%	0.485	17%	0.169	S	C	.	.	H	α-helix	trans	-66.5	-43.1	174.7	-81.1	68	0	0	0	111.3	F390 L392 P393 T434 N435 L440 A441 W442	F390-W438 HydrophobicContact CE2-CE3 4.1Å; F390-W438 HydrophobicContact CZ-CB 4.13Å; F390-W438 WeakPolarHBondContact CZ-O 3.47Å; L392-W438 HydrophobicContact CD2-CB 3.95Å; P393-W438 HydrophobicContact CG-CD2 4.04Å; P393-W438 HydrophobicContact CG-CG 3.85Å; T434-W438 PolarHBondContact O-N 2.97Å; N435-W438 PolarHBondContact O-N 3.24Å; W438-L440 VanDerWaalsContact C-N 3.33Å; W438-L440 PolarHBondContact O-N 3.16Å; W438-A441 PolarHBondContact O-N 3.28Å; W438-W442 PolarHBondContact O-N 3.01Å
439	G	86.7	Confident	83.8	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-43.1	173.2	0	0	0	0	0	112.7	N435 L436 A441 W442 V443	N435-G439 PolarHBondContact O-N 3.33Å; L436-G439 PolarHBondContact O-N 3.26Å; G439-A441 PolarHBondContact O-N 2.93Å; G439-W442 PolarHBondContact O-N 3.24Å; G439-V443 WeakPolarHBondContact O-CG2 3.26Å; G439-V443 PolarHBondContact O-N 3.32Å
440	L	87.4	Confident	81.5	Confident	3 Å²	3	52.7 Å²	52.7	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-46.2	174.5	-169.3	68.7	0	0	0	111.8	F270 N271 L313 L317 L436 K437 W438 W442 V443 S444	F270-L440 HydrophobicContact CB-CD1 3.46Å; F270-L440 VanDerWaalsContact CB-CD1 3.46Å; F270-L440 HydrophobicContact CB-CD2 4.41Å; F270-L440 HydrophobicContact CB-CG 4.14Å; F270-L440 HydrophobicContact CD1-CD1 3.88Å; F270-L440 HydrophobicContact CG-CD1 3.79Å; N271-L440 WeakPolarHBondContact OD1-CD2 3.3Å; L313-L440 HydrophobicContact CD1-CD1 3.57Å; L313-L440 HydrophobicContact CD1-CD2 4.5Å; L317-L440 HydrophobicContact CD1-CD1 4.26Å; L317-L440 HydrophobicContact CD2-CD1 3.63Å; L317-L440 HydrophobicContact CG-CD1 4.23Å; L436-L440 WeakPolarHBondContact O-CB 3.48Å; L436-L440 PolarHBondContact O-N 3.41Å; K437-L440 WeakPolarHBondContact O-CB 3.23Å; K437-L440 PolarHBondContact O-N 3.43Å; W438-L440 VanDerWaalsContact C-N 3.33Å; W438-L440 PolarHBondContact O-N 3.16Å; L440-W442 VanDerWaalsContact C-N 3.33Å; L440-W442 PolarHBondContact O-N 3.23Å; L440-V443 PolarHBondContact O-N 3.24Å; L440-S444 WeakPolarHBondContact O-CB 3.42Å; L440-S444 PolarHBondContact O-N 3.29Å; L440-S444 PolarHBondContact O-OG 3.1Å
441	A	85.2	Confident	81.1	Confident	54 Å²	54	52.6 Å²	52.6	45%	0.446	25%	0.253	S	S	.	.	H	α-helix	trans	-63.3	-39.4	178.5	0	0	0	0	0	111.9	K437 W438 G439 S444 S445	K437-A441 PolarHBondContact O-N 3.42Å; W438-A441 PolarHBondContact O-N 3.28Å; G439-A441 PolarHBondContact O-N 2.93Å; A441-S444 WeakPolarHBondContact O-CB 3.41Å; A441-S444 PolarHBondContact O-N 3.34Å; A441-S445 PolarHBondContact O-N 2.91Å
442	W	84.3	Confident	80.5	Confident	22 Å²	22	54.2 Å²	54.2	8%	0.083	26%	0.261	C	S	.	.	H	α-helix	trans	-66.9	-48.9	175.8	-178.2	89.5	0	0	0	112.4	M321 V383 E387 F390 W438 G439 L440 S444 S445 Q446	M321-W442 HydrophobicContact CE-CH2 3.99Å; M321-W442 HydrophobicContact CE-CZ3 3.62Å; M321-W442 HydrophobicContact SD-CZ3 3.82Å; V383-W442 HydrophobicContact CB-CD2 4.47Å; V383-W442 HydrophobicContact CB-CE3 4.22Å; V383-W442 HydrophobicContact CB-CH2 4.4Å; V383-W442 HydrophobicContact CB-CZ3 4.21Å; V383-W442 HydrophobicContact CG1-CD2 3.41Å; V383-W442 VanDerWaalsContact CG1-CD2 3.41Å; V383-W442 HydrophobicContact CG1-CE3 3.6Å; V383-W442 HydrophobicContact CG1-CG 3.85Å; V383-W442 HydrophobicContact CG1-CH2 4.12Å; V383-W442 HydrophobicContact CG1-CZ2 3.95Å; V383-W442 HydrophobicContact CG1-CZ3 3.97Å; V383-W442 HydrophobicContact CG2-CD2 4.44Å; V383-W442 HydrophobicContact CG2-CE3 3.76Å; V383-W442 HydrophobicContact CG2-CH2 4.37Å; V383-W442 HydrophobicContact CG2-CZ3 3.74Å; E387-W442 HydrophobicContact CB-CZ2 4.22Å; F390-W442 HydrophobicContact CD1-CB 4.39Å; F390-W442 AromaticContact CD1-CD1 3.85Å; F390-W442 HydrophobicContact CD1-CG 4.09Å; F390-W442 HydrophobicContact CD2-CB 3.98Å; F390-W442 AromaticContact CD2-CD1 3.47Å; F390-W442 VanDerWaalsContact CD2-CD1 3.47Å; F390-W442 HydrophobicContact CD2-CG 4.01Å; F390-W442 HydrophobicContact CE1-CB 4.02Å; F390-W442 HydrophobicContact CE1-CG 4.18Å; F390-W442 HydrophobicContact CE2-CB 3.61Å; F390-W442 HydrophobicContact CE2-CG 4.12Å; F390-W442 HydrophobicContact CG-CB 4.34Å; F390-W442 AromaticContact CG-CD1 3.34Å; F390-W442 AromaticContact CG-CG 3.97Å; F390-W442 HydrophobicContact CG-CG 3.97Å; F390-W442 AromaticContact CG-NE1 3.96Å; F390-W442 HydrophobicContact CZ-CB 3.6Å; F390-W442 HydrophobicContact CZ-CG 4.18Å; W438-W442 PolarHBondContact O-N 3.01Å; G439-W442 PolarHBondContact O-N 3.24Å; L440-W442 VanDerWaalsContact C-N 3.33Å; L440-W442 PolarHBondContact O-N 3.23Å; W442-S444 PolarHBondContact O-N 3.1Å; W442-S445 PolarHBondContact O-N 3.22Å; W442-S445 PolarHBondContact O-OG 3.44Å; W442-Q446 HydrophobicContact CD2-CG 3.91Å; W442-Q446 HydrophobicContact CE3-CG 4.01Å; W442-Q446 HydrophobicContact CH2-CG 3.8Å; W442-Q446 HydrophobicContact CZ2-CG 3.68Å; W442-Q446 HydrophobicContact CZ3-CG 3.95Å; W442-Q446 WeakPolarHBondContact O-CG 3.43Å; W442-Q446 PolarHBondContact O-N 2.83Å
443	V	82.7	Confident	79.9	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-58.5	-39.9	176.6	174.8	0	0	0	0	109.5	L317 K320 M321 F379 G439 L440 S445 Q446 F447	L317-V443 HydrophobicContact CD2-CB 3.89Å; L317-V443 HydrophobicContact CD2-CG1 3.92Å; L317-V443 HydrophobicContact CD2-CG2 3.94Å; K320-V443 HydrophobicContact CG-CG1 4.2Å; M321-V443 HydrophobicContact CG-CG2 4.15Å; M321-V443 HydrophobicContact SD-CG2 3.74Å; F379-V443 HydrophobicContact CE2-CG2 4.32Å; F379-V443 HydrophobicContact CZ-CG2 3.87Å; G439-V443 WeakPolarHBondContact O-CG2 3.26Å; G439-V443 PolarHBondContact O-N 3.32Å; L440-V443 PolarHBondContact O-N 3.24Å; V443-S445 PolarHBondContact O-N 3.4Å; V443-Q446 PolarHBondContact O-N 3.22Å; V443-F447 HydrophobicContact CG1-CD2 4.05Å; V443-F447 HydrophobicContact CG1-CE2 3.75Å; V443-F447 WeakPolarHBondContact O-CD2 3.44Å; V443-F447 PolarHBondContact O-N 3.11Å
444	S	80.3	Confident	79.1	Confident	13 Å²	13	60.5 Å²	60.5	9%	0.091	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-40.9	175.2	-64.4	0	0	0	0	113.5	N268 L440 A441 W442 F447 Y448	N268-S444 WeakPolarHBondContact ND2-CB 3.46Å; N268-S444 PolarHBondContact ND2-OG 3.24Å; L440-S444 WeakPolarHBondContact O-CB 3.42Å; L440-S444 PolarHBondContact O-N 3.29Å; L440-S444 PolarHBondContact O-OG 3.1Å; A441-S444 WeakPolarHBondContact O-CB 3.41Å; A441-S444 PolarHBondContact O-N 3.34Å; W442-S444 PolarHBondContact O-N 3.1Å; S444-F447 PolarHBondContact O-N 3.1Å; S444-Y448 PolarHBondContact O-N 2.78Å
445	S	78.9	Confident	78.3	Confident	53 Å²	53	62.1 Å²	62.1	37%	0.371	30%	0.296	S	S	.	.	H	α-helix	trans	-72.7	-32.3	179.3	65.8	0	0	0	0	112.8	A441 W442 V443 F447 Y448	A441-S445 PolarHBondContact O-N 2.91Å; W442-S445 PolarHBondContact O-N 3.22Å; W442-S445 PolarHBondContact O-OG 3.44Å; V443-S445 PolarHBondContact O-N 3.4Å; S445-F447 PolarHBondContact O-N 3.44Å; S445-Y448 PolarHBondContact O-N 3.29Å
446	Q	75.5	Confident	77.5	Confident	64 Å²	64	66.1 Å²	66.1	30%	0.299	32%	0.316	S	S	.	.	H	α-helix	trans	-63.8	-29.5	176.4	-67.4	-60.2	-28.5	0	0	112.9	E387 W442 V443	E387-Q446 PolarHBondContact OE2-NE2 2.94Å; W442-Q446 HydrophobicContact CD2-CG 3.91Å; W442-Q446 HydrophobicContact CE3-CG 4.01Å; W442-Q446 HydrophobicContact CH2-CG 3.8Å; W442-Q446 HydrophobicContact CZ2-CG 3.68Å; W442-Q446 HydrophobicContact CZ3-CG 3.95Å; W442-Q446 WeakPolarHBondContact O-CG 3.43Å; W442-Q446 PolarHBondContact O-N 2.83Å; V443-Q446 PolarHBondContact O-N 3.22Å
447	F	68.8	Low	76.5	Confident	80 Å²	80	70.8 Å²	70.8	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-96.7	-12.1	177.4	-65.2	-70.6	0	0	0	114.3	K320 V443 S444 S445 N449	K320-F447 HydrophobicContact CD-CE2 4.08Å; K320-F447 HydrophobicContact CD-CZ 4.11Å; K320-F447 VanDerWaalsContact CE-CE2 3.48Å; K320-F447 HydrophobicContact CG-CD2 4.32Å; K320-F447 HydrophobicContact CG-CE2 3.5Å; K320-F447 VanDerWaalsContact CG-CE2 3.5Å; K320-F447 HydrophobicContact CG-CZ 3.83Å; V443-F447 HydrophobicContact CG1-CD2 4.05Å; V443-F447 HydrophobicContact CG1-CE2 3.75Å; V443-F447 WeakPolarHBondContact O-CD2 3.44Å; V443-F447 PolarHBondContact O-N 3.11Å; S444-F447 PolarHBondContact O-N 3.1Å; S445-F447 PolarHBondContact O-N 3.44Å; F447-N449 VanDerWaalsContact C-N 3.34Å
448	Y	63.4	Low	75.4	Confident	126 Å²	126	70.2 Å²	70.2	49%	0.494	34%	0.338	S	S	.	.	H	α-helix	trans	-72.5	-30.7	174.1	-170	-90.1	0	0	0	112.2	K265 S444 S445	K265-Y448 HydrophobicContact CB-CE2 3.8Å; K265-Y448 WeakPolarHBondContact O-CE2 3.5Å; S444-Y448 PolarHBondContact O-N 2.78Å; S445-Y448 PolarHBondContact O-N 3.29Å
449	N	52.8	Low	74.3	Confident	145 Å²	145	65.4 Å²	65.4	78%	0.775	33%	0.326	S	S	*	.			trans	-87.7	-3.9	-178.1	-71.5	-21.7	0	0	0	114.2	F447	F447-N449 VanDerWaalsContact C-N 3.34Å
450	K	45.6	Very low	73.2	Confident	224 Å²	224	71.4 Å²	71.4	97%	0.974	36%	0.355	S	S	*	.			trans	-98.9	0	169	-74.2	-173	177.9	179.7	0	109.1

Retrieved 450 of 450 residues in 1124.4 ms (Link to these results)

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